USER MOD reduce.3.24.130724 H: found=0, std=0, add=1367, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1367 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 34 SER OG : rot 49:sc= 0.708 USER MOD Set 1.2: A 85 THR OG1 : rot 83:sc= 1.02 USER MOD Single : A 1 MET CE :methyl -159:sc= -0.106 (180deg=-0.623) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 41:sc= 0.42 USER MOD Single : A 3 GLN : amide:sc= -1.31! K(o=-1.3!,f=-1.9) USER MOD Single : A 9 SER OG : rot -118:sc= 0.252 USER MOD Single : A 10 SER OG : rot -35:sc= 0.354 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ -164:sc= 0.057! (180deg=-0.181!) USER MOD Single : A 25 GLN : amide:sc= -0.0235 K(o=-0.023,f=-1.5) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -2.17! C(o=-2.2!,f=-2.7!) USER MOD Single : A 39 LYS NZ :NH3+ -153:sc= 0.785 (180deg=0.245) USER MOD Single : A 50 LYS NZ :NH3+ 166:sc= 1.16 (180deg=1.01) USER MOD Single : A 51 GLN : amide:sc= 1.14 K(o=1.1,f=-0.0035) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -0.303 K(o=-0.3,f=-1.7!) USER MOD Single : A 75 TYR OH : rot 30:sc= 0.202 USER MOD Single : A 77 GLN : amide:sc= 1.77 K(o=1.8,f=-6.7!) USER MOD Single : A 86 THR OG1 : rot 130:sc= -0.245 USER MOD Single : A 89 LYS NZ :NH3+ -152:sc= 0.929 (180deg=0.29) USER MOD Single : A 93 LYS NZ :NH3+ -149:sc= 0.624 (180deg=-0.415!) USER MOD Single : A 100 LYS NZ :NH3+ 156:sc= -1.43 (180deg=-1.79!) USER MOD Single : A 110 TYR OH : rot 180:sc= -0.486 USER MOD Single : A 111 ASN : amide:sc= -0.296 K(o=-0.3,f=-1.4) USER MOD Single : A 112 ASN : amide:sc= -0.0181 K(o=-0.018,f=-7.9!) USER MOD Single : A 113 LYS NZ :NH3+ -171:sc= -0.002 (180deg=-0.0908) USER MOD Single : A 119 LYS NZ :NH3+ -169:sc= -0.0145 (180deg=-0.175) USER MOD Single : A 122 GLN : amide:sc= -0.711 K(o=-0.71,f=-2.8!) USER MOD Single : A 123 GLN : amide:sc= -0.887 K(o=-0.89,f=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot -150:sc= 1.04 USER MOD Single : A 136 SER OG : rot -34:sc= 0.306 USER MOD Single : A 138 LYS NZ :NH3+ -142:sc= -1.44 (180deg=-3.76!) USER MOD Single : A 144 GLN : amide:sc= -1.01 K(o=-1,f=-3!) USER MOD Single : A 151 LYS NZ :NH3+ 153:sc= -0.255 (180deg=-2.02!) USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 157 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 159 HIS : no HD1:sc= -1.09 K(o=-1.1,f=-3.5) USER MOD Single : A 160 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 161 HIS : no HD1:sc= -0.0985 X(o=-0.098,f=-0.56) USER MOD Single : A 162 HIS : no HD1:sc= -0.687 X(o=-0.69,f=-0.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.105 -5.977 18.371 1.00 31.02 N ATOM 2 CA MET A 1 -0.164 -4.753 17.567 1.00 74.02 C ATOM 3 C MET A 1 -0.872 -5.101 16.248 1.00 51.22 C ATOM 4 O MET A 1 -0.251 -5.606 15.311 1.00 24.35 O ATOM 5 CB MET A 1 1.154 -4.011 17.287 1.00 15.10 C ATOM 6 CG MET A 1 0.997 -2.752 16.438 1.00 14.03 C ATOM 7 SD MET A 1 2.560 -1.877 16.193 1.00 72.11 S ATOM 8 CE MET A 1 2.948 -1.385 17.875 1.00 42.11 C ATOM 0 H1 MET A 1 0.583 -5.713 19.256 1.00 31.02 H new ATOM 0 H2 MET A 1 -0.794 -6.452 18.592 1.00 31.02 H new ATOM 0 H3 MET A 1 0.713 -6.622 17.828 1.00 31.02 H new ATOM 0 HA MET A 1 -0.825 -4.104 18.141 1.00 74.02 H new ATOM 0 HB2 MET A 1 1.614 -3.739 18.237 1.00 15.10 H new ATOM 0 HB3 MET A 1 1.841 -4.691 16.784 1.00 15.10 H new ATOM 0 HG2 MET A 1 0.581 -3.023 15.468 1.00 14.03 H new ATOM 0 HG3 MET A 1 0.282 -2.083 16.916 1.00 14.03 H new ATOM 0 HE1 MET A 1 3.647 -0.549 17.857 1.00 42.11 H new ATOM 0 HE2 MET A 1 2.034 -1.083 18.386 1.00 42.11 H new ATOM 0 HE3 MET A 1 3.399 -2.224 18.405 1.00 42.11 H new ATOM 20 N SER A 2 -2.175 -4.838 16.182 1.00 11.44 N ATOM 21 CA SER A 2 -2.955 -5.086 14.962 1.00 45.15 C ATOM 22 C SER A 2 -2.855 -3.891 14.007 1.00 42.13 C ATOM 23 O SER A 2 -3.751 -3.047 13.943 1.00 14.41 O ATOM 24 CB SER A 2 -4.430 -5.376 15.301 1.00 14.05 C ATOM 25 OG SER A 2 -5.013 -4.321 16.055 1.00 50.42 O ATOM 0 H SER A 2 -2.717 -4.453 16.956 1.00 11.44 H new ATOM 0 HA SER A 2 -2.538 -5.964 14.468 1.00 45.15 H new ATOM 0 HB2 SER A 2 -4.994 -5.519 14.379 1.00 14.05 H new ATOM 0 HB3 SER A 2 -4.498 -6.307 15.864 1.00 14.05 H new ATOM 0 HG SER A 2 -4.717 -3.459 15.694 1.00 50.42 H new ATOM 31 N GLN A 3 -1.748 -3.824 13.270 1.00 25.54 N ATOM 32 CA GLN A 3 -1.467 -2.681 12.395 1.00 12.04 C ATOM 33 C GLN A 3 -1.254 -3.130 10.944 1.00 10.22 C ATOM 34 O GLN A 3 -0.632 -4.158 10.688 1.00 22.02 O ATOM 35 CB GLN A 3 -0.227 -1.926 12.906 1.00 74.54 C ATOM 36 CG GLN A 3 0.061 -0.617 12.173 1.00 70.52 C ATOM 37 CD GLN A 3 1.257 0.135 12.742 1.00 1.13 C ATOM 38 OE1 GLN A 3 2.197 -0.461 13.260 1.00 20.40 O ATOM 39 NE2 GLN A 3 1.226 1.452 12.661 1.00 25.21 N ATOM 0 H GLN A 3 -1.029 -4.547 13.259 1.00 25.54 H new ATOM 0 HA GLN A 3 -2.330 -2.015 12.415 1.00 12.04 H new ATOM 0 HB2 GLN A 3 -0.358 -1.713 13.967 1.00 74.54 H new ATOM 0 HB3 GLN A 3 0.642 -2.577 12.817 1.00 74.54 H new ATOM 0 HG2 GLN A 3 0.241 -0.829 11.119 1.00 70.52 H new ATOM 0 HG3 GLN A 3 -0.820 0.022 12.223 1.00 70.52 H new ATOM 0 HE21 GLN A 3 0.430 1.918 12.224 1.00 25.21 H new ATOM 0 HE22 GLN A 3 1.998 2.004 13.035 1.00 25.21 H new ATOM 48 N ILE A 4 -1.759 -2.346 9.997 1.00 23.43 N ATOM 49 CA ILE A 4 -1.636 -2.678 8.574 1.00 43.34 C ATOM 50 C ILE A 4 -0.707 -1.691 7.845 1.00 34.21 C ATOM 51 O ILE A 4 -0.853 -0.468 7.955 1.00 44.21 O ATOM 52 CB ILE A 4 -3.026 -2.714 7.881 1.00 62.21 C ATOM 53 CG1 ILE A 4 -2.886 -3.111 6.400 1.00 24.32 C ATOM 54 CG2 ILE A 4 -3.746 -1.370 8.020 1.00 44.23 C ATOM 55 CD1 ILE A 4 -4.210 -3.268 5.680 1.00 4.55 C ATOM 0 H ILE A 4 -2.258 -1.476 10.185 1.00 23.43 H new ATOM 0 HA ILE A 4 -1.194 -3.673 8.514 1.00 43.34 H new ATOM 0 HB ILE A 4 -3.632 -3.470 8.381 1.00 62.21 H new ATOM 0 HG12 ILE A 4 -2.291 -2.356 5.886 1.00 24.32 H new ATOM 0 HG13 ILE A 4 -2.335 -4.049 6.336 1.00 24.32 H new ATOM 0 HG21 ILE A 4 -4.716 -1.424 7.526 1.00 44.23 H new ATOM 0 HG22 ILE A 4 -3.889 -1.141 9.076 1.00 44.23 H new ATOM 0 HG23 ILE A 4 -3.146 -0.586 7.557 1.00 44.23 H new ATOM 0 HD11 ILE A 4 -4.029 -3.548 4.642 1.00 4.55 H new ATOM 0 HD12 ILE A 4 -4.800 -4.044 6.168 1.00 4.55 H new ATOM 0 HD13 ILE A 4 -4.755 -2.325 5.711 1.00 4.55 H new ATOM 67 N PHE A 5 0.259 -2.240 7.111 1.00 61.41 N ATOM 68 CA PHE A 5 1.259 -1.440 6.396 1.00 63.43 C ATOM 69 C PHE A 5 0.829 -1.211 4.937 1.00 73.23 C ATOM 70 O PHE A 5 0.635 -2.163 4.181 1.00 1.32 O ATOM 71 CB PHE A 5 2.611 -2.168 6.448 1.00 33.33 C ATOM 72 CG PHE A 5 3.791 -1.353 5.980 1.00 4.34 C ATOM 73 CD1 PHE A 5 4.514 -0.579 6.875 1.00 34.31 C ATOM 74 CD2 PHE A 5 4.190 -1.376 4.654 1.00 0.42 C ATOM 75 CE1 PHE A 5 5.603 0.158 6.456 1.00 32.35 C ATOM 76 CE2 PHE A 5 5.282 -0.642 4.230 1.00 23.03 C ATOM 77 CZ PHE A 5 5.988 0.125 5.131 1.00 12.14 C ATOM 0 H PHE A 5 0.373 -3.247 6.994 1.00 61.41 H new ATOM 0 HA PHE A 5 1.350 -0.465 6.875 1.00 63.43 H new ATOM 0 HB2 PHE A 5 2.794 -2.490 7.473 1.00 33.33 H new ATOM 0 HB3 PHE A 5 2.546 -3.069 5.838 1.00 33.33 H new ATOM 0 HD1 PHE A 5 4.221 -0.553 7.914 1.00 34.31 H new ATOM 0 HD2 PHE A 5 3.641 -1.975 3.942 1.00 0.42 H new ATOM 0 HE1 PHE A 5 6.153 0.760 7.164 1.00 32.35 H new ATOM 0 HE2 PHE A 5 5.582 -0.670 3.193 1.00 23.03 H new ATOM 0 HZ PHE A 5 6.841 0.699 4.801 1.00 12.14 H new ATOM 87 N VAL A 6 0.681 0.052 4.544 1.00 13.10 N ATOM 88 CA VAL A 6 0.246 0.387 3.183 1.00 63.25 C ATOM 89 C VAL A 6 1.209 1.375 2.501 1.00 34.05 C ATOM 90 O VAL A 6 1.597 2.392 3.077 1.00 61.51 O ATOM 91 CB VAL A 6 -1.196 0.966 3.178 1.00 3.54 C ATOM 92 CG1 VAL A 6 -1.285 2.232 4.026 1.00 73.12 C ATOM 93 CG2 VAL A 6 -1.678 1.231 1.751 1.00 14.33 C ATOM 0 H VAL A 6 0.854 0.859 5.143 1.00 13.10 H new ATOM 0 HA VAL A 6 0.253 -0.543 2.614 1.00 63.25 H new ATOM 0 HB VAL A 6 -1.854 0.219 3.622 1.00 3.54 H new ATOM 0 HG11 VAL A 6 -2.306 2.614 4.003 1.00 73.12 H new ATOM 0 HG12 VAL A 6 -1.007 2.001 5.054 1.00 73.12 H new ATOM 0 HG13 VAL A 6 -0.606 2.986 3.627 1.00 73.12 H new ATOM 0 HG21 VAL A 6 -2.690 1.636 1.778 1.00 14.33 H new ATOM 0 HG22 VAL A 6 -1.013 1.948 1.270 1.00 14.33 H new ATOM 0 HG23 VAL A 6 -1.675 0.298 1.187 1.00 14.33 H new ATOM 103 N VAL A 7 1.597 1.056 1.269 1.00 70.34 N ATOM 104 CA VAL A 7 2.496 1.903 0.482 1.00 30.40 C ATOM 105 C VAL A 7 1.782 2.489 -0.741 1.00 35.14 C ATOM 106 O VAL A 7 1.222 1.755 -1.554 1.00 65.43 O ATOM 107 CB VAL A 7 3.736 1.111 -0.008 1.00 24.54 C ATOM 108 CG1 VAL A 7 4.637 1.997 -0.866 1.00 21.42 C ATOM 109 CG2 VAL A 7 4.513 0.532 1.170 1.00 50.13 C ATOM 0 H VAL A 7 1.300 0.207 0.788 1.00 70.34 H new ATOM 0 HA VAL A 7 2.816 2.710 1.141 1.00 30.40 H new ATOM 0 HB VAL A 7 3.386 0.281 -0.622 1.00 24.54 H new ATOM 0 HG11 VAL A 7 5.501 1.422 -1.200 1.00 21.42 H new ATOM 0 HG12 VAL A 7 4.080 2.351 -1.733 1.00 21.42 H new ATOM 0 HG13 VAL A 7 4.974 2.851 -0.278 1.00 21.42 H new ATOM 0 HG21 VAL A 7 5.378 -0.019 0.800 1.00 50.13 H new ATOM 0 HG22 VAL A 7 4.849 1.342 1.818 1.00 50.13 H new ATOM 0 HG23 VAL A 7 3.869 -0.141 1.735 1.00 50.13 H new ATOM 119 N PHE A 8 1.806 3.811 -0.870 1.00 24.31 N ATOM 120 CA PHE A 8 1.271 4.472 -2.062 1.00 70.33 C ATOM 121 C PHE A 8 2.412 4.946 -2.969 1.00 0.14 C ATOM 122 O PHE A 8 3.271 5.729 -2.554 1.00 15.23 O ATOM 123 CB PHE A 8 0.386 5.663 -1.661 1.00 73.44 C ATOM 124 CG PHE A 8 -0.892 5.264 -0.959 1.00 11.13 C ATOM 125 CD1 PHE A 8 -0.913 5.041 0.412 1.00 2.52 C ATOM 126 CD2 PHE A 8 -2.077 5.117 -1.672 1.00 21.44 C ATOM 127 CE1 PHE A 8 -2.085 4.679 1.054 1.00 32.22 C ATOM 128 CE2 PHE A 8 -3.249 4.754 -1.032 1.00 23.02 C ATOM 129 CZ PHE A 8 -3.253 4.535 0.331 1.00 74.43 C ATOM 0 H PHE A 8 2.188 4.446 -0.169 1.00 24.31 H new ATOM 0 HA PHE A 8 0.664 3.753 -2.611 1.00 70.33 H new ATOM 0 HB2 PHE A 8 0.957 6.324 -1.009 1.00 73.44 H new ATOM 0 HB3 PHE A 8 0.136 6.235 -2.555 1.00 73.44 H new ATOM 0 HD1 PHE A 8 -0.004 5.151 0.984 1.00 2.52 H new ATOM 0 HD2 PHE A 8 -2.083 5.288 -2.738 1.00 21.44 H new ATOM 0 HE1 PHE A 8 -2.086 4.509 2.121 1.00 32.22 H new ATOM 0 HE2 PHE A 8 -4.161 4.642 -1.599 1.00 23.02 H new ATOM 0 HZ PHE A 8 -4.167 4.252 0.831 1.00 74.43 H new ATOM 139 N SER A 9 2.425 4.461 -4.206 1.00 73.22 N ATOM 140 CA SER A 9 3.434 4.868 -5.188 1.00 12.43 C ATOM 141 C SER A 9 2.826 4.996 -6.582 1.00 74.32 C ATOM 142 O SER A 9 2.088 4.121 -7.029 1.00 62.12 O ATOM 143 CB SER A 9 4.598 3.869 -5.226 1.00 72.31 C ATOM 144 OG SER A 9 5.578 4.263 -6.174 1.00 32.44 O ATOM 0 H SER A 9 1.748 3.784 -4.557 1.00 73.22 H new ATOM 0 HA SER A 9 3.812 5.842 -4.879 1.00 12.43 H new ATOM 0 HB2 SER A 9 5.052 3.797 -4.238 1.00 72.31 H new ATOM 0 HB3 SER A 9 4.222 2.877 -5.477 1.00 72.31 H new ATOM 0 HG SER A 9 5.657 3.576 -6.868 1.00 32.44 H new ATOM 150 N SER A 10 3.145 6.083 -7.270 1.00 30.41 N ATOM 151 CA SER A 10 2.681 6.298 -8.646 1.00 24.24 C ATOM 152 C SER A 10 3.664 5.677 -9.653 1.00 74.31 C ATOM 153 O SER A 10 3.465 5.750 -10.869 1.00 54.14 O ATOM 154 CB SER A 10 2.517 7.803 -8.912 1.00 4.43 C ATOM 155 OG SER A 10 2.060 8.064 -10.231 1.00 13.44 O ATOM 0 H SER A 10 3.725 6.837 -6.902 1.00 30.41 H new ATOM 0 HA SER A 10 1.715 5.809 -8.771 1.00 24.24 H new ATOM 0 HB2 SER A 10 1.812 8.223 -8.194 1.00 4.43 H new ATOM 0 HB3 SER A 10 3.471 8.305 -8.753 1.00 4.43 H new ATOM 0 HG SER A 10 2.446 7.407 -10.847 1.00 13.44 H new ATOM 161 N ASP A 11 4.722 5.048 -9.131 1.00 22.12 N ATOM 162 CA ASP A 11 5.771 4.450 -9.964 1.00 71.03 C ATOM 163 C ASP A 11 5.893 2.931 -9.720 1.00 22.22 C ATOM 164 O ASP A 11 6.385 2.498 -8.673 1.00 25.24 O ATOM 165 CB ASP A 11 7.110 5.129 -9.662 1.00 13.43 C ATOM 166 CG ASP A 11 7.023 6.640 -9.778 1.00 21.00 C ATOM 167 OD1 ASP A 11 6.952 7.148 -10.914 1.00 32.12 O ATOM 168 OD2 ASP A 11 7.018 7.329 -8.733 1.00 11.55 O ATOM 0 H ASP A 11 4.875 4.939 -8.128 1.00 22.12 H new ATOM 0 HA ASP A 11 5.501 4.601 -11.009 1.00 71.03 H new ATOM 0 HB2 ASP A 11 7.433 4.861 -8.656 1.00 13.43 H new ATOM 0 HB3 ASP A 11 7.868 4.756 -10.350 1.00 13.43 H new ATOM 173 N PRO A 12 5.464 2.094 -10.691 1.00 33.33 N ATOM 174 CA PRO A 12 5.498 0.622 -10.550 1.00 15.05 C ATOM 175 C PRO A 12 6.918 0.069 -10.328 1.00 51.01 C ATOM 176 O PRO A 12 7.096 -1.006 -9.755 1.00 62.22 O ATOM 177 CB PRO A 12 4.917 0.117 -11.885 1.00 61.25 C ATOM 178 CG PRO A 12 5.069 1.262 -12.831 1.00 75.43 C ATOM 179 CD PRO A 12 4.911 2.504 -11.996 1.00 3.13 C ATOM 0 HA PRO A 12 4.939 0.292 -9.675 1.00 15.05 H new ATOM 0 HB2 PRO A 12 5.453 -0.763 -12.241 1.00 61.25 H new ATOM 0 HB3 PRO A 12 3.871 -0.169 -11.777 1.00 61.25 H new ATOM 0 HG2 PRO A 12 6.043 1.240 -13.319 1.00 75.43 H new ATOM 0 HG3 PRO A 12 4.317 1.222 -13.619 1.00 75.43 H new ATOM 0 HD2 PRO A 12 5.456 3.348 -12.419 1.00 3.13 H new ATOM 0 HD3 PRO A 12 3.867 2.807 -11.916 1.00 3.13 H new ATOM 187 N GLU A 13 7.924 0.819 -10.772 1.00 4.10 N ATOM 188 CA GLU A 13 9.328 0.410 -10.632 1.00 53.45 C ATOM 189 C GLU A 13 9.756 0.314 -9.156 1.00 20.02 C ATOM 190 O GLU A 13 10.636 -0.474 -8.804 1.00 32.34 O ATOM 191 CB GLU A 13 10.234 1.395 -11.378 1.00 62.24 C ATOM 192 CG GLU A 13 9.964 1.457 -12.879 1.00 43.33 C ATOM 193 CD GLU A 13 10.868 2.442 -13.602 1.00 62.32 C ATOM 194 OE1 GLU A 13 12.051 2.111 -13.833 1.00 32.23 O ATOM 195 OE2 GLU A 13 10.404 3.548 -13.943 1.00 41.21 O ATOM 0 H GLU A 13 7.796 1.719 -11.235 1.00 4.10 H new ATOM 0 HA GLU A 13 9.428 -0.584 -11.068 1.00 53.45 H new ATOM 0 HB2 GLU A 13 10.103 2.390 -10.952 1.00 62.24 H new ATOM 0 HB3 GLU A 13 11.274 1.113 -11.216 1.00 62.24 H new ATOM 0 HG2 GLU A 13 10.099 0.464 -13.309 1.00 43.33 H new ATOM 0 HG3 GLU A 13 8.924 1.737 -13.045 1.00 43.33 H new ATOM 202 N ILE A 14 9.125 1.114 -8.298 1.00 55.52 N ATOM 203 CA ILE A 14 9.406 1.088 -6.858 1.00 43.43 C ATOM 204 C ILE A 14 8.634 -0.061 -6.204 1.00 33.12 C ATOM 205 O ILE A 14 9.150 -0.784 -5.350 1.00 50.02 O ATOM 206 CB ILE A 14 9.013 2.428 -6.181 1.00 54.14 C ATOM 207 CG1 ILE A 14 9.751 3.597 -6.856 1.00 12.23 C ATOM 208 CG2 ILE A 14 9.317 2.389 -4.681 1.00 20.11 C ATOM 209 CD1 ILE A 14 9.388 4.959 -6.297 1.00 31.41 C ATOM 0 H ILE A 14 8.413 1.791 -8.573 1.00 55.52 H new ATOM 0 HA ILE A 14 10.478 0.940 -6.725 1.00 43.43 H new ATOM 0 HB ILE A 14 7.940 2.577 -6.302 1.00 54.14 H new ATOM 0 HG12 ILE A 14 10.825 3.446 -6.749 1.00 12.23 H new ATOM 0 HG13 ILE A 14 9.532 3.584 -7.924 1.00 12.23 H new ATOM 0 HG21 ILE A 14 9.033 3.339 -4.227 1.00 20.11 H new ATOM 0 HG22 ILE A 14 8.751 1.582 -4.216 1.00 20.11 H new ATOM 0 HG23 ILE A 14 10.383 2.219 -4.530 1.00 20.11 H new ATOM 0 HD11 ILE A 14 9.949 5.730 -6.824 1.00 31.41 H new ATOM 0 HD12 ILE A 14 8.320 5.134 -6.429 1.00 31.41 H new ATOM 0 HD13 ILE A 14 9.633 4.994 -5.235 1.00 31.41 H new ATOM 221 N LEU A 15 7.391 -0.219 -6.646 1.00 0.12 N ATOM 222 CA LEU A 15 6.518 -1.309 -6.218 1.00 4.55 C ATOM 223 C LEU A 15 7.192 -2.688 -6.403 1.00 65.13 C ATOM 224 O LEU A 15 7.121 -3.544 -5.517 1.00 30.22 O ATOM 225 CB LEU A 15 5.190 -1.194 -7.002 1.00 43.03 C ATOM 226 CG LEU A 15 4.517 -2.501 -7.446 1.00 71.41 C ATOM 227 CD1 LEU A 15 4.040 -3.327 -6.253 1.00 73.32 C ATOM 228 CD2 LEU A 15 3.353 -2.196 -8.391 1.00 72.30 C ATOM 0 H LEU A 15 6.956 0.412 -7.319 1.00 0.12 H new ATOM 0 HA LEU A 15 6.315 -1.226 -5.150 1.00 4.55 H new ATOM 0 HB2 LEU A 15 4.481 -0.643 -6.385 1.00 43.03 H new ATOM 0 HB3 LEU A 15 5.375 -0.591 -7.891 1.00 43.03 H new ATOM 0 HG LEU A 15 5.260 -3.097 -7.976 1.00 71.41 H new ATOM 0 HD11 LEU A 15 3.570 -4.243 -6.610 1.00 73.32 H new ATOM 0 HD12 LEU A 15 4.892 -3.578 -5.621 1.00 73.32 H new ATOM 0 HD13 LEU A 15 3.318 -2.749 -5.676 1.00 73.32 H new ATOM 0 HD21 LEU A 15 2.882 -3.129 -8.701 1.00 72.30 H new ATOM 0 HD22 LEU A 15 2.621 -1.573 -7.877 1.00 72.30 H new ATOM 0 HD23 LEU A 15 3.726 -1.669 -9.269 1.00 72.30 H new ATOM 240 N LYS A 16 7.859 -2.891 -7.542 1.00 33.35 N ATOM 241 CA LYS A 16 8.579 -4.149 -7.811 1.00 43.51 C ATOM 242 C LYS A 16 9.618 -4.463 -6.716 1.00 4.21 C ATOM 243 O LYS A 16 9.659 -5.575 -6.178 1.00 73.04 O ATOM 244 CB LYS A 16 9.283 -4.079 -9.176 1.00 4.12 C ATOM 245 CG LYS A 16 8.334 -3.968 -10.367 1.00 2.02 C ATOM 246 CD LYS A 16 9.101 -3.799 -11.676 1.00 11.02 C ATOM 247 CE LYS A 16 8.168 -3.644 -12.870 1.00 52.44 C ATOM 248 NZ LYS A 16 8.921 -3.502 -14.145 1.00 11.15 N ATOM 0 H LYS A 16 7.918 -2.205 -8.294 1.00 33.35 H new ATOM 0 HA LYS A 16 7.839 -4.949 -7.817 1.00 43.51 H new ATOM 0 HB2 LYS A 16 9.956 -3.221 -9.181 1.00 4.12 H new ATOM 0 HB3 LYS A 16 9.900 -4.969 -9.300 1.00 4.12 H new ATOM 0 HG2 LYS A 16 7.710 -4.860 -10.422 1.00 2.02 H new ATOM 0 HG3 LYS A 16 7.665 -3.120 -10.223 1.00 2.02 H new ATOM 0 HD2 LYS A 16 9.748 -2.925 -11.606 1.00 11.02 H new ATOM 0 HD3 LYS A 16 9.747 -4.663 -11.831 1.00 11.02 H new ATOM 0 HE2 LYS A 16 7.509 -4.510 -12.931 1.00 52.44 H new ATOM 0 HE3 LYS A 16 7.533 -2.770 -12.724 1.00 52.44 H new ATOM 0 HZ1 LYS A 16 8.251 -3.399 -14.934 1.00 11.15 H new ATOM 0 HZ2 LYS A 16 9.531 -2.661 -14.096 1.00 11.15 H new ATOM 0 HZ3 LYS A 16 9.508 -4.347 -14.297 1.00 11.15 H new ATOM 262 N GLU A 17 10.447 -3.472 -6.389 1.00 41.11 N ATOM 263 CA GLU A 17 11.487 -3.622 -5.364 1.00 22.12 C ATOM 264 C GLU A 17 10.888 -4.000 -4.002 1.00 65.22 C ATOM 265 O GLU A 17 11.474 -4.774 -3.240 1.00 2.15 O ATOM 266 CB GLU A 17 12.282 -2.318 -5.241 1.00 24.05 C ATOM 267 CG GLU A 17 12.967 -1.886 -6.533 1.00 25.44 C ATOM 268 CD GLU A 17 14.028 -2.868 -6.996 1.00 43.35 C ATOM 269 OE1 GLU A 17 15.145 -2.842 -6.437 1.00 31.33 O ATOM 270 OE2 GLU A 17 13.759 -3.655 -7.929 1.00 3.31 O ATOM 0 H GLU A 17 10.420 -2.549 -6.821 1.00 41.11 H new ATOM 0 HA GLU A 17 12.150 -4.431 -5.672 1.00 22.12 H new ATOM 0 HB2 GLU A 17 11.610 -1.524 -4.915 1.00 24.05 H new ATOM 0 HB3 GLU A 17 13.037 -2.436 -4.463 1.00 24.05 H new ATOM 0 HG2 GLU A 17 12.217 -1.773 -7.316 1.00 25.44 H new ATOM 0 HG3 GLU A 17 13.424 -0.907 -6.386 1.00 25.44 H new ATOM 277 N ILE A 18 9.717 -3.442 -3.701 1.00 34.51 N ATOM 278 CA ILE A 18 9.004 -3.763 -2.464 1.00 3.15 C ATOM 279 C ILE A 18 8.552 -5.232 -2.459 1.00 34.24 C ATOM 280 O ILE A 18 8.765 -5.959 -1.488 1.00 32.10 O ATOM 281 CB ILE A 18 7.764 -2.852 -2.273 1.00 3.13 C ATOM 282 CG1 ILE A 18 8.158 -1.373 -2.407 1.00 74.35 C ATOM 283 CG2 ILE A 18 7.110 -3.112 -0.916 1.00 30.43 C ATOM 284 CD1 ILE A 18 6.983 -0.419 -2.367 1.00 62.11 C ATOM 0 H ILE A 18 9.241 -2.765 -4.297 1.00 34.51 H new ATOM 0 HA ILE A 18 9.698 -3.593 -1.641 1.00 3.15 H new ATOM 0 HB ILE A 18 7.040 -3.088 -3.053 1.00 3.13 H new ATOM 0 HG12 ILE A 18 8.849 -1.117 -1.604 1.00 74.35 H new ATOM 0 HG13 ILE A 18 8.695 -1.234 -3.345 1.00 74.35 H new ATOM 0 HG21 ILE A 18 6.242 -2.463 -0.800 1.00 30.43 H new ATOM 0 HG22 ILE A 18 6.795 -4.154 -0.858 1.00 30.43 H new ATOM 0 HG23 ILE A 18 7.826 -2.904 -0.121 1.00 30.43 H new ATOM 0 HD11 ILE A 18 7.342 0.605 -2.467 1.00 62.11 H new ATOM 0 HD12 ILE A 18 6.302 -0.647 -3.187 1.00 62.11 H new ATOM 0 HD13 ILE A 18 6.458 -0.528 -1.418 1.00 62.11 H new ATOM 296 N VAL A 19 7.941 -5.663 -3.564 1.00 63.15 N ATOM 297 CA VAL A 19 7.441 -7.036 -3.702 1.00 21.44 C ATOM 298 C VAL A 19 8.541 -8.086 -3.461 1.00 60.34 C ATOM 299 O VAL A 19 8.371 -8.997 -2.643 1.00 51.03 O ATOM 300 CB VAL A 19 6.818 -7.267 -5.104 1.00 64.11 C ATOM 301 CG1 VAL A 19 6.448 -8.736 -5.308 1.00 2.43 C ATOM 302 CG2 VAL A 19 5.597 -6.372 -5.306 1.00 22.41 C ATOM 0 H VAL A 19 7.779 -5.077 -4.383 1.00 63.15 H new ATOM 0 HA VAL A 19 6.675 -7.159 -2.936 1.00 21.44 H new ATOM 0 HB VAL A 19 7.567 -7.002 -5.851 1.00 64.11 H new ATOM 0 HG11 VAL A 19 6.014 -8.868 -6.299 1.00 2.43 H new ATOM 0 HG12 VAL A 19 7.343 -9.352 -5.219 1.00 2.43 H new ATOM 0 HG13 VAL A 19 5.723 -9.037 -4.551 1.00 2.43 H new ATOM 0 HG21 VAL A 19 5.175 -6.550 -6.295 1.00 22.41 H new ATOM 0 HG22 VAL A 19 4.849 -6.600 -4.546 1.00 22.41 H new ATOM 0 HG23 VAL A 19 5.894 -5.327 -5.221 1.00 22.41 H new ATOM 312 N ARG A 20 9.670 -7.955 -4.167 1.00 74.33 N ATOM 313 CA ARG A 20 10.760 -8.936 -4.054 1.00 44.14 C ATOM 314 C ARG A 20 11.241 -9.069 -2.597 1.00 43.44 C ATOM 315 O ARG A 20 11.677 -10.142 -2.169 1.00 55.22 O ATOM 316 CB ARG A 20 11.937 -8.571 -4.980 1.00 2.53 C ATOM 317 CG ARG A 20 12.813 -7.423 -4.484 1.00 23.43 C ATOM 318 CD ARG A 20 13.971 -7.146 -5.439 1.00 14.54 C ATOM 319 NE ARG A 20 14.962 -6.239 -4.862 1.00 11.31 N ATOM 320 CZ ARG A 20 16.086 -5.910 -5.442 1.00 42.34 C ATOM 321 NH1 ARG A 20 16.368 -6.339 -6.632 1.00 61.14 N ATOM 322 NH2 ARG A 20 16.926 -5.144 -4.828 1.00 53.14 N ATOM 0 H ARG A 20 9.854 -7.190 -4.816 1.00 74.33 H new ATOM 0 HA ARG A 20 10.365 -9.901 -4.371 1.00 44.14 H new ATOM 0 HB2 ARG A 20 12.562 -9.454 -5.114 1.00 2.53 H new ATOM 0 HB3 ARG A 20 11.541 -8.309 -5.961 1.00 2.53 H new ATOM 0 HG2 ARG A 20 12.207 -6.523 -4.375 1.00 23.43 H new ATOM 0 HG3 ARG A 20 13.205 -7.665 -3.496 1.00 23.43 H new ATOM 0 HD2 ARG A 20 14.454 -8.087 -5.704 1.00 14.54 H new ATOM 0 HD3 ARG A 20 13.583 -6.716 -6.362 1.00 14.54 H new ATOM 0 HE ARG A 20 14.763 -5.836 -3.946 1.00 11.31 H new ATOM 0 HH11 ARG A 20 15.709 -6.941 -7.127 1.00 61.14 H new ATOM 0 HH12 ARG A 20 17.249 -6.075 -7.074 1.00 61.14 H new ATOM 0 HH21 ARG A 20 16.711 -4.798 -3.893 1.00 53.14 H new ATOM 0 HH22 ARG A 20 17.804 -4.886 -5.278 1.00 53.14 H new ATOM 336 N GLU A 21 11.148 -7.975 -1.839 1.00 34.41 N ATOM 337 CA GLU A 21 11.441 -8.003 -0.404 1.00 31.12 C ATOM 338 C GLU A 21 10.384 -8.807 0.358 1.00 24.32 C ATOM 339 O GLU A 21 10.696 -9.813 0.995 1.00 0.23 O ATOM 340 CB GLU A 21 11.500 -6.577 0.172 1.00 10.52 C ATOM 341 CG GLU A 21 12.708 -5.772 -0.285 1.00 1.51 C ATOM 342 CD GLU A 21 14.017 -6.458 0.066 1.00 42.13 C ATOM 343 OE1 GLU A 21 14.236 -6.747 1.261 1.00 50.11 O ATOM 344 OE2 GLU A 21 14.812 -6.740 -0.852 1.00 3.12 O ATOM 0 H GLU A 21 10.872 -7.059 -2.194 1.00 34.41 H new ATOM 0 HA GLU A 21 12.412 -8.482 -0.281 1.00 31.12 H new ATOM 0 HB2 GLU A 21 10.593 -6.044 -0.112 1.00 10.52 H new ATOM 0 HB3 GLU A 21 11.507 -6.636 1.260 1.00 10.52 H new ATOM 0 HG2 GLU A 21 12.656 -5.621 -1.363 1.00 1.51 H new ATOM 0 HG3 GLU A 21 12.681 -4.785 0.177 1.00 1.51 H new ATOM 351 N ILE A 22 9.131 -8.367 0.262 1.00 71.32 N ATOM 352 CA ILE A 22 8.017 -8.992 0.985 1.00 44.14 C ATOM 353 C ILE A 22 8.030 -10.524 0.840 1.00 15.15 C ATOM 354 O ILE A 22 7.896 -11.256 1.827 1.00 70.23 O ATOM 355 CB ILE A 22 6.657 -8.442 0.484 1.00 31.20 C ATOM 356 CG1 ILE A 22 6.629 -6.907 0.590 1.00 70.42 C ATOM 357 CG2 ILE A 22 5.504 -9.052 1.279 1.00 11.34 C ATOM 358 CD1 ILE A 22 5.403 -6.274 -0.031 1.00 54.32 C ATOM 0 H ILE A 22 8.857 -7.572 -0.315 1.00 71.32 H new ATOM 0 HA ILE A 22 8.144 -8.743 2.039 1.00 44.14 H new ATOM 0 HB ILE A 22 6.537 -8.721 -0.563 1.00 31.20 H new ATOM 0 HG12 ILE A 22 6.680 -6.624 1.641 1.00 70.42 H new ATOM 0 HG13 ILE A 22 7.519 -6.503 0.108 1.00 70.42 H new ATOM 0 HG21 ILE A 22 4.558 -8.653 0.912 1.00 11.34 H new ATOM 0 HG22 ILE A 22 5.512 -10.135 1.159 1.00 11.34 H new ATOM 0 HG23 ILE A 22 5.618 -8.803 2.334 1.00 11.34 H new ATOM 0 HD11 ILE A 22 5.455 -5.191 0.083 1.00 54.32 H new ATOM 0 HD12 ILE A 22 5.361 -6.526 -1.091 1.00 54.32 H new ATOM 0 HD13 ILE A 22 4.508 -6.649 0.467 1.00 54.32 H new ATOM 370 N LYS A 23 8.219 -10.997 -0.389 1.00 24.04 N ATOM 371 CA LYS A 23 8.258 -12.434 -0.668 1.00 51.14 C ATOM 372 C LYS A 23 9.422 -13.138 0.051 1.00 73.14 C ATOM 373 O LYS A 23 9.222 -14.169 0.698 1.00 64.13 O ATOM 374 CB LYS A 23 8.358 -12.672 -2.178 1.00 64.24 C ATOM 375 CG LYS A 23 7.208 -12.060 -2.976 1.00 55.03 C ATOM 376 CD LYS A 23 5.838 -12.549 -2.497 1.00 14.14 C ATOM 377 CE LYS A 23 5.733 -14.074 -2.480 1.00 63.00 C ATOM 378 NZ LYS A 23 6.059 -14.679 -3.798 1.00 61.51 N ATOM 0 H LYS A 23 8.348 -10.407 -1.211 1.00 24.04 H new ATOM 0 HA LYS A 23 7.332 -12.863 -0.286 1.00 51.14 H new ATOM 0 HB2 LYS A 23 9.299 -12.259 -2.540 1.00 64.24 H new ATOM 0 HB3 LYS A 23 8.388 -13.745 -2.366 1.00 64.24 H new ATOM 0 HG2 LYS A 23 7.251 -10.974 -2.895 1.00 55.03 H new ATOM 0 HG3 LYS A 23 7.330 -12.306 -4.031 1.00 55.03 H new ATOM 0 HD2 LYS A 23 5.648 -12.164 -1.495 1.00 14.14 H new ATOM 0 HD3 LYS A 23 5.063 -12.142 -3.147 1.00 14.14 H new ATOM 0 HE2 LYS A 23 6.408 -14.474 -1.723 1.00 63.00 H new ATOM 0 HE3 LYS A 23 4.723 -14.363 -2.191 1.00 63.00 H new ATOM 0 HZ1 LYS A 23 5.720 -15.662 -3.822 1.00 61.51 H new ATOM 0 HZ2 LYS A 23 5.597 -14.135 -4.554 1.00 61.51 H new ATOM 0 HZ3 LYS A 23 7.089 -14.664 -3.941 1.00 61.51 H new ATOM 392 N ARG A 24 10.637 -12.587 -0.056 1.00 54.53 N ATOM 393 CA ARG A 24 11.810 -13.219 0.568 1.00 42.35 C ATOM 394 C ARG A 24 11.734 -13.138 2.101 1.00 62.15 C ATOM 395 O ARG A 24 12.268 -13.997 2.806 1.00 52.44 O ATOM 396 CB ARG A 24 13.131 -12.600 0.066 1.00 1.32 C ATOM 397 CG ARG A 24 13.450 -11.201 0.600 1.00 75.45 C ATOM 398 CD ARG A 24 14.879 -10.784 0.243 1.00 21.30 C ATOM 399 NE ARG A 24 15.229 -9.459 0.765 1.00 25.42 N ATOM 400 CZ ARG A 24 16.309 -9.196 1.458 1.00 33.14 C ATOM 401 NH1 ARG A 24 17.124 -10.143 1.803 1.00 61.12 N ATOM 402 NH2 ARG A 24 16.560 -7.981 1.816 1.00 2.20 N ATOM 0 H ARG A 24 10.834 -11.721 -0.558 1.00 54.53 H new ATOM 0 HA ARG A 24 11.799 -14.268 0.274 1.00 42.35 H new ATOM 0 HB2 ARG A 24 13.950 -13.268 0.335 1.00 1.32 H new ATOM 0 HB3 ARG A 24 13.100 -12.556 -1.023 1.00 1.32 H new ATOM 0 HG2 ARG A 24 12.744 -10.481 0.186 1.00 75.45 H new ATOM 0 HG3 ARG A 24 13.323 -11.185 1.682 1.00 75.45 H new ATOM 0 HD2 ARG A 24 15.578 -11.522 0.638 1.00 21.30 H new ATOM 0 HD3 ARG A 24 14.993 -10.785 -0.841 1.00 21.30 H new ATOM 0 HE ARG A 24 14.587 -8.689 0.575 1.00 25.42 H new ATOM 0 HH11 ARG A 24 16.928 -11.107 1.535 1.00 61.12 H new ATOM 0 HH12 ARG A 24 17.961 -9.924 2.343 1.00 61.12 H new ATOM 0 HH21 ARG A 24 15.918 -7.231 1.559 1.00 2.20 H new ATOM 0 HH22 ARG A 24 17.400 -7.772 2.356 1.00 2.20 H new ATOM 416 N GLN A 25 11.054 -12.108 2.607 1.00 63.21 N ATOM 417 CA GLN A 25 10.863 -11.930 4.052 1.00 35.02 C ATOM 418 C GLN A 25 9.894 -12.978 4.632 1.00 1.23 C ATOM 419 O GLN A 25 9.908 -13.255 5.837 1.00 55.22 O ATOM 420 CB GLN A 25 10.317 -10.525 4.344 1.00 14.12 C ATOM 421 CG GLN A 25 11.223 -9.373 3.903 1.00 54.33 C ATOM 422 CD GLN A 25 12.592 -9.388 4.563 1.00 23.54 C ATOM 423 OE1 GLN A 25 12.767 -9.904 5.662 1.00 65.05 O ATOM 424 NE2 GLN A 25 13.572 -8.793 3.909 1.00 50.11 N ATOM 0 H GLN A 25 10.624 -11.380 2.037 1.00 63.21 H new ATOM 0 HA GLN A 25 11.835 -12.059 4.527 1.00 35.02 H new ATOM 0 HB2 GLN A 25 9.351 -10.417 3.850 1.00 14.12 H new ATOM 0 HB3 GLN A 25 10.138 -10.437 5.416 1.00 14.12 H new ATOM 0 HG2 GLN A 25 11.350 -9.416 2.821 1.00 54.33 H new ATOM 0 HG3 GLN A 25 10.730 -8.427 4.129 1.00 54.33 H new ATOM 0 HE21 GLN A 25 13.395 -8.373 2.996 1.00 50.11 H new ATOM 0 HE22 GLN A 25 14.506 -8.753 4.316 1.00 50.11 H new ATOM 433 N GLY A 26 9.052 -13.548 3.768 1.00 33.50 N ATOM 434 CA GLY A 26 8.053 -14.522 4.204 1.00 45.34 C ATOM 435 C GLY A 26 6.709 -13.884 4.543 1.00 12.05 C ATOM 436 O GLY A 26 5.882 -14.482 5.235 1.00 35.14 O ATOM 0 H GLY A 26 9.043 -13.352 2.767 1.00 33.50 H new ATOM 0 HA2 GLY A 26 7.909 -15.264 3.418 1.00 45.34 H new ATOM 0 HA3 GLY A 26 8.428 -15.053 5.079 1.00 45.34 H new ATOM 440 N VAL A 27 6.491 -12.670 4.046 1.00 61.31 N ATOM 441 CA VAL A 27 5.259 -11.917 4.311 1.00 5.02 C ATOM 442 C VAL A 27 4.338 -11.909 3.075 1.00 30.34 C ATOM 443 O VAL A 27 4.796 -12.107 1.946 1.00 31.40 O ATOM 444 CB VAL A 27 5.597 -10.457 4.726 1.00 3.01 C ATOM 445 CG1 VAL A 27 4.334 -9.663 5.062 1.00 42.33 C ATOM 446 CG2 VAL A 27 6.578 -10.440 5.902 1.00 22.42 C ATOM 0 H VAL A 27 7.157 -12.178 3.450 1.00 61.31 H new ATOM 0 HA VAL A 27 4.734 -12.410 5.129 1.00 5.02 H new ATOM 0 HB VAL A 27 6.074 -9.974 3.873 1.00 3.01 H new ATOM 0 HG11 VAL A 27 4.608 -8.647 5.348 1.00 42.33 H new ATOM 0 HG12 VAL A 27 3.681 -9.631 4.189 1.00 42.33 H new ATOM 0 HG13 VAL A 27 3.811 -10.144 5.889 1.00 42.33 H new ATOM 0 HG21 VAL A 27 6.800 -9.409 6.175 1.00 22.42 H new ATOM 0 HG22 VAL A 27 6.133 -10.954 6.754 1.00 22.42 H new ATOM 0 HG23 VAL A 27 7.500 -10.946 5.614 1.00 22.42 H new ATOM 456 N ARG A 28 3.038 -11.699 3.286 1.00 13.10 N ATOM 457 CA ARG A 28 2.076 -11.633 2.179 1.00 41.14 C ATOM 458 C ARG A 28 1.890 -10.190 1.676 1.00 45.21 C ATOM 459 O ARG A 28 1.903 -9.234 2.454 1.00 53.51 O ATOM 460 CB ARG A 28 0.729 -12.240 2.604 1.00 10.13 C ATOM 461 CG ARG A 28 -0.387 -12.051 1.579 1.00 75.45 C ATOM 462 CD ARG A 28 -1.587 -12.942 1.876 1.00 25.22 C ATOM 463 NE ARG A 28 -1.319 -14.340 1.545 1.00 62.24 N ATOM 464 CZ ARG A 28 -1.619 -15.356 2.308 1.00 35.53 C ATOM 465 NH1 ARG A 28 -2.180 -15.183 3.466 1.00 15.14 N ATOM 466 NH2 ARG A 28 -1.351 -16.553 1.906 1.00 65.12 N ATOM 0 H ARG A 28 2.625 -11.572 4.210 1.00 13.10 H new ATOM 0 HA ARG A 28 2.478 -12.218 1.352 1.00 41.14 H new ATOM 0 HB2 ARG A 28 0.864 -13.306 2.787 1.00 10.13 H new ATOM 0 HB3 ARG A 28 0.421 -11.791 3.548 1.00 10.13 H new ATOM 0 HG2 ARG A 28 -0.702 -11.008 1.573 1.00 75.45 H new ATOM 0 HG3 ARG A 28 -0.006 -12.275 0.582 1.00 75.45 H new ATOM 0 HD2 ARG A 28 -1.847 -12.862 2.931 1.00 25.22 H new ATOM 0 HD3 ARG A 28 -2.449 -12.593 1.308 1.00 25.22 H new ATOM 0 HE ARG A 28 -0.865 -14.536 0.653 1.00 62.24 H new ATOM 0 HH11 ARG A 28 -2.394 -14.241 3.794 1.00 15.14 H new ATOM 0 HH12 ARG A 28 -2.407 -15.989 4.048 1.00 15.14 H new ATOM 0 HH21 ARG A 28 -0.908 -16.699 0.999 1.00 65.12 H new ATOM 0 HH22 ARG A 28 -1.582 -17.353 2.496 1.00 65.12 H new ATOM 480 N VAL A 29 1.706 -10.050 0.366 1.00 21.33 N ATOM 481 CA VAL A 29 1.601 -8.737 -0.278 1.00 22.31 C ATOM 482 C VAL A 29 0.238 -8.535 -0.960 1.00 41.22 C ATOM 483 O VAL A 29 -0.207 -9.368 -1.750 1.00 12.32 O ATOM 484 CB VAL A 29 2.736 -8.548 -1.318 1.00 3.14 C ATOM 485 CG1 VAL A 29 2.843 -9.764 -2.235 1.00 72.41 C ATOM 486 CG2 VAL A 29 2.539 -7.263 -2.127 1.00 55.51 C ATOM 0 H VAL A 29 1.625 -10.836 -0.279 1.00 21.33 H new ATOM 0 HA VAL A 29 1.698 -7.989 0.508 1.00 22.31 H new ATOM 0 HB VAL A 29 3.675 -8.454 -0.773 1.00 3.14 H new ATOM 0 HG11 VAL A 29 3.646 -9.607 -2.955 1.00 72.41 H new ATOM 0 HG12 VAL A 29 3.058 -10.651 -1.639 1.00 72.41 H new ATOM 0 HG13 VAL A 29 1.901 -9.903 -2.766 1.00 72.41 H new ATOM 0 HG21 VAL A 29 3.350 -7.159 -2.847 1.00 55.51 H new ATOM 0 HG22 VAL A 29 1.587 -7.309 -2.656 1.00 55.51 H new ATOM 0 HG23 VAL A 29 2.539 -6.406 -1.454 1.00 55.51 H new ATOM 496 N VAL A 30 -0.416 -7.418 -0.644 1.00 74.54 N ATOM 497 CA VAL A 30 -1.710 -7.067 -1.239 1.00 42.02 C ATOM 498 C VAL A 30 -1.554 -5.894 -2.220 1.00 20.21 C ATOM 499 O VAL A 30 -1.494 -4.734 -1.816 1.00 52.45 O ATOM 500 CB VAL A 30 -2.742 -6.690 -0.146 1.00 24.43 C ATOM 501 CG1 VAL A 30 -4.124 -6.445 -0.752 1.00 31.25 C ATOM 502 CG2 VAL A 30 -2.796 -7.769 0.934 1.00 34.53 C ATOM 0 H VAL A 30 -0.069 -6.733 0.027 1.00 74.54 H new ATOM 0 HA VAL A 30 -2.073 -7.942 -1.778 1.00 42.02 H new ATOM 0 HB VAL A 30 -2.419 -5.759 0.320 1.00 24.43 H new ATOM 0 HG11 VAL A 30 -4.827 -6.182 0.039 1.00 31.25 H new ATOM 0 HG12 VAL A 30 -4.066 -5.629 -1.472 1.00 31.25 H new ATOM 0 HG13 VAL A 30 -4.466 -7.349 -1.256 1.00 31.25 H new ATOM 0 HG21 VAL A 30 -3.526 -7.488 1.693 1.00 34.53 H new ATOM 0 HG22 VAL A 30 -3.087 -8.719 0.485 1.00 34.53 H new ATOM 0 HG23 VAL A 30 -1.814 -7.872 1.395 1.00 34.53 H new ATOM 512 N LEU A 31 -1.472 -6.203 -3.508 1.00 4.22 N ATOM 513 CA LEU A 31 -1.262 -5.178 -4.535 1.00 24.23 C ATOM 514 C LEU A 31 -2.593 -4.693 -5.134 1.00 54.00 C ATOM 515 O LEU A 31 -3.328 -5.464 -5.746 1.00 74.53 O ATOM 516 CB LEU A 31 -0.346 -5.727 -5.642 1.00 70.32 C ATOM 517 CG LEU A 31 -0.080 -4.775 -6.822 1.00 71.03 C ATOM 518 CD1 LEU A 31 0.470 -3.437 -6.334 1.00 63.04 C ATOM 519 CD2 LEU A 31 0.880 -5.417 -7.820 1.00 32.05 C ATOM 0 H LEU A 31 -1.547 -7.153 -3.871 1.00 4.22 H new ATOM 0 HA LEU A 31 -0.784 -4.320 -4.062 1.00 24.23 H new ATOM 0 HB2 LEU A 31 0.611 -5.998 -5.195 1.00 70.32 H new ATOM 0 HB3 LEU A 31 -0.787 -6.644 -6.032 1.00 70.32 H new ATOM 0 HG LEU A 31 -1.029 -4.586 -7.324 1.00 71.03 H new ATOM 0 HD11 LEU A 31 0.649 -2.784 -7.188 1.00 63.04 H new ATOM 0 HD12 LEU A 31 -0.252 -2.969 -5.664 1.00 63.04 H new ATOM 0 HD13 LEU A 31 1.406 -3.601 -5.801 1.00 63.04 H new ATOM 0 HD21 LEU A 31 1.057 -4.730 -8.648 1.00 32.05 H new ATOM 0 HD22 LEU A 31 1.825 -5.639 -7.324 1.00 32.05 H new ATOM 0 HD23 LEU A 31 0.444 -6.340 -8.201 1.00 32.05 H new ATOM 531 N LEU A 32 -2.892 -3.409 -4.944 1.00 2.12 N ATOM 532 CA LEU A 32 -4.093 -2.794 -5.519 1.00 42.11 C ATOM 533 C LEU A 32 -3.733 -1.928 -6.740 1.00 51.12 C ATOM 534 O LEU A 32 -3.232 -0.808 -6.607 1.00 32.33 O ATOM 535 CB LEU A 32 -4.828 -1.959 -4.459 1.00 52.42 C ATOM 536 CG LEU A 32 -5.303 -2.748 -3.224 1.00 60.15 C ATOM 537 CD1 LEU A 32 -6.040 -1.839 -2.246 1.00 71.45 C ATOM 538 CD2 LEU A 32 -6.187 -3.927 -3.634 1.00 73.25 C ATOM 0 H LEU A 32 -2.318 -2.770 -4.394 1.00 2.12 H new ATOM 0 HA LEU A 32 -4.759 -3.590 -5.854 1.00 42.11 H new ATOM 0 HB2 LEU A 32 -4.168 -1.157 -4.128 1.00 52.42 H new ATOM 0 HB3 LEU A 32 -5.693 -1.487 -4.925 1.00 52.42 H new ATOM 0 HG LEU A 32 -4.420 -3.144 -2.722 1.00 60.15 H new ATOM 0 HD11 LEU A 32 -6.365 -2.420 -1.383 1.00 71.45 H new ATOM 0 HD12 LEU A 32 -5.373 -1.042 -1.917 1.00 71.45 H new ATOM 0 HD13 LEU A 32 -6.910 -1.404 -2.738 1.00 71.45 H new ATOM 0 HD21 LEU A 32 -6.509 -4.467 -2.744 1.00 73.25 H new ATOM 0 HD22 LEU A 32 -7.061 -3.557 -4.170 1.00 73.25 H new ATOM 0 HD23 LEU A 32 -5.622 -4.598 -4.281 1.00 73.25 H new ATOM 550 N TYR A 33 -3.985 -2.467 -7.930 1.00 61.32 N ATOM 551 CA TYR A 33 -3.610 -1.802 -9.185 1.00 22.23 C ATOM 552 C TYR A 33 -4.657 -0.755 -9.615 1.00 63.13 C ATOM 553 O TYR A 33 -5.725 -1.103 -10.126 1.00 51.24 O ATOM 554 CB TYR A 33 -3.413 -2.854 -10.297 1.00 65.32 C ATOM 555 CG TYR A 33 -2.015 -2.866 -10.894 1.00 10.12 C ATOM 556 CD1 TYR A 33 -1.003 -3.644 -10.343 1.00 72.23 C ATOM 557 CD2 TYR A 33 -1.709 -2.097 -12.010 1.00 72.41 C ATOM 558 CE1 TYR A 33 0.269 -3.654 -10.888 1.00 11.21 C ATOM 559 CE2 TYR A 33 -0.442 -2.103 -12.561 1.00 22.24 C ATOM 560 CZ TYR A 33 0.544 -2.883 -11.996 1.00 61.55 C ATOM 561 OH TYR A 33 1.808 -2.894 -12.543 1.00 12.15 O ATOM 0 H TYR A 33 -4.449 -3.366 -8.057 1.00 61.32 H new ATOM 0 HA TYR A 33 -2.672 -1.273 -9.016 1.00 22.23 H new ATOM 0 HB2 TYR A 33 -3.633 -3.842 -9.892 1.00 65.32 H new ATOM 0 HB3 TYR A 33 -4.135 -2.668 -11.092 1.00 65.32 H new ATOM 0 HD1 TYR A 33 -1.213 -4.251 -9.475 1.00 72.23 H new ATOM 0 HD2 TYR A 33 -2.477 -1.482 -12.456 1.00 72.41 H new ATOM 0 HE1 TYR A 33 1.043 -4.264 -10.446 1.00 11.21 H new ATOM 0 HE2 TYR A 33 -0.225 -1.500 -13.430 1.00 22.24 H new ATOM 0 HH TYR A 33 1.834 -2.297 -13.320 1.00 12.15 H new ATOM 571 N SER A 34 -4.347 0.525 -9.400 1.00 74.54 N ATOM 572 CA SER A 34 -5.235 1.628 -9.803 1.00 12.13 C ATOM 573 C SER A 34 -4.753 2.300 -11.097 1.00 51.33 C ATOM 574 O SER A 34 -3.825 3.115 -11.082 1.00 24.33 O ATOM 575 CB SER A 34 -5.325 2.677 -8.685 1.00 74.11 C ATOM 576 OG SER A 34 -4.037 3.137 -8.299 1.00 11.14 O ATOM 0 H SER A 34 -3.485 0.829 -8.947 1.00 74.54 H new ATOM 0 HA SER A 34 -6.221 1.201 -9.986 1.00 12.13 H new ATOM 0 HB2 SER A 34 -5.928 3.520 -9.023 1.00 74.11 H new ATOM 0 HB3 SER A 34 -5.833 2.248 -7.822 1.00 74.11 H new ATOM 0 HG SER A 34 -3.521 3.373 -9.098 1.00 11.14 H new ATOM 582 N ASP A 35 -5.376 1.936 -12.216 1.00 32.34 N ATOM 583 CA ASP A 35 -5.054 2.529 -13.520 1.00 31.05 C ATOM 584 C ASP A 35 -6.332 2.837 -14.325 1.00 64.32 C ATOM 585 O ASP A 35 -7.447 2.535 -13.892 1.00 53.41 O ATOM 586 CB ASP A 35 -4.125 1.601 -14.310 1.00 4.33 C ATOM 587 CG ASP A 35 -3.504 2.277 -15.524 1.00 21.22 C ATOM 588 OD1 ASP A 35 -2.450 2.926 -15.375 1.00 43.22 O ATOM 589 OD2 ASP A 35 -4.074 2.162 -16.632 1.00 45.04 O ATOM 0 H ASP A 35 -6.111 1.230 -12.249 1.00 32.34 H new ATOM 0 HA ASP A 35 -4.538 3.473 -13.346 1.00 31.05 H new ATOM 0 HB2 ASP A 35 -3.331 1.245 -13.653 1.00 4.33 H new ATOM 0 HB3 ASP A 35 -4.686 0.725 -14.636 1.00 4.33 H new ATOM 594 N GLN A 36 -6.156 3.443 -15.495 1.00 13.44 N ATOM 595 CA GLN A 36 -7.269 3.828 -16.365 1.00 30.23 C ATOM 596 C GLN A 36 -7.930 2.613 -17.057 1.00 44.44 C ATOM 597 O GLN A 36 -9.143 2.610 -17.271 1.00 64.21 O ATOM 598 CB GLN A 36 -6.786 4.828 -17.433 1.00 4.52 C ATOM 599 CG GLN A 36 -6.255 6.158 -16.883 1.00 0.24 C ATOM 600 CD GLN A 36 -5.036 6.001 -15.983 1.00 61.44 C ATOM 601 OE1 GLN A 36 -5.151 5.890 -14.767 1.00 72.23 O ATOM 602 NE2 GLN A 36 -3.860 5.957 -16.572 1.00 71.12 N ATOM 0 H GLN A 36 -5.238 3.682 -15.870 1.00 13.44 H new ATOM 0 HA GLN A 36 -8.022 4.293 -15.729 1.00 30.23 H new ATOM 0 HB2 GLN A 36 -6.000 4.356 -18.022 1.00 4.52 H new ATOM 0 HB3 GLN A 36 -7.612 5.037 -18.113 1.00 4.52 H new ATOM 0 HG2 GLN A 36 -5.999 6.811 -17.718 1.00 0.24 H new ATOM 0 HG3 GLN A 36 -7.048 6.653 -16.323 1.00 0.24 H new ATOM 0 HE21 GLN A 36 -3.793 6.052 -17.585 1.00 71.12 H new ATOM 0 HE22 GLN A 36 -3.015 5.828 -16.015 1.00 71.12 H new ATOM 611 N ASP A 37 -7.143 1.590 -17.414 1.00 20.15 N ATOM 612 CA ASP A 37 -7.680 0.436 -18.170 1.00 21.50 C ATOM 613 C ASP A 37 -7.578 -0.901 -17.408 1.00 40.34 C ATOM 614 O ASP A 37 -6.715 -1.092 -16.546 1.00 72.34 O ATOM 615 CB ASP A 37 -6.968 0.315 -19.525 1.00 54.23 C ATOM 616 CG ASP A 37 -7.505 -0.834 -20.370 1.00 41.43 C ATOM 617 OD1 ASP A 37 -8.740 -1.018 -20.437 1.00 60.50 O ATOM 618 OD2 ASP A 37 -6.699 -1.575 -20.952 1.00 74.44 O ATOM 0 H ASP A 37 -6.148 1.531 -17.199 1.00 20.15 H new ATOM 0 HA ASP A 37 -8.742 0.634 -18.315 1.00 21.50 H new ATOM 0 HB2 ASP A 37 -7.081 1.249 -20.075 1.00 54.23 H new ATOM 0 HB3 ASP A 37 -5.901 0.170 -19.358 1.00 54.23 H new ATOM 623 N GLU A 38 -8.469 -1.830 -17.775 1.00 30.34 N ATOM 624 CA GLU A 38 -8.529 -3.179 -17.188 1.00 23.04 C ATOM 625 C GLU A 38 -7.634 -4.170 -17.959 1.00 35.24 C ATOM 626 O GLU A 38 -6.883 -4.954 -17.372 1.00 34.43 O ATOM 627 CB GLU A 38 -9.974 -3.696 -17.248 1.00 12.32 C ATOM 628 CG GLU A 38 -11.023 -2.707 -16.754 1.00 2.54 C ATOM 629 CD GLU A 38 -12.434 -3.109 -17.166 1.00 51.33 C ATOM 630 OE1 GLU A 38 -12.880 -2.692 -18.263 1.00 40.05 O ATOM 631 OE2 GLU A 38 -13.092 -3.854 -16.414 1.00 21.35 O ATOM 0 H GLU A 38 -9.175 -1.668 -18.493 1.00 30.34 H new ATOM 0 HA GLU A 38 -8.178 -3.110 -16.158 1.00 23.04 H new ATOM 0 HB2 GLU A 38 -10.206 -3.968 -18.278 1.00 12.32 H new ATOM 0 HB3 GLU A 38 -10.045 -4.607 -16.654 1.00 12.32 H new ATOM 0 HG2 GLU A 38 -10.970 -2.637 -15.668 1.00 2.54 H new ATOM 0 HG3 GLU A 38 -10.800 -1.716 -17.149 1.00 2.54 H new ATOM 638 N LYS A 39 -7.725 -4.119 -19.285 1.00 33.22 N ATOM 639 CA LYS A 39 -7.086 -5.114 -20.160 1.00 41.20 C ATOM 640 C LYS A 39 -5.553 -5.006 -20.125 1.00 34.43 C ATOM 641 O LYS A 39 -4.851 -6.005 -19.951 1.00 34.33 O ATOM 642 CB LYS A 39 -7.623 -4.940 -21.586 1.00 23.24 C ATOM 643 CG LYS A 39 -9.150 -5.020 -21.654 1.00 5.04 C ATOM 644 CD LYS A 39 -9.693 -4.774 -23.059 1.00 62.03 C ATOM 645 CE LYS A 39 -9.354 -3.378 -23.574 1.00 4.33 C ATOM 646 NZ LYS A 39 -9.841 -2.303 -22.668 1.00 72.40 N ATOM 0 H LYS A 39 -8.239 -3.394 -19.787 1.00 33.22 H new ATOM 0 HA LYS A 39 -7.333 -6.112 -19.798 1.00 41.20 H new ATOM 0 HB2 LYS A 39 -7.296 -3.977 -21.979 1.00 23.24 H new ATOM 0 HB3 LYS A 39 -7.194 -5.709 -22.228 1.00 23.24 H new ATOM 0 HG2 LYS A 39 -9.473 -6.003 -21.311 1.00 5.04 H new ATOM 0 HG3 LYS A 39 -9.579 -4.287 -20.970 1.00 5.04 H new ATOM 0 HD2 LYS A 39 -9.283 -5.520 -23.740 1.00 62.03 H new ATOM 0 HD3 LYS A 39 -10.775 -4.905 -23.056 1.00 62.03 H new ATOM 0 HE2 LYS A 39 -8.274 -3.289 -23.690 1.00 4.33 H new ATOM 0 HE3 LYS A 39 -9.793 -3.242 -24.562 1.00 4.33 H new ATOM 0 HZ1 LYS A 39 -10.012 -1.437 -23.218 1.00 72.40 H new ATOM 0 HZ2 LYS A 39 -10.727 -2.606 -22.215 1.00 72.40 H new ATOM 0 HZ3 LYS A 39 -9.125 -2.114 -21.938 1.00 72.40 H new ATOM 660 N ARG A 40 -5.043 -3.786 -20.287 1.00 50.44 N ATOM 661 CA ARG A 40 -3.609 -3.505 -20.125 1.00 44.32 C ATOM 662 C ARG A 40 -3.128 -3.900 -18.721 1.00 63.32 C ATOM 663 O ARG A 40 -1.966 -4.255 -18.519 1.00 11.11 O ATOM 664 CB ARG A 40 -3.333 -2.009 -20.352 1.00 53.21 C ATOM 665 CG ARG A 40 -3.625 -1.521 -21.766 1.00 3.43 C ATOM 666 CD ARG A 40 -3.415 -0.015 -21.894 1.00 34.20 C ATOM 667 NE ARG A 40 -3.685 0.469 -23.246 1.00 61.32 N ATOM 668 CZ ARG A 40 -3.455 1.687 -23.652 1.00 14.23 C ATOM 669 NH1 ARG A 40 -2.963 2.571 -22.843 1.00 64.24 N ATOM 670 NH2 ARG A 40 -3.726 2.016 -24.870 1.00 30.24 N ATOM 0 H ARG A 40 -5.602 -2.969 -20.532 1.00 50.44 H new ATOM 0 HA ARG A 40 -3.066 -4.095 -20.863 1.00 44.32 H new ATOM 0 HB2 ARG A 40 -3.934 -1.431 -19.650 1.00 53.21 H new ATOM 0 HB3 ARG A 40 -2.288 -1.806 -20.119 1.00 53.21 H new ATOM 0 HG2 ARG A 40 -2.977 -2.041 -22.472 1.00 3.43 H new ATOM 0 HG3 ARG A 40 -4.652 -1.770 -22.033 1.00 3.43 H new ATOM 0 HD2 ARG A 40 -4.066 0.502 -21.189 1.00 34.20 H new ATOM 0 HD3 ARG A 40 -2.389 0.231 -21.620 1.00 34.20 H new ATOM 0 HE ARG A 40 -4.080 -0.190 -23.917 1.00 61.32 H new ATOM 0 HH11 ARG A 40 -2.752 2.317 -21.878 1.00 64.24 H new ATOM 0 HH12 ARG A 40 -2.787 3.521 -23.171 1.00 64.24 H new ATOM 0 HH21 ARG A 40 -4.118 1.325 -25.510 1.00 30.24 H new ATOM 0 HH22 ARG A 40 -3.548 2.967 -25.193 1.00 30.24 H new ATOM 684 N ARG A 41 -4.039 -3.827 -17.754 1.00 41.43 N ATOM 685 CA ARG A 41 -3.723 -4.132 -16.359 1.00 42.44 C ATOM 686 C ARG A 41 -3.304 -5.594 -16.197 1.00 24.23 C ATOM 687 O ARG A 41 -2.260 -5.882 -15.611 1.00 32.32 O ATOM 688 CB ARG A 41 -4.933 -3.827 -15.460 1.00 74.11 C ATOM 689 CG ARG A 41 -4.572 -3.206 -14.116 1.00 42.54 C ATOM 690 CD ARG A 41 -4.221 -1.727 -14.258 1.00 1.34 C ATOM 691 NE ARG A 41 -3.006 -1.497 -15.053 1.00 4.13 N ATOM 692 CZ ARG A 41 -2.995 -0.930 -16.236 1.00 62.30 C ATOM 693 NH1 ARG A 41 -4.104 -0.638 -16.840 1.00 23.25 N ATOM 694 NH2 ARG A 41 -1.875 -0.667 -16.825 1.00 51.41 N ATOM 0 H ARG A 41 -5.010 -3.557 -17.912 1.00 41.43 H new ATOM 0 HA ARG A 41 -2.887 -3.502 -16.057 1.00 42.44 H new ATOM 0 HB2 ARG A 41 -5.605 -3.152 -15.991 1.00 74.11 H new ATOM 0 HB3 ARG A 41 -5.483 -4.751 -15.284 1.00 74.11 H new ATOM 0 HG2 ARG A 41 -5.409 -3.318 -13.426 1.00 42.54 H new ATOM 0 HG3 ARG A 41 -3.727 -3.741 -13.682 1.00 42.54 H new ATOM 0 HD2 ARG A 41 -5.057 -1.204 -14.723 1.00 1.34 H new ATOM 0 HD3 ARG A 41 -4.087 -1.295 -13.266 1.00 1.34 H new ATOM 0 HE ARG A 41 -2.114 -1.798 -14.660 1.00 4.13 H new ATOM 0 HH11 ARG A 41 -4.998 -0.849 -16.396 1.00 23.25 H new ATOM 0 HH12 ARG A 41 -4.083 -0.197 -17.760 1.00 23.25 H new ATOM 0 HH21 ARG A 41 -0.992 -0.900 -16.370 1.00 51.41 H new ATOM 0 HH22 ARG A 41 -1.874 -0.226 -17.745 1.00 51.41 H new ATOM 708 N ARG A 42 -4.127 -6.502 -16.725 1.00 52.44 N ATOM 709 CA ARG A 42 -3.848 -7.949 -16.690 1.00 44.24 C ATOM 710 C ARG A 42 -2.389 -8.267 -17.069 1.00 42.31 C ATOM 711 O ARG A 42 -1.718 -9.039 -16.382 1.00 60.42 O ATOM 712 CB ARG A 42 -4.840 -8.682 -17.619 1.00 31.25 C ATOM 713 CG ARG A 42 -4.514 -10.152 -17.922 1.00 24.13 C ATOM 714 CD ARG A 42 -4.190 -10.972 -16.673 1.00 32.34 C ATOM 715 NE ARG A 42 -5.160 -10.793 -15.593 1.00 20.22 N ATOM 716 CZ ARG A 42 -5.010 -11.300 -14.400 1.00 30.22 C ATOM 717 NH1 ARG A 42 -4.022 -12.098 -14.147 1.00 72.11 N ATOM 718 NH2 ARG A 42 -5.866 -11.032 -13.466 1.00 51.52 N ATOM 0 H ARG A 42 -5.003 -6.262 -17.188 1.00 52.44 H new ATOM 0 HA ARG A 42 -3.983 -8.302 -15.668 1.00 44.24 H new ATOM 0 HB2 ARG A 42 -5.832 -8.635 -17.169 1.00 31.25 H new ATOM 0 HB3 ARG A 42 -4.892 -8.140 -18.563 1.00 31.25 H new ATOM 0 HG2 ARG A 42 -5.361 -10.606 -18.436 1.00 24.13 H new ATOM 0 HG3 ARG A 42 -3.666 -10.195 -18.606 1.00 24.13 H new ATOM 0 HD2 ARG A 42 -4.147 -12.028 -16.941 1.00 32.34 H new ATOM 0 HD3 ARG A 42 -3.200 -10.694 -16.312 1.00 32.34 H new ATOM 0 HE ARG A 42 -5.998 -10.243 -15.782 1.00 20.22 H new ATOM 0 HH11 ARG A 42 -3.355 -12.334 -14.882 1.00 72.11 H new ATOM 0 HH12 ARG A 42 -3.910 -12.491 -13.212 1.00 72.11 H new ATOM 0 HH21 ARG A 42 -6.660 -10.423 -13.662 1.00 51.52 H new ATOM 0 HH22 ARG A 42 -5.746 -11.430 -12.535 1.00 51.52 H new ATOM 732 N GLU A 43 -1.895 -7.652 -18.141 1.00 60.51 N ATOM 733 CA GLU A 43 -0.510 -7.871 -18.578 1.00 13.11 C ATOM 734 C GLU A 43 0.505 -7.399 -17.521 1.00 20.35 C ATOM 735 O GLU A 43 1.466 -8.106 -17.207 1.00 42.15 O ATOM 736 CB GLU A 43 -0.239 -7.142 -19.901 1.00 4.45 C ATOM 737 CG GLU A 43 -1.173 -7.542 -21.041 1.00 23.30 C ATOM 738 CD GLU A 43 -0.739 -6.981 -22.389 1.00 5.31 C ATOM 739 OE1 GLU A 43 -0.003 -5.967 -22.414 1.00 65.31 O ATOM 740 OE2 GLU A 43 -1.119 -7.563 -23.428 1.00 5.22 O ATOM 0 H GLU A 43 -2.425 -7.002 -18.722 1.00 60.51 H new ATOM 0 HA GLU A 43 -0.386 -8.945 -18.719 1.00 13.11 H new ATOM 0 HB2 GLU A 43 -0.326 -6.068 -19.735 1.00 4.45 H new ATOM 0 HB3 GLU A 43 0.790 -7.335 -20.205 1.00 4.45 H new ATOM 0 HG2 GLU A 43 -1.217 -8.629 -21.103 1.00 23.30 H new ATOM 0 HG3 GLU A 43 -2.181 -7.194 -20.816 1.00 23.30 H new ATOM 747 N ARG A 44 0.276 -6.203 -16.972 1.00 10.31 N ATOM 748 CA ARG A 44 1.206 -5.596 -16.009 1.00 14.23 C ATOM 749 C ARG A 44 1.204 -6.335 -14.655 1.00 20.41 C ATOM 750 O ARG A 44 2.259 -6.590 -14.078 1.00 52.45 O ATOM 751 CB ARG A 44 0.854 -4.116 -15.783 1.00 31.23 C ATOM 752 CG ARG A 44 0.804 -3.262 -17.053 1.00 31.35 C ATOM 753 CD ARG A 44 2.113 -3.301 -17.845 1.00 12.11 C ATOM 754 NE ARG A 44 2.195 -2.204 -18.816 1.00 61.11 N ATOM 755 CZ ARG A 44 2.438 -2.344 -20.093 1.00 33.11 C ATOM 756 NH1 ARG A 44 2.589 -3.517 -20.617 1.00 22.12 N ATOM 757 NH2 ARG A 44 2.524 -1.295 -20.848 1.00 22.33 N ATOM 0 H ARG A 44 -0.545 -5.634 -17.177 1.00 10.31 H new ATOM 0 HA ARG A 44 2.205 -5.677 -16.437 1.00 14.23 H new ATOM 0 HB2 ARG A 44 -0.115 -4.060 -15.287 1.00 31.23 H new ATOM 0 HB3 ARG A 44 1.586 -3.684 -15.101 1.00 31.23 H new ATOM 0 HG2 ARG A 44 -0.010 -3.611 -17.688 1.00 31.35 H new ATOM 0 HG3 ARG A 44 0.578 -2.230 -16.783 1.00 31.35 H new ATOM 0 HD2 ARG A 44 2.956 -3.241 -17.157 1.00 12.11 H new ATOM 0 HD3 ARG A 44 2.194 -4.255 -18.366 1.00 12.11 H new ATOM 0 HE ARG A 44 2.051 -1.257 -18.467 1.00 61.11 H new ATOM 0 HH11 ARG A 44 2.519 -4.350 -20.032 1.00 22.12 H new ATOM 0 HH12 ARG A 44 2.778 -3.609 -21.615 1.00 22.12 H new ATOM 0 HH21 ARG A 44 2.402 -0.366 -20.446 1.00 22.33 H new ATOM 0 HH22 ARG A 44 2.713 -1.398 -21.845 1.00 22.33 H new ATOM 771 N LEU A 45 0.015 -6.670 -14.149 1.00 5.44 N ATOM 772 CA LEU A 45 -0.110 -7.302 -12.829 1.00 22.21 C ATOM 773 C LEU A 45 0.218 -8.803 -12.866 1.00 45.31 C ATOM 774 O LEU A 45 0.588 -9.382 -11.840 1.00 43.45 O ATOM 775 CB LEU A 45 -1.504 -7.040 -12.225 1.00 1.14 C ATOM 776 CG LEU A 45 -2.722 -7.526 -13.038 1.00 62.43 C ATOM 777 CD1 LEU A 45 -2.981 -9.016 -12.832 1.00 31.22 C ATOM 778 CD2 LEU A 45 -3.962 -6.713 -12.678 1.00 24.30 C ATOM 0 H LEU A 45 -0.872 -6.516 -14.629 1.00 5.44 H new ATOM 0 HA LEU A 45 0.633 -6.841 -12.178 1.00 22.21 H new ATOM 0 HB2 LEU A 45 -1.542 -7.512 -11.243 1.00 1.14 H new ATOM 0 HB3 LEU A 45 -1.609 -5.967 -12.067 1.00 1.14 H new ATOM 0 HG LEU A 45 -2.495 -7.375 -14.093 1.00 62.43 H new ATOM 0 HD11 LEU A 45 -3.846 -9.320 -13.421 1.00 31.22 H new ATOM 0 HD12 LEU A 45 -2.107 -9.585 -13.151 1.00 31.22 H new ATOM 0 HD13 LEU A 45 -3.174 -9.209 -11.777 1.00 31.22 H new ATOM 0 HD21 LEU A 45 -4.812 -7.069 -13.260 1.00 24.30 H new ATOM 0 HD22 LEU A 45 -4.177 -6.828 -11.616 1.00 24.30 H new ATOM 0 HD23 LEU A 45 -3.784 -5.661 -12.901 1.00 24.30 H new ATOM 790 N GLU A 46 0.083 -9.433 -14.041 1.00 40.21 N ATOM 791 CA GLU A 46 0.460 -10.847 -14.201 1.00 41.33 C ATOM 792 C GLU A 46 1.861 -11.105 -13.645 1.00 71.30 C ATOM 793 O GLU A 46 2.088 -12.085 -12.938 1.00 72.15 O ATOM 794 CB GLU A 46 0.426 -11.279 -15.674 1.00 64.04 C ATOM 795 CG GLU A 46 0.923 -12.711 -15.886 1.00 64.22 C ATOM 796 CD GLU A 46 0.985 -13.122 -17.349 1.00 33.50 C ATOM 797 OE1 GLU A 46 -0.067 -13.101 -18.024 1.00 64.15 O ATOM 798 OE2 GLU A 46 2.089 -13.468 -17.829 1.00 41.43 O ATOM 0 H GLU A 46 -0.280 -8.993 -14.887 1.00 40.21 H new ATOM 0 HA GLU A 46 -0.271 -11.432 -13.643 1.00 41.33 H new ATOM 0 HB2 GLU A 46 -0.594 -11.195 -16.049 1.00 64.04 H new ATOM 0 HB3 GLU A 46 1.039 -10.596 -16.262 1.00 64.04 H new ATOM 0 HG2 GLU A 46 1.915 -12.811 -15.446 1.00 64.22 H new ATOM 0 HG3 GLU A 46 0.267 -13.398 -15.352 1.00 64.22 H new ATOM 805 N GLU A 47 2.791 -10.202 -13.958 1.00 70.51 N ATOM 806 CA GLU A 47 4.179 -10.323 -13.504 1.00 21.10 C ATOM 807 C GLU A 47 4.266 -10.516 -11.986 1.00 54.02 C ATOM 808 O GLU A 47 5.132 -11.232 -11.490 1.00 32.02 O ATOM 809 CB GLU A 47 4.992 -9.096 -13.935 1.00 12.41 C ATOM 810 CG GLU A 47 5.191 -8.995 -15.446 1.00 62.11 C ATOM 811 CD GLU A 47 5.860 -10.234 -16.027 1.00 11.50 C ATOM 812 OE1 GLU A 47 7.056 -10.450 -15.752 1.00 41.11 O ATOM 813 OE2 GLU A 47 5.187 -11.007 -16.749 1.00 43.11 O ATOM 0 H GLU A 47 2.608 -9.375 -14.526 1.00 70.51 H new ATOM 0 HA GLU A 47 4.602 -11.211 -13.973 1.00 21.10 H new ATOM 0 HB2 GLU A 47 4.490 -8.195 -13.582 1.00 12.41 H new ATOM 0 HB3 GLU A 47 5.967 -9.128 -13.450 1.00 12.41 H new ATOM 0 HG2 GLU A 47 4.225 -8.847 -15.928 1.00 62.11 H new ATOM 0 HG3 GLU A 47 5.797 -8.118 -15.672 1.00 62.11 H new ATOM 820 N PHE A 48 3.346 -9.902 -11.256 1.00 64.41 N ATOM 821 CA PHE A 48 3.311 -10.026 -9.802 1.00 64.11 C ATOM 822 C PHE A 48 2.605 -11.322 -9.366 1.00 23.44 C ATOM 823 O PHE A 48 3.092 -12.035 -8.491 1.00 3.43 O ATOM 824 CB PHE A 48 2.630 -8.797 -9.190 1.00 51.33 C ATOM 825 CG PHE A 48 3.342 -7.506 -9.516 1.00 1.32 C ATOM 826 CD1 PHE A 48 4.438 -7.092 -8.769 1.00 41.55 C ATOM 827 CD2 PHE A 48 2.921 -6.710 -10.571 1.00 43.43 C ATOM 828 CE1 PHE A 48 5.096 -5.915 -9.071 1.00 4.31 C ATOM 829 CE2 PHE A 48 3.576 -5.531 -10.875 1.00 65.43 C ATOM 830 CZ PHE A 48 4.664 -5.134 -10.123 1.00 62.23 C ATOM 0 H PHE A 48 2.611 -9.311 -11.646 1.00 64.41 H new ATOM 0 HA PHE A 48 4.337 -10.078 -9.436 1.00 64.11 H new ATOM 0 HB2 PHE A 48 1.603 -8.740 -9.550 1.00 51.33 H new ATOM 0 HB3 PHE A 48 2.582 -8.916 -8.108 1.00 51.33 H new ATOM 0 HD1 PHE A 48 4.780 -7.697 -7.942 1.00 41.55 H new ATOM 0 HD2 PHE A 48 2.071 -7.015 -11.163 1.00 43.43 H new ATOM 0 HE1 PHE A 48 5.948 -5.607 -8.484 1.00 4.31 H new ATOM 0 HE2 PHE A 48 3.237 -4.921 -11.700 1.00 65.43 H new ATOM 0 HZ PHE A 48 5.176 -4.213 -10.358 1.00 62.23 H new ATOM 840 N GLU A 49 1.470 -11.640 -9.994 1.00 25.15 N ATOM 841 CA GLU A 49 0.722 -12.862 -9.656 1.00 3.33 C ATOM 842 C GLU A 49 1.563 -14.126 -9.908 1.00 22.22 C ATOM 843 O GLU A 49 1.588 -15.041 -9.084 1.00 63.03 O ATOM 844 CB GLU A 49 -0.579 -12.957 -10.459 1.00 12.03 C ATOM 845 CG GLU A 49 -1.505 -11.752 -10.314 1.00 32.33 C ATOM 846 CD GLU A 49 -2.945 -12.081 -10.686 1.00 31.50 C ATOM 847 OE1 GLU A 49 -3.156 -12.782 -11.699 1.00 65.12 O ATOM 848 OE2 GLU A 49 -3.868 -11.661 -9.956 1.00 1.41 O ATOM 0 H GLU A 49 1.049 -11.077 -10.733 1.00 25.15 H new ATOM 0 HA GLU A 49 0.484 -12.800 -8.594 1.00 3.33 H new ATOM 0 HB2 GLU A 49 -0.332 -13.084 -11.513 1.00 12.03 H new ATOM 0 HB3 GLU A 49 -1.118 -13.852 -10.148 1.00 12.03 H new ATOM 0 HG2 GLU A 49 -1.471 -11.392 -9.286 1.00 32.33 H new ATOM 0 HG3 GLU A 49 -1.145 -10.941 -10.947 1.00 32.33 H new ATOM 855 N LYS A 50 2.254 -14.165 -11.050 1.00 71.21 N ATOM 856 CA LYS A 50 3.112 -15.305 -11.412 1.00 63.53 C ATOM 857 C LYS A 50 4.324 -15.417 -10.469 1.00 24.33 C ATOM 858 O LYS A 50 5.016 -16.434 -10.448 1.00 75.34 O ATOM 859 CB LYS A 50 3.571 -15.183 -12.876 1.00 54.42 C ATOM 860 CG LYS A 50 4.523 -14.018 -13.131 1.00 64.24 C ATOM 861 CD LYS A 50 4.486 -13.539 -14.582 1.00 4.03 C ATOM 862 CE LYS A 50 4.838 -14.623 -15.587 1.00 45.33 C ATOM 863 NZ LYS A 50 4.756 -14.109 -16.980 1.00 32.23 N ATOM 0 H LYS A 50 2.238 -13.419 -11.745 1.00 71.21 H new ATOM 0 HA LYS A 50 2.525 -16.217 -11.304 1.00 63.53 H new ATOM 0 HB2 LYS A 50 4.061 -16.111 -13.171 1.00 54.42 H new ATOM 0 HB3 LYS A 50 2.694 -15.069 -13.513 1.00 54.42 H new ATOM 0 HG2 LYS A 50 4.263 -13.190 -12.472 1.00 64.24 H new ATOM 0 HG3 LYS A 50 5.539 -14.321 -12.878 1.00 64.24 H new ATOM 0 HD2 LYS A 50 3.490 -13.157 -14.805 1.00 4.03 H new ATOM 0 HD3 LYS A 50 5.180 -12.707 -14.699 1.00 4.03 H new ATOM 0 HE2 LYS A 50 5.845 -14.992 -15.391 1.00 45.33 H new ATOM 0 HE3 LYS A 50 4.160 -15.468 -15.467 1.00 45.33 H new ATOM 0 HZ1 LYS A 50 5.221 -14.779 -17.625 1.00 32.23 H new ATOM 0 HZ2 LYS A 50 3.758 -14.002 -17.252 1.00 32.23 H new ATOM 0 HZ3 LYS A 50 5.231 -13.186 -17.038 1.00 32.23 H new ATOM 877 N GLN A 51 4.582 -14.355 -9.704 1.00 21.53 N ATOM 878 CA GLN A 51 5.620 -14.370 -8.661 1.00 23.51 C ATOM 879 C GLN A 51 5.012 -14.604 -7.268 1.00 23.04 C ATOM 880 O GLN A 51 5.712 -14.555 -6.258 1.00 53.12 O ATOM 881 CB GLN A 51 6.403 -13.050 -8.661 1.00 52.20 C ATOM 882 CG GLN A 51 7.283 -12.850 -9.888 1.00 51.32 C ATOM 883 CD GLN A 51 8.096 -11.569 -9.815 1.00 71.41 C ATOM 884 OE1 GLN A 51 9.216 -11.555 -9.313 1.00 32.21 O ATOM 885 NE2 GLN A 51 7.541 -10.482 -10.307 1.00 2.53 N ATOM 0 H GLN A 51 4.086 -13.467 -9.785 1.00 21.53 H new ATOM 0 HA GLN A 51 6.297 -15.194 -8.887 1.00 23.51 H new ATOM 0 HB2 GLN A 51 5.698 -12.222 -8.594 1.00 52.20 H new ATOM 0 HB3 GLN A 51 7.028 -13.010 -7.769 1.00 52.20 H new ATOM 0 HG2 GLN A 51 7.958 -13.700 -9.990 1.00 51.32 H new ATOM 0 HG3 GLN A 51 6.658 -12.830 -10.781 1.00 51.32 H new ATOM 0 HE21 GLN A 51 6.608 -10.527 -10.718 1.00 2.53 H new ATOM 0 HE22 GLN A 51 8.043 -9.595 -10.278 1.00 2.53 H new ATOM 894 N GLY A 52 3.704 -14.852 -7.221 1.00 22.42 N ATOM 895 CA GLY A 52 3.027 -15.114 -5.955 1.00 65.31 C ATOM 896 C GLY A 52 2.647 -13.848 -5.193 1.00 13.43 C ATOM 897 O GLY A 52 3.024 -13.677 -4.032 1.00 45.05 O ATOM 0 H GLY A 52 3.096 -14.877 -8.040 1.00 22.42 H new ATOM 0 HA2 GLY A 52 2.126 -15.696 -6.148 1.00 65.31 H new ATOM 0 HA3 GLY A 52 3.674 -15.726 -5.326 1.00 65.31 H new ATOM 901 N VAL A 53 1.916 -12.954 -5.853 1.00 62.13 N ATOM 902 CA VAL A 53 1.415 -11.722 -5.222 1.00 30.45 C ATOM 903 C VAL A 53 -0.120 -11.649 -5.279 1.00 64.52 C ATOM 904 O VAL A 53 -0.728 -11.972 -6.300 1.00 60.30 O ATOM 905 CB VAL A 53 2.008 -10.465 -5.910 1.00 31.14 C ATOM 906 CG1 VAL A 53 1.401 -9.177 -5.349 1.00 74.32 C ATOM 907 CG2 VAL A 53 3.527 -10.450 -5.777 1.00 34.20 C ATOM 0 H VAL A 53 1.652 -13.055 -6.833 1.00 62.13 H new ATOM 0 HA VAL A 53 1.731 -11.746 -4.179 1.00 30.45 H new ATOM 0 HB VAL A 53 1.752 -10.513 -6.968 1.00 31.14 H new ATOM 0 HG11 VAL A 53 1.840 -8.317 -5.855 1.00 74.32 H new ATOM 0 HG12 VAL A 53 0.323 -9.182 -5.512 1.00 74.32 H new ATOM 0 HG13 VAL A 53 1.606 -9.113 -4.280 1.00 74.32 H new ATOM 0 HG21 VAL A 53 3.926 -9.561 -6.265 1.00 34.20 H new ATOM 0 HG22 VAL A 53 3.800 -10.438 -4.722 1.00 34.20 H new ATOM 0 HG23 VAL A 53 3.942 -11.341 -6.249 1.00 34.20 H new ATOM 917 N ASP A 54 -0.742 -11.220 -4.180 1.00 4.15 N ATOM 918 CA ASP A 54 -2.201 -11.067 -4.132 1.00 64.51 C ATOM 919 C ASP A 54 -2.630 -9.719 -4.740 1.00 22.35 C ATOM 920 O ASP A 54 -2.650 -8.697 -4.053 1.00 62.13 O ATOM 921 CB ASP A 54 -2.698 -11.181 -2.681 1.00 45.05 C ATOM 922 CG ASP A 54 -2.455 -12.558 -2.088 1.00 13.31 C ATOM 923 OD1 ASP A 54 -1.316 -12.840 -1.657 1.00 64.32 O ATOM 924 OD2 ASP A 54 -3.410 -13.364 -2.046 1.00 11.12 O ATOM 0 H ASP A 54 -0.263 -10.973 -3.314 1.00 4.15 H new ATOM 0 HA ASP A 54 -2.650 -11.865 -4.723 1.00 64.51 H new ATOM 0 HB2 ASP A 54 -2.196 -10.432 -2.069 1.00 45.05 H new ATOM 0 HB3 ASP A 54 -3.764 -10.958 -2.647 1.00 45.05 H new ATOM 929 N VAL A 55 -2.975 -9.717 -6.029 1.00 4.03 N ATOM 930 CA VAL A 55 -3.306 -8.474 -6.744 1.00 73.42 C ATOM 931 C VAL A 55 -4.820 -8.313 -6.991 1.00 30.34 C ATOM 932 O VAL A 55 -5.491 -9.238 -7.443 1.00 21.22 O ATOM 933 CB VAL A 55 -2.581 -8.404 -8.113 1.00 4.33 C ATOM 934 CG1 VAL A 55 -2.818 -7.049 -8.780 1.00 65.20 C ATOM 935 CG2 VAL A 55 -1.085 -8.682 -7.957 1.00 53.53 C ATOM 0 H VAL A 55 -3.034 -10.559 -6.602 1.00 4.03 H new ATOM 0 HA VAL A 55 -2.970 -7.665 -6.096 1.00 73.42 H new ATOM 0 HB VAL A 55 -2.998 -9.178 -8.757 1.00 4.33 H new ATOM 0 HG11 VAL A 55 -2.301 -7.020 -9.739 1.00 65.20 H new ATOM 0 HG12 VAL A 55 -3.886 -6.904 -8.939 1.00 65.20 H new ATOM 0 HG13 VAL A 55 -2.436 -6.256 -8.138 1.00 65.20 H new ATOM 0 HG21 VAL A 55 -0.601 -8.627 -8.932 1.00 53.53 H new ATOM 0 HG22 VAL A 55 -0.645 -7.940 -7.291 1.00 53.53 H new ATOM 0 HG23 VAL A 55 -0.942 -9.678 -7.537 1.00 53.53 H new ATOM 945 N ARG A 56 -5.347 -7.129 -6.676 1.00 32.52 N ATOM 946 CA ARG A 56 -6.716 -6.740 -7.058 1.00 42.53 C ATOM 947 C ARG A 56 -6.707 -5.365 -7.751 1.00 2.03 C ATOM 948 O ARG A 56 -5.918 -4.487 -7.400 1.00 30.05 O ATOM 949 CB ARG A 56 -7.667 -6.717 -5.841 1.00 53.53 C ATOM 950 CG ARG A 56 -8.376 -8.047 -5.569 1.00 32.20 C ATOM 951 CD ARG A 56 -7.482 -9.067 -4.871 1.00 34.45 C ATOM 952 NE ARG A 56 -7.428 -8.858 -3.425 1.00 24.14 N ATOM 953 CZ ARG A 56 -6.363 -9.030 -2.696 1.00 40.50 C ATOM 954 NH1 ARG A 56 -5.225 -9.291 -3.246 1.00 63.43 N ATOM 955 NH2 ARG A 56 -6.442 -8.918 -1.413 1.00 24.21 N ATOM 0 H ARG A 56 -4.845 -6.412 -6.152 1.00 32.52 H new ATOM 0 HA ARG A 56 -7.088 -7.491 -7.755 1.00 42.53 H new ATOM 0 HB2 ARG A 56 -7.098 -6.435 -4.955 1.00 53.53 H new ATOM 0 HB3 ARG A 56 -8.419 -5.943 -5.997 1.00 53.53 H new ATOM 0 HG2 ARG A 56 -9.257 -7.864 -4.954 1.00 32.20 H new ATOM 0 HG3 ARG A 56 -8.727 -8.465 -6.513 1.00 32.20 H new ATOM 0 HD2 ARG A 56 -7.851 -10.072 -5.077 1.00 34.45 H new ATOM 0 HD3 ARG A 56 -6.475 -9.006 -5.283 1.00 34.45 H new ATOM 0 HE ARG A 56 -8.282 -8.557 -2.956 1.00 24.14 H new ATOM 0 HH11 ARG A 56 -5.154 -9.364 -4.261 1.00 63.43 H new ATOM 0 HH12 ARG A 56 -4.397 -9.424 -2.666 1.00 63.43 H new ATOM 0 HH21 ARG A 56 -7.336 -8.696 -0.975 1.00 24.21 H new ATOM 0 HH22 ARG A 56 -5.611 -9.052 -0.837 1.00 24.21 H new ATOM 969 N THR A 57 -7.577 -5.185 -8.742 1.00 4.21 N ATOM 970 CA THR A 57 -7.633 -3.929 -9.508 1.00 22.54 C ATOM 971 C THR A 57 -8.687 -2.958 -8.956 1.00 32.12 C ATOM 972 O THR A 57 -9.776 -3.368 -8.552 1.00 61.31 O ATOM 973 CB THR A 57 -7.929 -4.189 -11.006 1.00 20.23 C ATOM 974 OG1 THR A 57 -9.131 -4.967 -11.155 1.00 2.14 O ATOM 975 CG2 THR A 57 -6.761 -4.909 -11.668 1.00 11.41 C ATOM 0 H THR A 57 -8.254 -5.888 -9.038 1.00 4.21 H new ATOM 0 HA THR A 57 -6.648 -3.473 -9.406 1.00 22.54 H new ATOM 0 HB THR A 57 -8.069 -3.225 -11.495 1.00 20.23 H new ATOM 0 HG1 THR A 57 -9.305 -5.121 -12.107 1.00 2.14 H new ATOM 0 HG21 THR A 57 -6.989 -5.082 -12.720 1.00 11.41 H new ATOM 0 HG22 THR A 57 -5.863 -4.296 -11.588 1.00 11.41 H new ATOM 0 HG23 THR A 57 -6.594 -5.865 -11.171 1.00 11.41 H new ATOM 983 N VAL A 58 -8.352 -1.666 -8.950 1.00 4.53 N ATOM 984 CA VAL A 58 -9.267 -0.615 -8.478 1.00 75.43 C ATOM 985 C VAL A 58 -9.376 0.544 -9.485 1.00 33.21 C ATOM 986 O VAL A 58 -8.373 1.138 -9.883 1.00 72.31 O ATOM 987 CB VAL A 58 -8.835 -0.056 -7.094 1.00 45.11 C ATOM 988 CG1 VAL A 58 -9.268 -0.992 -5.971 1.00 10.41 C ATOM 989 CG2 VAL A 58 -7.325 0.175 -7.045 1.00 1.23 C ATOM 0 H VAL A 58 -7.448 -1.317 -9.268 1.00 4.53 H new ATOM 0 HA VAL A 58 -10.245 -1.085 -8.378 1.00 75.43 H new ATOM 0 HB VAL A 58 -9.332 0.904 -6.952 1.00 45.11 H new ATOM 0 HG11 VAL A 58 -8.954 -0.579 -5.012 1.00 10.41 H new ATOM 0 HG12 VAL A 58 -10.353 -1.098 -5.983 1.00 10.41 H new ATOM 0 HG13 VAL A 58 -8.807 -1.969 -6.114 1.00 10.41 H new ATOM 0 HG21 VAL A 58 -7.048 0.566 -6.066 1.00 1.23 H new ATOM 0 HG22 VAL A 58 -6.807 -0.768 -7.218 1.00 1.23 H new ATOM 0 HG23 VAL A 58 -7.041 0.892 -7.816 1.00 1.23 H new ATOM 999 N GLU A 59 -10.605 0.859 -9.894 1.00 61.13 N ATOM 1000 CA GLU A 59 -10.849 1.931 -10.872 1.00 61.20 C ATOM 1001 C GLU A 59 -11.009 3.309 -10.204 1.00 72.24 C ATOM 1002 O GLU A 59 -10.619 4.331 -10.773 1.00 32.31 O ATOM 1003 CB GLU A 59 -12.106 1.615 -11.699 1.00 73.31 C ATOM 1004 CG GLU A 59 -13.393 1.569 -10.876 1.00 72.53 C ATOM 1005 CD GLU A 59 -14.636 1.347 -11.726 1.00 13.43 C ATOM 1006 OE1 GLU A 59 -15.162 2.333 -12.290 1.00 52.01 O ATOM 1007 OE2 GLU A 59 -15.092 0.189 -11.834 1.00 45.14 O ATOM 0 H GLU A 59 -11.450 0.390 -9.566 1.00 61.13 H new ATOM 0 HA GLU A 59 -9.974 1.976 -11.521 1.00 61.20 H new ATOM 0 HB2 GLU A 59 -12.213 2.367 -12.481 1.00 73.31 H new ATOM 0 HB3 GLU A 59 -11.970 0.655 -12.196 1.00 73.31 H new ATOM 0 HG2 GLU A 59 -13.317 0.771 -10.138 1.00 72.53 H new ATOM 0 HG3 GLU A 59 -13.499 2.503 -10.325 1.00 72.53 H new ATOM 1014 N ASP A 60 -11.575 3.332 -8.996 1.00 3.15 N ATOM 1015 CA ASP A 60 -11.939 4.592 -8.332 1.00 25.21 C ATOM 1016 C ASP A 60 -11.948 4.432 -6.795 1.00 70.32 C ATOM 1017 O ASP A 60 -11.750 3.330 -6.279 1.00 43.22 O ATOM 1018 CB ASP A 60 -13.322 5.033 -8.844 1.00 41.31 C ATOM 1019 CG ASP A 60 -13.716 6.427 -8.387 1.00 42.41 C ATOM 1020 OD1 ASP A 60 -13.380 7.407 -9.085 1.00 41.24 O ATOM 1021 OD2 ASP A 60 -14.356 6.550 -7.322 1.00 70.34 O ATOM 0 H ASP A 60 -11.792 2.495 -8.455 1.00 3.15 H new ATOM 0 HA ASP A 60 -11.197 5.354 -8.570 1.00 25.21 H new ATOM 0 HB2 ASP A 60 -13.325 5.001 -9.934 1.00 41.31 H new ATOM 0 HB3 ASP A 60 -14.072 4.320 -8.502 1.00 41.31 H new ATOM 1026 N LYS A 61 -12.185 5.533 -6.071 1.00 52.05 N ATOM 1027 CA LYS A 61 -12.252 5.510 -4.602 1.00 2.05 C ATOM 1028 C LYS A 61 -13.290 4.486 -4.107 1.00 72.34 C ATOM 1029 O LYS A 61 -13.006 3.665 -3.232 1.00 64.14 O ATOM 1030 CB LYS A 61 -12.609 6.903 -4.039 1.00 3.25 C ATOM 1031 CG LYS A 61 -11.539 7.984 -4.241 1.00 22.54 C ATOM 1032 CD LYS A 61 -11.493 8.513 -5.677 1.00 13.40 C ATOM 1033 CE LYS A 61 -10.553 9.709 -5.809 1.00 44.22 C ATOM 1034 NZ LYS A 61 -10.523 10.251 -7.195 1.00 41.40 N ATOM 0 H LYS A 61 -12.334 6.456 -6.480 1.00 52.05 H new ATOM 0 HA LYS A 61 -11.265 5.220 -4.243 1.00 2.05 H new ATOM 0 HB2 LYS A 61 -13.535 7.239 -4.506 1.00 3.25 H new ATOM 0 HB3 LYS A 61 -12.807 6.806 -2.972 1.00 3.25 H new ATOM 0 HG2 LYS A 61 -11.733 8.812 -3.560 1.00 22.54 H new ATOM 0 HG3 LYS A 61 -10.563 7.576 -3.977 1.00 22.54 H new ATOM 0 HD2 LYS A 61 -11.166 7.718 -6.347 1.00 13.40 H new ATOM 0 HD3 LYS A 61 -12.496 8.802 -5.990 1.00 13.40 H new ATOM 0 HE2 LYS A 61 -10.867 10.494 -5.121 1.00 44.22 H new ATOM 0 HE3 LYS A 61 -9.546 9.412 -5.515 1.00 44.22 H new ATOM 0 HZ1 LYS A 61 -9.872 11.061 -7.237 1.00 41.40 H new ATOM 0 HZ2 LYS A 61 -10.198 9.511 -7.850 1.00 41.40 H new ATOM 0 HZ3 LYS A 61 -11.478 10.560 -7.468 1.00 41.40 H new ATOM 1048 N GLU A 62 -14.489 4.529 -4.693 1.00 33.44 N ATOM 1049 CA GLU A 62 -15.575 3.613 -4.315 1.00 71.33 C ATOM 1050 C GLU A 62 -15.155 2.141 -4.456 1.00 0.45 C ATOM 1051 O GLU A 62 -15.613 1.279 -3.708 1.00 51.53 O ATOM 1052 CB GLU A 62 -16.822 3.881 -5.169 1.00 71.10 C ATOM 1053 CG GLU A 62 -17.382 5.293 -5.021 1.00 3.41 C ATOM 1054 CD GLU A 62 -18.633 5.518 -5.855 1.00 54.43 C ATOM 1055 OE1 GLU A 62 -18.502 5.869 -7.049 1.00 72.55 O ATOM 1056 OE2 GLU A 62 -19.747 5.334 -5.323 1.00 73.42 O ATOM 0 H GLU A 62 -14.735 5.188 -5.432 1.00 33.44 H new ATOM 0 HA GLU A 62 -15.806 3.798 -3.266 1.00 71.33 H new ATOM 0 HB2 GLU A 62 -16.577 3.706 -6.217 1.00 71.10 H new ATOM 0 HB3 GLU A 62 -17.597 3.163 -4.898 1.00 71.10 H new ATOM 0 HG2 GLU A 62 -17.611 5.481 -3.972 1.00 3.41 H new ATOM 0 HG3 GLU A 62 -16.620 6.015 -5.315 1.00 3.41 H new ATOM 1063 N ASP A 63 -14.281 1.867 -5.420 1.00 62.43 N ATOM 1064 CA ASP A 63 -13.740 0.524 -5.629 1.00 10.14 C ATOM 1065 C ASP A 63 -12.647 0.235 -4.584 1.00 45.12 C ATOM 1066 O ASP A 63 -12.625 -0.819 -3.946 1.00 74.25 O ATOM 1067 CB ASP A 63 -13.175 0.436 -7.057 1.00 64.22 C ATOM 1068 CG ASP A 63 -12.802 -0.972 -7.500 1.00 65.35 C ATOM 1069 OD1 ASP A 63 -12.869 -1.912 -6.686 1.00 11.43 O ATOM 1070 OD2 ASP A 63 -12.434 -1.134 -8.682 1.00 12.21 O ATOM 0 H ASP A 63 -13.928 2.564 -6.076 1.00 62.43 H new ATOM 0 HA ASP A 63 -14.525 -0.223 -5.511 1.00 10.14 H new ATOM 0 HB2 ASP A 63 -13.912 0.839 -7.752 1.00 64.22 H new ATOM 0 HB3 ASP A 63 -12.292 1.071 -7.125 1.00 64.22 H new ATOM 1075 N PHE A 64 -11.766 1.213 -4.397 1.00 40.55 N ATOM 1076 CA PHE A 64 -10.655 1.110 -3.450 1.00 3.45 C ATOM 1077 C PHE A 64 -11.128 0.674 -2.054 1.00 55.11 C ATOM 1078 O PHE A 64 -10.632 -0.311 -1.503 1.00 13.44 O ATOM 1079 CB PHE A 64 -9.927 2.460 -3.375 1.00 34.33 C ATOM 1080 CG PHE A 64 -8.736 2.482 -2.447 1.00 51.40 C ATOM 1081 CD1 PHE A 64 -7.701 1.568 -2.599 1.00 2.03 C ATOM 1082 CD2 PHE A 64 -8.646 3.423 -1.430 1.00 22.43 C ATOM 1083 CE1 PHE A 64 -6.608 1.594 -1.757 1.00 40.31 C ATOM 1084 CE2 PHE A 64 -7.553 3.451 -0.588 1.00 12.01 C ATOM 1085 CZ PHE A 64 -6.533 2.535 -0.751 1.00 44.43 C ATOM 0 H PHE A 64 -11.800 2.101 -4.897 1.00 40.55 H new ATOM 0 HA PHE A 64 -9.970 0.341 -3.808 1.00 3.45 H new ATOM 0 HB2 PHE A 64 -9.596 2.735 -4.376 1.00 34.33 H new ATOM 0 HB3 PHE A 64 -10.636 3.223 -3.053 1.00 34.33 H new ATOM 0 HD1 PHE A 64 -7.752 0.829 -3.385 1.00 2.03 H new ATOM 0 HD2 PHE A 64 -9.441 4.142 -1.296 1.00 22.43 H new ATOM 0 HE1 PHE A 64 -5.811 0.877 -1.886 1.00 40.31 H new ATOM 0 HE2 PHE A 64 -7.496 4.189 0.198 1.00 12.01 H new ATOM 0 HZ PHE A 64 -5.678 2.555 -0.092 1.00 44.43 H new ATOM 1095 N ARG A 65 -12.098 1.400 -1.497 1.00 64.21 N ATOM 1096 CA ARG A 65 -12.619 1.094 -0.157 1.00 1.01 C ATOM 1097 C ARG A 65 -13.101 -0.367 -0.043 1.00 2.30 C ATOM 1098 O ARG A 65 -12.871 -1.023 0.972 1.00 32.34 O ATOM 1099 CB ARG A 65 -13.752 2.058 0.220 1.00 3.14 C ATOM 1100 CG ARG A 65 -14.991 1.947 -0.662 1.00 61.21 C ATOM 1101 CD ARG A 65 -16.123 2.834 -0.156 1.00 74.52 C ATOM 1102 NE ARG A 65 -16.440 2.559 1.244 1.00 14.11 N ATOM 1103 CZ ARG A 65 -17.554 2.020 1.661 1.00 24.33 C ATOM 1104 NH1 ARG A 65 -18.465 1.632 0.822 1.00 70.44 N ATOM 1105 NH2 ARG A 65 -17.748 1.844 2.924 1.00 14.34 N ATOM 0 H ARG A 65 -12.540 2.201 -1.948 1.00 64.21 H new ATOM 0 HA ARG A 65 -11.795 1.225 0.544 1.00 1.01 H new ATOM 0 HB2 ARG A 65 -14.040 1.874 1.255 1.00 3.14 H new ATOM 0 HB3 ARG A 65 -13.375 3.080 0.170 1.00 3.14 H new ATOM 0 HG2 ARG A 65 -14.737 2.228 -1.684 1.00 61.21 H new ATOM 0 HG3 ARG A 65 -15.326 0.910 -0.691 1.00 61.21 H new ATOM 0 HD2 ARG A 65 -15.842 3.881 -0.267 1.00 74.52 H new ATOM 0 HD3 ARG A 65 -17.011 2.676 -0.768 1.00 74.52 H new ATOM 0 HE ARG A 65 -15.741 2.806 1.945 1.00 14.11 H new ATOM 0 HH11 ARG A 65 -18.317 1.746 -0.181 1.00 70.44 H new ATOM 0 HH12 ARG A 65 -19.329 1.213 1.165 1.00 70.44 H new ATOM 0 HH21 ARG A 65 -17.032 2.126 3.594 1.00 14.34 H new ATOM 0 HH22 ARG A 65 -18.617 1.423 3.253 1.00 14.34 H new ATOM 1119 N GLU A 66 -13.749 -0.878 -1.091 1.00 1.13 N ATOM 1120 CA GLU A 66 -14.221 -2.270 -1.107 1.00 1.33 C ATOM 1121 C GLU A 66 -13.049 -3.253 -0.933 1.00 51.14 C ATOM 1122 O GLU A 66 -13.100 -4.166 -0.106 1.00 35.20 O ATOM 1123 CB GLU A 66 -14.959 -2.572 -2.421 1.00 30.22 C ATOM 1124 CG GLU A 66 -16.179 -1.689 -2.679 1.00 34.43 C ATOM 1125 CD GLU A 66 -17.268 -1.846 -1.626 1.00 41.13 C ATOM 1126 OE1 GLU A 66 -17.698 -2.990 -1.375 1.00 35.23 O ATOM 1127 OE2 GLU A 66 -17.704 -0.825 -1.047 1.00 11.52 O ATOM 0 H GLU A 66 -13.960 -0.353 -1.940 1.00 1.13 H new ATOM 0 HA GLU A 66 -14.909 -2.398 -0.272 1.00 1.33 H new ATOM 0 HB2 GLU A 66 -14.261 -2.457 -3.250 1.00 30.22 H new ATOM 0 HB3 GLU A 66 -15.276 -3.615 -2.414 1.00 30.22 H new ATOM 0 HG2 GLU A 66 -15.864 -0.646 -2.713 1.00 34.43 H new ATOM 0 HG3 GLU A 66 -16.593 -1.929 -3.658 1.00 34.43 H new ATOM 1134 N ASN A 67 -11.988 -3.037 -1.710 1.00 15.10 N ATOM 1135 CA ASN A 67 -10.779 -3.870 -1.641 1.00 52.44 C ATOM 1136 C ASN A 67 -10.085 -3.760 -0.272 1.00 54.32 C ATOM 1137 O ASN A 67 -9.330 -4.645 0.124 1.00 32.12 O ATOM 1138 CB ASN A 67 -9.813 -3.474 -2.761 1.00 35.20 C ATOM 1139 CG ASN A 67 -10.331 -3.870 -4.132 1.00 22.42 C ATOM 1140 OD1 ASN A 67 -9.990 -4.921 -4.659 1.00 41.11 O ATOM 1141 ND2 ASN A 67 -11.175 -3.044 -4.711 1.00 74.23 N ATOM 0 H ASN A 67 -11.938 -2.288 -2.400 1.00 15.10 H new ATOM 0 HA ASN A 67 -11.080 -4.910 -1.770 1.00 52.44 H new ATOM 0 HB2 ASN A 67 -9.650 -2.397 -2.734 1.00 35.20 H new ATOM 0 HB3 ASN A 67 -8.846 -3.947 -2.589 1.00 35.20 H new ATOM 0 HD21 ASN A 67 -11.565 -3.272 -5.625 1.00 74.23 H new ATOM 0 HD22 ASN A 67 -11.439 -2.176 -4.246 1.00 74.23 H new ATOM 1148 N ILE A 68 -10.329 -2.664 0.440 1.00 71.24 N ATOM 1149 CA ILE A 68 -9.823 -2.508 1.809 1.00 23.14 C ATOM 1150 C ILE A 68 -10.639 -3.357 2.793 1.00 4.10 C ATOM 1151 O ILE A 68 -10.093 -3.995 3.692 1.00 53.31 O ATOM 1152 CB ILE A 68 -9.883 -1.030 2.263 1.00 54.44 C ATOM 1153 CG1 ILE A 68 -9.121 -0.133 1.278 1.00 41.20 C ATOM 1154 CG2 ILE A 68 -9.322 -0.871 3.679 1.00 23.23 C ATOM 1155 CD1 ILE A 68 -9.275 1.342 1.570 1.00 31.50 C ATOM 0 H ILE A 68 -10.871 -1.871 0.098 1.00 71.24 H new ATOM 0 HA ILE A 68 -8.786 -2.843 1.807 1.00 23.14 H new ATOM 0 HB ILE A 68 -10.928 -0.721 2.275 1.00 54.44 H new ATOM 0 HG12 ILE A 68 -8.063 -0.393 1.305 1.00 41.20 H new ATOM 0 HG13 ILE A 68 -9.473 -0.335 0.266 1.00 41.20 H new ATOM 0 HG21 ILE A 68 -9.375 0.176 3.976 1.00 23.23 H new ATOM 0 HG22 ILE A 68 -9.908 -1.475 4.372 1.00 23.23 H new ATOM 0 HG23 ILE A 68 -8.284 -1.202 3.698 1.00 23.23 H new ATOM 0 HD11 ILE A 68 -8.711 1.919 0.837 1.00 31.50 H new ATOM 0 HD12 ILE A 68 -10.329 1.616 1.515 1.00 31.50 H new ATOM 0 HD13 ILE A 68 -8.896 1.557 2.569 1.00 31.50 H new ATOM 1167 N ARG A 69 -11.955 -3.363 2.602 1.00 4.02 N ATOM 1168 CA ARG A 69 -12.873 -4.069 3.499 1.00 52.23 C ATOM 1169 C ARG A 69 -12.623 -5.585 3.507 1.00 2.01 C ATOM 1170 O ARG A 69 -12.699 -6.225 4.559 1.00 71.20 O ATOM 1171 CB ARG A 69 -14.320 -3.770 3.102 1.00 11.23 C ATOM 1172 CG ARG A 69 -14.647 -2.282 3.120 1.00 15.44 C ATOM 1173 CD ARG A 69 -16.076 -2.003 2.679 1.00 14.12 C ATOM 1174 NE ARG A 69 -17.051 -2.567 3.608 1.00 34.50 N ATOM 1175 CZ ARG A 69 -17.870 -1.858 4.330 1.00 21.53 C ATOM 1176 NH1 ARG A 69 -17.819 -0.562 4.307 1.00 12.40 N ATOM 1177 NH2 ARG A 69 -18.716 -2.447 5.109 1.00 11.02 N ATOM 0 H ARG A 69 -12.415 -2.884 1.828 1.00 4.02 H new ATOM 0 HA ARG A 69 -12.690 -3.708 4.511 1.00 52.23 H new ATOM 0 HB2 ARG A 69 -14.506 -4.165 2.103 1.00 11.23 H new ATOM 0 HB3 ARG A 69 -14.993 -4.292 3.782 1.00 11.23 H new ATOM 0 HG2 ARG A 69 -14.496 -1.891 4.126 1.00 15.44 H new ATOM 0 HG3 ARG A 69 -13.956 -1.752 2.465 1.00 15.44 H new ATOM 0 HD2 ARG A 69 -16.229 -0.927 2.601 1.00 14.12 H new ATOM 0 HD3 ARG A 69 -16.238 -2.420 1.685 1.00 14.12 H new ATOM 0 HE ARG A 69 -17.093 -3.582 3.697 1.00 34.50 H new ATOM 0 HH11 ARG A 69 -17.133 -0.089 3.719 1.00 12.40 H new ATOM 0 HH12 ARG A 69 -18.465 -0.016 4.877 1.00 12.40 H new ATOM 0 HH21 ARG A 69 -18.741 -3.466 5.157 1.00 11.02 H new ATOM 0 HH22 ARG A 69 -19.359 -1.893 5.676 1.00 11.02 H new ATOM 1191 N GLU A 70 -12.320 -6.158 2.342 1.00 41.15 N ATOM 1192 CA GLU A 70 -12.023 -7.592 2.257 1.00 1.22 C ATOM 1193 C GLU A 70 -10.788 -7.954 3.095 1.00 3.14 C ATOM 1194 O GLU A 70 -10.736 -9.021 3.698 1.00 44.22 O ATOM 1195 CB GLU A 70 -11.797 -8.039 0.803 1.00 54.51 C ATOM 1196 CG GLU A 70 -10.565 -7.426 0.142 1.00 2.21 C ATOM 1197 CD GLU A 70 -10.121 -8.182 -1.099 1.00 31.31 C ATOM 1198 OE1 GLU A 70 -10.798 -8.075 -2.141 1.00 71.02 O ATOM 1199 OE2 GLU A 70 -9.091 -8.886 -1.033 1.00 72.35 O ATOM 0 H GLU A 70 -12.273 -5.660 1.453 1.00 41.15 H new ATOM 0 HA GLU A 70 -12.892 -8.116 2.654 1.00 1.22 H new ATOM 0 HB2 GLU A 70 -11.705 -9.125 0.779 1.00 54.51 H new ATOM 0 HB3 GLU A 70 -12.677 -7.780 0.215 1.00 54.51 H new ATOM 0 HG2 GLU A 70 -10.780 -6.392 -0.126 1.00 2.21 H new ATOM 0 HG3 GLU A 70 -9.746 -7.405 0.861 1.00 2.21 H new ATOM 1206 N ILE A 71 -9.804 -7.051 3.135 1.00 25.42 N ATOM 1207 CA ILE A 71 -8.538 -7.287 3.851 1.00 62.12 C ATOM 1208 C ILE A 71 -8.767 -7.737 5.304 1.00 24.33 C ATOM 1209 O ILE A 71 -8.093 -8.646 5.798 1.00 73.13 O ATOM 1210 CB ILE A 71 -7.655 -6.009 3.844 1.00 53.32 C ATOM 1211 CG1 ILE A 71 -7.281 -5.630 2.402 1.00 71.14 C ATOM 1212 CG2 ILE A 71 -6.397 -6.194 4.698 1.00 70.35 C ATOM 1213 CD1 ILE A 71 -6.478 -4.349 2.290 1.00 35.20 C ATOM 0 H ILE A 71 -9.857 -6.141 2.677 1.00 25.42 H new ATOM 0 HA ILE A 71 -8.026 -8.091 3.322 1.00 62.12 H new ATOM 0 HB ILE A 71 -8.234 -5.196 4.283 1.00 53.32 H new ATOM 0 HG12 ILE A 71 -6.709 -6.445 1.960 1.00 71.14 H new ATOM 0 HG13 ILE A 71 -8.194 -5.527 1.816 1.00 71.14 H new ATOM 0 HG21 ILE A 71 -5.802 -5.281 4.671 1.00 70.35 H new ATOM 0 HG22 ILE A 71 -6.684 -6.410 5.727 1.00 70.35 H new ATOM 0 HG23 ILE A 71 -5.809 -7.023 4.304 1.00 70.35 H new ATOM 0 HD11 ILE A 71 -6.254 -4.151 1.242 1.00 35.20 H new ATOM 0 HD12 ILE A 71 -7.055 -3.521 2.701 1.00 35.20 H new ATOM 0 HD13 ILE A 71 -5.547 -4.453 2.847 1.00 35.20 H new ATOM 1225 N TRP A 72 -9.739 -7.114 5.965 1.00 3.11 N ATOM 1226 CA TRP A 72 -10.028 -7.385 7.380 1.00 32.25 C ATOM 1227 C TRP A 72 -10.564 -8.815 7.590 1.00 61.15 C ATOM 1228 O TRP A 72 -10.468 -9.375 8.685 1.00 42.20 O ATOM 1229 CB TRP A 72 -11.036 -6.352 7.902 1.00 71.41 C ATOM 1230 CG TRP A 72 -10.725 -4.946 7.458 1.00 42.41 C ATOM 1231 CD1 TRP A 72 -11.563 -4.090 6.796 1.00 43.40 C ATOM 1232 CD2 TRP A 72 -9.482 -4.246 7.612 1.00 60.10 C ATOM 1233 NE1 TRP A 72 -10.924 -2.900 6.549 1.00 70.43 N ATOM 1234 CE2 TRP A 72 -9.646 -2.971 7.038 1.00 41.42 C ATOM 1235 CE3 TRP A 72 -8.248 -4.568 8.185 1.00 40.33 C ATOM 1236 CZ2 TRP A 72 -8.626 -2.024 7.019 1.00 5.24 C ATOM 1237 CZ3 TRP A 72 -7.237 -3.628 8.164 1.00 32.13 C ATOM 1238 CH2 TRP A 72 -7.431 -2.369 7.586 1.00 14.21 C ATOM 0 H TRP A 72 -10.347 -6.412 5.544 1.00 3.11 H new ATOM 0 HA TRP A 72 -9.097 -7.304 7.941 1.00 32.25 H new ATOM 0 HB2 TRP A 72 -12.035 -6.622 7.559 1.00 71.41 H new ATOM 0 HB3 TRP A 72 -11.052 -6.387 8.991 1.00 71.41 H new ATOM 0 HD1 TRP A 72 -12.579 -4.317 6.510 1.00 43.40 H new ATOM 0 HE1 TRP A 72 -11.334 -2.094 6.078 1.00 70.43 H new ATOM 0 HE3 TRP A 72 -8.088 -5.536 8.637 1.00 40.33 H new ATOM 0 HZ2 TRP A 72 -8.773 -1.052 6.572 1.00 5.24 H new ATOM 0 HZ3 TRP A 72 -6.279 -3.869 8.602 1.00 32.13 H new ATOM 0 HH2 TRP A 72 -6.620 -1.655 7.588 1.00 14.21 H new ATOM 1249 N GLU A 73 -11.134 -9.396 6.533 1.00 44.10 N ATOM 1250 CA GLU A 73 -11.644 -10.772 6.570 1.00 1.32 C ATOM 1251 C GLU A 73 -10.647 -11.757 5.930 1.00 15.33 C ATOM 1252 O GLU A 73 -10.548 -12.918 6.333 1.00 41.51 O ATOM 1253 CB GLU A 73 -12.998 -10.842 5.847 1.00 22.14 C ATOM 1254 CG GLU A 73 -13.589 -12.247 5.769 1.00 23.40 C ATOM 1255 CD GLU A 73 -14.951 -12.281 5.095 1.00 31.14 C ATOM 1256 OE1 GLU A 73 -15.026 -12.039 3.874 1.00 52.33 O ATOM 1257 OE2 GLU A 73 -15.955 -12.564 5.782 1.00 2.01 O ATOM 0 H GLU A 73 -11.256 -8.932 5.633 1.00 44.10 H new ATOM 0 HA GLU A 73 -11.774 -11.061 7.613 1.00 1.32 H new ATOM 0 HB2 GLU A 73 -13.705 -10.189 6.359 1.00 22.14 H new ATOM 0 HB3 GLU A 73 -12.879 -10.453 4.836 1.00 22.14 H new ATOM 0 HG2 GLU A 73 -12.903 -12.894 5.223 1.00 23.40 H new ATOM 0 HG3 GLU A 73 -13.678 -12.655 6.776 1.00 23.40 H new ATOM 1264 N ARG A 74 -9.907 -11.275 4.937 1.00 51.44 N ATOM 1265 CA ARG A 74 -8.920 -12.088 4.220 1.00 30.43 C ATOM 1266 C ARG A 74 -7.723 -12.442 5.114 1.00 41.11 C ATOM 1267 O ARG A 74 -7.311 -13.602 5.190 1.00 71.21 O ATOM 1268 CB ARG A 74 -8.422 -11.329 2.978 1.00 54.31 C ATOM 1269 CG ARG A 74 -9.454 -11.192 1.856 1.00 34.32 C ATOM 1270 CD ARG A 74 -9.615 -12.490 1.069 1.00 20.21 C ATOM 1271 NE ARG A 74 -10.604 -12.364 -0.004 1.00 61.31 N ATOM 1272 CZ ARG A 74 -10.310 -12.130 -1.259 1.00 1.12 C ATOM 1273 NH1 ARG A 74 -9.086 -11.952 -1.637 1.00 3.32 N ATOM 1274 NH2 ARG A 74 -11.250 -12.072 -2.140 1.00 54.34 N ATOM 0 H ARG A 74 -9.971 -10.313 4.604 1.00 51.44 H new ATOM 0 HA ARG A 74 -9.408 -13.015 3.920 1.00 30.43 H new ATOM 0 HB2 ARG A 74 -8.102 -10.333 3.282 1.00 54.31 H new ATOM 0 HB3 ARG A 74 -7.543 -11.840 2.585 1.00 54.31 H new ATOM 0 HG2 ARG A 74 -10.416 -10.903 2.280 1.00 34.32 H new ATOM 0 HG3 ARG A 74 -9.151 -10.393 1.180 1.00 34.32 H new ATOM 0 HD2 ARG A 74 -8.653 -12.777 0.643 1.00 20.21 H new ATOM 0 HD3 ARG A 74 -9.915 -13.289 1.746 1.00 20.21 H new ATOM 0 HE ARG A 74 -11.589 -12.465 0.243 1.00 61.31 H new ATOM 0 HH11 ARG A 74 -8.330 -11.993 -0.953 1.00 3.32 H new ATOM 0 HH12 ARG A 74 -8.877 -11.771 -2.619 1.00 3.32 H new ATOM 0 HH21 ARG A 74 -12.221 -12.208 -1.859 1.00 54.34 H new ATOM 0 HH22 ARG A 74 -11.022 -11.890 -3.117 1.00 54.34 H new ATOM 1288 N TYR A 75 -7.165 -11.432 5.784 1.00 20.12 N ATOM 1289 CA TYR A 75 -5.951 -11.609 6.594 1.00 52.33 C ATOM 1290 C TYR A 75 -6.170 -11.089 8.030 1.00 1.52 C ATOM 1291 O TYR A 75 -5.814 -9.954 8.352 1.00 54.15 O ATOM 1292 CB TYR A 75 -4.769 -10.871 5.937 1.00 15.22 C ATOM 1293 CG TYR A 75 -4.867 -10.774 4.421 1.00 31.52 C ATOM 1294 CD1 TYR A 75 -4.587 -11.865 3.603 1.00 64.54 C ATOM 1295 CD2 TYR A 75 -5.252 -9.585 3.812 1.00 52.13 C ATOM 1296 CE1 TYR A 75 -4.684 -11.766 2.225 1.00 13.20 C ATOM 1297 CE2 TYR A 75 -5.352 -9.481 2.439 1.00 40.43 C ATOM 1298 CZ TYR A 75 -5.068 -10.573 1.649 1.00 75.34 C ATOM 1299 OH TYR A 75 -5.164 -10.468 0.277 1.00 54.33 O ATOM 0 H TYR A 75 -7.533 -10.481 5.784 1.00 20.12 H new ATOM 0 HA TYR A 75 -5.723 -12.674 6.647 1.00 52.33 H new ATOM 0 HB2 TYR A 75 -4.706 -9.865 6.352 1.00 15.22 H new ATOM 0 HB3 TYR A 75 -3.843 -11.383 6.199 1.00 15.22 H new ATOM 0 HD1 TYR A 75 -4.290 -12.802 4.049 1.00 64.54 H new ATOM 0 HD2 TYR A 75 -5.477 -8.725 4.425 1.00 52.13 H new ATOM 0 HE1 TYR A 75 -4.460 -12.620 1.603 1.00 13.20 H new ATOM 0 HE2 TYR A 75 -5.652 -8.547 1.986 1.00 40.43 H new ATOM 0 HH TYR A 75 -5.403 -11.340 -0.102 1.00 54.33 H new ATOM 1309 N PRO A 76 -6.758 -11.918 8.916 1.00 74.41 N ATOM 1310 CA PRO A 76 -7.125 -11.500 10.288 1.00 5.43 C ATOM 1311 C PRO A 76 -5.918 -11.267 11.219 1.00 42.34 C ATOM 1312 O PRO A 76 -6.087 -10.898 12.386 1.00 21.33 O ATOM 1313 CB PRO A 76 -7.973 -12.676 10.791 1.00 54.13 C ATOM 1314 CG PRO A 76 -7.467 -13.852 10.025 1.00 12.45 C ATOM 1315 CD PRO A 76 -7.116 -13.327 8.657 1.00 64.44 C ATOM 0 HA PRO A 76 -7.637 -10.538 10.283 1.00 5.43 H new ATOM 0 HB2 PRO A 76 -7.855 -12.820 11.865 1.00 54.13 H new ATOM 0 HB3 PRO A 76 -9.034 -12.508 10.607 1.00 54.13 H new ATOM 0 HG2 PRO A 76 -6.596 -14.291 10.511 1.00 12.45 H new ATOM 0 HG3 PRO A 76 -8.224 -14.634 9.962 1.00 12.45 H new ATOM 0 HD2 PRO A 76 -6.286 -13.878 8.215 1.00 64.44 H new ATOM 0 HD3 PRO A 76 -7.956 -13.408 7.967 1.00 64.44 H new ATOM 1323 N GLN A 77 -4.709 -11.501 10.715 1.00 14.15 N ATOM 1324 CA GLN A 77 -3.482 -11.270 11.494 1.00 54.03 C ATOM 1325 C GLN A 77 -2.946 -9.844 11.297 1.00 14.44 C ATOM 1326 O GLN A 77 -2.313 -9.286 12.192 1.00 10.41 O ATOM 1327 CB GLN A 77 -2.399 -12.280 11.095 1.00 21.13 C ATOM 1328 CG GLN A 77 -2.791 -13.731 11.344 1.00 3.02 C ATOM 1329 CD GLN A 77 -1.702 -14.706 10.933 1.00 5.03 C ATOM 1330 OE1 GLN A 77 -0.834 -15.066 11.725 1.00 22.52 O ATOM 1331 NE2 GLN A 77 -1.739 -15.146 9.694 1.00 32.54 N ATOM 0 H GLN A 77 -4.546 -11.851 9.771 1.00 14.15 H new ATOM 0 HA GLN A 77 -3.736 -11.399 12.546 1.00 54.03 H new ATOM 0 HB2 GLN A 77 -2.168 -12.152 10.038 1.00 21.13 H new ATOM 0 HB3 GLN A 77 -1.487 -12.059 11.650 1.00 21.13 H new ATOM 0 HG2 GLN A 77 -3.016 -13.867 12.402 1.00 3.02 H new ATOM 0 HG3 GLN A 77 -3.704 -13.957 10.793 1.00 3.02 H new ATOM 0 HE21 GLN A 77 -2.473 -14.828 9.061 1.00 32.54 H new ATOM 0 HE22 GLN A 77 -1.034 -15.806 9.366 1.00 32.54 H new ATOM 1340 N LEU A 78 -3.215 -9.267 10.122 1.00 13.02 N ATOM 1341 CA LEU A 78 -2.728 -7.926 9.764 1.00 51.12 C ATOM 1342 C LEU A 78 -1.192 -7.833 9.808 1.00 51.42 C ATOM 1343 O LEU A 78 -0.618 -7.111 10.622 1.00 3.22 O ATOM 1344 CB LEU A 78 -3.359 -6.851 10.663 1.00 52.21 C ATOM 1345 CG LEU A 78 -4.890 -6.743 10.575 1.00 73.04 C ATOM 1346 CD1 LEU A 78 -5.403 -5.625 11.475 1.00 33.45 C ATOM 1347 CD2 LEU A 78 -5.331 -6.526 9.129 1.00 41.41 C ATOM 0 H LEU A 78 -3.774 -9.712 9.393 1.00 13.02 H new ATOM 0 HA LEU A 78 -3.036 -7.744 8.734 1.00 51.12 H new ATOM 0 HB2 LEU A 78 -3.084 -7.057 11.697 1.00 52.21 H new ATOM 0 HB3 LEU A 78 -2.927 -5.884 10.405 1.00 52.21 H new ATOM 0 HG LEU A 78 -5.322 -7.681 10.923 1.00 73.04 H new ATOM 0 HD11 LEU A 78 -6.489 -5.565 11.398 1.00 33.45 H new ATOM 0 HD12 LEU A 78 -5.123 -5.832 12.508 1.00 33.45 H new ATOM 0 HD13 LEU A 78 -4.964 -4.677 11.163 1.00 33.45 H new ATOM 0 HD21 LEU A 78 -6.418 -6.452 9.087 1.00 41.41 H new ATOM 0 HD22 LEU A 78 -4.890 -5.605 8.748 1.00 41.41 H new ATOM 0 HD23 LEU A 78 -5.001 -7.366 8.518 1.00 41.41 H new ATOM 1359 N ASP A 79 -0.542 -8.598 8.937 1.00 43.25 N ATOM 1360 CA ASP A 79 0.914 -8.526 8.752 1.00 20.11 C ATOM 1361 C ASP A 79 1.257 -8.181 7.295 1.00 63.23 C ATOM 1362 O ASP A 79 2.423 -8.125 6.911 1.00 20.01 O ATOM 1363 CB ASP A 79 1.546 -9.873 9.121 1.00 4.54 C ATOM 1364 CG ASP A 79 1.066 -10.992 8.210 1.00 50.13 C ATOM 1365 OD1 ASP A 79 -0.064 -11.489 8.412 1.00 35.43 O ATOM 1366 OD2 ASP A 79 1.811 -11.386 7.286 1.00 54.14 O ATOM 0 H ASP A 79 -1.002 -9.284 8.339 1.00 43.25 H new ATOM 0 HA ASP A 79 1.309 -7.743 9.400 1.00 20.11 H new ATOM 0 HB2 ASP A 79 2.631 -9.794 9.059 1.00 4.54 H new ATOM 0 HB3 ASP A 79 1.303 -10.117 10.155 1.00 4.54 H new ATOM 1371 N VAL A 80 0.224 -7.916 6.502 1.00 24.00 N ATOM 1372 CA VAL A 80 0.366 -7.804 5.051 1.00 21.22 C ATOM 1373 C VAL A 80 0.667 -6.369 4.593 1.00 44.45 C ATOM 1374 O VAL A 80 0.190 -5.393 5.179 1.00 50.34 O ATOM 1375 CB VAL A 80 -0.914 -8.312 4.334 1.00 41.42 C ATOM 1376 CG1 VAL A 80 -1.180 -9.776 4.687 1.00 14.35 C ATOM 1377 CG2 VAL A 80 -2.123 -7.442 4.686 1.00 34.22 C ATOM 0 H VAL A 80 -0.727 -7.774 6.841 1.00 24.00 H new ATOM 0 HA VAL A 80 1.218 -8.427 4.778 1.00 21.22 H new ATOM 0 HB VAL A 80 -0.751 -8.240 3.259 1.00 41.42 H new ATOM 0 HG11 VAL A 80 -2.081 -10.116 4.176 1.00 14.35 H new ATOM 0 HG12 VAL A 80 -0.333 -10.386 4.373 1.00 14.35 H new ATOM 0 HG13 VAL A 80 -1.316 -9.872 5.764 1.00 14.35 H new ATOM 0 HG21 VAL A 80 -3.006 -7.820 4.170 1.00 34.22 H new ATOM 0 HG22 VAL A 80 -2.291 -7.471 5.763 1.00 34.22 H new ATOM 0 HG23 VAL A 80 -1.934 -6.414 4.376 1.00 34.22 H new ATOM 1387 N VAL A 81 1.468 -6.259 3.536 1.00 23.35 N ATOM 1388 CA VAL A 81 1.807 -4.965 2.941 1.00 60.15 C ATOM 1389 C VAL A 81 0.905 -4.656 1.735 1.00 55.43 C ATOM 1390 O VAL A 81 0.984 -5.319 0.697 1.00 52.24 O ATOM 1391 CB VAL A 81 3.290 -4.926 2.496 1.00 52.23 C ATOM 1392 CG1 VAL A 81 3.613 -3.616 1.774 1.00 31.43 C ATOM 1393 CG2 VAL A 81 4.212 -5.131 3.698 1.00 71.35 C ATOM 0 H VAL A 81 1.899 -7.057 3.069 1.00 23.35 H new ATOM 0 HA VAL A 81 1.647 -4.207 3.708 1.00 60.15 H new ATOM 0 HB VAL A 81 3.458 -5.741 1.792 1.00 52.23 H new ATOM 0 HG11 VAL A 81 4.661 -3.615 1.473 1.00 31.43 H new ATOM 0 HG12 VAL A 81 2.981 -3.522 0.891 1.00 31.43 H new ATOM 0 HG13 VAL A 81 3.428 -2.776 2.444 1.00 31.43 H new ATOM 0 HG21 VAL A 81 5.251 -5.101 3.369 1.00 71.35 H new ATOM 0 HG22 VAL A 81 4.040 -4.340 4.428 1.00 71.35 H new ATOM 0 HG23 VAL A 81 4.004 -6.098 4.155 1.00 71.35 H new ATOM 1403 N VAL A 82 0.038 -3.661 1.889 1.00 24.13 N ATOM 1404 CA VAL A 82 -0.867 -3.240 0.816 1.00 2.42 C ATOM 1405 C VAL A 82 -0.226 -2.139 -0.045 1.00 4.44 C ATOM 1406 O VAL A 82 0.011 -1.031 0.425 1.00 13.23 O ATOM 1407 CB VAL A 82 -2.212 -2.726 1.389 1.00 24.24 C ATOM 1408 CG1 VAL A 82 -3.179 -2.351 0.264 1.00 72.43 C ATOM 1409 CG2 VAL A 82 -2.832 -3.768 2.320 1.00 72.22 C ATOM 0 H VAL A 82 -0.060 -3.125 2.751 1.00 24.13 H new ATOM 0 HA VAL A 82 -1.058 -4.114 0.193 1.00 2.42 H new ATOM 0 HB VAL A 82 -2.013 -1.826 1.970 1.00 24.24 H new ATOM 0 HG11 VAL A 82 -4.115 -1.993 0.693 1.00 72.43 H new ATOM 0 HG12 VAL A 82 -2.737 -1.565 -0.349 1.00 72.43 H new ATOM 0 HG13 VAL A 82 -3.375 -3.227 -0.355 1.00 72.43 H new ATOM 0 HG21 VAL A 82 -3.776 -3.389 2.713 1.00 72.22 H new ATOM 0 HG22 VAL A 82 -3.013 -4.689 1.766 1.00 72.22 H new ATOM 0 HG23 VAL A 82 -2.150 -3.969 3.146 1.00 72.22 H new ATOM 1419 N ILE A 83 0.056 -2.447 -1.306 1.00 24.42 N ATOM 1420 CA ILE A 83 0.682 -1.482 -2.217 1.00 43.21 C ATOM 1421 C ILE A 83 -0.331 -0.957 -3.247 1.00 44.52 C ATOM 1422 O ILE A 83 -0.888 -1.728 -4.025 1.00 45.35 O ATOM 1423 CB ILE A 83 1.882 -2.114 -2.965 1.00 5.44 C ATOM 1424 CG1 ILE A 83 2.847 -2.779 -1.968 1.00 12.22 C ATOM 1425 CG2 ILE A 83 2.611 -1.054 -3.796 1.00 23.44 C ATOM 1426 CD1 ILE A 83 3.980 -3.542 -2.626 1.00 40.33 C ATOM 0 H ILE A 83 -0.137 -3.356 -1.726 1.00 24.42 H new ATOM 0 HA ILE A 83 1.038 -0.652 -1.607 1.00 43.21 H new ATOM 0 HB ILE A 83 1.505 -2.881 -3.641 1.00 5.44 H new ATOM 0 HG12 ILE A 83 3.268 -2.012 -1.318 1.00 12.22 H new ATOM 0 HG13 ILE A 83 2.283 -3.462 -1.332 1.00 12.22 H new ATOM 0 HG21 ILE A 83 3.452 -1.514 -4.316 1.00 23.44 H new ATOM 0 HG22 ILE A 83 1.923 -0.627 -4.526 1.00 23.44 H new ATOM 0 HG23 ILE A 83 2.978 -0.266 -3.139 1.00 23.44 H new ATOM 0 HD11 ILE A 83 4.617 -3.982 -1.858 1.00 40.33 H new ATOM 0 HD12 ILE A 83 3.570 -4.333 -3.254 1.00 40.33 H new ATOM 0 HD13 ILE A 83 4.569 -2.861 -3.240 1.00 40.33 H new ATOM 1438 N VAL A 84 -0.566 0.352 -3.248 1.00 1.53 N ATOM 1439 CA VAL A 84 -1.521 0.967 -4.178 1.00 2.41 C ATOM 1440 C VAL A 84 -0.795 1.853 -5.205 1.00 10.20 C ATOM 1441 O VAL A 84 0.027 2.700 -4.842 1.00 33.33 O ATOM 1442 CB VAL A 84 -2.572 1.816 -3.418 1.00 14.03 C ATOM 1443 CG1 VAL A 84 -3.685 2.282 -4.356 1.00 1.34 C ATOM 1444 CG2 VAL A 84 -3.142 1.035 -2.233 1.00 72.34 C ATOM 0 H VAL A 84 -0.111 1.011 -2.617 1.00 1.53 H new ATOM 0 HA VAL A 84 -2.031 0.158 -4.702 1.00 2.41 H new ATOM 0 HB VAL A 84 -2.073 2.704 -3.030 1.00 14.03 H new ATOM 0 HG11 VAL A 84 -4.408 2.875 -3.796 1.00 1.34 H new ATOM 0 HG12 VAL A 84 -3.258 2.889 -5.154 1.00 1.34 H new ATOM 0 HG13 VAL A 84 -4.184 1.414 -4.788 1.00 1.34 H new ATOM 0 HG21 VAL A 84 -3.878 1.649 -1.713 1.00 72.34 H new ATOM 0 HG22 VAL A 84 -3.619 0.124 -2.594 1.00 72.34 H new ATOM 0 HG23 VAL A 84 -2.336 0.775 -1.547 1.00 72.34 H new ATOM 1454 N THR A 85 -1.111 1.665 -6.487 1.00 31.51 N ATOM 1455 CA THR A 85 -0.412 2.376 -7.571 1.00 63.34 C ATOM 1456 C THR A 85 -0.976 3.789 -7.811 1.00 52.02 C ATOM 1457 O THR A 85 -1.534 4.082 -8.875 1.00 53.05 O ATOM 1458 CB THR A 85 -0.454 1.577 -8.900 1.00 23.44 C ATOM 1459 OG1 THR A 85 -1.806 1.437 -9.359 1.00 41.04 O ATOM 1460 CG2 THR A 85 0.166 0.193 -8.727 1.00 33.13 C ATOM 0 H THR A 85 -1.843 1.030 -6.805 1.00 31.51 H new ATOM 0 HA THR A 85 0.623 2.472 -7.241 1.00 63.34 H new ATOM 0 HB THR A 85 0.124 2.133 -9.638 1.00 23.44 H new ATOM 0 HG1 THR A 85 -2.071 2.244 -9.847 1.00 41.04 H new ATOM 0 HG21 THR A 85 0.123 -0.346 -9.674 1.00 33.13 H new ATOM 0 HG22 THR A 85 1.205 0.296 -8.415 1.00 33.13 H new ATOM 0 HG23 THR A 85 -0.387 -0.361 -7.969 1.00 33.13 H new ATOM 1468 N THR A 86 -0.829 4.663 -6.814 1.00 15.30 N ATOM 1469 CA THR A 86 -1.265 6.064 -6.935 1.00 73.54 C ATOM 1470 C THR A 86 -0.667 6.948 -5.831 1.00 61.23 C ATOM 1471 O THR A 86 -0.092 6.451 -4.862 1.00 21.24 O ATOM 1472 CB THR A 86 -2.807 6.211 -6.902 1.00 43.41 C ATOM 1473 OG1 THR A 86 -3.170 7.587 -7.113 1.00 34.40 O ATOM 1474 CG2 THR A 86 -3.385 5.731 -5.574 1.00 65.31 C ATOM 0 H THR A 86 -0.412 4.430 -5.913 1.00 15.30 H new ATOM 0 HA THR A 86 -0.899 6.396 -7.907 1.00 73.54 H new ATOM 0 HB THR A 86 -3.220 5.591 -7.698 1.00 43.41 H new ATOM 0 HG1 THR A 86 -3.851 7.642 -7.815 1.00 34.40 H new ATOM 0 HG21 THR A 86 -4.469 5.848 -5.585 1.00 65.31 H new ATOM 0 HG22 THR A 86 -3.135 4.680 -5.427 1.00 65.31 H new ATOM 0 HG23 THR A 86 -2.965 6.321 -4.760 1.00 65.31 H new ATOM 1482 N ASP A 87 -0.815 8.261 -5.991 1.00 62.34 N ATOM 1483 CA ASP A 87 -0.283 9.245 -5.037 1.00 63.30 C ATOM 1484 C ASP A 87 -1.404 10.110 -4.420 1.00 24.32 C ATOM 1485 O ASP A 87 -1.131 11.049 -3.664 1.00 42.13 O ATOM 1486 CB ASP A 87 0.728 10.144 -5.759 1.00 53.23 C ATOM 1487 CG ASP A 87 0.092 10.901 -6.917 1.00 63.33 C ATOM 1488 OD1 ASP A 87 -0.195 10.273 -7.962 1.00 73.01 O ATOM 1489 OD2 ASP A 87 -0.134 12.120 -6.789 1.00 61.12 O ATOM 0 H ASP A 87 -1.305 8.677 -6.782 1.00 62.34 H new ATOM 0 HA ASP A 87 0.201 8.706 -4.223 1.00 63.30 H new ATOM 0 HB2 ASP A 87 1.152 10.855 -5.050 1.00 53.23 H new ATOM 0 HB3 ASP A 87 1.552 9.536 -6.132 1.00 53.23 H new ATOM 1494 N ASP A 88 -2.658 9.784 -4.739 1.00 52.40 N ATOM 1495 CA ASP A 88 -3.807 10.612 -4.339 1.00 22.22 C ATOM 1496 C ASP A 88 -4.052 10.615 -2.816 1.00 24.11 C ATOM 1497 O ASP A 88 -4.189 9.559 -2.181 1.00 30.14 O ATOM 1498 CB ASP A 88 -5.073 10.145 -5.062 1.00 4.25 C ATOM 1499 CG ASP A 88 -4.954 10.231 -6.574 1.00 52.13 C ATOM 1500 OD1 ASP A 88 -4.394 11.228 -7.077 1.00 42.35 O ATOM 1501 OD2 ASP A 88 -5.439 9.311 -7.267 1.00 21.34 O ATOM 0 H ASP A 88 -2.908 8.952 -5.274 1.00 52.40 H new ATOM 0 HA ASP A 88 -3.565 11.635 -4.626 1.00 22.22 H new ATOM 0 HB2 ASP A 88 -5.289 9.115 -4.777 1.00 4.25 H new ATOM 0 HB3 ASP A 88 -5.918 10.751 -4.734 1.00 4.25 H new ATOM 1506 N LYS A 89 -4.152 11.819 -2.251 1.00 33.51 N ATOM 1507 CA LYS A 89 -4.391 11.996 -0.817 1.00 2.30 C ATOM 1508 C LYS A 89 -5.735 11.397 -0.376 1.00 62.44 C ATOM 1509 O LYS A 89 -5.838 10.839 0.716 1.00 64.33 O ATOM 1510 CB LYS A 89 -4.334 13.484 -0.439 1.00 64.32 C ATOM 1511 CG LYS A 89 -2.950 14.113 -0.600 1.00 3.13 C ATOM 1512 CD LYS A 89 -2.777 15.348 0.289 1.00 45.45 C ATOM 1513 CE LYS A 89 -3.845 16.403 0.028 1.00 31.34 C ATOM 1514 NZ LYS A 89 -3.699 17.571 0.936 1.00 12.42 N ATOM 0 H LYS A 89 -4.070 12.694 -2.770 1.00 33.51 H new ATOM 0 HA LYS A 89 -3.600 11.459 -0.294 1.00 2.30 H new ATOM 0 HB2 LYS A 89 -5.045 14.033 -1.056 1.00 64.32 H new ATOM 0 HB3 LYS A 89 -4.656 13.598 0.596 1.00 64.32 H new ATOM 0 HG2 LYS A 89 -2.186 13.377 -0.351 1.00 3.13 H new ATOM 0 HG3 LYS A 89 -2.797 14.392 -1.643 1.00 3.13 H new ATOM 0 HD2 LYS A 89 -2.815 15.047 1.336 1.00 45.45 H new ATOM 0 HD3 LYS A 89 -1.792 15.781 0.117 1.00 45.45 H new ATOM 0 HE2 LYS A 89 -3.781 16.737 -1.008 1.00 31.34 H new ATOM 0 HE3 LYS A 89 -4.833 15.961 0.160 1.00 31.34 H new ATOM 0 HZ1 LYS A 89 -4.628 18.014 1.084 1.00 12.42 H new ATOM 0 HZ2 LYS A 89 -3.317 17.255 1.850 1.00 12.42 H new ATOM 0 HZ3 LYS A 89 -3.050 18.263 0.510 1.00 12.42 H new ATOM 1528 N GLU A 90 -6.764 11.518 -1.220 1.00 61.54 N ATOM 1529 CA GLU A 90 -8.078 10.934 -0.913 1.00 14.50 C ATOM 1530 C GLU A 90 -7.957 9.436 -0.599 1.00 63.55 C ATOM 1531 O GLU A 90 -8.451 8.964 0.424 1.00 21.41 O ATOM 1532 CB GLU A 90 -9.066 11.140 -2.071 1.00 43.11 C ATOM 1533 CG GLU A 90 -9.414 12.599 -2.353 1.00 53.45 C ATOM 1534 CD GLU A 90 -10.646 12.746 -3.236 1.00 50.20 C ATOM 1535 OE1 GLU A 90 -11.771 12.744 -2.692 1.00 13.13 O ATOM 1536 OE2 GLU A 90 -10.500 12.868 -4.469 1.00 51.41 O ATOM 0 H GLU A 90 -6.717 12.009 -2.113 1.00 61.54 H new ATOM 0 HA GLU A 90 -8.460 11.450 -0.032 1.00 14.50 H new ATOM 0 HB2 GLU A 90 -8.645 10.699 -2.974 1.00 43.11 H new ATOM 0 HB3 GLU A 90 -9.985 10.597 -1.849 1.00 43.11 H new ATOM 0 HG2 GLU A 90 -9.584 13.117 -1.409 1.00 53.45 H new ATOM 0 HG3 GLU A 90 -8.566 13.085 -2.835 1.00 53.45 H new ATOM 1543 N TRP A 91 -7.274 8.704 -1.477 1.00 43.14 N ATOM 1544 CA TRP A 91 -7.051 7.266 -1.288 1.00 63.14 C ATOM 1545 C TRP A 91 -6.347 6.986 0.048 1.00 33.44 C ATOM 1546 O TRP A 91 -6.750 6.096 0.801 1.00 32.10 O ATOM 1547 CB TRP A 91 -6.223 6.707 -2.456 1.00 62.44 C ATOM 1548 CG TRP A 91 -6.938 6.754 -3.780 1.00 52.24 C ATOM 1549 CD1 TRP A 91 -7.471 7.855 -4.389 1.00 44.32 C ATOM 1550 CD2 TRP A 91 -7.184 5.653 -4.665 1.00 2.01 C ATOM 1551 NE1 TRP A 91 -8.038 7.503 -5.589 1.00 61.11 N ATOM 1552 CE2 TRP A 91 -7.874 6.158 -5.782 1.00 3.21 C ATOM 1553 CE3 TRP A 91 -6.887 4.291 -4.619 1.00 53.11 C ATOM 1554 CZ2 TRP A 91 -8.274 5.349 -6.842 1.00 31.15 C ATOM 1555 CZ3 TRP A 91 -7.283 3.487 -5.671 1.00 54.33 C ATOM 1556 CH2 TRP A 91 -7.969 4.018 -6.770 1.00 61.42 C ATOM 0 H TRP A 91 -6.863 9.082 -2.330 1.00 43.14 H new ATOM 0 HA TRP A 91 -8.020 6.768 -1.266 1.00 63.14 H new ATOM 0 HB2 TRP A 91 -5.294 7.272 -2.534 1.00 62.44 H new ATOM 0 HB3 TRP A 91 -5.951 5.675 -2.236 1.00 62.44 H new ATOM 0 HD1 TRP A 91 -7.449 8.856 -3.985 1.00 44.32 H new ATOM 0 HE1 TRP A 91 -8.506 8.141 -6.233 1.00 61.11 H new ATOM 0 HE3 TRP A 91 -6.357 3.872 -3.776 1.00 53.11 H new ATOM 0 HZ2 TRP A 91 -8.805 5.757 -7.689 1.00 31.15 H new ATOM 0 HZ3 TRP A 91 -7.059 2.431 -5.645 1.00 54.33 H new ATOM 0 HH2 TRP A 91 -8.263 3.363 -7.577 1.00 61.42 H new ATOM 1567 N ILE A 92 -5.303 7.759 0.340 1.00 40.21 N ATOM 1568 CA ILE A 92 -4.596 7.644 1.621 1.00 43.11 C ATOM 1569 C ILE A 92 -5.553 7.857 2.809 1.00 45.01 C ATOM 1570 O ILE A 92 -5.537 7.102 3.783 1.00 53.41 O ATOM 1571 CB ILE A 92 -3.434 8.668 1.714 1.00 21.20 C ATOM 1572 CG1 ILE A 92 -2.470 8.499 0.526 1.00 44.32 C ATOM 1573 CG2 ILE A 92 -2.688 8.518 3.041 1.00 65.34 C ATOM 1574 CD1 ILE A 92 -1.330 9.497 0.510 1.00 62.05 C ATOM 0 H ILE A 92 -4.927 8.470 -0.287 1.00 40.21 H new ATOM 0 HA ILE A 92 -4.188 6.634 1.669 1.00 43.11 H new ATOM 0 HB ILE A 92 -3.856 9.672 1.673 1.00 21.20 H new ATOM 0 HG12 ILE A 92 -2.056 7.491 0.548 1.00 44.32 H new ATOM 0 HG13 ILE A 92 -3.034 8.592 -0.402 1.00 44.32 H new ATOM 0 HG21 ILE A 92 -1.877 9.245 3.087 1.00 65.34 H new ATOM 0 HG22 ILE A 92 -3.377 8.691 3.867 1.00 65.34 H new ATOM 0 HG23 ILE A 92 -2.277 7.511 3.116 1.00 65.34 H new ATOM 0 HD11 ILE A 92 -0.696 9.312 -0.357 1.00 62.05 H new ATOM 0 HD12 ILE A 92 -1.733 10.508 0.456 1.00 62.05 H new ATOM 0 HD13 ILE A 92 -0.740 9.390 1.420 1.00 62.05 H new ATOM 1586 N LYS A 93 -6.397 8.883 2.705 1.00 63.42 N ATOM 1587 CA LYS A 93 -7.351 9.239 3.766 1.00 12.12 C ATOM 1588 C LYS A 93 -8.410 8.141 3.986 1.00 75.31 C ATOM 1589 O LYS A 93 -8.574 7.637 5.100 1.00 43.35 O ATOM 1590 CB LYS A 93 -8.019 10.587 3.420 1.00 75.25 C ATOM 1591 CG LYS A 93 -9.128 11.035 4.383 1.00 44.11 C ATOM 1592 CD LYS A 93 -10.523 10.640 3.889 1.00 75.22 C ATOM 1593 CE LYS A 93 -10.838 11.268 2.535 1.00 63.43 C ATOM 1594 NZ LYS A 93 -12.209 10.934 2.066 1.00 4.20 N ATOM 0 H LYS A 93 -6.442 9.492 1.888 1.00 63.42 H new ATOM 0 HA LYS A 93 -6.801 9.334 4.703 1.00 12.12 H new ATOM 0 HB2 LYS A 93 -7.250 11.359 3.393 1.00 75.25 H new ATOM 0 HB3 LYS A 93 -8.438 10.519 2.416 1.00 75.25 H new ATOM 0 HG2 LYS A 93 -8.954 10.593 5.364 1.00 44.11 H new ATOM 0 HG3 LYS A 93 -9.082 12.117 4.508 1.00 44.11 H new ATOM 0 HD2 LYS A 93 -10.588 9.555 3.811 1.00 75.22 H new ATOM 0 HD3 LYS A 93 -11.270 10.953 4.618 1.00 75.22 H new ATOM 0 HE2 LYS A 93 -10.734 12.351 2.606 1.00 63.43 H new ATOM 0 HE3 LYS A 93 -10.111 10.925 1.799 1.00 63.43 H new ATOM 0 HZ1 LYS A 93 -12.221 10.896 1.027 1.00 4.20 H new ATOM 0 HZ2 LYS A 93 -12.492 10.010 2.450 1.00 4.20 H new ATOM 0 HZ3 LYS A 93 -12.875 11.663 2.393 1.00 4.20 H new ATOM 1608 N ASP A 94 -9.121 7.770 2.921 1.00 53.11 N ATOM 1609 CA ASP A 94 -10.199 6.779 3.018 1.00 43.13 C ATOM 1610 C ASP A 94 -9.691 5.416 3.517 1.00 24.04 C ATOM 1611 O ASP A 94 -10.421 4.684 4.190 1.00 51.43 O ATOM 1612 CB ASP A 94 -10.908 6.630 1.670 1.00 64.15 C ATOM 1613 CG ASP A 94 -11.712 7.869 1.316 1.00 72.43 C ATOM 1614 OD1 ASP A 94 -12.727 8.135 1.994 1.00 61.44 O ATOM 1615 OD2 ASP A 94 -11.340 8.592 0.371 1.00 42.50 O ATOM 0 H ASP A 94 -8.972 8.139 1.982 1.00 53.11 H new ATOM 0 HA ASP A 94 -10.913 7.145 3.756 1.00 43.13 H new ATOM 0 HB2 ASP A 94 -10.170 6.440 0.890 1.00 64.15 H new ATOM 0 HB3 ASP A 94 -11.569 5.764 1.701 1.00 64.15 H new ATOM 1620 N PHE A 95 -8.440 5.082 3.198 1.00 12.14 N ATOM 1621 CA PHE A 95 -7.819 3.861 3.723 1.00 23.42 C ATOM 1622 C PHE A 95 -7.791 3.891 5.260 1.00 24.03 C ATOM 1623 O PHE A 95 -8.168 2.924 5.926 1.00 44.22 O ATOM 1624 CB PHE A 95 -6.393 3.702 3.169 1.00 64.33 C ATOM 1625 CG PHE A 95 -5.758 2.371 3.502 1.00 2.00 C ATOM 1626 CD1 PHE A 95 -5.071 2.184 4.697 1.00 33.43 C ATOM 1627 CD2 PHE A 95 -5.851 1.305 2.618 1.00 34.45 C ATOM 1628 CE1 PHE A 95 -4.497 0.965 4.999 1.00 33.45 C ATOM 1629 CE2 PHE A 95 -5.276 0.084 2.917 1.00 73.11 C ATOM 1630 CZ PHE A 95 -4.599 -0.086 4.109 1.00 40.03 C ATOM 0 H PHE A 95 -7.840 5.633 2.584 1.00 12.14 H new ATOM 0 HA PHE A 95 -8.415 3.007 3.402 1.00 23.42 H new ATOM 0 HB2 PHE A 95 -6.418 3.822 2.086 1.00 64.33 H new ATOM 0 HB3 PHE A 95 -5.767 4.502 3.564 1.00 64.33 H new ATOM 0 HD1 PHE A 95 -4.986 3.002 5.397 1.00 33.43 H new ATOM 0 HD2 PHE A 95 -6.379 1.431 1.685 1.00 34.45 H new ATOM 0 HE1 PHE A 95 -3.968 0.833 5.931 1.00 33.45 H new ATOM 0 HE2 PHE A 95 -5.356 -0.736 2.219 1.00 73.11 H new ATOM 0 HZ PHE A 95 -4.150 -1.040 4.345 1.00 40.03 H new ATOM 1640 N ILE A 96 -7.352 5.020 5.807 1.00 2.04 N ATOM 1641 CA ILE A 96 -7.300 5.222 7.256 1.00 14.00 C ATOM 1642 C ILE A 96 -8.712 5.197 7.869 1.00 43.34 C ATOM 1643 O ILE A 96 -8.925 4.652 8.953 1.00 55.12 O ATOM 1644 CB ILE A 96 -6.610 6.569 7.598 1.00 44.44 C ATOM 1645 CG1 ILE A 96 -5.202 6.616 6.979 1.00 23.21 C ATOM 1646 CG2 ILE A 96 -6.541 6.780 9.110 1.00 24.03 C ATOM 1647 CD1 ILE A 96 -4.489 7.938 7.174 1.00 22.25 C ATOM 0 H ILE A 96 -7.023 5.819 5.264 1.00 2.04 H new ATOM 0 HA ILE A 96 -6.718 4.404 7.681 1.00 14.00 H new ATOM 0 HB ILE A 96 -7.206 7.377 7.174 1.00 44.44 H new ATOM 0 HG12 ILE A 96 -4.597 5.821 7.415 1.00 23.21 H new ATOM 0 HG13 ILE A 96 -5.278 6.410 5.911 1.00 23.21 H new ATOM 0 HG21 ILE A 96 -6.053 7.731 9.323 1.00 24.03 H new ATOM 0 HG22 ILE A 96 -7.550 6.790 9.522 1.00 24.03 H new ATOM 0 HG23 ILE A 96 -5.971 5.970 9.565 1.00 24.03 H new ATOM 0 HD11 ILE A 96 -3.504 7.892 6.710 1.00 22.25 H new ATOM 0 HD12 ILE A 96 -5.070 8.736 6.713 1.00 22.25 H new ATOM 0 HD13 ILE A 96 -4.379 8.138 8.240 1.00 22.25 H new ATOM 1659 N GLU A 97 -9.674 5.783 7.158 1.00 13.25 N ATOM 1660 CA GLU A 97 -11.072 5.808 7.603 1.00 4.32 C ATOM 1661 C GLU A 97 -11.656 4.394 7.753 1.00 40.32 C ATOM 1662 O GLU A 97 -12.104 4.020 8.840 1.00 63.11 O ATOM 1663 CB GLU A 97 -11.911 6.634 6.622 1.00 3.31 C ATOM 1664 CG GLU A 97 -11.527 8.110 6.601 1.00 11.42 C ATOM 1665 CD GLU A 97 -11.941 8.846 7.871 1.00 43.13 C ATOM 1666 OE1 GLU A 97 -11.315 8.620 8.933 1.00 13.42 O ATOM 1667 OE2 GLU A 97 -12.907 9.635 7.813 1.00 40.53 O ATOM 0 H GLU A 97 -9.512 6.250 6.266 1.00 13.25 H new ATOM 0 HA GLU A 97 -11.102 6.272 8.589 1.00 4.32 H new ATOM 0 HB2 GLU A 97 -11.798 6.221 5.620 1.00 3.31 H new ATOM 0 HB3 GLU A 97 -12.964 6.543 6.888 1.00 3.31 H new ATOM 0 HG2 GLU A 97 -10.448 8.198 6.470 1.00 11.42 H new ATOM 0 HG3 GLU A 97 -11.993 8.590 5.740 1.00 11.42 H new ATOM 1674 N GLU A 98 -11.641 3.611 6.671 1.00 20.31 N ATOM 1675 CA GLU A 98 -12.119 2.219 6.719 1.00 62.52 C ATOM 1676 C GLU A 98 -11.423 1.427 7.837 1.00 73.13 C ATOM 1677 O GLU A 98 -12.056 0.654 8.552 1.00 30.21 O ATOM 1678 CB GLU A 98 -11.897 1.517 5.364 1.00 32.14 C ATOM 1679 CG GLU A 98 -13.000 1.768 4.333 1.00 55.03 C ATOM 1680 CD GLU A 98 -14.327 1.111 4.701 1.00 50.51 C ATOM 1681 OE1 GLU A 98 -14.311 0.043 5.353 1.00 62.44 O ATOM 1682 OE2 GLU A 98 -15.393 1.646 4.318 1.00 42.22 O ATOM 0 H GLU A 98 -11.306 3.911 5.755 1.00 20.31 H new ATOM 0 HA GLU A 98 -13.188 2.248 6.932 1.00 62.52 H new ATOM 0 HB2 GLU A 98 -10.946 1.849 4.948 1.00 32.14 H new ATOM 0 HB3 GLU A 98 -11.813 0.444 5.534 1.00 32.14 H new ATOM 0 HG2 GLU A 98 -13.151 2.842 4.226 1.00 55.03 H new ATOM 0 HG3 GLU A 98 -12.673 1.394 3.363 1.00 55.03 H new ATOM 1689 N ALA A 99 -10.119 1.638 7.989 1.00 71.13 N ATOM 1690 CA ALA A 99 -9.343 0.955 9.029 1.00 20.05 C ATOM 1691 C ALA A 99 -9.814 1.333 10.449 1.00 42.40 C ATOM 1692 O ALA A 99 -10.079 0.459 11.281 1.00 33.14 O ATOM 1693 CB ALA A 99 -7.865 1.261 8.858 1.00 72.22 C ATOM 0 H ALA A 99 -9.574 2.275 7.408 1.00 71.13 H new ATOM 0 HA ALA A 99 -9.506 -0.117 8.913 1.00 20.05 H new ATOM 0 HB1 ALA A 99 -7.295 0.750 9.634 1.00 72.22 H new ATOM 0 HB2 ALA A 99 -7.533 0.917 7.878 1.00 72.22 H new ATOM 0 HB3 ALA A 99 -7.704 2.336 8.938 1.00 72.22 H new ATOM 1699 N LYS A 100 -9.927 2.634 10.727 1.00 13.33 N ATOM 1700 CA LYS A 100 -10.406 3.098 12.036 1.00 33.10 C ATOM 1701 C LYS A 100 -11.842 2.617 12.300 1.00 54.13 C ATOM 1702 O LYS A 100 -12.211 2.321 13.438 1.00 60.53 O ATOM 1703 CB LYS A 100 -10.325 4.629 12.140 1.00 1.23 C ATOM 1704 CG LYS A 100 -8.894 5.170 12.108 1.00 31.22 C ATOM 1705 CD LYS A 100 -8.794 6.640 12.541 1.00 54.23 C ATOM 1706 CE LYS A 100 -9.338 7.620 11.500 1.00 54.33 C ATOM 1707 NZ LYS A 100 -10.818 7.541 11.352 1.00 22.43 N ATOM 0 H LYS A 100 -9.696 3.381 10.071 1.00 13.33 H new ATOM 0 HA LYS A 100 -9.756 2.668 12.798 1.00 33.10 H new ATOM 0 HB2 LYS A 100 -10.890 5.071 11.319 1.00 1.23 H new ATOM 0 HB3 LYS A 100 -10.805 4.948 13.065 1.00 1.23 H new ATOM 0 HG2 LYS A 100 -8.268 4.562 12.761 1.00 31.22 H new ATOM 0 HG3 LYS A 100 -8.496 5.067 11.099 1.00 31.22 H new ATOM 0 HD2 LYS A 100 -9.340 6.774 13.475 1.00 54.23 H new ATOM 0 HD3 LYS A 100 -7.751 6.881 12.745 1.00 54.23 H new ATOM 0 HE2 LYS A 100 -9.059 8.635 11.783 1.00 54.33 H new ATOM 0 HE3 LYS A 100 -8.870 7.417 10.537 1.00 54.33 H new ATOM 0 HZ1 LYS A 100 -11.178 8.442 10.977 1.00 22.43 H new ATOM 0 HZ2 LYS A 100 -11.061 6.771 10.696 1.00 22.43 H new ATOM 0 HZ3 LYS A 100 -11.250 7.354 12.279 1.00 22.43 H new ATOM 1721 N GLU A 101 -12.634 2.521 11.236 1.00 74.31 N ATOM 1722 CA GLU A 101 -13.995 1.976 11.316 1.00 11.03 C ATOM 1723 C GLU A 101 -13.980 0.519 11.823 1.00 34.41 C ATOM 1724 O GLU A 101 -14.942 0.047 12.430 1.00 33.44 O ATOM 1725 CB GLU A 101 -14.658 2.050 9.931 1.00 4.32 C ATOM 1726 CG GLU A 101 -16.095 1.537 9.885 1.00 61.53 C ATOM 1727 CD GLU A 101 -17.063 2.395 10.688 1.00 70.25 C ATOM 1728 OE1 GLU A 101 -17.387 3.512 10.237 1.00 3.42 O ATOM 1729 OE2 GLU A 101 -17.516 1.953 11.767 1.00 34.14 O ATOM 0 H GLU A 101 -12.358 2.815 10.299 1.00 74.31 H new ATOM 0 HA GLU A 101 -14.568 2.571 12.027 1.00 11.03 H new ATOM 0 HB2 GLU A 101 -14.645 3.086 9.592 1.00 4.32 H new ATOM 0 HB3 GLU A 101 -14.058 1.476 9.225 1.00 4.32 H new ATOM 0 HG2 GLU A 101 -16.428 1.499 8.848 1.00 61.53 H new ATOM 0 HG3 GLU A 101 -16.122 0.516 10.266 1.00 61.53 H new ATOM 1736 N ARG A 102 -12.878 -0.191 11.571 1.00 34.23 N ATOM 1737 CA ARG A 102 -12.733 -1.586 12.018 1.00 13.14 C ATOM 1738 C ARG A 102 -11.961 -1.678 13.346 1.00 3.25 C ATOM 1739 O ARG A 102 -11.768 -2.769 13.892 1.00 11.14 O ATOM 1740 CB ARG A 102 -12.015 -2.411 10.940 1.00 53.54 C ATOM 1741 CG ARG A 102 -12.546 -2.163 9.532 1.00 12.43 C ATOM 1742 CD ARG A 102 -14.050 -2.393 9.429 1.00 43.22 C ATOM 1743 NE ARG A 102 -14.608 -1.813 8.206 1.00 43.43 N ATOM 1744 CZ ARG A 102 -15.884 -1.761 7.926 1.00 53.11 C ATOM 1745 NH1 ARG A 102 -16.768 -2.254 8.738 1.00 60.02 N ATOM 1746 NH2 ARG A 102 -16.273 -1.195 6.834 1.00 12.02 N ATOM 0 H ARG A 102 -12.073 0.172 11.061 1.00 34.23 H new ATOM 0 HA ARG A 102 -13.733 -1.989 12.182 1.00 13.14 H new ATOM 0 HB2 ARG A 102 -10.950 -2.179 10.965 1.00 53.54 H new ATOM 0 HB3 ARG A 102 -12.116 -3.470 11.177 1.00 53.54 H new ATOM 0 HG2 ARG A 102 -12.317 -1.140 9.235 1.00 12.43 H new ATOM 0 HG3 ARG A 102 -12.032 -2.821 8.832 1.00 12.43 H new ATOM 0 HD2 ARG A 102 -14.256 -3.463 9.450 1.00 43.22 H new ATOM 0 HD3 ARG A 102 -14.544 -1.956 10.297 1.00 43.22 H new ATOM 0 HE ARG A 102 -13.956 -1.423 7.525 1.00 43.43 H new ATOM 0 HH11 ARG A 102 -16.471 -2.691 9.611 1.00 60.02 H new ATOM 0 HH12 ARG A 102 -17.759 -2.205 8.504 1.00 60.02 H new ATOM 0 HH21 ARG A 102 -15.587 -0.792 6.196 1.00 12.02 H new ATOM 0 HH22 ARG A 102 -17.267 -1.151 6.609 1.00 12.02 H new ATOM 1760 N GLY A 103 -11.521 -0.530 13.854 1.00 60.01 N ATOM 1761 CA GLY A 103 -10.794 -0.480 15.120 1.00 74.54 C ATOM 1762 C GLY A 103 -9.360 -0.998 15.029 1.00 22.14 C ATOM 1763 O GLY A 103 -8.779 -1.420 16.032 1.00 74.24 O ATOM 0 H GLY A 103 -11.655 0.378 13.409 1.00 60.01 H new ATOM 0 HA2 GLY A 103 -10.776 0.550 15.478 1.00 74.54 H new ATOM 0 HA3 GLY A 103 -11.336 -1.066 15.863 1.00 74.54 H new ATOM 1767 N VAL A 104 -8.781 -0.952 13.833 1.00 3.41 N ATOM 1768 CA VAL A 104 -7.413 -1.442 13.609 1.00 3.12 C ATOM 1769 C VAL A 104 -6.417 -0.288 13.395 1.00 31.32 C ATOM 1770 O VAL A 104 -6.809 0.841 13.097 1.00 12.53 O ATOM 1771 CB VAL A 104 -7.364 -2.411 12.400 1.00 13.50 C ATOM 1772 CG1 VAL A 104 -8.121 -3.696 12.725 1.00 72.52 C ATOM 1773 CG2 VAL A 104 -7.937 -1.752 11.147 1.00 63.40 C ATOM 0 H VAL A 104 -9.234 -0.580 12.998 1.00 3.41 H new ATOM 0 HA VAL A 104 -7.117 -1.980 14.510 1.00 3.12 H new ATOM 0 HB VAL A 104 -6.321 -2.659 12.201 1.00 13.50 H new ATOM 0 HG11 VAL A 104 -8.080 -4.369 11.869 1.00 72.52 H new ATOM 0 HG12 VAL A 104 -7.664 -4.179 13.588 1.00 72.52 H new ATOM 0 HG13 VAL A 104 -9.161 -3.459 12.950 1.00 72.52 H new ATOM 0 HG21 VAL A 104 -7.891 -2.453 10.314 1.00 63.40 H new ATOM 0 HG22 VAL A 104 -8.974 -1.470 11.326 1.00 63.40 H new ATOM 0 HG23 VAL A 104 -7.355 -0.862 10.905 1.00 63.40 H new ATOM 1783 N GLU A 105 -5.128 -0.582 13.563 1.00 23.40 N ATOM 1784 CA GLU A 105 -4.072 0.428 13.419 1.00 13.51 C ATOM 1785 C GLU A 105 -3.577 0.526 11.966 1.00 11.43 C ATOM 1786 O GLU A 105 -3.584 -0.458 11.224 1.00 71.21 O ATOM 1787 CB GLU A 105 -2.897 0.092 14.345 1.00 20.34 C ATOM 1788 CG GLU A 105 -3.272 0.000 15.820 1.00 45.25 C ATOM 1789 CD GLU A 105 -2.110 -0.450 16.693 1.00 65.42 C ATOM 1790 OE1 GLU A 105 -1.233 0.385 17.001 1.00 15.50 O ATOM 1791 OE2 GLU A 105 -2.076 -1.640 17.087 1.00 52.33 O ATOM 0 H GLU A 105 -4.786 -1.513 13.800 1.00 23.40 H new ATOM 0 HA GLU A 105 -4.494 1.394 13.697 1.00 13.51 H new ATOM 0 HB2 GLU A 105 -2.462 -0.857 14.032 1.00 20.34 H new ATOM 0 HB3 GLU A 105 -2.125 0.852 14.224 1.00 20.34 H new ATOM 0 HG2 GLU A 105 -3.623 0.973 16.163 1.00 45.25 H new ATOM 0 HG3 GLU A 105 -4.101 -0.698 15.937 1.00 45.25 H new ATOM 1798 N VAL A 106 -3.127 1.715 11.573 1.00 35.33 N ATOM 1799 CA VAL A 106 -2.678 1.963 10.198 1.00 22.44 C ATOM 1800 C VAL A 106 -1.218 2.438 10.161 1.00 45.12 C ATOM 1801 O VAL A 106 -0.724 3.047 11.110 1.00 0.13 O ATOM 1802 CB VAL A 106 -3.563 3.029 9.502 1.00 24.13 C ATOM 1803 CG1 VAL A 106 -3.250 3.117 8.008 1.00 11.21 C ATOM 1804 CG2 VAL A 106 -5.041 2.743 9.733 1.00 2.25 C ATOM 0 H VAL A 106 -3.062 2.527 12.187 1.00 35.33 H new ATOM 0 HA VAL A 106 -2.763 1.015 9.667 1.00 22.44 H new ATOM 0 HB VAL A 106 -3.332 3.997 9.948 1.00 24.13 H new ATOM 0 HG11 VAL A 106 -3.886 3.873 7.547 1.00 11.21 H new ATOM 0 HG12 VAL A 106 -2.204 3.390 7.871 1.00 11.21 H new ATOM 0 HG13 VAL A 106 -3.437 2.151 7.540 1.00 11.21 H new ATOM 0 HG21 VAL A 106 -5.641 3.505 9.235 1.00 2.25 H new ATOM 0 HG22 VAL A 106 -5.290 1.762 9.327 1.00 2.25 H new ATOM 0 HG23 VAL A 106 -5.252 2.757 10.802 1.00 2.25 H new ATOM 1814 N PHE A 107 -0.529 2.139 9.067 1.00 51.52 N ATOM 1815 CA PHE A 107 0.828 2.640 8.841 1.00 64.54 C ATOM 1816 C PHE A 107 1.045 2.924 7.341 1.00 63.33 C ATOM 1817 O PHE A 107 1.225 2.008 6.540 1.00 42.45 O ATOM 1818 CB PHE A 107 1.849 1.625 9.391 1.00 75.13 C ATOM 1819 CG PHE A 107 3.303 2.040 9.312 1.00 4.43 C ATOM 1820 CD1 PHE A 107 3.683 3.280 8.817 1.00 1.32 C ATOM 1821 CD2 PHE A 107 4.297 1.164 9.729 1.00 32.45 C ATOM 1822 CE1 PHE A 107 5.011 3.632 8.741 1.00 52.34 C ATOM 1823 CE2 PHE A 107 5.630 1.516 9.650 1.00 71.21 C ATOM 1824 CZ PHE A 107 5.987 2.751 9.152 1.00 73.41 C ATOM 0 H PHE A 107 -0.887 1.549 8.316 1.00 51.52 H new ATOM 0 HA PHE A 107 0.970 3.581 9.373 1.00 64.54 H new ATOM 0 HB2 PHE A 107 1.605 1.423 10.434 1.00 75.13 H new ATOM 0 HB3 PHE A 107 1.729 0.688 8.848 1.00 75.13 H new ATOM 0 HD1 PHE A 107 2.927 3.977 8.487 1.00 1.32 H new ATOM 0 HD2 PHE A 107 4.024 0.195 10.120 1.00 32.45 H new ATOM 0 HE1 PHE A 107 5.289 4.603 8.358 1.00 52.34 H new ATOM 0 HE2 PHE A 107 6.392 0.825 9.978 1.00 71.21 H new ATOM 0 HZ PHE A 107 7.029 3.027 9.084 1.00 73.41 H new ATOM 1834 N VAL A 108 1.012 4.208 6.980 1.00 32.25 N ATOM 1835 CA VAL A 108 1.118 4.644 5.581 1.00 71.21 C ATOM 1836 C VAL A 108 2.531 5.149 5.239 1.00 11.11 C ATOM 1837 O VAL A 108 3.082 6.011 5.928 1.00 24.34 O ATOM 1838 CB VAL A 108 0.108 5.783 5.271 1.00 55.10 C ATOM 1839 CG1 VAL A 108 0.141 6.154 3.786 1.00 33.42 C ATOM 1840 CG2 VAL A 108 -1.307 5.401 5.705 1.00 32.21 C ATOM 0 H VAL A 108 0.911 4.975 7.645 1.00 32.25 H new ATOM 0 HA VAL A 108 0.894 3.768 4.973 1.00 71.21 H new ATOM 0 HB VAL A 108 0.408 6.659 5.846 1.00 55.10 H new ATOM 0 HG11 VAL A 108 -0.575 6.953 3.595 1.00 33.42 H new ATOM 0 HG12 VAL A 108 1.142 6.491 3.517 1.00 33.42 H new ATOM 0 HG13 VAL A 108 -0.121 5.282 3.187 1.00 33.42 H new ATOM 0 HG21 VAL A 108 -1.991 6.218 5.475 1.00 32.21 H new ATOM 0 HG22 VAL A 108 -1.621 4.504 5.172 1.00 32.21 H new ATOM 0 HG23 VAL A 108 -1.319 5.209 6.778 1.00 32.21 H new ATOM 1850 N VAL A 109 3.112 4.603 4.172 1.00 33.22 N ATOM 1851 CA VAL A 109 4.385 5.102 3.634 1.00 12.10 C ATOM 1852 C VAL A 109 4.252 5.421 2.135 1.00 70.05 C ATOM 1853 O VAL A 109 3.834 4.574 1.346 1.00 61.34 O ATOM 1854 CB VAL A 109 5.538 4.082 3.841 1.00 54.43 C ATOM 1855 CG1 VAL A 109 6.864 4.644 3.325 1.00 52.32 C ATOM 1856 CG2 VAL A 109 5.652 3.686 5.311 1.00 61.44 C ATOM 0 H VAL A 109 2.723 3.812 3.659 1.00 33.22 H new ATOM 0 HA VAL A 109 4.628 6.012 4.182 1.00 12.10 H new ATOM 0 HB VAL A 109 5.305 3.187 3.265 1.00 54.43 H new ATOM 0 HG11 VAL A 109 7.655 3.911 3.481 1.00 52.32 H new ATOM 0 HG12 VAL A 109 6.777 4.863 2.261 1.00 52.32 H new ATOM 0 HG13 VAL A 109 7.106 5.560 3.865 1.00 52.32 H new ATOM 0 HG21 VAL A 109 6.466 2.971 5.433 1.00 61.44 H new ATOM 0 HG22 VAL A 109 5.855 4.573 5.912 1.00 61.44 H new ATOM 0 HG23 VAL A 109 4.717 3.231 5.639 1.00 61.44 H new ATOM 1866 N TYR A 110 4.603 6.645 1.741 1.00 2.42 N ATOM 1867 CA TYR A 110 4.507 7.055 0.332 1.00 62.31 C ATOM 1868 C TYR A 110 5.755 7.813 -0.139 1.00 21.31 C ATOM 1869 O TYR A 110 6.427 8.499 0.642 1.00 13.12 O ATOM 1870 CB TYR A 110 3.239 7.892 0.086 1.00 13.13 C ATOM 1871 CG TYR A 110 3.069 9.085 1.015 1.00 52.34 C ATOM 1872 CD1 TYR A 110 3.724 10.294 0.779 1.00 3.31 C ATOM 1873 CD2 TYR A 110 2.237 9.001 2.127 1.00 52.43 C ATOM 1874 CE1 TYR A 110 3.554 11.372 1.624 1.00 2.23 C ATOM 1875 CE2 TYR A 110 2.064 10.077 2.974 1.00 23.12 C ATOM 1876 CZ TYR A 110 2.723 11.258 2.718 1.00 53.21 C ATOM 1877 OH TYR A 110 2.556 12.328 3.563 1.00 14.14 O ATOM 0 H TYR A 110 4.954 7.368 2.369 1.00 2.42 H new ATOM 0 HA TYR A 110 4.441 6.142 -0.259 1.00 62.31 H new ATOM 0 HB2 TYR A 110 3.252 8.250 -0.943 1.00 13.13 H new ATOM 0 HB3 TYR A 110 2.368 7.244 0.187 1.00 13.13 H new ATOM 0 HD1 TYR A 110 4.374 10.388 -0.078 1.00 3.31 H new ATOM 0 HD2 TYR A 110 1.717 8.077 2.331 1.00 52.43 H new ATOM 0 HE1 TYR A 110 4.070 12.301 1.429 1.00 2.23 H new ATOM 0 HE2 TYR A 110 1.415 9.993 3.833 1.00 23.12 H new ATOM 0 HH TYR A 110 1.938 12.083 4.283 1.00 14.14 H new ATOM 1887 N ASN A 111 6.063 7.672 -1.427 1.00 52.05 N ATOM 1888 CA ASN A 111 7.234 8.319 -2.026 1.00 44.23 C ATOM 1889 C ASN A 111 6.869 9.697 -2.610 1.00 21.31 C ATOM 1890 O ASN A 111 6.169 9.791 -3.620 1.00 53.20 O ATOM 1891 CB ASN A 111 7.824 7.419 -3.122 1.00 14.30 C ATOM 1892 CG ASN A 111 9.125 7.963 -3.682 1.00 54.21 C ATOM 1893 OD1 ASN A 111 9.133 8.750 -4.617 1.00 51.35 O ATOM 1894 ND2 ASN A 111 10.238 7.540 -3.121 1.00 73.32 N ATOM 0 H ASN A 111 5.516 7.112 -2.081 1.00 52.05 H new ATOM 0 HA ASN A 111 7.979 8.471 -1.245 1.00 44.23 H new ATOM 0 HB2 ASN A 111 7.996 6.422 -2.716 1.00 14.30 H new ATOM 0 HB3 ASN A 111 7.100 7.314 -3.930 1.00 14.30 H new ATOM 0 HD21 ASN A 111 11.140 7.869 -3.465 1.00 73.32 H new ATOM 0 HD22 ASN A 111 10.199 6.883 -2.342 1.00 73.32 H new ATOM 1901 N ASN A 112 7.346 10.761 -1.964 1.00 23.01 N ATOM 1902 CA ASN A 112 7.077 12.137 -2.404 1.00 71.32 C ATOM 1903 C ASN A 112 8.359 12.986 -2.290 1.00 71.11 C ATOM 1904 O ASN A 112 9.039 12.969 -1.266 1.00 73.11 O ATOM 1905 CB ASN A 112 5.926 12.731 -1.573 1.00 70.43 C ATOM 1906 CG ASN A 112 5.433 14.074 -2.091 1.00 63.23 C ATOM 1907 OD1 ASN A 112 6.208 14.911 -2.541 1.00 32.34 O ATOM 1908 ND2 ASN A 112 4.130 14.278 -2.058 1.00 60.14 N ATOM 0 H ASN A 112 7.926 10.699 -1.127 1.00 23.01 H new ATOM 0 HA ASN A 112 6.772 12.137 -3.450 1.00 71.32 H new ATOM 0 HB2 ASN A 112 5.094 12.027 -1.564 1.00 70.43 H new ATOM 0 HB3 ASN A 112 6.256 12.848 -0.541 1.00 70.43 H new ATOM 0 HD21 ASN A 112 3.741 15.152 -2.413 1.00 60.14 H new ATOM 0 HD22 ASN A 112 3.511 13.562 -1.677 1.00 60.14 H new ATOM 1915 N LYS A 113 8.674 13.733 -3.348 1.00 61.25 N ATOM 1916 CA LYS A 113 9.979 14.403 -3.472 1.00 35.42 C ATOM 1917 C LYS A 113 10.012 15.806 -2.832 1.00 1.11 C ATOM 1918 O LYS A 113 11.038 16.485 -2.888 1.00 43.00 O ATOM 1919 CB LYS A 113 10.384 14.513 -4.955 1.00 10.04 C ATOM 1920 CG LYS A 113 10.613 13.174 -5.664 1.00 31.41 C ATOM 1921 CD LYS A 113 9.318 12.387 -5.860 1.00 62.40 C ATOM 1922 CE LYS A 113 9.555 11.073 -6.596 1.00 1.42 C ATOM 1923 NZ LYS A 113 9.996 11.287 -8.000 1.00 52.33 N ATOM 0 H LYS A 113 8.046 13.893 -4.135 1.00 61.25 H new ATOM 0 HA LYS A 113 10.690 13.783 -2.926 1.00 35.42 H new ATOM 0 HB2 LYS A 113 9.608 15.062 -5.488 1.00 10.04 H new ATOM 0 HB3 LYS A 113 11.297 15.104 -5.024 1.00 10.04 H new ATOM 0 HG2 LYS A 113 11.075 13.355 -6.635 1.00 31.41 H new ATOM 0 HG3 LYS A 113 11.314 12.575 -5.084 1.00 31.41 H new ATOM 0 HD2 LYS A 113 8.867 12.183 -4.889 1.00 62.40 H new ATOM 0 HD3 LYS A 113 8.606 12.993 -6.420 1.00 62.40 H new ATOM 0 HE2 LYS A 113 10.309 10.492 -6.065 1.00 1.42 H new ATOM 0 HE3 LYS A 113 8.637 10.485 -6.591 1.00 1.42 H new ATOM 0 HZ1 LYS A 113 9.998 10.378 -8.506 1.00 52.33 H new ATOM 0 HZ2 LYS A 113 9.343 11.945 -8.472 1.00 52.33 H new ATOM 0 HZ3 LYS A 113 10.956 11.688 -8.005 1.00 52.33 H new ATOM 1937 N ASP A 114 8.908 16.243 -2.231 1.00 35.50 N ATOM 1938 CA ASP A 114 8.842 17.583 -1.625 1.00 64.02 C ATOM 1939 C ASP A 114 8.508 17.523 -0.124 1.00 24.52 C ATOM 1940 O ASP A 114 7.455 17.014 0.265 1.00 23.33 O ATOM 1941 CB ASP A 114 7.805 18.440 -2.355 1.00 4.11 C ATOM 1942 CG ASP A 114 8.180 18.698 -3.803 1.00 51.21 C ATOM 1943 OD1 ASP A 114 8.950 19.646 -4.061 1.00 52.24 O ATOM 1944 OD2 ASP A 114 7.702 17.960 -4.691 1.00 1.12 O ATOM 0 H ASP A 114 8.050 15.698 -2.147 1.00 35.50 H new ATOM 0 HA ASP A 114 9.829 18.035 -1.726 1.00 64.02 H new ATOM 0 HB2 ASP A 114 6.836 17.943 -2.317 1.00 4.11 H new ATOM 0 HB3 ASP A 114 7.695 19.392 -1.836 1.00 4.11 H new ATOM 1949 N ASP A 115 9.397 18.080 0.703 1.00 44.35 N ATOM 1950 CA ASP A 115 9.222 18.099 2.165 1.00 53.34 C ATOM 1951 C ASP A 115 7.906 18.790 2.559 1.00 13.21 C ATOM 1952 O ASP A 115 7.120 18.248 3.334 1.00 65.21 O ATOM 1953 CB ASP A 115 10.419 18.802 2.824 1.00 21.01 C ATOM 1954 CG ASP A 115 10.271 18.954 4.332 1.00 53.03 C ATOM 1955 OD1 ASP A 115 10.468 17.962 5.063 1.00 10.31 O ATOM 1956 OD2 ASP A 115 9.974 20.078 4.797 1.00 23.14 O ATOM 0 H ASP A 115 10.255 18.529 0.384 1.00 44.35 H new ATOM 0 HA ASP A 115 9.174 17.069 2.519 1.00 53.34 H new ATOM 0 HB2 ASP A 115 11.326 18.237 2.610 1.00 21.01 H new ATOM 0 HB3 ASP A 115 10.544 19.788 2.377 1.00 21.01 H new ATOM 1961 N ASP A 116 7.671 19.980 2.009 1.00 21.34 N ATOM 1962 CA ASP A 116 6.437 20.733 2.269 1.00 12.20 C ATOM 1963 C ASP A 116 5.180 19.878 2.013 1.00 22.41 C ATOM 1964 O ASP A 116 4.323 19.737 2.889 1.00 32.44 O ATOM 1965 CB ASP A 116 6.410 21.990 1.395 1.00 64.14 C ATOM 1966 CG ASP A 116 7.562 22.929 1.705 1.00 30.23 C ATOM 1967 OD1 ASP A 116 8.715 22.614 1.330 1.00 62.44 O ATOM 1968 OD2 ASP A 116 7.325 23.981 2.337 1.00 63.24 O ATOM 0 H ASP A 116 8.320 20.449 1.377 1.00 21.34 H new ATOM 0 HA ASP A 116 6.429 21.017 3.321 1.00 12.20 H new ATOM 0 HB2 ASP A 116 6.452 21.701 0.345 1.00 64.14 H new ATOM 0 HB3 ASP A 116 5.466 22.514 1.544 1.00 64.14 H new ATOM 1973 N ARG A 117 5.089 19.300 0.812 1.00 75.14 N ATOM 1974 CA ARG A 117 3.964 18.422 0.446 1.00 44.52 C ATOM 1975 C ARG A 117 3.842 17.224 1.407 1.00 5.23 C ATOM 1976 O ARG A 117 2.746 16.735 1.681 1.00 74.43 O ATOM 1977 CB ARG A 117 4.142 17.898 -0.990 1.00 12.23 C ATOM 1978 CG ARG A 117 4.241 18.980 -2.071 1.00 42.13 C ATOM 1979 CD ARG A 117 2.914 19.703 -2.321 1.00 42.33 C ATOM 1980 NE ARG A 117 2.607 20.694 -1.293 1.00 24.43 N ATOM 1981 CZ ARG A 117 2.530 21.981 -1.513 1.00 44.44 C ATOM 1982 NH1 ARG A 117 2.777 22.469 -2.689 1.00 4.24 N ATOM 1983 NH2 ARG A 117 2.211 22.777 -0.548 1.00 14.54 N ATOM 0 H ARG A 117 5.780 19.422 0.072 1.00 75.14 H new ATOM 0 HA ARG A 117 3.053 19.016 0.515 1.00 44.52 H new ATOM 0 HB2 ARG A 117 5.043 17.286 -1.027 1.00 12.23 H new ATOM 0 HB3 ARG A 117 3.303 17.245 -1.228 1.00 12.23 H new ATOM 0 HG2 ARG A 117 4.996 19.710 -1.778 1.00 42.13 H new ATOM 0 HG3 ARG A 117 4.581 18.525 -3.001 1.00 42.13 H new ATOM 0 HD2 ARG A 117 2.951 20.194 -3.293 1.00 42.33 H new ATOM 0 HD3 ARG A 117 2.109 18.970 -2.365 1.00 42.33 H new ATOM 0 HE ARG A 117 2.442 20.361 -0.343 1.00 24.43 H new ATOM 0 HH11 ARG A 117 3.035 21.847 -3.455 1.00 4.24 H new ATOM 0 HH12 ARG A 117 2.713 23.475 -2.848 1.00 4.24 H new ATOM 0 HH21 ARG A 117 2.020 22.401 0.381 1.00 14.54 H new ATOM 0 HH22 ARG A 117 2.150 23.781 -0.715 1.00 14.54 H new ATOM 1997 N ARG A 118 4.984 16.753 1.902 1.00 70.34 N ATOM 1998 CA ARG A 118 5.037 15.596 2.805 1.00 13.22 C ATOM 1999 C ARG A 118 4.533 15.933 4.219 1.00 1.51 C ATOM 2000 O ARG A 118 3.631 15.276 4.742 1.00 74.50 O ATOM 2001 CB ARG A 118 6.480 15.068 2.874 1.00 14.32 C ATOM 2002 CG ARG A 118 6.939 14.368 1.597 1.00 53.24 C ATOM 2003 CD ARG A 118 8.461 14.235 1.519 1.00 62.40 C ATOM 2004 NE ARG A 118 9.038 13.639 2.724 1.00 2.04 N ATOM 2005 CZ ARG A 118 10.318 13.500 2.939 1.00 1.14 C ATOM 2006 NH1 ARG A 118 11.188 13.950 2.092 1.00 51.31 N ATOM 2007 NH2 ARG A 118 10.727 12.914 4.017 1.00 34.01 N ATOM 0 H ARG A 118 5.897 17.157 1.693 1.00 70.34 H new ATOM 0 HA ARG A 118 4.374 14.830 2.402 1.00 13.22 H new ATOM 0 HB2 ARG A 118 7.152 15.900 3.084 1.00 14.32 H new ATOM 0 HB3 ARG A 118 6.564 14.373 3.709 1.00 14.32 H new ATOM 0 HG2 ARG A 118 6.488 13.377 1.547 1.00 53.24 H new ATOM 0 HG3 ARG A 118 6.581 14.926 0.732 1.00 53.24 H new ATOM 0 HD2 ARG A 118 8.725 13.625 0.655 1.00 62.40 H new ATOM 0 HD3 ARG A 118 8.900 15.220 1.360 1.00 62.40 H new ATOM 0 HE ARG A 118 8.396 13.310 3.445 1.00 2.04 H new ATOM 0 HH11 ARG A 118 10.876 14.421 1.243 1.00 51.31 H new ATOM 0 HH12 ARG A 118 12.185 13.834 2.274 1.00 51.31 H new ATOM 0 HH21 ARG A 118 10.050 12.563 4.695 1.00 34.01 H new ATOM 0 HH22 ARG A 118 11.726 12.803 4.189 1.00 34.01 H new ATOM 2021 N LYS A 119 5.118 16.961 4.827 1.00 41.21 N ATOM 2022 CA LYS A 119 4.822 17.318 6.218 1.00 1.21 C ATOM 2023 C LYS A 119 3.351 17.717 6.415 1.00 42.11 C ATOM 2024 O LYS A 119 2.703 17.278 7.369 1.00 70.45 O ATOM 2025 CB LYS A 119 5.741 18.458 6.678 1.00 72.35 C ATOM 2026 CG LYS A 119 7.231 18.157 6.521 1.00 21.33 C ATOM 2027 CD LYS A 119 7.648 16.879 7.251 1.00 40.51 C ATOM 2028 CE LYS A 119 7.433 16.977 8.757 1.00 2.51 C ATOM 2029 NZ LYS A 119 8.217 18.085 9.364 1.00 61.02 N ATOM 0 H LYS A 119 5.805 17.567 4.378 1.00 41.21 H new ATOM 0 HA LYS A 119 5.005 16.432 6.826 1.00 1.21 H new ATOM 0 HB2 LYS A 119 5.501 19.357 6.110 1.00 72.35 H new ATOM 0 HB3 LYS A 119 5.534 18.678 7.725 1.00 72.35 H new ATOM 0 HG2 LYS A 119 7.470 18.062 5.462 1.00 21.33 H new ATOM 0 HG3 LYS A 119 7.811 18.997 6.904 1.00 21.33 H new ATOM 0 HD2 LYS A 119 7.078 16.037 6.859 1.00 40.51 H new ATOM 0 HD3 LYS A 119 8.699 16.674 7.049 1.00 40.51 H new ATOM 0 HE2 LYS A 119 6.373 17.129 8.962 1.00 2.51 H new ATOM 0 HE3 LYS A 119 7.716 16.034 9.225 1.00 2.51 H new ATOM 0 HZ1 LYS A 119 8.191 18.002 10.400 1.00 61.02 H new ATOM 0 HZ2 LYS A 119 9.203 18.032 9.037 1.00 61.02 H new ATOM 0 HZ3 LYS A 119 7.807 18.997 9.079 1.00 61.02 H new ATOM 2043 N GLU A 120 2.827 18.548 5.512 1.00 42.32 N ATOM 2044 CA GLU A 120 1.422 18.971 5.582 1.00 51.12 C ATOM 2045 C GLU A 120 0.483 17.754 5.531 1.00 5.14 C ATOM 2046 O GLU A 120 -0.520 17.694 6.246 1.00 72.33 O ATOM 2047 CB GLU A 120 1.096 19.945 4.441 1.00 32.40 C ATOM 2048 CG GLU A 120 1.198 19.329 3.049 1.00 33.13 C ATOM 2049 CD GLU A 120 0.907 20.331 1.945 1.00 34.44 C ATOM 2050 OE1 GLU A 120 -0.279 20.518 1.602 1.00 25.23 O ATOM 2051 OE2 GLU A 120 1.858 20.940 1.422 1.00 34.14 O ATOM 0 H GLU A 120 3.348 18.941 4.728 1.00 42.32 H new ATOM 0 HA GLU A 120 1.268 19.484 6.532 1.00 51.12 H new ATOM 0 HB2 GLU A 120 0.086 20.330 4.583 1.00 32.40 H new ATOM 0 HB3 GLU A 120 1.773 20.797 4.500 1.00 32.40 H new ATOM 0 HG2 GLU A 120 2.199 18.920 2.909 1.00 33.13 H new ATOM 0 HG3 GLU A 120 0.499 18.496 2.972 1.00 33.13 H new ATOM 2058 N ALA A 121 0.837 16.777 4.698 1.00 3.21 N ATOM 2059 CA ALA A 121 0.072 15.535 4.589 1.00 21.44 C ATOM 2060 C ALA A 121 0.145 14.720 5.891 1.00 63.43 C ATOM 2061 O ALA A 121 -0.868 14.215 6.375 1.00 15.15 O ATOM 2062 CB ALA A 121 0.572 14.714 3.408 1.00 73.13 C ATOM 0 H ALA A 121 1.652 16.822 4.086 1.00 3.21 H new ATOM 0 HA ALA A 121 -0.974 15.791 4.420 1.00 21.44 H new ATOM 0 HB1 ALA A 121 -0.004 13.792 3.336 1.00 73.13 H new ATOM 0 HB2 ALA A 121 0.453 15.288 2.489 1.00 73.13 H new ATOM 0 HB3 ALA A 121 1.625 14.473 3.552 1.00 73.13 H new ATOM 2068 N GLN A 122 1.342 14.607 6.467 1.00 44.32 N ATOM 2069 CA GLN A 122 1.514 13.923 7.756 1.00 74.22 C ATOM 2070 C GLN A 122 0.604 14.534 8.835 1.00 53.05 C ATOM 2071 O GLN A 122 0.104 13.833 9.716 1.00 45.22 O ATOM 2072 CB GLN A 122 2.981 13.973 8.209 1.00 24.41 C ATOM 2073 CG GLN A 122 3.919 13.153 7.331 1.00 30.31 C ATOM 2074 CD GLN A 122 5.367 13.202 7.793 1.00 41.23 C ATOM 2075 OE1 GLN A 122 6.142 14.046 7.359 1.00 70.01 O ATOM 2076 NE2 GLN A 122 5.746 12.295 8.668 1.00 51.32 N ATOM 0 H GLN A 122 2.204 14.977 6.067 1.00 44.32 H new ATOM 0 HA GLN A 122 1.227 12.881 7.617 1.00 74.22 H new ATOM 0 HB2 GLN A 122 3.316 15.010 8.214 1.00 24.41 H new ATOM 0 HB3 GLN A 122 3.048 13.611 9.235 1.00 24.41 H new ATOM 0 HG2 GLN A 122 3.583 12.116 7.320 1.00 30.31 H new ATOM 0 HG3 GLN A 122 3.859 13.518 6.306 1.00 30.31 H new ATOM 0 HE21 GLN A 122 5.077 11.606 9.010 1.00 51.32 H new ATOM 0 HE22 GLN A 122 6.709 12.281 9.004 1.00 51.32 H new ATOM 2085 N GLN A 123 0.381 15.843 8.757 1.00 12.04 N ATOM 2086 CA GLN A 123 -0.513 16.528 9.696 1.00 44.12 C ATOM 2087 C GLN A 123 -1.986 16.114 9.491 1.00 53.25 C ATOM 2088 O GLN A 123 -2.754 16.033 10.452 1.00 72.21 O ATOM 2089 CB GLN A 123 -0.373 18.051 9.555 1.00 23.50 C ATOM 2090 CG GLN A 123 -1.273 18.841 10.504 1.00 20.03 C ATOM 2091 CD GLN A 123 -1.112 20.347 10.378 1.00 1.24 C ATOM 2092 OE1 GLN A 123 -2.057 21.104 10.580 1.00 32.21 O ATOM 2093 NE2 GLN A 123 0.083 20.802 10.059 1.00 13.13 N ATOM 0 H GLN A 123 0.804 16.452 8.057 1.00 12.04 H new ATOM 0 HA GLN A 123 -0.218 16.230 10.702 1.00 44.12 H new ATOM 0 HB2 GLN A 123 0.665 18.330 9.736 1.00 23.50 H new ATOM 0 HB3 GLN A 123 -0.605 18.335 8.528 1.00 23.50 H new ATOM 0 HG2 GLN A 123 -2.313 18.577 10.310 1.00 20.03 H new ATOM 0 HG3 GLN A 123 -1.055 18.545 11.530 1.00 20.03 H new ATOM 0 HE21 GLN A 123 0.850 20.150 9.897 1.00 13.13 H new ATOM 0 HE22 GLN A 123 0.241 21.806 9.974 1.00 13.13 H new ATOM 2102 N GLU A 124 -2.373 15.848 8.243 1.00 25.02 N ATOM 2103 CA GLU A 124 -3.769 15.507 7.923 1.00 4.40 C ATOM 2104 C GLU A 124 -4.017 13.985 7.875 1.00 12.40 C ATOM 2105 O GLU A 124 -5.159 13.549 7.731 1.00 60.23 O ATOM 2106 CB GLU A 124 -4.186 16.153 6.588 1.00 51.15 C ATOM 2107 CG GLU A 124 -3.418 15.642 5.373 1.00 45.11 C ATOM 2108 CD GLU A 124 -3.844 16.319 4.076 1.00 22.31 C ATOM 2109 OE1 GLU A 124 -4.811 15.850 3.440 1.00 12.34 O ATOM 2110 OE2 GLU A 124 -3.218 17.327 3.684 1.00 70.23 O ATOM 0 H GLU A 124 -1.747 15.861 7.438 1.00 25.02 H new ATOM 0 HA GLU A 124 -4.383 15.905 8.731 1.00 4.40 H new ATOM 0 HB2 GLU A 124 -5.250 15.977 6.430 1.00 51.15 H new ATOM 0 HB3 GLU A 124 -4.049 17.232 6.662 1.00 51.15 H new ATOM 0 HG2 GLU A 124 -2.351 15.804 5.529 1.00 45.11 H new ATOM 0 HG3 GLU A 124 -3.567 14.566 5.281 1.00 45.11 H new ATOM 2117 N PHE A 125 -2.959 13.171 7.985 1.00 1.35 N ATOM 2118 CA PHE A 125 -3.119 11.702 7.952 1.00 32.22 C ATOM 2119 C PHE A 125 -2.676 11.008 9.252 1.00 3.33 C ATOM 2120 O PHE A 125 -3.248 9.989 9.643 1.00 64.32 O ATOM 2121 CB PHE A 125 -2.324 11.099 6.784 1.00 41.43 C ATOM 2122 CG PHE A 125 -2.770 11.562 5.424 1.00 34.14 C ATOM 2123 CD1 PHE A 125 -4.110 11.523 5.067 1.00 72.45 C ATOM 2124 CD2 PHE A 125 -1.849 12.024 4.499 1.00 22.02 C ATOM 2125 CE1 PHE A 125 -4.517 11.936 3.816 1.00 41.13 C ATOM 2126 CE2 PHE A 125 -2.254 12.438 3.248 1.00 51.45 C ATOM 2127 CZ PHE A 125 -3.588 12.396 2.908 1.00 71.15 C ATOM 0 H PHE A 125 -1.997 13.492 8.096 1.00 1.35 H new ATOM 0 HA PHE A 125 -4.187 11.526 7.827 1.00 32.22 H new ATOM 0 HB2 PHE A 125 -1.270 11.347 6.911 1.00 41.43 H new ATOM 0 HB3 PHE A 125 -2.403 10.013 6.829 1.00 41.43 H new ATOM 0 HD1 PHE A 125 -4.842 11.165 5.776 1.00 72.45 H new ATOM 0 HD2 PHE A 125 -0.802 12.060 4.760 1.00 22.02 H new ATOM 0 HE1 PHE A 125 -5.563 11.899 3.548 1.00 41.13 H new ATOM 0 HE2 PHE A 125 -1.526 12.795 2.535 1.00 51.45 H new ATOM 0 HZ PHE A 125 -3.906 12.724 1.929 1.00 71.15 H new ATOM 2137 N ARG A 126 -1.672 11.555 9.930 1.00 15.04 N ATOM 2138 CA ARG A 126 -1.096 10.887 11.104 1.00 34.13 C ATOM 2139 C ARG A 126 -1.932 11.155 12.369 1.00 4.41 C ATOM 2140 O ARG A 126 -1.851 12.225 12.973 1.00 42.34 O ATOM 2141 CB ARG A 126 0.375 11.323 11.290 1.00 54.10 C ATOM 2142 CG ARG A 126 1.197 10.490 12.286 1.00 43.14 C ATOM 2143 CD ARG A 126 0.916 10.863 13.742 1.00 31.11 C ATOM 2144 NE ARG A 126 0.974 12.310 13.946 1.00 32.32 N ATOM 2145 CZ ARG A 126 1.657 12.907 14.884 1.00 72.51 C ATOM 2146 NH1 ARG A 126 2.371 12.230 15.726 1.00 53.34 N ATOM 2147 NH2 ARG A 126 1.627 14.197 14.969 1.00 21.21 N ATOM 0 H ARG A 126 -1.241 12.449 9.695 1.00 15.04 H new ATOM 0 HA ARG A 126 -1.116 9.810 10.936 1.00 34.13 H new ATOM 0 HB2 ARG A 126 0.870 11.288 10.320 1.00 54.10 H new ATOM 0 HB3 ARG A 126 0.388 12.363 11.617 1.00 54.10 H new ATOM 0 HG2 ARG A 126 0.977 9.433 12.137 1.00 43.14 H new ATOM 0 HG3 ARG A 126 2.258 10.627 12.079 1.00 43.14 H new ATOM 0 HD2 ARG A 126 -0.068 10.493 14.030 1.00 31.11 H new ATOM 0 HD3 ARG A 126 1.643 10.374 14.391 1.00 31.11 H new ATOM 0 HE ARG A 126 0.440 12.898 13.306 1.00 32.32 H new ATOM 0 HH11 ARG A 126 2.406 11.213 15.663 1.00 53.34 H new ATOM 0 HH12 ARG A 126 2.898 12.714 16.453 1.00 53.34 H new ATOM 0 HH21 ARG A 126 1.073 14.739 14.306 1.00 21.21 H new ATOM 0 HH22 ARG A 126 2.158 14.672 15.699 1.00 21.21 H new ATOM 2161 N SER A 127 -2.743 10.169 12.741 1.00 32.25 N ATOM 2162 CA SER A 127 -3.543 10.212 13.977 1.00 4.32 C ATOM 2163 C SER A 127 -3.066 9.124 14.950 1.00 54.30 C ATOM 2164 O SER A 127 -2.164 8.351 14.625 1.00 43.14 O ATOM 2165 CB SER A 127 -5.037 10.013 13.653 1.00 11.35 C ATOM 2166 OG SER A 127 -5.258 8.795 12.963 1.00 22.31 O ATOM 0 H SER A 127 -2.869 9.314 12.199 1.00 32.25 H new ATOM 0 HA SER A 127 -3.413 11.188 14.445 1.00 4.32 H new ATOM 0 HB2 SER A 127 -5.615 10.020 14.577 1.00 11.35 H new ATOM 0 HB3 SER A 127 -5.394 10.846 13.047 1.00 11.35 H new ATOM 0 HG SER A 127 -6.214 8.696 12.773 1.00 22.31 H new ATOM 2172 N ASP A 128 -3.653 9.059 16.143 1.00 30.25 N ATOM 2173 CA ASP A 128 -3.276 8.023 17.110 1.00 53.41 C ATOM 2174 C ASP A 128 -3.657 6.625 16.588 1.00 22.22 C ATOM 2175 O ASP A 128 -4.813 6.370 16.238 1.00 74.41 O ATOM 2176 CB ASP A 128 -3.917 8.299 18.478 1.00 0.00 C ATOM 2177 CG ASP A 128 -5.432 8.372 18.418 1.00 34.30 C ATOM 2178 OD1 ASP A 128 -5.964 9.442 18.059 1.00 71.12 O ATOM 2179 OD2 ASP A 128 -6.099 7.361 18.738 1.00 63.15 O ATOM 0 H ASP A 128 -4.380 9.699 16.463 1.00 30.25 H new ATOM 0 HA ASP A 128 -2.194 8.048 17.236 1.00 53.41 H new ATOM 0 HB2 ASP A 128 -3.624 7.515 19.176 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -3.529 9.238 18.873 1.00 0.00 H new ATOM 2184 N GLY A 129 -2.676 5.728 16.522 1.00 45.41 N ATOM 2185 CA GLY A 129 -2.898 4.415 15.921 1.00 33.30 C ATOM 2186 C GLY A 129 -2.548 4.387 14.434 1.00 11.24 C ATOM 2187 O GLY A 129 -2.534 3.329 13.808 1.00 25.42 O ATOM 0 H GLY A 129 -1.731 5.883 16.872 1.00 45.41 H new ATOM 0 HA2 GLY A 129 -2.298 3.672 16.446 1.00 33.30 H new ATOM 0 HA3 GLY A 129 -3.942 4.131 16.051 1.00 33.30 H new ATOM 2191 N VAL A 130 -2.263 5.562 13.868 1.00 71.50 N ATOM 2192 CA VAL A 130 -1.927 5.690 12.447 1.00 52.13 C ATOM 2193 C VAL A 130 -0.547 6.340 12.251 1.00 30.52 C ATOM 2194 O VAL A 130 -0.359 7.522 12.543 1.00 61.14 O ATOM 2195 CB VAL A 130 -2.992 6.532 11.700 1.00 64.03 C ATOM 2196 CG1 VAL A 130 -2.631 6.695 10.223 1.00 70.20 C ATOM 2197 CG2 VAL A 130 -4.381 5.912 11.862 1.00 70.12 C ATOM 0 H VAL A 130 -2.258 6.446 14.377 1.00 71.50 H new ATOM 0 HA VAL A 130 -1.905 4.682 12.034 1.00 52.13 H new ATOM 0 HB VAL A 130 -3.010 7.526 12.146 1.00 64.03 H new ATOM 0 HG11 VAL A 130 -3.396 7.290 9.725 1.00 70.20 H new ATOM 0 HG12 VAL A 130 -1.668 7.198 10.137 1.00 70.20 H new ATOM 0 HG13 VAL A 130 -2.571 5.714 9.753 1.00 70.20 H new ATOM 0 HG21 VAL A 130 -5.114 6.518 11.330 1.00 70.12 H new ATOM 0 HG22 VAL A 130 -4.379 4.902 11.452 1.00 70.12 H new ATOM 0 HG23 VAL A 130 -4.641 5.873 12.920 1.00 70.12 H new ATOM 2207 N ASP A 131 0.413 5.564 11.757 1.00 41.43 N ATOM 2208 CA ASP A 131 1.755 6.083 11.480 1.00 52.43 C ATOM 2209 C ASP A 131 1.872 6.515 10.012 1.00 4.33 C ATOM 2210 O ASP A 131 1.313 5.876 9.124 1.00 54.45 O ATOM 2211 CB ASP A 131 2.823 5.025 11.802 1.00 4.42 C ATOM 2212 CG ASP A 131 4.204 5.636 12.006 1.00 74.05 C ATOM 2213 OD1 ASP A 131 4.289 6.833 12.352 1.00 13.02 O ATOM 2214 OD2 ASP A 131 5.214 4.924 11.831 1.00 13.13 O ATOM 0 H ASP A 131 0.290 4.575 11.539 1.00 41.43 H new ATOM 0 HA ASP A 131 1.921 6.952 12.117 1.00 52.43 H new ATOM 0 HB2 ASP A 131 2.533 4.482 12.701 1.00 4.42 H new ATOM 0 HB3 ASP A 131 2.867 4.298 10.991 1.00 4.42 H new ATOM 2219 N VAL A 132 2.597 7.602 9.761 1.00 52.21 N ATOM 2220 CA VAL A 132 2.792 8.107 8.394 1.00 43.33 C ATOM 2221 C VAL A 132 4.261 8.489 8.150 1.00 63.12 C ATOM 2222 O VAL A 132 4.758 9.480 8.690 1.00 51.14 O ATOM 2223 CB VAL A 132 1.883 9.331 8.096 1.00 21.14 C ATOM 2224 CG1 VAL A 132 2.135 9.864 6.684 1.00 14.53 C ATOM 2225 CG2 VAL A 132 0.406 8.975 8.278 1.00 11.23 C ATOM 0 H VAL A 132 3.061 8.154 10.482 1.00 52.21 H new ATOM 0 HA VAL A 132 2.514 7.298 7.718 1.00 43.33 H new ATOM 0 HB VAL A 132 2.134 10.115 8.810 1.00 21.14 H new ATOM 0 HG11 VAL A 132 1.487 10.721 6.498 1.00 14.53 H new ATOM 0 HG12 VAL A 132 3.177 10.170 6.591 1.00 14.53 H new ATOM 0 HG13 VAL A 132 1.920 9.082 5.956 1.00 14.53 H new ATOM 0 HG21 VAL A 132 -0.208 9.849 8.063 1.00 11.23 H new ATOM 0 HG22 VAL A 132 0.140 8.168 7.596 1.00 11.23 H new ATOM 0 HG23 VAL A 132 0.233 8.654 9.305 1.00 11.23 H new ATOM 2235 N ARG A 133 4.951 7.688 7.341 1.00 14.23 N ATOM 2236 CA ARG A 133 6.359 7.935 7.013 1.00 32.11 C ATOM 2237 C ARG A 133 6.506 8.390 5.558 1.00 45.22 C ATOM 2238 O ARG A 133 5.952 7.784 4.639 1.00 51.03 O ATOM 2239 CB ARG A 133 7.191 6.671 7.264 1.00 32.34 C ATOM 2240 CG ARG A 133 7.123 6.187 8.709 1.00 32.10 C ATOM 2241 CD ARG A 133 7.792 7.158 9.675 1.00 1.40 C ATOM 2242 NE ARG A 133 7.151 7.139 10.988 1.00 20.04 N ATOM 2243 CZ ARG A 133 7.366 8.020 11.925 1.00 31.02 C ATOM 2244 NH1 ARG A 133 8.256 8.949 11.769 1.00 11.11 N ATOM 2245 NH2 ARG A 133 6.687 7.963 13.022 1.00 34.12 N ATOM 0 H ARG A 133 4.558 6.858 6.897 1.00 14.23 H new ATOM 0 HA ARG A 133 6.728 8.732 7.658 1.00 32.11 H new ATOM 0 HB2 ARG A 133 6.842 5.877 6.604 1.00 32.34 H new ATOM 0 HB3 ARG A 133 8.230 6.869 7.002 1.00 32.34 H new ATOM 0 HG2 ARG A 133 6.080 6.052 8.996 1.00 32.10 H new ATOM 0 HG3 ARG A 133 7.603 5.212 8.786 1.00 32.10 H new ATOM 0 HD2 ARG A 133 8.846 6.899 9.780 1.00 1.40 H new ATOM 0 HD3 ARG A 133 7.751 8.167 9.264 1.00 1.40 H new ATOM 0 HE ARG A 133 6.491 6.386 11.185 1.00 20.04 H new ATOM 0 HH11 ARG A 133 8.797 8.997 10.906 1.00 11.11 H new ATOM 0 HH12 ARG A 133 8.415 9.632 12.509 1.00 11.11 H new ATOM 0 HH21 ARG A 133 5.988 7.232 13.151 1.00 34.12 H new ATOM 0 HH22 ARG A 133 6.850 8.649 13.759 1.00 34.12 H new ATOM 2259 N THR A 134 7.253 9.464 5.357 1.00 34.44 N ATOM 2260 CA THR A 134 7.419 10.058 4.029 1.00 13.41 C ATOM 2261 C THR A 134 8.863 9.938 3.530 1.00 63.21 C ATOM 2262 O THR A 134 9.811 10.288 4.237 1.00 4.43 O ATOM 2263 CB THR A 134 7.014 11.550 4.038 1.00 41.44 C ATOM 2264 OG1 THR A 134 7.908 12.308 4.871 1.00 63.53 O ATOM 2265 CG2 THR A 134 5.586 11.727 4.541 1.00 2.32 C ATOM 0 H THR A 134 7.759 9.949 6.098 1.00 34.44 H new ATOM 0 HA THR A 134 6.767 9.505 3.353 1.00 13.41 H new ATOM 0 HB THR A 134 7.074 11.915 3.013 1.00 41.44 H new ATOM 0 HG1 THR A 134 7.429 13.072 5.255 1.00 63.53 H new ATOM 0 HG21 THR A 134 5.327 12.786 4.537 1.00 2.32 H new ATOM 0 HG22 THR A 134 4.901 11.184 3.890 1.00 2.32 H new ATOM 0 HG23 THR A 134 5.507 11.338 5.556 1.00 2.32 H new ATOM 2273 N VAL A 135 9.029 9.443 2.307 1.00 65.52 N ATOM 2274 CA VAL A 135 10.360 9.261 1.717 1.00 23.24 C ATOM 2275 C VAL A 135 10.443 9.868 0.310 1.00 42.02 C ATOM 2276 O VAL A 135 9.463 9.877 -0.430 1.00 22.00 O ATOM 2277 CB VAL A 135 10.743 7.762 1.642 1.00 2.52 C ATOM 2278 CG1 VAL A 135 10.925 7.177 3.043 1.00 31.34 C ATOM 2279 CG2 VAL A 135 9.695 6.973 0.853 1.00 55.35 C ATOM 0 H VAL A 135 8.259 9.159 1.701 1.00 65.52 H new ATOM 0 HA VAL A 135 11.062 9.780 2.370 1.00 23.24 H new ATOM 0 HB VAL A 135 11.694 7.680 1.116 1.00 2.52 H new ATOM 0 HG11 VAL A 135 11.194 6.123 2.965 1.00 31.34 H new ATOM 0 HG12 VAL A 135 11.717 7.716 3.562 1.00 31.34 H new ATOM 0 HG13 VAL A 135 9.994 7.274 3.601 1.00 31.34 H new ATOM 0 HG21 VAL A 135 9.984 5.923 0.813 1.00 55.35 H new ATOM 0 HG22 VAL A 135 8.726 7.064 1.343 1.00 55.35 H new ATOM 0 HG23 VAL A 135 9.628 7.370 -0.160 1.00 55.35 H new ATOM 2289 N SER A 136 11.620 10.371 -0.051 1.00 73.23 N ATOM 2290 CA SER A 136 11.844 10.954 -1.384 1.00 3.32 C ATOM 2291 C SER A 136 12.627 9.993 -2.290 1.00 65.34 C ATOM 2292 O SER A 136 12.937 10.314 -3.440 1.00 70.21 O ATOM 2293 CB SER A 136 12.610 12.279 -1.252 1.00 44.12 C ATOM 2294 OG SER A 136 12.844 12.887 -2.517 1.00 44.03 O ATOM 0 H SER A 136 12.439 10.390 0.557 1.00 73.23 H new ATOM 0 HA SER A 136 10.871 11.135 -1.840 1.00 3.32 H new ATOM 0 HB2 SER A 136 12.044 12.963 -0.620 1.00 44.12 H new ATOM 0 HB3 SER A 136 13.563 12.099 -0.754 1.00 44.12 H new ATOM 0 HG SER A 136 12.993 12.192 -3.191 1.00 44.03 H new ATOM 2300 N ASP A 137 12.933 8.807 -1.770 1.00 71.44 N ATOM 2301 CA ASP A 137 13.759 7.829 -2.488 1.00 3.32 C ATOM 2302 C ASP A 137 13.111 6.436 -2.503 1.00 12.41 C ATOM 2303 O ASP A 137 12.208 6.141 -1.716 1.00 70.04 O ATOM 2304 CB ASP A 137 15.140 7.746 -1.833 1.00 21.23 C ATOM 2305 CG ASP A 137 16.145 6.990 -2.680 1.00 31.42 C ATOM 2306 OD1 ASP A 137 16.717 7.591 -3.613 1.00 24.40 O ATOM 2307 OD2 ASP A 137 16.351 5.785 -2.432 1.00 40.43 O ATOM 0 H ASP A 137 12.622 8.495 -0.850 1.00 71.44 H new ATOM 0 HA ASP A 137 13.853 8.164 -3.521 1.00 3.32 H new ATOM 0 HB2 ASP A 137 15.511 8.754 -1.649 1.00 21.23 H new ATOM 0 HB3 ASP A 137 15.049 7.258 -0.863 1.00 21.23 H new ATOM 2312 N LYS A 138 13.585 5.591 -3.411 1.00 43.20 N ATOM 2313 CA LYS A 138 13.118 4.209 -3.525 1.00 24.24 C ATOM 2314 C LYS A 138 13.605 3.351 -2.341 1.00 64.34 C ATOM 2315 O LYS A 138 12.800 2.770 -1.609 1.00 51.43 O ATOM 2316 CB LYS A 138 13.626 3.620 -4.845 1.00 41.04 C ATOM 2317 CG LYS A 138 13.191 2.179 -5.105 1.00 51.45 C ATOM 2318 CD LYS A 138 13.687 1.652 -6.456 1.00 35.30 C ATOM 2319 CE LYS A 138 15.180 1.313 -6.450 1.00 62.32 C ATOM 2320 NZ LYS A 138 16.047 2.523 -6.386 1.00 72.10 N ATOM 0 H LYS A 138 14.304 5.842 -4.090 1.00 43.20 H new ATOM 0 HA LYS A 138 12.028 4.205 -3.508 1.00 24.24 H new ATOM 0 HB2 LYS A 138 13.276 4.246 -5.666 1.00 41.04 H new ATOM 0 HB3 LYS A 138 14.715 3.664 -4.853 1.00 41.04 H new ATOM 0 HG2 LYS A 138 13.569 1.539 -4.308 1.00 51.45 H new ATOM 0 HG3 LYS A 138 12.103 2.120 -5.072 1.00 51.45 H new ATOM 0 HD2 LYS A 138 13.118 0.762 -6.724 1.00 35.30 H new ATOM 0 HD3 LYS A 138 13.492 2.399 -7.226 1.00 35.30 H new ATOM 0 HE2 LYS A 138 15.398 0.670 -5.598 1.00 62.32 H new ATOM 0 HE3 LYS A 138 15.422 0.745 -7.348 1.00 62.32 H new ATOM 0 HZ1 LYS A 138 16.885 2.381 -6.985 1.00 72.10 H new ATOM 0 HZ2 LYS A 138 15.515 3.350 -6.725 1.00 72.10 H new ATOM 0 HZ3 LYS A 138 16.347 2.684 -5.403 1.00 72.10 H new ATOM 2334 N GLU A 139 14.926 3.294 -2.150 1.00 33.25 N ATOM 2335 CA GLU A 139 15.530 2.491 -1.076 1.00 52.41 C ATOM 2336 C GLU A 139 15.004 2.930 0.300 1.00 74.23 C ATOM 2337 O GLU A 139 14.669 2.098 1.143 1.00 63.12 O ATOM 2338 CB GLU A 139 17.060 2.614 -1.123 1.00 53.32 C ATOM 2339 CG GLU A 139 17.786 1.713 -0.129 1.00 20.25 C ATOM 2340 CD GLU A 139 19.298 1.878 -0.189 1.00 3.21 C ATOM 2341 OE1 GLU A 139 19.949 1.188 -1.004 1.00 15.14 O ATOM 2342 OE2 GLU A 139 19.842 2.709 0.569 1.00 61.23 O ATOM 0 H GLU A 139 15.602 3.795 -2.726 1.00 33.25 H new ATOM 0 HA GLU A 139 15.252 1.448 -1.230 1.00 52.41 H new ATOM 0 HB2 GLU A 139 17.402 2.377 -2.130 1.00 53.32 H new ATOM 0 HB3 GLU A 139 17.337 3.650 -0.928 1.00 53.32 H new ATOM 0 HG2 GLU A 139 17.439 1.937 0.880 1.00 20.25 H new ATOM 0 HG3 GLU A 139 17.529 0.673 -0.331 1.00 20.25 H new ATOM 2349 N GLU A 140 14.928 4.247 0.503 1.00 31.25 N ATOM 2350 CA GLU A 140 14.317 4.830 1.710 1.00 3.44 C ATOM 2351 C GLU A 140 12.959 4.183 2.026 1.00 53.11 C ATOM 2352 O GLU A 140 12.644 3.894 3.182 1.00 41.00 O ATOM 2353 CB GLU A 140 14.133 6.343 1.510 1.00 3.14 C ATOM 2354 CG GLU A 140 15.401 7.167 1.722 1.00 21.20 C ATOM 2355 CD GLU A 140 15.616 7.549 3.179 1.00 33.02 C ATOM 2356 OE1 GLU A 140 14.702 8.158 3.773 1.00 23.44 O ATOM 2357 OE2 GLU A 140 16.700 7.268 3.731 1.00 32.10 O ATOM 0 H GLU A 140 15.284 4.939 -0.156 1.00 31.25 H new ATOM 0 HA GLU A 140 14.983 4.640 2.552 1.00 3.44 H new ATOM 0 HB2 GLU A 140 13.763 6.521 0.500 1.00 3.14 H new ATOM 0 HB3 GLU A 140 13.365 6.697 2.198 1.00 3.14 H new ATOM 0 HG2 GLU A 140 16.262 6.599 1.369 1.00 21.20 H new ATOM 0 HG3 GLU A 140 15.346 8.072 1.117 1.00 21.20 H new ATOM 2364 N LEU A 141 12.163 3.953 0.983 1.00 22.41 N ATOM 2365 CA LEU A 141 10.843 3.336 1.131 1.00 14.43 C ATOM 2366 C LEU A 141 10.996 1.852 1.511 1.00 5.33 C ATOM 2367 O LEU A 141 10.303 1.347 2.396 1.00 20.23 O ATOM 2368 CB LEU A 141 10.046 3.502 -0.181 1.00 33.12 C ATOM 2369 CG LEU A 141 8.514 3.346 -0.082 1.00 44.23 C ATOM 2370 CD1 LEU A 141 7.841 3.854 -1.354 1.00 42.21 C ATOM 2371 CD2 LEU A 141 8.118 1.894 0.174 1.00 32.31 C ATOM 0 H LEU A 141 12.410 4.186 0.021 1.00 22.41 H new ATOM 0 HA LEU A 141 10.292 3.831 1.931 1.00 14.43 H new ATOM 0 HB2 LEU A 141 10.262 4.489 -0.589 1.00 33.12 H new ATOM 0 HB3 LEU A 141 10.417 2.772 -0.900 1.00 33.12 H new ATOM 0 HG LEU A 141 8.175 3.945 0.763 1.00 44.23 H new ATOM 0 HD11 LEU A 141 6.761 3.736 -1.266 1.00 42.21 H new ATOM 0 HD12 LEU A 141 8.081 4.908 -1.496 1.00 42.21 H new ATOM 0 HD13 LEU A 141 8.200 3.281 -2.209 1.00 42.21 H new ATOM 0 HD21 LEU A 141 7.033 1.819 0.238 1.00 32.31 H new ATOM 0 HD22 LEU A 141 8.477 1.269 -0.644 1.00 32.31 H new ATOM 0 HD23 LEU A 141 8.561 1.556 1.111 1.00 32.31 H new ATOM 2383 N ILE A 142 11.930 1.171 0.847 1.00 70.21 N ATOM 2384 CA ILE A 142 12.224 -0.239 1.134 1.00 20.22 C ATOM 2385 C ILE A 142 12.611 -0.434 2.609 1.00 13.12 C ATOM 2386 O ILE A 142 12.206 -1.408 3.247 1.00 24.51 O ATOM 2387 CB ILE A 142 13.376 -0.765 0.236 1.00 34.12 C ATOM 2388 CG1 ILE A 142 13.055 -0.540 -1.253 1.00 34.12 C ATOM 2389 CG2 ILE A 142 13.648 -2.244 0.514 1.00 61.03 C ATOM 2390 CD1 ILE A 142 11.797 -1.237 -1.723 1.00 13.50 C ATOM 0 H ILE A 142 12.500 1.573 0.103 1.00 70.21 H new ATOM 0 HA ILE A 142 11.317 -0.804 0.922 1.00 20.22 H new ATOM 0 HB ILE A 142 14.278 -0.202 0.477 1.00 34.12 H new ATOM 0 HG12 ILE A 142 12.955 0.530 -1.435 1.00 34.12 H new ATOM 0 HG13 ILE A 142 13.896 -0.888 -1.852 1.00 34.12 H new ATOM 0 HG21 ILE A 142 14.459 -2.591 -0.126 1.00 61.03 H new ATOM 0 HG22 ILE A 142 13.931 -2.372 1.559 1.00 61.03 H new ATOM 0 HG23 ILE A 142 12.749 -2.824 0.308 1.00 61.03 H new ATOM 0 HD11 ILE A 142 11.640 -1.030 -2.782 1.00 13.50 H new ATOM 0 HD12 ILE A 142 11.900 -2.312 -1.575 1.00 13.50 H new ATOM 0 HD13 ILE A 142 10.944 -0.872 -1.151 1.00 13.50 H new ATOM 2402 N GLU A 143 13.391 0.508 3.142 1.00 64.34 N ATOM 2403 CA GLU A 143 13.820 0.475 4.548 1.00 62.23 C ATOM 2404 C GLU A 143 12.624 0.362 5.504 1.00 12.03 C ATOM 2405 O GLU A 143 12.645 -0.431 6.449 1.00 72.03 O ATOM 2406 CB GLU A 143 14.634 1.733 4.880 1.00 31.05 C ATOM 2407 CG GLU A 143 15.907 1.880 4.054 1.00 61.11 C ATOM 2408 CD GLU A 143 16.873 0.725 4.254 1.00 65.43 C ATOM 2409 OE1 GLU A 143 17.618 0.735 5.258 1.00 75.45 O ATOM 2410 OE2 GLU A 143 16.890 -0.200 3.415 1.00 61.22 O ATOM 0 H GLU A 143 13.743 1.310 2.619 1.00 64.34 H new ATOM 0 HA GLU A 143 14.442 -0.410 4.683 1.00 62.23 H new ATOM 0 HB2 GLU A 143 14.008 2.611 4.724 1.00 31.05 H new ATOM 0 HB3 GLU A 143 14.899 1.714 5.937 1.00 31.05 H new ATOM 0 HG2 GLU A 143 15.644 1.950 2.998 1.00 61.11 H new ATOM 0 HG3 GLU A 143 16.403 2.813 4.321 1.00 61.11 H new ATOM 2417 N GLN A 144 11.581 1.154 5.253 1.00 31.23 N ATOM 2418 CA GLN A 144 10.364 1.110 6.073 1.00 72.41 C ATOM 2419 C GLN A 144 9.732 -0.292 6.048 1.00 5.12 C ATOM 2420 O GLN A 144 9.297 -0.813 7.080 1.00 62.21 O ATOM 2421 CB GLN A 144 9.349 2.154 5.585 1.00 4.51 C ATOM 2422 CG GLN A 144 9.843 3.599 5.648 1.00 54.55 C ATOM 2423 CD GLN A 144 10.296 4.012 7.041 1.00 4.03 C ATOM 2424 OE1 GLN A 144 9.500 4.442 7.862 1.00 21.35 O ATOM 2425 NE2 GLN A 144 11.583 3.926 7.306 1.00 20.51 N ATOM 0 H GLN A 144 11.552 1.832 4.492 1.00 31.23 H new ATOM 0 HA GLN A 144 10.644 1.342 7.101 1.00 72.41 H new ATOM 0 HB2 GLN A 144 9.075 1.922 4.556 1.00 4.51 H new ATOM 0 HB3 GLN A 144 8.442 2.067 6.183 1.00 4.51 H new ATOM 0 HG2 GLN A 144 10.671 3.725 4.950 1.00 54.55 H new ATOM 0 HG3 GLN A 144 9.045 4.265 5.319 1.00 54.55 H new ATOM 0 HE21 GLN A 144 12.226 3.563 6.602 1.00 20.51 H new ATOM 0 HE22 GLN A 144 11.937 4.222 8.215 1.00 20.51 H new ATOM 2434 N VAL A 145 9.700 -0.900 4.863 1.00 44.23 N ATOM 2435 CA VAL A 145 9.179 -2.263 4.696 1.00 41.11 C ATOM 2436 C VAL A 145 10.017 -3.279 5.492 1.00 22.23 C ATOM 2437 O VAL A 145 9.479 -4.104 6.234 1.00 52.54 O ATOM 2438 CB VAL A 145 9.158 -2.675 3.201 1.00 64.25 C ATOM 2439 CG1 VAL A 145 8.580 -4.080 3.026 1.00 10.11 C ATOM 2440 CG2 VAL A 145 8.378 -1.655 2.371 1.00 32.22 C ATOM 0 H VAL A 145 10.030 -0.471 3.998 1.00 44.23 H new ATOM 0 HA VAL A 145 8.159 -2.265 5.080 1.00 41.11 H new ATOM 0 HB VAL A 145 10.186 -2.692 2.840 1.00 64.25 H new ATOM 0 HG11 VAL A 145 8.577 -4.343 1.968 1.00 10.11 H new ATOM 0 HG12 VAL A 145 9.191 -4.796 3.576 1.00 10.11 H new ATOM 0 HG13 VAL A 145 7.560 -4.104 3.409 1.00 10.11 H new ATOM 0 HG21 VAL A 145 8.375 -1.963 1.325 1.00 32.22 H new ATOM 0 HG22 VAL A 145 7.352 -1.598 2.735 1.00 32.22 H new ATOM 0 HG23 VAL A 145 8.850 -0.676 2.460 1.00 32.22 H new ATOM 2450 N ARG A 146 11.342 -3.194 5.340 1.00 21.13 N ATOM 2451 CA ARG A 146 12.276 -4.078 6.054 1.00 32.44 C ATOM 2452 C ARG A 146 12.063 -3.998 7.576 1.00 21.32 C ATOM 2453 O ARG A 146 12.090 -5.013 8.274 1.00 51.41 O ATOM 2454 CB ARG A 146 13.727 -3.703 5.700 1.00 75.14 C ATOM 2455 CG ARG A 146 14.042 -3.800 4.206 1.00 33.43 C ATOM 2456 CD ARG A 146 15.432 -3.256 3.867 1.00 63.40 C ATOM 2457 NE ARG A 146 16.517 -4.086 4.398 1.00 70.24 N ATOM 2458 CZ ARG A 146 17.754 -3.675 4.528 1.00 52.24 C ATOM 2459 NH1 ARG A 146 18.080 -2.453 4.259 1.00 34.13 N ATOM 2460 NH2 ARG A 146 18.664 -4.489 4.944 1.00 70.44 N ATOM 0 H ARG A 146 11.797 -2.519 4.726 1.00 21.13 H new ATOM 0 HA ARG A 146 12.083 -5.104 5.741 1.00 32.44 H new ATOM 0 HB2 ARG A 146 13.922 -2.685 6.038 1.00 75.14 H new ATOM 0 HB3 ARG A 146 14.406 -4.357 6.248 1.00 75.14 H new ATOM 0 HG2 ARG A 146 13.975 -4.841 3.890 1.00 33.43 H new ATOM 0 HG3 ARG A 146 13.291 -3.247 3.642 1.00 33.43 H new ATOM 0 HD2 ARG A 146 15.534 -3.184 2.784 1.00 63.40 H new ATOM 0 HD3 ARG A 146 15.527 -2.245 4.264 1.00 63.40 H new ATOM 0 HE ARG A 146 16.296 -5.040 4.683 1.00 70.24 H new ATOM 0 HH11 ARG A 146 17.370 -1.794 3.941 1.00 34.13 H new ATOM 0 HH12 ARG A 146 19.048 -2.148 4.365 1.00 34.13 H new ATOM 0 HH21 ARG A 146 18.420 -5.453 5.172 1.00 70.44 H new ATOM 0 HH22 ARG A 146 19.627 -4.169 5.045 1.00 70.44 H new ATOM 2474 N ARG A 147 11.839 -2.783 8.079 1.00 42.10 N ATOM 2475 CA ARG A 147 11.580 -2.570 9.510 1.00 24.13 C ATOM 2476 C ARG A 147 10.222 -3.160 9.932 1.00 43.24 C ATOM 2477 O ARG A 147 10.110 -3.800 10.983 1.00 64.15 O ATOM 2478 CB ARG A 147 11.639 -1.074 9.847 1.00 75.50 C ATOM 2479 CG ARG A 147 13.005 -0.444 9.588 1.00 23.13 C ATOM 2480 CD ARG A 147 13.062 1.009 10.044 1.00 22.02 C ATOM 2481 NE ARG A 147 14.375 1.610 9.798 1.00 13.03 N ATOM 2482 CZ ARG A 147 15.121 2.158 10.718 1.00 73.52 C ATOM 2483 NH1 ARG A 147 14.736 2.194 11.951 1.00 3.21 N ATOM 2484 NH2 ARG A 147 16.260 2.676 10.403 1.00 3.11 N ATOM 0 H ARG A 147 11.831 -1.930 7.520 1.00 42.10 H new ATOM 0 HA ARG A 147 12.358 -3.090 10.069 1.00 24.13 H new ATOM 0 HB2 ARG A 147 10.888 -0.547 9.259 1.00 75.50 H new ATOM 0 HB3 ARG A 147 11.377 -0.936 10.896 1.00 75.50 H new ATOM 0 HG2 ARG A 147 13.773 -1.017 10.108 1.00 23.13 H new ATOM 0 HG3 ARG A 147 13.233 -0.499 8.524 1.00 23.13 H new ATOM 0 HD2 ARG A 147 12.297 1.583 9.522 1.00 22.02 H new ATOM 0 HD3 ARG A 147 12.831 1.064 11.108 1.00 22.02 H new ATOM 0 HE ARG A 147 14.731 1.599 8.842 1.00 13.03 H new ATOM 0 HH11 ARG A 147 13.838 1.791 12.217 1.00 3.21 H new ATOM 0 HH12 ARG A 147 15.330 2.626 12.658 1.00 3.21 H new ATOM 0 HH21 ARG A 147 16.578 2.657 9.434 1.00 3.11 H new ATOM 0 HH22 ARG A 147 16.842 3.104 11.123 1.00 3.11 H new ATOM 2498 N PHE A 148 9.195 -2.944 9.106 1.00 71.15 N ATOM 2499 CA PHE A 148 7.862 -3.499 9.368 1.00 44.41 C ATOM 2500 C PHE A 148 7.913 -5.028 9.534 1.00 4.41 C ATOM 2501 O PHE A 148 7.371 -5.580 10.492 1.00 54.33 O ATOM 2502 CB PHE A 148 6.891 -3.120 8.242 1.00 44.43 C ATOM 2503 CG PHE A 148 5.544 -3.791 8.363 1.00 5.54 C ATOM 2504 CD1 PHE A 148 4.644 -3.403 9.347 1.00 73.14 C ATOM 2505 CD2 PHE A 148 5.183 -4.812 7.495 1.00 41.13 C ATOM 2506 CE1 PHE A 148 3.414 -4.021 9.461 1.00 20.42 C ATOM 2507 CE2 PHE A 148 3.955 -5.432 7.605 1.00 51.11 C ATOM 2508 CZ PHE A 148 3.070 -5.038 8.589 1.00 13.32 C ATOM 0 H PHE A 148 9.259 -2.390 8.252 1.00 71.15 H new ATOM 0 HA PHE A 148 7.503 -3.070 10.304 1.00 44.41 H new ATOM 0 HB2 PHE A 148 6.752 -2.039 8.241 1.00 44.43 H new ATOM 0 HB3 PHE A 148 7.336 -3.385 7.283 1.00 44.43 H new ATOM 0 HD1 PHE A 148 4.909 -2.610 10.030 1.00 73.14 H new ATOM 0 HD2 PHE A 148 5.871 -5.125 6.724 1.00 41.13 H new ATOM 0 HE1 PHE A 148 2.722 -3.711 10.230 1.00 20.42 H new ATOM 0 HE2 PHE A 148 3.686 -6.225 6.922 1.00 51.11 H new ATOM 0 HZ PHE A 148 2.110 -5.524 8.678 1.00 13.32 H new ATOM 2518 N VAL A 149 8.569 -5.703 8.600 1.00 71.32 N ATOM 2519 CA VAL A 149 8.747 -7.155 8.678 1.00 74.52 C ATOM 2520 C VAL A 149 9.347 -7.589 10.031 1.00 72.22 C ATOM 2521 O VAL A 149 8.995 -8.638 10.572 1.00 12.30 O ATOM 2522 CB VAL A 149 9.654 -7.666 7.530 1.00 1.44 C ATOM 2523 CG1 VAL A 149 9.907 -9.167 7.661 1.00 13.32 C ATOM 2524 CG2 VAL A 149 9.037 -7.330 6.171 1.00 64.13 C ATOM 0 H VAL A 149 8.989 -5.272 7.777 1.00 71.32 H new ATOM 0 HA VAL A 149 7.755 -7.597 8.581 1.00 74.52 H new ATOM 0 HB VAL A 149 10.616 -7.159 7.602 1.00 1.44 H new ATOM 0 HG11 VAL A 149 10.546 -9.501 6.844 1.00 13.32 H new ATOM 0 HG12 VAL A 149 10.398 -9.372 8.612 1.00 13.32 H new ATOM 0 HG13 VAL A 149 8.958 -9.701 7.621 1.00 13.32 H new ATOM 0 HG21 VAL A 149 9.687 -7.696 5.376 1.00 64.13 H new ATOM 0 HG22 VAL A 149 8.059 -7.805 6.088 1.00 64.13 H new ATOM 0 HG23 VAL A 149 8.925 -6.250 6.079 1.00 64.13 H new ATOM 2534 N ARG A 150 10.237 -6.774 10.588 1.00 23.12 N ATOM 2535 CA ARG A 150 10.876 -7.105 11.866 1.00 53.45 C ATOM 2536 C ARG A 150 9.910 -6.931 13.053 1.00 41.44 C ATOM 2537 O ARG A 150 9.962 -7.694 14.019 1.00 14.30 O ATOM 2538 CB ARG A 150 12.139 -6.259 12.083 1.00 3.23 C ATOM 2539 CG ARG A 150 13.150 -6.357 10.941 1.00 40.31 C ATOM 2540 CD ARG A 150 14.548 -5.928 11.377 1.00 61.24 C ATOM 2541 NE ARG A 150 15.126 -6.879 12.324 1.00 13.43 N ATOM 2542 CZ ARG A 150 16.164 -6.639 13.076 1.00 1.43 C ATOM 2543 NH1 ARG A 150 16.741 -5.479 13.063 1.00 62.31 N ATOM 2544 NH2 ARG A 150 16.616 -7.567 13.854 1.00 75.24 N ATOM 0 H ARG A 150 10.533 -5.886 10.182 1.00 23.12 H new ATOM 0 HA ARG A 150 11.160 -8.156 11.818 1.00 53.45 H new ATOM 0 HB2 ARG A 150 11.849 -5.216 12.211 1.00 3.23 H new ATOM 0 HB3 ARG A 150 12.620 -6.572 13.010 1.00 3.23 H new ATOM 0 HG2 ARG A 150 13.184 -7.383 10.574 1.00 40.31 H new ATOM 0 HG3 ARG A 150 12.821 -5.732 10.111 1.00 40.31 H new ATOM 0 HD2 ARG A 150 15.194 -5.844 10.503 1.00 61.24 H new ATOM 0 HD3 ARG A 150 14.501 -4.940 11.834 1.00 61.24 H new ATOM 0 HE ARG A 150 14.686 -7.796 12.402 1.00 13.43 H new ATOM 0 HH11 ARG A 150 16.384 -4.739 12.459 1.00 62.31 H new ATOM 0 HH12 ARG A 150 17.552 -5.306 13.657 1.00 62.31 H new ATOM 0 HH21 ARG A 150 16.161 -8.480 13.877 1.00 75.24 H new ATOM 0 HH22 ARG A 150 17.428 -7.387 14.445 1.00 75.24 H new ATOM 2558 N LYS A 151 9.023 -5.936 12.979 1.00 71.34 N ATOM 2559 CA LYS A 151 8.054 -5.694 14.065 1.00 52.21 C ATOM 2560 C LYS A 151 6.865 -6.675 14.017 1.00 43.21 C ATOM 2561 O LYS A 151 6.096 -6.767 14.973 1.00 45.34 O ATOM 2562 CB LYS A 151 7.544 -4.238 14.041 1.00 61.45 C ATOM 2563 CG LYS A 151 6.815 -3.849 12.758 1.00 23.11 C ATOM 2564 CD LYS A 151 6.331 -2.393 12.759 1.00 63.52 C ATOM 2565 CE LYS A 151 5.014 -2.204 13.515 1.00 50.50 C ATOM 2566 NZ LYS A 151 5.151 -2.449 14.976 1.00 15.34 N ATOM 0 H LYS A 151 8.951 -5.290 12.193 1.00 71.34 H new ATOM 0 HA LYS A 151 8.586 -5.866 15.001 1.00 52.21 H new ATOM 0 HB2 LYS A 151 6.873 -4.086 14.887 1.00 61.45 H new ATOM 0 HB3 LYS A 151 8.391 -3.566 14.182 1.00 61.45 H new ATOM 0 HG2 LYS A 151 7.480 -4.004 11.908 1.00 23.11 H new ATOM 0 HG3 LYS A 151 5.960 -4.510 12.618 1.00 23.11 H new ATOM 0 HD2 LYS A 151 7.097 -1.761 13.209 1.00 63.52 H new ATOM 0 HD3 LYS A 151 6.205 -2.057 11.730 1.00 63.52 H new ATOM 0 HE2 LYS A 151 4.649 -1.190 13.353 1.00 50.50 H new ATOM 0 HE3 LYS A 151 4.264 -2.881 13.106 1.00 50.50 H new ATOM 0 HZ1 LYS A 151 4.432 -1.900 15.489 1.00 15.34 H new ATOM 0 HZ2 LYS A 151 5.018 -3.462 15.172 1.00 15.34 H new ATOM 0 HZ3 LYS A 151 6.099 -2.157 15.290 1.00 15.34 H new ATOM 2580 N VAL A 152 6.703 -7.399 12.900 1.00 61.14 N ATOM 2581 CA VAL A 152 5.599 -8.372 12.766 1.00 22.02 C ATOM 2582 C VAL A 152 6.087 -9.827 12.554 1.00 32.33 C ATOM 2583 O VAL A 152 5.690 -10.735 13.282 1.00 2.33 O ATOM 2584 CB VAL A 152 4.620 -7.977 11.622 1.00 33.44 C ATOM 2585 CG1 VAL A 152 3.987 -6.616 11.903 1.00 24.32 C ATOM 2586 CG2 VAL A 152 5.317 -7.973 10.260 1.00 11.24 C ATOM 0 H VAL A 152 7.311 -7.334 12.084 1.00 61.14 H new ATOM 0 HA VAL A 152 5.071 -8.339 13.719 1.00 22.02 H new ATOM 0 HB VAL A 152 3.832 -8.730 11.588 1.00 33.44 H new ATOM 0 HG11 VAL A 152 3.306 -6.357 11.092 1.00 24.32 H new ATOM 0 HG12 VAL A 152 3.434 -6.659 12.842 1.00 24.32 H new ATOM 0 HG13 VAL A 152 4.768 -5.859 11.976 1.00 24.32 H new ATOM 0 HG21 VAL A 152 4.602 -7.693 9.486 1.00 11.24 H new ATOM 0 HG22 VAL A 152 6.137 -7.255 10.273 1.00 11.24 H new ATOM 0 HG23 VAL A 152 5.709 -8.968 10.049 1.00 11.24 H new ATOM 2596 N GLY A 153 6.965 -10.044 11.576 1.00 15.52 N ATOM 2597 CA GLY A 153 7.366 -11.406 11.205 1.00 4.15 C ATOM 2598 C GLY A 153 8.475 -12.005 12.072 1.00 72.13 C ATOM 2599 O GLY A 153 8.987 -13.084 11.769 1.00 60.11 O ATOM 0 H GLY A 153 7.410 -9.306 11.030 1.00 15.52 H new ATOM 0 HA2 GLY A 153 6.492 -12.055 11.258 1.00 4.15 H new ATOM 0 HA3 GLY A 153 7.697 -11.402 10.167 1.00 4.15 H new ATOM 2603 N SER A 154 8.845 -11.322 13.152 1.00 54.50 N ATOM 2604 CA SER A 154 9.901 -11.817 14.058 1.00 11.11 C ATOM 2605 C SER A 154 9.365 -12.032 15.481 1.00 0.11 C ATOM 2606 O SER A 154 10.134 -12.145 16.438 1.00 12.44 O ATOM 2607 CB SER A 154 11.082 -10.835 14.088 1.00 23.00 C ATOM 2608 OG SER A 154 11.665 -10.683 12.798 1.00 32.14 O ATOM 0 H SER A 154 8.438 -10.429 13.428 1.00 54.50 H new ATOM 0 HA SER A 154 10.241 -12.779 13.675 1.00 11.11 H new ATOM 0 HB2 SER A 154 10.742 -9.865 14.451 1.00 23.00 H new ATOM 0 HB3 SER A 154 11.836 -11.192 14.790 1.00 23.00 H new ATOM 0 HG SER A 154 12.412 -10.051 12.849 1.00 32.14 H new ATOM 2614 N LEU A 155 8.043 -12.107 15.613 1.00 32.40 N ATOM 2615 CA LEU A 155 7.395 -12.251 16.923 1.00 32.21 C ATOM 2616 C LEU A 155 7.297 -13.723 17.358 1.00 72.43 C ATOM 2617 O LEU A 155 7.466 -14.638 16.545 1.00 62.41 O ATOM 2618 CB LEU A 155 5.993 -11.626 16.876 1.00 62.10 C ATOM 2619 CG LEU A 155 5.949 -10.165 16.398 1.00 3.02 C ATOM 2620 CD1 LEU A 155 4.514 -9.647 16.359 1.00 40.43 C ATOM 2621 CD2 LEU A 155 6.825 -9.277 17.280 1.00 72.14 C ATOM 0 H LEU A 155 7.393 -12.071 14.828 1.00 32.40 H new ATOM 0 HA LEU A 155 8.010 -11.732 17.658 1.00 32.21 H new ATOM 0 HB2 LEU A 155 5.365 -12.227 16.218 1.00 62.10 H new ATOM 0 HB3 LEU A 155 5.554 -11.680 17.872 1.00 62.10 H new ATOM 0 HG LEU A 155 6.347 -10.130 15.384 1.00 3.02 H new ATOM 0 HD11 LEU A 155 4.510 -8.612 16.018 1.00 40.43 H new ATOM 0 HD12 LEU A 155 3.925 -10.257 15.674 1.00 40.43 H new ATOM 0 HD13 LEU A 155 4.080 -9.702 17.357 1.00 40.43 H new ATOM 0 HD21 LEU A 155 6.777 -8.249 16.922 1.00 72.14 H new ATOM 0 HD22 LEU A 155 6.467 -9.320 18.309 1.00 72.14 H new ATOM 0 HD23 LEU A 155 7.856 -9.628 17.239 1.00 72.14 H new ATOM 2633 N GLU A 156 7.032 -13.946 18.647 1.00 2.43 N ATOM 2634 CA GLU A 156 6.845 -15.302 19.178 1.00 34.50 C ATOM 2635 C GLU A 156 5.540 -15.917 18.650 1.00 51.33 C ATOM 2636 O GLU A 156 5.456 -17.123 18.410 1.00 23.14 O ATOM 2637 CB GLU A 156 6.844 -15.284 20.714 1.00 1.14 C ATOM 2638 CG GLU A 156 8.136 -14.746 21.327 1.00 32.22 C ATOM 2639 CD GLU A 156 8.108 -14.739 22.850 1.00 43.35 C ATOM 2640 OE1 GLU A 156 8.492 -15.762 23.461 1.00 60.12 O ATOM 2641 OE2 GLU A 156 7.701 -13.716 23.443 1.00 43.43 O ATOM 0 H GLU A 156 6.942 -13.207 19.344 1.00 2.43 H new ATOM 0 HA GLU A 156 7.678 -15.918 18.839 1.00 34.50 H new ATOM 0 HB2 GLU A 156 6.008 -14.676 21.060 1.00 1.14 H new ATOM 0 HB3 GLU A 156 6.674 -16.297 21.079 1.00 1.14 H new ATOM 0 HG2 GLU A 156 8.975 -15.353 20.986 1.00 32.22 H new ATOM 0 HG3 GLU A 156 8.309 -13.732 20.967 1.00 32.22 H new ATOM 2648 N HIS A 157 4.524 -15.073 18.481 1.00 51.33 N ATOM 2649 CA HIS A 157 3.265 -15.480 17.853 1.00 30.04 C ATOM 2650 C HIS A 157 3.500 -15.909 16.396 1.00 42.33 C ATOM 2651 O HIS A 157 3.704 -15.070 15.517 1.00 72.33 O ATOM 2652 CB HIS A 157 2.254 -14.322 17.919 1.00 2.52 C ATOM 2653 CG HIS A 157 1.008 -14.539 17.108 1.00 51.13 C ATOM 2654 ND1 HIS A 157 0.711 -13.808 15.978 1.00 54.32 N ATOM 2655 CD2 HIS A 157 -0.022 -15.407 17.267 1.00 54.20 C ATOM 2656 CE1 HIS A 157 -0.436 -14.215 15.478 1.00 51.14 C ATOM 2657 NE2 HIS A 157 -0.905 -15.182 16.238 1.00 42.54 N ATOM 0 H HIS A 157 4.547 -14.096 18.772 1.00 51.33 H new ATOM 0 HA HIS A 157 2.861 -16.335 18.395 1.00 30.04 H new ATOM 0 HB2 HIS A 157 1.972 -14.161 18.960 1.00 2.52 H new ATOM 0 HB3 HIS A 157 2.742 -13.410 17.576 1.00 2.52 H new ATOM 0 HD2 HIS A 157 -0.128 -16.138 18.055 1.00 54.20 H new ATOM 0 HE1 HIS A 157 -0.913 -13.822 14.592 1.00 51.14 H new ATOM 0 HE2 HIS A 157 -1.781 -15.683 16.088 1.00 42.54 H new ATOM 2666 N HIS A 158 3.478 -17.218 16.148 1.00 13.15 N ATOM 2667 CA HIS A 158 3.770 -17.756 14.815 1.00 4.55 C ATOM 2668 C HIS A 158 2.783 -17.238 13.759 1.00 34.54 C ATOM 2669 O HIS A 158 1.564 -17.306 13.936 1.00 52.32 O ATOM 2670 CB HIS A 158 3.756 -19.290 14.834 1.00 41.03 C ATOM 2671 CG HIS A 158 4.085 -19.910 13.504 1.00 72.34 C ATOM 2672 ND1 HIS A 158 5.368 -19.991 13.012 1.00 55.10 N ATOM 2673 CD2 HIS A 158 3.290 -20.471 12.557 1.00 45.32 C ATOM 2674 CE1 HIS A 158 5.351 -20.570 11.827 1.00 22.44 C ATOM 2675 NE2 HIS A 158 4.106 -20.871 11.528 1.00 51.15 N ATOM 0 H HIS A 158 3.262 -17.926 16.849 1.00 13.15 H new ATOM 0 HA HIS A 158 4.767 -17.410 14.542 1.00 4.55 H new ATOM 0 HB2 HIS A 158 4.471 -19.643 15.577 1.00 41.03 H new ATOM 0 HB3 HIS A 158 2.771 -19.632 15.152 1.00 41.03 H new ATOM 0 HD2 HIS A 158 2.217 -20.582 12.604 1.00 45.32 H new ATOM 0 HE1 HIS A 158 6.214 -20.764 11.207 1.00 22.44 H new ATOM 0 HE2 HIS A 158 3.797 -21.328 10.670 1.00 51.15 H new ATOM 2684 N HIS A 159 3.325 -16.730 12.659 1.00 74.11 N ATOM 2685 CA HIS A 159 2.517 -16.221 11.554 1.00 23.23 C ATOM 2686 C HIS A 159 1.817 -17.362 10.802 1.00 42.52 C ATOM 2687 O HIS A 159 2.467 -18.231 10.225 1.00 21.13 O ATOM 2688 CB HIS A 159 3.401 -15.414 10.595 1.00 2.11 C ATOM 2689 CG HIS A 159 2.674 -14.898 9.390 1.00 32.43 C ATOM 2690 ND1 HIS A 159 3.132 -15.069 8.105 1.00 73.24 N ATOM 2691 CD2 HIS A 159 1.517 -14.206 9.281 1.00 62.43 C ATOM 2692 CE1 HIS A 159 2.292 -14.508 7.261 1.00 74.44 C ATOM 2693 NE2 HIS A 159 1.302 -13.974 7.946 1.00 24.14 N ATOM 0 H HIS A 159 4.331 -16.659 12.506 1.00 74.11 H new ATOM 0 HA HIS A 159 1.744 -15.572 11.965 1.00 23.23 H new ATOM 0 HB2 HIS A 159 3.832 -14.572 11.136 1.00 2.11 H new ATOM 0 HB3 HIS A 159 4.230 -16.040 10.267 1.00 2.11 H new ATOM 0 HD2 HIS A 159 0.880 -13.894 10.095 1.00 62.43 H new ATOM 0 HE1 HIS A 159 2.397 -14.489 6.186 1.00 74.44 H new ATOM 0 HE2 HIS A 159 0.508 -13.472 7.550 1.00 24.14 H new ATOM 2702 N HIS A 160 0.487 -17.350 10.816 1.00 61.24 N ATOM 2703 CA HIS A 160 -0.308 -18.367 10.120 1.00 22.32 C ATOM 2704 C HIS A 160 -0.443 -18.045 8.620 1.00 61.41 C ATOM 2705 O HIS A 160 -0.089 -16.954 8.175 1.00 60.13 O ATOM 2706 CB HIS A 160 -1.703 -18.464 10.751 1.00 14.14 C ATOM 2707 CG HIS A 160 -1.687 -18.669 12.237 1.00 14.43 C ATOM 2708 ND1 HIS A 160 -2.340 -17.835 13.116 1.00 15.31 N ATOM 2709 CD2 HIS A 160 -1.107 -19.629 12.999 1.00 13.24 C ATOM 2710 CE1 HIS A 160 -2.164 -18.267 14.345 1.00 72.35 C ATOM 2711 NE2 HIS A 160 -1.422 -19.354 14.306 1.00 63.33 N ATOM 0 H HIS A 160 -0.068 -16.646 11.303 1.00 61.24 H new ATOM 0 HA HIS A 160 0.209 -19.321 10.220 1.00 22.32 H new ATOM 0 HB2 HIS A 160 -2.257 -17.552 10.526 1.00 14.14 H new ATOM 0 HB3 HIS A 160 -2.244 -19.288 10.287 1.00 14.14 H new ATOM 0 HD2 HIS A 160 -0.509 -20.455 12.644 1.00 13.24 H new ATOM 0 HE1 HIS A 160 -2.562 -17.807 15.238 1.00 72.35 H new ATOM 0 HE2 HIS A 160 -1.129 -19.902 15.115 1.00 63.33 H new ATOM 2720 N HIS A 161 -0.965 -18.998 7.845 1.00 13.41 N ATOM 2721 CA HIS A 161 -1.276 -18.753 6.427 1.00 64.25 C ATOM 2722 C HIS A 161 -2.539 -17.885 6.298 1.00 31.12 C ATOM 2723 O HIS A 161 -2.682 -17.102 5.354 1.00 3.41 O ATOM 2724 CB HIS A 161 -1.469 -20.078 5.673 1.00 1.22 C ATOM 2725 CG HIS A 161 -0.206 -20.867 5.486 1.00 72.11 C ATOM 2726 ND1 HIS A 161 0.682 -21.122 6.506 1.00 25.43 N ATOM 2727 CD2 HIS A 161 0.322 -21.455 4.384 1.00 3.12 C ATOM 2728 CE1 HIS A 161 1.695 -21.826 6.045 1.00 40.31 C ATOM 2729 NE2 HIS A 161 1.503 -22.041 4.763 1.00 14.24 N ATOM 0 H HIS A 161 -1.181 -19.941 8.168 1.00 13.41 H new ATOM 0 HA HIS A 161 -0.434 -18.222 5.982 1.00 64.25 H new ATOM 0 HB2 HIS A 161 -2.190 -20.690 6.215 1.00 1.22 H new ATOM 0 HB3 HIS A 161 -1.901 -19.867 4.695 1.00 1.22 H new ATOM 0 HD2 HIS A 161 -0.107 -21.461 3.393 1.00 3.12 H new ATOM 0 HE1 HIS A 161 2.541 -22.169 6.623 1.00 40.31 H new ATOM 0 HE2 HIS A 161 2.131 -22.560 4.149 1.00 14.24 H new ATOM 2738 N HIS A 162 -3.445 -18.039 7.265 1.00 41.51 N ATOM 2739 CA HIS A 162 -4.683 -17.247 7.334 1.00 54.22 C ATOM 2740 C HIS A 162 -4.695 -16.343 8.589 1.00 15.41 C ATOM 2741 O HIS A 162 -5.037 -16.843 9.689 1.00 37.58 O ATOM 2742 CB HIS A 162 -5.902 -18.188 7.332 1.00 71.02 C ATOM 2743 CG HIS A 162 -7.220 -17.483 7.445 1.00 35.51 C ATOM 2744 ND1 HIS A 162 -7.824 -17.209 8.652 1.00 1.15 N ATOM 2745 CD2 HIS A 162 -8.062 -17.013 6.494 1.00 43.43 C ATOM 2746 CE1 HIS A 162 -8.976 -16.608 8.441 1.00 1.20 C ATOM 2747 NE2 HIS A 162 -9.144 -16.474 7.143 1.00 62.45 N ATOM 2748 OXT HIS A 162 -4.356 -15.146 8.470 1.00 37.58 O ATOM 0 H HIS A 162 -3.345 -18.714 8.023 1.00 41.51 H new ATOM 0 HA HIS A 162 -4.731 -16.599 6.459 1.00 54.22 H new ATOM 0 HB2 HIS A 162 -5.893 -18.774 6.413 1.00 71.02 H new ATOM 0 HB3 HIS A 162 -5.806 -18.891 8.159 1.00 71.02 H new ATOM 0 HD2 HIS A 162 -7.910 -17.055 5.426 1.00 43.43 H new ATOM 0 HE1 HIS A 162 -9.666 -16.280 9.204 1.00 1.20 H new ATOM 0 HE2 HIS A 162 -9.949 -16.039 6.692 1.00 62.45 H new TER 2757 HIS A 162