USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 738 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 160 SER OG : rot -165:sc= 1.58 USER MOD Set 1.2: A 163 SER OG : rot 84:sc= 1.1 USER MOD Set 2.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 118 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 89 HIS : no HD1:sc= -0.432 X(o=-0.48,f=-0.3) USER MOD Set 3.2: A 91 HIS : no HD1:sc= -0.048 X(o=-0.48,f=-0.3) USER MOD Set 4.1: A 86 HIS :FLIP no HD1:sc= -0.0485 F(o=-0.71,f=-0.06) USER MOD Set 4.2: A 88 HIS : no HD1:sc= -0.0116 X(o=-0.06,f=-0.06) USER MOD Set 5.1: A 83 HIS : no HD1:sc= -0.131 X(o=-0.25,f=0) USER MOD Set 5.2: A 85 HIS : no HD1:sc= -0.119 X(o=-0.25,f=0) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 87 HIS : no HD1:sc=-0.00824 X(o=-0.0082,f=0) USER MOD Single : A 90 HIS : no HD1:sc=-0.00966 X(o=-0.0097,f=-0.056) USER MOD Single : A 92 SER OG : rot -48:sc= 0.325 USER MOD Single : A 93 SER OG : rot 98:sc= 0.31 USER MOD Single : A 95 HIS : no HE2:sc= 1.13 K(o=1.1,f=-3.5!) USER MOD Single : A 100 HIS : no HE2:sc= 0.574 K(o=0.57,f=-3.1!) USER MOD Single : A 101 MET CE :methyl -158:sc= -0.344 (180deg=-0.437) USER MOD Single : A 106 TYR OH : rot 19:sc= 0.991 USER MOD Single : A 107 CYS SG : rot 180:sc= -0.624 USER MOD Single : A 113 SER OG : rot 180:sc= -0.0858 USER MOD Single : A 116 THR OG1 : rot 29:sc= 1.03 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 128 HIS : no HD1:sc= -0.0944 X(o=-0.094,f=-0.0052) USER MOD Single : A 129 ASN : amide:sc= -0.0209 K(o=-0.021,f=-0.75) USER MOD Single : A 134 CYS SG : rot 160:sc= -1.78 USER MOD Single : A 138 SER OG : rot -83:sc= 1.22 USER MOD Single : A 145 SER OG : rot 150:sc= -0.336 USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 149 TYR OH : rot 13:sc= 1.32 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0.329 K(o=0.33,f=-4.6!) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 164 TYR OH : rot 158:sc= 0.844 USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 176 GLN : amide:sc= 1.08 K(o=1.1,f=-4.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 80 29.854 -26.173 -0.202 1.00 25.00 N ATOM 2 CA MET A 80 29.737 -25.191 -1.310 1.00 25.00 C ATOM 3 C MET A 80 28.416 -24.438 -1.324 1.00 25.00 C ATOM 4 O MET A 80 27.351 -24.970 -1.096 1.00 25.00 O ATOM 5 CB MET A 80 29.912 -25.914 -2.660 1.00 25.00 C ATOM 6 CG MET A 80 31.328 -26.497 -2.811 1.00 25.00 C ATOM 7 SD MET A 80 32.606 -25.197 -2.828 1.00 25.00 S ATOM 8 CE MET A 80 34.105 -26.213 -3.034 1.00 25.00 C ATOM 0 HA MET A 80 30.523 -24.453 -1.149 1.00 25.00 H new ATOM 0 HB2 MET A 80 29.177 -26.715 -2.742 1.00 25.00 H new ATOM 0 HB3 MET A 80 29.716 -25.217 -3.475 1.00 25.00 H new ATOM 0 HG2 MET A 80 31.525 -27.188 -1.991 1.00 25.00 H new ATOM 0 HG3 MET A 80 31.386 -27.074 -3.734 1.00 25.00 H new ATOM 0 HE1 MET A 80 34.982 -25.566 -3.064 1.00 25.00 H new ATOM 0 HE2 MET A 80 34.193 -26.905 -2.197 1.00 25.00 H new ATOM 0 HE3 MET A 80 34.038 -26.776 -3.965 1.00 25.00 H new ATOM 18 N GLY A 81 28.496 -23.138 -1.622 1.00 25.00 N ATOM 19 CA GLY A 81 27.327 -22.281 -1.695 1.00 25.00 C ATOM 20 C GLY A 81 27.732 -20.940 -2.263 1.00 25.00 C ATOM 21 O GLY A 81 28.923 -20.665 -2.393 1.00 25.00 O ATOM 0 H GLY A 81 29.375 -22.658 -1.818 1.00 25.00 H new ATOM 0 HA2 GLY A 81 26.563 -22.740 -2.322 1.00 25.00 H new ATOM 0 HA3 GLY A 81 26.892 -22.154 -0.704 1.00 25.00 H new ATOM 25 N HIS A 82 26.762 -20.118 -2.626 1.00 25.00 N ATOM 26 CA HIS A 82 27.049 -18.808 -3.202 1.00 25.00 C ATOM 27 C HIS A 82 27.452 -17.826 -2.106 1.00 25.00 C ATOM 28 O HIS A 82 26.826 -17.779 -1.047 1.00 25.00 O ATOM 29 CB HIS A 82 25.814 -18.273 -3.929 1.00 25.00 C ATOM 30 CG HIS A 82 25.334 -19.164 -5.035 1.00 25.00 C ATOM 31 ND1 HIS A 82 24.028 -19.245 -5.451 1.00 25.00 N ATOM 32 CD2 HIS A 82 26.013 -20.036 -5.831 1.00 25.00 C ATOM 33 CE1 HIS A 82 23.962 -20.133 -6.440 1.00 25.00 C ATOM 34 NE2 HIS A 82 25.142 -20.650 -6.709 1.00 25.00 N ATOM 0 H HIS A 82 25.769 -20.331 -2.534 1.00 25.00 H new ATOM 0 HA HIS A 82 27.871 -18.914 -3.910 1.00 25.00 H new ATOM 0 HB2 HIS A 82 25.008 -18.138 -3.207 1.00 25.00 H new ATOM 0 HB3 HIS A 82 26.042 -17.289 -4.340 1.00 25.00 H new ATOM 0 HD2 HIS A 82 27.076 -20.220 -5.783 1.00 25.00 H new ATOM 0 HE1 HIS A 82 23.052 -20.397 -6.958 1.00 25.00 H new ATOM 0 HE2 HIS A 82 25.365 -21.353 -7.414 1.00 25.00 H new ATOM 42 N HIS A 83 28.464 -17.018 -2.380 1.00 25.00 N ATOM 43 CA HIS A 83 28.901 -15.980 -1.457 1.00 25.00 C ATOM 44 C HIS A 83 29.518 -14.884 -2.308 1.00 25.00 C ATOM 45 O HIS A 83 29.933 -15.149 -3.435 1.00 25.00 O ATOM 46 CB HIS A 83 29.927 -16.528 -0.463 1.00 25.00 C ATOM 47 CG HIS A 83 29.991 -15.748 0.813 1.00 25.00 C ATOM 48 ND1 HIS A 83 29.159 -15.956 1.883 1.00 25.00 N ATOM 49 CD2 HIS A 83 30.806 -14.723 1.192 1.00 25.00 C ATOM 50 CE1 HIS A 83 29.483 -15.087 2.836 1.00 25.00 C ATOM 51 NE2 HIS A 83 30.475 -14.305 2.466 1.00 25.00 N ATOM 0 H HIS A 83 29.004 -17.062 -3.244 1.00 25.00 H new ATOM 0 HA HIS A 83 28.063 -15.603 -0.870 1.00 25.00 H new ATOM 0 HB2 HIS A 83 29.683 -17.565 -0.235 1.00 25.00 H new ATOM 0 HB3 HIS A 83 30.912 -16.528 -0.931 1.00 25.00 H new ATOM 0 HD2 HIS A 83 31.594 -14.300 0.586 1.00 25.00 H new ATOM 0 HE1 HIS A 83 28.992 -15.030 3.796 1.00 25.00 H new ATOM 0 HE2 HIS A 83 30.906 -13.553 3.004 1.00 25.00 H new ATOM 59 N HIS A 84 29.566 -13.666 -1.792 1.00 25.00 N ATOM 60 CA HIS A 84 30.108 -12.539 -2.540 1.00 25.00 C ATOM 61 C HIS A 84 31.114 -11.808 -1.672 1.00 25.00 C ATOM 62 O HIS A 84 30.859 -11.567 -0.501 1.00 25.00 O ATOM 63 CB HIS A 84 28.982 -11.588 -2.952 1.00 25.00 C ATOM 64 CG HIS A 84 27.899 -12.253 -3.743 1.00 25.00 C ATOM 65 ND1 HIS A 84 26.646 -12.537 -3.256 1.00 25.00 N ATOM 66 CD2 HIS A 84 27.891 -12.714 -5.025 1.00 25.00 C ATOM 67 CE1 HIS A 84 25.951 -13.134 -4.220 1.00 25.00 C ATOM 68 NE2 HIS A 84 26.660 -13.267 -5.321 1.00 25.00 N ATOM 0 H HIS A 84 29.236 -13.431 -0.856 1.00 25.00 H new ATOM 0 HA HIS A 84 30.599 -12.904 -3.442 1.00 25.00 H new ATOM 0 HB2 HIS A 84 28.547 -11.143 -2.057 1.00 25.00 H new ATOM 0 HB3 HIS A 84 29.403 -10.773 -3.541 1.00 25.00 H new ATOM 0 HD2 HIS A 84 28.724 -12.656 -5.709 1.00 25.00 H new ATOM 0 HE1 HIS A 84 24.930 -13.469 -4.113 1.00 25.00 H new ATOM 0 HE2 HIS A 84 26.365 -13.687 -6.202 1.00 25.00 H new ATOM 76 N HIS A 85 32.248 -11.451 -2.256 1.00 25.00 N ATOM 77 CA HIS A 85 33.328 -10.780 -1.529 1.00 25.00 C ATOM 78 C HIS A 85 33.618 -9.442 -2.198 1.00 25.00 C ATOM 79 O HIS A 85 34.727 -8.926 -2.121 1.00 25.00 O ATOM 80 CB HIS A 85 34.577 -11.665 -1.551 1.00 25.00 C ATOM 81 CG HIS A 85 34.302 -13.096 -1.205 1.00 25.00 C ATOM 82 ND1 HIS A 85 34.246 -14.117 -2.121 1.00 25.00 N ATOM 83 CD2 HIS A 85 34.050 -13.686 -0.003 1.00 25.00 C ATOM 84 CE1 HIS A 85 33.969 -15.244 -1.472 1.00 25.00 C ATOM 85 NE2 HIS A 85 33.840 -15.040 -0.178 1.00 25.00 N ATOM 0 H HIS A 85 32.450 -11.615 -3.242 1.00 25.00 H new ATOM 0 HA HIS A 85 33.035 -10.608 -0.493 1.00 25.00 H new ATOM 0 HB2 HIS A 85 35.027 -11.619 -2.543 1.00 25.00 H new ATOM 0 HB3 HIS A 85 35.309 -11.264 -0.850 1.00 25.00 H new ATOM 0 HD2 HIS A 85 34.019 -13.171 0.946 1.00 25.00 H new ATOM 0 HE1 HIS A 85 33.863 -16.208 -1.948 1.00 25.00 H new ATOM 0 HE2 HIS A 85 33.630 -15.733 0.541 1.00 25.00 H new ATOM 93 N HIS A 86 32.603 -8.951 -2.910 1.00 25.00 N ATOM 94 CA HIS A 86 32.702 -7.785 -3.802 1.00 25.00 C ATOM 95 C HIS A 86 33.636 -8.124 -4.973 1.00 25.00 C ATOM 96 O HIS A 86 34.198 -9.215 -5.033 1.00 25.00 O ATOM 97 CB HIS A 86 33.161 -6.522 -3.049 1.00 25.00 C ATOM 98 CG HIS A 86 32.640 -5.247 -3.641 1.00 25.00 C ATOM 99 ND1 HIS A 86 33.223 -4.361 -4.497 1.00 25.00 N flip ATOM 100 CD2 HIS A 86 31.392 -4.733 -3.392 1.00 25.00 C flip ATOM 101 CE1 HIS A 86 32.347 -3.332 -4.777 1.00 25.00 C flip ATOM 102 NE2 HIS A 86 31.264 -3.603 -4.081 1.00 25.00 N flip ATOM 0 H HIS A 86 31.668 -9.358 -2.885 1.00 25.00 H new ATOM 0 HA HIS A 86 31.711 -7.557 -4.195 1.00 25.00 H new ATOM 0 HB2 HIS A 86 32.836 -6.590 -2.011 1.00 25.00 H new ATOM 0 HB3 HIS A 86 34.251 -6.490 -3.041 1.00 25.00 H new ATOM 0 HD2 HIS A 86 30.644 -5.171 -2.748 1.00 25.00 H new ATOM 0 HE1 HIS A 86 32.514 -2.486 -5.427 1.00 25.00 H new ATOM 0 HE2 HIS A 86 30.429 -3.018 -4.071 1.00 25.00 H new ATOM 110 N HIS A 87 33.750 -7.218 -5.933 1.00 25.00 N ATOM 111 CA HIS A 87 34.591 -7.440 -7.104 1.00 25.00 C ATOM 112 C HIS A 87 35.383 -6.174 -7.368 1.00 25.00 C ATOM 113 O HIS A 87 34.843 -5.076 -7.283 1.00 25.00 O ATOM 114 CB HIS A 87 33.734 -7.772 -8.330 1.00 25.00 C ATOM 115 CG HIS A 87 32.880 -8.992 -8.159 1.00 25.00 C ATOM 116 ND1 HIS A 87 31.532 -9.033 -8.415 1.00 25.00 N ATOM 117 CD2 HIS A 87 33.200 -10.251 -7.748 1.00 25.00 C ATOM 118 CE1 HIS A 87 31.097 -10.264 -8.158 1.00 25.00 C ATOM 119 NE2 HIS A 87 32.070 -11.047 -7.740 1.00 25.00 N ATOM 0 H HIS A 87 33.269 -6.318 -5.925 1.00 25.00 H new ATOM 0 HA HIS A 87 35.260 -8.280 -6.917 1.00 25.00 H new ATOM 0 HB2 HIS A 87 33.093 -6.920 -8.555 1.00 25.00 H new ATOM 0 HB3 HIS A 87 34.388 -7.915 -9.191 1.00 25.00 H new ATOM 0 HD2 HIS A 87 34.191 -10.579 -7.469 1.00 25.00 H new ATOM 0 HE1 HIS A 87 30.072 -10.582 -8.278 1.00 25.00 H new ATOM 0 HE2 HIS A 87 32.004 -12.028 -7.469 1.00 25.00 H new ATOM 127 N HIS A 88 36.654 -6.335 -7.699 1.00 25.00 N ATOM 128 CA HIS A 88 37.527 -5.212 -8.012 1.00 25.00 C ATOM 129 C HIS A 88 38.348 -5.632 -9.222 1.00 25.00 C ATOM 130 O HIS A 88 38.487 -6.825 -9.485 1.00 25.00 O ATOM 131 CB HIS A 88 38.430 -4.890 -6.817 1.00 25.00 C ATOM 132 CG HIS A 88 37.673 -4.518 -5.578 1.00 25.00 C ATOM 133 ND1 HIS A 88 37.049 -3.310 -5.385 1.00 25.00 N ATOM 134 CD2 HIS A 88 37.428 -5.227 -4.441 1.00 25.00 C ATOM 135 CE1 HIS A 88 36.469 -3.328 -4.188 1.00 25.00 C ATOM 136 NE2 HIS A 88 36.666 -4.474 -3.569 1.00 25.00 N ATOM 0 H HIS A 88 37.110 -7.245 -7.759 1.00 25.00 H new ATOM 0 HA HIS A 88 36.956 -4.309 -8.227 1.00 25.00 H new ATOM 0 HB2 HIS A 88 39.058 -5.755 -6.603 1.00 25.00 H new ATOM 0 HB3 HIS A 88 39.096 -4.070 -7.086 1.00 25.00 H new ATOM 0 HD2 HIS A 88 37.778 -6.231 -4.249 1.00 25.00 H new ATOM 0 HE1 HIS A 88 35.906 -2.504 -3.775 1.00 25.00 H new ATOM 0 HE2 HIS A 88 36.329 -4.746 -2.646 1.00 25.00 H new ATOM 144 N HIS A 89 38.855 -4.666 -9.970 1.00 25.00 N ATOM 145 CA HIS A 89 39.610 -4.938 -11.188 1.00 25.00 C ATOM 146 C HIS A 89 40.778 -3.972 -11.222 1.00 25.00 C ATOM 147 O HIS A 89 40.598 -2.789 -10.960 1.00 25.00 O ATOM 148 CB HIS A 89 38.710 -4.733 -12.407 1.00 25.00 C ATOM 149 CG HIS A 89 39.421 -4.884 -13.714 1.00 25.00 C ATOM 150 ND1 HIS A 89 40.063 -3.860 -14.366 1.00 25.00 N ATOM 151 CD2 HIS A 89 39.580 -5.970 -14.517 1.00 25.00 C ATOM 152 CE1 HIS A 89 40.564 -4.338 -15.497 1.00 25.00 C ATOM 153 NE2 HIS A 89 40.308 -5.623 -15.637 1.00 25.00 N ATOM 0 H HIS A 89 38.757 -3.674 -9.754 1.00 25.00 H new ATOM 0 HA HIS A 89 39.971 -5.966 -11.205 1.00 25.00 H new ATOM 0 HB2 HIS A 89 37.889 -5.449 -12.366 1.00 25.00 H new ATOM 0 HB3 HIS A 89 38.268 -3.738 -12.357 1.00 25.00 H new ATOM 0 HD2 HIS A 89 39.194 -6.957 -14.309 1.00 25.00 H new ATOM 0 HE1 HIS A 89 41.114 -3.747 -16.215 1.00 25.00 H new ATOM 0 HE2 HIS A 89 40.588 -6.230 -16.407 1.00 25.00 H new ATOM 161 N HIS A 90 41.973 -4.482 -11.499 1.00 25.00 N ATOM 162 CA HIS A 90 43.188 -3.668 -11.404 1.00 25.00 C ATOM 163 C HIS A 90 44.063 -3.655 -12.656 1.00 25.00 C ATOM 164 O HIS A 90 45.109 -3.014 -12.670 1.00 25.00 O ATOM 165 CB HIS A 90 44.018 -4.159 -10.216 1.00 0.00 C ATOM 166 CG HIS A 90 43.223 -4.309 -8.957 1.00 25.00 C ATOM 167 ND1 HIS A 90 43.104 -5.480 -8.249 1.00 25.00 N ATOM 168 CD2 HIS A 90 42.476 -3.403 -8.267 1.00 25.00 C ATOM 169 CE1 HIS A 90 42.318 -5.254 -7.201 1.00 25.00 C ATOM 170 NE2 HIS A 90 41.900 -4.005 -7.166 1.00 25.00 N ATOM 0 H HIS A 90 42.130 -5.447 -11.789 1.00 25.00 H new ATOM 0 HA HIS A 90 42.849 -2.640 -11.276 1.00 25.00 H new ATOM 0 HB2 HIS A 90 44.468 -5.119 -10.469 1.00 0.00 H new ATOM 0 HB3 HIS A 90 44.835 -3.460 -10.040 1.00 0.00 H new ATOM 0 HD2 HIS A 90 42.352 -2.366 -8.541 1.00 25.00 H new ATOM 0 HE1 HIS A 90 42.054 -6.002 -6.468 1.00 25.00 H new ATOM 0 HE2 HIS A 90 41.284 -3.576 -6.475 1.00 25.00 H new ATOM 178 N HIS A 91 43.665 -4.349 -13.711 1.00 25.00 N ATOM 179 CA HIS A 91 44.472 -4.332 -14.928 1.00 25.00 C ATOM 180 C HIS A 91 44.373 -2.939 -15.547 1.00 25.00 C ATOM 181 O HIS A 91 43.322 -2.305 -15.478 1.00 25.00 O ATOM 182 CB HIS A 91 44.006 -5.399 -15.919 1.00 25.00 C ATOM 183 CG HIS A 91 44.027 -6.785 -15.357 1.00 25.00 C ATOM 184 ND1 HIS A 91 45.170 -7.475 -15.036 1.00 25.00 N ATOM 185 CD2 HIS A 91 43.005 -7.632 -15.050 1.00 25.00 C ATOM 186 CE1 HIS A 91 44.816 -8.665 -14.558 1.00 25.00 C ATOM 187 NE2 HIS A 91 43.508 -8.813 -14.539 1.00 25.00 N ATOM 0 H HIS A 91 42.817 -4.915 -13.755 1.00 25.00 H new ATOM 0 HA HIS A 91 45.509 -4.560 -14.681 1.00 25.00 H new ATOM 0 HB2 HIS A 91 42.993 -5.163 -16.245 1.00 25.00 H new ATOM 0 HB3 HIS A 91 44.642 -5.364 -16.804 1.00 25.00 H new ATOM 0 HD2 HIS A 91 41.956 -7.413 -15.186 1.00 25.00 H new ATOM 0 HE1 HIS A 91 45.516 -9.418 -14.226 1.00 25.00 H new ATOM 0 HE2 HIS A 91 42.980 -9.624 -14.217 1.00 25.00 H new ATOM 195 N SER A 92 45.483 -2.475 -16.115 1.00 25.00 N ATOM 196 CA SER A 92 45.595 -1.139 -16.723 1.00 25.00 C ATOM 197 C SER A 92 45.362 0.014 -15.732 1.00 25.00 C ATOM 198 O SER A 92 44.941 1.104 -16.122 1.00 25.00 O ATOM 199 CB SER A 92 44.656 -1.008 -17.933 1.00 25.00 C ATOM 200 OG SER A 92 45.029 0.090 -18.746 1.00 25.00 O ATOM 0 H SER A 92 46.345 -3.018 -16.170 1.00 25.00 H new ATOM 0 HA SER A 92 46.629 -1.049 -17.056 1.00 25.00 H new ATOM 0 HB2 SER A 92 44.683 -1.926 -18.520 1.00 25.00 H new ATOM 0 HB3 SER A 92 43.630 -0.879 -17.590 1.00 25.00 H new ATOM 0 HG SER A 92 45.166 0.881 -18.184 1.00 25.00 H new ATOM 206 N SER A 93 45.675 -0.212 -14.463 1.00 25.00 N ATOM 207 CA SER A 93 45.607 0.852 -13.458 1.00 25.00 C ATOM 208 C SER A 93 46.900 1.661 -13.505 1.00 25.00 C ATOM 209 O SER A 93 47.896 1.216 -14.070 1.00 25.00 O ATOM 210 CB SER A 93 45.438 0.264 -12.059 1.00 25.00 C ATOM 211 OG SER A 93 44.251 -0.500 -11.986 1.00 25.00 O ATOM 0 H SER A 93 45.978 -1.117 -14.102 1.00 25.00 H new ATOM 0 HA SER A 93 44.749 1.488 -13.676 1.00 25.00 H new ATOM 0 HB2 SER A 93 46.296 -0.362 -11.814 1.00 25.00 H new ATOM 0 HB3 SER A 93 45.408 1.066 -11.322 1.00 25.00 H new ATOM 0 HG SER A 93 44.465 -1.449 -12.108 1.00 25.00 H new ATOM 217 N GLY A 94 46.898 2.834 -12.890 1.00 25.00 N ATOM 218 CA GLY A 94 48.105 3.641 -12.838 1.00 25.00 C ATOM 219 C GLY A 94 49.067 3.125 -11.785 1.00 25.00 C ATOM 220 O GLY A 94 48.710 3.015 -10.617 1.00 25.00 O ATOM 0 H GLY A 94 46.086 3.243 -12.427 1.00 25.00 H new ATOM 0 HA2 GLY A 94 48.592 3.634 -13.813 1.00 25.00 H new ATOM 0 HA3 GLY A 94 47.844 4.676 -12.619 1.00 25.00 H new ATOM 224 N HIS A 95 50.290 2.819 -12.192 1.00 25.00 N ATOM 225 CA HIS A 95 51.320 2.339 -11.272 1.00 25.00 C ATOM 226 C HIS A 95 52.139 3.517 -10.748 1.00 25.00 C ATOM 227 O HIS A 95 53.046 4.014 -11.424 1.00 25.00 O ATOM 228 CB HIS A 95 52.236 1.340 -11.986 1.00 25.00 C ATOM 229 CG HIS A 95 51.593 0.011 -12.242 1.00 25.00 C ATOM 230 ND1 HIS A 95 51.959 -1.151 -11.615 1.00 25.00 N ATOM 231 CD2 HIS A 95 50.572 -0.345 -13.074 1.00 25.00 C ATOM 232 CE1 HIS A 95 51.186 -2.133 -12.065 1.00 25.00 C ATOM 233 NE2 HIS A 95 50.318 -1.699 -12.959 1.00 25.00 N ATOM 0 H HIS A 95 50.599 2.894 -13.161 1.00 25.00 H new ATOM 0 HA HIS A 95 50.840 1.839 -10.431 1.00 25.00 H new ATOM 0 HB2 HIS A 95 52.556 1.768 -12.936 1.00 25.00 H new ATOM 0 HB3 HIS A 95 53.133 1.190 -11.386 1.00 25.00 H new ATOM 0 HD1 HIS A 95 52.700 -1.246 -10.920 1.00 25.00 H new ATOM 0 HD2 HIS A 95 50.040 0.332 -13.727 1.00 25.00 H new ATOM 0 HE1 HIS A 95 51.259 -3.160 -11.739 1.00 25.00 H new ATOM 241 N ILE A 96 51.810 3.980 -9.550 1.00 25.00 N ATOM 242 CA ILE A 96 52.519 5.105 -8.926 1.00 25.00 C ATOM 243 C ILE A 96 53.679 4.523 -8.104 1.00 25.00 C ATOM 244 O ILE A 96 53.708 4.593 -6.883 1.00 25.00 O ATOM 245 CB ILE A 96 51.567 5.985 -8.040 1.00 25.00 C ATOM 246 CG1 ILE A 96 50.294 6.364 -8.827 1.00 25.00 C ATOM 247 CG2 ILE A 96 52.271 7.303 -7.603 1.00 25.00 C ATOM 248 CD1 ILE A 96 49.037 5.612 -8.372 1.00 25.00 C ATOM 0 H ILE A 96 51.054 3.596 -8.983 1.00 25.00 H new ATOM 0 HA ILE A 96 52.901 5.773 -9.698 1.00 25.00 H new ATOM 0 HB ILE A 96 51.308 5.396 -7.161 1.00 25.00 H new ATOM 0 HG12 ILE A 96 50.121 7.435 -8.726 1.00 25.00 H new ATOM 0 HG13 ILE A 96 50.461 6.166 -9.886 1.00 25.00 H new ATOM 0 HG21 ILE A 96 51.590 7.894 -6.991 1.00 25.00 H new ATOM 0 HG22 ILE A 96 53.164 7.064 -7.025 1.00 25.00 H new ATOM 0 HG23 ILE A 96 52.553 7.875 -8.487 1.00 25.00 H new ATOM 0 HD11 ILE A 96 48.185 5.932 -8.971 1.00 25.00 H new ATOM 0 HD12 ILE A 96 49.188 4.540 -8.499 1.00 25.00 H new ATOM 0 HD13 ILE A 96 48.844 5.829 -7.321 1.00 25.00 H new ATOM 260 N GLU A 97 54.597 3.876 -8.805 1.00 25.00 N ATOM 261 CA GLU A 97 55.721 3.177 -8.172 1.00 25.00 C ATOM 262 C GLU A 97 56.980 4.047 -8.179 1.00 25.00 C ATOM 263 O GLU A 97 57.926 3.803 -7.441 1.00 25.00 O ATOM 264 CB GLU A 97 55.968 1.865 -8.922 1.00 25.00 C ATOM 265 CG GLU A 97 54.779 0.897 -8.813 1.00 25.00 C ATOM 266 CD GLU A 97 54.920 -0.338 -9.692 1.00 25.00 C ATOM 267 OE1 GLU A 97 55.894 -0.434 -10.462 1.00 25.00 O ATOM 268 OE2 GLU A 97 53.992 -1.180 -9.667 1.00 25.00 O1- ATOM 0 H GLU A 97 54.591 3.816 -9.823 1.00 25.00 H new ATOM 0 HA GLU A 97 55.476 2.966 -7.131 1.00 25.00 H new ATOM 0 HB2 GLU A 97 56.163 2.081 -9.973 1.00 25.00 H new ATOM 0 HB3 GLU A 97 56.862 1.385 -8.524 1.00 25.00 H new ATOM 0 HG2 GLU A 97 54.669 0.584 -7.775 1.00 25.00 H new ATOM 0 HG3 GLU A 97 53.865 1.425 -9.085 1.00 25.00 H new ATOM 275 N GLY A 98 56.953 5.092 -8.997 1.00 25.00 N ATOM 276 CA GLY A 98 58.074 6.017 -9.090 1.00 25.00 C ATOM 277 C GLY A 98 59.114 5.599 -10.115 1.00 25.00 C ATOM 278 O GLY A 98 59.184 4.440 -10.506 1.00 25.00 O ATOM 0 H GLY A 98 56.167 5.320 -9.605 1.00 25.00 H new ATOM 0 HA2 GLY A 98 57.698 7.008 -9.347 1.00 25.00 H new ATOM 0 HA3 GLY A 98 58.550 6.100 -8.113 1.00 25.00 H new ATOM 282 N ARG A 99 59.896 6.574 -10.578 1.00 25.00 N ATOM 283 CA ARG A 99 60.964 6.360 -11.579 1.00 25.00 C ATOM 284 C ARG A 99 61.783 7.644 -11.715 1.00 25.00 C ATOM 285 O ARG A 99 62.152 8.054 -12.806 1.00 25.00 O ATOM 286 CB ARG A 99 60.385 5.957 -12.950 1.00 25.00 C ATOM 287 CG ARG A 99 59.310 6.890 -13.496 1.00 25.00 C ATOM 288 CD ARG A 99 58.973 6.512 -14.927 1.00 25.00 C ATOM 289 NE ARG A 99 57.943 7.404 -15.488 1.00 25.00 N ATOM 290 CZ ARG A 99 56.632 7.215 -15.396 1.00 25.00 C ATOM 291 NH1 ARG A 99 56.109 6.179 -14.783 1.00 25.00 N1+ ATOM 292 NH2 ARG A 99 55.829 8.092 -15.932 1.00 25.00 N ATOM 0 H ARG A 99 59.813 7.544 -10.273 1.00 25.00 H new ATOM 0 HA ARG A 99 61.599 5.542 -11.238 1.00 25.00 H new ATOM 0 HB2 ARG A 99 61.201 5.906 -13.671 1.00 25.00 H new ATOM 0 HB3 ARG A 99 59.967 4.953 -12.870 1.00 25.00 H new ATOM 0 HG2 ARG A 99 58.416 6.831 -12.875 1.00 25.00 H new ATOM 0 HG3 ARG A 99 59.658 7.922 -13.456 1.00 25.00 H new ATOM 0 HD2 ARG A 99 59.873 6.561 -15.540 1.00 25.00 H new ATOM 0 HD3 ARG A 99 58.621 5.481 -14.960 1.00 25.00 H new ATOM 0 HE ARG A 99 58.263 8.234 -15.987 1.00 25.00 H new ATOM 0 HH11 ARG A 99 56.716 5.480 -14.354 1.00 25.00 H new ATOM 0 HH12 ARG A 99 55.096 6.072 -14.736 1.00 25.00 H new ATOM 0 HH21 ARG A 99 56.211 8.907 -16.412 1.00 25.00 H new ATOM 0 HH22 ARG A 99 54.819 7.963 -15.871 1.00 25.00 H new ATOM 306 N HIS A 100 61.997 8.305 -10.592 1.00 25.00 N ATOM 307 CA HIS A 100 62.684 9.592 -10.555 1.00 25.00 C ATOM 308 C HIS A 100 63.736 9.467 -9.467 1.00 25.00 C ATOM 309 O HIS A 100 63.745 8.468 -8.747 1.00 25.00 O ATOM 310 CB HIS A 100 61.687 10.710 -10.219 1.00 25.00 C ATOM 311 CG HIS A 100 61.121 10.609 -8.837 1.00 25.00 C ATOM 312 ND1 HIS A 100 61.758 11.051 -7.706 1.00 25.00 N ATOM 313 CD2 HIS A 100 59.943 10.087 -8.396 1.00 25.00 C ATOM 314 CE1 HIS A 100 60.992 10.772 -6.661 1.00 25.00 C ATOM 315 NE2 HIS A 100 59.866 10.189 -7.023 1.00 25.00 N ATOM 0 H HIS A 100 61.701 7.968 -9.676 1.00 25.00 H new ATOM 0 HA HIS A 100 63.135 9.841 -11.515 1.00 25.00 H new ATOM 0 HB2 HIS A 100 62.183 11.674 -10.330 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.870 10.687 -10.940 1.00 25.00 H new ATOM 0 HD1 HIS A 100 62.666 11.515 -7.674 1.00 25.00 H new ATOM 0 HD2 HIS A 100 59.181 9.656 -9.029 1.00 25.00 H new ATOM 0 HE1 HIS A 100 61.258 10.995 -5.638 1.00 25.00 H new ATOM 323 N MET A 101 64.590 10.467 -9.318 1.00 25.00 N ATOM 324 CA MET A 101 65.618 10.444 -8.284 1.00 25.00 C ATOM 325 C MET A 101 65.289 11.458 -7.195 1.00 25.00 C ATOM 326 O MET A 101 64.395 12.304 -7.352 1.00 25.00 O ATOM 327 CB MET A 101 66.999 10.707 -8.896 1.00 25.00 C ATOM 328 CG MET A 101 67.188 12.088 -9.474 1.00 25.00 C ATOM 329 SD MET A 101 68.800 12.204 -10.242 1.00 25.00 S ATOM 330 CE MET A 101 68.866 13.924 -10.619 1.00 25.00 C ATOM 0 H MET A 101 64.594 11.306 -9.899 1.00 25.00 H new ATOM 0 HA MET A 101 65.641 9.455 -7.827 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.757 10.544 -8.129 1.00 25.00 H new ATOM 0 HB3 MET A 101 67.177 9.973 -9.682 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.409 12.296 -10.208 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.094 12.838 -8.688 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.588 14.094 -11.418 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.882 14.264 -10.941 1.00 25.00 H new ATOM 0 HE3 MET A 101 69.169 14.480 -9.732 1.00 25.00 H new ATOM 340 N LEU A 102 65.986 11.345 -6.077 1.00 25.00 N ATOM 341 CA LEU A 102 65.773 12.219 -4.930 1.00 25.00 C ATOM 342 C LEU A 102 67.115 12.833 -4.593 1.00 25.00 C ATOM 343 O LEU A 102 68.109 12.119 -4.521 1.00 25.00 O ATOM 344 CB LEU A 102 65.258 11.401 -3.738 1.00 25.00 C ATOM 345 CG LEU A 102 64.902 12.197 -2.469 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.534 12.861 -2.603 1.00 25.00 C ATOM 347 CD2 LEU A 102 64.901 11.271 -1.257 1.00 25.00 C ATOM 0 H LEU A 102 66.716 10.646 -5.936 1.00 25.00 H new ATOM 0 HA LEU A 102 65.035 12.989 -5.155 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.372 10.851 -4.057 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.015 10.662 -3.477 1.00 25.00 H new ATOM 0 HG LEU A 102 65.654 12.975 -2.336 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.308 13.416 -1.693 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.543 13.544 -3.452 1.00 25.00 H new ATOM 0 HD13 LEU A 102 62.773 12.097 -2.760 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.648 11.842 -0.363 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.164 10.481 -1.403 1.00 25.00 H new ATOM 0 HD23 LEU A 102 65.890 10.828 -1.137 1.00 25.00 H new ATOM 359 N LEU A 103 67.151 14.139 -4.394 1.00 25.00 N ATOM 360 CA LEU A 103 68.387 14.832 -4.032 1.00 25.00 C ATOM 361 C LEU A 103 68.158 15.542 -2.725 1.00 25.00 C ATOM 362 O LEU A 103 67.031 15.908 -2.416 1.00 25.00 O ATOM 363 CB LEU A 103 68.771 15.861 -5.094 1.00 25.00 C ATOM 364 CG LEU A 103 69.070 15.318 -6.496 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.433 16.491 -7.390 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.197 14.314 -6.486 1.00 25.00 C ATOM 0 H LEU A 103 66.337 14.748 -4.476 1.00 25.00 H new ATOM 0 HA LEU A 103 69.195 14.105 -3.952 1.00 25.00 H new ATOM 0 HB2 LEU A 103 67.961 16.586 -5.175 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.650 16.402 -4.743 1.00 25.00 H new ATOM 0 HG LEU A 103 68.185 14.802 -6.868 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.650 16.129 -8.395 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.598 17.191 -7.429 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.311 16.996 -6.988 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.374 13.956 -7.500 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.102 14.787 -6.105 1.00 25.00 H new ATOM 0 HD23 LEU A 103 69.930 13.473 -5.846 1.00 25.00 H new ATOM 378 N THR A 104 69.220 15.762 -1.972 1.00 25.00 N ATOM 379 CA THR A 104 69.125 16.476 -0.706 1.00 25.00 C ATOM 380 C THR A 104 69.727 17.854 -0.906 1.00 25.00 C ATOM 381 O THR A 104 70.716 18.009 -1.611 1.00 25.00 O ATOM 382 CB THR A 104 69.874 15.720 0.406 1.00 25.00 C ATOM 383 OG1 THR A 104 69.453 14.355 0.407 1.00 25.00 O ATOM 384 CG2 THR A 104 69.578 16.306 1.782 1.00 25.00 C ATOM 0 H THR A 104 70.163 15.456 -2.214 1.00 25.00 H new ATOM 0 HA THR A 104 68.082 16.556 -0.400 1.00 25.00 H new ATOM 0 HB THR A 104 70.942 15.808 0.208 1.00 25.00 H new ATOM 0 HG1 THR A 104 69.927 13.867 1.112 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.124 15.746 2.541 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.889 17.350 1.807 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.509 16.241 1.983 1.00 25.00 H new ATOM 392 N VAL A 105 69.122 18.858 -0.305 1.00 25.00 N ATOM 393 CA VAL A 105 69.603 20.224 -0.399 1.00 25.00 C ATOM 394 C VAL A 105 69.849 20.721 1.011 1.00 25.00 C ATOM 395 O VAL A 105 68.976 20.621 1.871 1.00 25.00 O ATOM 396 CB VAL A 105 68.565 21.132 -1.088 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.046 22.593 -1.110 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.279 20.641 -2.520 1.00 25.00 C ATOM 0 H VAL A 105 68.282 18.751 0.263 1.00 25.00 H new ATOM 0 HA VAL A 105 70.516 20.250 -0.994 1.00 25.00 H new ATOM 0 HB VAL A 105 67.640 21.083 -0.514 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.298 23.215 -1.601 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.195 22.942 -0.088 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.987 22.658 -1.656 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.544 21.295 -2.989 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.201 20.656 -3.101 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.889 19.624 -2.485 1.00 25.00 H new ATOM 408 N TYR A 106 71.037 21.252 1.244 1.00 25.00 N ATOM 409 CA TYR A 106 71.394 21.827 2.533 1.00 25.00 C ATOM 410 C TYR A 106 71.589 23.329 2.330 1.00 25.00 C ATOM 411 O TYR A 106 72.504 23.756 1.629 1.00 25.00 O ATOM 412 CB TYR A 106 72.666 21.164 3.066 1.00 25.00 C ATOM 413 CG TYR A 106 72.977 21.554 4.490 1.00 25.00 C ATOM 414 CD1 TYR A 106 73.765 22.682 4.770 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.477 20.800 5.572 1.00 25.00 C ATOM 416 CE1 TYR A 106 74.039 23.061 6.108 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.745 21.188 6.916 1.00 25.00 C ATOM 418 CZ TYR A 106 73.521 22.322 7.164 1.00 25.00 C ATOM 419 OH TYR A 106 73.785 22.728 8.446 1.00 25.00 O ATOM 0 H TYR A 106 71.781 21.298 0.548 1.00 25.00 H new ATOM 0 HA TYR A 106 70.609 21.657 3.270 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.558 20.081 3.006 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.507 21.436 2.428 1.00 25.00 H new ATOM 0 HD1 TYR A 106 74.167 23.268 3.956 1.00 25.00 H new ATOM 0 HD2 TYR A 106 71.884 19.918 5.379 1.00 25.00 H new ATOM 0 HE1 TYR A 106 74.653 23.927 6.307 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.351 20.609 7.738 1.00 25.00 H new ATOM 0 HH TYR A 106 74.071 23.665 8.440 1.00 25.00 H new ATOM 429 N CYS A 107 70.690 24.125 2.882 1.00 25.00 N ATOM 430 CA CYS A 107 70.705 25.572 2.700 1.00 25.00 C ATOM 431 C CYS A 107 71.380 26.250 3.880 1.00 25.00 C ATOM 432 O CYS A 107 70.963 26.097 5.028 1.00 25.00 O ATOM 433 CB CYS A 107 69.277 26.095 2.566 1.00 25.00 C ATOM 434 SG CYS A 107 69.192 27.895 2.404 1.00 25.00 S ATOM 0 H CYS A 107 69.927 23.789 3.470 1.00 25.00 H new ATOM 0 HA CYS A 107 71.264 25.799 1.792 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.808 25.635 1.696 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.700 25.787 3.438 1.00 25.00 H new ATOM 0 HG CYS A 107 67.950 28.263 2.293 1.00 25.00 H new ATOM 440 N VAL A 108 72.418 27.011 3.582 1.00 25.00 N ATOM 441 CA VAL A 108 73.201 27.698 4.592 1.00 25.00 C ATOM 442 C VAL A 108 72.895 29.182 4.606 1.00 25.00 C ATOM 443 O VAL A 108 73.023 29.877 3.589 1.00 25.00 O ATOM 444 CB VAL A 108 74.717 27.502 4.344 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.544 28.108 5.496 1.00 25.00 C ATOM 446 CG2 VAL A 108 75.023 26.022 4.211 1.00 25.00 C ATOM 0 H VAL A 108 72.742 27.170 2.628 1.00 25.00 H new ATOM 0 HA VAL A 108 72.931 27.266 5.556 1.00 25.00 H new ATOM 0 HB VAL A 108 74.988 28.015 3.422 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.606 27.958 5.300 1.00 25.00 H new ATOM 0 HG12 VAL A 108 75.336 29.175 5.571 1.00 25.00 H new ATOM 0 HG13 VAL A 108 75.276 27.619 6.433 1.00 25.00 H new ATOM 0 HG21 VAL A 108 76.090 25.885 4.036 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.736 25.507 5.128 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.462 25.608 3.373 1.00 25.00 H new ATOM 456 N ARG A 109 72.548 29.679 5.781 1.00 25.00 N ATOM 457 CA ARG A 109 72.344 31.098 6.000 1.00 25.00 C ATOM 458 C ARG A 109 73.349 31.507 7.045 1.00 25.00 C ATOM 459 O ARG A 109 73.705 30.710 7.897 1.00 25.00 O ATOM 460 CB ARG A 109 70.935 31.359 6.495 1.00 25.00 C ATOM 461 CG ARG A 109 69.851 30.944 5.482 1.00 25.00 C ATOM 462 CD ARG A 109 68.460 31.428 5.878 1.00 25.00 C ATOM 463 NE ARG A 109 68.329 32.880 5.672 1.00 25.00 N ATOM 464 CZ ARG A 109 67.871 33.760 6.554 1.00 25.00 C ATOM 465 NH1 ARG A 109 67.470 33.426 7.754 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 67.819 35.014 6.205 1.00 25.00 N ATOM 0 H ARG A 109 72.400 29.106 6.612 1.00 25.00 H new ATOM 0 HA ARG A 109 72.473 31.665 5.078 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.778 30.818 7.428 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.826 32.420 6.720 1.00 25.00 H new ATOM 0 HG2 ARG A 109 70.105 31.344 4.500 1.00 25.00 H new ATOM 0 HG3 ARG A 109 69.841 29.858 5.391 1.00 25.00 H new ATOM 0 HD2 ARG A 109 67.707 30.904 5.289 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.271 31.187 6.924 1.00 25.00 H new ATOM 0 HE ARG A 109 68.618 33.245 4.764 1.00 25.00 H new ATOM 0 HH11 ARG A 109 67.501 32.450 8.049 1.00 25.00 H new ATOM 0 HH12 ARG A 109 67.126 34.142 8.394 1.00 25.00 H new ATOM 0 HH21 ARG A 109 68.126 35.298 5.274 1.00 25.00 H new ATOM 0 HH22 ARG A 109 67.471 35.712 6.862 1.00 25.00 H new ATOM 480 N ARG A 110 73.833 32.738 6.966 1.00 25.00 N ATOM 481 CA ARG A 110 74.909 33.178 7.855 1.00 25.00 C ATOM 482 C ARG A 110 74.540 33.129 9.336 1.00 25.00 C ATOM 483 O ARG A 110 75.389 32.900 10.182 1.00 25.00 O ATOM 484 CB ARG A 110 75.355 34.602 7.492 1.00 25.00 C ATOM 485 CG ARG A 110 76.674 35.020 8.159 1.00 25.00 C ATOM 486 CD ARG A 110 76.899 36.523 8.087 1.00 25.00 C ATOM 487 NE ARG A 110 78.112 36.914 8.832 1.00 25.00 N ATOM 488 CZ ARG A 110 78.178 37.111 10.148 1.00 25.00 C ATOM 489 NH1 ARG A 110 77.142 36.965 10.940 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 79.318 37.460 10.678 1.00 25.00 N ATOM 0 H ARG A 110 73.506 33.444 6.307 1.00 25.00 H new ATOM 0 HA ARG A 110 75.725 32.471 7.705 1.00 25.00 H new ATOM 0 HB2 ARG A 110 75.465 34.675 6.410 1.00 25.00 H new ATOM 0 HB3 ARG A 110 74.573 35.304 7.781 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.669 34.704 9.202 1.00 25.00 H new ATOM 0 HG3 ARG A 110 77.504 34.506 7.674 1.00 25.00 H new ATOM 0 HD2 ARG A 110 76.993 36.830 7.046 1.00 25.00 H new ATOM 0 HD3 ARG A 110 76.033 37.044 8.496 1.00 25.00 H new ATOM 0 HE ARG A 110 78.970 37.044 8.295 1.00 25.00 H new ATOM 0 HH11 ARG A 110 76.239 36.690 10.553 1.00 25.00 H new ATOM 0 HH12 ARG A 110 77.240 37.127 11.942 1.00 25.00 H new ATOM 0 HH21 ARG A 110 80.141 37.578 10.087 1.00 25.00 H new ATOM 0 HH22 ARG A 110 79.387 37.615 11.684 1.00 25.00 H new ATOM 504 N ASP A 111 73.279 33.378 9.637 1.00 25.00 N ATOM 505 CA ASP A 111 72.821 33.498 11.023 1.00 25.00 C ATOM 506 C ASP A 111 72.462 32.149 11.671 1.00 25.00 C ATOM 507 O ASP A 111 71.599 32.084 12.537 1.00 25.00 O ATOM 508 CB ASP A 111 71.617 34.448 11.049 1.00 25.00 C ATOM 509 CG ASP A 111 71.605 35.351 12.271 1.00 25.00 C ATOM 510 OD1 ASP A 111 72.705 35.736 12.735 1.00 25.00 O ATOM 511 OD2 ASP A 111 70.510 35.793 12.668 1.00 25.00 O1- ATOM 0 H ASP A 111 72.544 33.503 8.941 1.00 25.00 H new ATOM 0 HA ASP A 111 73.645 33.894 11.617 1.00 25.00 H new ATOM 0 HB2 ASP A 111 71.626 35.063 10.149 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.698 33.863 11.026 1.00 25.00 H new ATOM 516 N LEU A 112 73.103 31.077 11.199 1.00 25.00 N ATOM 517 CA LEU A 112 72.881 29.695 11.684 1.00 25.00 C ATOM 518 C LEU A 112 71.410 29.286 11.569 1.00 25.00 C ATOM 519 O LEU A 112 70.910 28.427 12.281 1.00 25.00 O ATOM 520 CB LEU A 112 73.392 29.520 13.124 1.00 25.00 C ATOM 521 CG LEU A 112 74.875 29.866 13.355 1.00 25.00 C ATOM 522 CD1 LEU A 112 75.192 29.764 14.845 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.811 28.938 12.566 1.00 25.00 C ATOM 0 H LEU A 112 73.802 31.136 10.459 1.00 25.00 H new ATOM 0 HA LEU A 112 73.458 29.030 11.041 1.00 25.00 H new ATOM 0 HB2 LEU A 112 72.786 30.142 13.783 1.00 25.00 H new ATOM 0 HB3 LEU A 112 73.229 28.485 13.424 1.00 25.00 H new ATOM 0 HG LEU A 112 75.041 30.883 13.000 1.00 25.00 H new ATOM 0 HD11 LEU A 112 76.241 30.008 15.011 1.00 25.00 H new ATOM 0 HD12 LEU A 112 74.565 30.462 15.399 1.00 25.00 H new ATOM 0 HD13 LEU A 112 74.997 28.749 15.190 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.847 29.217 12.758 1.00 25.00 H new ATOM 0 HD22 LEU A 112 75.649 27.907 12.879 1.00 25.00 H new ATOM 0 HD23 LEU A 112 75.602 29.031 11.500 1.00 25.00 H new ATOM 535 N SER A 113 70.749 29.909 10.610 1.00 25.00 N ATOM 536 CA SER A 113 69.338 29.692 10.286 1.00 25.00 C ATOM 537 C SER A 113 69.186 28.555 9.283 1.00 25.00 C ATOM 538 O SER A 113 68.358 28.624 8.378 1.00 25.00 O ATOM 539 CB SER A 113 68.730 30.958 9.720 1.00 25.00 C ATOM 540 OG SER A 113 69.060 32.081 10.514 1.00 25.00 O ATOM 0 H SER A 113 71.190 30.606 10.010 1.00 25.00 H new ATOM 0 HA SER A 113 68.815 29.423 11.203 1.00 25.00 H new ATOM 0 HB2 SER A 113 69.086 31.112 8.701 1.00 25.00 H new ATOM 0 HB3 SER A 113 67.646 30.852 9.667 1.00 25.00 H new ATOM 0 HG SER A 113 68.657 32.886 10.126 1.00 25.00 H new ATOM 546 N GLU A 114 70.164 27.669 9.290 1.00 25.00 N ATOM 547 CA GLU A 114 70.370 26.702 8.222 1.00 25.00 C ATOM 548 C GLU A 114 69.294 25.623 8.270 1.00 25.00 C ATOM 549 O GLU A 114 68.698 25.360 9.311 1.00 25.00 O ATOM 550 CB GLU A 114 71.748 26.053 8.403 1.00 25.00 C ATOM 551 CG GLU A 114 72.864 27.081 8.442 1.00 25.00 C ATOM 552 CD GLU A 114 74.230 26.484 8.745 1.00 25.00 C ATOM 553 OE1 GLU A 114 74.577 25.428 8.175 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 74.990 27.123 9.502 1.00 25.00 O1- ATOM 0 H GLU A 114 70.847 27.598 10.045 1.00 25.00 H new ATOM 0 HA GLU A 114 70.314 27.210 7.259 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.757 25.474 9.327 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.929 25.354 7.587 1.00 25.00 H new ATOM 0 HG2 GLU A 114 72.906 27.596 7.482 1.00 25.00 H new ATOM 0 HG3 GLU A 114 72.629 27.832 9.196 1.00 25.00 H new ATOM 561 N VAL A 115 69.012 25.055 7.110 1.00 25.00 N ATOM 562 CA VAL A 115 67.905 24.105 6.957 1.00 25.00 C ATOM 563 C VAL A 115 68.285 23.108 5.878 1.00 25.00 C ATOM 564 O VAL A 115 69.087 23.414 5.003 1.00 25.00 O ATOM 565 CB VAL A 115 66.554 24.858 6.582 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.629 25.521 5.198 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.333 23.920 6.656 1.00 25.00 C ATOM 0 H VAL A 115 69.533 25.232 6.251 1.00 25.00 H new ATOM 0 HA VAL A 115 67.730 23.586 7.899 1.00 25.00 H new ATOM 0 HB VAL A 115 66.426 25.643 7.327 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.686 26.023 4.983 1.00 25.00 H new ATOM 0 HG12 VAL A 115 67.439 26.250 5.187 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.816 24.760 4.440 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.432 24.474 6.393 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.467 23.093 5.959 1.00 25.00 H new ATOM 0 HG23 VAL A 115 65.235 23.529 7.669 1.00 25.00 H new ATOM 577 N THR A 116 67.706 21.924 5.919 1.00 25.00 N ATOM 578 CA THR A 116 67.927 20.936 4.879 1.00 25.00 C ATOM 579 C THR A 116 66.592 20.301 4.538 1.00 25.00 C ATOM 580 O THR A 116 65.695 20.235 5.379 1.00 25.00 O ATOM 581 CB THR A 116 68.983 19.881 5.303 1.00 25.00 C ATOM 582 OG1 THR A 116 69.321 19.054 4.184 1.00 25.00 O ATOM 583 CG2 THR A 116 68.493 18.988 6.435 1.00 25.00 C ATOM 0 H THR A 116 67.077 21.621 6.663 1.00 25.00 H new ATOM 0 HA THR A 116 68.335 21.420 3.992 1.00 25.00 H new ATOM 0 HB THR A 116 69.855 20.432 5.657 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.212 19.565 3.355 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.270 18.268 6.693 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.261 19.600 7.307 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.597 18.456 6.117 1.00 25.00 H new ATOM 591 N PHE A 117 66.449 19.897 3.287 1.00 25.00 N ATOM 592 CA PHE A 117 65.215 19.312 2.780 1.00 25.00 C ATOM 593 C PHE A 117 65.615 18.478 1.572 1.00 25.00 C ATOM 594 O PHE A 117 66.774 18.515 1.166 1.00 25.00 O ATOM 595 CB PHE A 117 64.207 20.411 2.409 1.00 25.00 C ATOM 596 CG PHE A 117 64.762 21.472 1.498 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.725 21.299 0.103 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.305 22.666 2.030 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.217 22.303 -0.767 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.800 23.678 1.168 1.00 25.00 C ATOM 601 CZ PHE A 117 65.749 23.496 -0.234 1.00 25.00 C ATOM 0 H PHE A 117 67.189 19.965 2.589 1.00 25.00 H new ATOM 0 HA PHE A 117 64.721 18.693 3.528 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.344 19.950 1.929 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.848 20.884 3.323 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.316 20.389 -0.311 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.343 22.808 3.100 1.00 25.00 H new ATOM 0 HE1 PHE A 117 65.185 22.155 -1.836 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.215 24.585 1.581 1.00 25.00 H new ATOM 0 HZ PHE A 117 66.116 24.268 -0.894 1.00 25.00 H new ATOM 611 N SER A 118 64.689 17.725 1.002 1.00 25.00 N ATOM 612 CA SER A 118 64.989 16.892 -0.161 1.00 25.00 C ATOM 613 C SER A 118 63.983 17.171 -1.263 1.00 25.00 C ATOM 614 O SER A 118 62.853 17.554 -0.986 1.00 25.00 O ATOM 615 CB SER A 118 64.955 15.410 0.218 1.00 25.00 C ATOM 616 OG SER A 118 65.912 15.122 1.225 1.00 25.00 O ATOM 0 H SER A 118 63.722 17.670 1.322 1.00 25.00 H new ATOM 0 HA SER A 118 65.990 17.134 -0.518 1.00 25.00 H new ATOM 0 HB2 SER A 118 63.959 15.144 0.571 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.154 14.801 -0.663 1.00 25.00 H new ATOM 0 HG SER A 118 65.871 14.170 1.452 1.00 25.00 H new ATOM 622 N LEU A 119 64.407 16.992 -2.506 1.00 25.00 N ATOM 623 CA LEU A 119 63.568 17.274 -3.667 1.00 25.00 C ATOM 624 C LEU A 119 63.489 16.084 -4.602 1.00 25.00 C ATOM 625 O LEU A 119 64.474 15.379 -4.824 1.00 25.00 O ATOM 626 CB LEU A 119 64.126 18.472 -4.438 1.00 25.00 C ATOM 627 CG LEU A 119 63.627 19.853 -3.989 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.408 20.923 -4.730 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.128 20.009 -4.276 1.00 25.00 C ATOM 0 H LEU A 119 65.339 16.649 -2.740 1.00 25.00 H new ATOM 0 HA LEU A 119 62.566 17.495 -3.299 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.213 18.456 -4.357 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.883 18.345 -5.493 1.00 25.00 H new ATOM 0 HG LEU A 119 63.780 19.956 -2.915 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.061 21.908 -4.418 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.469 20.823 -4.502 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.255 20.807 -5.803 1.00 25.00 H new ATOM 0 HD21 LEU A 119 61.796 20.995 -3.950 1.00 25.00 H new ATOM 0 HD22 LEU A 119 61.949 19.901 -5.346 1.00 25.00 H new ATOM 0 HD23 LEU A 119 61.572 19.242 -3.736 1.00 25.00 H new ATOM 641 N GLN A 120 62.304 15.886 -5.159 1.00 25.00 N ATOM 642 CA GLN A 120 62.038 14.805 -6.106 1.00 25.00 C ATOM 643 C GLN A 120 62.196 15.372 -7.507 1.00 25.00 C ATOM 644 O GLN A 120 61.450 16.267 -7.893 1.00 25.00 O ATOM 645 CB GLN A 120 60.606 14.290 -5.928 1.00 25.00 C ATOM 646 CG GLN A 120 60.337 13.661 -4.564 1.00 25.00 C ATOM 647 CD GLN A 120 58.932 13.101 -4.459 1.00 25.00 C ATOM 648 OE1 GLN A 120 57.961 13.779 -4.736 1.00 25.00 O ATOM 649 NE2 GLN A 120 58.824 11.861 -4.057 1.00 25.00 N ATOM 0 H GLN A 120 61.492 16.473 -4.968 1.00 25.00 H new ATOM 0 HA GLN A 120 62.728 13.978 -5.938 1.00 25.00 H new ATOM 0 HB2 GLN A 120 59.912 15.117 -6.078 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.397 13.553 -6.704 1.00 25.00 H new ATOM 0 HG2 GLN A 120 61.058 12.864 -4.385 1.00 25.00 H new ATOM 0 HG3 GLN A 120 60.488 14.408 -3.785 1.00 25.00 H new ATOM 0 HE21 GLN A 120 59.661 11.323 -3.833 1.00 25.00 H new ATOM 0 HE22 GLN A 120 57.903 11.432 -3.967 1.00 25.00 H new ATOM 658 N VAL A 121 63.179 14.888 -8.252 1.00 25.00 N ATOM 659 CA VAL A 121 63.467 15.433 -9.581 1.00 25.00 C ATOM 660 C VAL A 121 63.771 14.328 -10.581 1.00 25.00 C ATOM 661 O VAL A 121 64.104 13.204 -10.210 1.00 25.00 O ATOM 662 CB VAL A 121 64.681 16.415 -9.534 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.336 17.664 -8.722 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.916 15.732 -8.927 1.00 25.00 C ATOM 0 H VAL A 121 63.790 14.123 -7.966 1.00 25.00 H new ATOM 0 HA VAL A 121 62.574 15.970 -9.901 1.00 25.00 H new ATOM 0 HB VAL A 121 64.908 16.708 -10.559 1.00 25.00 H new ATOM 0 HG11 VAL A 121 65.195 18.334 -8.702 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.489 18.174 -9.181 1.00 25.00 H new ATOM 0 HG13 VAL A 121 64.077 17.376 -7.703 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.748 16.436 -8.905 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.690 15.407 -7.912 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.188 14.868 -9.533 1.00 25.00 H new ATOM 674 N ASP A 122 63.665 14.656 -11.857 1.00 25.00 N ATOM 675 CA ASP A 122 64.014 13.722 -12.920 1.00 25.00 C ATOM 676 C ASP A 122 65.528 13.765 -13.109 1.00 25.00 C ATOM 677 O ASP A 122 66.176 14.725 -12.703 1.00 25.00 O ATOM 678 CB ASP A 122 63.310 14.114 -14.221 1.00 25.00 C ATOM 679 CG ASP A 122 63.365 13.012 -15.262 1.00 25.00 C ATOM 680 OD1 ASP A 122 62.458 12.157 -15.263 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 64.359 12.949 -16.016 1.00 25.00 O1- ATOM 0 H ASP A 122 63.339 15.565 -12.186 1.00 25.00 H new ATOM 0 HA ASP A 122 63.695 12.714 -12.654 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.269 14.358 -14.009 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.773 15.015 -14.624 1.00 25.00 H new ATOM 686 N ALA A 123 66.090 12.748 -13.739 1.00 25.00 N ATOM 687 CA ALA A 123 67.519 12.724 -14.011 1.00 25.00 C ATOM 688 C ALA A 123 67.893 13.888 -14.942 1.00 25.00 C ATOM 689 O ALA A 123 68.923 14.544 -14.754 1.00 25.00 O ATOM 690 CB ALA A 123 67.901 11.382 -14.647 1.00 25.00 C ATOM 0 H ALA A 123 65.581 11.929 -14.072 1.00 25.00 H new ATOM 0 HA ALA A 123 68.068 12.837 -13.076 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.972 11.367 -14.850 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.650 10.571 -13.964 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.353 11.253 -15.581 1.00 25.00 H new ATOM 696 N ASP A 124 67.052 14.146 -15.934 1.00 25.00 N ATOM 697 CA ASP A 124 67.348 15.175 -16.933 1.00 25.00 C ATOM 698 C ASP A 124 66.735 16.534 -16.577 1.00 25.00 C ATOM 699 O ASP A 124 66.618 17.426 -17.411 1.00 25.00 O ATOM 700 CB ASP A 124 66.887 14.721 -18.321 1.00 25.00 C ATOM 701 CG ASP A 124 67.798 15.238 -19.437 1.00 25.00 C ATOM 702 OD1 ASP A 124 69.023 15.406 -19.189 1.00 25.00 O ATOM 703 OD2 ASP A 124 67.314 15.396 -20.576 1.00 25.00 O1- ATOM 0 H ASP A 124 66.164 13.663 -16.072 1.00 25.00 H new ATOM 0 HA ASP A 124 68.430 15.310 -16.943 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.860 13.632 -18.353 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.869 15.071 -18.495 1.00 25.00 H new ATOM 708 N PHE A 125 66.364 16.696 -15.316 1.00 25.00 N ATOM 709 CA PHE A 125 65.817 17.960 -14.824 1.00 25.00 C ATOM 710 C PHE A 125 66.915 19.025 -14.888 1.00 25.00 C ATOM 711 O PHE A 125 68.044 18.773 -14.470 1.00 25.00 O ATOM 712 CB PHE A 125 65.359 17.759 -13.382 1.00 25.00 C ATOM 713 CG PHE A 125 64.287 18.702 -12.927 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.964 18.536 -13.372 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.575 19.725 -12.006 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.930 19.376 -12.900 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.544 20.560 -11.514 1.00 25.00 C ATOM 718 CZ PHE A 125 62.221 20.385 -11.965 1.00 25.00 C ATOM 0 H PHE A 125 66.431 15.965 -14.608 1.00 25.00 H new ATOM 0 HA PHE A 125 64.970 18.281 -15.430 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.996 16.737 -13.270 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.221 17.866 -12.723 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.735 17.757 -14.084 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.591 19.874 -11.672 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.919 19.243 -13.256 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.771 21.331 -10.793 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.433 21.024 -11.594 1.00 25.00 H new ATOM 728 N GLU A 126 66.600 20.197 -15.420 1.00 25.00 N ATOM 729 CA GLU A 126 67.596 21.265 -15.573 1.00 25.00 C ATOM 730 C GLU A 126 68.091 21.775 -14.231 1.00 25.00 C ATOM 731 O GLU A 126 67.320 21.889 -13.280 1.00 25.00 O ATOM 732 CB GLU A 126 66.991 22.491 -16.255 1.00 25.00 C ATOM 733 CG GLU A 126 66.573 22.352 -17.689 1.00 25.00 C ATOM 734 CD GLU A 126 66.017 23.680 -18.191 1.00 25.00 C ATOM 735 OE1 GLU A 126 65.017 24.151 -17.596 1.00 25.00 O ATOM 736 OE2 GLU A 126 66.628 24.305 -19.083 1.00 25.00 O1- ATOM 0 H GLU A 126 65.667 20.439 -15.754 1.00 25.00 H new ATOM 0 HA GLU A 126 68.403 20.822 -16.157 1.00 25.00 H new ATOM 0 HB2 GLU A 126 66.119 22.800 -15.679 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.717 23.302 -16.194 1.00 25.00 H new ATOM 0 HG2 GLU A 126 67.424 22.049 -18.299 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.819 21.571 -17.784 1.00 25.00 H new ATOM 743 N LEU A 127 69.330 22.244 -14.204 1.00 25.00 N ATOM 744 CA LEU A 127 69.849 22.971 -13.047 1.00 25.00 C ATOM 745 C LEU A 127 69.040 24.262 -12.893 1.00 25.00 C ATOM 746 O LEU A 127 68.739 24.705 -11.781 1.00 25.00 O ATOM 747 CB LEU A 127 71.341 23.277 -13.267 1.00 25.00 C ATOM 748 CG LEU A 127 72.183 23.877 -12.121 1.00 25.00 C ATOM 749 CD1 LEU A 127 72.158 25.404 -12.116 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.754 23.352 -10.758 1.00 25.00 C ATOM 0 H LEU A 127 69.997 22.136 -14.968 1.00 25.00 H new ATOM 0 HA LEU A 127 69.755 22.377 -12.138 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.822 22.347 -13.569 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.410 23.961 -14.113 1.00 25.00 H new ATOM 0 HG LEU A 127 73.207 23.554 -12.310 1.00 25.00 H new ATOM 0 HD11 LEU A 127 72.766 25.775 -11.291 1.00 25.00 H new ATOM 0 HD12 LEU A 127 72.559 25.778 -13.058 1.00 25.00 H new ATOM 0 HD13 LEU A 127 71.132 25.751 -11.996 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.375 23.802 -9.983 1.00 25.00 H new ATOM 0 HD22 LEU A 127 70.710 23.609 -10.581 1.00 25.00 H new ATOM 0 HD23 LEU A 127 71.870 22.269 -10.732 1.00 25.00 H new ATOM 762 N HIS A 128 68.638 24.828 -14.025 1.00 25.00 N ATOM 763 CA HIS A 128 67.814 26.033 -14.049 1.00 25.00 C ATOM 764 C HIS A 128 66.483 25.824 -13.326 1.00 25.00 C ATOM 765 O HIS A 128 66.014 26.686 -12.591 1.00 25.00 O ATOM 766 CB HIS A 128 67.518 26.411 -15.500 1.00 25.00 C ATOM 767 CG HIS A 128 67.245 27.868 -15.702 1.00 25.00 C ATOM 768 ND1 HIS A 128 66.589 28.383 -16.789 1.00 25.00 N ATOM 769 CD2 HIS A 128 67.561 28.949 -14.934 1.00 25.00 C ATOM 770 CE1 HIS A 128 66.533 29.704 -16.654 1.00 25.00 C ATOM 771 NE2 HIS A 128 67.119 30.106 -15.544 1.00 25.00 N ATOM 0 H HIS A 128 68.872 24.467 -14.950 1.00 25.00 H new ATOM 0 HA HIS A 128 68.366 26.823 -13.540 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.365 26.120 -16.121 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.658 25.838 -15.846 1.00 25.00 H new ATOM 0 HD2 HIS A 128 68.080 28.907 -13.988 1.00 25.00 H new ATOM 0 HE1 HIS A 128 66.065 30.367 -17.367 1.00 25.00 H new ATOM 0 HE2 HIS A 128 67.223 31.064 -15.209 1.00 25.00 H new ATOM 779 N ASN A 129 65.878 24.668 -13.543 1.00 25.00 N ATOM 780 CA ASN A 129 64.598 24.348 -12.925 1.00 25.00 C ATOM 781 C ASN A 129 64.808 23.944 -11.462 1.00 25.00 C ATOM 782 O ASN A 129 64.034 24.297 -10.578 1.00 25.00 O ATOM 783 CB ASN A 129 63.935 23.216 -13.712 1.00 25.00 C ATOM 784 CG ASN A 129 62.436 23.311 -13.709 1.00 25.00 C ATOM 785 OD1 ASN A 129 61.816 23.502 -12.685 1.00 25.00 O ATOM 786 ND2 ASN A 129 61.849 23.200 -14.868 1.00 25.00 N ATOM 0 H ASN A 129 66.252 23.933 -14.143 1.00 25.00 H new ATOM 0 HA ASN A 129 63.948 25.223 -12.943 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.294 23.235 -14.741 1.00 25.00 H new ATOM 0 HB3 ASN A 129 64.236 22.258 -13.287 1.00 25.00 H new ATOM 0 HD21 ASN A 129 60.834 23.274 -14.935 1.00 25.00 H new ATOM 0 HD22 ASN A 129 62.405 23.039 -15.708 1.00 25.00 H new ATOM 793 N PHE A 130 65.897 23.235 -11.204 1.00 25.00 N ATOM 794 CA PHE A 130 66.215 22.767 -9.858 1.00 25.00 C ATOM 795 C PHE A 130 66.401 23.914 -8.876 1.00 25.00 C ATOM 796 O PHE A 130 65.894 23.869 -7.761 1.00 25.00 O ATOM 797 CB PHE A 130 67.488 21.925 -9.901 1.00 25.00 C ATOM 798 CG PHE A 130 67.816 21.249 -8.598 1.00 25.00 C ATOM 799 CD1 PHE A 130 66.881 20.401 -7.977 1.00 25.00 C ATOM 800 CD2 PHE A 130 69.071 21.439 -7.991 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.194 19.736 -6.768 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.396 20.777 -6.781 1.00 25.00 C ATOM 803 CZ PHE A 130 68.455 19.923 -6.171 1.00 25.00 C ATOM 0 H PHE A 130 66.581 22.969 -11.912 1.00 25.00 H new ATOM 0 HA PHE A 130 65.372 22.170 -9.510 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.384 21.166 -10.677 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.324 22.562 -10.189 1.00 25.00 H new ATOM 0 HD1 PHE A 130 65.911 20.256 -8.429 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.794 22.096 -8.452 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.467 19.086 -6.304 1.00 25.00 H new ATOM 0 HE2 PHE A 130 70.364 20.927 -6.326 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.700 19.415 -5.250 1.00 25.00 H new ATOM 813 N ARG A 131 67.102 24.960 -9.288 1.00 25.00 N ATOM 814 CA ARG A 131 67.310 26.114 -8.407 1.00 25.00 C ATOM 815 C ARG A 131 65.999 26.869 -8.158 1.00 25.00 C ATOM 816 O ARG A 131 65.832 27.467 -7.105 1.00 25.00 O ATOM 817 CB ARG A 131 68.418 27.035 -8.941 1.00 25.00 C ATOM 818 CG ARG A 131 68.085 27.765 -10.232 1.00 25.00 C ATOM 819 CD ARG A 131 69.341 28.296 -10.900 1.00 25.00 C ATOM 820 NE ARG A 131 70.063 29.250 -10.042 1.00 25.00 N ATOM 821 CZ ARG A 131 71.316 29.649 -10.228 1.00 25.00 C ATOM 822 NH1 ARG A 131 72.046 29.224 -11.232 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 71.845 30.492 -9.383 1.00 25.00 N ATOM 0 H ARG A 131 67.532 25.040 -10.209 1.00 25.00 H new ATOM 0 HA ARG A 131 67.649 25.739 -7.441 1.00 25.00 H new ATOM 0 HB2 ARG A 131 68.655 27.774 -8.175 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.318 26.440 -9.100 1.00 25.00 H new ATOM 0 HG2 ARG A 131 67.566 27.089 -10.912 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.405 28.590 -10.022 1.00 25.00 H new ATOM 0 HD2 ARG A 131 69.999 27.463 -11.149 1.00 25.00 H new ATOM 0 HD3 ARG A 131 69.074 28.783 -11.838 1.00 25.00 H new ATOM 0 HE ARG A 131 69.561 29.635 -9.242 1.00 25.00 H new ATOM 0 HH11 ARG A 131 71.654 28.564 -11.904 1.00 25.00 H new ATOM 0 HH12 ARG A 131 73.005 29.554 -11.341 1.00 25.00 H new ATOM 0 HH21 ARG A 131 71.297 30.835 -8.594 1.00 25.00 H new ATOM 0 HH22 ARG A 131 72.806 30.808 -9.512 1.00 25.00 H new ATOM 837 N ALA A 132 65.067 26.815 -9.102 1.00 25.00 N ATOM 838 CA ALA A 132 63.758 27.442 -8.915 1.00 25.00 C ATOM 839 C ALA A 132 62.936 26.641 -7.890 1.00 25.00 C ATOM 840 O ALA A 132 62.308 27.210 -7.008 1.00 25.00 O ATOM 841 CB ALA A 132 63.015 27.529 -10.257 1.00 25.00 C ATOM 0 H ALA A 132 65.189 26.347 -10.000 1.00 25.00 H new ATOM 0 HA ALA A 132 63.898 28.454 -8.535 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.043 27.997 -10.105 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.599 28.125 -10.958 1.00 25.00 H new ATOM 0 HB3 ALA A 132 62.876 26.526 -10.661 1.00 25.00 H new ATOM 847 N LEU A 133 62.987 25.319 -7.977 1.00 25.00 N ATOM 848 CA LEU A 133 62.305 24.465 -6.996 1.00 25.00 C ATOM 849 C LEU A 133 62.937 24.664 -5.621 1.00 25.00 C ATOM 850 O LEU A 133 62.260 24.677 -4.603 1.00 25.00 O ATOM 851 CB LEU A 133 62.415 22.990 -7.397 1.00 25.00 C ATOM 852 CG LEU A 133 61.186 22.383 -8.094 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.873 23.068 -9.423 1.00 25.00 C ATOM 854 CD2 LEU A 133 61.428 20.891 -8.328 1.00 25.00 C ATOM 0 H LEU A 133 63.487 24.812 -8.707 1.00 25.00 H new ATOM 0 HA LEU A 133 61.251 24.743 -6.964 1.00 25.00 H new ATOM 0 HB2 LEU A 133 63.274 22.878 -8.058 1.00 25.00 H new ATOM 0 HB3 LEU A 133 62.624 22.406 -6.501 1.00 25.00 H new ATOM 0 HG LEU A 133 60.325 22.534 -7.442 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.997 22.603 -9.875 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.673 24.125 -9.249 1.00 25.00 H new ATOM 0 HD13 LEU A 133 61.725 22.966 -10.095 1.00 25.00 H new ATOM 0 HD21 LEU A 133 60.560 20.455 -8.822 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.308 20.759 -8.958 1.00 25.00 H new ATOM 0 HD23 LEU A 133 61.589 20.394 -7.371 1.00 25.00 H new ATOM 866 N CYS A 134 64.246 24.851 -5.605 1.00 25.00 N ATOM 867 CA CYS A 134 64.971 25.092 -4.366 1.00 25.00 C ATOM 868 C CYS A 134 64.531 26.395 -3.694 1.00 25.00 C ATOM 869 O CYS A 134 64.461 26.463 -2.475 1.00 25.00 O ATOM 870 CB CYS A 134 66.469 25.142 -4.657 1.00 25.00 C ATOM 871 SG CYS A 134 67.471 25.236 -3.184 1.00 25.00 S ATOM 0 H CYS A 134 64.832 24.841 -6.440 1.00 25.00 H new ATOM 0 HA CYS A 134 64.748 24.275 -3.680 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.752 24.255 -5.224 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.681 26.005 -5.288 1.00 25.00 H new ATOM 0 HG CYS A 134 68.683 24.853 -3.458 1.00 25.00 H new ATOM 877 N GLU A 135 64.225 27.420 -4.479 1.00 25.00 N ATOM 878 CA GLU A 135 63.745 28.699 -3.937 1.00 25.00 C ATOM 879 C GLU A 135 62.428 28.480 -3.192 1.00 25.00 C ATOM 880 O GLU A 135 62.246 28.969 -2.073 1.00 25.00 O ATOM 881 CB GLU A 135 63.557 29.711 -5.083 1.00 25.00 C ATOM 882 CG GLU A 135 62.814 30.996 -4.715 1.00 25.00 C ATOM 883 CD GLU A 135 62.805 32.005 -5.859 1.00 25.00 C ATOM 884 OE1 GLU A 135 63.902 32.489 -6.236 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 61.717 32.339 -6.366 1.00 25.00 O1- ATOM 0 H GLU A 135 64.299 27.397 -5.496 1.00 25.00 H new ATOM 0 HA GLU A 135 64.480 29.098 -3.237 1.00 25.00 H new ATOM 0 HB2 GLU A 135 64.539 29.979 -5.472 1.00 25.00 H new ATOM 0 HB3 GLU A 135 63.017 29.220 -5.893 1.00 25.00 H new ATOM 0 HG2 GLU A 135 61.788 30.754 -4.439 1.00 25.00 H new ATOM 0 HG3 GLU A 135 63.282 31.446 -3.840 1.00 25.00 H new ATOM 892 N LEU A 136 61.536 27.703 -3.792 1.00 25.00 N ATOM 893 CA LEU A 136 60.227 27.428 -3.201 1.00 25.00 C ATOM 894 C LEU A 136 60.345 26.735 -1.845 1.00 25.00 C ATOM 895 O LEU A 136 59.685 27.124 -0.886 1.00 25.00 O ATOM 896 CB LEU A 136 59.407 26.548 -4.156 1.00 25.00 C ATOM 897 CG LEU A 136 57.967 26.215 -3.726 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.079 27.464 -3.719 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.389 25.171 -4.679 1.00 25.00 C ATOM 0 H LEU A 136 61.693 27.249 -4.692 1.00 25.00 H new ATOM 0 HA LEU A 136 59.727 28.384 -3.044 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.366 27.045 -5.125 1.00 25.00 H new ATOM 0 HB3 LEU A 136 59.944 25.611 -4.300 1.00 25.00 H new ATOM 0 HG LEU A 136 57.992 25.822 -2.710 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.070 27.191 -3.411 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.486 28.196 -3.021 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.049 27.894 -4.720 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.369 24.931 -4.380 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.386 25.567 -5.694 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.000 24.269 -4.644 1.00 25.00 H new ATOM 911 N GLU A 137 61.175 25.706 -1.773 1.00 25.00 N ATOM 912 CA GLU A 137 61.313 24.926 -0.540 1.00 25.00 C ATOM 913 C GLU A 137 62.128 25.654 0.533 1.00 25.00 C ATOM 914 O GLU A 137 61.902 25.474 1.726 1.00 25.00 O ATOM 915 CB GLU A 137 61.994 23.593 -0.843 1.00 25.00 C ATOM 916 CG GLU A 137 61.239 22.696 -1.819 1.00 25.00 C ATOM 917 CD GLU A 137 59.836 22.342 -1.347 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.689 21.836 -0.213 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.880 22.532 -2.133 1.00 25.00 O1- ATOM 0 H GLU A 137 61.762 25.388 -2.544 1.00 25.00 H new ATOM 0 HA GLU A 137 60.305 24.772 -0.153 1.00 25.00 H new ATOM 0 HB2 GLU A 137 62.986 23.792 -1.247 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.134 23.051 0.093 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.175 23.195 -2.786 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.806 21.778 -1.972 1.00 25.00 H new ATOM 926 N SER A 138 63.103 26.452 0.117 1.00 25.00 N ATOM 927 CA SER A 138 63.968 27.146 1.076 1.00 25.00 C ATOM 928 C SER A 138 63.342 28.441 1.580 1.00 25.00 C ATOM 929 O SER A 138 63.701 28.929 2.654 1.00 25.00 O ATOM 930 CB SER A 138 65.332 27.451 0.457 1.00 25.00 C ATOM 931 OG SER A 138 65.210 28.335 -0.642 1.00 25.00 O ATOM 0 H SER A 138 63.317 26.636 -0.863 1.00 25.00 H new ATOM 0 HA SER A 138 64.094 26.475 1.925 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.986 27.891 1.210 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.802 26.523 0.130 1.00 25.00 H new ATOM 0 HG SER A 138 64.968 27.828 -1.445 1.00 25.00 H new ATOM 937 N GLY A 139 62.420 29.007 0.811 1.00 25.00 N ATOM 938 CA GLY A 139 61.731 30.216 1.235 1.00 25.00 C ATOM 939 C GLY A 139 62.562 31.475 1.083 1.00 25.00 C ATOM 940 O GLY A 139 62.185 32.533 1.591 1.00 25.00 O ATOM 0 H GLY A 139 62.135 28.651 -0.101 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.814 30.324 0.655 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.437 30.109 2.279 1.00 25.00 H new ATOM 944 N ILE A 140 63.691 31.377 0.393 1.00 25.00 N ATOM 945 CA ILE A 140 64.561 32.528 0.158 1.00 25.00 C ATOM 946 C ILE A 140 64.829 32.637 -1.343 1.00 25.00 C ATOM 947 O ILE A 140 64.895 31.619 -2.036 1.00 25.00 O ATOM 948 CB ILE A 140 65.909 32.424 0.942 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.652 31.114 0.610 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.652 32.518 2.469 1.00 25.00 C ATOM 951 CD1 ILE A 140 68.114 31.123 0.995 1.00 25.00 C ATOM 0 H ILE A 140 64.030 30.507 -0.017 1.00 25.00 H new ATOM 0 HA ILE A 140 64.055 33.422 0.523 1.00 25.00 H new ATOM 0 HB ILE A 140 66.540 33.258 0.633 1.00 25.00 H new ATOM 0 HG12 ILE A 140 66.157 30.288 1.121 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.570 30.922 -0.460 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.600 32.444 3.003 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.179 33.472 2.700 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.997 31.704 2.779 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.566 30.167 0.729 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.625 31.926 0.464 1.00 25.00 H new ATOM 0 HD13 ILE A 140 68.206 31.282 2.069 1.00 25.00 H new ATOM 963 N PRO A 141 64.950 33.868 -1.874 1.00 25.00 N ATOM 964 CA PRO A 141 65.136 33.946 -3.327 1.00 25.00 C ATOM 965 C PRO A 141 66.432 33.313 -3.823 1.00 25.00 C ATOM 966 O PRO A 141 67.505 33.526 -3.251 1.00 25.00 O ATOM 967 CB PRO A 141 65.161 35.458 -3.594 1.00 25.00 C ATOM 968 CG PRO A 141 64.467 36.062 -2.427 1.00 25.00 C ATOM 969 CD PRO A 141 64.888 35.213 -1.273 1.00 25.00 C ATOM 0 HA PRO A 141 64.351 33.398 -3.849 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.183 35.827 -3.681 1.00 25.00 H new ATOM 0 HB3 PRO A 141 64.653 35.703 -4.527 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.759 37.102 -2.284 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.385 36.050 -2.557 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.853 35.523 -0.871 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.172 35.259 -0.453 1.00 25.00 H new ATOM 977 N ALA A 142 66.346 32.606 -4.940 1.00 25.00 N ATOM 978 CA ALA A 142 67.518 32.046 -5.604 1.00 25.00 C ATOM 979 C ALA A 142 68.412 33.189 -6.092 1.00 25.00 C ATOM 980 O ALA A 142 69.610 33.022 -6.267 1.00 25.00 O ATOM 981 CB ALA A 142 67.086 31.156 -6.780 1.00 25.00 C ATOM 0 H ALA A 142 65.465 32.404 -5.412 1.00 25.00 H new ATOM 0 HA ALA A 142 68.078 31.429 -4.901 1.00 25.00 H new ATOM 0 HB1 ALA A 142 67.969 30.744 -7.268 1.00 25.00 H new ATOM 0 HB2 ALA A 142 66.462 30.342 -6.410 1.00 25.00 H new ATOM 0 HB3 ALA A 142 66.520 31.750 -7.497 1.00 25.00 H new ATOM 987 N ALA A 143 67.808 34.349 -6.310 1.00 25.00 N ATOM 988 CA ALA A 143 68.532 35.539 -6.751 1.00 25.00 C ATOM 989 C ALA A 143 69.512 36.044 -5.678 1.00 25.00 C ATOM 990 O ALA A 143 70.497 36.705 -5.992 1.00 25.00 O ATOM 991 CB ALA A 143 67.527 36.644 -7.104 1.00 25.00 C ATOM 0 H ALA A 143 66.806 34.494 -6.187 1.00 25.00 H new ATOM 0 HA ALA A 143 69.119 35.272 -7.630 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.065 37.533 -7.433 1.00 25.00 H new ATOM 0 HB2 ALA A 143 66.873 36.298 -7.904 1.00 25.00 H new ATOM 0 HB3 ALA A 143 66.929 36.886 -6.225 1.00 25.00 H new ATOM 997 N GLU A 144 69.228 35.738 -4.420 1.00 25.00 N ATOM 998 CA GLU A 144 70.056 36.187 -3.297 1.00 25.00 C ATOM 999 C GLU A 144 70.971 35.066 -2.819 1.00 25.00 C ATOM 1000 O GLU A 144 71.568 35.155 -1.747 1.00 25.00 O ATOM 1001 CB GLU A 144 69.161 36.599 -2.123 1.00 25.00 C ATOM 1002 CG GLU A 144 68.263 37.791 -2.402 1.00 25.00 C ATOM 1003 CD GLU A 144 67.433 38.171 -1.184 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.520 37.462 -0.152 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 66.697 39.174 -1.251 1.00 25.00 O1- ATOM 0 H GLU A 144 68.423 35.175 -4.144 1.00 25.00 H new ATOM 0 HA GLU A 144 70.655 37.031 -3.639 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.539 35.750 -1.842 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.792 36.829 -1.265 1.00 25.00 H new ATOM 0 HG2 GLU A 144 68.873 38.642 -2.706 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.600 37.559 -3.236 1.00 25.00 H new ATOM 1012 N SER A 145 71.031 33.980 -3.574 1.00 25.00 N ATOM 1013 CA SER A 145 71.725 32.786 -3.115 1.00 25.00 C ATOM 1014 C SER A 145 72.541 32.116 -4.216 1.00 25.00 C ATOM 1015 O SER A 145 72.308 32.321 -5.404 1.00 25.00 O ATOM 1016 CB SER A 145 70.681 31.813 -2.564 1.00 25.00 C ATOM 1017 OG SER A 145 71.269 30.867 -1.694 1.00 25.00 O ATOM 0 H SER A 145 70.611 33.900 -4.500 1.00 25.00 H new ATOM 0 HA SER A 145 72.437 33.077 -2.343 1.00 25.00 H new ATOM 0 HB2 SER A 145 69.908 32.368 -2.032 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.191 31.296 -3.389 1.00 25.00 H new ATOM 0 HG SER A 145 70.615 30.595 -1.017 1.00 25.00 H new ATOM 1023 N GLN A 146 73.499 31.298 -3.816 1.00 25.00 N ATOM 1024 CA GLN A 146 74.323 30.554 -4.762 1.00 25.00 C ATOM 1025 C GLN A 146 74.185 29.072 -4.496 1.00 25.00 C ATOM 1026 O GLN A 146 73.926 28.665 -3.375 1.00 25.00 O ATOM 1027 CB GLN A 146 75.789 30.959 -4.643 1.00 25.00 C ATOM 1028 CG GLN A 146 76.044 32.411 -4.991 1.00 25.00 C ATOM 1029 CD GLN A 146 77.485 32.649 -5.361 1.00 25.00 C ATOM 1030 OE1 GLN A 146 78.337 32.852 -4.515 1.00 25.00 O ATOM 1031 NE2 GLN A 146 77.769 32.586 -6.636 1.00 25.00 N ATOM 0 H GLN A 146 73.729 31.129 -2.837 1.00 25.00 H new ATOM 0 HA GLN A 146 73.982 30.783 -5.772 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.128 30.773 -3.624 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.387 30.326 -5.298 1.00 25.00 H new ATOM 0 HG2 GLN A 146 75.402 32.705 -5.821 1.00 25.00 H new ATOM 0 HG3 GLN A 146 75.777 33.041 -4.143 1.00 25.00 H new ATOM 0 HE21 GLN A 146 77.028 32.414 -7.316 1.00 25.00 H new ATOM 0 HE22 GLN A 146 78.731 32.709 -6.951 1.00 25.00 H new ATOM 1040 N ILE A 147 74.374 28.270 -5.529 1.00 25.00 N ATOM 1041 CA ILE A 147 74.266 26.820 -5.421 1.00 25.00 C ATOM 1042 C ILE A 147 75.635 26.201 -5.708 1.00 25.00 C ATOM 1043 O ILE A 147 76.357 26.633 -6.611 1.00 25.00 O ATOM 1044 CB ILE A 147 73.162 26.283 -6.378 1.00 25.00 C ATOM 1045 CG1 ILE A 147 73.119 24.745 -6.308 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.374 26.821 -7.815 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.923 24.101 -7.002 1.00 25.00 C ATOM 0 H ILE A 147 74.606 28.601 -6.465 1.00 25.00 H new ATOM 0 HA ILE A 147 73.967 26.538 -4.412 1.00 25.00 H new ATOM 0 HB ILE A 147 72.186 26.648 -6.059 1.00 25.00 H new ATOM 0 HG12 ILE A 147 74.033 24.350 -6.752 1.00 25.00 H new ATOM 0 HG13 ILE A 147 73.117 24.444 -5.260 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.592 26.434 -8.468 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.332 27.910 -7.806 1.00 25.00 H new ATOM 0 HG23 ILE A 147 74.347 26.498 -8.184 1.00 25.00 H new ATOM 0 HD11 ILE A 147 71.982 23.018 -6.898 1.00 25.00 H new ATOM 0 HD12 ILE A 147 71.001 24.460 -6.545 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.931 24.365 -8.060 1.00 25.00 H new ATOM 1059 N VAL A 148 76.008 25.245 -4.875 1.00 25.00 N ATOM 1060 CA VAL A 148 77.325 24.614 -4.891 1.00 25.00 C ATOM 1061 C VAL A 148 77.163 23.096 -4.793 1.00 25.00 C ATOM 1062 O VAL A 148 76.371 22.602 -4.001 1.00 25.00 O ATOM 1063 CB VAL A 148 78.173 25.125 -3.668 1.00 25.00 C ATOM 1064 CG1 VAL A 148 79.560 24.467 -3.621 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.340 26.655 -3.730 1.00 25.00 C ATOM 0 H VAL A 148 75.393 24.874 -4.151 1.00 25.00 H new ATOM 0 HA VAL A 148 77.836 24.870 -5.819 1.00 25.00 H new ATOM 0 HB VAL A 148 77.630 24.849 -2.764 1.00 25.00 H new ATOM 0 HG11 VAL A 148 80.114 24.847 -2.762 1.00 25.00 H new ATOM 0 HG12 VAL A 148 79.447 23.387 -3.531 1.00 25.00 H new ATOM 0 HG13 VAL A 148 80.105 24.700 -4.536 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.929 26.992 -2.877 1.00 25.00 H new ATOM 0 HG22 VAL A 148 78.850 26.928 -4.654 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.359 27.129 -3.704 1.00 25.00 H new ATOM 1075 N TYR A 149 77.939 22.363 -5.576 1.00 25.00 N ATOM 1076 CA TYR A 149 77.967 20.903 -5.521 1.00 25.00 C ATOM 1077 C TYR A 149 79.411 20.495 -5.727 1.00 25.00 C ATOM 1078 O TYR A 149 80.114 21.137 -6.501 1.00 25.00 O ATOM 1079 CB TYR A 149 77.108 20.311 -6.628 1.00 25.00 C ATOM 1080 CG TYR A 149 77.292 18.824 -6.797 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.819 17.924 -5.824 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.955 18.304 -7.930 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.010 16.529 -5.975 1.00 25.00 C ATOM 1084 CE2 TYR A 149 78.139 16.906 -8.085 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.663 16.030 -7.108 1.00 25.00 C ATOM 1086 OH TYR A 149 77.849 14.684 -7.272 1.00 25.00 O ATOM 0 H TYR A 149 78.570 22.762 -6.271 1.00 25.00 H new ATOM 0 HA TYR A 149 77.577 20.543 -4.569 1.00 25.00 H new ATOM 0 HB2 TYR A 149 76.059 20.518 -6.414 1.00 25.00 H new ATOM 0 HB3 TYR A 149 77.346 20.808 -7.568 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.305 18.301 -4.953 1.00 25.00 H new ATOM 0 HD2 TYR A 149 78.326 18.978 -8.687 1.00 25.00 H new ATOM 0 HE1 TYR A 149 76.652 15.850 -5.216 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.646 16.520 -8.957 1.00 25.00 H new ATOM 0 HH TYR A 149 77.296 14.196 -6.626 1.00 25.00 H new ATOM 1096 N ALA A 150 79.865 19.470 -5.010 1.00 25.00 N ATOM 1097 CA ALA A 150 81.255 19.007 -5.091 1.00 25.00 C ATOM 1098 C ALA A 150 82.234 20.187 -4.936 1.00 25.00 C ATOM 1099 O ALA A 150 83.175 20.332 -5.712 1.00 25.00 O ATOM 1100 CB ALA A 150 81.491 18.259 -6.425 1.00 25.00 C ATOM 0 H ALA A 150 79.287 18.938 -4.360 1.00 25.00 H new ATOM 0 HA ALA A 150 81.440 18.313 -4.271 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.526 17.920 -6.474 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.824 17.399 -6.483 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.289 18.931 -7.259 1.00 25.00 H new ATOM 1106 N GLU A 151 81.953 21.037 -3.949 1.00 25.00 N ATOM 1107 CA GLU A 151 82.757 22.236 -3.620 1.00 25.00 C ATOM 1108 C GLU A 151 82.874 23.285 -4.745 1.00 25.00 C ATOM 1109 O GLU A 151 83.659 24.225 -4.638 1.00 25.00 O ATOM 1110 CB GLU A 151 84.169 21.836 -3.161 1.00 25.00 C ATOM 1111 CG GLU A 151 84.197 20.855 -2.000 1.00 25.00 C ATOM 1112 CD GLU A 151 85.620 20.515 -1.595 1.00 25.00 C ATOM 1113 OE1 GLU A 151 86.256 21.339 -0.904 1.00 25.00 O ATOM 1114 OE2 GLU A 151 86.120 19.447 -2.012 1.00 25.00 O1- ATOM 0 H GLU A 151 81.146 20.918 -3.337 1.00 25.00 H new ATOM 0 HA GLU A 151 82.201 22.717 -2.815 1.00 25.00 H new ATOM 0 HB2 GLU A 151 84.701 21.397 -4.005 1.00 25.00 H new ATOM 0 HB3 GLU A 151 84.713 22.736 -2.874 1.00 25.00 H new ATOM 0 HG2 GLU A 151 83.667 21.282 -1.148 1.00 25.00 H new ATOM 0 HG3 GLU A 151 83.669 19.943 -2.280 1.00 25.00 H new ATOM 1121 N ARG A 152 82.100 23.140 -5.813 1.00 25.00 N ATOM 1122 CA ARG A 152 82.174 24.056 -6.959 1.00 25.00 C ATOM 1123 C ARG A 152 80.792 24.634 -7.271 1.00 25.00 C ATOM 1124 O ARG A 152 79.786 23.944 -7.133 1.00 25.00 O ATOM 1125 CB ARG A 152 82.719 23.286 -8.166 1.00 25.00 C ATOM 1126 CG ARG A 152 84.192 22.884 -8.007 1.00 25.00 C ATOM 1127 CD ARG A 152 84.492 21.550 -8.681 1.00 25.00 C ATOM 1128 NE ARG A 152 85.924 21.203 -8.588 1.00 25.00 N ATOM 1129 CZ ARG A 152 86.512 20.598 -7.557 1.00 25.00 C ATOM 1130 NH1 ARG A 152 85.869 20.230 -6.481 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 87.793 20.360 -7.614 1.00 25.00 N ATOM 0 H ARG A 152 81.410 22.396 -5.916 1.00 25.00 H new ATOM 0 HA ARG A 152 82.838 24.888 -6.724 1.00 25.00 H new ATOM 0 HB2 ARG A 152 82.118 22.390 -8.319 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.610 23.899 -9.060 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.828 23.659 -8.435 1.00 25.00 H new ATOM 0 HG3 ARG A 152 84.438 22.819 -6.947 1.00 25.00 H new ATOM 0 HD2 ARG A 152 83.896 20.765 -8.216 1.00 25.00 H new ATOM 0 HD3 ARG A 152 84.196 21.597 -9.729 1.00 25.00 H new ATOM 0 HE ARG A 152 86.515 21.448 -9.383 1.00 25.00 H new ATOM 0 HH11 ARG A 152 84.867 20.403 -6.402 1.00 25.00 H new ATOM 0 HH12 ARG A 152 86.369 19.770 -5.720 1.00 25.00 H new ATOM 0 HH21 ARG A 152 88.327 20.636 -8.438 1.00 25.00 H new ATOM 0 HH22 ARG A 152 88.261 19.898 -6.834 1.00 25.00 H new ATOM 1145 N PRO A 153 80.716 25.921 -7.650 1.00 25.00 N ATOM 1146 CA PRO A 153 79.371 26.442 -7.902 1.00 25.00 C ATOM 1147 C PRO A 153 78.760 25.905 -9.191 1.00 25.00 C ATOM 1148 O PRO A 153 79.459 25.654 -10.173 1.00 25.00 O ATOM 1149 CB PRO A 153 79.599 27.952 -7.987 1.00 25.00 C ATOM 1150 CG PRO A 153 80.972 28.078 -8.522 1.00 25.00 C ATOM 1151 CD PRO A 153 81.740 26.962 -7.854 1.00 25.00 C ATOM 0 HA PRO A 153 78.663 26.146 -7.128 1.00 25.00 H new ATOM 0 HB2 PRO A 153 78.870 28.429 -8.642 1.00 25.00 H new ATOM 0 HB3 PRO A 153 79.507 28.425 -7.009 1.00 25.00 H new ATOM 0 HG2 PRO A 153 80.986 27.976 -9.607 1.00 25.00 H new ATOM 0 HG3 PRO A 153 81.402 29.052 -8.288 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.557 26.605 -8.480 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.179 27.285 -6.910 1.00 25.00 H new ATOM 1159 N LEU A 154 77.448 25.755 -9.185 1.00 25.00 N ATOM 1160 CA LEU A 154 76.716 25.287 -10.364 1.00 25.00 C ATOM 1161 C LEU A 154 76.201 26.506 -11.121 1.00 0.00 C ATOM 1162 O LEU A 154 75.269 27.179 -10.680 1.00 25.00 O ATOM 1163 CB LEU A 154 75.556 24.358 -9.968 1.00 25.00 C ATOM 1164 CG LEU A 154 75.927 23.077 -9.194 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.690 22.224 -8.944 1.00 25.00 C ATOM 1166 CD2 LEU A 154 76.917 22.258 -9.971 1.00 25.00 C ATOM 0 H LEU A 154 76.859 25.950 -8.376 1.00 25.00 H new ATOM 0 HA LEU A 154 77.383 24.707 -11.002 1.00 25.00 H new ATOM 0 HB2 LEU A 154 74.854 24.930 -9.362 1.00 25.00 H new ATOM 0 HB3 LEU A 154 75.029 24.066 -10.876 1.00 25.00 H new ATOM 0 HG LEU A 154 76.364 23.382 -8.243 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.973 21.325 -8.397 1.00 25.00 H new ATOM 0 HD12 LEU A 154 73.968 22.793 -8.359 1.00 25.00 H new ATOM 0 HD13 LEU A 154 74.243 21.943 -9.898 1.00 25.00 H new ATOM 0 HD21 LEU A 154 77.166 21.358 -9.408 1.00 25.00 H new ATOM 0 HD22 LEU A 154 76.483 21.977 -10.931 1.00 25.00 H new ATOM 0 HD23 LEU A 154 77.821 22.843 -10.139 1.00 25.00 H new ATOM 1178 N THR A 155 76.869 26.839 -12.217 1.00 25.00 N ATOM 1179 CA THR A 155 76.569 28.065 -12.962 1.00 25.00 C ATOM 1180 C THR A 155 75.977 27.828 -14.349 1.00 25.00 C ATOM 1181 O THR A 155 75.306 28.702 -14.893 1.00 25.00 O ATOM 1182 CB THR A 155 77.852 28.896 -13.143 1.00 25.00 C ATOM 1183 OG1 THR A 155 78.840 28.097 -13.799 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.422 29.325 -11.793 1.00 25.00 C ATOM 0 H THR A 155 77.624 26.280 -12.614 1.00 25.00 H new ATOM 0 HA THR A 155 75.820 28.586 -12.365 1.00 25.00 H new ATOM 0 HB THR A 155 77.603 29.780 -13.730 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.659 28.622 -13.918 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.328 29.910 -11.950 1.00 25.00 H new ATOM 0 HG22 THR A 155 77.686 29.930 -11.263 1.00 25.00 H new ATOM 0 HG23 THR A 155 78.659 28.441 -11.201 1.00 25.00 H new ATOM 1192 N ASP A 156 76.220 26.661 -14.928 1.00 25.00 N ATOM 1193 CA ASP A 156 75.683 26.342 -16.252 1.00 25.00 C ATOM 1194 C ASP A 156 74.259 25.815 -16.078 1.00 25.00 C ATOM 1195 O ASP A 156 74.037 24.657 -15.716 1.00 25.00 O ATOM 1196 CB ASP A 156 76.575 25.324 -16.969 1.00 25.00 C ATOM 1197 CG ASP A 156 76.169 25.104 -18.412 1.00 25.00 C ATOM 1198 OD1 ASP A 156 75.080 25.566 -18.820 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 76.950 24.445 -19.140 1.00 25.00 O1- ATOM 0 H ASP A 156 76.782 25.920 -14.508 1.00 25.00 H new ATOM 0 HA ASP A 156 75.663 27.237 -16.874 1.00 25.00 H new ATOM 0 HB2 ASP A 156 77.609 25.666 -16.935 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.536 24.374 -16.436 1.00 25.00 H new ATOM 1204 N ASN A 157 73.300 26.707 -16.276 1.00 25.00 N ATOM 1205 CA ASN A 157 71.885 26.401 -16.066 1.00 25.00 C ATOM 1206 C ASN A 157 71.344 25.381 -17.061 1.00 25.00 C ATOM 1207 O ASN A 157 70.352 24.713 -16.786 1.00 25.00 O ATOM 1208 CB ASN A 157 71.060 27.687 -16.213 1.00 25.00 C ATOM 1209 CG ASN A 157 71.126 28.573 -14.993 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.147 28.108 -13.861 1.00 25.00 O ATOM 1211 ND2 ASN A 157 71.141 29.857 -15.217 1.00 25.00 N ATOM 0 H ASN A 157 73.476 27.663 -16.586 1.00 25.00 H new ATOM 0 HA ASN A 157 71.801 25.977 -15.065 1.00 25.00 H new ATOM 0 HB2 ASN A 157 71.417 28.244 -17.079 1.00 25.00 H new ATOM 0 HB3 ASN A 157 70.020 27.425 -16.409 1.00 25.00 H new ATOM 0 HD21 ASN A 157 71.171 30.511 -14.435 1.00 25.00 H new ATOM 0 HD22 ASN A 157 71.123 30.208 -16.175 1.00 25.00 H new ATOM 1218 N HIS A 158 71.974 25.299 -18.226 1.00 25.00 N ATOM 1219 CA HIS A 158 71.471 24.477 -19.327 1.00 25.00 C ATOM 1220 C HIS A 158 71.761 22.995 -19.147 1.00 25.00 C ATOM 1221 O HIS A 158 71.281 22.163 -19.909 1.00 25.00 O ATOM 1222 CB HIS A 158 72.109 24.950 -20.632 1.00 25.00 C ATOM 1223 CG HIS A 158 71.916 26.410 -20.891 1.00 25.00 C ATOM 1224 ND1 HIS A 158 70.723 26.983 -21.249 1.00 25.00 N ATOM 1225 CD2 HIS A 158 72.800 27.445 -20.825 1.00 25.00 C ATOM 1226 CE1 HIS A 158 70.913 28.292 -21.384 1.00 25.00 C ATOM 1227 NE2 HIS A 158 72.162 28.631 -21.130 1.00 25.00 N ATOM 0 H HIS A 158 72.840 25.794 -18.437 1.00 25.00 H new ATOM 0 HA HIS A 158 70.387 24.594 -19.346 1.00 25.00 H new ATOM 0 HB2 HIS A 158 73.176 24.731 -20.607 1.00 25.00 H new ATOM 0 HB3 HIS A 158 71.687 24.382 -21.461 1.00 25.00 H new ATOM 0 HD2 HIS A 158 73.846 27.351 -20.571 1.00 25.00 H new ATOM 0 HE1 HIS A 158 70.140 28.991 -21.667 1.00 25.00 H new ATOM 0 HE2 HIS A 158 72.568 29.566 -21.154 1.00 25.00 H new ATOM 1235 N ARG A 159 72.560 22.660 -18.148 1.00 25.00 N ATOM 1236 CA ARG A 159 72.877 21.263 -17.885 1.00 25.00 C ATOM 1237 C ARG A 159 71.834 20.674 -16.979 1.00 25.00 C ATOM 1238 O ARG A 159 71.348 21.335 -16.061 1.00 25.00 O ATOM 1239 CB ARG A 159 74.234 21.135 -17.211 1.00 25.00 C ATOM 1240 CG ARG A 159 75.368 21.480 -18.116 1.00 25.00 C ATOM 1241 CD ARG A 159 76.678 21.373 -17.385 1.00 25.00 C ATOM 1242 NE ARG A 159 77.760 21.850 -18.252 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.859 21.178 -18.563 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.114 19.978 -18.092 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 79.719 21.732 -19.368 1.00 25.00 N ATOM 0 H ARG A 159 72.998 23.326 -17.511 1.00 25.00 H new ATOM 0 HA ARG A 159 72.899 20.732 -18.837 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.263 21.786 -16.337 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.360 20.114 -16.852 1.00 25.00 H new ATOM 0 HG2 ARG A 159 75.370 20.812 -18.977 1.00 25.00 H new ATOM 0 HG3 ARG A 159 75.240 22.493 -18.499 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.645 21.962 -16.469 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.860 20.339 -17.093 1.00 25.00 H new ATOM 0 HE ARG A 159 77.658 22.783 -18.652 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.453 19.527 -17.460 1.00 25.00 H new ATOM 0 HH12 ARG A 159 79.973 19.497 -18.359 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.539 22.663 -19.744 1.00 25.00 H new ATOM 0 HH22 ARG A 159 80.573 21.235 -19.623 1.00 25.00 H new ATOM 1259 N SER A 160 71.536 19.411 -17.199 1.00 25.00 N ATOM 1260 CA SER A 160 70.657 18.689 -16.311 1.00 25.00 C ATOM 1261 C SER A 160 71.455 18.220 -15.109 1.00 25.00 C ATOM 1262 O SER A 160 72.687 18.258 -15.107 1.00 25.00 O ATOM 1263 CB SER A 160 70.034 17.507 -17.032 1.00 25.00 C ATOM 1264 OG SER A 160 71.014 16.625 -17.555 1.00 25.00 O ATOM 0 H SER A 160 71.890 18.866 -17.985 1.00 25.00 H new ATOM 0 HA SER A 160 69.850 19.343 -15.979 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.387 16.963 -16.344 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.403 17.869 -17.843 1.00 25.00 H new ATOM 0 HG SER A 160 70.598 16.023 -18.206 1.00 25.00 H new ATOM 1270 N LEU A 161 70.762 17.788 -14.075 1.00 25.00 N ATOM 1271 CA LEU A 161 71.412 17.353 -12.845 1.00 25.00 C ATOM 1272 C LEU A 161 72.258 16.096 -13.074 1.00 25.00 C ATOM 1273 O LEU A 161 73.381 15.991 -12.562 1.00 25.00 O ATOM 1274 CB LEU A 161 70.339 17.125 -11.782 1.00 25.00 C ATOM 1275 CG LEU A 161 69.600 18.418 -11.392 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.320 18.084 -10.659 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.483 19.328 -10.529 1.00 25.00 C ATOM 0 H LEU A 161 69.744 17.727 -14.058 1.00 25.00 H new ATOM 0 HA LEU A 161 72.099 18.126 -12.502 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.617 16.397 -12.152 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.800 16.694 -10.894 1.00 25.00 H new ATOM 0 HG LEU A 161 69.358 18.957 -12.308 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.805 19.006 -10.388 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.677 17.485 -11.304 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.554 17.520 -9.756 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.931 20.232 -10.271 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.765 18.802 -9.617 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.381 19.597 -11.085 1.00 25.00 H new ATOM 1289 N ALA A 162 71.778 15.189 -13.914 1.00 25.00 N ATOM 1290 CA ALA A 162 72.551 13.997 -14.268 1.00 25.00 C ATOM 1291 C ALA A 162 73.840 14.392 -15.001 1.00 25.00 C ATOM 1292 O ALA A 162 74.871 13.746 -14.845 1.00 25.00 O ATOM 1293 CB ALA A 162 71.714 13.061 -15.136 1.00 25.00 C ATOM 0 H ALA A 162 70.864 15.251 -14.362 1.00 25.00 H new ATOM 0 HA ALA A 162 72.821 13.474 -13.350 1.00 25.00 H new ATOM 0 HB1 ALA A 162 72.302 12.179 -15.392 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.822 12.757 -14.588 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.420 13.578 -16.049 1.00 25.00 H new ATOM 1299 N SER A 163 73.794 15.486 -15.749 1.00 25.00 N ATOM 1300 CA SER A 163 74.975 15.994 -16.457 1.00 25.00 C ATOM 1301 C SER A 163 76.019 16.553 -15.486 1.00 25.00 C ATOM 1302 O SER A 163 77.181 16.732 -15.854 1.00 25.00 O ATOM 1303 CB SER A 163 74.587 17.076 -17.464 1.00 25.00 C ATOM 1304 OG SER A 163 73.672 16.579 -18.424 1.00 25.00 O ATOM 0 H SER A 163 72.952 16.045 -15.885 1.00 25.00 H new ATOM 0 HA SER A 163 75.413 15.149 -16.989 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.144 17.922 -16.939 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.481 17.445 -17.967 1.00 25.00 H new ATOM 0 HG SER A 163 72.763 16.620 -18.061 1.00 25.00 H new ATOM 1310 N TYR A 164 75.612 16.824 -14.251 1.00 25.00 N ATOM 1311 CA TYR A 164 76.539 17.280 -13.215 1.00 25.00 C ATOM 1312 C TYR A 164 76.952 16.119 -12.315 1.00 25.00 C ATOM 1313 O TYR A 164 77.809 16.274 -11.449 1.00 25.00 O ATOM 1314 CB TYR A 164 75.880 18.343 -12.345 1.00 25.00 C ATOM 1315 CG TYR A 164 75.942 19.737 -12.901 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.174 20.417 -12.992 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.771 20.408 -13.300 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.230 21.755 -13.449 1.00 25.00 C ATOM 1319 CE2 TYR A 164 74.827 21.747 -13.754 1.00 25.00 C ATOM 1320 CZ TYR A 164 76.053 22.408 -13.808 1.00 25.00 C ATOM 1321 OH TYR A 164 76.106 23.708 -14.206 1.00 25.00 O ATOM 0 H TYR A 164 74.645 16.736 -13.940 1.00 25.00 H new ATOM 0 HA TYR A 164 77.416 17.693 -13.714 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.835 18.073 -12.194 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.356 18.336 -11.364 1.00 25.00 H new ATOM 0 HD1 TYR A 164 78.085 19.911 -12.710 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.821 19.896 -13.259 1.00 25.00 H new ATOM 0 HE1 TYR A 164 78.179 22.266 -13.519 1.00 25.00 H new ATOM 0 HE2 TYR A 164 73.923 22.255 -14.057 1.00 25.00 H new ATOM 0 HH TYR A 164 75.310 23.920 -14.738 1.00 25.00 H new ATOM 1331 N GLY A 165 76.330 14.966 -12.510 1.00 25.00 N ATOM 1332 CA GLY A 165 76.618 13.806 -11.685 1.00 25.00 C ATOM 1333 C GLY A 165 75.819 13.763 -10.395 1.00 25.00 C ATOM 1334 O GLY A 165 76.186 13.035 -9.469 1.00 25.00 O ATOM 0 H GLY A 165 75.625 14.810 -13.230 1.00 25.00 H new ATOM 0 HA2 GLY A 165 76.413 12.902 -12.259 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.681 13.797 -11.444 1.00 25.00 H new ATOM 1338 N LEU A 166 74.721 14.511 -10.319 1.00 25.00 N ATOM 1339 CA LEU A 166 73.884 14.488 -9.118 1.00 25.00 C ATOM 1340 C LEU A 166 73.108 13.172 -9.051 1.00 25.00 C ATOM 1341 O LEU A 166 71.966 13.076 -9.486 1.00 25.00 O ATOM 1342 CB LEU A 166 72.904 15.669 -9.096 1.00 25.00 C ATOM 1343 CG LEU A 166 73.307 16.975 -8.393 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.515 16.749 -6.897 1.00 25.00 C ATOM 1345 CD2 LEU A 166 74.539 17.608 -8.999 1.00 25.00 C ATOM 0 H LEU A 166 74.392 15.131 -11.059 1.00 25.00 H new ATOM 0 HA LEU A 166 74.538 14.574 -8.250 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.666 15.915 -10.131 1.00 25.00 H new ATOM 0 HB3 LEU A 166 71.982 15.319 -8.632 1.00 25.00 H new ATOM 0 HG LEU A 166 72.480 17.670 -8.539 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.799 17.689 -6.423 1.00 25.00 H new ATOM 0 HD12 LEU A 166 72.589 16.384 -6.452 1.00 25.00 H new ATOM 0 HD13 LEU A 166 74.305 16.013 -6.747 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.777 18.527 -8.463 1.00 25.00 H new ATOM 0 HD22 LEU A 166 75.378 16.916 -8.924 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.351 17.838 -10.048 1.00 25.00 H new ATOM 1357 N LYS A 167 73.768 12.156 -8.520 1.00 25.00 N ATOM 1358 CA LYS A 167 73.161 10.840 -8.309 1.00 25.00 C ATOM 1359 C LYS A 167 72.057 10.924 -7.256 1.00 25.00 C ATOM 1360 O LYS A 167 72.033 11.835 -6.419 1.00 25.00 O ATOM 1361 CB LYS A 167 74.226 9.847 -7.824 1.00 25.00 C ATOM 1362 CG LYS A 167 74.814 10.258 -6.483 1.00 25.00 C ATOM 1363 CD LYS A 167 75.761 9.269 -5.898 1.00 25.00 C ATOM 1364 CE LYS A 167 76.134 9.770 -4.511 1.00 25.00 C ATOM 1365 NZ LYS A 167 77.043 8.833 -3.801 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.741 12.214 -8.221 1.00 25.00 H new ATOM 0 HA LYS A 167 72.737 10.503 -9.255 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.785 8.854 -7.738 1.00 25.00 H new ATOM 0 HB3 LYS A 167 75.023 9.779 -8.564 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.330 11.210 -6.603 1.00 25.00 H new ATOM 0 HG3 LYS A 167 73.999 10.424 -5.778 1.00 25.00 H new ATOM 0 HD2 LYS A 167 75.300 8.283 -5.840 1.00 25.00 H new ATOM 0 HD3 LYS A 167 76.649 9.170 -6.523 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.614 10.745 -4.596 1.00 25.00 H new ATOM 0 HE3 LYS A 167 75.228 9.911 -3.922 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 77.270 9.215 -2.861 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 76.576 7.910 -3.696 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 77.919 8.718 -4.349 1.00 25.00 H new ATOM 1379 N ASP A 168 71.200 9.922 -7.233 1.00 25.00 N ATOM 1380 CA ASP A 168 70.193 9.821 -6.196 1.00 25.00 C ATOM 1381 C ASP A 168 70.881 9.763 -4.833 1.00 25.00 C ATOM 1382 O ASP A 168 71.843 9.022 -4.618 1.00 25.00 O ATOM 1383 CB ASP A 168 69.311 8.579 -6.407 1.00 25.00 C ATOM 1384 CG ASP A 168 70.110 7.278 -6.419 1.00 25.00 C ATOM 1385 OD1 ASP A 168 70.950 7.093 -7.335 1.00 25.00 O ATOM 1386 OD2 ASP A 168 69.836 6.408 -5.565 1.00 25.00 O1- ATOM 0 H ASP A 168 71.181 9.168 -7.919 1.00 25.00 H new ATOM 0 HA ASP A 168 69.547 10.698 -6.240 1.00 25.00 H new ATOM 0 HB2 ASP A 168 68.563 8.533 -5.616 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.773 8.678 -7.350 1.00 25.00 H new ATOM 1391 N GLY A 169 70.407 10.603 -3.931 1.00 25.00 N ATOM 1392 CA GLY A 169 70.940 10.654 -2.584 1.00 25.00 C ATOM 1393 C GLY A 169 72.079 11.634 -2.417 1.00 25.00 C ATOM 1394 O GLY A 169 72.560 11.817 -1.300 1.00 25.00 O ATOM 0 H GLY A 169 69.650 11.262 -4.110 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.138 10.922 -1.896 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.284 9.659 -2.301 1.00 25.00 H new ATOM 1398 N ASP A 170 72.526 12.276 -3.490 1.00 25.00 N ATOM 1399 CA ASP A 170 73.607 13.250 -3.350 1.00 25.00 C ATOM 1400 C ASP A 170 73.105 14.566 -2.750 1.00 25.00 C ATOM 1401 O ASP A 170 71.892 14.819 -2.690 1.00 25.00 O ATOM 1402 CB ASP A 170 74.283 13.506 -4.685 1.00 25.00 C ATOM 1403 CG ASP A 170 75.794 13.597 -4.552 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.275 14.056 -3.493 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.508 13.162 -5.478 1.00 25.00 O1- ATOM 0 H ASP A 170 72.172 12.148 -4.438 1.00 25.00 H new ATOM 0 HA ASP A 170 74.339 12.824 -2.664 1.00 25.00 H new ATOM 0 HB2 ASP A 170 74.028 12.705 -5.379 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.901 14.433 -5.113 1.00 25.00 H new ATOM 1410 N VAL A 171 74.037 15.385 -2.279 1.00 25.00 N ATOM 1411 CA VAL A 171 73.706 16.617 -1.561 1.00 25.00 C ATOM 1412 C VAL A 171 74.189 17.868 -2.298 1.00 25.00 C ATOM 1413 O VAL A 171 75.366 17.989 -2.646 1.00 25.00 O ATOM 1414 CB VAL A 171 74.333 16.608 -0.128 1.00 25.00 C ATOM 1415 CG1 VAL A 171 73.841 17.820 0.697 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.979 15.302 0.613 1.00 25.00 C ATOM 0 H VAL A 171 75.038 15.219 -2.381 1.00 25.00 H new ATOM 0 HA VAL A 171 72.618 16.651 -1.496 1.00 25.00 H new ATOM 0 HB VAL A 171 75.415 16.673 -0.239 1.00 25.00 H new ATOM 0 HG11 VAL A 171 74.291 17.791 1.689 1.00 25.00 H new ATOM 0 HG12 VAL A 171 74.129 18.743 0.194 1.00 25.00 H new ATOM 0 HG13 VAL A 171 72.756 17.781 0.789 1.00 25.00 H new ATOM 0 HG21 VAL A 171 74.425 15.316 1.608 1.00 25.00 H new ATOM 0 HG22 VAL A 171 72.896 15.216 0.702 1.00 25.00 H new ATOM 0 HG23 VAL A 171 74.366 14.450 0.054 1.00 25.00 H new ATOM 1426 N VAL A 172 73.287 18.823 -2.482 1.00 25.00 N ATOM 1427 CA VAL A 172 73.627 20.123 -3.053 1.00 25.00 C ATOM 1428 C VAL A 172 73.611 21.114 -1.894 1.00 25.00 C ATOM 1429 O VAL A 172 72.838 20.964 -0.949 1.00 25.00 O ATOM 1430 CB VAL A 172 72.626 20.511 -4.200 1.00 25.00 C ATOM 1431 CG1 VAL A 172 71.870 21.819 -3.906 1.00 25.00 C ATOM 1432 CG2 VAL A 172 73.376 20.634 -5.523 1.00 25.00 C ATOM 0 H VAL A 172 72.301 18.721 -2.241 1.00 25.00 H new ATOM 0 HA VAL A 172 74.610 20.116 -3.523 1.00 25.00 H new ATOM 0 HB VAL A 172 71.884 19.715 -4.263 1.00 25.00 H new ATOM 0 HG11 VAL A 172 71.192 22.040 -4.730 1.00 25.00 H new ATOM 0 HG12 VAL A 172 71.298 21.709 -2.985 1.00 25.00 H new ATOM 0 HG13 VAL A 172 72.584 22.635 -3.794 1.00 25.00 H new ATOM 0 HG21 VAL A 172 72.676 20.903 -6.314 1.00 25.00 H new ATOM 0 HG22 VAL A 172 74.141 21.406 -5.437 1.00 25.00 H new ATOM 0 HG23 VAL A 172 73.847 19.681 -5.764 1.00 25.00 H new ATOM 1442 N ILE A 173 74.492 22.100 -1.938 1.00 25.00 N ATOM 1443 CA ILE A 173 74.600 23.087 -0.876 1.00 25.00 C ATOM 1444 C ILE A 173 74.165 24.432 -1.439 1.00 25.00 C ATOM 1445 O ILE A 173 74.701 24.895 -2.440 1.00 25.00 O ATOM 1446 CB ILE A 173 76.058 23.186 -0.339 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.563 21.798 0.106 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.130 24.162 0.863 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.476 21.091 -0.923 1.00 25.00 C ATOM 0 H ILE A 173 75.149 22.239 -2.706 1.00 25.00 H new ATOM 0 HA ILE A 173 73.964 22.790 -0.042 1.00 25.00 H new ATOM 0 HB ILE A 173 76.689 23.560 -1.145 1.00 25.00 H new ATOM 0 HG12 ILE A 173 77.108 21.907 1.043 1.00 25.00 H new ATOM 0 HG13 ILE A 173 75.703 21.160 0.310 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.157 24.218 1.225 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.802 25.152 0.548 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.483 23.803 1.663 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.785 20.123 -0.530 1.00 25.00 H new ATOM 0 HD12 ILE A 173 76.930 20.947 -1.855 1.00 25.00 H new ATOM 0 HD13 ILE A 173 78.357 21.705 -1.110 1.00 25.00 H new ATOM 1461 N LEU A 174 73.199 25.060 -0.796 1.00 25.00 N ATOM 1462 CA LEU A 174 72.724 26.376 -1.205 1.00 25.00 C ATOM 1463 C LEU A 174 73.274 27.362 -0.179 1.00 25.00 C ATOM 1464 O LEU A 174 73.346 27.037 0.994 1.00 25.00 O ATOM 1465 CB LEU A 174 71.195 26.400 -1.230 1.00 25.00 C ATOM 1466 CG LEU A 174 70.601 27.641 -1.911 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.590 27.484 -3.428 1.00 25.00 C ATOM 1468 CD2 LEU A 174 69.197 27.924 -1.399 1.00 25.00 C ATOM 0 H LEU A 174 72.721 24.678 0.020 1.00 25.00 H new ATOM 0 HA LEU A 174 73.060 26.634 -2.209 1.00 25.00 H new ATOM 0 HB2 LEU A 174 70.836 25.509 -1.745 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.824 26.347 -0.206 1.00 25.00 H new ATOM 0 HG LEU A 174 71.237 28.490 -1.660 1.00 25.00 H new ATOM 0 HD11 LEU A 174 70.164 28.378 -3.883 1.00 25.00 H new ATOM 0 HD12 LEU A 174 71.610 27.345 -3.787 1.00 25.00 H new ATOM 0 HD13 LEU A 174 69.988 26.617 -3.700 1.00 25.00 H new ATOM 0 HD21 LEU A 174 68.799 28.808 -1.897 1.00 25.00 H new ATOM 0 HD22 LEU A 174 68.554 27.069 -1.609 1.00 25.00 H new ATOM 0 HD23 LEU A 174 69.230 28.098 -0.323 1.00 25.00 H new ATOM 1480 N ARG A 175 73.719 28.532 -0.611 1.00 25.00 N ATOM 1481 CA ARG A 175 74.339 29.511 0.292 1.00 25.00 C ATOM 1482 C ARG A 175 73.823 30.921 0.057 1.00 25.00 C ATOM 1483 O ARG A 175 74.130 31.533 -0.961 1.00 25.00 O ATOM 1484 CB ARG A 175 75.856 29.512 0.083 1.00 25.00 C ATOM 1485 CG ARG A 175 76.532 28.217 0.498 1.00 25.00 C ATOM 1486 CD ARG A 175 78.038 28.314 0.331 1.00 25.00 C ATOM 1487 NE ARG A 175 78.738 27.552 1.381 1.00 25.00 N ATOM 1488 CZ ARG A 175 79.060 28.022 2.583 1.00 25.00 C ATOM 1489 NH1 ARG A 175 78.787 29.250 2.957 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 79.670 27.239 3.428 1.00 25.00 N ATOM 0 H ARG A 175 73.666 28.835 -1.584 1.00 25.00 H new ATOM 0 HA ARG A 175 74.082 29.217 1.309 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.068 29.701 -0.969 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.291 30.336 0.649 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.291 27.993 1.537 1.00 25.00 H new ATOM 0 HG3 ARG A 175 76.148 27.393 -0.103 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.324 27.934 -0.650 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.345 29.359 0.370 1.00 25.00 H new ATOM 0 HE ARG A 175 78.996 26.588 1.169 1.00 25.00 H new ATOM 0 HH11 ARG A 175 78.310 29.884 2.316 1.00 25.00 H new ATOM 0 HH12 ARG A 175 79.052 29.570 3.889 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.894 26.280 3.164 1.00 25.00 H new ATOM 0 HH22 ARG A 175 79.923 27.586 4.353 1.00 25.00 H new ATOM 1504 N GLN A 176 73.082 31.457 1.033 1.00 25.00 N ATOM 1505 CA GLN A 176 72.598 32.848 0.978 1.00 25.00 C ATOM 1506 C GLN A 176 73.674 33.816 1.482 1.00 25.00 C ATOM 1507 O GLN A 176 74.246 34.633 0.805 1.00 25.00 O ATOM 1508 CB GLN A 176 71.268 33.027 1.754 1.00 25.00 C ATOM 1509 CG GLN A 176 70.578 34.365 1.380 1.00 25.00 C ATOM 1510 CD GLN A 176 69.331 34.598 2.198 1.00 25.00 C ATOM 1511 OE1 GLN A 176 69.188 34.193 3.333 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.373 35.310 1.635 1.00 25.00 N ATOM 1513 OXT GLN A 176 73.976 33.686 2.636 1.00 25.00 O ATOM 0 H GLN A 176 72.802 30.951 1.873 1.00 25.00 H new ATOM 0 HA GLN A 176 72.390 33.085 -0.065 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.599 32.195 1.532 1.00 25.00 H new ATOM 0 HB3 GLN A 176 71.463 33.002 2.826 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.274 35.189 1.535 1.00 25.00 H new ATOM 0 HG3 GLN A 176 70.322 34.359 0.320 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.486 35.654 0.681 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.519 35.517 2.154 1.00 25.00 H new TER 1523 GLN A 176