USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 936 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 105 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 109 CYS SG : rot 84:sc= -2.81! USER MOD Set 2.1: A 54 CYS SG : rot -86:sc= -2.85! USER MOD Set 2.2: A 80 MET CE :methyl -176:sc= -3.04! (180deg=-0.287) USER MOD Set 3.1: A 38 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 70 LYS NZ :NH3+ 156:sc= 0 (180deg=-0.261) USER MOD Single : A 1 GLY N :NH3+ -102:sc= 0.0352 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.148 K(o=-0.15,f=-0.98) USER MOD Single : A 14 ASN : amide:sc= 0.373 X(o=0.37,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.745 K(o=-0.75,f=-2.9!) USER MOD Single : A 19 THR OG1 : rot -174:sc= 1.06 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot -56:sc= 0.0226 USER MOD Single : A 27 THR OG1 : rot 94:sc= -0.0327 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0.442 USER MOD Single : A 33 LYS NZ :NH3+ -159:sc= -0.0782 (180deg=-0.407) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot -121:sc= -0.617 USER MOD Single : A 39 SER OG : rot -69:sc= 0.434 USER MOD Single : A 40 SER OG : rot 120:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -0.0946 K(o=-0.095,f=-2.2!) USER MOD Single : A 56 ASN : amide:sc= -0.0569 K(o=-0.057,f=-1.8!) USER MOD Single : A 57 TYR OH : rot 141:sc= -0.635 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 THR OG1 : rot -60:sc= 0.211 USER MOD Single : A 71 HIS : no HD1:sc= -1.4 K(o=-1.4,f=-2.2!) USER MOD Single : A 72 ASN : amide:sc= -0.537 K(o=-0.54,f=-0.033) USER MOD Single : A 73 ASN : amide:sc= -0.19 K(o=-0.19,f=-4.1!) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 TYR OH : rot 30:sc= 0 USER MOD Single : A 79 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ -177:sc= 0.239 (180deg=0.236) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 MET CE :methyl 180:sc=-0.000547 (180deg=-0.000547) USER MOD Single : A 104 MET CE :methyl -146:sc= -4.26 (180deg=-7.19!) USER MOD Single : A 111 MET CE :methyl -138:sc= -0.0749 (180deg=-1.01) USER MOD Single : A 115 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 137:sc= 0.433 (180deg=0) USER MOD Single : A 119 SER OG : rot 64:sc= 0.91 USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 14.755 2.959 -30.692 1.00 0.00 N ATOM 2 CA GLY A 1 13.634 2.202 -30.167 1.00 0.00 C ATOM 3 C GLY A 1 12.770 3.021 -29.228 1.00 0.00 C ATOM 4 O GLY A 1 13.259 3.933 -28.561 1.00 0.00 O ATOM 0 H1 GLY A 1 14.546 3.260 -31.665 1.00 0.00 H new ATOM 0 H2 GLY A 1 14.917 3.797 -30.098 1.00 0.00 H new ATOM 0 H3 GLY A 1 15.608 2.363 -30.690 1.00 0.00 H new ATOM 0 HA2 GLY A 1 13.024 1.841 -30.995 1.00 0.00 H new ATOM 0 HA3 GLY A 1 14.007 1.324 -29.640 1.00 0.00 H new ATOM 8 N SER A 2 11.482 2.697 -29.177 1.00 0.00 N ATOM 9 CA SER A 2 10.547 3.413 -28.317 1.00 0.00 C ATOM 10 C SER A 2 10.240 2.607 -27.059 1.00 0.00 C ATOM 11 O SER A 2 10.204 3.149 -25.954 1.00 0.00 O ATOM 12 CB SER A 2 9.252 3.712 -29.074 1.00 0.00 C ATOM 13 OG SER A 2 8.711 2.533 -29.644 1.00 0.00 O ATOM 0 H SER A 2 11.062 1.943 -29.721 1.00 0.00 H new ATOM 0 HA SER A 2 11.011 4.353 -28.020 1.00 0.00 H new ATOM 0 HB2 SER A 2 8.525 4.158 -28.395 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.446 4.443 -29.859 1.00 0.00 H new ATOM 0 HG SER A 2 7.883 2.750 -30.121 1.00 0.00 H new ATOM 19 N SER A 3 10.018 1.308 -27.235 1.00 0.00 N ATOM 20 CA SER A 3 9.710 0.427 -26.115 1.00 0.00 C ATOM 21 C SER A 3 10.674 -0.755 -26.073 1.00 0.00 C ATOM 22 O SER A 3 10.946 -1.386 -27.093 1.00 0.00 O ATOM 23 CB SER A 3 8.270 -0.079 -26.219 1.00 0.00 C ATOM 24 OG SER A 3 7.730 -0.347 -24.936 1.00 0.00 O ATOM 0 H SER A 3 10.046 0.843 -28.142 1.00 0.00 H new ATOM 0 HA SER A 3 9.822 0.998 -25.193 1.00 0.00 H new ATOM 0 HB2 SER A 3 7.656 0.664 -26.728 1.00 0.00 H new ATOM 0 HB3 SER A 3 8.242 -0.984 -26.825 1.00 0.00 H new ATOM 0 HG SER A 3 6.809 -0.667 -25.029 1.00 0.00 H new ATOM 30 N GLY A 4 11.189 -1.048 -24.882 1.00 0.00 N ATOM 31 CA GLY A 4 12.118 -2.153 -24.727 1.00 0.00 C ATOM 32 C GLY A 4 12.813 -2.141 -23.381 1.00 0.00 C ATOM 33 O GLY A 4 12.618 -1.225 -22.582 1.00 0.00 O ATOM 0 H GLY A 4 10.980 -0.540 -24.022 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.582 -3.094 -24.847 1.00 0.00 H new ATOM 0 HA3 GLY A 4 12.866 -2.109 -25.519 1.00 0.00 H new ATOM 37 N SER A 5 13.626 -3.161 -23.127 1.00 0.00 N ATOM 38 CA SER A 5 14.349 -3.268 -21.865 1.00 0.00 C ATOM 39 C SER A 5 13.387 -3.221 -20.682 1.00 0.00 C ATOM 40 O SER A 5 13.656 -2.568 -19.674 1.00 0.00 O ATOM 41 CB SER A 5 15.377 -2.141 -21.746 1.00 0.00 C ATOM 42 OG SER A 5 16.534 -2.423 -22.513 1.00 0.00 O ATOM 0 H SER A 5 13.801 -3.926 -23.779 1.00 0.00 H new ATOM 0 HA SER A 5 14.867 -4.227 -21.851 1.00 0.00 H new ATOM 0 HB2 SER A 5 14.934 -1.203 -22.082 1.00 0.00 H new ATOM 0 HB3 SER A 5 15.654 -2.006 -20.700 1.00 0.00 H new ATOM 0 HG SER A 5 17.175 -1.687 -22.421 1.00 0.00 H new ATOM 48 N SER A 6 12.263 -3.919 -20.814 1.00 0.00 N ATOM 49 CA SER A 6 11.258 -3.956 -19.758 1.00 0.00 C ATOM 50 C SER A 6 11.319 -5.275 -18.995 1.00 0.00 C ATOM 51 O SER A 6 11.754 -6.295 -19.529 1.00 0.00 O ATOM 52 CB SER A 6 9.860 -3.758 -20.349 1.00 0.00 C ATOM 53 OG SER A 6 9.697 -2.441 -20.844 1.00 0.00 O ATOM 0 H SER A 6 12.026 -4.466 -21.641 1.00 0.00 H new ATOM 0 HA SER A 6 11.468 -3.145 -19.061 1.00 0.00 H new ATOM 0 HB2 SER A 6 9.697 -4.475 -21.154 1.00 0.00 H new ATOM 0 HB3 SER A 6 9.108 -3.959 -19.586 1.00 0.00 H new ATOM 0 HG SER A 6 8.797 -2.341 -21.218 1.00 0.00 H new ATOM 59 N GLY A 7 10.878 -5.248 -17.741 1.00 0.00 N ATOM 60 CA GLY A 7 10.891 -6.447 -16.924 1.00 0.00 C ATOM 61 C GLY A 7 9.576 -6.671 -16.203 1.00 0.00 C ATOM 62 O GLY A 7 8.514 -6.315 -16.711 1.00 0.00 O ATOM 0 H GLY A 7 10.512 -4.417 -17.276 1.00 0.00 H new ATOM 0 HA2 GLY A 7 11.108 -7.310 -17.554 1.00 0.00 H new ATOM 0 HA3 GLY A 7 11.696 -6.376 -16.192 1.00 0.00 H new ATOM 66 N ASN A 8 9.647 -7.264 -15.016 1.00 0.00 N ATOM 67 CA ASN A 8 8.453 -7.538 -14.225 1.00 0.00 C ATOM 68 C ASN A 8 8.077 -6.330 -13.372 1.00 0.00 C ATOM 69 O ASN A 8 8.544 -6.185 -12.242 1.00 0.00 O ATOM 70 CB ASN A 8 8.677 -8.758 -13.330 1.00 0.00 C ATOM 71 CG ASN A 8 9.429 -9.867 -14.041 1.00 0.00 C ATOM 72 OD1 ASN A 8 9.344 -10.005 -15.262 1.00 0.00 O ATOM 73 ND2 ASN A 8 10.169 -10.663 -13.279 1.00 0.00 N ATOM 0 H ASN A 8 10.519 -7.564 -14.581 1.00 0.00 H new ATOM 0 HA ASN A 8 7.632 -7.746 -14.912 1.00 0.00 H new ATOM 0 HB2 ASN A 8 9.233 -8.457 -12.442 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.713 -9.137 -12.989 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.697 -11.427 -13.701 1.00 0.00 H new ATOM 0 HD22 ASN A 8 10.210 -10.511 -12.271 1.00 0.00 H new ATOM 80 N ASP A 9 7.230 -5.466 -13.921 1.00 0.00 N ATOM 81 CA ASP A 9 6.789 -4.271 -13.211 1.00 0.00 C ATOM 82 C ASP A 9 5.280 -4.298 -12.987 1.00 0.00 C ATOM 83 O ASP A 9 4.809 -4.200 -11.854 1.00 0.00 O ATOM 84 CB ASP A 9 7.180 -3.015 -13.991 1.00 0.00 C ATOM 85 CG ASP A 9 8.594 -3.085 -14.531 1.00 0.00 C ATOM 86 OD1 ASP A 9 8.773 -3.573 -15.667 1.00 0.00 O ATOM 87 OD2 ASP A 9 9.523 -2.652 -13.818 1.00 0.00 O ATOM 0 H ASP A 9 6.835 -5.571 -14.856 1.00 0.00 H new ATOM 0 HA ASP A 9 7.282 -4.253 -12.239 1.00 0.00 H new ATOM 0 HB2 ASP A 9 6.485 -2.874 -14.819 1.00 0.00 H new ATOM 0 HB3 ASP A 9 7.085 -2.144 -13.343 1.00 0.00 H new ATOM 92 N ASP A 10 4.529 -4.429 -14.074 1.00 0.00 N ATOM 93 CA ASP A 10 3.073 -4.468 -13.997 1.00 0.00 C ATOM 94 C ASP A 10 2.605 -5.646 -13.147 1.00 0.00 C ATOM 95 O ASP A 10 1.728 -5.500 -12.295 1.00 0.00 O ATOM 96 CB ASP A 10 2.469 -4.563 -15.399 1.00 0.00 C ATOM 97 CG ASP A 10 3.243 -3.752 -16.419 1.00 0.00 C ATOM 98 OD1 ASP A 10 4.394 -4.128 -16.727 1.00 0.00 O ATOM 99 OD2 ASP A 10 2.698 -2.741 -16.910 1.00 0.00 O ATOM 0 H ASP A 10 4.904 -4.510 -15.019 1.00 0.00 H new ATOM 0 HA ASP A 10 2.734 -3.546 -13.526 1.00 0.00 H new ATOM 0 HB2 ASP A 10 2.446 -5.607 -15.711 1.00 0.00 H new ATOM 0 HB3 ASP A 10 1.436 -4.215 -15.371 1.00 0.00 H new ATOM 104 N ILE A 11 3.195 -6.812 -13.386 1.00 0.00 N ATOM 105 CA ILE A 11 2.839 -8.014 -12.643 1.00 0.00 C ATOM 106 C ILE A 11 2.682 -7.715 -11.156 1.00 0.00 C ATOM 107 O ILE A 11 1.616 -7.927 -10.579 1.00 0.00 O ATOM 108 CB ILE A 11 3.893 -9.122 -12.825 1.00 0.00 C ATOM 109 CG1 ILE A 11 4.034 -9.484 -14.305 1.00 0.00 C ATOM 110 CG2 ILE A 11 3.519 -10.349 -12.007 1.00 0.00 C ATOM 111 CD1 ILE A 11 5.265 -10.310 -14.610 1.00 0.00 C ATOM 0 H ILE A 11 3.922 -6.950 -14.088 1.00 0.00 H new ATOM 0 HA ILE A 11 1.887 -8.362 -13.043 1.00 0.00 H new ATOM 0 HB ILE A 11 4.854 -8.751 -12.468 1.00 0.00 H new ATOM 0 HG12 ILE A 11 3.149 -10.035 -14.622 1.00 0.00 H new ATOM 0 HG13 ILE A 11 4.066 -8.567 -14.894 1.00 0.00 H new ATOM 0 HG21 ILE A 11 4.274 -11.123 -12.146 1.00 0.00 H new ATOM 0 HG22 ILE A 11 3.465 -10.080 -10.952 1.00 0.00 H new ATOM 0 HG23 ILE A 11 2.550 -10.724 -12.336 1.00 0.00 H new ATOM 0 HD11 ILE A 11 5.301 -10.530 -15.677 1.00 0.00 H new ATOM 0 HD12 ILE A 11 6.157 -9.753 -14.324 1.00 0.00 H new ATOM 0 HD13 ILE A 11 5.225 -11.243 -14.049 1.00 0.00 H new ATOM 123 N ILE A 12 3.752 -7.221 -10.542 1.00 0.00 N ATOM 124 CA ILE A 12 3.733 -6.890 -9.123 1.00 0.00 C ATOM 125 C ILE A 12 2.556 -5.980 -8.787 1.00 0.00 C ATOM 126 O ILE A 12 1.786 -6.258 -7.866 1.00 0.00 O ATOM 127 CB ILE A 12 5.040 -6.201 -8.688 1.00 0.00 C ATOM 128 CG1 ILE A 12 6.237 -7.114 -8.957 1.00 0.00 C ATOM 129 CG2 ILE A 12 4.974 -5.823 -7.215 1.00 0.00 C ATOM 130 CD1 ILE A 12 7.573 -6.423 -8.796 1.00 0.00 C ATOM 0 H ILE A 12 4.643 -7.041 -11.005 1.00 0.00 H new ATOM 0 HA ILE A 12 3.629 -7.830 -8.581 1.00 0.00 H new ATOM 0 HB ILE A 12 5.165 -5.289 -9.272 1.00 0.00 H new ATOM 0 HG12 ILE A 12 6.194 -7.966 -8.278 1.00 0.00 H new ATOM 0 HG13 ILE A 12 6.161 -7.509 -9.970 1.00 0.00 H new ATOM 0 HG21 ILE A 12 5.905 -5.337 -6.922 1.00 0.00 H new ATOM 0 HG22 ILE A 12 4.141 -5.140 -7.052 1.00 0.00 H new ATOM 0 HG23 ILE A 12 4.829 -6.721 -6.615 1.00 0.00 H new ATOM 0 HD11 ILE A 12 8.376 -7.131 -9.002 1.00 0.00 H new ATOM 0 HD12 ILE A 12 7.637 -5.588 -9.494 1.00 0.00 H new ATOM 0 HD13 ILE A 12 7.670 -6.051 -7.776 1.00 0.00 H new ATOM 142 N VAL A 13 2.420 -4.894 -9.540 1.00 0.00 N ATOM 143 CA VAL A 13 1.335 -3.944 -9.324 1.00 0.00 C ATOM 144 C VAL A 13 -0.013 -4.654 -9.269 1.00 0.00 C ATOM 145 O VAL A 13 -0.822 -4.403 -8.377 1.00 0.00 O ATOM 146 CB VAL A 13 1.295 -2.876 -10.433 1.00 0.00 C ATOM 147 CG1 VAL A 13 0.135 -1.917 -10.210 1.00 0.00 C ATOM 148 CG2 VAL A 13 2.615 -2.123 -10.494 1.00 0.00 C ATOM 0 H VAL A 13 3.048 -4.650 -10.306 1.00 0.00 H new ATOM 0 HA VAL A 13 1.526 -3.457 -8.368 1.00 0.00 H new ATOM 0 HB VAL A 13 1.143 -3.376 -11.390 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.123 -1.170 -11.003 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -0.803 -2.472 -10.220 1.00 0.00 H new ATOM 0 HG13 VAL A 13 0.253 -1.421 -9.246 1.00 0.00 H new ATOM 0 HG21 VAL A 13 2.569 -1.372 -11.283 1.00 0.00 H new ATOM 0 HG22 VAL A 13 2.799 -1.634 -9.538 1.00 0.00 H new ATOM 0 HG23 VAL A 13 3.424 -2.823 -10.705 1.00 0.00 H new ATOM 158 N ASN A 14 -0.248 -5.542 -10.230 1.00 0.00 N ATOM 159 CA ASN A 14 -1.499 -6.289 -10.291 1.00 0.00 C ATOM 160 C ASN A 14 -1.792 -6.970 -8.957 1.00 0.00 C ATOM 161 O ASN A 14 -2.909 -6.902 -8.446 1.00 0.00 O ATOM 162 CB ASN A 14 -1.440 -7.333 -11.407 1.00 0.00 C ATOM 163 CG ASN A 14 -1.923 -6.787 -12.737 1.00 0.00 C ATOM 164 OD1 ASN A 14 -3.003 -7.140 -13.210 1.00 0.00 O ATOM 165 ND2 ASN A 14 -1.123 -5.920 -13.346 1.00 0.00 N ATOM 0 H ASN A 14 0.411 -5.762 -10.977 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.303 -5.585 -10.504 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -0.415 -7.689 -11.514 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -2.048 -8.193 -11.128 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -1.395 -5.518 -14.243 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -0.236 -5.656 -12.917 1.00 0.00 H new ATOM 172 N TRP A 15 -0.780 -7.626 -8.400 1.00 0.00 N ATOM 173 CA TRP A 15 -0.928 -8.320 -7.125 1.00 0.00 C ATOM 174 C TRP A 15 -1.248 -7.337 -6.005 1.00 0.00 C ATOM 175 O TRP A 15 -2.070 -7.620 -5.133 1.00 0.00 O ATOM 176 CB TRP A 15 0.347 -9.095 -6.792 1.00 0.00 C ATOM 177 CG TRP A 15 0.203 -9.992 -5.600 1.00 0.00 C ATOM 178 CD1 TRP A 15 -0.187 -11.301 -5.602 1.00 0.00 C ATOM 179 CD2 TRP A 15 0.444 -9.645 -4.232 1.00 0.00 C ATOM 180 NE1 TRP A 15 -0.203 -11.789 -4.318 1.00 0.00 N ATOM 181 CE2 TRP A 15 0.181 -10.793 -3.459 1.00 0.00 C ATOM 182 CE3 TRP A 15 0.858 -8.478 -3.585 1.00 0.00 C ATOM 183 CZ2 TRP A 15 0.319 -10.805 -2.073 1.00 0.00 C ATOM 184 CZ3 TRP A 15 0.994 -8.491 -2.210 1.00 0.00 C ATOM 185 CH2 TRP A 15 0.726 -9.648 -1.466 1.00 0.00 C ATOM 0 H TRP A 15 0.151 -7.692 -8.811 1.00 0.00 H new ATOM 0 HA TRP A 15 -1.757 -9.021 -7.215 1.00 0.00 H new ATOM 0 HB2 TRP A 15 0.635 -9.694 -7.656 1.00 0.00 H new ATOM 0 HB3 TRP A 15 1.156 -8.388 -6.610 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -0.445 -11.869 -6.484 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -0.459 -12.739 -4.048 1.00 0.00 H new ATOM 0 HE3 TRP A 15 1.068 -7.582 -4.150 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 0.112 -11.696 -1.498 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 1.312 -7.594 -1.700 1.00 0.00 H new ATOM 0 HH2 TRP A 15 0.843 -9.626 -0.393 1.00 0.00 H new ATOM 196 N VAL A 16 -0.595 -6.179 -6.034 1.00 0.00 N ATOM 197 CA VAL A 16 -0.812 -5.153 -5.021 1.00 0.00 C ATOM 198 C VAL A 16 -2.289 -4.796 -4.907 1.00 0.00 C ATOM 199 O VAL A 16 -2.787 -4.510 -3.820 1.00 0.00 O ATOM 200 CB VAL A 16 -0.009 -3.877 -5.335 1.00 0.00 C ATOM 201 CG1 VAL A 16 -0.336 -2.780 -4.332 1.00 0.00 C ATOM 202 CG2 VAL A 16 1.483 -4.174 -5.344 1.00 0.00 C ATOM 0 H VAL A 16 0.089 -5.928 -6.748 1.00 0.00 H new ATOM 0 HA VAL A 16 -0.468 -5.566 -4.073 1.00 0.00 H new ATOM 0 HB VAL A 16 -0.292 -3.526 -6.327 1.00 0.00 H new ATOM 0 HG11 VAL A 16 0.241 -1.886 -4.570 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -1.400 -2.549 -4.380 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -0.083 -3.118 -3.327 1.00 0.00 H new ATOM 0 HG21 VAL A 16 2.034 -3.261 -5.568 1.00 0.00 H new ATOM 0 HG22 VAL A 16 1.785 -4.550 -4.367 1.00 0.00 H new ATOM 0 HG23 VAL A 16 1.700 -4.924 -6.104 1.00 0.00 H new ATOM 212 N ASN A 17 -2.986 -4.816 -6.039 1.00 0.00 N ATOM 213 CA ASN A 17 -4.408 -4.494 -6.067 1.00 0.00 C ATOM 214 C ASN A 17 -5.247 -5.701 -5.656 1.00 0.00 C ATOM 215 O ASN A 17 -6.182 -5.579 -4.864 1.00 0.00 O ATOM 216 CB ASN A 17 -4.819 -4.026 -7.465 1.00 0.00 C ATOM 217 CG ASN A 17 -4.675 -2.526 -7.637 1.00 0.00 C ATOM 218 OD1 ASN A 17 -5.660 -1.817 -7.844 1.00 0.00 O ATOM 219 ND2 ASN A 17 -3.444 -2.036 -7.553 1.00 0.00 N ATOM 0 H ASN A 17 -2.589 -5.052 -6.949 1.00 0.00 H new ATOM 0 HA ASN A 17 -4.587 -3.689 -5.354 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -4.208 -4.535 -8.210 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -5.854 -4.313 -7.652 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -3.285 -1.034 -7.661 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -2.657 -2.661 -7.380 1.00 0.00 H new ATOM 226 N ARG A 18 -4.905 -6.865 -6.199 1.00 0.00 N ATOM 227 CA ARG A 18 -5.627 -8.093 -5.889 1.00 0.00 C ATOM 228 C ARG A 18 -5.758 -8.281 -4.380 1.00 0.00 C ATOM 229 O ARG A 18 -6.855 -8.493 -3.862 1.00 0.00 O ATOM 230 CB ARG A 18 -4.912 -9.298 -6.504 1.00 0.00 C ATOM 231 CG ARG A 18 -5.714 -10.587 -6.425 1.00 0.00 C ATOM 232 CD ARG A 18 -6.648 -10.735 -7.616 1.00 0.00 C ATOM 233 NE ARG A 18 -7.399 -11.987 -7.571 1.00 0.00 N ATOM 234 CZ ARG A 18 -8.547 -12.179 -8.210 1.00 0.00 C ATOM 235 NH1 ARG A 18 -9.074 -11.206 -8.940 1.00 0.00 N ATOM 236 NH2 ARG A 18 -9.171 -13.347 -8.120 1.00 0.00 N ATOM 0 H ARG A 18 -4.133 -6.983 -6.855 1.00 0.00 H new ATOM 0 HA ARG A 18 -6.627 -8.015 -6.316 1.00 0.00 H new ATOM 0 HB2 ARG A 18 -4.688 -9.083 -7.549 1.00 0.00 H new ATOM 0 HB3 ARG A 18 -3.958 -9.442 -5.997 1.00 0.00 H new ATOM 0 HG2 ARG A 18 -5.034 -11.438 -6.386 1.00 0.00 H new ATOM 0 HG3 ARG A 18 -6.294 -10.600 -5.502 1.00 0.00 H new ATOM 0 HD2 ARG A 18 -7.343 -9.896 -7.638 1.00 0.00 H new ATOM 0 HD3 ARG A 18 -6.069 -10.693 -8.538 1.00 0.00 H new ATOM 0 HE ARG A 18 -7.021 -12.756 -7.018 1.00 0.00 H new ATOM 0 HH11 ARG A 18 -8.597 -10.307 -9.012 1.00 0.00 H new ATOM 0 HH12 ARG A 18 -9.956 -11.356 -9.430 1.00 0.00 H new ATOM 0 HH21 ARG A 18 -8.769 -14.098 -7.559 1.00 0.00 H new ATOM 0 HH22 ARG A 18 -10.053 -13.493 -8.611 1.00 0.00 H new ATOM 250 N THR A 19 -4.631 -8.203 -3.679 1.00 0.00 N ATOM 251 CA THR A 19 -4.619 -8.366 -2.231 1.00 0.00 C ATOM 252 C THR A 19 -5.554 -7.368 -1.558 1.00 0.00 C ATOM 253 O THR A 19 -6.263 -7.708 -0.610 1.00 0.00 O ATOM 254 CB THR A 19 -3.200 -8.190 -1.658 1.00 0.00 C ATOM 255 OG1 THR A 19 -2.284 -9.053 -2.342 1.00 0.00 O ATOM 256 CG2 THR A 19 -3.176 -8.496 -0.168 1.00 0.00 C ATOM 0 H THR A 19 -3.715 -8.028 -4.091 1.00 0.00 H new ATOM 0 HA THR A 19 -4.963 -9.379 -2.024 1.00 0.00 H new ATOM 0 HB THR A 19 -2.899 -7.153 -1.805 1.00 0.00 H new ATOM 0 HG1 THR A 19 -1.407 -9.011 -1.906 1.00 0.00 H new ATOM 0 HG21 THR A 19 -2.164 -8.365 0.214 1.00 0.00 H new ATOM 0 HG22 THR A 19 -3.851 -7.818 0.354 1.00 0.00 H new ATOM 0 HG23 THR A 19 -3.496 -9.525 -0.003 1.00 0.00 H new ATOM 264 N LEU A 20 -5.552 -6.135 -2.053 1.00 0.00 N ATOM 265 CA LEU A 20 -6.402 -5.087 -1.499 1.00 0.00 C ATOM 266 C LEU A 20 -7.877 -5.443 -1.655 1.00 0.00 C ATOM 267 O LEU A 20 -8.676 -5.232 -0.742 1.00 0.00 O ATOM 268 CB LEU A 20 -6.112 -3.752 -2.187 1.00 0.00 C ATOM 269 CG LEU A 20 -4.738 -3.140 -1.914 1.00 0.00 C ATOM 270 CD1 LEU A 20 -4.401 -2.094 -2.964 1.00 0.00 C ATOM 271 CD2 LEU A 20 -4.691 -2.533 -0.519 1.00 0.00 C ATOM 0 H LEU A 20 -4.971 -5.837 -2.837 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.180 -4.997 -0.436 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -6.219 -3.890 -3.263 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -6.874 -3.035 -1.881 1.00 0.00 H new ATOM 0 HG LEU A 20 -3.992 -3.933 -1.968 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.419 -1.670 -2.753 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -4.391 -2.558 -3.950 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.150 -1.303 -2.943 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.705 -2.102 -0.343 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -5.448 -1.753 -0.436 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -4.886 -3.308 0.222 1.00 0.00 H new ATOM 283 N SER A 21 -8.230 -5.985 -2.816 1.00 0.00 N ATOM 284 CA SER A 21 -9.610 -6.370 -3.092 1.00 0.00 C ATOM 285 C SER A 21 -10.000 -7.607 -2.289 1.00 0.00 C ATOM 286 O SER A 21 -11.111 -7.695 -1.767 1.00 0.00 O ATOM 287 CB SER A 21 -9.797 -6.637 -4.586 1.00 0.00 C ATOM 288 OG SER A 21 -11.167 -6.817 -4.904 1.00 0.00 O ATOM 0 H SER A 21 -7.580 -6.168 -3.581 1.00 0.00 H new ATOM 0 HA SER A 21 -10.258 -5.546 -2.794 1.00 0.00 H new ATOM 0 HB2 SER A 21 -9.393 -5.804 -5.161 1.00 0.00 H new ATOM 0 HB3 SER A 21 -9.234 -7.525 -4.873 1.00 0.00 H new ATOM 0 HG SER A 21 -11.260 -6.985 -5.865 1.00 0.00 H new ATOM 294 N GLU A 22 -9.077 -8.559 -2.195 1.00 0.00 N ATOM 295 CA GLU A 22 -9.325 -9.792 -1.456 1.00 0.00 C ATOM 296 C GLU A 22 -10.030 -9.502 -0.134 1.00 0.00 C ATOM 297 O GLU A 22 -10.951 -10.217 0.260 1.00 0.00 O ATOM 298 CB GLU A 22 -8.010 -10.529 -1.195 1.00 0.00 C ATOM 299 CG GLU A 22 -7.613 -11.480 -2.311 1.00 0.00 C ATOM 300 CD GLU A 22 -6.726 -12.610 -1.826 1.00 0.00 C ATOM 301 OE1 GLU A 22 -7.182 -13.397 -0.970 1.00 0.00 O ATOM 302 OE2 GLU A 22 -5.576 -12.708 -2.302 1.00 0.00 O ATOM 0 H GLU A 22 -8.152 -8.501 -2.621 1.00 0.00 H new ATOM 0 HA GLU A 22 -9.974 -10.425 -2.062 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -7.215 -9.797 -1.053 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -8.096 -11.090 -0.265 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -8.512 -11.898 -2.764 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -7.092 -10.923 -3.090 1.00 0.00 H new ATOM 309 N ALA A 23 -9.591 -8.448 0.545 1.00 0.00 N ATOM 310 CA ALA A 23 -10.179 -8.061 1.821 1.00 0.00 C ATOM 311 C ALA A 23 -11.312 -7.060 1.623 1.00 0.00 C ATOM 312 O ALA A 23 -12.332 -7.118 2.308 1.00 0.00 O ATOM 313 CB ALA A 23 -9.114 -7.481 2.740 1.00 0.00 C ATOM 0 H ALA A 23 -8.829 -7.846 0.232 1.00 0.00 H new ATOM 0 HA ALA A 23 -10.596 -8.955 2.286 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -9.568 -7.196 3.689 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -8.340 -8.228 2.917 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -8.669 -6.602 2.273 1.00 0.00 H new ATOM 319 N GLY A 24 -11.125 -6.141 0.680 1.00 0.00 N ATOM 320 CA GLY A 24 -12.140 -5.139 0.409 1.00 0.00 C ATOM 321 C GLY A 24 -11.706 -3.748 0.825 1.00 0.00 C ATOM 322 O GLY A 24 -12.406 -3.070 1.579 1.00 0.00 O ATOM 0 H GLY A 24 -10.289 -6.073 0.099 1.00 0.00 H new ATOM 0 HA2 GLY A 24 -12.373 -5.141 -0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 24 -13.057 -5.403 0.936 1.00 0.00 H new ATOM 326 N LYS A 25 -10.548 -3.319 0.336 1.00 0.00 N ATOM 327 CA LYS A 25 -10.020 -1.999 0.661 1.00 0.00 C ATOM 328 C LYS A 25 -10.387 -0.986 -0.419 1.00 0.00 C ATOM 329 O LYS A 25 -10.757 -1.358 -1.532 1.00 0.00 O ATOM 330 CB LYS A 25 -8.500 -2.061 0.823 1.00 0.00 C ATOM 331 CG LYS A 25 -8.041 -3.042 1.887 1.00 0.00 C ATOM 332 CD LYS A 25 -8.318 -2.518 3.286 1.00 0.00 C ATOM 333 CE LYS A 25 -8.561 -3.653 4.269 1.00 0.00 C ATOM 334 NZ LYS A 25 -9.996 -4.048 4.316 1.00 0.00 N ATOM 0 H LYS A 25 -9.956 -3.867 -0.288 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.466 -1.678 1.602 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.052 -2.338 -0.132 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.129 -1.067 1.073 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -8.550 -3.996 1.747 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.974 -3.231 1.773 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.474 -1.917 3.624 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.188 -1.862 3.264 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.956 -4.514 3.986 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -8.235 -3.348 5.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.120 -4.824 4.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.571 -3.233 4.611 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -10.300 -4.363 3.373 1.00 0.00 H new ATOM 348 N SER A 26 -10.279 0.295 -0.082 1.00 0.00 N ATOM 349 CA SER A 26 -10.602 1.362 -1.022 1.00 0.00 C ATOM 350 C SER A 26 -9.341 2.105 -1.454 1.00 0.00 C ATOM 351 O SER A 26 -9.370 3.311 -1.701 1.00 0.00 O ATOM 352 CB SER A 26 -11.594 2.342 -0.394 1.00 0.00 C ATOM 353 OG SER A 26 -12.304 3.058 -1.389 1.00 0.00 O ATOM 0 H SER A 26 -9.970 0.619 0.835 1.00 0.00 H new ATOM 0 HA SER A 26 -11.058 0.910 -1.903 1.00 0.00 H new ATOM 0 HB2 SER A 26 -12.296 1.798 0.238 1.00 0.00 H new ATOM 0 HB3 SER A 26 -11.061 3.041 0.250 1.00 0.00 H new ATOM 0 HG SER A 26 -11.669 3.514 -1.980 1.00 0.00 H new ATOM 359 N THR A 27 -8.233 1.376 -1.543 1.00 0.00 N ATOM 360 CA THR A 27 -6.961 1.963 -1.944 1.00 0.00 C ATOM 361 C THR A 27 -6.291 1.135 -3.034 1.00 0.00 C ATOM 362 O THR A 27 -6.559 -0.059 -3.173 1.00 0.00 O ATOM 363 CB THR A 27 -5.999 2.090 -0.747 1.00 0.00 C ATOM 364 OG1 THR A 27 -5.882 0.830 -0.078 1.00 0.00 O ATOM 365 CG2 THR A 27 -6.489 3.146 0.231 1.00 0.00 C ATOM 0 H THR A 27 -8.191 0.377 -1.342 1.00 0.00 H new ATOM 0 HA THR A 27 -7.181 2.958 -2.332 1.00 0.00 H new ATOM 0 HB THR A 27 -5.022 2.393 -1.124 1.00 0.00 H new ATOM 0 HG1 THR A 27 -5.107 0.344 -0.429 1.00 0.00 H new ATOM 0 HG21 THR A 27 -5.794 3.218 1.068 1.00 0.00 H new ATOM 0 HG22 THR A 27 -6.549 4.110 -0.274 1.00 0.00 H new ATOM 0 HG23 THR A 27 -7.476 2.869 0.602 1.00 0.00 H new ATOM 373 N SER A 28 -5.419 1.775 -3.806 1.00 0.00 N ATOM 374 CA SER A 28 -4.713 1.097 -4.887 1.00 0.00 C ATOM 375 C SER A 28 -3.641 2.002 -5.487 1.00 0.00 C ATOM 376 O SER A 28 -3.679 3.221 -5.322 1.00 0.00 O ATOM 377 CB SER A 28 -5.698 0.663 -5.974 1.00 0.00 C ATOM 378 OG SER A 28 -6.368 1.780 -6.531 1.00 0.00 O ATOM 0 H SER A 28 -5.184 2.762 -3.703 1.00 0.00 H new ATOM 0 HA SER A 28 -4.227 0.213 -4.473 1.00 0.00 H new ATOM 0 HB2 SER A 28 -5.165 0.126 -6.759 1.00 0.00 H new ATOM 0 HB3 SER A 28 -6.427 -0.029 -5.553 1.00 0.00 H new ATOM 0 HG SER A 28 -6.990 1.476 -7.224 1.00 0.00 H new ATOM 384 N ILE A 29 -2.687 1.395 -6.185 1.00 0.00 N ATOM 385 CA ILE A 29 -1.605 2.145 -6.811 1.00 0.00 C ATOM 386 C ILE A 29 -1.445 1.759 -8.277 1.00 0.00 C ATOM 387 O ILE A 29 -1.512 0.581 -8.629 1.00 0.00 O ATOM 388 CB ILE A 29 -0.267 1.917 -6.083 1.00 0.00 C ATOM 389 CG1 ILE A 29 -0.056 0.426 -5.812 1.00 0.00 C ATOM 390 CG2 ILE A 29 -0.230 2.708 -4.784 1.00 0.00 C ATOM 391 CD1 ILE A 29 1.400 0.018 -5.778 1.00 0.00 C ATOM 0 H ILE A 29 -2.641 0.387 -6.331 1.00 0.00 H new ATOM 0 HA ILE A 29 -1.872 3.200 -6.742 1.00 0.00 H new ATOM 0 HB ILE A 29 0.543 2.268 -6.723 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -0.519 0.169 -4.859 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -0.569 -0.151 -6.582 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.722 2.537 -4.281 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -0.339 3.770 -5.002 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -1.046 2.384 -4.138 1.00 0.00 H new ATOM 0 HD11 ILE A 29 1.474 -1.052 -5.581 1.00 0.00 H new ATOM 0 HD12 ILE A 29 1.863 0.243 -6.739 1.00 0.00 H new ATOM 0 HD13 ILE A 29 1.914 0.568 -4.990 1.00 0.00 H new ATOM 403 N GLN A 30 -1.232 2.758 -9.127 1.00 0.00 N ATOM 404 CA GLN A 30 -1.061 2.522 -10.556 1.00 0.00 C ATOM 405 C GLN A 30 0.337 1.992 -10.857 1.00 0.00 C ATOM 406 O GLN A 30 0.510 1.112 -11.700 1.00 0.00 O ATOM 407 CB GLN A 30 -1.310 3.811 -11.341 1.00 0.00 C ATOM 408 CG GLN A 30 -2.778 4.063 -11.647 1.00 0.00 C ATOM 409 CD GLN A 30 -3.001 5.347 -12.420 1.00 0.00 C ATOM 410 OE1 GLN A 30 -3.635 6.280 -11.926 1.00 0.00 O ATOM 411 NE2 GLN A 30 -2.479 5.403 -13.640 1.00 0.00 N ATOM 0 H GLN A 30 -1.174 3.738 -8.851 1.00 0.00 H new ATOM 0 HA GLN A 30 -1.789 1.771 -10.864 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -0.916 4.654 -10.774 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -0.754 3.769 -12.278 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -3.175 3.225 -12.220 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -3.338 4.104 -10.713 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -1.961 4.606 -14.010 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -2.596 6.243 -14.207 1.00 0.00 H new ATOM 420 N SER A 31 1.333 2.534 -10.162 1.00 0.00 N ATOM 421 CA SER A 31 2.717 2.119 -10.358 1.00 0.00 C ATOM 422 C SER A 31 3.594 2.590 -9.202 1.00 0.00 C ATOM 423 O SER A 31 3.136 3.307 -8.312 1.00 0.00 O ATOM 424 CB SER A 31 3.255 2.671 -11.680 1.00 0.00 C ATOM 425 OG SER A 31 3.732 3.996 -11.523 1.00 0.00 O ATOM 0 H SER A 31 1.207 3.261 -9.458 1.00 0.00 H new ATOM 0 HA SER A 31 2.743 1.030 -10.390 1.00 0.00 H new ATOM 0 HB2 SER A 31 4.060 2.032 -12.044 1.00 0.00 H new ATOM 0 HB3 SER A 31 2.467 2.652 -12.433 1.00 0.00 H new ATOM 0 HG SER A 31 4.072 4.325 -12.381 1.00 0.00 H new ATOM 431 N PHE A 32 4.858 2.182 -9.223 1.00 0.00 N ATOM 432 CA PHE A 32 5.801 2.560 -8.177 1.00 0.00 C ATOM 433 C PHE A 32 6.188 4.031 -8.300 1.00 0.00 C ATOM 434 O PHE A 32 6.967 4.549 -7.500 1.00 0.00 O ATOM 435 CB PHE A 32 7.053 1.684 -8.248 1.00 0.00 C ATOM 436 CG PHE A 32 6.759 0.239 -8.534 1.00 0.00 C ATOM 437 CD1 PHE A 32 6.261 -0.590 -7.542 1.00 0.00 C ATOM 438 CD2 PHE A 32 6.980 -0.290 -9.795 1.00 0.00 C ATOM 439 CE1 PHE A 32 5.988 -1.920 -7.801 1.00 0.00 C ATOM 440 CE2 PHE A 32 6.709 -1.619 -10.061 1.00 0.00 C ATOM 441 CZ PHE A 32 6.213 -2.435 -9.063 1.00 0.00 C ATOM 0 H PHE A 32 5.253 1.589 -9.953 1.00 0.00 H new ATOM 0 HA PHE A 32 5.315 2.409 -7.213 1.00 0.00 H new ATOM 0 HB2 PHE A 32 7.715 2.072 -9.023 1.00 0.00 H new ATOM 0 HB3 PHE A 32 7.591 1.757 -7.303 1.00 0.00 H new ATOM 0 HD1 PHE A 32 6.084 -0.192 -6.554 1.00 0.00 H new ATOM 0 HD2 PHE A 32 7.368 0.343 -10.579 1.00 0.00 H new ATOM 0 HE1 PHE A 32 5.600 -2.555 -7.019 1.00 0.00 H new ATOM 0 HE2 PHE A 32 6.885 -2.019 -11.049 1.00 0.00 H new ATOM 0 HZ PHE A 32 6.001 -3.474 -9.269 1.00 0.00 H new ATOM 451 N LYS A 33 5.639 4.699 -9.309 1.00 0.00 N ATOM 452 CA LYS A 33 5.925 6.110 -9.539 1.00 0.00 C ATOM 453 C LYS A 33 4.755 6.981 -9.092 1.00 0.00 C ATOM 454 O LYS A 33 4.941 8.136 -8.706 1.00 0.00 O ATOM 455 CB LYS A 33 6.222 6.357 -11.020 1.00 0.00 C ATOM 456 CG LYS A 33 7.642 6.001 -11.423 1.00 0.00 C ATOM 457 CD LYS A 33 8.016 6.624 -12.757 1.00 0.00 C ATOM 458 CE LYS A 33 7.415 5.852 -13.921 1.00 0.00 C ATOM 459 NZ LYS A 33 7.996 4.486 -14.040 1.00 0.00 N ATOM 0 H LYS A 33 4.993 4.285 -9.981 1.00 0.00 H new ATOM 0 HA LYS A 33 6.802 6.378 -8.950 1.00 0.00 H new ATOM 0 HB2 LYS A 33 5.525 5.775 -11.624 1.00 0.00 H new ATOM 0 HB3 LYS A 33 6.041 7.407 -11.248 1.00 0.00 H new ATOM 0 HG2 LYS A 33 8.336 6.342 -10.654 1.00 0.00 H new ATOM 0 HG3 LYS A 33 7.743 4.917 -11.486 1.00 0.00 H new ATOM 0 HD2 LYS A 33 7.670 7.657 -12.787 1.00 0.00 H new ATOM 0 HD3 LYS A 33 9.101 6.648 -12.857 1.00 0.00 H new ATOM 0 HE2 LYS A 33 6.336 5.777 -13.788 1.00 0.00 H new ATOM 0 HE3 LYS A 33 7.585 6.401 -14.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 7.849 4.129 -15.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 9.015 4.523 -13.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 7.530 3.850 -13.361 1.00 0.00 H new ATOM 473 N ASP A 34 3.552 6.422 -9.146 1.00 0.00 N ATOM 474 CA ASP A 34 2.352 7.147 -8.744 1.00 0.00 C ATOM 475 C ASP A 34 2.630 8.025 -7.527 1.00 0.00 C ATOM 476 O ASP A 34 3.487 7.707 -6.702 1.00 0.00 O ATOM 477 CB ASP A 34 1.218 6.169 -8.435 1.00 0.00 C ATOM 478 CG ASP A 34 -0.150 6.773 -8.680 1.00 0.00 C ATOM 479 OD1 ASP A 34 -0.215 7.963 -9.052 1.00 0.00 O ATOM 480 OD2 ASP A 34 -1.157 6.056 -8.500 1.00 0.00 O ATOM 0 H ASP A 34 3.381 5.468 -9.464 1.00 0.00 H new ATOM 0 HA ASP A 34 2.051 7.789 -9.572 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.334 5.277 -9.051 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.290 5.850 -7.395 1.00 0.00 H new ATOM 485 N LYS A 35 1.901 9.131 -7.423 1.00 0.00 N ATOM 486 CA LYS A 35 2.068 10.055 -6.308 1.00 0.00 C ATOM 487 C LYS A 35 1.102 9.721 -5.176 1.00 0.00 C ATOM 488 O LYS A 35 0.737 10.588 -4.380 1.00 0.00 O ATOM 489 CB LYS A 35 1.845 11.495 -6.775 1.00 0.00 C ATOM 490 CG LYS A 35 2.684 11.880 -7.981 1.00 0.00 C ATOM 491 CD LYS A 35 4.047 12.408 -7.567 1.00 0.00 C ATOM 492 CE LYS A 35 5.102 12.116 -8.623 1.00 0.00 C ATOM 493 NZ LYS A 35 5.057 13.100 -9.739 1.00 0.00 N ATOM 0 H LYS A 35 1.189 9.409 -8.098 1.00 0.00 H new ATOM 0 HA LYS A 35 3.087 9.954 -5.934 1.00 0.00 H new ATOM 0 HB2 LYS A 35 0.791 11.630 -7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 35 2.072 12.174 -5.953 1.00 0.00 H new ATOM 0 HG2 LYS A 35 2.810 11.013 -8.629 1.00 0.00 H new ATOM 0 HG3 LYS A 35 2.160 12.639 -8.562 1.00 0.00 H new ATOM 0 HD2 LYS A 35 3.986 13.483 -7.399 1.00 0.00 H new ATOM 0 HD3 LYS A 35 4.342 11.954 -6.621 1.00 0.00 H new ATOM 0 HE2 LYS A 35 6.090 12.133 -8.163 1.00 0.00 H new ATOM 0 HE3 LYS A 35 4.952 11.111 -9.018 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.791 12.866 -10.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 4.123 13.066 -10.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 5.226 14.056 -9.366 1.00 0.00 H new ATOM 507 N THR A 36 0.691 8.459 -5.107 1.00 0.00 N ATOM 508 CA THR A 36 -0.233 8.011 -4.072 1.00 0.00 C ATOM 509 C THR A 36 0.497 7.231 -2.985 1.00 0.00 C ATOM 510 O THR A 36 0.061 7.198 -1.833 1.00 0.00 O ATOM 511 CB THR A 36 -1.349 7.127 -4.660 1.00 0.00 C ATOM 512 OG1 THR A 36 -0.779 5.993 -5.322 1.00 0.00 O ATOM 513 CG2 THR A 36 -2.204 7.917 -5.641 1.00 0.00 C ATOM 0 H THR A 36 0.983 7.728 -5.756 1.00 0.00 H new ATOM 0 HA THR A 36 -0.679 8.905 -3.637 1.00 0.00 H new ATOM 0 HB THR A 36 -1.983 6.787 -3.841 1.00 0.00 H new ATOM 0 HG1 THR A 36 -1.050 5.994 -6.264 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.985 7.272 -6.044 1.00 0.00 H new ATOM 0 HG22 THR A 36 -2.660 8.763 -5.127 1.00 0.00 H new ATOM 0 HG23 THR A 36 -1.579 8.282 -6.456 1.00 0.00 H new ATOM 521 N ILE A 37 1.609 6.605 -3.356 1.00 0.00 N ATOM 522 CA ILE A 37 2.400 5.827 -2.411 1.00 0.00 C ATOM 523 C ILE A 37 2.967 6.714 -1.308 1.00 0.00 C ATOM 524 O ILE A 37 3.124 6.280 -0.167 1.00 0.00 O ATOM 525 CB ILE A 37 3.559 5.096 -3.114 1.00 0.00 C ATOM 526 CG1 ILE A 37 3.032 4.270 -4.289 1.00 0.00 C ATOM 527 CG2 ILE A 37 4.301 4.209 -2.126 1.00 0.00 C ATOM 528 CD1 ILE A 37 4.075 3.994 -5.349 1.00 0.00 C ATOM 0 H ILE A 37 1.982 6.622 -4.305 1.00 0.00 H new ATOM 0 HA ILE A 37 1.730 5.088 -1.971 1.00 0.00 H new ATOM 0 HB ILE A 37 4.257 5.839 -3.501 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.648 3.322 -3.913 1.00 0.00 H new ATOM 0 HG13 ILE A 37 2.193 4.795 -4.745 1.00 0.00 H new ATOM 0 HG21 ILE A 37 5.117 3.699 -2.637 1.00 0.00 H new ATOM 0 HG22 ILE A 37 4.704 4.821 -1.319 1.00 0.00 H new ATOM 0 HG23 ILE A 37 3.614 3.471 -1.713 1.00 0.00 H new ATOM 0 HD11 ILE A 37 3.631 3.404 -6.151 1.00 0.00 H new ATOM 0 HD12 ILE A 37 4.442 4.938 -5.753 1.00 0.00 H new ATOM 0 HD13 ILE A 37 4.904 3.441 -4.908 1.00 0.00 H new ATOM 540 N SER A 38 3.272 7.961 -1.656 1.00 0.00 N ATOM 541 CA SER A 38 3.824 8.909 -0.696 1.00 0.00 C ATOM 542 C SER A 38 3.009 8.913 0.594 1.00 0.00 C ATOM 543 O SER A 38 3.559 9.042 1.687 1.00 0.00 O ATOM 544 CB SER A 38 3.854 10.316 -1.298 1.00 0.00 C ATOM 545 OG SER A 38 2.549 10.758 -1.628 1.00 0.00 O ATOM 0 H SER A 38 3.146 8.337 -2.596 1.00 0.00 H new ATOM 0 HA SER A 38 4.842 8.599 -0.461 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.307 11.009 -0.589 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.479 10.320 -2.191 1.00 0.00 H new ATOM 0 HG SER A 38 2.596 11.660 -2.009 1.00 0.00 H new ATOM 551 N SER A 39 1.695 8.771 0.457 1.00 0.00 N ATOM 552 CA SER A 39 0.803 8.761 1.610 1.00 0.00 C ATOM 553 C SER A 39 0.924 7.449 2.380 1.00 0.00 C ATOM 554 O SER A 39 0.632 7.388 3.574 1.00 0.00 O ATOM 555 CB SER A 39 -0.645 8.972 1.163 1.00 0.00 C ATOM 556 OG SER A 39 -1.187 7.784 0.612 1.00 0.00 O ATOM 0 H SER A 39 1.224 8.661 -0.441 1.00 0.00 H new ATOM 0 HA SER A 39 1.094 9.578 2.271 1.00 0.00 H new ATOM 0 HB2 SER A 39 -1.248 9.291 2.013 1.00 0.00 H new ATOM 0 HB3 SER A 39 -0.688 9.772 0.424 1.00 0.00 H new ATOM 0 HG SER A 39 -0.747 7.589 -0.241 1.00 0.00 H new ATOM 562 N SER A 40 1.356 6.401 1.686 1.00 0.00 N ATOM 563 CA SER A 40 1.513 5.089 2.302 1.00 0.00 C ATOM 564 C SER A 40 0.172 4.559 2.800 1.00 0.00 C ATOM 565 O SER A 40 0.115 3.765 3.740 1.00 0.00 O ATOM 566 CB SER A 40 2.508 5.162 3.462 1.00 0.00 C ATOM 567 OG SER A 40 3.703 5.814 3.069 1.00 0.00 O ATOM 0 H SER A 40 1.603 6.435 0.697 1.00 0.00 H new ATOM 0 HA SER A 40 1.897 4.404 1.546 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.057 5.696 4.299 1.00 0.00 H new ATOM 0 HB3 SER A 40 2.737 4.156 3.812 1.00 0.00 H new ATOM 0 HG SER A 40 3.839 6.610 3.624 1.00 0.00 H new ATOM 573 N LEU A 41 -0.906 5.005 2.164 1.00 0.00 N ATOM 574 CA LEU A 41 -2.249 4.577 2.541 1.00 0.00 C ATOM 575 C LEU A 41 -2.603 3.249 1.879 1.00 0.00 C ATOM 576 O LEU A 41 -3.326 2.433 2.450 1.00 0.00 O ATOM 577 CB LEU A 41 -3.274 5.643 2.152 1.00 0.00 C ATOM 578 CG LEU A 41 -3.108 7.009 2.820 1.00 0.00 C ATOM 579 CD1 LEU A 41 -4.055 8.025 2.201 1.00 0.00 C ATOM 580 CD2 LEU A 41 -3.345 6.901 4.320 1.00 0.00 C ATOM 0 H LEU A 41 -0.876 5.663 1.385 1.00 0.00 H new ATOM 0 HA LEU A 41 -2.270 4.440 3.622 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -3.232 5.782 1.072 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -4.269 5.265 2.387 1.00 0.00 H new ATOM 0 HG LEU A 41 -2.086 7.350 2.657 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -3.922 8.991 2.689 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -3.838 8.123 1.137 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -5.084 7.690 2.332 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -3.223 7.882 4.779 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -4.356 6.538 4.503 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.626 6.206 4.753 1.00 0.00 H new ATOM 592 N ALA A 42 -2.087 3.039 0.673 1.00 0.00 N ATOM 593 CA ALA A 42 -2.345 1.809 -0.065 1.00 0.00 C ATOM 594 C ALA A 42 -1.433 0.683 0.408 1.00 0.00 C ATOM 595 O ALA A 42 -1.844 -0.475 0.479 1.00 0.00 O ATOM 596 CB ALA A 42 -2.167 2.042 -1.558 1.00 0.00 C ATOM 0 H ALA A 42 -1.487 3.705 0.186 1.00 0.00 H new ATOM 0 HA ALA A 42 -3.376 1.511 0.125 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -2.363 1.115 -2.097 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -2.864 2.810 -1.892 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -1.146 2.368 -1.756 1.00 0.00 H new ATOM 602 N VAL A 43 -0.191 1.030 0.731 1.00 0.00 N ATOM 603 CA VAL A 43 0.780 0.048 1.199 1.00 0.00 C ATOM 604 C VAL A 43 0.281 -0.667 2.449 1.00 0.00 C ATOM 605 O VAL A 43 0.325 -1.894 2.536 1.00 0.00 O ATOM 606 CB VAL A 43 2.140 0.704 1.505 1.00 0.00 C ATOM 607 CG1 VAL A 43 3.109 -0.317 2.080 1.00 0.00 C ATOM 608 CG2 VAL A 43 2.713 1.348 0.252 1.00 0.00 C ATOM 0 H VAL A 43 0.166 1.984 0.677 1.00 0.00 H new ATOM 0 HA VAL A 43 0.907 -0.677 0.396 1.00 0.00 H new ATOM 0 HB VAL A 43 1.988 1.484 2.251 1.00 0.00 H new ATOM 0 HG11 VAL A 43 4.064 0.165 2.290 1.00 0.00 H new ATOM 0 HG12 VAL A 43 2.700 -0.728 3.003 1.00 0.00 H new ATOM 0 HG13 VAL A 43 3.259 -1.122 1.360 1.00 0.00 H new ATOM 0 HG21 VAL A 43 3.674 1.807 0.486 1.00 0.00 H new ATOM 0 HG22 VAL A 43 2.851 0.588 -0.517 1.00 0.00 H new ATOM 0 HG23 VAL A 43 2.025 2.111 -0.112 1.00 0.00 H new ATOM 618 N VAL A 44 -0.196 0.110 3.418 1.00 0.00 N ATOM 619 CA VAL A 44 -0.706 -0.449 4.664 1.00 0.00 C ATOM 620 C VAL A 44 -1.916 -1.341 4.412 1.00 0.00 C ATOM 621 O VAL A 44 -1.965 -2.482 4.870 1.00 0.00 O ATOM 622 CB VAL A 44 -1.098 0.661 5.657 1.00 0.00 C ATOM 623 CG1 VAL A 44 -1.669 0.060 6.933 1.00 0.00 C ATOM 624 CG2 VAL A 44 0.100 1.547 5.966 1.00 0.00 C ATOM 0 H VAL A 44 -0.239 1.128 3.363 1.00 0.00 H new ATOM 0 HA VAL A 44 0.097 -1.046 5.096 1.00 0.00 H new ATOM 0 HB VAL A 44 -1.870 1.279 5.198 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.940 0.860 7.622 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -2.555 -0.528 6.693 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.922 -0.583 7.399 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.195 2.326 6.669 1.00 0.00 H new ATOM 0 HG22 VAL A 44 0.895 0.944 6.405 1.00 0.00 H new ATOM 0 HG23 VAL A 44 0.460 2.007 5.045 1.00 0.00 H new ATOM 634 N ASP A 45 -2.891 -0.812 3.680 1.00 0.00 N ATOM 635 CA ASP A 45 -4.102 -1.561 3.365 1.00 0.00 C ATOM 636 C ASP A 45 -3.760 -2.950 2.836 1.00 0.00 C ATOM 637 O ASP A 45 -4.543 -3.891 2.977 1.00 0.00 O ATOM 638 CB ASP A 45 -4.943 -0.803 2.337 1.00 0.00 C ATOM 639 CG ASP A 45 -5.753 0.315 2.963 1.00 0.00 C ATOM 640 OD1 ASP A 45 -5.197 1.051 3.804 1.00 0.00 O ATOM 641 OD2 ASP A 45 -6.944 0.454 2.612 1.00 0.00 O ATOM 0 H ASP A 45 -2.866 0.132 3.294 1.00 0.00 H new ATOM 0 HA ASP A 45 -4.679 -1.674 4.283 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -4.288 -0.388 1.571 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -5.616 -1.500 1.838 1.00 0.00 H new ATOM 646 N LEU A 46 -2.586 -3.073 2.226 1.00 0.00 N ATOM 647 CA LEU A 46 -2.140 -4.347 1.674 1.00 0.00 C ATOM 648 C LEU A 46 -1.802 -5.334 2.786 1.00 0.00 C ATOM 649 O LEU A 46 -2.147 -6.513 2.710 1.00 0.00 O ATOM 650 CB LEU A 46 -0.920 -4.137 0.775 1.00 0.00 C ATOM 651 CG LEU A 46 -0.434 -5.365 0.005 1.00 0.00 C ATOM 652 CD1 LEU A 46 -1.169 -5.489 -1.321 1.00 0.00 C ATOM 653 CD2 LEU A 46 1.069 -5.293 -0.221 1.00 0.00 C ATOM 0 H LEU A 46 -1.926 -2.306 2.101 1.00 0.00 H new ATOM 0 HA LEU A 46 -2.954 -4.762 1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.154 -3.352 0.056 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -0.099 -3.771 1.391 1.00 0.00 H new ATOM 0 HG LEU A 46 -0.649 -6.252 0.601 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -0.810 -6.369 -1.855 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -2.239 -5.588 -1.136 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.986 -4.599 -1.923 1.00 0.00 H new ATOM 0 HD21 LEU A 46 1.397 -6.175 -0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.308 -4.398 -0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.580 -5.254 0.741 1.00 0.00 H new ATOM 665 N ILE A 47 -1.127 -4.843 3.820 1.00 0.00 N ATOM 666 CA ILE A 47 -0.745 -5.681 4.950 1.00 0.00 C ATOM 667 C ILE A 47 -1.964 -6.356 5.570 1.00 0.00 C ATOM 668 O ILE A 47 -2.079 -7.582 5.561 1.00 0.00 O ATOM 669 CB ILE A 47 -0.017 -4.866 6.035 1.00 0.00 C ATOM 670 CG1 ILE A 47 1.277 -4.272 5.475 1.00 0.00 C ATOM 671 CG2 ILE A 47 0.276 -5.739 7.246 1.00 0.00 C ATOM 672 CD1 ILE A 47 1.738 -3.031 6.205 1.00 0.00 C ATOM 0 H ILE A 47 -0.833 -3.869 3.899 1.00 0.00 H new ATOM 0 HA ILE A 47 -0.068 -6.442 4.563 1.00 0.00 H new ATOM 0 HB ILE A 47 -0.665 -4.048 6.349 1.00 0.00 H new ATOM 0 HG12 ILE A 47 2.063 -5.025 5.523 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.131 -4.031 4.422 1.00 0.00 H new ATOM 0 HG21 ILE A 47 0.791 -5.149 8.004 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -0.660 -6.119 7.656 1.00 0.00 H new ATOM 0 HG23 ILE A 47 0.907 -6.576 6.947 1.00 0.00 H new ATOM 0 HD11 ILE A 47 2.660 -2.665 5.754 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.970 -2.261 6.135 1.00 0.00 H new ATOM 0 HD13 ILE A 47 1.917 -3.271 7.253 1.00 0.00 H new ATOM 684 N ASP A 48 -2.872 -5.548 6.106 1.00 0.00 N ATOM 685 CA ASP A 48 -4.084 -6.067 6.729 1.00 0.00 C ATOM 686 C ASP A 48 -4.703 -7.171 5.876 1.00 0.00 C ATOM 687 O ASP A 48 -4.990 -8.262 6.369 1.00 0.00 O ATOM 688 CB ASP A 48 -5.097 -4.940 6.939 1.00 0.00 C ATOM 689 CG ASP A 48 -4.972 -3.847 5.896 1.00 0.00 C ATOM 690 OD1 ASP A 48 -4.013 -3.052 5.981 1.00 0.00 O ATOM 691 OD2 ASP A 48 -5.834 -3.787 4.994 1.00 0.00 O ATOM 0 H ASP A 48 -2.792 -4.531 6.122 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.814 -6.488 7.697 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -6.106 -5.352 6.910 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -4.957 -4.510 7.931 1.00 0.00 H new ATOM 696 N ALA A 49 -4.906 -6.879 4.596 1.00 0.00 N ATOM 697 CA ALA A 49 -5.490 -7.847 3.675 1.00 0.00 C ATOM 698 C ALA A 49 -4.875 -9.229 3.869 1.00 0.00 C ATOM 699 O ALA A 49 -5.585 -10.233 3.918 1.00 0.00 O ATOM 700 CB ALA A 49 -5.309 -7.383 2.238 1.00 0.00 C ATOM 0 H ALA A 49 -4.675 -5.980 4.173 1.00 0.00 H new ATOM 0 HA ALA A 49 -6.556 -7.919 3.890 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.750 -8.115 1.561 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -5.802 -6.420 2.102 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -4.246 -7.281 2.020 1.00 0.00 H new ATOM 706 N ILE A 50 -3.551 -9.272 3.976 1.00 0.00 N ATOM 707 CA ILE A 50 -2.841 -10.531 4.164 1.00 0.00 C ATOM 708 C ILE A 50 -3.007 -11.048 5.589 1.00 0.00 C ATOM 709 O ILE A 50 -3.413 -12.190 5.802 1.00 0.00 O ATOM 710 CB ILE A 50 -1.340 -10.382 3.855 1.00 0.00 C ATOM 711 CG1 ILE A 50 -1.140 -9.760 2.472 1.00 0.00 C ATOM 712 CG2 ILE A 50 -0.645 -11.733 3.940 1.00 0.00 C ATOM 713 CD1 ILE A 50 0.145 -8.972 2.343 1.00 0.00 C ATOM 0 H ILE A 50 -2.949 -8.450 3.936 1.00 0.00 H new ATOM 0 HA ILE A 50 -3.277 -11.247 3.467 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.896 -9.719 4.598 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -1.148 -10.551 1.722 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.982 -9.104 2.252 1.00 0.00 H new ATOM 0 HG21 ILE A 50 0.415 -11.611 3.719 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -0.762 -12.140 4.944 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -1.090 -12.417 3.217 1.00 0.00 H new ATOM 0 HD11 ILE A 50 0.220 -8.560 1.337 1.00 0.00 H new ATOM 0 HD12 ILE A 50 0.148 -8.159 3.069 1.00 0.00 H new ATOM 0 HD13 ILE A 50 0.995 -9.628 2.530 1.00 0.00 H new ATOM 725 N GLN A 51 -2.691 -10.198 6.562 1.00 0.00 N ATOM 726 CA GLN A 51 -2.807 -10.570 7.967 1.00 0.00 C ATOM 727 C GLN A 51 -3.569 -9.506 8.750 1.00 0.00 C ATOM 728 O GLN A 51 -2.983 -8.625 9.380 1.00 0.00 O ATOM 729 CB GLN A 51 -1.419 -10.774 8.578 1.00 0.00 C ATOM 730 CG GLN A 51 -1.420 -10.790 10.098 1.00 0.00 C ATOM 731 CD GLN A 51 -0.303 -11.638 10.673 1.00 0.00 C ATOM 732 OE1 GLN A 51 0.444 -12.284 9.937 1.00 0.00 O ATOM 733 NE2 GLN A 51 -0.181 -11.640 11.995 1.00 0.00 N ATOM 0 H GLN A 51 -2.353 -9.249 6.403 1.00 0.00 H new ATOM 0 HA GLN A 51 -3.363 -11.506 8.025 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -1.005 -11.714 8.213 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -0.758 -9.979 8.232 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -1.324 -9.769 10.468 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -2.378 -11.169 10.453 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -0.822 -11.090 12.567 1.00 0.00 H new ATOM 0 HE22 GLN A 51 0.554 -12.191 12.439 1.00 0.00 H new ATOM 742 N PRO A 52 -4.907 -9.587 8.712 1.00 0.00 N ATOM 743 CA PRO A 52 -5.778 -8.640 9.413 1.00 0.00 C ATOM 744 C PRO A 52 -5.714 -8.804 10.927 1.00 0.00 C ATOM 745 O PRO A 52 -5.182 -9.792 11.432 1.00 0.00 O ATOM 746 CB PRO A 52 -7.175 -8.992 8.895 1.00 0.00 C ATOM 747 CG PRO A 52 -7.077 -10.421 8.484 1.00 0.00 C ATOM 748 CD PRO A 52 -5.673 -10.611 7.981 1.00 0.00 C ATOM 0 HA PRO A 52 -5.488 -7.606 9.227 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -7.931 -8.853 9.668 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.458 -8.357 8.055 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -7.284 -11.084 9.324 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.805 -10.655 7.707 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -5.304 -11.615 8.190 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -5.610 -10.467 6.902 1.00 0.00 H new ATOM 756 N GLY A 53 -6.260 -7.829 11.648 1.00 0.00 N ATOM 757 CA GLY A 53 -6.254 -7.886 13.098 1.00 0.00 C ATOM 758 C GLY A 53 -5.023 -7.238 13.699 1.00 0.00 C ATOM 759 O GLY A 53 -5.047 -6.787 14.844 1.00 0.00 O ATOM 0 H GLY A 53 -6.706 -7.001 11.254 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -7.146 -7.390 13.482 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.306 -8.927 13.418 1.00 0.00 H new ATOM 763 N CYS A 54 -3.943 -7.193 12.925 1.00 0.00 N ATOM 764 CA CYS A 54 -2.695 -6.598 13.389 1.00 0.00 C ATOM 765 C CYS A 54 -2.637 -5.115 13.037 1.00 0.00 C ATOM 766 O CYS A 54 -2.057 -4.315 13.773 1.00 0.00 O ATOM 767 CB CYS A 54 -1.499 -7.327 12.775 1.00 0.00 C ATOM 768 SG CYS A 54 -1.167 -6.883 11.054 1.00 0.00 S ATOM 0 H CYS A 54 -3.907 -7.561 11.974 1.00 0.00 H new ATOM 0 HA CYS A 54 -2.654 -6.698 14.474 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -0.612 -7.114 13.371 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -1.672 -8.401 12.835 1.00 0.00 H new ATOM 0 HG CYS A 54 -1.885 -7.628 10.267 1.00 0.00 H new ATOM 774 N ILE A 55 -3.239 -4.755 11.909 1.00 0.00 N ATOM 775 CA ILE A 55 -3.255 -3.369 11.460 1.00 0.00 C ATOM 776 C ILE A 55 -4.259 -2.544 12.258 1.00 0.00 C ATOM 777 O ILE A 55 -5.389 -2.973 12.486 1.00 0.00 O ATOM 778 CB ILE A 55 -3.598 -3.266 9.962 1.00 0.00 C ATOM 779 CG1 ILE A 55 -2.544 -3.992 9.124 1.00 0.00 C ATOM 780 CG2 ILE A 55 -3.704 -1.807 9.542 1.00 0.00 C ATOM 781 CD1 ILE A 55 -1.304 -3.165 8.864 1.00 0.00 C ATOM 0 H ILE A 55 -3.722 -5.405 11.289 1.00 0.00 H new ATOM 0 HA ILE A 55 -2.252 -2.973 11.623 1.00 0.00 H new ATOM 0 HB ILE A 55 -4.563 -3.744 9.791 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -2.257 -4.912 9.633 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -2.985 -4.280 8.170 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -3.947 -1.751 8.481 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.488 -1.318 10.120 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -2.753 -1.306 9.724 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -0.600 -3.743 8.264 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -1.578 -2.257 8.327 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -0.839 -2.899 9.813 1.00 0.00 H new ATOM 793 N ASN A 56 -3.838 -1.355 12.679 1.00 0.00 N ATOM 794 CA ASN A 56 -4.701 -0.469 13.451 1.00 0.00 C ATOM 795 C ASN A 56 -4.813 0.899 12.783 1.00 0.00 C ATOM 796 O ASN A 56 -4.050 1.815 13.091 1.00 0.00 O ATOM 797 CB ASN A 56 -4.163 -0.311 14.874 1.00 0.00 C ATOM 798 CG ASN A 56 -5.260 -0.012 15.878 1.00 0.00 C ATOM 799 OD1 ASN A 56 -6.433 0.092 15.519 1.00 0.00 O ATOM 800 ND2 ASN A 56 -4.882 0.128 17.143 1.00 0.00 N ATOM 0 H ASN A 56 -2.905 -0.984 12.498 1.00 0.00 H new ATOM 0 HA ASN A 56 -5.694 -0.916 13.493 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -3.645 -1.224 15.167 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -3.427 0.493 14.894 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -5.576 0.330 17.863 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -3.898 0.033 17.395 1.00 0.00 H new ATOM 807 N TYR A 57 -5.768 1.028 11.869 1.00 0.00 N ATOM 808 CA TYR A 57 -5.978 2.283 11.156 1.00 0.00 C ATOM 809 C TYR A 57 -6.116 3.447 12.132 1.00 0.00 C ATOM 810 O TYR A 57 -5.602 4.539 11.890 1.00 0.00 O ATOM 811 CB TYR A 57 -7.226 2.190 10.276 1.00 0.00 C ATOM 812 CG TYR A 57 -7.066 1.260 9.095 1.00 0.00 C ATOM 813 CD1 TYR A 57 -5.999 1.398 8.216 1.00 0.00 C ATOM 814 CD2 TYR A 57 -7.981 0.241 8.859 1.00 0.00 C ATOM 815 CE1 TYR A 57 -5.850 0.551 7.135 1.00 0.00 C ATOM 816 CE2 TYR A 57 -7.839 -0.612 7.782 1.00 0.00 C ATOM 817 CZ TYR A 57 -6.772 -0.453 6.923 1.00 0.00 C ATOM 818 OH TYR A 57 -6.626 -1.300 5.848 1.00 0.00 O ATOM 0 H TYR A 57 -6.409 0.280 11.604 1.00 0.00 H new ATOM 0 HA TYR A 57 -5.108 2.463 10.524 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -8.065 1.851 10.884 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -7.479 3.186 9.912 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -5.274 2.181 8.381 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -8.818 0.114 9.530 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -5.016 0.674 6.460 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -8.559 -1.399 7.614 1.00 0.00 H new ATOM 0 HH TYR A 57 -6.870 -2.211 6.114 1.00 0.00 H new ATOM 828 N ASP A 58 -6.813 3.205 13.237 1.00 0.00 N ATOM 829 CA ASP A 58 -7.018 4.232 14.252 1.00 0.00 C ATOM 830 C ASP A 58 -5.770 5.095 14.412 1.00 0.00 C ATOM 831 O ASP A 58 -5.861 6.309 14.599 1.00 0.00 O ATOM 832 CB ASP A 58 -7.385 3.590 15.591 1.00 0.00 C ATOM 833 CG ASP A 58 -8.804 3.057 15.608 1.00 0.00 C ATOM 834 OD1 ASP A 58 -9.665 3.639 14.916 1.00 0.00 O ATOM 835 OD2 ASP A 58 -9.053 2.057 16.313 1.00 0.00 O ATOM 0 H ASP A 58 -7.245 2.307 13.453 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.840 4.870 13.927 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.692 2.776 15.802 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.266 4.325 16.387 1.00 0.00 H new ATOM 840 N LEU A 59 -4.605 4.460 14.340 1.00 0.00 N ATOM 841 CA LEU A 59 -3.338 5.169 14.478 1.00 0.00 C ATOM 842 C LEU A 59 -2.910 5.782 13.148 1.00 0.00 C ATOM 843 O LEU A 59 -2.433 6.917 13.101 1.00 0.00 O ATOM 844 CB LEU A 59 -2.253 4.219 14.988 1.00 0.00 C ATOM 845 CG LEU A 59 -2.599 3.415 16.241 1.00 0.00 C ATOM 846 CD1 LEU A 59 -1.558 2.334 16.487 1.00 0.00 C ATOM 847 CD2 LEU A 59 -2.712 4.334 17.449 1.00 0.00 C ATOM 0 H LEU A 59 -4.512 3.456 14.187 1.00 0.00 H new ATOM 0 HA LEU A 59 -3.476 5.974 15.200 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -2.006 3.520 14.189 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -1.354 4.802 15.191 1.00 0.00 H new ATOM 0 HG LEU A 59 -3.564 2.932 16.085 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -1.822 1.772 17.383 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -1.526 1.659 15.632 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -0.580 2.795 16.622 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -2.959 3.745 18.332 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -1.762 4.845 17.607 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -3.496 5.071 17.274 1.00 0.00 H new ATOM 859 N VAL A 60 -3.084 5.025 12.070 1.00 0.00 N ATOM 860 CA VAL A 60 -2.719 5.495 10.739 1.00 0.00 C ATOM 861 C VAL A 60 -3.479 6.766 10.377 1.00 0.00 C ATOM 862 O VAL A 60 -4.619 6.963 10.798 1.00 0.00 O ATOM 863 CB VAL A 60 -2.996 4.422 9.669 1.00 0.00 C ATOM 864 CG1 VAL A 60 -2.633 4.941 8.286 1.00 0.00 C ATOM 865 CG2 VAL A 60 -2.233 3.145 9.986 1.00 0.00 C ATOM 0 H VAL A 60 -3.476 4.083 12.092 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.650 5.708 10.761 1.00 0.00 H new ATOM 0 HB VAL A 60 -4.062 4.193 9.676 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -2.835 4.169 7.543 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -3.229 5.826 8.062 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -1.575 5.200 8.261 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -2.440 2.398 9.220 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -1.164 3.356 10.007 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -2.547 2.765 10.958 1.00 0.00 H new ATOM 875 N LYS A 61 -2.840 7.628 9.593 1.00 0.00 N ATOM 876 CA LYS A 61 -3.455 8.881 9.172 1.00 0.00 C ATOM 877 C LYS A 61 -4.129 8.726 7.812 1.00 0.00 C ATOM 878 O LYS A 61 -4.051 7.668 7.188 1.00 0.00 O ATOM 879 CB LYS A 61 -2.405 9.993 9.108 1.00 0.00 C ATOM 880 CG LYS A 61 -2.214 10.726 10.425 1.00 0.00 C ATOM 881 CD LYS A 61 -3.378 11.658 10.717 1.00 0.00 C ATOM 882 CE LYS A 61 -3.207 12.360 12.055 1.00 0.00 C ATOM 883 NZ LYS A 61 -4.344 13.276 12.350 1.00 0.00 N ATOM 0 H LYS A 61 -1.896 7.481 9.236 1.00 0.00 H new ATOM 0 HA LYS A 61 -4.214 9.148 9.907 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -1.452 9.564 8.799 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -2.695 10.711 8.341 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -2.114 10.003 11.234 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -1.287 11.299 10.393 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.459 12.400 9.923 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -4.309 11.090 10.719 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -3.125 11.616 12.848 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -2.276 12.926 12.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -4.190 13.735 13.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -4.407 14.001 11.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -5.230 12.732 12.379 1.00 0.00 H new ATOM 897 N SER A 62 -4.789 9.787 7.360 1.00 0.00 N ATOM 898 CA SER A 62 -5.479 9.768 6.075 1.00 0.00 C ATOM 899 C SER A 62 -5.894 11.176 5.660 1.00 0.00 C ATOM 900 O SER A 62 -6.246 12.004 6.499 1.00 0.00 O ATOM 901 CB SER A 62 -6.709 8.861 6.147 1.00 0.00 C ATOM 902 OG SER A 62 -7.607 9.298 7.153 1.00 0.00 O ATOM 0 H SER A 62 -4.861 10.671 7.864 1.00 0.00 H new ATOM 0 HA SER A 62 -4.791 9.376 5.326 1.00 0.00 H new ATOM 0 HB2 SER A 62 -7.215 8.853 5.182 1.00 0.00 H new ATOM 0 HB3 SER A 62 -6.398 7.837 6.353 1.00 0.00 H new ATOM 0 HG SER A 62 -8.385 8.703 7.178 1.00 0.00 H new ATOM 908 N GLY A 63 -5.849 11.440 4.358 1.00 0.00 N ATOM 909 CA GLY A 63 -6.223 12.748 3.852 1.00 0.00 C ATOM 910 C GLY A 63 -5.019 13.601 3.506 1.00 0.00 C ATOM 911 O GLY A 63 -4.144 13.175 2.753 1.00 0.00 O ATOM 0 H GLY A 63 -5.560 10.771 3.644 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -6.846 12.627 2.966 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.828 13.264 4.598 1.00 0.00 H new ATOM 915 N ASN A 64 -4.975 14.810 4.056 1.00 0.00 N ATOM 916 CA ASN A 64 -3.870 15.727 3.799 1.00 0.00 C ATOM 917 C ASN A 64 -2.706 15.456 4.748 1.00 0.00 C ATOM 918 O ASN A 64 -2.644 16.010 5.846 1.00 0.00 O ATOM 919 CB ASN A 64 -4.337 17.176 3.948 1.00 0.00 C ATOM 920 CG ASN A 64 -5.628 17.447 3.201 1.00 0.00 C ATOM 921 OD1 ASN A 64 -6.718 17.339 3.763 1.00 0.00 O ATOM 922 ND2 ASN A 64 -5.511 17.801 1.927 1.00 0.00 N ATOM 0 H ASN A 64 -5.691 15.178 4.682 1.00 0.00 H new ATOM 0 HA ASN A 64 -3.527 15.566 2.777 1.00 0.00 H new ATOM 0 HB2 ASN A 64 -4.478 17.403 5.005 1.00 0.00 H new ATOM 0 HB3 ASN A 64 -3.560 17.845 3.579 1.00 0.00 H new ATOM 0 HD21 ASN A 64 -6.345 17.996 1.373 1.00 0.00 H new ATOM 0 HD22 ASN A 64 -4.587 17.878 1.502 1.00 0.00 H new ATOM 929 N LEU A 65 -1.785 14.601 4.317 1.00 0.00 N ATOM 930 CA LEU A 65 -0.622 14.256 5.127 1.00 0.00 C ATOM 931 C LEU A 65 0.516 15.244 4.894 1.00 0.00 C ATOM 932 O LEU A 65 1.045 15.350 3.787 1.00 0.00 O ATOM 933 CB LEU A 65 -0.154 12.836 4.804 1.00 0.00 C ATOM 934 CG LEU A 65 -1.205 11.734 4.946 1.00 0.00 C ATOM 935 CD1 LEU A 65 -0.673 10.416 4.404 1.00 0.00 C ATOM 936 CD2 LEU A 65 -1.626 11.584 6.401 1.00 0.00 C ATOM 0 H LEU A 65 -1.821 14.134 3.411 1.00 0.00 H new ATOM 0 HA LEU A 65 -0.913 14.306 6.176 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.221 12.823 3.781 1.00 0.00 H new ATOM 0 HB3 LEU A 65 0.686 12.595 5.455 1.00 0.00 H new ATOM 0 HG LEU A 65 -2.081 12.016 4.362 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -1.434 9.644 4.513 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -0.422 10.531 3.350 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.219 10.127 4.960 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -2.374 10.796 6.484 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -0.757 11.325 7.006 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -2.048 12.524 6.756 1.00 0.00 H new ATOM 948 N THR A 66 0.890 15.966 5.946 1.00 0.00 N ATOM 949 CA THR A 66 1.966 16.945 5.856 1.00 0.00 C ATOM 950 C THR A 66 3.325 16.261 5.750 1.00 0.00 C ATOM 951 O THR A 66 3.421 15.038 5.837 1.00 0.00 O ATOM 952 CB THR A 66 1.972 17.886 7.076 1.00 0.00 C ATOM 953 OG1 THR A 66 2.170 17.131 8.277 1.00 0.00 O ATOM 954 CG2 THR A 66 0.667 18.662 7.168 1.00 0.00 C ATOM 0 H THR A 66 0.464 15.891 6.870 1.00 0.00 H new ATOM 0 HA THR A 66 1.786 17.531 4.955 1.00 0.00 H new ATOM 0 HB THR A 66 2.790 18.596 6.955 1.00 0.00 H new ATOM 0 HG1 THR A 66 1.447 16.476 8.375 1.00 0.00 H new ATOM 0 HG21 THR A 66 0.695 19.319 8.037 1.00 0.00 H new ATOM 0 HG22 THR A 66 0.534 19.259 6.266 1.00 0.00 H new ATOM 0 HG23 THR A 66 -0.165 17.965 7.267 1.00 0.00 H new ATOM 962 N GLU A 67 4.371 17.059 5.562 1.00 0.00 N ATOM 963 CA GLU A 67 5.724 16.529 5.444 1.00 0.00 C ATOM 964 C GLU A 67 6.002 15.499 6.535 1.00 0.00 C ATOM 965 O GLU A 67 6.673 14.494 6.299 1.00 0.00 O ATOM 966 CB GLU A 67 6.749 17.662 5.525 1.00 0.00 C ATOM 967 CG GLU A 67 6.867 18.468 4.242 1.00 0.00 C ATOM 968 CD GLU A 67 8.097 19.355 4.222 1.00 0.00 C ATOM 969 OE1 GLU A 67 8.059 20.438 4.843 1.00 0.00 O ATOM 970 OE2 GLU A 67 9.098 18.966 3.584 1.00 0.00 O ATOM 0 H GLU A 67 4.308 18.074 5.488 1.00 0.00 H new ATOM 0 HA GLU A 67 5.811 16.039 4.474 1.00 0.00 H new ATOM 0 HB2 GLU A 67 6.475 18.331 6.341 1.00 0.00 H new ATOM 0 HB3 GLU A 67 7.724 17.242 5.771 1.00 0.00 H new ATOM 0 HG2 GLU A 67 6.901 17.787 3.391 1.00 0.00 H new ATOM 0 HG3 GLU A 67 5.977 19.085 4.122 1.00 0.00 H new ATOM 977 N ASP A 68 5.481 15.756 7.730 1.00 0.00 N ATOM 978 CA ASP A 68 5.672 14.852 8.858 1.00 0.00 C ATOM 979 C ASP A 68 4.775 13.625 8.728 1.00 0.00 C ATOM 980 O ASP A 68 5.243 12.489 8.817 1.00 0.00 O ATOM 981 CB ASP A 68 5.380 15.575 10.174 1.00 0.00 C ATOM 982 CG ASP A 68 6.600 16.285 10.727 1.00 0.00 C ATOM 983 OD1 ASP A 68 7.727 15.815 10.469 1.00 0.00 O ATOM 984 OD2 ASP A 68 6.427 17.310 11.420 1.00 0.00 O ATOM 0 H ASP A 68 4.923 16.583 7.942 1.00 0.00 H new ATOM 0 HA ASP A 68 6.711 14.523 8.856 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.581 16.300 10.018 1.00 0.00 H new ATOM 0 HB3 ASP A 68 5.018 14.855 10.908 1.00 0.00 H new ATOM 989 N ASP A 69 3.485 13.860 8.519 1.00 0.00 N ATOM 990 CA ASP A 69 2.522 12.774 8.377 1.00 0.00 C ATOM 991 C ASP A 69 3.040 11.711 7.414 1.00 0.00 C ATOM 992 O ASP A 69 3.282 10.569 7.804 1.00 0.00 O ATOM 993 CB ASP A 69 1.179 13.316 7.884 1.00 0.00 C ATOM 994 CG ASP A 69 0.498 14.198 8.912 1.00 0.00 C ATOM 995 OD1 ASP A 69 1.211 14.916 9.644 1.00 0.00 O ATOM 996 OD2 ASP A 69 -0.748 14.171 8.984 1.00 0.00 O ATOM 0 H ASP A 69 3.081 14.794 8.444 1.00 0.00 H new ATOM 0 HA ASP A 69 2.382 12.315 9.356 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.335 13.885 6.967 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.524 12.482 7.634 1.00 0.00 H new ATOM 1001 N LYS A 70 3.208 12.094 6.152 1.00 0.00 N ATOM 1002 CA LYS A 70 3.698 11.175 5.132 1.00 0.00 C ATOM 1003 C LYS A 70 4.712 10.199 5.720 1.00 0.00 C ATOM 1004 O LYS A 70 4.600 8.987 5.535 1.00 0.00 O ATOM 1005 CB LYS A 70 4.334 11.954 3.978 1.00 0.00 C ATOM 1006 CG LYS A 70 3.338 12.392 2.918 1.00 0.00 C ATOM 1007 CD LYS A 70 4.039 12.950 1.691 1.00 0.00 C ATOM 1008 CE LYS A 70 3.041 13.414 0.641 1.00 0.00 C ATOM 1009 NZ LYS A 70 3.711 13.779 -0.638 1.00 0.00 N ATOM 0 H LYS A 70 3.012 13.035 5.812 1.00 0.00 H new ATOM 0 HA LYS A 70 2.849 10.605 4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 70 4.836 12.835 4.378 1.00 0.00 H new ATOM 0 HB3 LYS A 70 5.100 11.335 3.511 1.00 0.00 H new ATOM 0 HG2 LYS A 70 2.716 11.544 2.629 1.00 0.00 H new ATOM 0 HG3 LYS A 70 2.672 13.149 3.333 1.00 0.00 H new ATOM 0 HD2 LYS A 70 4.676 13.785 1.983 1.00 0.00 H new ATOM 0 HD3 LYS A 70 4.690 12.187 1.264 1.00 0.00 H new ATOM 0 HE2 LYS A 70 2.313 12.623 0.457 1.00 0.00 H new ATOM 0 HE3 LYS A 70 2.489 14.274 1.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 3.032 13.695 -1.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 4.056 14.759 -0.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 4.513 13.139 -0.805 1.00 0.00 H new ATOM 1023 N HIS A 71 5.699 10.735 6.430 1.00 0.00 N ATOM 1024 CA HIS A 71 6.732 9.910 7.047 1.00 0.00 C ATOM 1025 C HIS A 71 6.124 8.950 8.066 1.00 0.00 C ATOM 1026 O HIS A 71 6.405 7.753 8.049 1.00 0.00 O ATOM 1027 CB HIS A 71 7.782 10.792 7.724 1.00 0.00 C ATOM 1028 CG HIS A 71 8.819 11.319 6.780 1.00 0.00 C ATOM 1029 ND1 HIS A 71 9.702 10.506 6.102 1.00 0.00 N ATOM 1030 CD2 HIS A 71 9.109 12.586 6.402 1.00 0.00 C ATOM 1031 CE1 HIS A 71 10.492 11.250 5.349 1.00 0.00 C ATOM 1032 NE2 HIS A 71 10.153 12.516 5.513 1.00 0.00 N ATOM 0 H HIS A 71 5.806 11.736 6.593 1.00 0.00 H new ATOM 0 HA HIS A 71 7.211 9.324 6.263 1.00 0.00 H new ATOM 0 HB2 HIS A 71 7.283 11.631 8.208 1.00 0.00 H new ATOM 0 HB3 HIS A 71 8.275 10.219 8.509 1.00 0.00 H new ATOM 0 HD2 HIS A 71 8.612 13.484 6.737 1.00 0.00 H new ATOM 0 HE1 HIS A 71 11.281 10.885 4.708 1.00 0.00 H new ATOM 0 HE2 HIS A 71 10.595 13.312 5.054 1.00 0.00 H new ATOM 1041 N ASN A 72 5.290 9.486 8.951 1.00 0.00 N ATOM 1042 CA ASN A 72 4.643 8.677 9.978 1.00 0.00 C ATOM 1043 C ASN A 72 3.929 7.480 9.358 1.00 0.00 C ATOM 1044 O ASN A 72 4.117 6.342 9.786 1.00 0.00 O ATOM 1045 CB ASN A 72 3.647 9.524 10.772 1.00 0.00 C ATOM 1046 CG ASN A 72 4.331 10.440 11.768 1.00 0.00 C ATOM 1047 OD1 ASN A 72 5.045 9.982 12.661 1.00 0.00 O ATOM 1048 ND2 ASN A 72 4.116 11.742 11.620 1.00 0.00 N ATOM 0 H ASN A 72 5.046 10.476 8.978 1.00 0.00 H new ATOM 0 HA ASN A 72 5.415 8.307 10.653 1.00 0.00 H new ATOM 0 HB2 ASN A 72 3.052 10.122 10.082 1.00 0.00 H new ATOM 0 HB3 ASN A 72 2.957 8.867 11.301 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.550 12.407 12.261 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.517 12.077 10.866 1.00 0.00 H new ATOM 1055 N ASN A 73 3.109 7.746 8.346 1.00 0.00 N ATOM 1056 CA ASN A 73 2.366 6.691 7.667 1.00 0.00 C ATOM 1057 C ASN A 73 3.304 5.584 7.193 1.00 0.00 C ATOM 1058 O ASN A 73 3.108 4.412 7.513 1.00 0.00 O ATOM 1059 CB ASN A 73 1.596 7.266 6.476 1.00 0.00 C ATOM 1060 CG ASN A 73 0.477 8.194 6.906 1.00 0.00 C ATOM 1061 OD1 ASN A 73 0.707 9.181 7.605 1.00 0.00 O ATOM 1062 ND2 ASN A 73 -0.745 7.881 6.490 1.00 0.00 N ATOM 0 H ASN A 73 2.943 8.683 7.978 1.00 0.00 H new ATOM 0 HA ASN A 73 1.658 6.264 8.378 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.285 7.808 5.828 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.180 6.449 5.886 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -1.538 8.468 6.749 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -0.891 7.053 5.912 1.00 0.00 H new ATOM 1069 N ALA A 74 4.323 5.965 6.430 1.00 0.00 N ATOM 1070 CA ALA A 74 5.292 5.006 5.915 1.00 0.00 C ATOM 1071 C ALA A 74 5.909 4.189 7.045 1.00 0.00 C ATOM 1072 O ALA A 74 5.791 2.964 7.075 1.00 0.00 O ATOM 1073 CB ALA A 74 6.377 5.724 5.127 1.00 0.00 C ATOM 0 H ALA A 74 4.499 6.931 6.155 1.00 0.00 H new ATOM 0 HA ALA A 74 4.769 4.320 5.249 1.00 0.00 H new ATOM 0 HB1 ALA A 74 7.094 4.996 4.748 1.00 0.00 H new ATOM 0 HB2 ALA A 74 5.926 6.258 4.291 1.00 0.00 H new ATOM 0 HB3 ALA A 74 6.889 6.433 5.777 1.00 0.00 H new ATOM 1079 N LYS A 75 6.569 4.874 7.972 1.00 0.00 N ATOM 1080 CA LYS A 75 7.205 4.212 9.105 1.00 0.00 C ATOM 1081 C LYS A 75 6.357 3.045 9.600 1.00 0.00 C ATOM 1082 O LYS A 75 6.803 1.897 9.601 1.00 0.00 O ATOM 1083 CB LYS A 75 7.432 5.210 10.243 1.00 0.00 C ATOM 1084 CG LYS A 75 8.653 6.091 10.046 1.00 0.00 C ATOM 1085 CD LYS A 75 9.123 6.695 11.358 1.00 0.00 C ATOM 1086 CE LYS A 75 8.371 7.976 11.684 1.00 0.00 C ATOM 1087 NZ LYS A 75 8.889 8.625 12.920 1.00 0.00 N ATOM 0 H LYS A 75 6.678 5.888 7.961 1.00 0.00 H new ATOM 0 HA LYS A 75 8.168 3.823 8.773 1.00 0.00 H new ATOM 0 HB2 LYS A 75 6.550 5.843 10.341 1.00 0.00 H new ATOM 0 HB3 LYS A 75 7.537 4.662 11.180 1.00 0.00 H new ATOM 0 HG2 LYS A 75 9.459 5.504 9.605 1.00 0.00 H new ATOM 0 HG3 LYS A 75 8.417 6.888 9.341 1.00 0.00 H new ATOM 0 HD2 LYS A 75 8.981 5.974 12.163 1.00 0.00 H new ATOM 0 HD3 LYS A 75 10.191 6.904 11.301 1.00 0.00 H new ATOM 0 HE2 LYS A 75 8.455 8.669 10.847 1.00 0.00 H new ATOM 0 HE3 LYS A 75 7.311 7.753 11.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 8.350 9.495 13.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 8.785 7.973 13.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 9.894 8.861 12.793 1.00 0.00 H new ATOM 1101 N TYR A 76 5.132 3.345 10.018 1.00 0.00 N ATOM 1102 CA TYR A 76 4.222 2.320 10.516 1.00 0.00 C ATOM 1103 C TYR A 76 4.181 1.122 9.571 1.00 0.00 C ATOM 1104 O TYR A 76 4.352 -0.021 9.993 1.00 0.00 O ATOM 1105 CB TYR A 76 2.816 2.897 10.687 1.00 0.00 C ATOM 1106 CG TYR A 76 1.897 2.018 11.506 1.00 0.00 C ATOM 1107 CD1 TYR A 76 2.191 1.716 12.830 1.00 0.00 C ATOM 1108 CD2 TYR A 76 0.736 1.490 10.956 1.00 0.00 C ATOM 1109 CE1 TYR A 76 1.354 0.913 13.582 1.00 0.00 C ATOM 1110 CE2 TYR A 76 -0.107 0.688 11.700 1.00 0.00 C ATOM 1111 CZ TYR A 76 0.207 0.402 13.013 1.00 0.00 C ATOM 1112 OH TYR A 76 -0.630 -0.397 13.757 1.00 0.00 O ATOM 0 H TYR A 76 4.746 4.289 10.022 1.00 0.00 H new ATOM 0 HA TYR A 76 4.590 1.983 11.485 1.00 0.00 H new ATOM 0 HB2 TYR A 76 2.889 3.875 11.163 1.00 0.00 H new ATOM 0 HB3 TYR A 76 2.374 3.053 9.703 1.00 0.00 H new ATOM 0 HD1 TYR A 76 3.088 2.115 13.279 1.00 0.00 H new ATOM 0 HD2 TYR A 76 0.488 1.711 9.928 1.00 0.00 H new ATOM 0 HE1 TYR A 76 1.597 0.687 14.610 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -1.007 0.287 11.257 1.00 0.00 H new ATOM 0 HH TYR A 76 -0.575 -0.139 14.701 1.00 0.00 H new ATOM 1122 N ALA A 77 3.954 1.395 8.291 1.00 0.00 N ATOM 1123 CA ALA A 77 3.893 0.342 7.285 1.00 0.00 C ATOM 1124 C ALA A 77 5.166 -0.498 7.291 1.00 0.00 C ATOM 1125 O ALA A 77 5.114 -1.723 7.188 1.00 0.00 O ATOM 1126 CB ALA A 77 3.661 0.941 5.906 1.00 0.00 C ATOM 0 H ALA A 77 3.809 2.336 7.926 1.00 0.00 H new ATOM 0 HA ALA A 77 3.056 -0.312 7.531 1.00 0.00 H new ATOM 0 HB1 ALA A 77 3.618 0.143 5.165 1.00 0.00 H new ATOM 0 HB2 ALA A 77 2.720 1.491 5.902 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.479 1.619 5.662 1.00 0.00 H new ATOM 1132 N VAL A 78 6.309 0.170 7.412 1.00 0.00 N ATOM 1133 CA VAL A 78 7.596 -0.515 7.432 1.00 0.00 C ATOM 1134 C VAL A 78 7.677 -1.498 8.594 1.00 0.00 C ATOM 1135 O VAL A 78 8.105 -2.640 8.426 1.00 0.00 O ATOM 1136 CB VAL A 78 8.762 0.485 7.538 1.00 0.00 C ATOM 1137 CG1 VAL A 78 10.094 -0.249 7.572 1.00 0.00 C ATOM 1138 CG2 VAL A 78 8.720 1.476 6.385 1.00 0.00 C ATOM 0 H VAL A 78 6.370 1.185 7.498 1.00 0.00 H new ATOM 0 HA VAL A 78 7.679 -1.060 6.492 1.00 0.00 H new ATOM 0 HB VAL A 78 8.657 1.041 8.470 1.00 0.00 H new ATOM 0 HG11 VAL A 78 10.906 0.474 7.647 1.00 0.00 H new ATOM 0 HG12 VAL A 78 10.120 -0.915 8.434 1.00 0.00 H new ATOM 0 HG13 VAL A 78 10.211 -0.833 6.659 1.00 0.00 H new ATOM 0 HG21 VAL A 78 9.551 2.175 6.476 1.00 0.00 H new ATOM 0 HG22 VAL A 78 8.800 0.938 5.440 1.00 0.00 H new ATOM 0 HG23 VAL A 78 7.779 2.026 6.412 1.00 0.00 H new ATOM 1148 N SER A 79 7.263 -1.047 9.774 1.00 0.00 N ATOM 1149 CA SER A 79 7.291 -1.886 10.966 1.00 0.00 C ATOM 1150 C SER A 79 6.358 -3.083 10.811 1.00 0.00 C ATOM 1151 O SER A 79 6.744 -4.223 11.066 1.00 0.00 O ATOM 1152 CB SER A 79 6.895 -1.071 12.199 1.00 0.00 C ATOM 1153 OG SER A 79 7.963 -0.247 12.631 1.00 0.00 O ATOM 0 H SER A 79 6.904 -0.105 9.930 1.00 0.00 H new ATOM 0 HA SER A 79 8.308 -2.256 11.096 1.00 0.00 H new ATOM 0 HB2 SER A 79 6.027 -0.454 11.967 1.00 0.00 H new ATOM 0 HB3 SER A 79 6.602 -1.744 13.005 1.00 0.00 H new ATOM 0 HG SER A 79 7.684 0.264 13.419 1.00 0.00 H new ATOM 1159 N MET A 80 5.126 -2.813 10.392 1.00 0.00 N ATOM 1160 CA MET A 80 4.136 -3.867 10.201 1.00 0.00 C ATOM 1161 C MET A 80 4.601 -4.866 9.146 1.00 0.00 C ATOM 1162 O MET A 80 4.790 -6.047 9.436 1.00 0.00 O ATOM 1163 CB MET A 80 2.790 -3.265 9.792 1.00 0.00 C ATOM 1164 CG MET A 80 2.106 -2.493 10.908 1.00 0.00 C ATOM 1165 SD MET A 80 1.939 -3.459 12.421 1.00 0.00 S ATOM 1166 CE MET A 80 0.720 -4.671 11.916 1.00 0.00 C ATOM 0 H MET A 80 4.789 -1.874 10.178 1.00 0.00 H new ATOM 0 HA MET A 80 4.017 -4.394 11.148 1.00 0.00 H new ATOM 0 HB2 MET A 80 2.942 -2.600 8.942 1.00 0.00 H new ATOM 0 HB3 MET A 80 2.130 -4.065 9.457 1.00 0.00 H new ATOM 0 HG2 MET A 80 2.676 -1.588 11.120 1.00 0.00 H new ATOM 0 HG3 MET A 80 1.118 -2.177 10.573 1.00 0.00 H new ATOM 0 HE1 MET A 80 0.457 -5.299 12.767 1.00 0.00 H new ATOM 0 HE2 MET A 80 -0.172 -4.160 11.553 1.00 0.00 H new ATOM 0 HE3 MET A 80 1.132 -5.292 11.120 1.00 0.00 H new ATOM 1176 N ALA A 81 4.784 -4.383 7.921 1.00 0.00 N ATOM 1177 CA ALA A 81 5.228 -5.233 6.824 1.00 0.00 C ATOM 1178 C ALA A 81 6.187 -6.312 7.318 1.00 0.00 C ATOM 1179 O ALA A 81 5.909 -7.505 7.198 1.00 0.00 O ATOM 1180 CB ALA A 81 5.889 -4.394 5.740 1.00 0.00 C ATOM 0 H ALA A 81 4.631 -3.408 7.664 1.00 0.00 H new ATOM 0 HA ALA A 81 4.352 -5.727 6.403 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.216 -5.042 4.927 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.175 -3.665 5.358 1.00 0.00 H new ATOM 0 HB3 ALA A 81 6.751 -3.873 6.158 1.00 0.00 H new ATOM 1186 N ARG A 82 7.315 -5.884 7.874 1.00 0.00 N ATOM 1187 CA ARG A 82 8.316 -6.814 8.385 1.00 0.00 C ATOM 1188 C ARG A 82 7.742 -7.662 9.516 1.00 0.00 C ATOM 1189 O ARG A 82 8.005 -8.862 9.600 1.00 0.00 O ATOM 1190 CB ARG A 82 9.546 -6.051 8.879 1.00 0.00 C ATOM 1191 CG ARG A 82 9.258 -5.121 10.046 1.00 0.00 C ATOM 1192 CD ARG A 82 10.520 -4.418 10.523 1.00 0.00 C ATOM 1193 NE ARG A 82 11.281 -5.238 11.462 1.00 0.00 N ATOM 1194 CZ ARG A 82 12.220 -4.754 12.267 1.00 0.00 C ATOM 1195 NH1 ARG A 82 12.511 -3.461 12.248 1.00 0.00 N ATOM 1196 NH2 ARG A 82 12.869 -5.564 13.093 1.00 0.00 N ATOM 0 H ARG A 82 7.559 -4.900 7.982 1.00 0.00 H new ATOM 0 HA ARG A 82 8.610 -7.476 7.571 1.00 0.00 H new ATOM 0 HB2 ARG A 82 10.312 -6.767 9.177 1.00 0.00 H new ATOM 0 HB3 ARG A 82 9.957 -5.469 8.054 1.00 0.00 H new ATOM 0 HG2 ARG A 82 8.518 -4.379 9.747 1.00 0.00 H new ATOM 0 HG3 ARG A 82 8.825 -5.690 10.868 1.00 0.00 H new ATOM 0 HD2 ARG A 82 11.146 -4.174 9.665 1.00 0.00 H new ATOM 0 HD3 ARG A 82 10.252 -3.475 11.000 1.00 0.00 H new ATOM 0 HE ARG A 82 11.080 -6.237 11.502 1.00 0.00 H new ATOM 0 HH11 ARG A 82 12.013 -2.836 11.614 1.00 0.00 H new ATOM 0 HH12 ARG A 82 13.232 -3.091 12.867 1.00 0.00 H new ATOM 0 HH21 ARG A 82 12.647 -6.559 13.110 1.00 0.00 H new ATOM 0 HH22 ARG A 82 13.590 -5.191 13.711 1.00 0.00 H new ATOM 1210 N ARG A 83 6.957 -7.031 10.383 1.00 0.00 N ATOM 1211 CA ARG A 83 6.347 -7.728 11.509 1.00 0.00 C ATOM 1212 C ARG A 83 5.644 -9.000 11.046 1.00 0.00 C ATOM 1213 O ARG A 83 5.891 -10.085 11.573 1.00 0.00 O ATOM 1214 CB ARG A 83 5.351 -6.812 12.224 1.00 0.00 C ATOM 1215 CG ARG A 83 5.052 -7.235 13.653 1.00 0.00 C ATOM 1216 CD ARG A 83 4.023 -6.322 14.300 1.00 0.00 C ATOM 1217 NE ARG A 83 3.544 -6.853 15.574 1.00 0.00 N ATOM 1218 CZ ARG A 83 2.788 -7.940 15.679 1.00 0.00 C ATOM 1219 NH1 ARG A 83 2.427 -8.608 14.592 1.00 0.00 N ATOM 1220 NH2 ARG A 83 2.392 -8.361 16.873 1.00 0.00 N ATOM 0 H ARG A 83 6.728 -6.038 10.327 1.00 0.00 H new ATOM 0 HA ARG A 83 7.139 -8.005 12.204 1.00 0.00 H new ATOM 0 HB2 ARG A 83 5.745 -5.796 12.230 1.00 0.00 H new ATOM 0 HB3 ARG A 83 4.420 -6.790 11.658 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.685 -8.261 13.661 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.972 -7.221 14.238 1.00 0.00 H new ATOM 0 HD2 ARG A 83 4.462 -5.337 14.460 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.179 -6.189 13.623 1.00 0.00 H new ATOM 0 HE ARG A 83 3.804 -6.362 16.429 1.00 0.00 H new ATOM 0 HH11 ARG A 83 2.730 -8.287 13.672 1.00 0.00 H new ATOM 0 HH12 ARG A 83 1.846 -9.442 14.676 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.668 -7.850 17.711 1.00 0.00 H new ATOM 0 HH22 ARG A 83 1.811 -9.196 16.953 1.00 0.00 H new ATOM 1234 N ILE A 84 4.766 -8.858 10.058 1.00 0.00 N ATOM 1235 CA ILE A 84 4.028 -9.995 9.524 1.00 0.00 C ATOM 1236 C ILE A 84 4.961 -10.976 8.822 1.00 0.00 C ATOM 1237 O ILE A 84 4.566 -12.091 8.484 1.00 0.00 O ATOM 1238 CB ILE A 84 2.937 -9.543 8.534 1.00 0.00 C ATOM 1239 CG1 ILE A 84 3.564 -8.784 7.363 1.00 0.00 C ATOM 1240 CG2 ILE A 84 1.905 -8.679 9.242 1.00 0.00 C ATOM 1241 CD1 ILE A 84 2.686 -8.742 6.132 1.00 0.00 C ATOM 0 H ILE A 84 4.549 -7.967 9.612 1.00 0.00 H new ATOM 0 HA ILE A 84 3.555 -10.491 10.372 1.00 0.00 H new ATOM 0 HB ILE A 84 2.434 -10.427 8.141 1.00 0.00 H new ATOM 0 HG12 ILE A 84 3.784 -7.764 7.678 1.00 0.00 H new ATOM 0 HG13 ILE A 84 4.515 -9.250 7.106 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.141 -8.367 8.530 1.00 0.00 H new ATOM 0 HG22 ILE A 84 1.441 -9.251 10.045 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.393 -7.798 9.659 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.193 -8.188 5.342 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.487 -9.758 5.792 1.00 0.00 H new ATOM 0 HD13 ILE A 84 1.744 -8.249 6.373 1.00 0.00 H new ATOM 1253 N GLY A 85 6.203 -10.552 8.607 1.00 0.00 N ATOM 1254 CA GLY A 85 7.174 -11.406 7.948 1.00 0.00 C ATOM 1255 C GLY A 85 7.414 -11.005 6.506 1.00 0.00 C ATOM 1256 O GLY A 85 6.874 -11.619 5.587 1.00 0.00 O ATOM 0 H GLY A 85 6.554 -9.633 8.877 1.00 0.00 H new ATOM 0 HA2 GLY A 85 8.117 -11.368 8.494 1.00 0.00 H new ATOM 0 HA3 GLY A 85 6.827 -12.439 7.982 1.00 0.00 H new ATOM 1260 N ALA A 86 8.225 -9.972 6.308 1.00 0.00 N ATOM 1261 CA ALA A 86 8.535 -9.490 4.968 1.00 0.00 C ATOM 1262 C ALA A 86 10.042 -9.389 4.756 1.00 0.00 C ATOM 1263 O ALA A 86 10.541 -9.623 3.655 1.00 0.00 O ATOM 1264 CB ALA A 86 7.874 -8.141 4.725 1.00 0.00 C ATOM 0 H ALA A 86 8.680 -9.452 7.059 1.00 0.00 H new ATOM 0 HA ALA A 86 8.141 -10.209 4.250 1.00 0.00 H new ATOM 0 HB1 ALA A 86 8.115 -7.794 3.720 1.00 0.00 H new ATOM 0 HB2 ALA A 86 6.793 -8.242 4.825 1.00 0.00 H new ATOM 0 HB3 ALA A 86 8.240 -7.420 5.456 1.00 0.00 H new ATOM 1270 N ARG A 87 10.762 -9.037 5.816 1.00 0.00 N ATOM 1271 CA ARG A 87 12.212 -8.903 5.745 1.00 0.00 C ATOM 1272 C ARG A 87 12.609 -7.818 4.749 1.00 0.00 C ATOM 1273 O ARG A 87 13.426 -8.048 3.857 1.00 0.00 O ATOM 1274 CB ARG A 87 12.849 -10.235 5.346 1.00 0.00 C ATOM 1275 CG ARG A 87 14.248 -10.433 5.908 1.00 0.00 C ATOM 1276 CD ARG A 87 14.206 -10.929 7.345 1.00 0.00 C ATOM 1277 NE ARG A 87 14.187 -12.387 7.420 1.00 0.00 N ATOM 1278 CZ ARG A 87 15.225 -13.153 7.104 1.00 0.00 C ATOM 1279 NH1 ARG A 87 16.359 -12.602 6.694 1.00 0.00 N ATOM 1280 NH2 ARG A 87 15.130 -14.473 7.199 1.00 0.00 N ATOM 0 H ARG A 87 10.365 -8.839 6.734 1.00 0.00 H new ATOM 0 HA ARG A 87 12.575 -8.616 6.732 1.00 0.00 H new ATOM 0 HB2 ARG A 87 12.211 -11.050 5.687 1.00 0.00 H new ATOM 0 HB3 ARG A 87 12.891 -10.297 4.259 1.00 0.00 H new ATOM 0 HG2 ARG A 87 14.791 -11.148 5.291 1.00 0.00 H new ATOM 0 HG3 ARG A 87 14.796 -9.492 5.863 1.00 0.00 H new ATOM 0 HD2 ARG A 87 15.073 -10.549 7.885 1.00 0.00 H new ATOM 0 HD3 ARG A 87 13.322 -10.529 7.841 1.00 0.00 H new ATOM 0 HE ARG A 87 13.329 -12.842 7.732 1.00 0.00 H new ATOM 0 HH11 ARG A 87 16.436 -11.588 6.621 1.00 0.00 H new ATOM 0 HH12 ARG A 87 17.155 -13.193 6.452 1.00 0.00 H new ATOM 0 HH21 ARG A 87 14.259 -14.900 7.515 1.00 0.00 H new ATOM 0 HH22 ARG A 87 15.928 -15.061 6.956 1.00 0.00 H new ATOM 1294 N VAL A 88 12.025 -6.634 4.907 1.00 0.00 N ATOM 1295 CA VAL A 88 12.318 -5.513 4.022 1.00 0.00 C ATOM 1296 C VAL A 88 13.154 -4.455 4.734 1.00 0.00 C ATOM 1297 O VAL A 88 12.650 -3.715 5.579 1.00 0.00 O ATOM 1298 CB VAL A 88 11.025 -4.861 3.496 1.00 0.00 C ATOM 1299 CG1 VAL A 88 10.233 -5.849 2.654 1.00 0.00 C ATOM 1300 CG2 VAL A 88 10.185 -4.337 4.650 1.00 0.00 C ATOM 0 H VAL A 88 11.346 -6.427 5.640 1.00 0.00 H new ATOM 0 HA VAL A 88 12.883 -5.913 3.180 1.00 0.00 H new ATOM 0 HB VAL A 88 11.296 -4.017 2.862 1.00 0.00 H new ATOM 0 HG11 VAL A 88 9.323 -5.371 2.291 1.00 0.00 H new ATOM 0 HG12 VAL A 88 10.837 -6.170 1.806 1.00 0.00 H new ATOM 0 HG13 VAL A 88 9.970 -6.715 3.261 1.00 0.00 H new ATOM 0 HG21 VAL A 88 9.276 -3.880 4.260 1.00 0.00 H new ATOM 0 HG22 VAL A 88 9.921 -5.162 5.312 1.00 0.00 H new ATOM 0 HG23 VAL A 88 10.755 -3.593 5.207 1.00 0.00 H new ATOM 1310 N TYR A 89 14.434 -4.389 4.386 1.00 0.00 N ATOM 1311 CA TYR A 89 15.342 -3.423 4.993 1.00 0.00 C ATOM 1312 C TYR A 89 15.256 -2.075 4.284 1.00 0.00 C ATOM 1313 O TYR A 89 16.251 -1.361 4.161 1.00 0.00 O ATOM 1314 CB TYR A 89 16.780 -3.945 4.948 1.00 0.00 C ATOM 1315 CG TYR A 89 17.082 -4.783 3.726 1.00 0.00 C ATOM 1316 CD1 TYR A 89 16.753 -6.132 3.686 1.00 0.00 C ATOM 1317 CD2 TYR A 89 17.695 -4.225 2.611 1.00 0.00 C ATOM 1318 CE1 TYR A 89 17.027 -6.901 2.572 1.00 0.00 C ATOM 1319 CE2 TYR A 89 17.973 -4.986 1.492 1.00 0.00 C ATOM 1320 CZ TYR A 89 17.637 -6.324 1.478 1.00 0.00 C ATOM 1321 OH TYR A 89 17.911 -7.087 0.365 1.00 0.00 O ATOM 0 H TYR A 89 14.866 -4.993 3.687 1.00 0.00 H new ATOM 0 HA TYR A 89 15.045 -3.286 6.033 1.00 0.00 H new ATOM 0 HB2 TYR A 89 17.466 -3.098 4.976 1.00 0.00 H new ATOM 0 HB3 TYR A 89 16.970 -4.539 5.842 1.00 0.00 H new ATOM 0 HD1 TYR A 89 16.275 -6.587 4.541 1.00 0.00 H new ATOM 0 HD2 TYR A 89 17.959 -3.178 2.619 1.00 0.00 H new ATOM 0 HE1 TYR A 89 16.765 -7.949 2.558 1.00 0.00 H new ATOM 0 HE2 TYR A 89 18.450 -4.536 0.634 1.00 0.00 H new ATOM 0 HH TYR A 89 18.341 -6.529 -0.316 1.00 0.00 H new ATOM 1331 N ALA A 90 14.058 -1.733 3.821 1.00 0.00 N ATOM 1332 CA ALA A 90 13.839 -0.470 3.128 1.00 0.00 C ATOM 1333 C ALA A 90 13.699 0.683 4.117 1.00 0.00 C ATOM 1334 O ALA A 90 13.376 0.474 5.287 1.00 0.00 O ATOM 1335 CB ALA A 90 12.605 -0.561 2.242 1.00 0.00 C ATOM 0 H ALA A 90 13.224 -2.313 3.914 1.00 0.00 H new ATOM 0 HA ALA A 90 14.709 -0.273 2.502 1.00 0.00 H new ATOM 0 HB1 ALA A 90 12.453 0.390 1.730 1.00 0.00 H new ATOM 0 HB2 ALA A 90 12.744 -1.352 1.505 1.00 0.00 H new ATOM 0 HB3 ALA A 90 11.732 -0.786 2.855 1.00 0.00 H new ATOM 1341 N LEU A 91 13.945 1.898 3.640 1.00 0.00 N ATOM 1342 CA LEU A 91 13.847 3.084 4.483 1.00 0.00 C ATOM 1343 C LEU A 91 12.434 3.659 4.453 1.00 0.00 C ATOM 1344 O LEU A 91 11.742 3.617 3.435 1.00 0.00 O ATOM 1345 CB LEU A 91 14.850 4.144 4.025 1.00 0.00 C ATOM 1346 CG LEU A 91 16.271 3.649 3.752 1.00 0.00 C ATOM 1347 CD1 LEU A 91 17.119 4.763 3.158 1.00 0.00 C ATOM 1348 CD2 LEU A 91 16.905 3.116 5.028 1.00 0.00 C ATOM 0 H LEU A 91 14.214 2.088 2.674 1.00 0.00 H new ATOM 0 HA LEU A 91 14.079 2.791 5.507 1.00 0.00 H new ATOM 0 HB2 LEU A 91 14.468 4.609 3.116 1.00 0.00 H new ATOM 0 HB3 LEU A 91 14.898 4.923 4.786 1.00 0.00 H new ATOM 0 HG LEU A 91 16.219 2.835 3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 91 18.127 4.393 2.970 1.00 0.00 H new ATOM 0 HD12 LEU A 91 16.675 5.098 2.220 1.00 0.00 H new ATOM 0 HD13 LEU A 91 17.164 5.598 3.857 1.00 0.00 H new ATOM 0 HD21 LEU A 91 17.916 2.768 4.814 1.00 0.00 H new ATOM 0 HD22 LEU A 91 16.944 3.910 5.774 1.00 0.00 H new ATOM 0 HD23 LEU A 91 16.310 2.287 5.411 1.00 0.00 H new ATOM 1360 N PRO A 92 11.994 4.210 5.593 1.00 0.00 N ATOM 1361 CA PRO A 92 10.661 4.806 5.722 1.00 0.00 C ATOM 1362 C PRO A 92 10.527 6.102 4.929 1.00 0.00 C ATOM 1363 O PRO A 92 9.432 6.647 4.796 1.00 0.00 O ATOM 1364 CB PRO A 92 10.540 5.083 7.223 1.00 0.00 C ATOM 1365 CG PRO A 92 11.945 5.225 7.697 1.00 0.00 C ATOM 1366 CD PRO A 92 12.765 4.295 6.845 1.00 0.00 C ATOM 0 HA PRO A 92 9.882 4.151 5.331 1.00 0.00 H new ATOM 0 HB2 PRO A 92 9.965 5.989 7.413 1.00 0.00 H new ATOM 0 HB3 PRO A 92 10.030 4.268 7.736 1.00 0.00 H new ATOM 0 HG2 PRO A 92 12.289 6.254 7.594 1.00 0.00 H new ATOM 0 HG3 PRO A 92 12.029 4.964 8.752 1.00 0.00 H new ATOM 0 HD2 PRO A 92 13.768 4.686 6.674 1.00 0.00 H new ATOM 0 HD3 PRO A 92 12.880 3.317 7.313 1.00 0.00 H new ATOM 1374 N GLU A 93 11.647 6.589 4.404 1.00 0.00 N ATOM 1375 CA GLU A 93 11.652 7.821 3.625 1.00 0.00 C ATOM 1376 C GLU A 93 11.448 7.527 2.141 1.00 0.00 C ATOM 1377 O GLU A 93 10.756 8.266 1.441 1.00 0.00 O ATOM 1378 CB GLU A 93 12.968 8.575 3.830 1.00 0.00 C ATOM 1379 CG GLU A 93 13.227 8.965 5.275 1.00 0.00 C ATOM 1380 CD GLU A 93 14.125 10.180 5.400 1.00 0.00 C ATOM 1381 OE1 GLU A 93 13.673 11.291 5.052 1.00 0.00 O ATOM 1382 OE2 GLU A 93 15.281 10.020 5.845 1.00 0.00 O ATOM 0 H GLU A 93 12.562 6.149 4.504 1.00 0.00 H new ATOM 0 HA GLU A 93 10.827 8.443 3.972 1.00 0.00 H new ATOM 0 HB2 GLU A 93 13.791 7.954 3.477 1.00 0.00 H new ATOM 0 HB3 GLU A 93 12.961 9.475 3.215 1.00 0.00 H new ATOM 0 HG2 GLU A 93 12.277 9.168 5.768 1.00 0.00 H new ATOM 0 HG3 GLU A 93 13.684 8.125 5.798 1.00 0.00 H new ATOM 1389 N ASP A 94 12.055 6.443 1.670 1.00 0.00 N ATOM 1390 CA ASP A 94 11.940 6.050 0.270 1.00 0.00 C ATOM 1391 C ASP A 94 10.481 6.052 -0.177 1.00 0.00 C ATOM 1392 O ASP A 94 10.151 6.550 -1.254 1.00 0.00 O ATOM 1393 CB ASP A 94 12.550 4.664 0.056 1.00 0.00 C ATOM 1394 CG ASP A 94 14.032 4.629 0.370 1.00 0.00 C ATOM 1395 OD1 ASP A 94 14.706 5.661 0.165 1.00 0.00 O ATOM 1396 OD2 ASP A 94 14.520 3.570 0.819 1.00 0.00 O ATOM 0 H ASP A 94 12.631 5.821 2.237 1.00 0.00 H new ATOM 0 HA ASP A 94 12.487 6.776 -0.332 1.00 0.00 H new ATOM 0 HB2 ASP A 94 12.031 3.941 0.685 1.00 0.00 H new ATOM 0 HB3 ASP A 94 12.393 4.357 -0.978 1.00 0.00 H new ATOM 1401 N LEU A 95 9.611 5.493 0.657 1.00 0.00 N ATOM 1402 CA LEU A 95 8.187 5.429 0.348 1.00 0.00 C ATOM 1403 C LEU A 95 7.601 6.828 0.189 1.00 0.00 C ATOM 1404 O LEU A 95 6.856 7.098 -0.753 1.00 0.00 O ATOM 1405 CB LEU A 95 7.440 4.672 1.448 1.00 0.00 C ATOM 1406 CG LEU A 95 7.807 3.198 1.616 1.00 0.00 C ATOM 1407 CD1 LEU A 95 7.227 2.648 2.910 1.00 0.00 C ATOM 1408 CD2 LEU A 95 7.320 2.387 0.424 1.00 0.00 C ATOM 0 H LEU A 95 9.867 5.077 1.553 1.00 0.00 H new ATOM 0 HA LEU A 95 8.068 4.896 -0.596 1.00 0.00 H new ATOM 0 HB2 LEU A 95 7.617 5.180 2.396 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.371 4.739 1.246 1.00 0.00 H new ATOM 0 HG LEU A 95 8.893 3.117 1.665 1.00 0.00 H new ATOM 0 HD11 LEU A 95 7.498 1.597 3.013 1.00 0.00 H new ATOM 0 HD12 LEU A 95 7.625 3.210 3.755 1.00 0.00 H new ATOM 0 HD13 LEU A 95 6.141 2.742 2.891 1.00 0.00 H new ATOM 0 HD21 LEU A 95 7.590 1.340 0.561 1.00 0.00 H new ATOM 0 HD22 LEU A 95 6.237 2.474 0.343 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.784 2.765 -0.487 1.00 0.00 H new ATOM 1420 N VAL A 96 7.945 7.717 1.116 1.00 0.00 N ATOM 1421 CA VAL A 96 7.455 9.090 1.078 1.00 0.00 C ATOM 1422 C VAL A 96 7.759 9.744 -0.266 1.00 0.00 C ATOM 1423 O VAL A 96 6.892 10.373 -0.870 1.00 0.00 O ATOM 1424 CB VAL A 96 8.078 9.939 2.202 1.00 0.00 C ATOM 1425 CG1 VAL A 96 7.592 11.378 2.115 1.00 0.00 C ATOM 1426 CG2 VAL A 96 7.755 9.340 3.562 1.00 0.00 C ATOM 0 H VAL A 96 8.561 7.511 1.902 1.00 0.00 H new ATOM 0 HA VAL A 96 6.375 9.046 1.222 1.00 0.00 H new ATOM 0 HB VAL A 96 9.161 9.938 2.078 1.00 0.00 H new ATOM 0 HG11 VAL A 96 8.042 11.963 2.917 1.00 0.00 H new ATOM 0 HG12 VAL A 96 7.878 11.801 1.152 1.00 0.00 H new ATOM 0 HG13 VAL A 96 6.507 11.402 2.214 1.00 0.00 H new ATOM 0 HG21 VAL A 96 8.203 9.952 4.345 1.00 0.00 H new ATOM 0 HG22 VAL A 96 6.674 9.310 3.699 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.156 8.328 3.619 1.00 0.00 H new ATOM 1436 N GLU A 97 8.996 9.590 -0.727 1.00 0.00 N ATOM 1437 CA GLU A 97 9.414 10.166 -1.999 1.00 0.00 C ATOM 1438 C GLU A 97 8.970 9.288 -3.166 1.00 0.00 C ATOM 1439 O GLU A 97 9.334 9.534 -4.316 1.00 0.00 O ATOM 1440 CB GLU A 97 10.934 10.343 -2.030 1.00 0.00 C ATOM 1441 CG GLU A 97 11.460 11.272 -0.948 1.00 0.00 C ATOM 1442 CD GLU A 97 12.969 11.413 -0.984 1.00 0.00 C ATOM 1443 OE1 GLU A 97 13.509 11.745 -2.060 1.00 0.00 O ATOM 1444 OE2 GLU A 97 13.610 11.190 0.064 1.00 0.00 O ATOM 0 H GLU A 97 9.726 9.071 -0.239 1.00 0.00 H new ATOM 0 HA GLU A 97 8.940 11.142 -2.099 1.00 0.00 H new ATOM 0 HB2 GLU A 97 11.407 9.367 -1.921 1.00 0.00 H new ATOM 0 HB3 GLU A 97 11.226 10.732 -3.005 1.00 0.00 H new ATOM 0 HG2 GLU A 97 11.004 12.255 -1.065 1.00 0.00 H new ATOM 0 HG3 GLU A 97 11.157 10.894 0.029 1.00 0.00 H new ATOM 1451 N VAL A 98 8.180 8.263 -2.861 1.00 0.00 N ATOM 1452 CA VAL A 98 7.685 7.349 -3.883 1.00 0.00 C ATOM 1453 C VAL A 98 8.792 6.963 -4.857 1.00 0.00 C ATOM 1454 O VAL A 98 8.596 6.972 -6.073 1.00 0.00 O ATOM 1455 CB VAL A 98 6.515 7.968 -4.671 1.00 0.00 C ATOM 1456 CG1 VAL A 98 5.933 6.955 -5.645 1.00 0.00 C ATOM 1457 CG2 VAL A 98 5.445 8.481 -3.719 1.00 0.00 C ATOM 0 H VAL A 98 7.869 8.045 -1.914 1.00 0.00 H new ATOM 0 HA VAL A 98 7.333 6.457 -3.366 1.00 0.00 H new ATOM 0 HB VAL A 98 6.893 8.813 -5.246 1.00 0.00 H new ATOM 0 HG11 VAL A 98 5.108 7.410 -6.193 1.00 0.00 H new ATOM 0 HG12 VAL A 98 6.705 6.640 -6.347 1.00 0.00 H new ATOM 0 HG13 VAL A 98 5.569 6.088 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 98 4.626 8.915 -4.292 1.00 0.00 H new ATOM 0 HG22 VAL A 98 5.068 7.655 -3.116 1.00 0.00 H new ATOM 0 HG23 VAL A 98 5.873 9.241 -3.066 1.00 0.00 H new ATOM 1467 N LYS A 99 9.957 6.623 -4.317 1.00 0.00 N ATOM 1468 CA LYS A 99 11.097 6.231 -5.137 1.00 0.00 C ATOM 1469 C LYS A 99 10.861 4.869 -5.781 1.00 0.00 C ATOM 1470 O LYS A 99 10.715 3.852 -5.102 1.00 0.00 O ATOM 1471 CB LYS A 99 12.372 6.194 -4.291 1.00 0.00 C ATOM 1472 CG LYS A 99 12.638 7.484 -3.535 1.00 0.00 C ATOM 1473 CD LYS A 99 14.001 7.466 -2.864 1.00 0.00 C ATOM 1474 CE LYS A 99 14.153 8.615 -1.879 1.00 0.00 C ATOM 1475 NZ LYS A 99 15.382 8.476 -1.050 1.00 0.00 N ATOM 0 H LYS A 99 10.137 6.611 -3.313 1.00 0.00 H new ATOM 0 HA LYS A 99 11.215 6.971 -5.928 1.00 0.00 H new ATOM 0 HB2 LYS A 99 12.301 5.373 -3.578 1.00 0.00 H new ATOM 0 HB3 LYS A 99 13.222 5.981 -4.939 1.00 0.00 H new ATOM 0 HG2 LYS A 99 12.581 8.328 -4.222 1.00 0.00 H new ATOM 0 HG3 LYS A 99 11.863 7.632 -2.783 1.00 0.00 H new ATOM 0 HD2 LYS A 99 14.139 6.518 -2.343 1.00 0.00 H new ATOM 0 HD3 LYS A 99 14.782 7.530 -3.622 1.00 0.00 H new ATOM 0 HE2 LYS A 99 14.187 9.558 -2.424 1.00 0.00 H new ATOM 0 HE3 LYS A 99 13.279 8.654 -1.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 15.423 9.251 -0.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 15.362 7.565 -0.549 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 16.221 8.516 -1.663 1.00 0.00 H new ATOM 1489 N PRO A 100 10.825 4.845 -7.121 1.00 0.00 N ATOM 1490 CA PRO A 100 10.609 3.613 -7.886 1.00 0.00 C ATOM 1491 C PRO A 100 11.800 2.664 -7.804 1.00 0.00 C ATOM 1492 O PRO A 100 11.798 1.594 -8.413 1.00 0.00 O ATOM 1493 CB PRO A 100 10.422 4.113 -9.320 1.00 0.00 C ATOM 1494 CG PRO A 100 11.142 5.416 -9.364 1.00 0.00 C ATOM 1495 CD PRO A 100 10.991 6.019 -7.994 1.00 0.00 C ATOM 0 HA PRO A 100 9.762 3.041 -7.506 1.00 0.00 H new ATOM 0 HB2 PRO A 100 10.835 3.408 -10.042 1.00 0.00 H new ATOM 0 HB3 PRO A 100 9.366 4.236 -9.562 1.00 0.00 H new ATOM 0 HG2 PRO A 100 12.193 5.273 -9.614 1.00 0.00 H new ATOM 0 HG3 PRO A 100 10.719 6.070 -10.127 1.00 0.00 H new ATOM 0 HD2 PRO A 100 11.866 6.607 -7.715 1.00 0.00 H new ATOM 0 HD3 PRO A 100 10.129 6.685 -7.941 1.00 0.00 H new ATOM 1503 N LYS A 101 12.817 3.062 -7.047 1.00 0.00 N ATOM 1504 CA LYS A 101 14.015 2.247 -6.883 1.00 0.00 C ATOM 1505 C LYS A 101 13.867 1.294 -5.701 1.00 0.00 C ATOM 1506 O LYS A 101 14.300 0.144 -5.761 1.00 0.00 O ATOM 1507 CB LYS A 101 15.241 3.140 -6.682 1.00 0.00 C ATOM 1508 CG LYS A 101 15.802 3.703 -7.976 1.00 0.00 C ATOM 1509 CD LYS A 101 16.813 4.806 -7.712 1.00 0.00 C ATOM 1510 CE LYS A 101 17.006 5.690 -8.935 1.00 0.00 C ATOM 1511 NZ LYS A 101 17.734 6.946 -8.603 1.00 0.00 N ATOM 0 H LYS A 101 12.835 3.945 -6.537 1.00 0.00 H new ATOM 0 HA LYS A 101 14.149 1.656 -7.789 1.00 0.00 H new ATOM 0 HB2 LYS A 101 14.975 3.965 -6.022 1.00 0.00 H new ATOM 0 HB3 LYS A 101 16.019 2.567 -6.178 1.00 0.00 H new ATOM 0 HG2 LYS A 101 16.275 2.904 -8.547 1.00 0.00 H new ATOM 0 HG3 LYS A 101 14.988 4.093 -8.587 1.00 0.00 H new ATOM 0 HD2 LYS A 101 16.478 5.414 -6.871 1.00 0.00 H new ATOM 0 HD3 LYS A 101 17.768 4.365 -7.426 1.00 0.00 H new ATOM 0 HE2 LYS A 101 17.559 5.140 -9.697 1.00 0.00 H new ATOM 0 HE3 LYS A 101 16.034 5.936 -9.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 17.845 7.520 -9.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 17.194 7.483 -7.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 18.672 6.712 -8.219 1.00 0.00 H new ATOM 1525 N MET A 102 13.252 1.781 -4.628 1.00 0.00 N ATOM 1526 CA MET A 102 13.046 0.971 -3.433 1.00 0.00 C ATOM 1527 C MET A 102 11.610 0.461 -3.363 1.00 0.00 C ATOM 1528 O MET A 102 11.373 -0.734 -3.191 1.00 0.00 O ATOM 1529 CB MET A 102 13.373 1.782 -2.178 1.00 0.00 C ATOM 1530 CG MET A 102 14.851 2.105 -2.031 1.00 0.00 C ATOM 1531 SD MET A 102 15.872 0.628 -1.867 1.00 0.00 S ATOM 1532 CE MET A 102 15.721 0.306 -0.111 1.00 0.00 C ATOM 0 H MET A 102 12.888 2.732 -4.562 1.00 0.00 H new ATOM 0 HA MET A 102 13.716 0.113 -3.487 1.00 0.00 H new ATOM 0 HB2 MET A 102 12.806 2.713 -2.199 1.00 0.00 H new ATOM 0 HB3 MET A 102 13.042 1.227 -1.300 1.00 0.00 H new ATOM 0 HG2 MET A 102 15.182 2.676 -2.898 1.00 0.00 H new ATOM 0 HG3 MET A 102 14.995 2.740 -1.157 1.00 0.00 H new ATOM 0 HE1 MET A 102 16.299 -0.581 0.147 1.00 0.00 H new ATOM 0 HE2 MET A 102 16.098 1.161 0.450 1.00 0.00 H new ATOM 0 HE3 MET A 102 14.673 0.142 0.140 1.00 0.00 H new ATOM 1542 N VAL A 103 10.655 1.376 -3.498 1.00 0.00 N ATOM 1543 CA VAL A 103 9.242 1.018 -3.451 1.00 0.00 C ATOM 1544 C VAL A 103 8.975 -0.271 -4.220 1.00 0.00 C ATOM 1545 O VAL A 103 8.125 -1.072 -3.832 1.00 0.00 O ATOM 1546 CB VAL A 103 8.360 2.140 -4.030 1.00 0.00 C ATOM 1547 CG1 VAL A 103 6.896 1.726 -4.023 1.00 0.00 C ATOM 1548 CG2 VAL A 103 8.561 3.431 -3.251 1.00 0.00 C ATOM 0 H VAL A 103 10.834 2.370 -3.641 1.00 0.00 H new ATOM 0 HA VAL A 103 8.988 0.870 -2.401 1.00 0.00 H new ATOM 0 HB VAL A 103 8.658 2.316 -5.064 1.00 0.00 H new ATOM 0 HG11 VAL A 103 6.288 2.531 -4.436 1.00 0.00 H new ATOM 0 HG12 VAL A 103 6.769 0.829 -4.628 1.00 0.00 H new ATOM 0 HG13 VAL A 103 6.581 1.521 -3.000 1.00 0.00 H new ATOM 0 HG21 VAL A 103 7.930 4.213 -3.674 1.00 0.00 H new ATOM 0 HG22 VAL A 103 8.291 3.272 -2.207 1.00 0.00 H new ATOM 0 HG23 VAL A 103 9.606 3.735 -3.313 1.00 0.00 H new ATOM 1558 N MET A 104 9.708 -0.464 -5.311 1.00 0.00 N ATOM 1559 CA MET A 104 9.552 -1.658 -6.135 1.00 0.00 C ATOM 1560 C MET A 104 9.740 -2.922 -5.301 1.00 0.00 C ATOM 1561 O MET A 104 8.816 -3.723 -5.152 1.00 0.00 O ATOM 1562 CB MET A 104 10.554 -1.642 -7.290 1.00 0.00 C ATOM 1563 CG MET A 104 10.477 -2.872 -8.179 1.00 0.00 C ATOM 1564 SD MET A 104 11.576 -4.193 -7.633 1.00 0.00 S ATOM 1565 CE MET A 104 10.388 -5.440 -7.141 1.00 0.00 C ATOM 0 H MET A 104 10.416 0.190 -5.645 1.00 0.00 H new ATOM 0 HA MET A 104 8.541 -1.659 -6.542 1.00 0.00 H new ATOM 0 HB2 MET A 104 10.381 -0.754 -7.897 1.00 0.00 H new ATOM 0 HB3 MET A 104 11.562 -1.560 -6.884 1.00 0.00 H new ATOM 0 HG2 MET A 104 9.451 -3.241 -8.194 1.00 0.00 H new ATOM 0 HG3 MET A 104 10.731 -2.593 -9.202 1.00 0.00 H new ATOM 0 HE1 MET A 104 10.778 -5.999 -6.291 1.00 0.00 H new ATOM 0 HE2 MET A 104 9.451 -4.959 -6.860 1.00 0.00 H new ATOM 0 HE3 MET A 104 10.210 -6.122 -7.973 1.00 0.00 H new ATOM 1575 N THR A 105 10.941 -3.095 -4.760 1.00 0.00 N ATOM 1576 CA THR A 105 11.250 -4.262 -3.943 1.00 0.00 C ATOM 1577 C THR A 105 10.375 -4.307 -2.695 1.00 0.00 C ATOM 1578 O THR A 105 10.014 -5.382 -2.217 1.00 0.00 O ATOM 1579 CB THR A 105 12.731 -4.273 -3.517 1.00 0.00 C ATOM 1580 OG1 THR A 105 12.977 -5.371 -2.631 1.00 0.00 O ATOM 1581 CG2 THR A 105 13.108 -2.968 -2.833 1.00 0.00 C ATOM 0 H THR A 105 11.716 -2.442 -4.873 1.00 0.00 H new ATOM 0 HA THR A 105 11.049 -5.140 -4.557 1.00 0.00 H new ATOM 0 HB THR A 105 13.343 -4.384 -4.412 1.00 0.00 H new ATOM 0 HG1 THR A 105 13.920 -5.372 -2.366 1.00 0.00 H new ATOM 0 HG21 THR A 105 14.158 -3.000 -2.542 1.00 0.00 H new ATOM 0 HG22 THR A 105 12.947 -2.137 -3.520 1.00 0.00 H new ATOM 0 HG23 THR A 105 12.489 -2.830 -1.946 1.00 0.00 H new ATOM 1589 N VAL A 106 10.036 -3.133 -2.173 1.00 0.00 N ATOM 1590 CA VAL A 106 9.200 -3.039 -0.982 1.00 0.00 C ATOM 1591 C VAL A 106 7.930 -3.868 -1.134 1.00 0.00 C ATOM 1592 O VAL A 106 7.494 -4.534 -0.195 1.00 0.00 O ATOM 1593 CB VAL A 106 8.813 -1.578 -0.681 1.00 0.00 C ATOM 1594 CG1 VAL A 106 7.831 -1.514 0.478 1.00 0.00 C ATOM 1595 CG2 VAL A 106 10.054 -0.749 -0.386 1.00 0.00 C ATOM 0 H VAL A 106 10.327 -2.234 -2.556 1.00 0.00 H new ATOM 0 HA VAL A 106 9.788 -3.430 -0.152 1.00 0.00 H new ATOM 0 HB VAL A 106 8.326 -1.160 -1.562 1.00 0.00 H new ATOM 0 HG11 VAL A 106 7.569 -0.475 0.676 1.00 0.00 H new ATOM 0 HG12 VAL A 106 6.930 -2.073 0.223 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.288 -1.949 1.367 1.00 0.00 H new ATOM 0 HG21 VAL A 106 9.763 0.280 -0.176 1.00 0.00 H new ATOM 0 HG22 VAL A 106 10.571 -1.164 0.479 1.00 0.00 H new ATOM 0 HG23 VAL A 106 10.718 -0.769 -1.250 1.00 0.00 H new ATOM 1605 N PHE A 107 7.341 -3.824 -2.325 1.00 0.00 N ATOM 1606 CA PHE A 107 6.119 -4.571 -2.601 1.00 0.00 C ATOM 1607 C PHE A 107 6.430 -6.039 -2.875 1.00 0.00 C ATOM 1608 O PHE A 107 5.910 -6.931 -2.205 1.00 0.00 O ATOM 1609 CB PHE A 107 5.383 -3.962 -3.796 1.00 0.00 C ATOM 1610 CG PHE A 107 4.397 -2.896 -3.414 1.00 0.00 C ATOM 1611 CD1 PHE A 107 3.203 -3.229 -2.794 1.00 0.00 C ATOM 1612 CD2 PHE A 107 4.663 -1.562 -3.674 1.00 0.00 C ATOM 1613 CE1 PHE A 107 2.293 -2.251 -2.440 1.00 0.00 C ATOM 1614 CE2 PHE A 107 3.757 -0.579 -3.322 1.00 0.00 C ATOM 1615 CZ PHE A 107 2.570 -0.924 -2.705 1.00 0.00 C ATOM 0 H PHE A 107 7.690 -3.279 -3.114 1.00 0.00 H new ATOM 0 HA PHE A 107 5.479 -4.511 -1.721 1.00 0.00 H new ATOM 0 HB2 PHE A 107 6.114 -3.539 -4.485 1.00 0.00 H new ATOM 0 HB3 PHE A 107 4.860 -4.754 -4.332 1.00 0.00 H new ATOM 0 HD1 PHE A 107 2.981 -4.265 -2.585 1.00 0.00 H new ATOM 0 HD2 PHE A 107 5.589 -1.287 -4.157 1.00 0.00 H new ATOM 0 HE1 PHE A 107 1.366 -2.524 -1.957 1.00 0.00 H new ATOM 0 HE2 PHE A 107 3.977 0.458 -3.529 1.00 0.00 H new ATOM 0 HZ PHE A 107 1.860 -0.158 -2.430 1.00 0.00 H new ATOM 1625 N ALA A 108 7.282 -6.283 -3.865 1.00 0.00 N ATOM 1626 CA ALA A 108 7.664 -7.642 -4.228 1.00 0.00 C ATOM 1627 C ALA A 108 7.923 -8.489 -2.986 1.00 0.00 C ATOM 1628 O ALA A 108 7.581 -9.672 -2.948 1.00 0.00 O ATOM 1629 CB ALA A 108 8.895 -7.623 -5.122 1.00 0.00 C ATOM 0 H ALA A 108 7.721 -5.557 -4.430 1.00 0.00 H new ATOM 0 HA ALA A 108 6.837 -8.092 -4.777 1.00 0.00 H new ATOM 0 HB1 ALA A 108 9.169 -8.645 -5.385 1.00 0.00 H new ATOM 0 HB2 ALA A 108 8.677 -7.060 -6.030 1.00 0.00 H new ATOM 0 HB3 ALA A 108 9.722 -7.150 -4.592 1.00 0.00 H new ATOM 1635 N CYS A 109 8.528 -7.878 -1.974 1.00 0.00 N ATOM 1636 CA CYS A 109 8.834 -8.577 -0.731 1.00 0.00 C ATOM 1637 C CYS A 109 7.560 -9.098 -0.073 1.00 0.00 C ATOM 1638 O CYS A 109 7.499 -10.249 0.362 1.00 0.00 O ATOM 1639 CB CYS A 109 9.577 -7.649 0.231 1.00 0.00 C ATOM 1640 SG CYS A 109 11.362 -7.573 -0.047 1.00 0.00 S ATOM 0 H CYS A 109 8.817 -6.900 -1.990 1.00 0.00 H new ATOM 0 HA CYS A 109 9.473 -9.428 -0.969 1.00 0.00 H new ATOM 0 HB2 CYS A 109 9.163 -6.645 0.142 1.00 0.00 H new ATOM 0 HB3 CYS A 109 9.393 -7.980 1.253 1.00 0.00 H new ATOM 0 HG CYS A 109 11.618 -6.714 -0.988 1.00 0.00 H new ATOM 1646 N LEU A 110 6.546 -8.243 -0.001 1.00 0.00 N ATOM 1647 CA LEU A 110 5.273 -8.616 0.606 1.00 0.00 C ATOM 1648 C LEU A 110 4.650 -9.804 -0.121 1.00 0.00 C ATOM 1649 O LEU A 110 4.187 -10.755 0.508 1.00 0.00 O ATOM 1650 CB LEU A 110 4.309 -7.429 0.586 1.00 0.00 C ATOM 1651 CG LEU A 110 4.786 -6.164 1.302 1.00 0.00 C ATOM 1652 CD1 LEU A 110 4.102 -4.934 0.725 1.00 0.00 C ATOM 1653 CD2 LEU A 110 4.528 -6.268 2.798 1.00 0.00 C ATOM 0 H LEU A 110 6.580 -7.287 -0.355 1.00 0.00 H new ATOM 0 HA LEU A 110 5.463 -8.905 1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 110 4.097 -7.176 -0.453 1.00 0.00 H new ATOM 0 HB3 LEU A 110 3.367 -7.744 1.036 1.00 0.00 H new ATOM 0 HG LEU A 110 5.860 -6.064 1.145 1.00 0.00 H new ATOM 0 HD11 LEU A 110 4.454 -4.044 1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 110 4.338 -4.850 -0.336 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.023 -5.025 0.850 1.00 0.00 H new ATOM 0 HD21 LEU A 110 4.874 -5.359 3.291 1.00 0.00 H new ATOM 0 HD22 LEU A 110 3.460 -6.393 2.975 1.00 0.00 H new ATOM 0 HD23 LEU A 110 5.065 -7.126 3.201 1.00 0.00 H new ATOM 1665 N MET A 111 4.644 -9.741 -1.448 1.00 0.00 N ATOM 1666 CA MET A 111 4.081 -10.814 -2.261 1.00 0.00 C ATOM 1667 C MET A 111 4.650 -12.167 -1.844 1.00 0.00 C ATOM 1668 O MET A 111 3.908 -13.127 -1.644 1.00 0.00 O ATOM 1669 CB MET A 111 4.365 -10.563 -3.743 1.00 0.00 C ATOM 1670 CG MET A 111 3.915 -11.697 -4.649 1.00 0.00 C ATOM 1671 SD MET A 111 4.594 -11.568 -6.314 1.00 0.00 S ATOM 1672 CE MET A 111 3.883 -10.014 -6.850 1.00 0.00 C ATOM 0 H MET A 111 5.022 -8.959 -1.983 1.00 0.00 H new ATOM 0 HA MET A 111 3.003 -10.829 -2.103 1.00 0.00 H new ATOM 0 HB2 MET A 111 3.865 -9.644 -4.050 1.00 0.00 H new ATOM 0 HB3 MET A 111 5.435 -10.404 -3.878 1.00 0.00 H new ATOM 0 HG2 MET A 111 4.217 -12.648 -4.211 1.00 0.00 H new ATOM 0 HG3 MET A 111 2.826 -11.702 -4.704 1.00 0.00 H new ATOM 0 HE1 MET A 111 3.544 -10.106 -7.882 1.00 0.00 H new ATOM 0 HE2 MET A 111 3.037 -9.761 -6.211 1.00 0.00 H new ATOM 0 HE3 MET A 111 4.635 -9.228 -6.784 1.00 0.00 H new ATOM 1682 N GLY A 112 5.971 -12.235 -1.716 1.00 0.00 N ATOM 1683 CA GLY A 112 6.616 -13.474 -1.324 1.00 0.00 C ATOM 1684 C GLY A 112 5.830 -14.229 -0.270 1.00 0.00 C ATOM 1685 O GLY A 112 5.230 -15.265 -0.557 1.00 0.00 O ATOM 0 H GLY A 112 6.607 -11.454 -1.877 1.00 0.00 H new ATOM 0 HA2 GLY A 112 6.742 -14.108 -2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 112 7.613 -13.256 -0.942 1.00 0.00 H new ATOM 1689 N ARG A 113 5.834 -13.710 0.953 1.00 0.00 N ATOM 1690 CA ARG A 113 5.119 -14.343 2.054 1.00 0.00 C ATOM 1691 C ARG A 113 3.619 -14.385 1.776 1.00 0.00 C ATOM 1692 O ARG A 113 2.970 -15.411 1.969 1.00 0.00 O ATOM 1693 CB ARG A 113 5.385 -13.594 3.361 1.00 0.00 C ATOM 1694 CG ARG A 113 5.294 -14.474 4.597 1.00 0.00 C ATOM 1695 CD ARG A 113 3.849 -14.778 4.959 1.00 0.00 C ATOM 1696 NE ARG A 113 3.740 -15.482 6.234 1.00 0.00 N ATOM 1697 CZ ARG A 113 2.639 -15.492 6.977 1.00 0.00 C ATOM 1698 NH1 ARG A 113 1.557 -14.841 6.573 1.00 0.00 N ATOM 1699 NH2 ARG A 113 2.618 -16.156 8.126 1.00 0.00 N ATOM 0 H ARG A 113 6.325 -12.852 1.206 1.00 0.00 H new ATOM 0 HA ARG A 113 5.482 -15.366 2.149 1.00 0.00 H new ATOM 0 HB2 ARG A 113 6.377 -13.145 3.317 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.670 -12.777 3.454 1.00 0.00 H new ATOM 0 HG2 ARG A 113 5.830 -15.407 4.421 1.00 0.00 H new ATOM 0 HG3 ARG A 113 5.784 -13.978 5.435 1.00 0.00 H new ATOM 0 HD2 ARG A 113 3.285 -13.847 5.010 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.398 -15.382 4.172 1.00 0.00 H new ATOM 0 HE ARG A 113 4.554 -15.994 6.573 1.00 0.00 H new ATOM 0 HH11 ARG A 113 1.569 -14.331 5.690 1.00 0.00 H new ATOM 0 HH12 ARG A 113 0.713 -14.850 7.145 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.448 -16.659 8.439 1.00 0.00 H new ATOM 0 HH22 ARG A 113 1.772 -16.163 8.696 1.00 0.00 H new ATOM 1713 N GLY A 114 3.076 -13.260 1.321 1.00 0.00 N ATOM 1714 CA GLY A 114 1.657 -13.189 1.024 1.00 0.00 C ATOM 1715 C GLY A 114 1.155 -14.418 0.292 1.00 0.00 C ATOM 1716 O GLY A 114 0.276 -15.125 0.784 1.00 0.00 O ATOM 0 H GLY A 114 3.593 -12.397 1.153 1.00 0.00 H new ATOM 0 HA2 GLY A 114 1.100 -13.071 1.953 1.00 0.00 H new ATOM 0 HA3 GLY A 114 1.459 -12.304 0.419 1.00 0.00 H new ATOM 1720 N MET A 115 1.715 -14.673 -0.886 1.00 0.00 N ATOM 1721 CA MET A 115 1.318 -15.826 -1.686 1.00 0.00 C ATOM 1722 C MET A 115 1.212 -17.078 -0.821 1.00 0.00 C ATOM 1723 O MET A 115 2.218 -17.712 -0.502 1.00 0.00 O ATOM 1724 CB MET A 115 2.321 -16.058 -2.818 1.00 0.00 C ATOM 1725 CG MET A 115 2.072 -15.186 -4.038 1.00 0.00 C ATOM 1726 SD MET A 115 3.233 -15.519 -5.377 1.00 0.00 S ATOM 1727 CE MET A 115 2.405 -14.719 -6.750 1.00 0.00 C ATOM 0 H MET A 115 2.444 -14.098 -1.307 1.00 0.00 H new ATOM 0 HA MET A 115 0.338 -15.618 -2.115 1.00 0.00 H new ATOM 0 HB2 MET A 115 3.328 -15.868 -2.445 1.00 0.00 H new ATOM 0 HB3 MET A 115 2.284 -17.106 -3.117 1.00 0.00 H new ATOM 0 HG2 MET A 115 1.055 -15.349 -4.395 1.00 0.00 H new ATOM 0 HG3 MET A 115 2.145 -14.137 -3.751 1.00 0.00 H new ATOM 0 HE1 MET A 115 3.002 -14.838 -7.654 1.00 0.00 H new ATOM 0 HE2 MET A 115 1.426 -15.174 -6.899 1.00 0.00 H new ATOM 0 HE3 MET A 115 2.283 -13.658 -6.533 1.00 0.00 H new ATOM 1737 N LYS A 116 -0.013 -17.429 -0.444 1.00 0.00 N ATOM 1738 CA LYS A 116 -0.252 -18.605 0.384 1.00 0.00 C ATOM 1739 C LYS A 116 -0.221 -19.877 -0.457 1.00 0.00 C ATOM 1740 O LYS A 116 -0.914 -19.980 -1.470 1.00 0.00 O ATOM 1741 CB LYS A 116 -1.599 -18.486 1.099 1.00 0.00 C ATOM 1742 CG LYS A 116 -1.832 -19.566 2.142 1.00 0.00 C ATOM 1743 CD LYS A 116 -1.074 -19.274 3.426 1.00 0.00 C ATOM 1744 CE LYS A 116 -1.192 -20.423 4.416 1.00 0.00 C ATOM 1745 NZ LYS A 116 -0.473 -20.134 5.688 1.00 0.00 N ATOM 0 H LYS A 116 -0.856 -16.915 -0.699 1.00 0.00 H new ATOM 0 HA LYS A 116 0.543 -18.663 1.128 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -1.661 -17.509 1.579 1.00 0.00 H new ATOM 0 HB3 LYS A 116 -2.398 -18.529 0.359 1.00 0.00 H new ATOM 0 HG2 LYS A 116 -2.898 -19.642 2.357 1.00 0.00 H new ATOM 0 HG3 LYS A 116 -1.518 -20.531 1.744 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -0.023 -19.096 3.197 1.00 0.00 H new ATOM 0 HD3 LYS A 116 -1.461 -18.361 3.879 1.00 0.00 H new ATOM 0 HE2 LYS A 116 -2.244 -20.613 4.628 1.00 0.00 H new ATOM 0 HE3 LYS A 116 -0.788 -21.331 3.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 -1.059 -20.432 6.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 0.427 -20.655 5.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.284 -19.114 5.756 1.00 0.00 H new ATOM 1759 N ARG A 117 0.584 -20.844 -0.030 1.00 0.00 N ATOM 1760 CA ARG A 117 0.704 -22.110 -0.744 1.00 0.00 C ATOM 1761 C ARG A 117 1.583 -23.089 0.029 1.00 0.00 C ATOM 1762 O ARG A 117 2.779 -22.859 0.207 1.00 0.00 O ATOM 1763 CB ARG A 117 1.285 -21.879 -2.140 1.00 0.00 C ATOM 1764 CG ARG A 117 0.943 -22.979 -3.132 1.00 0.00 C ATOM 1765 CD ARG A 117 -0.533 -22.957 -3.500 1.00 0.00 C ATOM 1766 NE ARG A 117 -0.923 -21.694 -4.122 1.00 0.00 N ATOM 1767 CZ ARG A 117 -0.641 -21.376 -5.380 1.00 0.00 C ATOM 1768 NH1 ARG A 117 0.029 -22.224 -6.148 1.00 0.00 N ATOM 1769 NH2 ARG A 117 -1.030 -20.207 -5.874 1.00 0.00 N ATOM 0 H ARG A 117 1.163 -20.775 0.807 1.00 0.00 H new ATOM 0 HA ARG A 117 -0.293 -22.541 -0.839 1.00 0.00 H new ATOM 0 HB2 ARG A 117 0.917 -20.928 -2.524 1.00 0.00 H new ATOM 0 HB3 ARG A 117 2.369 -21.794 -2.064 1.00 0.00 H new ATOM 0 HG2 ARG A 117 1.546 -22.859 -4.032 1.00 0.00 H new ATOM 0 HG3 ARG A 117 1.198 -23.949 -2.704 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -0.749 -23.779 -4.182 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -1.132 -23.120 -2.604 1.00 0.00 H new ATOM 0 HE ARG A 117 -1.441 -21.019 -3.559 1.00 0.00 H new ATOM 0 HH11 ARG A 117 0.329 -23.124 -5.773 1.00 0.00 H new ATOM 0 HH12 ARG A 117 0.244 -21.977 -7.114 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -1.546 -19.552 -5.287 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -0.813 -19.964 -6.841 1.00 0.00 H new ATOM 1783 N VAL A 118 0.981 -24.182 0.486 1.00 0.00 N ATOM 1784 CA VAL A 118 1.708 -25.197 1.240 1.00 0.00 C ATOM 1785 C VAL A 118 2.789 -24.566 2.110 1.00 0.00 C ATOM 1786 O VAL A 118 3.931 -25.026 2.130 1.00 0.00 O ATOM 1787 CB VAL A 118 2.358 -26.233 0.303 1.00 0.00 C ATOM 1788 CG1 VAL A 118 2.661 -27.519 1.058 1.00 0.00 C ATOM 1789 CG2 VAL A 118 1.459 -26.507 -0.893 1.00 0.00 C ATOM 0 H VAL A 118 -0.008 -24.388 0.347 1.00 0.00 H new ATOM 0 HA VAL A 118 0.981 -25.700 1.877 1.00 0.00 H new ATOM 0 HB VAL A 118 3.299 -25.825 -0.065 1.00 0.00 H new ATOM 0 HG11 VAL A 118 3.120 -28.239 0.381 1.00 0.00 H new ATOM 0 HG12 VAL A 118 3.346 -27.306 1.879 1.00 0.00 H new ATOM 0 HG13 VAL A 118 1.735 -27.934 1.456 1.00 0.00 H new ATOM 0 HG21 VAL A 118 1.934 -27.241 -1.544 1.00 0.00 H new ATOM 0 HG22 VAL A 118 0.501 -26.895 -0.547 1.00 0.00 H new ATOM 0 HG23 VAL A 118 1.297 -25.582 -1.446 1.00 0.00 H new ATOM 1799 N SER A 119 2.422 -23.509 2.827 1.00 0.00 N ATOM 1800 CA SER A 119 3.361 -22.812 3.698 1.00 0.00 C ATOM 1801 C SER A 119 2.820 -22.723 5.121 1.00 0.00 C ATOM 1802 O SER A 119 2.112 -21.780 5.470 1.00 0.00 O ATOM 1803 CB SER A 119 3.644 -21.409 3.158 1.00 0.00 C ATOM 1804 OG SER A 119 4.467 -21.461 2.006 1.00 0.00 O ATOM 0 H SER A 119 1.481 -23.116 2.822 1.00 0.00 H new ATOM 0 HA SER A 119 4.291 -23.380 3.718 1.00 0.00 H new ATOM 0 HB2 SER A 119 2.704 -20.913 2.915 1.00 0.00 H new ATOM 0 HB3 SER A 119 4.130 -20.811 3.929 1.00 0.00 H new ATOM 0 HG SER A 119 3.995 -21.932 1.288 1.00 0.00 H new ATOM 1810 N GLY A 120 3.159 -23.714 5.940 1.00 0.00 N ATOM 1811 CA GLY A 120 2.699 -23.730 7.316 1.00 0.00 C ATOM 1812 C GLY A 120 3.338 -24.839 8.128 1.00 0.00 C ATOM 1813 O GLY A 120 4.440 -24.695 8.657 1.00 0.00 O ATOM 0 H GLY A 120 3.744 -24.506 5.675 1.00 0.00 H new ATOM 0 HA2 GLY A 120 2.921 -22.769 7.781 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.616 -23.850 7.332 1.00 0.00 H new ATOM 1817 N PRO A 121 2.637 -25.977 8.237 1.00 0.00 N ATOM 1818 CA PRO A 121 3.122 -27.137 8.991 1.00 0.00 C ATOM 1819 C PRO A 121 4.306 -27.817 8.310 1.00 0.00 C ATOM 1820 O PRO A 121 4.530 -27.641 7.113 1.00 0.00 O ATOM 1821 CB PRO A 121 1.912 -28.074 9.019 1.00 0.00 C ATOM 1822 CG PRO A 121 1.114 -27.698 7.818 1.00 0.00 C ATOM 1823 CD PRO A 121 1.316 -26.220 7.633 1.00 0.00 C ATOM 0 HA PRO A 121 3.484 -26.857 9.980 1.00 0.00 H new ATOM 0 HB2 PRO A 121 2.219 -29.119 8.979 1.00 0.00 H new ATOM 0 HB3 PRO A 121 1.334 -27.947 9.934 1.00 0.00 H new ATOM 0 HG2 PRO A 121 1.447 -28.250 6.939 1.00 0.00 H new ATOM 0 HG3 PRO A 121 0.059 -27.933 7.961 1.00 0.00 H new ATOM 0 HD2 PRO A 121 1.299 -25.941 6.579 1.00 0.00 H new ATOM 0 HD3 PRO A 121 0.535 -25.643 8.129 1.00 0.00 H new ATOM 1831 N SER A 122 5.060 -28.593 9.081 1.00 0.00 N ATOM 1832 CA SER A 122 6.223 -29.297 8.553 1.00 0.00 C ATOM 1833 C SER A 122 5.797 -30.414 7.605 1.00 0.00 C ATOM 1834 O SER A 122 5.607 -31.557 8.021 1.00 0.00 O ATOM 1835 CB SER A 122 7.060 -29.873 9.696 1.00 0.00 C ATOM 1836 OG SER A 122 8.406 -30.064 9.297 1.00 0.00 O ATOM 0 H SER A 122 4.887 -28.750 10.074 1.00 0.00 H new ATOM 0 HA SER A 122 6.828 -28.582 7.995 1.00 0.00 H new ATOM 0 HB2 SER A 122 7.023 -29.200 10.553 1.00 0.00 H new ATOM 0 HB3 SER A 122 6.635 -30.823 10.019 1.00 0.00 H new ATOM 0 HG SER A 122 8.920 -30.431 10.046 1.00 0.00 H new ATOM 1842 N SER A 123 5.651 -30.075 6.328 1.00 0.00 N ATOM 1843 CA SER A 123 5.244 -31.048 5.321 1.00 0.00 C ATOM 1844 C SER A 123 6.458 -31.764 4.736 1.00 0.00 C ATOM 1845 O SER A 123 7.445 -31.133 4.361 1.00 0.00 O ATOM 1846 CB SER A 123 4.458 -30.359 4.204 1.00 0.00 C ATOM 1847 OG SER A 123 3.123 -30.102 4.604 1.00 0.00 O ATOM 0 H SER A 123 5.808 -29.134 5.966 1.00 0.00 H new ATOM 0 HA SER A 123 4.605 -31.787 5.803 1.00 0.00 H new ATOM 0 HB2 SER A 123 4.947 -29.423 3.935 1.00 0.00 H new ATOM 0 HB3 SER A 123 4.460 -30.987 3.313 1.00 0.00 H new ATOM 0 HG SER A 123 2.642 -29.660 3.874 1.00 0.00 H new ATOM 1853 N GLY A 124 6.377 -33.090 4.663 1.00 0.00 N ATOM 1854 CA GLY A 124 7.474 -33.871 4.124 1.00 0.00 C ATOM 1855 C GLY A 124 6.996 -35.065 3.321 1.00 0.00 C ATOM 1856 O GLY A 124 6.420 -36.002 3.874 1.00 0.00 O ATOM 0 H GLY A 124 5.571 -33.636 4.968 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.092 -33.235 3.490 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.106 -34.217 4.942 1.00 0.00 H new TER 1860 GLY A 124