USER MOD reduce.3.24.130724 H: found=0, std=0, add=1138, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 1013 hydrogens (79 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 52 THR OG1 : rot 143:sc= 0.054 USER MOD Set 1.2: A 132 SER OG : rot 180:sc= -0.673 USER MOD Set 2.1: A 98 THR OG1 : rot -60:sc= 0.465 USER MOD Set 2.2: A 129 HIS :FLIP no HD1:sc= -1.72! F(o=-2.2,f=-1.3!) USER MOD Set 3.1: A 80 SER OG : rot -92:sc= 0.691 USER MOD Set 3.2: A 81 GLN :FLIP amide:sc= 0.681 F(o=-0.66,f=1.4) USER MOD Set 4.1: A 55 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 68 THR OG1 : rot 134:sc= 1.73 USER MOD Set 5.1: A 4 LYS NZ :NH3+ -125:sc= 0.35 (180deg=0) USER MOD Set 5.2: A 8 ASN : amide:sc= -5.34! C(o=-5!,f=-30!) USER MOD Single : A 1 PHE N :NH3+ 168:sc= 0.722 (180deg=0.432) USER MOD Single : A 2 ASN : amide:sc= -0.364 X(o=-0.36,f=-0.0021) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 145:sc= -0.591 (180deg=-1.84!) USER MOD Single : A 17 THR OG1 : rot 79:sc= 0.623! USER MOD Single : A 19 ASN : amide:sc= -12.2! C(o=-12!,f=-13!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= 1.11 K(o=1.1,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.88 K(o=-1.9,f=-2.5!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 137:sc= -0.601 (180deg=-0.992) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.579 F(o=-2.1,f=-0.58) USER MOD Single : A 39 SER OG : rot -4:sc= 0.687! USER MOD Single : A 41 ASN :FLIP amide:sc= -0.878 F(o=-4.8!,f=-0.88) USER MOD Single : A 44 LYS NZ :NH3+ 172:sc= -2.68! (180deg=-2.84!) USER MOD Single : A 47 LYS NZ :NH3+ 159:sc= -0.0352 (180deg=-0.321) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 180:sc= -0.319 USER MOD Single : A 56 THR OG1 : rot 158:sc= -1.2 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 19:sc= 0.393 USER MOD Single : A 73 LYS NZ :NH3+ 138:sc= -0.288 (180deg=-1.48!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 GLN :FLIP amide:sc= -0.0275 F(o=-2!,f=-0.027) USER MOD Single : A 87 THR OG1 : rot -68:sc= 0.347 USER MOD Single : A 91 GLN : amide:sc= 0.188 K(o=0.19,f=-0.8) USER MOD Single : A 93 MET CE :methyl -167:sc= -1.55 (180deg=-2.14) USER MOD Single : A 97 SER OG : rot -65:sc= 0.847 USER MOD Single : A 102 TYR OH : rot -52:sc= 0.0249 USER MOD Single : A 105 SER OG : rot 180:sc= -0.013 USER MOD Single : A 109 TYR OH : rot 168:sc= -4.06! USER MOD Single : A 113 SER OG : rot 140:sc= -3.29! USER MOD Single : A 121 ASN :FLIP amide:sc= -0.146 F(o=-1.6!,f=-0.15) USER MOD Single : A 123 THR OG1 : rot 160:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -114:sc= -0.427 (180deg=-3.7!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 LYS NZ :NH3+ -149:sc= -0.4 (180deg=-1.58!) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 RAP O10 : rot -20:sc= -2.29! USER MOD Single : A 138 RAP O13 : rot 36:sc= 0.0137 USER MOD Single : A 138 RAP O6 : rot -3:sc= 0.0401 USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 1 93.930 26.522 2.867 1.00 1.00 N ATOM 2 CA PHE A 1 95.249 27.184 2.653 1.00 1.00 C ATOM 3 C PHE A 1 96.335 26.415 3.408 1.00 1.00 C ATOM 4 O PHE A 1 96.154 25.248 3.754 1.00 1.00 O ATOM 5 CB PHE A 1 95.165 28.629 3.155 1.00 1.00 C ATOM 6 CG PHE A 1 94.364 29.458 2.176 1.00 1.00 C ATOM 7 CD1 PHE A 1 92.964 29.409 2.191 1.00 1.00 C ATOM 8 CD2 PHE A 1 95.026 30.273 1.250 1.00 1.00 C ATOM 9 CE1 PHE A 1 92.229 30.175 1.277 1.00 1.00 C ATOM 10 CE2 PHE A 1 94.291 31.039 0.338 1.00 1.00 C ATOM 11 CZ PHE A 1 92.894 30.989 0.351 1.00 1.00 C ATOM 0 H1 PHE A 1 93.170 27.146 2.530 1.00 1.00 H new ATOM 0 H2 PHE A 1 93.902 25.626 2.339 1.00 1.00 H new ATOM 0 H3 PHE A 1 93.798 26.331 3.881 1.00 1.00 H new ATOM 0 HA PHE A 1 95.501 27.188 1.593 1.00 1.00 H new ATOM 0 HB2 PHE A 1 94.697 28.657 4.139 1.00 1.00 H new ATOM 0 HB3 PHE A 1 96.166 29.045 3.266 1.00 1.00 H new ATOM 0 HD1 PHE A 1 92.452 28.782 2.906 1.00 1.00 H new ATOM 0 HD2 PHE A 1 96.105 30.311 1.239 1.00 1.00 H new ATOM 0 HE1 PHE A 1 91.150 30.138 1.286 1.00 1.00 H new ATOM 0 HE2 PHE A 1 94.803 31.668 -0.375 1.00 1.00 H new ATOM 0 HZ PHE A 1 92.327 31.579 -0.354 1.00 1.00 H new ATOM 23 N ASN A 2 97.468 27.073 3.644 1.00 1.00 N ATOM 24 CA ASN A 2 98.586 26.443 4.339 1.00 1.00 C ATOM 25 C ASN A 2 98.248 26.094 5.786 1.00 1.00 C ATOM 26 O ASN A 2 98.779 25.128 6.331 1.00 1.00 O ATOM 27 CB ASN A 2 99.814 27.350 4.323 1.00 1.00 C ATOM 28 CG ASN A 2 100.224 27.670 2.890 1.00 1.00 C ATOM 29 OD1 ASN A 2 100.574 28.810 2.586 1.00 1.00 O ATOM 30 ND2 ASN A 2 100.202 26.730 1.986 1.00 1.00 N ATOM 0 H ASN A 2 97.635 28.040 3.365 1.00 1.00 H new ATOM 0 HA ASN A 2 98.799 25.518 3.804 1.00 1.00 H new ATOM 0 HB2 ASN A 2 99.598 28.273 4.860 1.00 1.00 H new ATOM 0 HB3 ASN A 2 100.639 26.864 4.843 1.00 1.00 H new ATOM 0 HD21 ASN A 2 100.475 26.939 1.026 1.00 1.00 H new ATOM 0 HD22 ASN A 2 99.912 25.786 2.239 1.00 1.00 H new ATOM 37 N LYS A 3 97.397 26.886 6.423 1.00 1.00 N ATOM 38 CA LYS A 3 97.057 26.631 7.818 1.00 1.00 C ATOM 39 C LYS A 3 96.742 25.151 8.046 1.00 1.00 C ATOM 40 O LYS A 3 97.167 24.573 9.044 1.00 1.00 O ATOM 41 CB LYS A 3 95.857 27.496 8.238 1.00 1.00 C ATOM 42 CG LYS A 3 94.651 27.272 7.277 1.00 1.00 C ATOM 43 CD LYS A 3 93.455 26.695 8.046 1.00 1.00 C ATOM 44 CE LYS A 3 92.321 26.393 7.074 1.00 1.00 C ATOM 45 NZ LYS A 3 91.106 25.991 7.838 1.00 1.00 N ATOM 0 H LYS A 3 96.936 27.696 6.007 1.00 1.00 H new ATOM 0 HA LYS A 3 97.920 26.894 8.430 1.00 1.00 H new ATOM 0 HB2 LYS A 3 95.565 27.250 9.259 1.00 1.00 H new ATOM 0 HB3 LYS A 3 96.142 28.548 8.233 1.00 1.00 H new ATOM 0 HG2 LYS A 3 94.370 28.216 6.810 1.00 1.00 H new ATOM 0 HG3 LYS A 3 94.938 26.592 6.475 1.00 1.00 H new ATOM 0 HD2 LYS A 3 93.751 25.786 8.570 1.00 1.00 H new ATOM 0 HD3 LYS A 3 93.120 27.404 8.803 1.00 1.00 H new ATOM 0 HE2 LYS A 3 92.107 27.271 6.465 1.00 1.00 H new ATOM 0 HE3 LYS A 3 92.615 25.595 6.392 1.00 1.00 H new ATOM 0 HZ1 LYS A 3 90.332 25.785 7.175 1.00 1.00 H new ATOM 0 HZ2 LYS A 3 91.315 25.142 8.401 1.00 1.00 H new ATOM 0 HZ3 LYS A 3 90.822 26.765 8.472 1.00 1.00 H new ATOM 59 N LYS A 4 96.014 24.538 7.119 1.00 1.00 N ATOM 60 CA LYS A 4 95.675 23.123 7.243 1.00 1.00 C ATOM 61 C LYS A 4 96.931 22.269 7.044 1.00 1.00 C ATOM 62 O LYS A 4 97.114 21.234 7.682 1.00 1.00 O ATOM 63 CB LYS A 4 94.603 22.759 6.201 1.00 1.00 C ATOM 64 CG LYS A 4 93.697 21.629 6.709 1.00 1.00 C ATOM 65 CD LYS A 4 94.476 20.317 6.856 1.00 1.00 C ATOM 66 CE LYS A 4 93.476 19.151 6.890 1.00 1.00 C ATOM 67 NZ LYS A 4 94.189 17.867 7.127 1.00 1.00 N ATOM 0 H LYS A 4 95.650 24.992 6.281 1.00 1.00 H new ATOM 0 HA LYS A 4 95.278 22.928 8.239 1.00 1.00 H new ATOM 0 HB2 LYS A 4 94.000 23.638 5.973 1.00 1.00 H new ATOM 0 HB3 LYS A 4 95.084 22.453 5.272 1.00 1.00 H new ATOM 0 HG2 LYS A 4 93.267 21.909 7.670 1.00 1.00 H new ATOM 0 HG3 LYS A 4 92.867 21.486 6.017 1.00 1.00 H new ATOM 0 HD2 LYS A 4 95.171 20.195 6.025 1.00 1.00 H new ATOM 0 HD3 LYS A 4 95.071 20.331 7.769 1.00 1.00 H new ATOM 0 HE2 LYS A 4 92.740 19.317 7.677 1.00 1.00 H new ATOM 0 HE3 LYS A 4 92.930 19.103 5.948 1.00 1.00 H new ATOM 0 HZ1 LYS A 4 93.953 17.194 6.370 1.00 1.00 H new ATOM 0 HZ2 LYS A 4 95.215 18.036 7.133 1.00 1.00 H new ATOM 0 HZ3 LYS A 4 93.898 17.473 8.044 1.00 1.00 H new ATOM 81 N ALA A 5 97.794 22.725 6.148 1.00 1.00 N ATOM 82 CA ALA A 5 99.029 22.024 5.844 1.00 1.00 C ATOM 83 C ALA A 5 99.806 21.740 7.104 1.00 1.00 C ATOM 84 O ALA A 5 100.471 20.715 7.219 1.00 1.00 O ATOM 85 CB ALA A 5 99.873 22.890 4.910 1.00 1.00 C ATOM 0 H ALA A 5 97.658 23.585 5.616 1.00 1.00 H new ATOM 0 HA ALA A 5 98.789 21.074 5.365 1.00 1.00 H new ATOM 0 HB1 ALA A 5 100.803 22.372 4.675 1.00 1.00 H new ATOM 0 HB2 ALA A 5 99.320 23.078 3.990 1.00 1.00 H new ATOM 0 HB3 ALA A 5 100.099 23.838 5.398 1.00 1.00 H new ATOM 91 N ASP A 6 99.713 22.660 8.036 1.00 1.00 N ATOM 92 CA ASP A 6 100.411 22.522 9.292 1.00 1.00 C ATOM 93 C ASP A 6 99.930 21.271 10.036 1.00 1.00 C ATOM 94 O ASP A 6 100.723 20.566 10.652 1.00 1.00 O ATOM 95 CB ASP A 6 100.158 23.741 10.149 1.00 1.00 C ATOM 96 CG ASP A 6 100.859 24.961 9.560 1.00 1.00 C ATOM 97 OD1 ASP A 6 101.595 24.791 8.600 1.00 1.00 O ATOM 98 OD2 ASP A 6 100.661 26.044 10.084 1.00 1.00 O ATOM 0 H ASP A 6 99.160 23.513 7.948 1.00 1.00 H new ATOM 0 HA ASP A 6 101.478 22.427 9.090 1.00 1.00 H new ATOM 0 HB2 ASP A 6 99.086 23.928 10.219 1.00 1.00 H new ATOM 0 HB3 ASP A 6 100.517 23.562 11.162 1.00 1.00 H new ATOM 103 N GLU A 7 98.625 20.997 9.987 1.00 1.00 N ATOM 104 CA GLU A 7 98.088 19.827 10.683 1.00 1.00 C ATOM 105 C GLU A 7 98.629 18.540 10.087 1.00 1.00 C ATOM 106 O GLU A 7 99.104 17.654 10.795 1.00 1.00 O ATOM 107 CB GLU A 7 96.570 19.808 10.589 1.00 1.00 C ATOM 108 CG GLU A 7 96.024 21.212 10.805 1.00 1.00 C ATOM 109 CD GLU A 7 94.504 21.177 10.910 1.00 1.00 C ATOM 110 OE1 GLU A 7 93.958 20.088 10.997 1.00 1.00 O ATOM 111 OE2 GLU A 7 93.906 22.240 10.907 1.00 1.00 O ATOM 0 H GLU A 7 97.934 21.555 9.485 1.00 1.00 H new ATOM 0 HA GLU A 7 98.396 19.895 11.726 1.00 1.00 H new ATOM 0 HB2 GLU A 7 96.261 19.434 9.613 1.00 1.00 H new ATOM 0 HB3 GLU A 7 96.158 19.129 11.336 1.00 1.00 H new ATOM 0 HG2 GLU A 7 96.449 21.639 11.714 1.00 1.00 H new ATOM 0 HG3 GLU A 7 96.324 21.857 9.979 1.00 1.00 H new ATOM 118 N ASN A 8 98.560 18.457 8.779 1.00 1.00 N ATOM 119 CA ASN A 8 99.058 17.285 8.074 1.00 1.00 C ATOM 120 C ASN A 8 100.540 17.191 8.326 1.00 1.00 C ATOM 121 O ASN A 8 101.111 16.113 8.488 1.00 1.00 O ATOM 122 CB ASN A 8 98.794 17.436 6.587 1.00 1.00 C ATOM 123 CG ASN A 8 97.324 17.726 6.357 1.00 1.00 C ATOM 124 OD1 ASN A 8 96.548 17.785 7.307 1.00 1.00 O ATOM 125 ND2 ASN A 8 96.899 17.919 5.143 1.00 1.00 N ATOM 0 H ASN A 8 98.167 19.181 8.178 1.00 1.00 H new ATOM 0 HA ASN A 8 98.557 16.383 8.425 1.00 1.00 H new ATOM 0 HB2 ASN A 8 99.402 18.244 6.180 1.00 1.00 H new ATOM 0 HB3 ASN A 8 99.082 16.525 6.062 1.00 1.00 H new ATOM 0 HD21 ASN A 8 95.914 18.121 4.974 1.00 1.00 H new ATOM 0 HD22 ASN A 8 97.551 17.868 4.360 1.00 1.00 H new ATOM 132 N LYS A 9 101.135 18.360 8.365 1.00 1.00 N ATOM 133 CA LYS A 9 102.554 18.502 8.610 1.00 1.00 C ATOM 134 C LYS A 9 102.926 18.054 10.025 1.00 1.00 C ATOM 135 O LYS A 9 103.833 17.251 10.205 1.00 1.00 O ATOM 136 CB LYS A 9 102.889 19.983 8.398 1.00 1.00 C ATOM 137 CG LYS A 9 104.200 20.385 9.052 1.00 1.00 C ATOM 138 CD LYS A 9 104.550 21.823 8.666 1.00 1.00 C ATOM 139 CE LYS A 9 105.959 22.148 9.165 1.00 1.00 C ATOM 140 NZ LYS A 9 106.376 23.482 8.648 1.00 1.00 N ATOM 0 H LYS A 9 100.647 19.245 8.227 1.00 1.00 H new ATOM 0 HA LYS A 9 103.125 17.869 7.931 1.00 1.00 H new ATOM 0 HB2 LYS A 9 102.942 20.190 7.329 1.00 1.00 H new ATOM 0 HB3 LYS A 9 102.083 20.595 8.802 1.00 1.00 H new ATOM 0 HG2 LYS A 9 104.118 20.299 10.136 1.00 1.00 H new ATOM 0 HG3 LYS A 9 104.996 19.710 8.738 1.00 1.00 H new ATOM 0 HD2 LYS A 9 104.497 21.945 7.584 1.00 1.00 H new ATOM 0 HD3 LYS A 9 103.829 22.515 9.101 1.00 1.00 H new ATOM 0 HE2 LYS A 9 105.979 22.146 10.255 1.00 1.00 H new ATOM 0 HE3 LYS A 9 106.660 21.382 8.832 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 107.334 23.702 8.988 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 106.372 23.468 7.608 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 105.713 24.208 8.987 1.00 1.00 H new ATOM 154 N VAL A 10 102.227 18.573 11.028 1.00 1.00 N ATOM 155 CA VAL A 10 102.534 18.205 12.404 1.00 1.00 C ATOM 156 C VAL A 10 102.205 16.747 12.675 1.00 1.00 C ATOM 157 O VAL A 10 103.010 16.021 13.257 1.00 1.00 O ATOM 158 CB VAL A 10 101.786 19.113 13.388 1.00 1.00 C ATOM 159 CG1 VAL A 10 101.914 18.564 14.798 1.00 1.00 C ATOM 160 CG2 VAL A 10 102.378 20.525 13.335 1.00 1.00 C ATOM 0 H VAL A 10 101.460 19.236 10.919 1.00 1.00 H new ATOM 0 HA VAL A 10 103.606 18.340 12.550 1.00 1.00 H new ATOM 0 HB VAL A 10 100.732 19.148 13.111 1.00 1.00 H new ATOM 0 HG11 VAL A 10 101.380 19.214 15.491 1.00 1.00 H new ATOM 0 HG12 VAL A 10 101.487 17.562 14.838 1.00 1.00 H new ATOM 0 HG13 VAL A 10 102.967 18.521 15.078 1.00 1.00 H new ATOM 0 HG21 VAL A 10 101.846 21.169 14.035 1.00 1.00 H new ATOM 0 HG22 VAL A 10 103.433 20.488 13.607 1.00 1.00 H new ATOM 0 HG23 VAL A 10 102.277 20.924 12.326 1.00 1.00 H new ATOM 164 N LYS A 11 101.030 16.316 12.251 1.00 1.00 N ATOM 165 CA LYS A 11 100.645 14.943 12.464 1.00 1.00 C ATOM 166 C LYS A 11 101.633 14.069 11.722 1.00 1.00 C ATOM 167 O LYS A 11 102.032 13.008 12.197 1.00 1.00 O ATOM 168 CB LYS A 11 99.223 14.676 11.960 1.00 1.00 C ATOM 169 CG LYS A 11 98.177 15.090 13.015 1.00 1.00 C ATOM 170 CD LYS A 11 98.146 16.620 13.201 1.00 1.00 C ATOM 171 CE LYS A 11 97.688 16.978 14.620 1.00 1.00 C ATOM 172 NZ LYS A 11 98.478 16.211 15.625 1.00 1.00 N ATOM 0 H LYS A 11 100.340 16.890 11.766 1.00 1.00 H new ATOM 0 HA LYS A 11 100.654 14.722 13.531 1.00 1.00 H new ATOM 0 HB2 LYS A 11 99.051 15.228 11.036 1.00 1.00 H new ATOM 0 HB3 LYS A 11 99.109 13.618 11.725 1.00 1.00 H new ATOM 0 HG2 LYS A 11 97.191 14.738 12.711 1.00 1.00 H new ATOM 0 HG3 LYS A 11 98.407 14.610 13.966 1.00 1.00 H new ATOM 0 HD2 LYS A 11 99.137 17.035 13.016 1.00 1.00 H new ATOM 0 HD3 LYS A 11 97.472 17.068 12.471 1.00 1.00 H new ATOM 0 HE2 LYS A 11 97.810 18.048 14.790 1.00 1.00 H new ATOM 0 HE3 LYS A 11 96.627 16.756 14.734 1.00 1.00 H new ATOM 0 HZ1 LYS A 11 98.629 16.799 16.470 1.00 1.00 H new ATOM 0 HZ2 LYS A 11 97.959 15.350 15.891 1.00 1.00 H new ATOM 0 HZ3 LYS A 11 99.398 15.949 15.217 1.00 1.00 H new ATOM 186 N GLY A 12 102.013 14.543 10.540 1.00 1.00 N ATOM 187 CA GLY A 12 102.953 13.815 9.694 1.00 1.00 C ATOM 188 C GLY A 12 104.373 13.841 10.246 1.00 1.00 C ATOM 189 O GLY A 12 105.048 12.814 10.281 1.00 1.00 O ATOM 0 H GLY A 12 101.686 15.425 10.147 1.00 1.00 H new ATOM 0 HA2 GLY A 12 102.623 12.781 9.596 1.00 1.00 H new ATOM 0 HA3 GLY A 12 102.947 14.248 8.694 1.00 1.00 H new ATOM 193 N GLU A 13 104.828 15.002 10.692 1.00 1.00 N ATOM 194 CA GLU A 13 106.174 15.083 11.249 1.00 1.00 C ATOM 195 C GLU A 13 106.261 14.145 12.437 1.00 1.00 C ATOM 196 O GLU A 13 107.294 13.537 12.697 1.00 1.00 O ATOM 197 CB GLU A 13 106.503 16.512 11.699 1.00 1.00 C ATOM 198 CG GLU A 13 106.862 17.379 10.495 1.00 1.00 C ATOM 199 CD GLU A 13 107.156 18.800 10.961 1.00 1.00 C ATOM 200 OE1 GLU A 13 107.478 19.625 10.123 1.00 1.00 O ATOM 201 OE2 GLU A 13 107.060 19.040 12.153 1.00 1.00 O ATOM 0 H GLU A 13 104.305 15.878 10.682 1.00 1.00 H new ATOM 0 HA GLU A 13 106.893 14.799 10.481 1.00 1.00 H new ATOM 0 HB2 GLU A 13 105.649 16.941 12.222 1.00 1.00 H new ATOM 0 HB3 GLU A 13 107.334 16.496 12.404 1.00 1.00 H new ATOM 0 HG2 GLU A 13 107.731 16.966 9.982 1.00 1.00 H new ATOM 0 HG3 GLU A 13 106.041 17.383 9.778 1.00 1.00 H new ATOM 208 N ALA A 14 105.149 14.034 13.140 1.00 1.00 N ATOM 209 CA ALA A 14 105.054 13.176 14.296 1.00 1.00 C ATOM 210 C ALA A 14 104.969 11.722 13.862 1.00 1.00 C ATOM 211 O ALA A 14 105.513 10.826 14.507 1.00 1.00 O ATOM 212 CB ALA A 14 103.809 13.544 15.103 1.00 1.00 C ATOM 0 H ALA A 14 104.289 14.538 12.922 1.00 1.00 H new ATOM 0 HA ALA A 14 105.942 13.310 14.913 1.00 1.00 H new ATOM 0 HB1 ALA A 14 103.737 12.896 15.976 1.00 1.00 H new ATOM 0 HB2 ALA A 14 103.879 14.583 15.426 1.00 1.00 H new ATOM 0 HB3 ALA A 14 102.922 13.416 14.482 1.00 1.00 H new ATOM 218 N PHE A 15 104.262 11.512 12.761 1.00 1.00 N ATOM 219 CA PHE A 15 104.059 10.188 12.206 1.00 1.00 C ATOM 220 C PHE A 15 105.382 9.537 11.840 1.00 1.00 C ATOM 221 O PHE A 15 105.645 8.397 12.225 1.00 1.00 O ATOM 222 CB PHE A 15 103.191 10.354 10.968 1.00 1.00 C ATOM 223 CG PHE A 15 102.761 9.034 10.411 1.00 1.00 C ATOM 224 CD1 PHE A 15 103.405 8.517 9.292 1.00 1.00 C ATOM 225 CD2 PHE A 15 101.676 8.362 10.976 1.00 1.00 C ATOM 226 CE1 PHE A 15 102.967 7.321 8.732 1.00 1.00 C ATOM 227 CE2 PHE A 15 101.243 7.156 10.426 1.00 1.00 C ATOM 228 CZ PHE A 15 101.889 6.635 9.302 1.00 1.00 C ATOM 0 H PHE A 15 103.814 12.258 12.229 1.00 1.00 H new ATOM 0 HA PHE A 15 103.579 9.540 12.939 1.00 1.00 H new ATOM 0 HB2 PHE A 15 102.311 10.947 11.218 1.00 1.00 H new ATOM 0 HB3 PHE A 15 103.743 10.907 10.208 1.00 1.00 H new ATOM 0 HD1 PHE A 15 104.243 9.043 8.859 1.00 1.00 H new ATOM 0 HD2 PHE A 15 101.173 8.775 11.838 1.00 1.00 H new ATOM 0 HE1 PHE A 15 103.459 6.922 7.857 1.00 1.00 H new ATOM 0 HE2 PHE A 15 100.411 6.627 10.867 1.00 1.00 H new ATOM 0 HZ PHE A 15 101.556 5.702 8.873 1.00 1.00 H new ATOM 238 N LEU A 16 106.221 10.264 11.118 1.00 1.00 N ATOM 239 CA LEU A 16 107.523 9.725 10.746 1.00 1.00 C ATOM 240 C LEU A 16 108.387 9.601 11.982 1.00 1.00 C ATOM 241 O LEU A 16 109.140 8.640 12.141 1.00 1.00 O ATOM 242 CB LEU A 16 108.236 10.614 9.721 1.00 1.00 C ATOM 243 CG LEU A 16 107.571 10.508 8.328 1.00 1.00 C ATOM 244 CD1 LEU A 16 106.431 11.534 8.173 1.00 1.00 C ATOM 245 CD2 LEU A 16 108.637 10.752 7.261 1.00 1.00 C ATOM 0 H LEU A 16 106.032 11.209 10.783 1.00 1.00 H new ATOM 0 HA LEU A 16 107.362 8.747 10.292 1.00 1.00 H new ATOM 0 HB2 LEU A 16 108.216 11.650 10.058 1.00 1.00 H new ATOM 0 HB3 LEU A 16 109.284 10.322 9.650 1.00 1.00 H new ATOM 0 HG LEU A 16 107.139 9.514 8.215 1.00 1.00 H new ATOM 0 HD11 LEU A 16 105.984 11.434 7.184 1.00 1.00 H new ATOM 0 HD12 LEU A 16 105.672 11.353 8.934 1.00 1.00 H new ATOM 0 HD13 LEU A 16 106.830 12.542 8.291 1.00 1.00 H new ATOM 0 HD21 LEU A 16 108.185 10.681 6.272 1.00 1.00 H new ATOM 0 HD22 LEU A 16 109.064 11.746 7.394 1.00 1.00 H new ATOM 0 HD23 LEU A 16 109.424 10.003 7.355 1.00 1.00 H new ATOM 257 N THR A 17 108.264 10.579 12.857 1.00 1.00 N ATOM 258 CA THR A 17 109.036 10.571 14.085 1.00 1.00 C ATOM 259 C THR A 17 108.688 9.338 14.900 1.00 1.00 C ATOM 260 O THR A 17 109.562 8.675 15.455 1.00 1.00 O ATOM 261 CB THR A 17 108.760 11.830 14.904 1.00 1.00 C ATOM 262 OG1 THR A 17 109.018 12.978 14.111 1.00 1.00 O ATOM 263 CG2 THR A 17 109.659 11.846 16.127 1.00 1.00 C ATOM 0 H THR A 17 107.644 11.381 12.744 1.00 1.00 H new ATOM 0 HA THR A 17 110.096 10.551 13.830 1.00 1.00 H new ATOM 0 HB THR A 17 107.717 11.835 15.220 1.00 1.00 H new ATOM 0 HG1 THR A 17 108.260 13.138 13.511 1.00 1.00 H new ATOM 0 HG21 THR A 17 109.462 12.745 16.712 1.00 1.00 H new ATOM 0 HG22 THR A 17 109.459 10.965 16.737 1.00 1.00 H new ATOM 0 HG23 THR A 17 110.702 11.840 15.812 1.00 1.00 H new ATOM 271 N GLU A 18 107.397 9.040 14.976 1.00 1.00 N ATOM 272 CA GLU A 18 106.932 7.893 15.723 1.00 1.00 C ATOM 273 C GLU A 18 107.165 6.587 14.968 1.00 1.00 C ATOM 274 O GLU A 18 107.579 5.587 15.556 1.00 1.00 O ATOM 275 CB GLU A 18 105.447 8.048 16.047 1.00 1.00 C ATOM 276 CG GLU A 18 104.988 6.889 16.935 1.00 1.00 C ATOM 277 CD GLU A 18 103.524 7.068 17.325 1.00 1.00 C ATOM 278 OE1 GLU A 18 103.017 8.167 17.168 1.00 1.00 O ATOM 279 OE2 GLU A 18 102.930 6.098 17.765 1.00 1.00 O ATOM 0 H GLU A 18 106.658 9.581 14.527 1.00 1.00 H new ATOM 0 HA GLU A 18 107.508 7.848 16.647 1.00 1.00 H new ATOM 0 HB2 GLU A 18 105.273 8.997 16.553 1.00 1.00 H new ATOM 0 HB3 GLU A 18 104.864 8.066 15.126 1.00 1.00 H new ATOM 0 HG2 GLU A 18 105.118 5.944 16.407 1.00 1.00 H new ATOM 0 HG3 GLU A 18 105.607 6.841 17.831 1.00 1.00 H new ATOM 286 N ASN A 19 106.848 6.582 13.675 1.00 1.00 N ATOM 287 CA ASN A 19 106.976 5.361 12.877 1.00 1.00 C ATOM 288 C ASN A 19 108.390 4.821 12.823 1.00 1.00 C ATOM 289 O ASN A 19 108.597 3.618 12.974 1.00 1.00 O ATOM 290 CB ASN A 19 106.502 5.611 11.458 1.00 1.00 C ATOM 291 CG ASN A 19 106.529 4.301 10.698 1.00 1.00 C ATOM 292 OD1 ASN A 19 105.959 3.310 11.152 1.00 1.00 O ATOM 293 ND2 ASN A 19 107.166 4.231 9.573 1.00 1.00 N ATOM 0 H ASN A 19 106.506 7.395 13.162 1.00 1.00 H new ATOM 0 HA ASN A 19 106.355 4.614 13.373 1.00 1.00 H new ATOM 0 HB2 ASN A 19 105.493 6.023 11.464 1.00 1.00 H new ATOM 0 HB3 ASN A 19 107.143 6.344 10.969 1.00 1.00 H new ATOM 0 HD21 ASN A 19 107.197 3.351 9.058 1.00 1.00 H new ATOM 0 HD22 ASN A 19 107.637 5.056 9.201 1.00 1.00 H new ATOM 300 N LYS A 20 109.359 5.684 12.611 1.00 1.00 N ATOM 301 CA LYS A 20 110.733 5.213 12.541 1.00 1.00 C ATOM 302 C LYS A 20 111.097 4.505 13.838 1.00 1.00 C ATOM 303 O LYS A 20 111.893 3.567 13.845 1.00 1.00 O ATOM 304 CB LYS A 20 111.692 6.376 12.294 1.00 1.00 C ATOM 305 CG LYS A 20 111.589 7.382 13.441 1.00 1.00 C ATOM 306 CD LYS A 20 112.252 8.703 13.031 1.00 1.00 C ATOM 307 CE LYS A 20 113.757 8.504 12.873 1.00 1.00 C ATOM 308 NZ LYS A 20 114.429 9.833 12.800 1.00 1.00 N ATOM 0 H LYS A 20 109.233 6.688 12.487 1.00 1.00 H new ATOM 0 HA LYS A 20 110.821 4.515 11.709 1.00 1.00 H new ATOM 0 HB2 LYS A 20 112.714 6.006 12.213 1.00 1.00 H new ATOM 0 HB3 LYS A 20 111.453 6.862 11.348 1.00 1.00 H new ATOM 0 HG2 LYS A 20 110.543 7.553 13.695 1.00 1.00 H new ATOM 0 HG3 LYS A 20 112.073 6.983 14.332 1.00 1.00 H new ATOM 0 HD2 LYS A 20 111.824 9.059 12.094 1.00 1.00 H new ATOM 0 HD3 LYS A 20 112.055 9.467 13.783 1.00 1.00 H new ATOM 0 HE2 LYS A 20 114.149 7.932 13.714 1.00 1.00 H new ATOM 0 HE3 LYS A 20 113.966 7.929 11.971 1.00 1.00 H new ATOM 0 HZ1 LYS A 20 115.455 9.698 12.692 1.00 1.00 H new ATOM 0 HZ2 LYS A 20 114.062 10.363 11.984 1.00 1.00 H new ATOM 0 HZ3 LYS A 20 114.240 10.366 13.673 1.00 1.00 H new ATOM 322 N ASN A 21 110.500 4.963 14.932 1.00 1.00 N ATOM 323 CA ASN A 21 110.753 4.378 16.243 1.00 1.00 C ATOM 324 C ASN A 21 109.937 3.105 16.460 1.00 1.00 C ATOM 325 O ASN A 21 110.330 2.240 17.242 1.00 1.00 O ATOM 326 CB ASN A 21 110.427 5.408 17.337 1.00 1.00 C ATOM 327 CG ASN A 21 111.611 6.348 17.558 1.00 1.00 C ATOM 328 OD1 ASN A 21 112.546 6.011 18.285 1.00 1.00 O ATOM 329 ND2 ASN A 21 111.631 7.512 16.966 1.00 1.00 N ATOM 0 H ASN A 21 109.837 5.738 14.937 1.00 1.00 H new ATOM 0 HA ASN A 21 111.807 4.105 16.295 1.00 1.00 H new ATOM 0 HB2 ASN A 21 109.547 5.984 17.052 1.00 1.00 H new ATOM 0 HB3 ASN A 21 110.184 4.894 18.267 1.00 1.00 H new ATOM 0 HD21 ASN A 21 112.421 8.142 17.106 1.00 1.00 H new ATOM 0 HD22 ASN A 21 110.857 7.791 16.364 1.00 1.00 H new ATOM 336 N LYS A 22 108.791 3.006 15.804 1.00 1.00 N ATOM 337 CA LYS A 22 107.939 1.844 15.987 1.00 1.00 C ATOM 338 C LYS A 22 108.670 0.539 15.601 1.00 1.00 C ATOM 339 O LYS A 22 109.491 0.545 14.683 1.00 1.00 O ATOM 340 CB LYS A 22 106.658 2.006 15.162 1.00 1.00 C ATOM 341 CG LYS A 22 105.684 3.002 15.846 1.00 1.00 C ATOM 342 CD LYS A 22 104.230 2.630 15.531 1.00 1.00 C ATOM 343 CE LYS A 22 103.975 2.839 14.042 1.00 1.00 C ATOM 344 NZ LYS A 22 102.604 2.364 13.698 1.00 1.00 N ATOM 0 H LYS A 22 108.435 3.704 15.151 1.00 1.00 H new ATOM 0 HA LYS A 22 107.680 1.774 17.044 1.00 1.00 H new ATOM 0 HB2 LYS A 22 106.907 2.362 14.162 1.00 1.00 H new ATOM 0 HB3 LYS A 22 106.171 1.038 15.044 1.00 1.00 H new ATOM 0 HG2 LYS A 22 105.843 2.993 16.924 1.00 1.00 H new ATOM 0 HG3 LYS A 22 105.889 4.016 15.502 1.00 1.00 H new ATOM 0 HD2 LYS A 22 104.040 1.592 15.803 1.00 1.00 H new ATOM 0 HD3 LYS A 22 103.548 3.244 16.119 1.00 1.00 H new ATOM 0 HE2 LYS A 22 104.079 3.894 13.789 1.00 1.00 H new ATOM 0 HE3 LYS A 22 104.717 2.296 13.456 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 102.432 2.507 12.682 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 102.520 1.352 13.924 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 101.903 2.901 14.247 1.00 1.00 H new ATOM 358 N PRO A 23 108.397 -0.576 16.275 1.00 1.00 N ATOM 359 CA PRO A 23 109.061 -1.890 15.968 1.00 1.00 C ATOM 360 C PRO A 23 108.894 -2.350 14.515 1.00 1.00 C ATOM 361 O PRO A 23 107.875 -2.092 13.875 1.00 1.00 O ATOM 362 CB PRO A 23 108.378 -2.899 16.907 1.00 1.00 C ATOM 363 CG PRO A 23 107.787 -2.084 18.005 1.00 1.00 C ATOM 364 CD PRO A 23 107.451 -0.716 17.406 1.00 1.00 C ATOM 0 HA PRO A 23 110.138 -1.801 16.112 1.00 1.00 H new ATOM 0 HB2 PRO A 23 107.609 -3.466 16.382 1.00 1.00 H new ATOM 0 HB3 PRO A 23 109.096 -3.621 17.297 1.00 1.00 H new ATOM 0 HG2 PRO A 23 106.892 -2.562 18.403 1.00 1.00 H new ATOM 0 HG3 PRO A 23 108.489 -1.982 18.832 1.00 1.00 H new ATOM 0 HD2 PRO A 23 106.416 -0.672 17.068 1.00 1.00 H new ATOM 0 HD3 PRO A 23 107.582 0.082 18.137 1.00 1.00 H new ATOM 372 N GLY A 24 109.902 -3.068 14.030 1.00 1.00 N ATOM 373 CA GLY A 24 109.885 -3.618 12.679 1.00 1.00 C ATOM 374 C GLY A 24 110.146 -2.566 11.619 1.00 1.00 C ATOM 375 O GLY A 24 110.494 -2.899 10.490 1.00 1.00 O ATOM 0 H GLY A 24 110.748 -3.284 14.558 1.00 1.00 H new ATOM 0 HA2 GLY A 24 110.638 -4.402 12.600 1.00 1.00 H new ATOM 0 HA3 GLY A 24 108.918 -4.084 12.493 1.00 1.00 H new ATOM 379 N VAL A 25 109.977 -1.303 11.972 1.00 1.00 N ATOM 380 CA VAL A 25 110.195 -0.229 11.010 1.00 1.00 C ATOM 381 C VAL A 25 111.676 0.127 10.945 1.00 1.00 C ATOM 382 O VAL A 25 112.329 0.300 11.974 1.00 1.00 O ATOM 383 CB VAL A 25 109.403 1.021 11.422 1.00 1.00 C ATOM 384 CG1 VAL A 25 109.557 2.132 10.377 1.00 1.00 C ATOM 385 CG2 VAL A 25 107.926 0.681 11.596 1.00 1.00 C ATOM 0 H VAL A 25 109.694 -0.996 12.903 1.00 1.00 H new ATOM 0 HA VAL A 25 109.857 -0.572 10.032 1.00 1.00 H new ATOM 0 HB VAL A 25 109.803 1.375 12.372 1.00 1.00 H new ATOM 0 HG11 VAL A 25 108.988 3.007 10.690 1.00 1.00 H new ATOM 0 HG12 VAL A 25 110.610 2.399 10.282 1.00 1.00 H new ATOM 0 HG13 VAL A 25 109.183 1.781 9.415 1.00 1.00 H new ATOM 0 HG21 VAL A 25 107.378 1.577 11.888 1.00 1.00 H new ATOM 0 HG22 VAL A 25 107.527 0.302 10.655 1.00 1.00 H new ATOM 0 HG23 VAL A 25 107.816 -0.079 12.369 1.00 1.00 H new ATOM 389 N VAL A 26 112.185 0.275 9.727 1.00 1.00 N ATOM 390 CA VAL A 26 113.579 0.660 9.510 1.00 1.00 C ATOM 391 C VAL A 26 113.586 1.950 8.708 1.00 1.00 C ATOM 392 O VAL A 26 113.011 2.008 7.624 1.00 1.00 O ATOM 393 CB VAL A 26 114.318 -0.442 8.746 1.00 1.00 C ATOM 394 CG1 VAL A 26 115.688 0.050 8.300 1.00 1.00 C ATOM 395 CG2 VAL A 26 114.476 -1.657 9.643 1.00 1.00 C ATOM 0 H VAL A 26 111.652 0.134 8.869 1.00 1.00 H new ATOM 0 HA VAL A 26 114.085 0.805 10.464 1.00 1.00 H new ATOM 0 HB VAL A 26 113.740 -0.711 7.862 1.00 1.00 H new ATOM 0 HG11 VAL A 26 116.201 -0.744 7.758 1.00 1.00 H new ATOM 0 HG12 VAL A 26 115.569 0.916 7.648 1.00 1.00 H new ATOM 0 HG13 VAL A 26 116.276 0.332 9.174 1.00 1.00 H new ATOM 0 HG21 VAL A 26 115.002 -2.443 9.101 1.00 1.00 H new ATOM 0 HG22 VAL A 26 115.047 -1.383 10.530 1.00 1.00 H new ATOM 0 HG23 VAL A 26 113.492 -2.018 9.943 1.00 1.00 H new ATOM 399 N VAL A 27 114.205 2.996 9.257 1.00 1.00 N ATOM 400 CA VAL A 27 114.229 4.298 8.588 1.00 1.00 C ATOM 401 C VAL A 27 115.467 4.476 7.742 1.00 1.00 C ATOM 402 O VAL A 27 116.547 3.982 8.066 1.00 1.00 O ATOM 403 CB VAL A 27 114.098 5.435 9.618 1.00 1.00 C ATOM 404 CG1 VAL A 27 115.187 5.301 10.650 1.00 1.00 C ATOM 405 CG2 VAL A 27 114.170 6.818 8.950 1.00 1.00 C ATOM 0 H VAL A 27 114.691 2.969 10.153 1.00 1.00 H new ATOM 0 HA VAL A 27 113.373 4.337 7.914 1.00 1.00 H new ATOM 0 HB VAL A 27 113.122 5.353 10.096 1.00 1.00 H new ATOM 0 HG11 VAL A 27 115.097 6.105 11.381 1.00 1.00 H new ATOM 0 HG12 VAL A 27 115.094 4.340 11.155 1.00 1.00 H new ATOM 0 HG13 VAL A 27 116.160 5.362 10.162 1.00 1.00 H new ATOM 0 HG21 VAL A 27 114.074 7.594 9.709 1.00 1.00 H new ATOM 0 HG22 VAL A 27 115.127 6.926 8.440 1.00 1.00 H new ATOM 0 HG23 VAL A 27 113.360 6.915 8.227 1.00 1.00 H new ATOM 409 N LEU A 28 115.280 5.194 6.633 1.00 1.00 N ATOM 410 CA LEU A 28 116.372 5.453 5.697 1.00 1.00 C ATOM 411 C LEU A 28 116.735 6.935 5.681 1.00 1.00 C ATOM 412 O LEU A 28 115.954 7.771 6.133 1.00 1.00 O ATOM 413 CB LEU A 28 115.961 5.037 4.283 1.00 1.00 C ATOM 414 CG LEU A 28 115.663 3.544 4.201 1.00 1.00 C ATOM 415 CD1 LEU A 28 115.199 3.228 2.778 1.00 1.00 C ATOM 416 CD2 LEU A 28 116.933 2.741 4.513 1.00 1.00 C ATOM 0 H LEU A 28 114.386 5.604 6.363 1.00 1.00 H new ATOM 0 HA LEU A 28 117.236 4.873 6.023 1.00 1.00 H new ATOM 0 HB2 LEU A 28 115.080 5.602 3.979 1.00 1.00 H new ATOM 0 HB3 LEU A 28 116.758 5.288 3.583 1.00 1.00 H new ATOM 0 HG LEU A 28 114.891 3.277 4.923 1.00 1.00 H new ATOM 0 HD11 LEU A 28 114.980 2.164 2.695 1.00 1.00 H new ATOM 0 HD12 LEU A 28 114.301 3.802 2.552 1.00 1.00 H new ATOM 0 HD13 LEU A 28 115.986 3.492 2.072 1.00 1.00 H new ATOM 0 HD21 LEU A 28 116.713 1.675 4.453 1.00 1.00 H new ATOM 0 HD22 LEU A 28 117.709 2.993 3.791 1.00 1.00 H new ATOM 0 HD23 LEU A 28 117.279 2.984 5.518 1.00 1.00 H new ATOM 428 N PRO A 29 117.895 7.291 5.163 1.00 1.00 N ATOM 429 CA PRO A 29 118.322 8.709 5.102 1.00 1.00 C ATOM 430 C PRO A 29 117.348 9.545 4.276 1.00 1.00 C ATOM 431 O PRO A 29 117.165 10.737 4.526 1.00 1.00 O ATOM 432 CB PRO A 29 119.716 8.661 4.459 1.00 1.00 C ATOM 433 CG PRO A 29 120.176 7.258 4.655 1.00 1.00 C ATOM 434 CD PRO A 29 118.919 6.408 4.582 1.00 1.00 C ATOM 0 HA PRO A 29 118.342 9.180 6.085 1.00 1.00 H new ATOM 0 HB2 PRO A 29 119.673 8.919 3.401 1.00 1.00 H new ATOM 0 HB3 PRO A 29 120.395 9.370 4.933 1.00 1.00 H new ATOM 0 HG2 PRO A 29 120.892 6.968 3.886 1.00 1.00 H new ATOM 0 HG3 PRO A 29 120.676 7.139 5.616 1.00 1.00 H new ATOM 0 HD2 PRO A 29 118.678 6.129 3.556 1.00 1.00 H new ATOM 0 HD3 PRO A 29 119.023 5.482 5.148 1.00 1.00 H new ATOM 442 N SER A 30 116.728 8.904 3.285 1.00 1.00 N ATOM 443 CA SER A 30 115.777 9.590 2.430 1.00 1.00 C ATOM 444 C SER A 30 114.524 9.924 3.221 1.00 1.00 C ATOM 445 O SER A 30 113.659 10.668 2.761 1.00 1.00 O ATOM 446 CB SER A 30 115.406 8.708 1.235 1.00 1.00 C ATOM 447 OG SER A 30 116.590 8.158 0.673 1.00 1.00 O ATOM 0 H SER A 30 116.870 7.919 3.061 1.00 1.00 H new ATOM 0 HA SER A 30 116.234 10.510 2.065 1.00 1.00 H new ATOM 0 HB2 SER A 30 114.735 7.910 1.552 1.00 1.00 H new ATOM 0 HB3 SER A 30 114.873 9.295 0.487 1.00 1.00 H new ATOM 0 HG SER A 30 116.356 7.591 -0.092 1.00 1.00 H new ATOM 453 N GLY A 31 114.432 9.347 4.414 1.00 1.00 N ATOM 454 CA GLY A 31 113.282 9.558 5.281 1.00 1.00 C ATOM 455 C GLY A 31 112.243 8.484 5.032 1.00 1.00 C ATOM 456 O GLY A 31 111.211 8.435 5.698 1.00 1.00 O ATOM 0 H GLY A 31 115.143 8.728 4.802 1.00 1.00 H new ATOM 0 HA2 GLY A 31 113.595 9.538 6.325 1.00 1.00 H new ATOM 0 HA3 GLY A 31 112.852 10.542 5.095 1.00 1.00 H new ATOM 460 N LEU A 32 112.529 7.608 4.070 1.00 1.00 N ATOM 461 CA LEU A 32 111.603 6.533 3.754 1.00 1.00 C ATOM 462 C LEU A 32 111.783 5.424 4.774 1.00 1.00 C ATOM 463 O LEU A 32 112.909 5.039 5.093 1.00 1.00 O ATOM 464 CB LEU A 32 111.864 6.011 2.321 1.00 1.00 C ATOM 465 CG LEU A 32 110.865 4.910 1.856 1.00 1.00 C ATOM 466 CD1 LEU A 32 111.244 3.537 2.390 1.00 1.00 C ATOM 467 CD2 LEU A 32 109.434 5.242 2.270 1.00 1.00 C ATOM 0 H LEU A 32 113.380 7.623 3.507 1.00 1.00 H new ATOM 0 HA LEU A 32 110.577 6.898 3.795 1.00 1.00 H new ATOM 0 HB2 LEU A 32 111.815 6.849 1.626 1.00 1.00 H new ATOM 0 HB3 LEU A 32 112.877 5.613 2.269 1.00 1.00 H new ATOM 0 HG LEU A 32 110.921 4.884 0.768 1.00 1.00 H new ATOM 0 HD11 LEU A 32 110.521 2.799 2.042 1.00 1.00 H new ATOM 0 HD12 LEU A 32 112.238 3.269 2.032 1.00 1.00 H new ATOM 0 HD13 LEU A 32 111.245 3.558 3.480 1.00 1.00 H new ATOM 0 HD21 LEU A 32 108.764 4.453 1.929 1.00 1.00 H new ATOM 0 HD22 LEU A 32 109.378 5.321 3.356 1.00 1.00 H new ATOM 0 HD23 LEU A 32 109.136 6.190 1.821 1.00 1.00 H new ATOM 479 N GLN A 33 110.675 4.921 5.296 1.00 1.00 N ATOM 480 CA GLN A 33 110.709 3.863 6.296 1.00 1.00 C ATOM 481 C GLN A 33 109.943 2.648 5.828 1.00 1.00 C ATOM 482 O GLN A 33 108.855 2.778 5.273 1.00 1.00 O ATOM 483 CB GLN A 33 110.067 4.383 7.581 1.00 1.00 C ATOM 484 CG GLN A 33 110.891 5.548 8.149 1.00 1.00 C ATOM 485 CD GLN A 33 110.237 6.891 7.906 1.00 1.00 C ATOM 486 OE1 GLN A 33 109.295 7.010 7.121 1.00 1.00 O ATOM 487 NE2 GLN A 33 110.699 7.921 8.539 1.00 1.00 N ATOM 0 H GLN A 33 109.736 5.230 5.043 1.00 1.00 H new ATOM 0 HA GLN A 33 111.747 3.576 6.466 1.00 1.00 H new ATOM 0 HB2 GLN A 33 109.048 4.712 7.380 1.00 1.00 H new ATOM 0 HB3 GLN A 33 110.003 3.580 8.316 1.00 1.00 H new ATOM 0 HG2 GLN A 33 111.029 5.403 9.220 1.00 1.00 H new ATOM 0 HG3 GLN A 33 111.882 5.543 7.696 1.00 1.00 H new ATOM 0 HE21 GLN A 33 111.479 7.814 9.187 1.00 1.00 H new ATOM 0 HE22 GLN A 33 110.283 8.840 8.390 1.00 1.00 H new ATOM 496 N TYR A 34 110.496 1.456 6.080 1.00 1.00 N ATOM 497 CA TYR A 34 109.818 0.224 5.699 1.00 1.00 C ATOM 498 C TYR A 34 109.834 -0.773 6.825 1.00 1.00 C ATOM 499 O TYR A 34 110.780 -0.845 7.609 1.00 1.00 O ATOM 500 CB TYR A 34 110.428 -0.394 4.439 1.00 1.00 C ATOM 501 CG TYR A 34 111.868 -0.774 4.675 1.00 1.00 C ATOM 502 CD1 TYR A 34 112.160 -1.944 5.376 1.00 1.00 C ATOM 503 CD2 TYR A 34 112.903 0.019 4.173 1.00 1.00 C ATOM 504 CE1 TYR A 34 113.488 -2.328 5.581 1.00 1.00 C ATOM 505 CE2 TYR A 34 114.235 -0.361 4.381 1.00 1.00 C ATOM 506 CZ TYR A 34 114.527 -1.536 5.083 1.00 1.00 C ATOM 507 OH TYR A 34 115.839 -1.911 5.285 1.00 1.00 O ATOM 0 H TYR A 34 111.397 1.324 6.539 1.00 1.00 H new ATOM 0 HA TYR A 34 108.783 0.486 5.478 1.00 1.00 H new ATOM 0 HB2 TYR A 34 109.857 -1.276 4.147 1.00 1.00 H new ATOM 0 HB3 TYR A 34 110.364 0.314 3.613 1.00 1.00 H new ATOM 0 HD1 TYR A 34 111.357 -2.555 5.762 1.00 1.00 H new ATOM 0 HD2 TYR A 34 112.677 0.922 3.626 1.00 1.00 H new ATOM 0 HE1 TYR A 34 113.711 -3.235 6.123 1.00 1.00 H new ATOM 0 HE2 TYR A 34 115.037 0.253 3.999 1.00 1.00 H new ATOM 0 HH TYR A 34 116.435 -1.251 4.874 1.00 1.00 H new ATOM 517 N LYS A 35 108.759 -1.546 6.890 1.00 1.00 N ATOM 518 CA LYS A 35 108.601 -2.558 7.903 1.00 1.00 C ATOM 519 C LYS A 35 108.221 -3.859 7.249 1.00 1.00 C ATOM 520 O LYS A 35 107.397 -3.892 6.337 1.00 1.00 O ATOM 521 CB LYS A 35 107.523 -2.132 8.899 1.00 1.00 C ATOM 522 CG LYS A 35 107.435 -3.122 10.063 1.00 1.00 C ATOM 523 CD LYS A 35 106.233 -4.040 9.897 1.00 1.00 C ATOM 524 CE LYS A 35 106.158 -4.973 11.094 1.00 1.00 C ATOM 525 NZ LYS A 35 106.071 -4.181 12.353 1.00 1.00 N ATOM 0 H LYS A 35 107.977 -1.483 6.238 1.00 1.00 H new ATOM 0 HA LYS A 35 109.540 -2.687 8.441 1.00 1.00 H new ATOM 0 HB2 LYS A 35 107.747 -1.135 9.280 1.00 1.00 H new ATOM 0 HB3 LYS A 35 106.559 -2.071 8.394 1.00 1.00 H new ATOM 0 HG2 LYS A 35 108.348 -3.715 10.112 1.00 1.00 H new ATOM 0 HG3 LYS A 35 107.357 -2.578 11.004 1.00 1.00 H new ATOM 0 HD2 LYS A 35 105.318 -3.453 9.819 1.00 1.00 H new ATOM 0 HD3 LYS A 35 106.322 -4.615 8.976 1.00 1.00 H new ATOM 0 HE2 LYS A 35 105.289 -5.624 11.004 1.00 1.00 H new ATOM 0 HE3 LYS A 35 107.037 -5.617 11.120 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 105.361 -4.607 12.983 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 106.997 -4.179 12.826 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 105.794 -3.204 12.130 1.00 1.00 H new ATOM 539 N VAL A 36 108.857 -4.927 7.695 1.00 1.00 N ATOM 540 CA VAL A 36 108.609 -6.247 7.115 1.00 1.00 C ATOM 541 C VAL A 36 107.535 -7.021 7.877 1.00 1.00 C ATOM 542 O VAL A 36 107.761 -7.562 8.957 1.00 1.00 O ATOM 543 CB VAL A 36 109.922 -7.034 7.051 1.00 1.00 C ATOM 544 CG1 VAL A 36 110.599 -7.042 8.417 1.00 1.00 C ATOM 545 CG2 VAL A 36 109.650 -8.477 6.591 1.00 1.00 C ATOM 0 H VAL A 36 109.544 -4.914 8.449 1.00 1.00 H new ATOM 0 HA VAL A 36 108.226 -6.107 6.104 1.00 1.00 H new ATOM 0 HB VAL A 36 110.585 -6.551 6.333 1.00 1.00 H new ATOM 0 HG11 VAL A 36 111.531 -7.604 8.358 1.00 1.00 H new ATOM 0 HG12 VAL A 36 110.812 -6.018 8.723 1.00 1.00 H new ATOM 0 HG13 VAL A 36 109.939 -7.509 9.148 1.00 1.00 H new ATOM 0 HG21 VAL A 36 110.589 -9.029 6.549 1.00 1.00 H new ATOM 0 HG22 VAL A 36 108.976 -8.963 7.296 1.00 1.00 H new ATOM 0 HG23 VAL A 36 109.192 -8.463 5.602 1.00 1.00 H new ATOM 549 N ILE A 37 106.360 -7.085 7.283 1.00 1.00 N ATOM 550 CA ILE A 37 105.255 -7.811 7.880 1.00 1.00 C ATOM 551 C ILE A 37 105.547 -9.301 7.802 1.00 1.00 C ATOM 552 O ILE A 37 105.298 -10.058 8.741 1.00 1.00 O ATOM 553 CB ILE A 37 103.959 -7.513 7.121 1.00 1.00 C ATOM 554 CG1 ILE A 37 103.835 -6.014 6.817 1.00 1.00 C ATOM 555 CG2 ILE A 37 102.782 -7.953 7.966 1.00 1.00 C ATOM 556 CD1 ILE A 37 103.737 -5.158 8.077 1.00 1.00 C ATOM 0 H ILE A 37 106.145 -6.644 6.389 1.00 1.00 H new ATOM 0 HA ILE A 37 105.139 -7.502 8.919 1.00 1.00 H new ATOM 0 HB ILE A 37 103.972 -8.056 6.176 1.00 1.00 H new ATOM 0 HG12 ILE A 37 104.698 -5.694 6.233 1.00 1.00 H new ATOM 0 HG13 ILE A 37 102.952 -5.845 6.200 1.00 1.00 H new ATOM 0 HG21 ILE A 37 101.854 -7.745 7.434 1.00 1.00 H new ATOM 0 HG22 ILE A 37 102.855 -9.023 8.163 1.00 1.00 H new ATOM 0 HG23 ILE A 37 102.788 -7.409 8.910 1.00 1.00 H new ATOM 0 HD11 ILE A 37 103.651 -4.108 7.798 1.00 1.00 H new ATOM 0 HD12 ILE A 37 102.858 -5.454 8.650 1.00 1.00 H new ATOM 0 HD13 ILE A 37 104.631 -5.300 8.684 1.00 1.00 H new ATOM 563 N ASN A 38 106.061 -9.709 6.648 1.00 1.00 N ATOM 564 CA ASN A 38 106.377 -11.106 6.393 1.00 1.00 C ATOM 565 C ASN A 38 107.633 -11.225 5.544 1.00 1.00 C ATOM 566 O ASN A 38 107.722 -10.627 4.477 1.00 1.00 O ATOM 567 CB ASN A 38 105.212 -11.753 5.651 1.00 1.00 C ATOM 568 CG ASN A 38 103.997 -11.842 6.567 1.00 1.00 C ATOM 569 OD1 ASN A 38 103.172 -10.832 6.643 1.00 1.00 O flip ATOM 570 ND2 ASN A 38 103.798 -12.855 7.235 1.00 1.00 N flip ATOM 0 H ASN A 38 106.269 -9.085 5.869 1.00 1.00 H new ATOM 0 HA ASN A 38 106.547 -11.608 7.346 1.00 1.00 H new ATOM 0 HB2 ASN A 38 104.967 -11.170 4.763 1.00 1.00 H new ATOM 0 HB3 ASN A 38 105.495 -12.749 5.310 1.00 1.00 H new ATOM 0 HD21 ASN A 38 104.444 -13.642 7.173 1.00 1.00 H new ATOM 0 HD22 ASN A 38 102.987 -12.909 7.851 1.00 1.00 H new ATOM 577 N SER A 39 108.593 -12.010 6.008 1.00 1.00 N ATOM 578 CA SER A 39 109.828 -12.212 5.260 1.00 1.00 C ATOM 579 C SER A 39 109.649 -13.312 4.222 1.00 1.00 C ATOM 580 O SER A 39 109.231 -14.425 4.542 1.00 1.00 O ATOM 581 CB SER A 39 110.966 -12.583 6.199 1.00 1.00 C ATOM 582 OG SER A 39 110.872 -13.962 6.532 1.00 1.00 O ATOM 0 H SER A 39 108.544 -12.515 6.893 1.00 1.00 H new ATOM 0 HA SER A 39 110.072 -11.278 4.754 1.00 1.00 H new ATOM 0 HB2 SER A 39 111.926 -12.377 5.725 1.00 1.00 H new ATOM 0 HB3 SER A 39 110.920 -11.975 7.103 1.00 1.00 H new ATOM 0 HG SER A 39 110.062 -14.341 6.132 1.00 1.00 H new ATOM 588 N GLY A 40 109.981 -12.990 2.973 1.00 1.00 N ATOM 589 CA GLY A 40 109.873 -13.940 1.873 1.00 1.00 C ATOM 590 C GLY A 40 111.252 -14.240 1.302 1.00 1.00 C ATOM 591 O GLY A 40 111.549 -15.371 0.917 1.00 1.00 O ATOM 0 H GLY A 40 110.329 -12.071 2.699 1.00 1.00 H new ATOM 0 HA2 GLY A 40 109.408 -14.861 2.223 1.00 1.00 H new ATOM 0 HA3 GLY A 40 109.229 -13.533 1.093 1.00 1.00 H new ATOM 595 N ASN A 41 112.091 -13.211 1.265 1.00 1.00 N ATOM 596 CA ASN A 41 113.448 -13.345 0.754 1.00 1.00 C ATOM 597 C ASN A 41 113.449 -13.884 -0.675 1.00 1.00 C ATOM 598 O ASN A 41 114.387 -14.564 -1.090 1.00 1.00 O ATOM 599 CB ASN A 41 114.239 -14.273 1.671 1.00 1.00 C ATOM 600 CG ASN A 41 114.145 -13.766 3.109 1.00 1.00 C ATOM 601 OD1 ASN A 41 113.428 -12.703 3.370 1.00 1.00 O flip ATOM 602 ND2 ASN A 41 114.732 -14.354 4.016 1.00 1.00 N flip ATOM 0 H ASN A 41 111.853 -12.272 1.584 1.00 1.00 H new ATOM 0 HA ASN A 41 113.916 -12.361 0.736 1.00 1.00 H new ATOM 0 HB2 ASN A 41 113.847 -15.288 1.605 1.00 1.00 H new ATOM 0 HB3 ASN A 41 115.281 -14.313 1.355 1.00 1.00 H new ATOM 0 HD21 ASN A 41 115.290 -15.182 3.809 1.00 1.00 H new ATOM 0 HD22 ASN A 41 114.661 -14.013 4.975 1.00 1.00 H new ATOM 609 N GLY A 42 112.395 -13.567 -1.428 1.00 1.00 N ATOM 610 CA GLY A 42 112.281 -14.013 -2.810 1.00 1.00 C ATOM 611 C GLY A 42 112.872 -13.008 -3.781 1.00 1.00 C ATOM 612 O GLY A 42 113.666 -12.141 -3.416 1.00 1.00 O ATOM 0 H GLY A 42 111.610 -13.003 -1.101 1.00 1.00 H new ATOM 0 HA2 GLY A 42 112.789 -14.971 -2.925 1.00 1.00 H new ATOM 0 HA3 GLY A 42 111.231 -14.178 -3.053 1.00 1.00 H new ATOM 616 N VAL A 43 112.439 -13.134 -5.022 1.00 1.00 N ATOM 617 CA VAL A 43 112.869 -12.247 -6.082 1.00 1.00 C ATOM 618 C VAL A 43 112.282 -10.865 -5.853 1.00 1.00 C ATOM 619 O VAL A 43 111.571 -10.648 -4.885 1.00 1.00 O ATOM 620 CB VAL A 43 112.470 -12.788 -7.464 1.00 1.00 C ATOM 621 CG1 VAL A 43 113.026 -14.195 -7.626 1.00 1.00 C ATOM 622 CG2 VAL A 43 110.950 -12.828 -7.641 1.00 1.00 C ATOM 0 H VAL A 43 111.781 -13.853 -5.321 1.00 1.00 H new ATOM 0 HA VAL A 43 113.957 -12.184 -6.063 1.00 1.00 H new ATOM 0 HB VAL A 43 112.881 -12.119 -8.220 1.00 1.00 H new ATOM 0 HG11 VAL A 43 112.747 -14.586 -8.604 1.00 1.00 H new ATOM 0 HG12 VAL A 43 114.112 -14.169 -7.542 1.00 1.00 H new ATOM 0 HG13 VAL A 43 112.617 -14.840 -6.848 1.00 1.00 H new ATOM 0 HG21 VAL A 43 110.709 -13.216 -8.631 1.00 1.00 H new ATOM 0 HG22 VAL A 43 110.512 -13.475 -6.881 1.00 1.00 H new ATOM 0 HG23 VAL A 43 110.545 -11.821 -7.538 1.00 1.00 H new ATOM 626 N LYS A 44 112.575 -9.959 -6.766 1.00 1.00 N ATOM 627 CA LYS A 44 112.084 -8.578 -6.696 1.00 1.00 C ATOM 628 C LYS A 44 112.691 -7.771 -7.850 1.00 1.00 C ATOM 629 O LYS A 44 113.710 -8.161 -8.419 1.00 1.00 O ATOM 630 CB LYS A 44 112.402 -7.906 -5.322 1.00 1.00 C ATOM 631 CG LYS A 44 113.898 -7.530 -5.147 1.00 1.00 C ATOM 632 CD LYS A 44 114.678 -8.679 -4.459 1.00 1.00 C ATOM 633 CE LYS A 44 114.715 -8.487 -2.931 1.00 1.00 C ATOM 634 NZ LYS A 44 115.076 -9.781 -2.293 1.00 1.00 N ATOM 0 H LYS A 44 113.159 -10.150 -7.580 1.00 1.00 H new ATOM 0 HA LYS A 44 110.998 -8.596 -6.788 1.00 1.00 H new ATOM 0 HB2 LYS A 44 111.795 -7.007 -5.217 1.00 1.00 H new ATOM 0 HB3 LYS A 44 112.110 -8.583 -4.519 1.00 1.00 H new ATOM 0 HG2 LYS A 44 114.340 -7.316 -6.120 1.00 1.00 H new ATOM 0 HG3 LYS A 44 113.982 -6.620 -4.552 1.00 1.00 H new ATOM 0 HD2 LYS A 44 114.210 -9.634 -4.697 1.00 1.00 H new ATOM 0 HD3 LYS A 44 115.695 -8.716 -4.849 1.00 1.00 H new ATOM 0 HE2 LYS A 44 115.442 -7.719 -2.665 1.00 1.00 H new ATOM 0 HE3 LYS A 44 113.745 -8.146 -2.570 1.00 1.00 H new ATOM 0 HZ1 LYS A 44 115.237 -9.634 -1.276 1.00 1.00 H new ATOM 0 HZ2 LYS A 44 114.301 -10.462 -2.426 1.00 1.00 H new ATOM 0 HZ3 LYS A 44 115.943 -10.154 -2.730 1.00 1.00 H new ATOM 648 N PRO A 45 112.029 -6.711 -8.261 1.00 1.00 N ATOM 649 CA PRO A 45 112.452 -5.893 -9.436 1.00 1.00 C ATOM 650 C PRO A 45 113.432 -4.781 -9.130 1.00 1.00 C ATOM 651 O PRO A 45 113.529 -4.308 -8.010 1.00 1.00 O ATOM 652 CB PRO A 45 111.130 -5.298 -9.936 1.00 1.00 C ATOM 653 CG PRO A 45 110.221 -5.246 -8.742 1.00 1.00 C ATOM 654 CD PRO A 45 110.809 -6.147 -7.652 1.00 1.00 C ATOM 0 HA PRO A 45 112.990 -6.514 -10.152 1.00 1.00 H new ATOM 0 HB2 PRO A 45 111.283 -4.303 -10.353 1.00 1.00 H new ATOM 0 HB3 PRO A 45 110.700 -5.912 -10.727 1.00 1.00 H new ATOM 0 HG2 PRO A 45 110.128 -4.222 -8.379 1.00 1.00 H new ATOM 0 HG3 PRO A 45 109.219 -5.581 -9.012 1.00 1.00 H new ATOM 0 HD2 PRO A 45 111.041 -5.580 -6.750 1.00 1.00 H new ATOM 0 HD3 PRO A 45 110.109 -6.932 -7.365 1.00 1.00 H new ATOM 662 N GLY A 46 114.094 -4.314 -10.181 1.00 1.00 N ATOM 663 CA GLY A 46 114.995 -3.191 -10.062 1.00 1.00 C ATOM 664 C GLY A 46 114.222 -1.935 -10.384 1.00 1.00 C ATOM 665 O GLY A 46 113.089 -1.981 -10.863 1.00 1.00 O ATOM 0 H GLY A 46 114.019 -4.700 -11.122 1.00 1.00 H new ATOM 0 HA2 GLY A 46 115.406 -3.137 -9.054 1.00 1.00 H new ATOM 0 HA3 GLY A 46 115.838 -3.305 -10.744 1.00 1.00 H new ATOM 669 N LYS A 47 114.862 -0.832 -10.148 1.00 1.00 N ATOM 670 CA LYS A 47 114.290 0.465 -10.427 1.00 1.00 C ATOM 671 C LYS A 47 113.644 0.500 -11.794 1.00 1.00 C ATOM 672 O LYS A 47 112.773 1.324 -12.049 1.00 1.00 O ATOM 673 CB LYS A 47 115.402 1.523 -10.369 1.00 1.00 C ATOM 674 CG LYS A 47 116.438 1.282 -11.498 1.00 1.00 C ATOM 675 CD LYS A 47 117.094 -0.095 -11.321 1.00 1.00 C ATOM 676 CE LYS A 47 118.379 -0.189 -12.112 1.00 1.00 C ATOM 677 NZ LYS A 47 119.430 0.635 -11.447 1.00 1.00 N ATOM 0 H LYS A 47 115.802 -0.797 -9.754 1.00 1.00 H new ATOM 0 HA LYS A 47 113.522 0.671 -9.681 1.00 1.00 H new ATOM 0 HB2 LYS A 47 114.971 2.519 -10.469 1.00 1.00 H new ATOM 0 HB3 LYS A 47 115.897 1.486 -9.399 1.00 1.00 H new ATOM 0 HG2 LYS A 47 115.949 1.339 -12.470 1.00 1.00 H new ATOM 0 HG3 LYS A 47 117.199 2.062 -11.478 1.00 1.00 H new ATOM 0 HD2 LYS A 47 117.299 -0.271 -10.265 1.00 1.00 H new ATOM 0 HD3 LYS A 47 116.405 -0.874 -11.646 1.00 1.00 H new ATOM 0 HE2 LYS A 47 118.703 -1.228 -12.179 1.00 1.00 H new ATOM 0 HE3 LYS A 47 118.218 0.161 -13.132 1.00 1.00 H new ATOM 0 HZ1 LYS A 47 120.370 0.311 -11.752 1.00 1.00 H new ATOM 0 HZ2 LYS A 47 119.306 1.634 -11.710 1.00 1.00 H new ATOM 0 HZ3 LYS A 47 119.348 0.536 -10.415 1.00 1.00 H new ATOM 691 N SER A 48 114.106 -0.370 -12.686 1.00 1.00 N ATOM 692 CA SER A 48 113.593 -0.384 -14.062 1.00 1.00 C ATOM 693 C SER A 48 112.694 -1.581 -14.375 1.00 1.00 C ATOM 694 O SER A 48 112.054 -1.602 -15.425 1.00 1.00 O ATOM 695 CB SER A 48 114.782 -0.374 -15.019 1.00 1.00 C ATOM 696 OG SER A 48 115.388 0.912 -14.995 1.00 1.00 O ATOM 0 H SER A 48 114.824 -1.067 -12.491 1.00 1.00 H new ATOM 0 HA SER A 48 112.969 0.501 -14.184 1.00 1.00 H new ATOM 0 HB2 SER A 48 115.505 -1.136 -14.728 1.00 1.00 H new ATOM 0 HB3 SER A 48 114.453 -0.616 -16.030 1.00 1.00 H new ATOM 0 HG SER A 48 116.154 0.924 -15.607 1.00 1.00 H new ATOM 702 N ASP A 49 112.615 -2.571 -13.487 1.00 1.00 N ATOM 703 CA ASP A 49 111.741 -3.721 -13.764 1.00 1.00 C ATOM 704 C ASP A 49 110.329 -3.394 -13.310 1.00 1.00 C ATOM 705 O ASP A 49 110.122 -2.419 -12.589 1.00 1.00 O ATOM 706 CB ASP A 49 112.256 -4.982 -13.074 1.00 1.00 C ATOM 707 CG ASP A 49 113.493 -5.508 -13.800 1.00 1.00 C ATOM 708 OD1 ASP A 49 113.749 -5.047 -14.899 1.00 1.00 O ATOM 709 OD2 ASP A 49 114.168 -6.357 -13.243 1.00 1.00 O ATOM 0 H ASP A 49 113.121 -2.608 -12.602 1.00 1.00 H new ATOM 0 HA ASP A 49 111.739 -3.917 -14.836 1.00 1.00 H new ATOM 0 HB2 ASP A 49 112.500 -4.763 -12.034 1.00 1.00 H new ATOM 0 HB3 ASP A 49 111.478 -5.745 -13.065 1.00 1.00 H new ATOM 714 N THR A 50 109.351 -4.199 -13.731 1.00 1.00 N ATOM 715 CA THR A 50 107.957 -3.955 -13.349 1.00 1.00 C ATOM 716 C THR A 50 107.554 -4.947 -12.278 1.00 1.00 C ATOM 717 O THR A 50 108.081 -6.059 -12.223 1.00 1.00 O ATOM 718 CB THR A 50 107.029 -4.014 -14.575 1.00 1.00 C ATOM 719 OG1 THR A 50 107.607 -3.283 -15.644 1.00 1.00 O ATOM 720 CG2 THR A 50 105.672 -3.420 -14.239 1.00 1.00 C ATOM 0 H THR A 50 109.494 -5.014 -14.328 1.00 1.00 H new ATOM 0 HA THR A 50 107.861 -2.949 -12.939 1.00 1.00 H new ATOM 0 HB THR A 50 106.900 -5.056 -14.866 1.00 1.00 H new ATOM 0 HG1 THR A 50 107.016 -3.323 -16.425 1.00 1.00 H new ATOM 0 HG21 THR A 50 105.026 -3.469 -15.116 1.00 1.00 H new ATOM 0 HG22 THR A 50 105.220 -3.984 -13.424 1.00 1.00 H new ATOM 0 HG23 THR A 50 105.795 -2.380 -13.936 1.00 1.00 H new ATOM 728 N VAL A 51 106.681 -4.507 -11.375 1.00 1.00 N ATOM 729 CA VAL A 51 106.281 -5.335 -10.240 1.00 1.00 C ATOM 730 C VAL A 51 104.780 -5.524 -10.159 1.00 1.00 C ATOM 731 O VAL A 51 104.029 -4.734 -10.705 1.00 1.00 O ATOM 732 CB VAL A 51 106.780 -4.650 -8.963 1.00 1.00 C ATOM 733 CG1 VAL A 51 105.926 -3.433 -8.610 1.00 1.00 C ATOM 734 CG2 VAL A 51 106.784 -5.656 -7.822 1.00 1.00 C ATOM 0 H VAL A 51 106.239 -3.588 -11.406 1.00 1.00 H new ATOM 0 HA VAL A 51 106.717 -6.326 -10.362 1.00 1.00 H new ATOM 0 HB VAL A 51 107.795 -4.291 -9.133 1.00 1.00 H new ATOM 0 HG11 VAL A 51 106.308 -2.972 -7.699 1.00 1.00 H new ATOM 0 HG12 VAL A 51 105.966 -2.712 -9.426 1.00 1.00 H new ATOM 0 HG13 VAL A 51 104.894 -3.746 -8.452 1.00 1.00 H new ATOM 0 HG21 VAL A 51 107.138 -5.172 -6.912 1.00 1.00 H new ATOM 0 HG22 VAL A 51 105.773 -6.031 -7.664 1.00 1.00 H new ATOM 0 HG23 VAL A 51 107.444 -6.487 -8.072 1.00 1.00 H new ATOM 738 N THR A 52 104.359 -6.563 -9.433 1.00 1.00 N ATOM 739 CA THR A 52 102.933 -6.838 -9.233 1.00 1.00 C ATOM 740 C THR A 52 102.672 -6.970 -7.729 1.00 1.00 C ATOM 741 O THR A 52 103.285 -7.807 -7.069 1.00 1.00 O ATOM 742 CB THR A 52 102.576 -8.137 -9.951 1.00 1.00 C ATOM 743 OG1 THR A 52 102.873 -8.012 -11.334 1.00 1.00 O ATOM 744 CG2 THR A 52 101.098 -8.446 -9.776 1.00 1.00 C ATOM 0 H THR A 52 104.983 -7.227 -8.975 1.00 1.00 H new ATOM 0 HA THR A 52 102.321 -6.031 -9.636 1.00 1.00 H new ATOM 0 HB THR A 52 103.161 -8.950 -9.522 1.00 1.00 H new ATOM 0 HG1 THR A 52 103.213 -8.866 -11.674 1.00 1.00 H new ATOM 0 HG21 THR A 52 100.857 -9.375 -10.293 1.00 1.00 H new ATOM 0 HG22 THR A 52 100.872 -8.552 -8.715 1.00 1.00 H new ATOM 0 HG23 THR A 52 100.504 -7.633 -10.194 1.00 1.00 H new ATOM 752 N VAL A 53 101.811 -6.105 -7.175 1.00 1.00 N ATOM 753 CA VAL A 53 101.558 -6.116 -5.721 1.00 1.00 C ATOM 754 C VAL A 53 100.135 -5.688 -5.332 1.00 1.00 C ATOM 755 O VAL A 53 99.447 -5.028 -6.108 1.00 1.00 O ATOM 756 CB VAL A 53 102.532 -5.113 -5.078 1.00 1.00 C ATOM 757 CG1 VAL A 53 103.950 -5.371 -5.582 1.00 1.00 C ATOM 758 CG2 VAL A 53 102.142 -3.658 -5.468 1.00 1.00 C ATOM 0 H VAL A 53 101.286 -5.402 -7.695 1.00 1.00 H new ATOM 0 HA VAL A 53 101.691 -7.142 -5.377 1.00 1.00 H new ATOM 0 HB VAL A 53 102.483 -5.237 -3.996 1.00 1.00 H new ATOM 0 HG11 VAL A 53 104.635 -4.658 -5.123 1.00 1.00 H new ATOM 0 HG12 VAL A 53 104.251 -6.385 -5.318 1.00 1.00 H new ATOM 0 HG13 VAL A 53 103.978 -5.255 -6.665 1.00 1.00 H new ATOM 0 HG21 VAL A 53 102.839 -2.958 -5.007 1.00 1.00 H new ATOM 0 HG22 VAL A 53 102.182 -3.549 -6.552 1.00 1.00 H new ATOM 0 HG23 VAL A 53 101.131 -3.446 -5.119 1.00 1.00 H new ATOM 762 N GLU A 54 99.755 -5.960 -4.065 1.00 1.00 N ATOM 763 CA GLU A 54 98.463 -5.494 -3.527 1.00 1.00 C ATOM 764 C GLU A 54 98.784 -4.569 -2.351 1.00 1.00 C ATOM 765 O GLU A 54 99.840 -4.719 -1.738 1.00 1.00 O ATOM 766 CB GLU A 54 97.562 -6.634 -3.010 1.00 1.00 C ATOM 767 CG GLU A 54 97.511 -7.830 -3.978 1.00 1.00 C ATOM 768 CD GLU A 54 97.251 -9.142 -3.229 1.00 1.00 C ATOM 769 OE1 GLU A 54 97.277 -10.177 -3.874 1.00 1.00 O ATOM 770 OE2 GLU A 54 97.031 -9.095 -2.030 1.00 1.00 O ATOM 0 H GLU A 54 100.319 -6.494 -3.404 1.00 1.00 H new ATOM 0 HA GLU A 54 97.917 -5.003 -4.332 1.00 1.00 H new ATOM 0 HB2 GLU A 54 97.928 -6.971 -2.040 1.00 1.00 H new ATOM 0 HB3 GLU A 54 96.553 -6.253 -2.855 1.00 1.00 H new ATOM 0 HG2 GLU A 54 96.726 -7.669 -4.717 1.00 1.00 H new ATOM 0 HG3 GLU A 54 98.453 -7.900 -4.523 1.00 1.00 H new ATOM 777 N TYR A 55 97.927 -3.582 -2.049 1.00 1.00 N ATOM 778 CA TYR A 55 98.265 -2.667 -0.964 1.00 1.00 C ATOM 779 C TYR A 55 97.090 -1.832 -0.447 1.00 1.00 C ATOM 780 O TYR A 55 96.100 -1.619 -1.146 1.00 1.00 O ATOM 781 CB TYR A 55 99.292 -1.699 -1.523 1.00 1.00 C ATOM 782 CG TYR A 55 98.698 -1.120 -2.780 1.00 1.00 C ATOM 783 CD1 TYR A 55 97.832 -0.023 -2.709 1.00 1.00 C ATOM 784 CD2 TYR A 55 98.987 -1.700 -4.016 1.00 1.00 C ATOM 785 CE1 TYR A 55 97.257 0.494 -3.874 1.00 1.00 C ATOM 786 CE2 TYR A 55 98.413 -1.183 -5.180 1.00 1.00 C ATOM 787 CZ TYR A 55 97.547 -0.087 -5.110 1.00 1.00 C ATOM 788 OH TYR A 55 96.981 0.422 -6.261 1.00 1.00 O ATOM 0 H TYR A 55 97.038 -3.406 -2.518 1.00 1.00 H new ATOM 0 HA TYR A 55 98.614 -3.269 -0.125 1.00 1.00 H new ATOM 0 HB2 TYR A 55 99.516 -0.913 -0.802 1.00 1.00 H new ATOM 0 HB3 TYR A 55 100.230 -2.211 -1.738 1.00 1.00 H new ATOM 0 HD1 TYR A 55 97.607 0.425 -1.752 1.00 1.00 H new ATOM 0 HD2 TYR A 55 99.654 -2.548 -4.073 1.00 1.00 H new ATOM 0 HE1 TYR A 55 96.590 1.341 -3.818 1.00 1.00 H new ATOM 0 HE2 TYR A 55 98.639 -1.631 -6.137 1.00 1.00 H new ATOM 0 HH TYR A 55 97.288 -0.097 -7.034 1.00 1.00 H new ATOM 798 N THR A 56 97.270 -1.279 0.769 1.00 1.00 N ATOM 799 CA THR A 56 96.281 -0.368 1.363 1.00 1.00 C ATOM 800 C THR A 56 96.968 0.946 1.697 1.00 1.00 C ATOM 801 O THR A 56 97.989 0.967 2.366 1.00 1.00 O ATOM 802 CB THR A 56 95.573 -0.964 2.596 1.00 1.00 C ATOM 803 OG1 THR A 56 94.535 -1.828 2.164 1.00 1.00 O ATOM 804 CG2 THR A 56 94.935 0.144 3.448 1.00 1.00 C ATOM 0 H THR A 56 98.088 -1.448 1.354 1.00 1.00 H new ATOM 0 HA THR A 56 95.490 -0.200 0.632 1.00 1.00 H new ATOM 0 HB THR A 56 96.314 -1.501 3.188 1.00 1.00 H new ATOM 0 HG1 THR A 56 94.324 -2.468 2.876 1.00 1.00 H new ATOM 0 HG21 THR A 56 94.441 -0.300 4.312 1.00 1.00 H new ATOM 0 HG22 THR A 56 95.708 0.833 3.787 1.00 1.00 H new ATOM 0 HG23 THR A 56 94.202 0.686 2.850 1.00 1.00 H new ATOM 812 N GLY A 57 96.404 2.048 1.216 1.00 1.00 N ATOM 813 CA GLY A 57 96.998 3.370 1.462 1.00 1.00 C ATOM 814 C GLY A 57 96.138 4.210 2.387 1.00 1.00 C ATOM 815 O GLY A 57 94.919 4.267 2.224 1.00 1.00 O ATOM 0 H GLY A 57 95.549 2.061 0.661 1.00 1.00 H new ATOM 0 HA2 GLY A 57 97.989 3.248 1.898 1.00 1.00 H new ATOM 0 HA3 GLY A 57 97.129 3.892 0.514 1.00 1.00 H new ATOM 819 N ARG A 58 96.774 4.888 3.352 1.00 1.00 N ATOM 820 CA ARG A 58 96.028 5.735 4.270 1.00 1.00 C ATOM 821 C ARG A 58 96.825 6.952 4.713 1.00 1.00 C ATOM 822 O ARG A 58 98.044 7.022 4.555 1.00 1.00 O ATOM 823 CB ARG A 58 95.568 4.945 5.506 1.00 1.00 C ATOM 824 CG ARG A 58 96.724 4.749 6.519 1.00 1.00 C ATOM 825 CD ARG A 58 96.187 4.143 7.821 1.00 1.00 C ATOM 826 NE ARG A 58 96.162 2.680 7.720 1.00 1.00 N ATOM 827 CZ ARG A 58 95.069 1.952 7.983 1.00 1.00 C ATOM 828 NH1 ARG A 58 93.939 2.524 8.303 1.00 1.00 N ATOM 829 NH2 ARG A 58 95.132 0.651 7.904 1.00 1.00 N ATOM 0 H ARG A 58 97.781 4.864 3.510 1.00 1.00 H new ATOM 0 HA ARG A 58 95.154 6.085 3.720 1.00 1.00 H new ATOM 0 HB2 ARG A 58 94.745 5.471 5.989 1.00 1.00 H new ATOM 0 HB3 ARG A 58 95.186 3.972 5.196 1.00 1.00 H new ATOM 0 HG2 ARG A 58 97.485 4.096 6.092 1.00 1.00 H new ATOM 0 HG3 ARG A 58 97.204 5.706 6.725 1.00 1.00 H new ATOM 0 HD2 ARG A 58 96.814 4.447 8.659 1.00 1.00 H new ATOM 0 HD3 ARG A 58 95.184 4.519 8.020 1.00 1.00 H new ATOM 0 HE ARG A 58 97.014 2.196 7.437 1.00 1.00 H new ATOM 0 HH11 ARG A 58 93.879 3.541 8.356 1.00 1.00 H new ATOM 0 HH12 ARG A 58 93.117 1.954 8.500 1.00 1.00 H new ATOM 0 HH21 ARG A 58 96.008 0.198 7.644 1.00 1.00 H new ATOM 0 HH22 ARG A 58 94.305 0.087 8.102 1.00 1.00 H new ATOM 843 N LEU A 59 96.101 7.884 5.313 1.00 1.00 N ATOM 844 CA LEU A 59 96.685 9.106 5.851 1.00 1.00 C ATOM 845 C LEU A 59 97.253 8.845 7.246 1.00 1.00 C ATOM 846 O LEU A 59 96.912 7.859 7.900 1.00 1.00 O ATOM 847 CB LEU A 59 95.587 10.189 5.951 1.00 1.00 C ATOM 848 CG LEU A 59 95.609 11.160 4.755 1.00 1.00 C ATOM 849 CD1 LEU A 59 94.942 10.528 3.547 1.00 1.00 C ATOM 850 CD2 LEU A 59 94.853 12.449 5.101 1.00 1.00 C ATOM 0 H LEU A 59 95.091 7.816 5.441 1.00 1.00 H new ATOM 0 HA LEU A 59 97.486 9.440 5.192 1.00 1.00 H new ATOM 0 HB2 LEU A 59 94.610 9.708 6.007 1.00 1.00 H new ATOM 0 HB3 LEU A 59 95.719 10.752 6.875 1.00 1.00 H new ATOM 0 HG LEU A 59 96.651 11.387 4.528 1.00 1.00 H new ATOM 0 HD11 LEU A 59 94.966 11.227 2.711 1.00 1.00 H new ATOM 0 HD12 LEU A 59 95.473 9.617 3.273 1.00 1.00 H new ATOM 0 HD13 LEU A 59 93.907 10.286 3.788 1.00 1.00 H new ATOM 0 HD21 LEU A 59 94.877 13.125 4.247 1.00 1.00 H new ATOM 0 HD22 LEU A 59 93.818 12.209 5.345 1.00 1.00 H new ATOM 0 HD23 LEU A 59 95.326 12.929 5.957 1.00 1.00 H new ATOM 862 N ILE A 60 98.087 9.769 7.695 1.00 1.00 N ATOM 863 CA ILE A 60 98.680 9.691 9.026 1.00 1.00 C ATOM 864 C ILE A 60 97.593 9.698 10.083 1.00 1.00 C ATOM 865 O ILE A 60 97.785 9.261 11.218 1.00 1.00 O ATOM 866 CB ILE A 60 99.606 10.898 9.268 1.00 1.00 C ATOM 867 CG1 ILE A 60 98.835 12.229 9.468 1.00 1.00 C ATOM 868 CG2 ILE A 60 100.562 11.064 8.102 1.00 1.00 C ATOM 869 CD1 ILE A 60 98.075 12.648 8.219 1.00 1.00 C ATOM 0 H ILE A 60 98.372 10.587 7.156 1.00 1.00 H new ATOM 0 HA ILE A 60 99.254 8.766 9.090 1.00 1.00 H new ATOM 0 HB ILE A 60 100.147 10.685 10.190 1.00 1.00 H new ATOM 0 HG12 ILE A 60 98.136 12.120 10.297 1.00 1.00 H new ATOM 0 HG13 ILE A 60 99.537 13.015 9.744 1.00 1.00 H new ATOM 0 HG21 ILE A 60 101.212 11.920 8.283 1.00 1.00 H new ATOM 0 HG22 ILE A 60 101.168 10.164 7.997 1.00 1.00 H new ATOM 0 HG23 ILE A 60 99.994 11.227 7.186 1.00 1.00 H new ATOM 0 HD11 ILE A 60 97.552 13.585 8.409 1.00 1.00 H new ATOM 0 HD12 ILE A 60 98.776 12.784 7.395 1.00 1.00 H new ATOM 0 HD13 ILE A 60 97.352 11.875 7.957 1.00 1.00 H new ATOM 876 N ASP A 61 96.472 10.260 9.689 1.00 1.00 N ATOM 877 CA ASP A 61 95.317 10.423 10.564 1.00 1.00 C ATOM 878 C ASP A 61 94.343 9.258 10.436 1.00 1.00 C ATOM 879 O ASP A 61 93.294 9.245 11.080 1.00 1.00 O ATOM 880 CB ASP A 61 94.619 11.730 10.197 1.00 1.00 C ATOM 881 CG ASP A 61 93.620 12.120 11.282 1.00 1.00 C ATOM 882 OD1 ASP A 61 94.046 12.332 12.405 1.00 1.00 O ATOM 883 OD2 ASP A 61 92.444 12.204 10.971 1.00 1.00 O ATOM 0 H ASP A 61 96.328 10.622 8.746 1.00 1.00 H new ATOM 0 HA ASP A 61 95.658 10.445 11.599 1.00 1.00 H new ATOM 0 HB2 ASP A 61 95.358 12.522 10.072 1.00 1.00 H new ATOM 0 HB3 ASP A 61 94.105 11.620 9.242 1.00 1.00 H new ATOM 888 N GLY A 62 94.698 8.273 9.619 1.00 1.00 N ATOM 889 CA GLY A 62 93.849 7.101 9.435 1.00 1.00 C ATOM 890 C GLY A 62 92.868 7.259 8.275 1.00 1.00 C ATOM 891 O GLY A 62 92.149 6.316 7.946 1.00 1.00 O ATOM 0 H GLY A 62 95.562 8.262 9.077 1.00 1.00 H new ATOM 0 HA2 GLY A 62 94.476 6.227 9.258 1.00 1.00 H new ATOM 0 HA3 GLY A 62 93.292 6.913 10.353 1.00 1.00 H new ATOM 895 N THR A 63 92.830 8.434 7.652 1.00 1.00 N ATOM 896 CA THR A 63 91.909 8.631 6.533 1.00 1.00 C ATOM 897 C THR A 63 92.362 7.816 5.329 1.00 1.00 C ATOM 898 O THR A 63 93.327 8.172 4.655 1.00 1.00 O ATOM 899 CB THR A 63 91.827 10.110 6.148 1.00 1.00 C ATOM 900 OG1 THR A 63 91.708 10.904 7.320 1.00 1.00 O ATOM 901 CG2 THR A 63 90.613 10.337 5.253 1.00 1.00 C ATOM 0 H THR A 63 93.406 9.241 7.891 1.00 1.00 H new ATOM 0 HA THR A 63 90.920 8.296 6.847 1.00 1.00 H new ATOM 0 HB THR A 63 92.732 10.393 5.611 1.00 1.00 H new ATOM 0 HG1 THR A 63 91.657 11.850 7.070 1.00 1.00 H new ATOM 0 HG21 THR A 63 90.555 11.390 4.979 1.00 1.00 H new ATOM 0 HG22 THR A 63 90.708 9.732 4.351 1.00 1.00 H new ATOM 0 HG23 THR A 63 89.708 10.051 5.788 1.00 1.00 H new ATOM 909 N VAL A 64 91.664 6.718 5.065 1.00 1.00 N ATOM 910 CA VAL A 64 92.015 5.866 3.937 1.00 1.00 C ATOM 911 C VAL A 64 91.615 6.520 2.637 1.00 1.00 C ATOM 912 O VAL A 64 90.448 6.848 2.422 1.00 1.00 O ATOM 913 CB VAL A 64 91.361 4.494 4.085 1.00 1.00 C ATOM 914 CG1 VAL A 64 91.700 3.602 2.888 1.00 1.00 C ATOM 915 CG2 VAL A 64 91.874 3.850 5.360 1.00 1.00 C ATOM 0 H VAL A 64 90.862 6.400 5.609 1.00 1.00 H new ATOM 0 HA VAL A 64 93.096 5.727 3.925 1.00 1.00 H new ATOM 0 HB VAL A 64 90.278 4.613 4.128 1.00 1.00 H new ATOM 0 HG11 VAL A 64 91.224 2.629 3.013 1.00 1.00 H new ATOM 0 HG12 VAL A 64 91.337 4.068 1.972 1.00 1.00 H new ATOM 0 HG13 VAL A 64 92.780 3.472 2.825 1.00 1.00 H new ATOM 0 HG21 VAL A 64 91.416 2.868 5.481 1.00 1.00 H new ATOM 0 HG22 VAL A 64 92.957 3.741 5.302 1.00 1.00 H new ATOM 0 HG23 VAL A 64 91.618 4.478 6.213 1.00 1.00 H new ATOM 919 N PHE A 65 92.612 6.713 1.768 1.00 1.00 N ATOM 920 CA PHE A 65 92.376 7.345 0.471 1.00 1.00 C ATOM 921 C PHE A 65 92.534 6.361 -0.670 1.00 1.00 C ATOM 922 O PHE A 65 92.100 6.626 -1.791 1.00 1.00 O ATOM 923 CB PHE A 65 93.330 8.523 0.279 1.00 1.00 C ATOM 924 CG PHE A 65 94.760 8.073 0.079 1.00 1.00 C ATOM 925 CD1 PHE A 65 95.516 7.707 1.189 1.00 1.00 C ATOM 926 CD2 PHE A 65 95.351 8.092 -1.195 1.00 1.00 C ATOM 927 CE1 PHE A 65 96.864 7.365 1.042 1.00 1.00 C ATOM 928 CE2 PHE A 65 96.699 7.735 -1.341 1.00 1.00 C ATOM 929 CZ PHE A 65 97.452 7.380 -0.219 1.00 1.00 C ATOM 0 H PHE A 65 93.581 6.443 1.939 1.00 1.00 H new ATOM 0 HA PHE A 65 91.347 7.704 0.461 1.00 1.00 H new ATOM 0 HB2 PHE A 65 93.012 9.110 -0.583 1.00 1.00 H new ATOM 0 HB3 PHE A 65 93.275 9.178 1.148 1.00 1.00 H new ATOM 0 HD1 PHE A 65 95.060 7.687 2.168 1.00 1.00 H new ATOM 0 HD2 PHE A 65 94.770 8.380 -2.058 1.00 1.00 H new ATOM 0 HE1 PHE A 65 97.449 7.089 1.907 1.00 1.00 H new ATOM 0 HE2 PHE A 65 97.155 7.734 -2.320 1.00 1.00 H new ATOM 0 HZ PHE A 65 98.493 7.116 -0.331 1.00 1.00 H new ATOM 939 N ASP A 66 93.150 5.224 -0.386 1.00 1.00 N ATOM 940 CA ASP A 66 93.347 4.208 -1.412 1.00 1.00 C ATOM 941 C ASP A 66 93.499 2.830 -0.788 1.00 1.00 C ATOM 942 O ASP A 66 94.035 2.694 0.311 1.00 1.00 O ATOM 943 CB ASP A 66 94.587 4.550 -2.240 1.00 1.00 C ATOM 944 CG ASP A 66 94.655 3.657 -3.474 1.00 1.00 C ATOM 945 OD1 ASP A 66 95.545 3.863 -4.283 1.00 1.00 O ATOM 946 OD2 ASP A 66 93.817 2.777 -3.591 1.00 1.00 O ATOM 0 H ASP A 66 93.519 4.982 0.534 1.00 1.00 H new ATOM 0 HA ASP A 66 92.471 4.192 -2.060 1.00 1.00 H new ATOM 0 HB2 ASP A 66 94.556 5.597 -2.541 1.00 1.00 H new ATOM 0 HB3 ASP A 66 95.485 4.418 -1.636 1.00 1.00 H new ATOM 951 N SER A 67 93.026 1.806 -1.499 1.00 1.00 N ATOM 952 CA SER A 67 93.122 0.439 -1.000 1.00 1.00 C ATOM 953 C SER A 67 93.128 -0.574 -2.137 1.00 1.00 C ATOM 954 O SER A 67 92.593 -0.315 -3.216 1.00 1.00 O ATOM 955 CB SER A 67 91.979 0.151 -0.037 1.00 1.00 C ATOM 956 OG SER A 67 90.748 0.168 -0.747 1.00 1.00 O ATOM 0 H SER A 67 92.578 1.897 -2.411 1.00 1.00 H new ATOM 0 HA SER A 67 94.069 0.342 -0.469 1.00 1.00 H new ATOM 0 HB2 SER A 67 92.124 -0.819 0.438 1.00 1.00 H new ATOM 0 HB3 SER A 67 91.963 0.896 0.759 1.00 1.00 H new ATOM 0 HG SER A 67 90.011 -0.019 -0.129 1.00 1.00 H new ATOM 962 N THR A 68 93.754 -1.730 -1.890 1.00 1.00 N ATOM 963 CA THR A 68 93.840 -2.776 -2.912 1.00 1.00 C ATOM 964 C THR A 68 94.054 -4.146 -2.284 1.00 1.00 C ATOM 965 O THR A 68 93.511 -5.146 -2.750 1.00 1.00 O ATOM 966 CB THR A 68 94.997 -2.477 -3.863 1.00 1.00 C ATOM 967 OG1 THR A 68 94.797 -1.208 -4.466 1.00 1.00 O ATOM 968 CG2 THR A 68 95.069 -3.547 -4.953 1.00 1.00 C ATOM 0 H THR A 68 94.202 -1.962 -1.004 1.00 1.00 H new ATOM 0 HA THR A 68 92.897 -2.787 -3.459 1.00 1.00 H new ATOM 0 HB THR A 68 95.930 -2.476 -3.299 1.00 1.00 H new ATOM 0 HG1 THR A 68 95.630 -0.694 -4.430 1.00 1.00 H new ATOM 0 HG21 THR A 68 95.897 -3.325 -5.626 1.00 1.00 H new ATOM 0 HG22 THR A 68 95.226 -4.523 -4.495 1.00 1.00 H new ATOM 0 HG23 THR A 68 94.136 -3.556 -5.516 1.00 1.00 H new ATOM 976 N GLU A 69 94.852 -4.188 -1.231 1.00 1.00 N ATOM 977 CA GLU A 69 95.126 -5.444 -0.552 1.00 1.00 C ATOM 978 C GLU A 69 93.864 -5.974 0.097 1.00 1.00 C ATOM 979 O GLU A 69 93.701 -7.182 0.263 1.00 1.00 O ATOM 980 CB GLU A 69 96.257 -5.289 0.446 1.00 1.00 C ATOM 981 CG GLU A 69 95.948 -4.198 1.448 1.00 1.00 C ATOM 982 CD GLU A 69 94.984 -4.700 2.521 1.00 1.00 C ATOM 983 OE1 GLU A 69 94.728 -5.892 2.554 1.00 1.00 O ATOM 984 OE2 GLU A 69 94.522 -3.884 3.301 1.00 1.00 O ATOM 0 H GLU A 69 95.318 -3.375 -0.830 1.00 1.00 H new ATOM 0 HA GLU A 69 95.454 -6.177 -1.289 1.00 1.00 H new ATOM 0 HB2 GLU A 69 96.419 -6.232 0.968 1.00 1.00 H new ATOM 0 HB3 GLU A 69 97.182 -5.053 -0.080 1.00 1.00 H new ATOM 0 HG2 GLU A 69 96.871 -3.855 1.915 1.00 1.00 H new ATOM 0 HG3 GLU A 69 95.513 -3.340 0.935 1.00 1.00 H new ATOM 991 N LYS A 70 92.959 -5.064 0.433 1.00 1.00 N ATOM 992 CA LYS A 70 91.702 -5.458 1.031 1.00 1.00 C ATOM 993 C LYS A 70 91.008 -6.418 0.084 1.00 1.00 C ATOM 994 O LYS A 70 90.437 -7.427 0.497 1.00 1.00 O ATOM 995 CB LYS A 70 90.837 -4.224 1.272 1.00 1.00 C ATOM 996 CG LYS A 70 91.551 -3.301 2.253 1.00 1.00 C ATOM 997 CD LYS A 70 91.582 -3.921 3.660 1.00 1.00 C ATOM 998 CE LYS A 70 91.916 -2.836 4.679 1.00 1.00 C ATOM 999 NZ LYS A 70 91.865 -3.410 6.054 1.00 1.00 N ATOM 0 H LYS A 70 93.075 -4.059 0.301 1.00 1.00 H new ATOM 0 HA LYS A 70 91.872 -5.946 1.991 1.00 1.00 H new ATOM 0 HB2 LYS A 70 90.653 -3.704 0.332 1.00 1.00 H new ATOM 0 HB3 LYS A 70 89.865 -4.517 1.670 1.00 1.00 H new ATOM 0 HG2 LYS A 70 92.569 -3.115 1.910 1.00 1.00 H new ATOM 0 HG3 LYS A 70 91.045 -2.336 2.287 1.00 1.00 H new ATOM 0 HD2 LYS A 70 90.617 -4.371 3.893 1.00 1.00 H new ATOM 0 HD3 LYS A 70 92.324 -4.718 3.703 1.00 1.00 H new ATOM 0 HE2 LYS A 70 92.907 -2.429 4.480 1.00 1.00 H new ATOM 0 HE3 LYS A 70 91.209 -2.011 4.592 1.00 1.00 H new ATOM 0 HZ1 LYS A 70 92.093 -2.670 6.748 1.00 1.00 H new ATOM 0 HZ2 LYS A 70 90.911 -3.778 6.241 1.00 1.00 H new ATOM 0 HZ3 LYS A 70 92.556 -4.183 6.133 1.00 1.00 H new ATOM 1013 N THR A 71 91.110 -6.108 -1.199 1.00 1.00 N ATOM 1014 CA THR A 71 90.549 -6.956 -2.234 1.00 1.00 C ATOM 1015 C THR A 71 91.528 -8.094 -2.511 1.00 1.00 C ATOM 1016 O THR A 71 91.137 -9.186 -2.920 1.00 1.00 O ATOM 1017 CB THR A 71 90.305 -6.146 -3.513 1.00 1.00 C ATOM 1018 OG1 THR A 71 91.438 -5.340 -3.789 1.00 1.00 O ATOM 1019 CG2 THR A 71 89.074 -5.249 -3.339 1.00 1.00 C ATOM 0 H THR A 71 91.578 -5.272 -1.547 1.00 1.00 H new ATOM 0 HA THR A 71 89.593 -7.360 -1.901 1.00 1.00 H new ATOM 0 HB THR A 71 90.134 -6.834 -4.341 1.00 1.00 H new ATOM 0 HG1 THR A 71 92.212 -5.685 -3.298 1.00 1.00 H new ATOM 0 HG21 THR A 71 88.908 -4.677 -4.252 1.00 1.00 H new ATOM 0 HG22 THR A 71 88.200 -5.867 -3.134 1.00 1.00 H new ATOM 0 HG23 THR A 71 89.238 -4.564 -2.507 1.00 1.00 H new ATOM 1027 N GLY A 72 92.809 -7.818 -2.254 1.00 1.00 N ATOM 1028 CA GLY A 72 93.863 -8.804 -2.444 1.00 1.00 C ATOM 1029 C GLY A 72 94.210 -8.968 -3.915 1.00 1.00 C ATOM 1030 O GLY A 72 94.824 -9.958 -4.310 1.00 1.00 O ATOM 0 H GLY A 72 93.137 -6.915 -1.913 1.00 1.00 H new ATOM 0 HA2 GLY A 72 94.752 -8.500 -1.891 1.00 1.00 H new ATOM 0 HA3 GLY A 72 93.545 -9.763 -2.035 1.00 1.00 H new ATOM 1034 N LYS A 73 93.799 -7.999 -4.726 1.00 1.00 N ATOM 1035 CA LYS A 73 94.064 -8.062 -6.172 1.00 1.00 C ATOM 1036 C LYS A 73 95.306 -7.238 -6.524 1.00 1.00 C ATOM 1037 O LYS A 73 95.303 -6.020 -6.346 1.00 1.00 O ATOM 1038 CB LYS A 73 92.827 -7.515 -6.929 1.00 1.00 C ATOM 1039 CG LYS A 73 91.863 -8.650 -7.330 1.00 1.00 C ATOM 1040 CD LYS A 73 90.962 -9.029 -6.142 1.00 1.00 C ATOM 1041 CE LYS A 73 90.428 -10.450 -6.312 1.00 1.00 C ATOM 1042 NZ LYS A 73 91.567 -11.401 -6.460 1.00 1.00 N ATOM 0 H LYS A 73 93.289 -7.170 -4.420 1.00 1.00 H new ATOM 0 HA LYS A 73 94.249 -9.096 -6.465 1.00 1.00 H new ATOM 0 HB2 LYS A 73 92.303 -6.796 -6.300 1.00 1.00 H new ATOM 0 HB3 LYS A 73 93.152 -6.980 -7.821 1.00 1.00 H new ATOM 0 HG2 LYS A 73 91.250 -8.334 -8.174 1.00 1.00 H new ATOM 0 HG3 LYS A 73 92.431 -9.521 -7.657 1.00 1.00 H new ATOM 0 HD2 LYS A 73 91.525 -8.954 -5.212 1.00 1.00 H new ATOM 0 HD3 LYS A 73 90.131 -8.327 -6.069 1.00 1.00 H new ATOM 0 HE2 LYS A 73 89.821 -10.726 -5.450 1.00 1.00 H new ATOM 0 HE3 LYS A 73 89.781 -10.503 -7.188 1.00 1.00 H new ATOM 0 HZ1 LYS A 73 91.377 -12.259 -5.904 1.00 1.00 H new ATOM 0 HZ2 LYS A 73 91.679 -11.655 -7.462 1.00 1.00 H new ATOM 0 HZ3 LYS A 73 92.440 -10.953 -6.117 1.00 1.00 H new ATOM 1056 N PRO A 74 96.382 -7.866 -6.994 1.00 1.00 N ATOM 1057 CA PRO A 74 97.636 -7.136 -7.329 1.00 1.00 C ATOM 1058 C PRO A 74 97.486 -6.099 -8.436 1.00 1.00 C ATOM 1059 O PRO A 74 96.628 -6.210 -9.312 1.00 1.00 O ATOM 1060 CB PRO A 74 98.618 -8.239 -7.752 1.00 1.00 C ATOM 1061 CG PRO A 74 98.058 -9.491 -7.193 1.00 1.00 C ATOM 1062 CD PRO A 74 96.565 -9.318 -7.245 1.00 1.00 C ATOM 0 HA PRO A 74 97.969 -6.553 -6.471 1.00 1.00 H new ATOM 0 HB2 PRO A 74 98.703 -8.296 -8.837 1.00 1.00 H new ATOM 0 HB3 PRO A 74 99.618 -8.047 -7.363 1.00 1.00 H new ATOM 0 HG2 PRO A 74 98.374 -10.357 -7.775 1.00 1.00 H new ATOM 0 HG3 PRO A 74 98.400 -9.652 -6.171 1.00 1.00 H new ATOM 0 HD2 PRO A 74 96.159 -9.614 -8.212 1.00 1.00 H new ATOM 0 HD3 PRO A 74 96.063 -9.923 -6.490 1.00 1.00 H new ATOM 1070 N ALA A 75 98.372 -5.111 -8.382 1.00 1.00 N ATOM 1071 CA ALA A 75 98.425 -4.036 -9.373 1.00 1.00 C ATOM 1072 C ALA A 75 99.845 -3.964 -9.931 1.00 1.00 C ATOM 1073 O ALA A 75 100.795 -4.311 -9.231 1.00 1.00 O ATOM 1074 CB ALA A 75 98.049 -2.704 -8.723 1.00 1.00 C ATOM 0 H ALA A 75 99.077 -5.030 -7.649 1.00 1.00 H new ATOM 0 HA ALA A 75 97.718 -4.236 -10.178 1.00 1.00 H new ATOM 0 HB1 ALA A 75 98.092 -1.910 -9.469 1.00 1.00 H new ATOM 0 HB2 ALA A 75 97.039 -2.769 -8.319 1.00 1.00 H new ATOM 0 HB3 ALA A 75 98.748 -2.482 -7.917 1.00 1.00 H new ATOM 1080 N THR A 76 100.006 -3.531 -11.184 1.00 1.00 N ATOM 1081 CA THR A 76 101.348 -3.463 -11.783 1.00 1.00 C ATOM 1082 C THR A 76 101.890 -2.044 -11.868 1.00 1.00 C ATOM 1083 O THR A 76 101.198 -1.120 -12.297 1.00 1.00 O ATOM 1084 CB THR A 76 101.337 -4.082 -13.178 1.00 1.00 C ATOM 1085 OG1 THR A 76 102.540 -3.737 -13.853 1.00 1.00 O ATOM 1086 CG2 THR A 76 100.138 -3.567 -13.977 1.00 1.00 C ATOM 0 H THR A 76 99.246 -3.228 -11.794 1.00 1.00 H new ATOM 0 HA THR A 76 102.008 -4.027 -11.124 1.00 1.00 H new ATOM 0 HB THR A 76 101.260 -5.165 -13.087 1.00 1.00 H new ATOM 0 HG1 THR A 76 102.538 -4.134 -14.749 1.00 1.00 H new ATOM 0 HG21 THR A 76 100.142 -4.016 -14.970 1.00 1.00 H new ATOM 0 HG22 THR A 76 99.215 -3.834 -13.462 1.00 1.00 H new ATOM 0 HG23 THR A 76 100.201 -2.483 -14.069 1.00 1.00 H new ATOM 1094 N PHE A 77 103.160 -1.898 -11.468 1.00 1.00 N ATOM 1095 CA PHE A 77 103.844 -0.608 -11.507 1.00 1.00 C ATOM 1096 C PHE A 77 105.275 -0.783 -11.904 1.00 1.00 C ATOM 1097 O PHE A 77 105.922 -1.761 -11.538 1.00 1.00 O ATOM 1098 CB PHE A 77 103.885 0.048 -10.134 1.00 1.00 C ATOM 1099 CG PHE A 77 102.501 0.270 -9.634 1.00 1.00 C ATOM 1100 CD1 PHE A 77 102.090 -0.362 -8.471 1.00 1.00 C ATOM 1101 CD2 PHE A 77 101.622 1.095 -10.347 1.00 1.00 C ATOM 1102 CE1 PHE A 77 100.788 -0.180 -8.013 1.00 1.00 C ATOM 1103 CE2 PHE A 77 100.331 1.288 -9.892 1.00 1.00 C ATOM 1104 CZ PHE A 77 99.903 0.650 -8.726 1.00 1.00 C ATOM 0 H PHE A 77 103.733 -2.664 -11.113 1.00 1.00 H new ATOM 0 HA PHE A 77 103.290 0.003 -12.219 1.00 1.00 H new ATOM 0 HB2 PHE A 77 104.435 -0.583 -9.437 1.00 1.00 H new ATOM 0 HB3 PHE A 77 104.416 0.998 -10.192 1.00 1.00 H new ATOM 0 HD1 PHE A 77 102.776 -0.992 -7.923 1.00 1.00 H new ATOM 0 HD2 PHE A 77 101.953 1.581 -11.253 1.00 1.00 H new ATOM 0 HE1 PHE A 77 100.458 -0.675 -7.112 1.00 1.00 H new ATOM 0 HE2 PHE A 77 99.655 1.931 -10.437 1.00 1.00 H new ATOM 0 HZ PHE A 77 98.893 0.793 -8.371 1.00 1.00 H new ATOM 1114 N GLN A 78 105.796 0.215 -12.570 1.00 1.00 N ATOM 1115 CA GLN A 78 107.198 0.207 -12.916 1.00 1.00 C ATOM 1116 C GLN A 78 107.908 0.877 -11.779 1.00 1.00 C ATOM 1117 O GLN A 78 107.562 1.992 -11.387 1.00 1.00 O ATOM 1118 CB GLN A 78 107.474 0.929 -14.229 1.00 1.00 C ATOM 1119 CG GLN A 78 106.963 0.076 -15.381 1.00 1.00 C ATOM 1120 CD GLN A 78 107.423 0.674 -16.701 1.00 1.00 C ATOM 1121 OE1 GLN A 78 108.223 1.695 -16.672 1.00 1.00 O flip ATOM 1122 NE2 GLN A 78 107.052 0.196 -17.773 1.00 1.00 N flip ATOM 0 H GLN A 78 105.279 1.037 -12.882 1.00 1.00 H new ATOM 0 HA GLN A 78 107.546 -0.815 -13.067 1.00 1.00 H new ATOM 0 HB2 GLN A 78 106.982 1.902 -14.234 1.00 1.00 H new ATOM 0 HB3 GLN A 78 108.543 1.111 -14.341 1.00 1.00 H new ATOM 0 HG2 GLN A 78 107.334 -0.944 -15.284 1.00 1.00 H new ATOM 0 HG3 GLN A 78 105.875 0.024 -15.353 1.00 1.00 H new ATOM 0 HE21 GLN A 78 106.423 -0.607 -17.783 1.00 1.00 H new ATOM 0 HE22 GLN A 78 107.374 0.603 -18.651 1.00 1.00 H new ATOM 1131 N VAL A 79 108.867 0.186 -11.214 1.00 1.00 N ATOM 1132 CA VAL A 79 109.562 0.726 -10.084 1.00 1.00 C ATOM 1133 C VAL A 79 110.076 2.129 -10.393 1.00 1.00 C ATOM 1134 O VAL A 79 110.168 2.963 -9.500 1.00 1.00 O ATOM 1135 CB VAL A 79 110.746 -0.165 -9.695 1.00 1.00 C ATOM 1136 CG1 VAL A 79 111.342 0.342 -8.403 1.00 1.00 C ATOM 1137 CG2 VAL A 79 110.311 -1.606 -9.474 1.00 1.00 C ATOM 0 H VAL A 79 109.177 -0.738 -11.516 1.00 1.00 H new ATOM 0 HA VAL A 79 108.858 0.770 -9.253 1.00 1.00 H new ATOM 0 HB VAL A 79 111.470 -0.132 -10.509 1.00 1.00 H new ATOM 0 HG11 VAL A 79 112.186 -0.288 -8.120 1.00 1.00 H new ATOM 0 HG12 VAL A 79 111.684 1.368 -8.538 1.00 1.00 H new ATOM 0 HG13 VAL A 79 110.587 0.312 -7.617 1.00 1.00 H new ATOM 0 HG21 VAL A 79 111.176 -2.209 -9.200 1.00 1.00 H new ATOM 0 HG22 VAL A 79 109.573 -1.644 -8.673 1.00 1.00 H new ATOM 0 HG23 VAL A 79 109.872 -1.998 -10.391 1.00 1.00 H new ATOM 1141 N SER A 80 110.427 2.388 -11.655 1.00 1.00 N ATOM 1142 CA SER A 80 110.959 3.695 -12.015 1.00 1.00 C ATOM 1143 C SER A 80 109.883 4.760 -12.047 1.00 1.00 C ATOM 1144 O SER A 80 110.165 5.941 -11.847 1.00 1.00 O ATOM 1145 CB SER A 80 111.621 3.631 -13.394 1.00 1.00 C ATOM 1146 OG SER A 80 111.733 4.946 -13.922 1.00 1.00 O ATOM 0 H SER A 80 110.353 1.724 -12.426 1.00 1.00 H new ATOM 0 HA SER A 80 111.688 3.962 -11.250 1.00 1.00 H new ATOM 0 HB2 SER A 80 112.607 3.173 -13.316 1.00 1.00 H new ATOM 0 HB3 SER A 80 111.031 3.006 -14.065 1.00 1.00 H new ATOM 0 HG SER A 80 110.942 5.150 -14.463 1.00 1.00 H new ATOM 1152 N GLN A 81 108.651 4.351 -12.318 1.00 1.00 N ATOM 1153 CA GLN A 81 107.546 5.304 -12.401 1.00 1.00 C ATOM 1154 C GLN A 81 106.679 5.330 -11.155 1.00 1.00 C ATOM 1155 O GLN A 81 105.839 6.214 -11.013 1.00 1.00 O ATOM 1156 CB GLN A 81 106.655 4.967 -13.574 1.00 1.00 C ATOM 1157 CG GLN A 81 107.486 4.772 -14.832 1.00 1.00 C ATOM 1158 CD GLN A 81 108.332 6.012 -15.102 1.00 1.00 C ATOM 1159 OE1 GLN A 81 109.536 5.876 -15.584 1.00 1.00 O flip ATOM 1160 NE2 GLN A 81 107.879 7.134 -14.875 1.00 1.00 N flip ATOM 0 H GLN A 81 108.390 3.379 -12.483 1.00 1.00 H new ATOM 0 HA GLN A 81 108.008 6.284 -12.517 1.00 1.00 H new ATOM 0 HB2 GLN A 81 106.089 4.060 -13.360 1.00 1.00 H new ATOM 0 HB3 GLN A 81 105.930 5.766 -13.730 1.00 1.00 H new ATOM 0 HG2 GLN A 81 108.131 3.900 -14.719 1.00 1.00 H new ATOM 0 HG3 GLN A 81 106.832 4.577 -15.682 1.00 1.00 H new ATOM 0 HE21 GLN A 81 106.937 7.237 -14.498 1.00 1.00 H new ATOM 0 HE22 GLN A 81 108.446 7.961 -15.064 1.00 1.00 H new ATOM 1169 N VAL A 82 106.831 4.357 -10.267 1.00 1.00 N ATOM 1170 CA VAL A 82 105.980 4.332 -9.084 1.00 1.00 C ATOM 1171 C VAL A 82 106.374 5.473 -8.130 1.00 1.00 C ATOM 1172 O VAL A 82 107.372 6.152 -8.370 1.00 1.00 O ATOM 1173 CB VAL A 82 106.055 2.957 -8.415 1.00 1.00 C ATOM 1174 CG1 VAL A 82 107.336 2.815 -7.633 1.00 1.00 C ATOM 1175 CG2 VAL A 82 104.885 2.763 -7.489 1.00 1.00 C ATOM 0 H VAL A 82 107.510 3.599 -10.336 1.00 1.00 H new ATOM 0 HA VAL A 82 104.941 4.495 -9.371 1.00 1.00 H new ATOM 0 HB VAL A 82 106.029 2.199 -9.198 1.00 1.00 H new ATOM 0 HG11 VAL A 82 107.370 1.831 -7.165 1.00 1.00 H new ATOM 0 HG12 VAL A 82 108.187 2.927 -8.305 1.00 1.00 H new ATOM 0 HG13 VAL A 82 107.379 3.585 -6.862 1.00 1.00 H new ATOM 0 HG21 VAL A 82 104.951 1.781 -7.020 1.00 1.00 H new ATOM 0 HG22 VAL A 82 104.898 3.534 -6.719 1.00 1.00 H new ATOM 0 HG23 VAL A 82 103.957 2.833 -8.056 1.00 1.00 H new ATOM 1179 N ILE A 83 105.596 5.710 -7.062 1.00 1.00 N ATOM 1180 CA ILE A 83 105.931 6.812 -6.144 1.00 1.00 C ATOM 1181 C ILE A 83 107.397 6.641 -5.672 1.00 1.00 C ATOM 1182 O ILE A 83 107.881 5.513 -5.586 1.00 1.00 O ATOM 1183 CB ILE A 83 104.943 6.865 -4.925 1.00 1.00 C ATOM 1184 CG1 ILE A 83 103.765 5.927 -5.150 1.00 1.00 C ATOM 1185 CG2 ILE A 83 104.365 8.287 -4.745 1.00 1.00 C ATOM 1186 CD1 ILE A 83 102.865 5.918 -3.920 1.00 1.00 C ATOM 0 H ILE A 83 104.762 5.177 -6.817 1.00 1.00 H new ATOM 0 HA ILE A 83 105.828 7.761 -6.671 1.00 1.00 H new ATOM 0 HB ILE A 83 105.510 6.570 -4.042 1.00 1.00 H new ATOM 0 HG12 ILE A 83 103.197 6.246 -6.024 1.00 1.00 H new ATOM 0 HG13 ILE A 83 104.126 4.919 -5.354 1.00 1.00 H new ATOM 0 HG21 ILE A 83 103.684 8.298 -3.894 1.00 1.00 H new ATOM 0 HG22 ILE A 83 105.178 8.991 -4.567 1.00 1.00 H new ATOM 0 HG23 ILE A 83 103.825 8.577 -5.646 1.00 1.00 H new ATOM 0 HD11 ILE A 83 102.025 5.245 -4.089 1.00 1.00 H new ATOM 0 HD12 ILE A 83 103.434 5.578 -3.055 1.00 1.00 H new ATOM 0 HD13 ILE A 83 102.491 6.925 -3.735 1.00 1.00 H new ATOM 1193 N PRO A 84 108.130 7.714 -5.395 1.00 1.00 N ATOM 1194 CA PRO A 84 109.567 7.612 -4.965 1.00 1.00 C ATOM 1195 C PRO A 84 109.801 6.616 -3.839 1.00 1.00 C ATOM 1196 O PRO A 84 110.719 5.802 -3.895 1.00 1.00 O ATOM 1197 CB PRO A 84 109.885 9.022 -4.466 1.00 1.00 C ATOM 1198 CG PRO A 84 108.999 9.917 -5.250 1.00 1.00 C ATOM 1199 CD PRO A 84 107.708 9.135 -5.460 1.00 1.00 C ATOM 0 HA PRO A 84 110.192 7.259 -5.786 1.00 1.00 H new ATOM 0 HB2 PRO A 84 109.693 9.115 -3.397 1.00 1.00 H new ATOM 0 HB3 PRO A 84 110.935 9.269 -4.624 1.00 1.00 H new ATOM 0 HG2 PRO A 84 108.811 10.848 -4.716 1.00 1.00 H new ATOM 0 HG3 PRO A 84 109.455 10.183 -6.203 1.00 1.00 H new ATOM 0 HD2 PRO A 84 106.972 9.368 -4.691 1.00 1.00 H new ATOM 0 HD3 PRO A 84 107.251 9.371 -6.421 1.00 1.00 H new ATOM 1207 N GLY A 85 108.981 6.694 -2.810 1.00 1.00 N ATOM 1208 CA GLY A 85 109.143 5.793 -1.682 1.00 1.00 C ATOM 1209 C GLY A 85 109.094 4.354 -2.156 1.00 1.00 C ATOM 1210 O GLY A 85 109.938 3.526 -1.810 1.00 1.00 O ATOM 0 H GLY A 85 108.210 7.357 -2.729 1.00 1.00 H new ATOM 0 HA2 GLY A 85 110.093 5.988 -1.184 1.00 1.00 H new ATOM 0 HA3 GLY A 85 108.356 5.970 -0.949 1.00 1.00 H new ATOM 1214 N TRP A 86 108.083 4.087 -2.959 1.00 1.00 N ATOM 1215 CA TRP A 86 107.853 2.765 -3.526 1.00 1.00 C ATOM 1216 C TRP A 86 108.998 2.344 -4.459 1.00 1.00 C ATOM 1217 O TRP A 86 109.317 1.163 -4.560 1.00 1.00 O ATOM 1218 CB TRP A 86 106.527 2.804 -4.311 1.00 1.00 C ATOM 1219 CG TRP A 86 105.344 2.514 -3.437 1.00 1.00 C ATOM 1220 CD1 TRP A 86 104.937 3.224 -2.357 1.00 1.00 C ATOM 1221 CD2 TRP A 86 104.385 1.449 -3.595 1.00 1.00 C ATOM 1222 NE1 TRP A 86 103.793 2.649 -1.847 1.00 1.00 N ATOM 1223 CE2 TRP A 86 103.415 1.546 -2.578 1.00 1.00 C ATOM 1224 CE3 TRP A 86 104.270 0.414 -4.517 1.00 1.00 C ATOM 1225 CZ2 TRP A 86 102.368 0.635 -2.489 1.00 1.00 C ATOM 1226 CZ3 TRP A 86 103.221 -0.495 -4.426 1.00 1.00 C ATOM 1227 CH2 TRP A 86 102.270 -0.389 -3.417 1.00 1.00 C ATOM 0 H TRP A 86 107.392 4.782 -3.240 1.00 1.00 H new ATOM 0 HA TRP A 86 107.805 2.034 -2.719 1.00 1.00 H new ATOM 0 HB2 TRP A 86 106.406 3.786 -4.769 1.00 1.00 H new ATOM 0 HB3 TRP A 86 106.565 2.076 -5.122 1.00 1.00 H new ATOM 0 HD1 TRP A 86 105.430 4.099 -1.960 1.00 1.00 H new ATOM 0 HE1 TRP A 86 103.290 2.997 -1.031 1.00 1.00 H new ATOM 0 HE3 TRP A 86 104.999 0.316 -5.308 1.00 1.00 H new ATOM 0 HZ2 TRP A 86 101.635 0.725 -1.701 1.00 1.00 H new ATOM 0 HZ3 TRP A 86 103.144 -1.294 -5.149 1.00 1.00 H new ATOM 0 HH2 TRP A 86 101.460 -1.101 -3.357 1.00 1.00 H new ATOM 1238 N THR A 87 109.587 3.297 -5.165 1.00 1.00 N ATOM 1239 CA THR A 87 110.652 2.977 -6.104 1.00 1.00 C ATOM 1240 C THR A 87 111.735 2.143 -5.433 1.00 1.00 C ATOM 1241 O THR A 87 112.104 1.087 -5.931 1.00 1.00 O ATOM 1242 CB THR A 87 111.269 4.284 -6.635 1.00 1.00 C ATOM 1243 OG1 THR A 87 110.273 5.018 -7.333 1.00 1.00 O ATOM 1244 CG2 THR A 87 112.446 4.001 -7.582 1.00 1.00 C ATOM 0 H THR A 87 109.350 4.287 -5.108 1.00 1.00 H new ATOM 0 HA THR A 87 110.230 2.399 -6.926 1.00 1.00 H new ATOM 0 HB THR A 87 111.643 4.858 -5.787 1.00 1.00 H new ATOM 0 HG1 THR A 87 110.029 4.540 -8.153 1.00 1.00 H new ATOM 0 HG21 THR A 87 112.860 4.944 -7.940 1.00 1.00 H new ATOM 0 HG22 THR A 87 113.217 3.446 -7.048 1.00 1.00 H new ATOM 0 HG23 THR A 87 112.097 3.413 -8.431 1.00 1.00 H new ATOM 1252 N GLU A 88 112.261 2.642 -4.325 1.00 1.00 N ATOM 1253 CA GLU A 88 113.332 1.949 -3.615 1.00 1.00 C ATOM 1254 C GLU A 88 112.846 0.714 -2.846 1.00 1.00 C ATOM 1255 O GLU A 88 113.503 -0.323 -2.863 1.00 1.00 O ATOM 1256 CB GLU A 88 114.034 2.939 -2.675 1.00 1.00 C ATOM 1257 CG GLU A 88 115.253 2.286 -2.006 1.00 1.00 C ATOM 1258 CD GLU A 88 116.342 2.003 -3.036 1.00 1.00 C ATOM 1259 OE1 GLU A 88 117.306 1.344 -2.680 1.00 1.00 O ATOM 1260 OE2 GLU A 88 116.203 2.450 -4.163 1.00 1.00 O ATOM 0 H GLU A 88 111.967 3.520 -3.897 1.00 1.00 H new ATOM 0 HA GLU A 88 114.036 1.576 -4.359 1.00 1.00 H new ATOM 0 HB2 GLU A 88 114.349 3.819 -3.236 1.00 1.00 H new ATOM 0 HB3 GLU A 88 113.335 3.281 -1.912 1.00 1.00 H new ATOM 0 HG2 GLU A 88 115.643 2.942 -1.228 1.00 1.00 H new ATOM 0 HG3 GLU A 88 114.954 1.357 -1.520 1.00 1.00 H new ATOM 1267 N ALA A 89 111.726 0.838 -2.142 1.00 1.00 N ATOM 1268 CA ALA A 89 111.218 -0.273 -1.330 1.00 1.00 C ATOM 1269 C ALA A 89 111.004 -1.571 -2.121 1.00 1.00 C ATOM 1270 O ALA A 89 111.349 -2.653 -1.645 1.00 1.00 O ATOM 1271 CB ALA A 89 109.899 0.132 -0.684 1.00 1.00 C ATOM 0 H ALA A 89 111.156 1.683 -2.114 1.00 1.00 H new ATOM 0 HA ALA A 89 111.983 -0.479 -0.581 1.00 1.00 H new ATOM 0 HB1 ALA A 89 109.521 -0.693 -0.080 1.00 1.00 H new ATOM 0 HB2 ALA A 89 110.057 1.003 -0.049 1.00 1.00 H new ATOM 0 HB3 ALA A 89 109.174 0.376 -1.460 1.00 1.00 H new ATOM 1277 N LEU A 90 110.415 -1.477 -3.302 1.00 1.00 N ATOM 1278 CA LEU A 90 110.143 -2.678 -4.098 1.00 1.00 C ATOM 1279 C LEU A 90 111.439 -3.423 -4.382 1.00 1.00 C ATOM 1280 O LEU A 90 111.491 -4.652 -4.341 1.00 1.00 O ATOM 1281 CB LEU A 90 109.524 -2.273 -5.432 1.00 1.00 C ATOM 1282 CG LEU A 90 108.195 -1.547 -5.196 1.00 1.00 C ATOM 1283 CD1 LEU A 90 107.856 -0.736 -6.440 1.00 1.00 C ATOM 1284 CD2 LEU A 90 107.080 -2.553 -4.921 1.00 1.00 C ATOM 0 H LEU A 90 110.118 -0.601 -3.731 1.00 1.00 H new ATOM 0 HA LEU A 90 109.462 -3.320 -3.539 1.00 1.00 H new ATOM 0 HB2 LEU A 90 110.209 -1.625 -5.978 1.00 1.00 H new ATOM 0 HB3 LEU A 90 109.360 -3.156 -6.049 1.00 1.00 H new ATOM 0 HG LEU A 90 108.289 -0.890 -4.331 1.00 1.00 H new ATOM 0 HD11 LEU A 90 106.912 -0.213 -6.287 1.00 1.00 H new ATOM 0 HD12 LEU A 90 108.647 -0.010 -6.628 1.00 1.00 H new ATOM 0 HD13 LEU A 90 107.766 -1.404 -7.297 1.00 1.00 H new ATOM 0 HD21 LEU A 90 106.143 -2.021 -4.756 1.00 1.00 H new ATOM 0 HD22 LEU A 90 106.973 -3.220 -5.776 1.00 1.00 H new ATOM 0 HD23 LEU A 90 107.327 -3.137 -4.034 1.00 1.00 H new ATOM 1296 N GLN A 91 112.473 -2.658 -4.697 1.00 1.00 N ATOM 1297 CA GLN A 91 113.771 -3.216 -5.022 1.00 1.00 C ATOM 1298 C GLN A 91 114.387 -3.906 -3.819 1.00 1.00 C ATOM 1299 O GLN A 91 115.252 -4.768 -3.963 1.00 1.00 O ATOM 1300 CB GLN A 91 114.700 -2.100 -5.482 1.00 1.00 C ATOM 1301 CG GLN A 91 114.023 -1.328 -6.608 1.00 1.00 C ATOM 1302 CD GLN A 91 114.880 -0.142 -7.030 1.00 1.00 C ATOM 1303 OE1 GLN A 91 116.098 -0.270 -7.162 1.00 1.00 O ATOM 1304 NE2 GLN A 91 114.318 1.014 -7.254 1.00 1.00 N ATOM 0 H GLN A 91 112.434 -1.639 -4.734 1.00 1.00 H new ATOM 0 HA GLN A 91 113.637 -3.951 -5.815 1.00 1.00 H new ATOM 0 HB2 GLN A 91 114.928 -1.432 -4.651 1.00 1.00 H new ATOM 0 HB3 GLN A 91 115.647 -2.516 -5.826 1.00 1.00 H new ATOM 0 HG2 GLN A 91 113.858 -1.987 -7.461 1.00 1.00 H new ATOM 0 HG3 GLN A 91 113.044 -0.979 -6.280 1.00 1.00 H new ATOM 0 HE21 GLN A 91 113.309 1.120 -7.145 1.00 1.00 H new ATOM 0 HE22 GLN A 91 114.887 1.811 -7.538 1.00 1.00 H new ATOM 1313 N LEU A 92 113.949 -3.512 -2.627 1.00 1.00 N ATOM 1314 CA LEU A 92 114.486 -4.096 -1.398 1.00 1.00 C ATOM 1315 C LEU A 92 113.514 -5.093 -0.815 1.00 1.00 C ATOM 1316 O LEU A 92 113.852 -5.802 0.120 1.00 1.00 O ATOM 1317 CB LEU A 92 114.746 -2.996 -0.367 1.00 1.00 C ATOM 1318 CG LEU A 92 115.640 -1.915 -0.968 1.00 1.00 C ATOM 1319 CD1 LEU A 92 115.753 -0.761 0.012 1.00 1.00 C ATOM 1320 CD2 LEU A 92 117.028 -2.472 -1.277 1.00 1.00 C ATOM 0 H LEU A 92 113.233 -2.800 -2.484 1.00 1.00 H new ATOM 0 HA LEU A 92 115.419 -4.604 -1.642 1.00 1.00 H new ATOM 0 HB2 LEU A 92 113.801 -2.559 -0.044 1.00 1.00 H new ATOM 0 HB3 LEU A 92 115.220 -3.421 0.518 1.00 1.00 H new ATOM 0 HG LEU A 92 115.197 -1.566 -1.901 1.00 1.00 H new ATOM 0 HD11 LEU A 92 116.391 0.015 -0.412 1.00 1.00 H new ATOM 0 HD12 LEU A 92 114.762 -0.350 0.206 1.00 1.00 H new ATOM 0 HD13 LEU A 92 116.187 -1.118 0.946 1.00 1.00 H new ATOM 0 HD21 LEU A 92 117.649 -1.685 -1.705 1.00 1.00 H new ATOM 0 HD22 LEU A 92 117.486 -2.837 -0.358 1.00 1.00 H new ATOM 0 HD23 LEU A 92 116.941 -3.292 -1.989 1.00 1.00 H new ATOM 1332 N MET A 93 112.304 -5.121 -1.362 1.00 1.00 N ATOM 1333 CA MET A 93 111.265 -6.020 -0.877 1.00 1.00 C ATOM 1334 C MET A 93 111.282 -7.373 -1.632 1.00 1.00 C ATOM 1335 O MET A 93 110.863 -7.429 -2.788 1.00 1.00 O ATOM 1336 CB MET A 93 109.919 -5.335 -1.092 1.00 1.00 C ATOM 1337 CG MET A 93 108.811 -6.161 -0.453 1.00 1.00 C ATOM 1338 SD MET A 93 107.309 -5.151 -0.349 1.00 1.00 S ATOM 1339 CE MET A 93 106.234 -6.210 -1.339 1.00 1.00 C ATOM 0 H MET A 93 112.019 -4.530 -2.143 1.00 1.00 H new ATOM 0 HA MET A 93 111.439 -6.232 0.178 1.00 1.00 H new ATOM 0 HB2 MET A 93 109.936 -4.335 -0.658 1.00 1.00 H new ATOM 0 HB3 MET A 93 109.727 -5.216 -2.158 1.00 1.00 H new ATOM 0 HG2 MET A 93 108.622 -7.058 -1.043 1.00 1.00 H new ATOM 0 HG3 MET A 93 109.113 -6.491 0.541 1.00 1.00 H new ATOM 0 HE1 MET A 93 105.325 -5.666 -1.597 1.00 1.00 H new ATOM 0 HE2 MET A 93 106.753 -6.503 -2.252 1.00 1.00 H new ATOM 0 HE3 MET A 93 105.974 -7.101 -0.767 1.00 1.00 H new ATOM 1349 N PRO A 94 111.729 -8.466 -1.018 1.00 1.00 N ATOM 1350 CA PRO A 94 111.754 -9.815 -1.672 1.00 1.00 C ATOM 1351 C PRO A 94 110.359 -10.356 -1.954 1.00 1.00 C ATOM 1352 O PRO A 94 109.403 -10.061 -1.236 1.00 1.00 O ATOM 1353 CB PRO A 94 112.509 -10.711 -0.675 1.00 1.00 C ATOM 1354 CG PRO A 94 113.169 -9.777 0.278 1.00 1.00 C ATOM 1355 CD PRO A 94 112.263 -8.568 0.346 1.00 1.00 C ATOM 0 HA PRO A 94 112.235 -9.774 -2.649 1.00 1.00 H new ATOM 0 HB2 PRO A 94 111.826 -11.383 -0.156 1.00 1.00 H new ATOM 0 HB3 PRO A 94 113.243 -11.334 -1.185 1.00 1.00 H new ATOM 0 HG2 PRO A 94 113.287 -10.236 1.260 1.00 1.00 H new ATOM 0 HG3 PRO A 94 114.166 -9.502 -0.067 1.00 1.00 H new ATOM 0 HD2 PRO A 94 111.468 -8.702 1.080 1.00 1.00 H new ATOM 0 HD3 PRO A 94 112.812 -7.670 0.631 1.00 1.00 H new ATOM 1363 N ALA A 95 110.257 -11.138 -3.017 1.00 1.00 N ATOM 1364 CA ALA A 95 108.983 -11.709 -3.404 1.00 1.00 C ATOM 1365 C ALA A 95 108.484 -12.694 -2.375 1.00 1.00 C ATOM 1366 O ALA A 95 109.237 -13.510 -1.841 1.00 1.00 O ATOM 1367 CB ALA A 95 109.069 -12.376 -4.769 1.00 1.00 C ATOM 0 H ALA A 95 111.038 -11.389 -3.623 1.00 1.00 H new ATOM 0 HA ALA A 95 108.269 -10.887 -3.465 1.00 1.00 H new ATOM 0 HB1 ALA A 95 108.097 -12.795 -5.031 1.00 1.00 H new ATOM 0 HB2 ALA A 95 109.360 -11.638 -5.517 1.00 1.00 H new ATOM 0 HB3 ALA A 95 109.811 -13.173 -4.738 1.00 1.00 H new ATOM 1373 N GLY A 96 107.198 -12.580 -2.086 1.00 1.00 N ATOM 1374 CA GLY A 96 106.557 -13.418 -1.101 1.00 1.00 C ATOM 1375 C GLY A 96 106.571 -12.692 0.226 1.00 1.00 C ATOM 1376 O GLY A 96 105.781 -12.986 1.123 1.00 1.00 O ATOM 0 H GLY A 96 106.576 -11.904 -2.529 1.00 1.00 H new ATOM 0 HA2 GLY A 96 105.533 -13.640 -1.401 1.00 1.00 H new ATOM 0 HA3 GLY A 96 107.079 -14.371 -1.017 1.00 1.00 H new ATOM 1380 N SER A 97 107.471 -11.711 0.332 1.00 1.00 N ATOM 1381 CA SER A 97 107.573 -10.917 1.539 1.00 1.00 C ATOM 1382 C SER A 97 106.592 -9.758 1.491 1.00 1.00 C ATOM 1383 O SER A 97 106.479 -9.063 0.481 1.00 1.00 O ATOM 1384 CB SER A 97 108.995 -10.372 1.696 1.00 1.00 C ATOM 1385 OG SER A 97 109.102 -9.143 0.991 1.00 1.00 O ATOM 0 H SER A 97 108.131 -11.456 -0.403 1.00 1.00 H new ATOM 0 HA SER A 97 107.335 -11.554 2.391 1.00 1.00 H new ATOM 0 HB2 SER A 97 109.226 -10.222 2.751 1.00 1.00 H new ATOM 0 HB3 SER A 97 109.718 -11.091 1.311 1.00 1.00 H new ATOM 0 HG SER A 97 108.993 -9.306 0.031 1.00 1.00 H new ATOM 1391 N THR A 98 105.890 -9.553 2.597 1.00 1.00 N ATOM 1392 CA THR A 98 104.920 -8.470 2.700 1.00 1.00 C ATOM 1393 C THR A 98 105.455 -7.394 3.615 1.00 1.00 C ATOM 1394 O THR A 98 105.663 -7.631 4.802 1.00 1.00 O ATOM 1395 CB THR A 98 103.603 -8.991 3.259 1.00 1.00 C ATOM 1396 OG1 THR A 98 103.118 -10.045 2.439 1.00 1.00 O ATOM 1397 CG2 THR A 98 102.597 -7.853 3.275 1.00 1.00 C ATOM 0 H THR A 98 105.974 -10.124 3.438 1.00 1.00 H new ATOM 0 HA THR A 98 104.749 -8.059 1.705 1.00 1.00 H new ATOM 0 HB THR A 98 103.753 -9.369 4.270 1.00 1.00 H new ATOM 0 HG1 THR A 98 102.979 -9.713 1.527 1.00 1.00 H new ATOM 0 HG21 THR A 98 101.648 -8.212 3.673 1.00 1.00 H new ATOM 0 HG22 THR A 98 102.972 -7.045 3.903 1.00 1.00 H new ATOM 0 HG23 THR A 98 102.448 -7.485 2.260 1.00 1.00 H new ATOM 1405 N TRP A 99 105.705 -6.209 3.060 1.00 1.00 N ATOM 1406 CA TRP A 99 106.246 -5.099 3.848 1.00 1.00 C ATOM 1407 C TRP A 99 105.256 -3.946 3.907 1.00 1.00 C ATOM 1408 O TRP A 99 104.321 -3.859 3.111 1.00 1.00 O ATOM 1409 CB TRP A 99 107.531 -4.535 3.213 1.00 1.00 C ATOM 1410 CG TRP A 99 108.699 -5.477 3.293 1.00 1.00 C ATOM 1411 CD1 TRP A 99 108.683 -6.773 3.690 1.00 1.00 C ATOM 1412 CD2 TRP A 99 110.084 -5.173 2.979 1.00 1.00 C ATOM 1413 NE1 TRP A 99 109.958 -7.286 3.616 1.00 1.00 N ATOM 1414 CE2 TRP A 99 110.864 -6.336 3.185 1.00 1.00 C ATOM 1415 CE3 TRP A 99 110.731 -4.004 2.528 1.00 1.00 C ATOM 1416 CZ2 TRP A 99 112.238 -6.342 2.956 1.00 1.00 C ATOM 1417 CZ3 TRP A 99 112.118 -4.008 2.299 1.00 1.00 C ATOM 1418 CH2 TRP A 99 112.867 -5.175 2.512 1.00 1.00 C ATOM 0 H TRP A 99 105.544 -5.992 2.076 1.00 1.00 H new ATOM 0 HA TRP A 99 106.449 -5.499 4.842 1.00 1.00 H new ATOM 0 HB2 TRP A 99 107.337 -4.297 2.167 1.00 1.00 H new ATOM 0 HB3 TRP A 99 107.793 -3.600 3.709 1.00 1.00 H new ATOM 0 HD1 TRP A 99 107.808 -7.317 4.013 1.00 1.00 H new ATOM 0 HE1 TRP A 99 110.204 -8.248 3.850 1.00 1.00 H new ATOM 0 HE3 TRP A 99 110.160 -3.103 2.358 1.00 1.00 H new ATOM 0 HZ2 TRP A 99 112.813 -7.241 3.120 1.00 1.00 H new ATOM 0 HZ3 TRP A 99 112.609 -3.109 1.958 1.00 1.00 H new ATOM 0 HH2 TRP A 99 113.932 -5.172 2.333 1.00 1.00 H new ATOM 1429 N GLU A 100 105.540 -3.021 4.813 1.00 1.00 N ATOM 1430 CA GLU A 100 104.766 -1.794 4.958 1.00 1.00 C ATOM 1431 C GLU A 100 105.748 -0.653 4.894 1.00 1.00 C ATOM 1432 O GLU A 100 106.739 -0.661 5.622 1.00 1.00 O ATOM 1433 CB GLU A 100 104.010 -1.729 6.288 1.00 1.00 C ATOM 1434 CG GLU A 100 102.770 -2.610 6.217 1.00 1.00 C ATOM 1435 CD GLU A 100 102.085 -2.669 7.577 1.00 1.00 C ATOM 1436 OE1 GLU A 100 101.118 -3.402 7.700 1.00 1.00 O ATOM 1437 OE2 GLU A 100 102.534 -1.976 8.476 1.00 1.00 O ATOM 0 H GLU A 100 106.316 -3.100 5.471 1.00 1.00 H new ATOM 0 HA GLU A 100 104.017 -1.748 4.168 1.00 1.00 H new ATOM 0 HB2 GLU A 100 104.656 -2.059 7.101 1.00 1.00 H new ATOM 0 HB3 GLU A 100 103.725 -0.700 6.505 1.00 1.00 H new ATOM 0 HG2 GLU A 100 102.079 -2.218 5.471 1.00 1.00 H new ATOM 0 HG3 GLU A 100 103.047 -3.615 5.898 1.00 1.00 H new ATOM 1444 N ILE A 101 105.487 0.331 4.037 1.00 1.00 N ATOM 1445 CA ILE A 101 106.381 1.463 3.917 1.00 1.00 C ATOM 1446 C ILE A 101 105.621 2.741 4.175 1.00 1.00 C ATOM 1447 O ILE A 101 104.477 2.910 3.758 1.00 1.00 O ATOM 1448 CB ILE A 101 107.116 1.448 2.565 1.00 1.00 C ATOM 1449 CG1 ILE A 101 106.306 2.092 1.437 1.00 1.00 C ATOM 1450 CG2 ILE A 101 107.413 -0.013 2.209 1.00 1.00 C ATOM 1451 CD1 ILE A 101 107.189 2.145 0.198 1.00 1.00 C ATOM 0 H ILE A 101 104.672 0.362 3.425 1.00 1.00 H new ATOM 0 HA ILE A 101 107.162 1.396 4.675 1.00 1.00 H new ATOM 0 HB ILE A 101 108.029 2.035 2.667 1.00 1.00 H new ATOM 0 HG12 ILE A 101 105.403 1.514 1.238 1.00 1.00 H new ATOM 0 HG13 ILE A 101 105.987 3.095 1.721 1.00 1.00 H new ATOM 0 HG21 ILE A 101 107.935 -0.056 1.253 1.00 1.00 H new ATOM 0 HG22 ILE A 101 108.038 -0.456 2.984 1.00 1.00 H new ATOM 0 HG23 ILE A 101 106.477 -0.567 2.137 1.00 1.00 H new ATOM 0 HD11 ILE A 101 106.636 2.600 -0.624 1.00 1.00 H new ATOM 0 HD12 ILE A 101 108.078 2.739 0.410 1.00 1.00 H new ATOM 0 HD13 ILE A 101 107.486 1.134 -0.081 1.00 1.00 H new ATOM 1458 N TYR A 102 106.275 3.618 4.916 1.00 1.00 N ATOM 1459 CA TYR A 102 105.706 4.881 5.312 1.00 1.00 C ATOM 1460 C TYR A 102 106.460 5.929 4.519 1.00 1.00 C ATOM 1461 O TYR A 102 107.634 6.194 4.774 1.00 1.00 O ATOM 1462 CB TYR A 102 105.911 5.082 6.829 1.00 1.00 C ATOM 1463 CG TYR A 102 105.393 3.878 7.636 1.00 1.00 C ATOM 1464 CD1 TYR A 102 105.801 2.566 7.334 1.00 1.00 C ATOM 1465 CD2 TYR A 102 104.493 4.077 8.699 1.00 1.00 C ATOM 1466 CE1 TYR A 102 105.320 1.484 8.067 1.00 1.00 C ATOM 1467 CE2 TYR A 102 104.017 2.987 9.441 1.00 1.00 C ATOM 1468 CZ TYR A 102 104.430 1.688 9.123 1.00 1.00 C ATOM 1469 OH TYR A 102 103.951 0.612 9.841 1.00 1.00 O ATOM 0 H TYR A 102 107.223 3.466 5.259 1.00 1.00 H new ATOM 0 HA TYR A 102 104.635 4.938 5.119 1.00 1.00 H new ATOM 0 HB2 TYR A 102 106.971 5.231 7.037 1.00 1.00 H new ATOM 0 HB3 TYR A 102 105.393 5.986 7.150 1.00 1.00 H new ATOM 0 HD1 TYR A 102 106.495 2.396 6.524 1.00 1.00 H new ATOM 0 HD2 TYR A 102 104.167 5.077 8.945 1.00 1.00 H new ATOM 0 HE1 TYR A 102 105.637 0.482 7.817 1.00 1.00 H new ATOM 0 HE2 TYR A 102 103.331 3.150 10.259 1.00 1.00 H new ATOM 0 HH TYR A 102 103.581 -0.054 9.225 1.00 1.00 H new ATOM 1479 N VAL A 103 105.801 6.440 3.487 1.00 1.00 N ATOM 1480 CA VAL A 103 106.433 7.369 2.564 1.00 1.00 C ATOM 1481 C VAL A 103 106.284 8.839 2.939 1.00 1.00 C ATOM 1482 O VAL A 103 105.181 9.383 2.896 1.00 1.00 O ATOM 1483 CB VAL A 103 105.850 7.199 1.168 1.00 1.00 C ATOM 1484 CG1 VAL A 103 106.727 7.939 0.161 1.00 1.00 C ATOM 1485 CG2 VAL A 103 105.775 5.718 0.807 1.00 1.00 C ATOM 0 H VAL A 103 104.828 6.225 3.269 1.00 1.00 H new ATOM 0 HA VAL A 103 107.494 7.121 2.606 1.00 1.00 H new ATOM 0 HB VAL A 103 104.842 7.614 1.145 1.00 1.00 H new ATOM 0 HG11 VAL A 103 106.312 7.819 -0.840 1.00 1.00 H new ATOM 0 HG12 VAL A 103 106.759 8.998 0.416 1.00 1.00 H new ATOM 0 HG13 VAL A 103 107.736 7.529 0.187 1.00 1.00 H new ATOM 0 HG21 VAL A 103 105.357 5.608 -0.193 1.00 1.00 H new ATOM 0 HG22 VAL A 103 106.776 5.286 0.831 1.00 1.00 H new ATOM 0 HG23 VAL A 103 105.139 5.200 1.525 1.00 1.00 H new ATOM 1489 N PRO A 104 107.373 9.514 3.228 1.00 1.00 N ATOM 1490 CA PRO A 104 107.323 10.966 3.520 1.00 1.00 C ATOM 1491 C PRO A 104 106.560 11.690 2.413 1.00 1.00 C ATOM 1492 O PRO A 104 106.629 11.300 1.248 1.00 1.00 O ATOM 1493 CB PRO A 104 108.803 11.384 3.537 1.00 1.00 C ATOM 1494 CG PRO A 104 109.579 10.134 3.838 1.00 1.00 C ATOM 1495 CD PRO A 104 108.741 8.971 3.335 1.00 1.00 C ATOM 0 HA PRO A 104 106.814 11.206 4.454 1.00 1.00 H new ATOM 0 HB2 PRO A 104 109.101 11.807 2.578 1.00 1.00 H new ATOM 0 HB3 PRO A 104 108.985 12.148 4.293 1.00 1.00 H new ATOM 0 HG2 PRO A 104 110.551 10.153 3.345 1.00 1.00 H new ATOM 0 HG3 PRO A 104 109.766 10.042 4.908 1.00 1.00 H new ATOM 0 HD2 PRO A 104 109.101 8.611 2.371 1.00 1.00 H new ATOM 0 HD3 PRO A 104 108.780 8.128 4.024 1.00 1.00 H new ATOM 1503 N SER A 105 105.816 12.724 2.776 1.00 1.00 N ATOM 1504 CA SER A 105 105.037 13.448 1.790 1.00 1.00 C ATOM 1505 C SER A 105 105.906 13.834 0.600 1.00 1.00 C ATOM 1506 O SER A 105 105.443 13.835 -0.541 1.00 1.00 O ATOM 1507 CB SER A 105 104.426 14.705 2.410 1.00 1.00 C ATOM 1508 OG SER A 105 105.441 15.679 2.606 1.00 1.00 O ATOM 0 H SER A 105 105.737 13.074 3.731 1.00 1.00 H new ATOM 0 HA SER A 105 104.235 12.795 1.445 1.00 1.00 H new ATOM 0 HB2 SER A 105 103.647 15.102 1.759 1.00 1.00 H new ATOM 0 HB3 SER A 105 103.953 14.461 3.361 1.00 1.00 H new ATOM 0 HG SER A 105 105.049 16.485 3.002 1.00 1.00 H new ATOM 1514 N GLY A 106 107.166 14.154 0.867 1.00 1.00 N ATOM 1515 CA GLY A 106 108.085 14.531 -0.197 1.00 1.00 C ATOM 1516 C GLY A 106 108.349 13.363 -1.135 1.00 1.00 C ATOM 1517 O GLY A 106 108.559 13.554 -2.334 1.00 1.00 O ATOM 0 H GLY A 106 107.571 14.160 1.803 1.00 1.00 H new ATOM 0 HA2 GLY A 106 107.670 15.367 -0.760 1.00 1.00 H new ATOM 0 HA3 GLY A 106 109.025 14.873 0.235 1.00 1.00 H new ATOM 1521 N LEU A 107 108.339 12.149 -0.584 1.00 1.00 N ATOM 1522 CA LEU A 107 108.586 10.947 -1.385 1.00 1.00 C ATOM 1523 C LEU A 107 107.271 10.272 -1.762 1.00 1.00 C ATOM 1524 O LEU A 107 107.277 9.222 -2.400 1.00 1.00 O ATOM 1525 CB LEU A 107 109.467 9.942 -0.604 1.00 1.00 C ATOM 1526 CG LEU A 107 110.840 10.560 -0.270 1.00 1.00 C ATOM 1527 CD1 LEU A 107 111.708 9.531 0.465 1.00 1.00 C ATOM 1528 CD2 LEU A 107 111.555 11.006 -1.556 1.00 1.00 C ATOM 0 H LEU A 107 108.164 11.971 0.405 1.00 1.00 H new ATOM 0 HA LEU A 107 109.107 11.253 -2.292 1.00 1.00 H new ATOM 0 HB2 LEU A 107 108.962 9.648 0.316 1.00 1.00 H new ATOM 0 HB3 LEU A 107 109.605 9.037 -1.195 1.00 1.00 H new ATOM 0 HG LEU A 107 110.683 11.430 0.368 1.00 1.00 H new ATOM 0 HD11 LEU A 107 112.677 9.973 0.699 1.00 1.00 H new ATOM 0 HD12 LEU A 107 111.213 9.232 1.389 1.00 1.00 H new ATOM 0 HD13 LEU A 107 111.852 8.656 -0.170 1.00 1.00 H new ATOM 0 HD21 LEU A 107 112.522 11.440 -1.303 1.00 1.00 H new ATOM 0 HD22 LEU A 107 111.703 10.145 -2.207 1.00 1.00 H new ATOM 0 HD23 LEU A 107 110.947 11.750 -2.071 1.00 1.00 H new ATOM 1540 N ALA A 108 106.135 10.858 -1.353 1.00 1.00 N ATOM 1541 CA ALA A 108 104.831 10.269 -1.650 1.00 1.00 C ATOM 1542 C ALA A 108 104.077 11.074 -2.702 1.00 1.00 C ATOM 1543 O ALA A 108 104.397 11.007 -3.887 1.00 1.00 O ATOM 1544 CB ALA A 108 103.976 10.188 -0.386 1.00 1.00 C ATOM 0 H ALA A 108 106.098 11.728 -0.822 1.00 1.00 H new ATOM 0 HA ALA A 108 105.016 9.267 -2.038 1.00 1.00 H new ATOM 0 HB1 ALA A 108 103.009 9.747 -0.628 1.00 1.00 H new ATOM 0 HB2 ALA A 108 104.481 9.570 0.356 1.00 1.00 H new ATOM 0 HB3 ALA A 108 103.827 11.190 0.017 1.00 1.00 H new ATOM 1550 N TYR A 109 103.039 11.812 -2.281 1.00 1.00 N ATOM 1551 CA TYR A 109 102.226 12.570 -3.222 1.00 1.00 C ATOM 1552 C TYR A 109 102.546 14.058 -3.247 1.00 1.00 C ATOM 1553 O TYR A 109 101.914 14.818 -3.979 1.00 1.00 O ATOM 1554 CB TYR A 109 100.747 12.274 -2.965 1.00 1.00 C ATOM 1555 CG TYR A 109 100.495 10.918 -3.581 1.00 1.00 C ATOM 1556 CD1 TYR A 109 100.400 9.794 -2.773 1.00 1.00 C ATOM 1557 CD2 TYR A 109 100.459 10.785 -4.978 1.00 1.00 C ATOM 1558 CE1 TYR A 109 100.273 8.537 -3.338 1.00 1.00 C ATOM 1559 CE2 TYR A 109 100.320 9.524 -5.551 1.00 1.00 C ATOM 1560 CZ TYR A 109 100.234 8.392 -4.725 1.00 1.00 C ATOM 1561 OH TYR A 109 100.121 7.135 -5.273 1.00 1.00 O ATOM 0 H TYR A 109 102.751 11.895 -1.306 1.00 1.00 H new ATOM 0 HA TYR A 109 102.476 12.237 -4.229 1.00 1.00 H new ATOM 0 HB2 TYR A 109 100.528 12.267 -1.897 1.00 1.00 H new ATOM 0 HB3 TYR A 109 100.110 13.035 -3.416 1.00 1.00 H new ATOM 0 HD1 TYR A 109 100.425 9.900 -1.699 1.00 1.00 H new ATOM 0 HD2 TYR A 109 100.539 11.659 -5.607 1.00 1.00 H new ATOM 0 HE1 TYR A 109 100.204 7.666 -2.703 1.00 1.00 H new ATOM 0 HE2 TYR A 109 100.279 9.417 -6.625 1.00 1.00 H new ATOM 0 HH TYR A 109 99.923 7.212 -6.230 1.00 1.00 H new ATOM 1571 N GLY A 110 103.574 14.468 -2.506 1.00 1.00 N ATOM 1572 CA GLY A 110 104.003 15.868 -2.534 1.00 1.00 C ATOM 1573 C GLY A 110 103.501 16.696 -1.354 1.00 1.00 C ATOM 1574 O GLY A 110 102.627 16.275 -0.598 1.00 1.00 O ATOM 0 H GLY A 110 104.118 13.865 -1.889 1.00 1.00 H new ATOM 0 HA2 GLY A 110 105.092 15.903 -2.552 1.00 1.00 H new ATOM 0 HA3 GLY A 110 103.654 16.325 -3.460 1.00 1.00 H new ATOM 1578 N PRO A 111 104.065 17.873 -1.197 1.00 1.00 N ATOM 1579 CA PRO A 111 103.712 18.823 -0.098 1.00 1.00 C ATOM 1580 C PRO A 111 102.323 19.457 -0.274 1.00 1.00 C ATOM 1581 O PRO A 111 101.734 19.958 0.681 1.00 1.00 O ATOM 1582 CB PRO A 111 104.822 19.874 -0.175 1.00 1.00 C ATOM 1583 CG PRO A 111 105.238 19.875 -1.607 1.00 1.00 C ATOM 1584 CD PRO A 111 105.119 18.432 -2.069 1.00 1.00 C ATOM 0 HA PRO A 111 103.650 18.325 0.869 1.00 1.00 H new ATOM 0 HB2 PRO A 111 104.461 20.855 0.134 1.00 1.00 H new ATOM 0 HB3 PRO A 111 105.655 19.620 0.480 1.00 1.00 H new ATOM 0 HG2 PRO A 111 104.600 20.530 -2.200 1.00 1.00 H new ATOM 0 HG3 PRO A 111 106.259 20.239 -1.718 1.00 1.00 H new ATOM 0 HD2 PRO A 111 104.843 18.370 -3.122 1.00 1.00 H new ATOM 0 HD3 PRO A 111 106.061 17.895 -1.954 1.00 1.00 H new ATOM 1592 N ARG A 112 101.812 19.431 -1.498 1.00 1.00 N ATOM 1593 CA ARG A 112 100.491 19.999 -1.799 1.00 1.00 C ATOM 1594 C ARG A 112 99.423 18.911 -1.715 1.00 1.00 C ATOM 1595 O ARG A 112 99.740 17.723 -1.685 1.00 1.00 O ATOM 1596 CB ARG A 112 100.494 20.580 -3.232 1.00 1.00 C ATOM 1597 CG ARG A 112 100.955 22.044 -3.249 1.00 1.00 C ATOM 1598 CD ARG A 112 102.463 22.125 -3.042 1.00 1.00 C ATOM 1599 NE ARG A 112 102.915 23.495 -3.258 1.00 1.00 N ATOM 1600 CZ ARG A 112 104.090 23.919 -2.804 1.00 1.00 C ATOM 1601 NH1 ARG A 112 104.819 23.150 -2.044 1.00 1.00 N ATOM 1602 NH2 ARG A 112 104.499 25.126 -3.089 1.00 1.00 N ATOM 0 H ARG A 112 102.287 19.024 -2.303 1.00 1.00 H new ATOM 0 HA ARG A 112 100.272 20.784 -1.075 1.00 1.00 H new ATOM 0 HB2 ARG A 112 101.151 19.984 -3.865 1.00 1.00 H new ATOM 0 HB3 ARG A 112 99.492 20.509 -3.656 1.00 1.00 H new ATOM 0 HG2 ARG A 112 100.686 22.506 -4.199 1.00 1.00 H new ATOM 0 HG3 ARG A 112 100.443 22.603 -2.466 1.00 1.00 H new ATOM 0 HD2 ARG A 112 102.719 21.802 -2.033 1.00 1.00 H new ATOM 0 HD3 ARG A 112 102.971 21.451 -3.731 1.00 1.00 H new ATOM 0 HE ARG A 112 102.315 24.143 -3.769 1.00 1.00 H new ATOM 0 HH11 ARG A 112 104.488 22.218 -1.795 1.00 1.00 H new ATOM 0 HH12 ARG A 112 105.720 23.481 -1.699 1.00 1.00 H new ATOM 0 HH21 ARG A 112 103.917 25.740 -3.659 1.00 1.00 H new ATOM 0 HH22 ARG A 112 105.400 25.454 -2.742 1.00 1.00 H new ATOM 1616 N SER A 113 98.157 19.322 -1.702 1.00 1.00 N ATOM 1617 CA SER A 113 97.071 18.366 -1.668 1.00 1.00 C ATOM 1618 C SER A 113 96.931 17.724 -3.042 1.00 1.00 C ATOM 1619 O SER A 113 96.035 18.071 -3.813 1.00 1.00 O ATOM 1620 CB SER A 113 95.769 19.062 -1.301 1.00 1.00 C ATOM 1621 OG SER A 113 95.995 19.921 -0.195 1.00 1.00 O ATOM 0 H SER A 113 97.868 20.300 -1.714 1.00 1.00 H new ATOM 0 HA SER A 113 97.287 17.604 -0.919 1.00 1.00 H new ATOM 0 HB2 SER A 113 95.396 19.634 -2.151 1.00 1.00 H new ATOM 0 HB3 SER A 113 95.006 18.324 -1.054 1.00 1.00 H new ATOM 0 HG SER A 113 95.500 20.757 -0.324 1.00 1.00 H new ATOM 1627 N VAL A 114 97.833 16.801 -3.354 1.00 1.00 N ATOM 1628 CA VAL A 114 97.817 16.132 -4.658 1.00 1.00 C ATOM 1629 C VAL A 114 97.002 14.840 -4.600 1.00 1.00 C ATOM 1630 O VAL A 114 97.528 13.753 -4.845 1.00 1.00 O ATOM 1631 CB VAL A 114 99.252 15.827 -5.107 1.00 1.00 C ATOM 1632 CG1 VAL A 114 99.257 15.457 -6.590 1.00 1.00 C ATOM 1633 CG2 VAL A 114 100.139 17.062 -4.889 1.00 1.00 C ATOM 0 H VAL A 114 98.581 16.497 -2.730 1.00 1.00 H new ATOM 0 HA VAL A 114 97.347 16.800 -5.380 1.00 1.00 H new ATOM 0 HB VAL A 114 99.640 14.994 -4.521 1.00 1.00 H new ATOM 0 HG11 VAL A 114 100.277 15.241 -6.908 1.00 1.00 H new ATOM 0 HG12 VAL A 114 98.633 14.577 -6.748 1.00 1.00 H new ATOM 0 HG13 VAL A 114 98.864 16.289 -7.174 1.00 1.00 H new ATOM 0 HG21 VAL A 114 101.157 16.840 -5.209 1.00 1.00 H new ATOM 0 HG22 VAL A 114 99.749 17.897 -5.471 1.00 1.00 H new ATOM 0 HG23 VAL A 114 100.141 17.326 -3.832 1.00 1.00 H new ATOM 1637 N GLY A 115 95.711 14.967 -4.290 1.00 1.00 N ATOM 1638 CA GLY A 115 94.836 13.799 -4.221 1.00 1.00 C ATOM 1639 C GLY A 115 93.466 14.157 -3.636 1.00 1.00 C ATOM 1640 O GLY A 115 93.212 15.307 -3.280 1.00 1.00 O ATOM 0 H GLY A 115 95.254 15.855 -4.085 1.00 1.00 H new ATOM 0 HA2 GLY A 115 94.708 13.379 -5.219 1.00 1.00 H new ATOM 0 HA3 GLY A 115 95.304 13.028 -3.609 1.00 1.00 H new ATOM 1644 N GLY A 116 92.589 13.155 -3.539 1.00 1.00 N ATOM 1645 CA GLY A 116 91.244 13.352 -2.996 1.00 1.00 C ATOM 1646 C GLY A 116 91.292 13.847 -1.540 1.00 1.00 C ATOM 1647 O GLY A 116 91.625 15.008 -1.302 1.00 1.00 O ATOM 0 H GLY A 116 92.787 12.198 -3.830 1.00 1.00 H new ATOM 0 HA2 GLY A 116 90.705 14.074 -3.609 1.00 1.00 H new ATOM 0 HA3 GLY A 116 90.690 12.415 -3.045 1.00 1.00 H new ATOM 1651 N PRO A 117 90.962 13.015 -0.562 1.00 1.00 N ATOM 1652 CA PRO A 117 90.969 13.429 0.870 1.00 1.00 C ATOM 1653 C PRO A 117 92.349 13.893 1.287 1.00 1.00 C ATOM 1654 O PRO A 117 92.522 14.504 2.341 1.00 1.00 O ATOM 1655 CB PRO A 117 90.522 12.187 1.648 1.00 1.00 C ATOM 1656 CG PRO A 117 90.742 11.051 0.713 1.00 1.00 C ATOM 1657 CD PRO A 117 90.569 11.605 -0.694 1.00 1.00 C ATOM 0 HA PRO A 117 90.306 14.273 1.062 1.00 1.00 H new ATOM 0 HB2 PRO A 117 91.102 12.064 2.563 1.00 1.00 H new ATOM 0 HB3 PRO A 117 89.475 12.260 1.942 1.00 1.00 H new ATOM 0 HG2 PRO A 117 91.739 10.629 0.843 1.00 1.00 H new ATOM 0 HG3 PRO A 117 90.029 10.249 0.904 1.00 1.00 H new ATOM 0 HD2 PRO A 117 91.198 11.079 -1.412 1.00 1.00 H new ATOM 0 HD3 PRO A 117 89.540 11.506 -1.040 1.00 1.00 H new ATOM 1665 N ILE A 118 93.328 13.603 0.443 1.00 1.00 N ATOM 1666 CA ILE A 118 94.685 14.008 0.738 1.00 1.00 C ATOM 1667 C ILE A 118 94.748 15.524 0.690 1.00 1.00 C ATOM 1668 O ILE A 118 94.588 16.127 -0.369 1.00 1.00 O ATOM 1669 CB ILE A 118 95.667 13.458 -0.300 1.00 1.00 C ATOM 1670 CG1 ILE A 118 95.567 11.934 -0.388 1.00 1.00 C ATOM 1671 CG2 ILE A 118 97.090 13.816 0.123 1.00 1.00 C ATOM 1672 CD1 ILE A 118 94.294 11.504 -1.121 1.00 1.00 C ATOM 0 H ILE A 118 93.208 13.098 -0.435 1.00 1.00 H new ATOM 0 HA ILE A 118 94.959 13.622 1.720 1.00 1.00 H new ATOM 0 HB ILE A 118 95.424 13.893 -1.269 1.00 1.00 H new ATOM 0 HG12 ILE A 118 96.440 11.539 -0.908 1.00 1.00 H new ATOM 0 HG13 ILE A 118 95.574 11.508 0.615 1.00 1.00 H new ATOM 0 HG21 ILE A 118 97.796 13.428 -0.611 1.00 1.00 H new ATOM 0 HG22 ILE A 118 97.189 14.900 0.185 1.00 1.00 H new ATOM 0 HG23 ILE A 118 97.301 13.376 1.098 1.00 1.00 H new ATOM 0 HD11 ILE A 118 94.251 10.416 -1.168 1.00 1.00 H new ATOM 0 HD12 ILE A 118 93.422 11.879 -0.586 1.00 1.00 H new ATOM 0 HD13 ILE A 118 94.302 11.911 -2.132 1.00 1.00 H new ATOM 1679 N GLY A 119 94.983 16.125 1.842 1.00 1.00 N ATOM 1680 CA GLY A 119 95.071 17.569 1.950 1.00 1.00 C ATOM 1681 C GLY A 119 96.506 18.029 1.780 1.00 1.00 C ATOM 1682 O GLY A 119 97.363 17.261 1.347 1.00 1.00 O ATOM 0 H GLY A 119 95.117 15.630 2.723 1.00 1.00 H new ATOM 0 HA2 GLY A 119 94.442 18.035 1.192 1.00 1.00 H new ATOM 0 HA3 GLY A 119 94.693 17.891 2.920 1.00 1.00 H new ATOM 1686 N PRO A 120 96.783 19.260 2.109 1.00 1.00 N ATOM 1687 CA PRO A 120 98.157 19.825 1.982 1.00 1.00 C ATOM 1688 C PRO A 120 99.169 19.131 2.900 1.00 1.00 C ATOM 1689 O PRO A 120 98.838 18.717 4.003 1.00 1.00 O ATOM 1690 CB PRO A 120 97.982 21.296 2.380 1.00 1.00 C ATOM 1691 CG PRO A 120 96.750 21.316 3.219 1.00 1.00 C ATOM 1692 CD PRO A 120 95.832 20.257 2.641 1.00 1.00 C ATOM 0 HA PRO A 120 98.557 19.690 0.977 1.00 1.00 H new ATOM 0 HB2 PRO A 120 98.846 21.662 2.936 1.00 1.00 H new ATOM 0 HB3 PRO A 120 97.874 21.934 1.503 1.00 1.00 H new ATOM 0 HG2 PRO A 120 96.985 21.102 4.262 1.00 1.00 H new ATOM 0 HG3 PRO A 120 96.277 22.298 3.194 1.00 1.00 H new ATOM 0 HD2 PRO A 120 95.179 19.828 3.401 1.00 1.00 H new ATOM 0 HD3 PRO A 120 95.189 20.661 1.859 1.00 1.00 H new ATOM 1700 N ASN A 121 100.408 19.044 2.437 1.00 1.00 N ATOM 1701 CA ASN A 121 101.487 18.442 3.220 1.00 1.00 C ATOM 1702 C ASN A 121 101.057 17.137 3.879 1.00 1.00 C ATOM 1703 O ASN A 121 101.127 17.001 5.099 1.00 1.00 O ATOM 1704 CB ASN A 121 101.958 19.434 4.293 1.00 1.00 C ATOM 1705 CG ASN A 121 103.387 19.119 4.730 1.00 1.00 C ATOM 1706 OD1 ASN A 121 103.754 17.878 4.896 1.00 1.00 O flip ATOM 1707 ND2 ASN A 121 104.186 20.033 4.935 1.00 1.00 N flip ATOM 0 H ASN A 121 100.695 19.383 1.519 1.00 1.00 H new ATOM 0 HA ASN A 121 102.304 18.211 2.537 1.00 1.00 H new ATOM 0 HB2 ASN A 121 101.908 20.450 3.903 1.00 1.00 H new ATOM 0 HB3 ASN A 121 101.291 19.390 5.154 1.00 1.00 H new ATOM 0 HD21 ASN A 121 103.897 21.002 4.804 1.00 1.00 H new ATOM 0 HD22 ASN A 121 105.137 19.821 5.235 1.00 1.00 H new ATOM 1714 N GLU A 122 100.612 16.181 3.072 1.00 1.00 N ATOM 1715 CA GLU A 122 100.170 14.890 3.596 1.00 1.00 C ATOM 1716 C GLU A 122 101.210 13.795 3.391 1.00 1.00 C ATOM 1717 O GLU A 122 101.704 13.582 2.284 1.00 1.00 O ATOM 1718 CB GLU A 122 98.888 14.458 2.882 1.00 1.00 C ATOM 1719 CG GLU A 122 97.684 15.215 3.422 1.00 1.00 C ATOM 1720 CD GLU A 122 97.397 14.785 4.857 1.00 1.00 C ATOM 1721 OE1 GLU A 122 96.574 15.417 5.493 1.00 1.00 O ATOM 1722 OE2 GLU A 122 98.012 13.828 5.301 1.00 1.00 O ATOM 0 H GLU A 122 100.547 16.272 2.058 1.00 1.00 H new ATOM 0 HA GLU A 122 100.006 15.021 4.666 1.00 1.00 H new ATOM 0 HB2 GLU A 122 98.985 14.638 1.811 1.00 1.00 H new ATOM 0 HB3 GLU A 122 98.737 13.386 3.013 1.00 1.00 H new ATOM 0 HG2 GLU A 122 97.873 16.288 3.386 1.00 1.00 H new ATOM 0 HG3 GLU A 122 96.813 15.024 2.795 1.00 1.00 H new ATOM 1729 N THR A 123 101.469 13.056 4.461 1.00 1.00 N ATOM 1730 CA THR A 123 102.370 11.916 4.402 1.00 1.00 C ATOM 1731 C THR A 123 101.496 10.687 4.214 1.00 1.00 C ATOM 1732 O THR A 123 100.531 10.495 4.952 1.00 1.00 O ATOM 1733 CB THR A 123 103.181 11.792 5.695 1.00 1.00 C ATOM 1734 OG1 THR A 123 104.070 12.895 5.797 1.00 1.00 O ATOM 1735 CG2 THR A 123 103.980 10.483 5.684 1.00 1.00 C ATOM 0 H THR A 123 101.066 13.227 5.382 1.00 1.00 H new ATOM 0 HA THR A 123 103.083 12.029 3.586 1.00 1.00 H new ATOM 0 HB THR A 123 102.504 11.788 6.550 1.00 1.00 H new ATOM 0 HG1 THR A 123 104.349 13.005 6.730 1.00 1.00 H new ATOM 0 HG21 THR A 123 104.555 10.400 6.606 1.00 1.00 H new ATOM 0 HG22 THR A 123 103.295 9.639 5.607 1.00 1.00 H new ATOM 0 HG23 THR A 123 104.659 10.478 4.831 1.00 1.00 H new ATOM 1743 N LEU A 124 101.819 9.865 3.225 1.00 1.00 N ATOM 1744 CA LEU A 124 101.027 8.664 2.949 1.00 1.00 C ATOM 1745 C LEU A 124 101.835 7.402 3.220 1.00 1.00 C ATOM 1746 O LEU A 124 103.044 7.354 2.994 1.00 1.00 O ATOM 1747 CB LEU A 124 100.569 8.633 1.477 1.00 1.00 C ATOM 1748 CG LEU A 124 99.667 9.836 1.090 1.00 1.00 C ATOM 1749 CD1 LEU A 124 98.682 10.183 2.194 1.00 1.00 C ATOM 1750 CD2 LEU A 124 100.513 11.065 0.784 1.00 1.00 C ATOM 0 H LEU A 124 102.616 10.002 2.603 1.00 1.00 H new ATOM 0 HA LEU A 124 100.159 8.696 3.608 1.00 1.00 H new ATOM 0 HB2 LEU A 124 101.447 8.623 0.831 1.00 1.00 H new ATOM 0 HB3 LEU A 124 100.026 7.706 1.292 1.00 1.00 H new ATOM 0 HG LEU A 124 99.108 9.538 0.203 1.00 1.00 H new ATOM 0 HD11 LEU A 124 98.070 11.030 1.883 1.00 1.00 H new ATOM 0 HD12 LEU A 124 98.040 9.325 2.392 1.00 1.00 H new ATOM 0 HD13 LEU A 124 99.228 10.444 3.100 1.00 1.00 H new ATOM 0 HD21 LEU A 124 99.862 11.897 0.515 1.00 1.00 H new ATOM 0 HD22 LEU A 124 101.098 11.332 1.664 1.00 1.00 H new ATOM 0 HD23 LEU A 124 101.185 10.847 -0.046 1.00 1.00 H new ATOM 1762 N ILE A 125 101.134 6.373 3.684 1.00 1.00 N ATOM 1763 CA ILE A 125 101.732 5.078 3.974 1.00 1.00 C ATOM 1764 C ILE A 125 101.003 4.026 3.182 1.00 1.00 C ATOM 1765 O ILE A 125 99.801 4.140 2.962 1.00 1.00 O ATOM 1766 CB ILE A 125 101.582 4.749 5.468 1.00 1.00 C ATOM 1767 CG1 ILE A 125 101.734 3.223 5.693 1.00 1.00 C ATOM 1768 CG2 ILE A 125 100.190 5.178 5.927 1.00 1.00 C ATOM 1769 CD1 ILE A 125 101.901 2.883 7.166 1.00 1.00 C ATOM 0 H ILE A 125 100.132 6.415 3.870 1.00 1.00 H new ATOM 0 HA ILE A 125 102.790 5.103 3.711 1.00 1.00 H new ATOM 0 HB ILE A 125 102.351 5.275 6.033 1.00 1.00 H new ATOM 0 HG12 ILE A 125 100.858 2.708 5.298 1.00 1.00 H new ATOM 0 HG13 ILE A 125 102.596 2.858 5.136 1.00 1.00 H new ATOM 0 HG21 ILE A 125 100.070 4.950 6.986 1.00 1.00 H new ATOM 0 HG22 ILE A 125 100.070 6.250 5.770 1.00 1.00 H new ATOM 0 HG23 ILE A 125 99.436 4.640 5.352 1.00 1.00 H new ATOM 0 HD11 ILE A 125 102.004 1.804 7.281 1.00 1.00 H new ATOM 0 HD12 ILE A 125 102.792 3.376 7.555 1.00 1.00 H new ATOM 0 HD13 ILE A 125 101.027 3.225 7.720 1.00 1.00 H new ATOM 1776 N PHE A 126 101.719 2.981 2.789 1.00 1.00 N ATOM 1777 CA PHE A 126 101.091 1.897 2.062 1.00 1.00 C ATOM 1778 C PHE A 126 101.609 0.552 2.525 1.00 1.00 C ATOM 1779 O PHE A 126 102.764 0.423 2.933 1.00 1.00 O ATOM 1780 CB PHE A 126 101.349 2.019 0.563 1.00 1.00 C ATOM 1781 CG PHE A 126 101.346 3.464 0.150 1.00 1.00 C ATOM 1782 CD1 PHE A 126 100.317 3.965 -0.655 1.00 1.00 C ATOM 1783 CD2 PHE A 126 102.381 4.303 0.567 1.00 1.00 C ATOM 1784 CE1 PHE A 126 100.328 5.309 -1.039 1.00 1.00 C ATOM 1785 CE2 PHE A 126 102.385 5.641 0.186 1.00 1.00 C ATOM 1786 CZ PHE A 126 101.363 6.145 -0.613 1.00 1.00 C ATOM 0 H PHE A 126 102.718 2.865 2.960 1.00 1.00 H new ATOM 0 HA PHE A 126 100.021 1.965 2.260 1.00 1.00 H new ATOM 0 HB2 PHE A 126 102.308 1.564 0.314 1.00 1.00 H new ATOM 0 HB3 PHE A 126 100.584 1.474 0.010 1.00 1.00 H new ATOM 0 HD1 PHE A 126 99.517 3.316 -0.979 1.00 1.00 H new ATOM 0 HD2 PHE A 126 103.177 3.914 1.184 1.00 1.00 H new ATOM 0 HE1 PHE A 126 99.538 5.700 -1.663 1.00 1.00 H new ATOM 0 HE2 PHE A 126 103.184 6.291 0.511 1.00 1.00 H new ATOM 0 HZ PHE A 126 101.370 7.185 -0.904 1.00 1.00 H new ATOM 1796 N LYS A 127 100.760 -0.465 2.403 1.00 1.00 N ATOM 1797 CA LYS A 127 101.149 -1.809 2.744 1.00 1.00 C ATOM 1798 C LYS A 127 101.468 -2.471 1.432 1.00 1.00 C ATOM 1799 O LYS A 127 100.650 -2.422 0.537 1.00 1.00 O ATOM 1800 CB LYS A 127 100.000 -2.568 3.458 1.00 1.00 C ATOM 1801 CG LYS A 127 98.928 -1.609 3.984 1.00 1.00 C ATOM 1802 CD LYS A 127 99.499 -0.667 5.060 1.00 1.00 C ATOM 1803 CE LYS A 127 98.386 0.248 5.574 1.00 1.00 C ATOM 1804 NZ LYS A 127 98.915 1.107 6.670 1.00 1.00 N ATOM 0 H LYS A 127 99.800 -0.373 2.070 1.00 1.00 H new ATOM 0 HA LYS A 127 101.995 -1.813 3.431 1.00 1.00 H new ATOM 0 HB2 LYS A 127 99.546 -3.276 2.765 1.00 1.00 H new ATOM 0 HB3 LYS A 127 100.407 -3.148 4.286 1.00 1.00 H new ATOM 0 HG2 LYS A 127 98.527 -1.021 3.159 1.00 1.00 H new ATOM 0 HG3 LYS A 127 98.099 -2.181 4.401 1.00 1.00 H new ATOM 0 HD2 LYS A 127 99.917 -1.247 5.883 1.00 1.00 H new ATOM 0 HD3 LYS A 127 100.312 -0.072 4.644 1.00 1.00 H new ATOM 0 HE2 LYS A 127 98.007 0.869 4.762 1.00 1.00 H new ATOM 0 HE3 LYS A 127 97.549 -0.348 5.937 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 98.446 0.857 7.564 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 99.940 0.959 6.763 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 98.728 2.106 6.449 1.00 1.00 H new ATOM 1818 N ILE A 128 102.659 -3.034 1.271 1.00 1.00 N ATOM 1819 CA ILE A 128 102.998 -3.629 -0.030 1.00 1.00 C ATOM 1820 C ILE A 128 103.291 -5.114 0.083 1.00 1.00 C ATOM 1821 O ILE A 128 104.222 -5.541 0.766 1.00 1.00 O ATOM 1822 CB ILE A 128 104.186 -2.877 -0.661 1.00 1.00 C ATOM 1823 CG1 ILE A 128 104.069 -1.383 -0.279 1.00 1.00 C ATOM 1824 CG2 ILE A 128 104.116 -3.021 -2.188 1.00 1.00 C ATOM 1825 CD1 ILE A 128 105.175 -0.542 -0.920 1.00 1.00 C ATOM 0 H ILE A 128 103.384 -3.095 1.986 1.00 1.00 H new ATOM 0 HA ILE A 128 102.130 -3.528 -0.681 1.00 1.00 H new ATOM 0 HB ILE A 128 105.131 -3.284 -0.303 1.00 1.00 H new ATOM 0 HG12 ILE A 128 103.096 -1.003 -0.592 1.00 1.00 H new ATOM 0 HG13 ILE A 128 104.117 -1.281 0.805 1.00 1.00 H new ATOM 0 HG21 ILE A 128 104.953 -2.491 -2.642 1.00 1.00 H new ATOM 0 HG22 ILE A 128 104.165 -4.076 -2.457 1.00 1.00 H new ATOM 0 HG23 ILE A 128 103.179 -2.598 -2.551 1.00 1.00 H new ATOM 0 HD11 ILE A 128 105.056 0.501 -0.626 1.00 1.00 H new ATOM 0 HD12 ILE A 128 106.147 -0.904 -0.586 1.00 1.00 H new ATOM 0 HD13 ILE A 128 105.111 -0.623 -2.005 1.00 1.00 H new ATOM 1832 N HIS A 129 102.471 -5.885 -0.630 1.00 1.00 N ATOM 1833 CA HIS A 129 102.589 -7.340 -0.675 1.00 1.00 C ATOM 1834 C HIS A 129 103.028 -7.751 -2.072 1.00 1.00 C ATOM 1835 O HIS A 129 102.399 -7.363 -3.055 1.00 1.00 O ATOM 1836 CB HIS A 129 101.230 -7.973 -0.360 1.00 1.00 C ATOM 1837 CG HIS A 129 101.285 -9.454 -0.609 1.00 1.00 C ATOM 1838 ND1 HIS A 129 102.276 -10.398 -0.425 1.00 1.00 N flip ATOM 1839 CD2 HIS A 129 100.232 -10.120 -1.209 1.00 1.00 C flip ATOM 1840 CE1 HIS A 129 101.835 -11.626 -0.927 1.00 1.00 C flip ATOM 1841 NE2 HIS A 129 100.601 -11.397 -1.379 1.00 1.00 N flip ATOM 0 H HIS A 129 101.705 -5.516 -1.194 1.00 1.00 H new ATOM 0 HA HIS A 129 103.321 -7.677 0.060 1.00 1.00 H new ATOM 0 HB2 HIS A 129 100.961 -7.780 0.679 1.00 1.00 H new ATOM 0 HB3 HIS A 129 100.456 -7.520 -0.979 1.00 1.00 H new ATOM 0 HD2 HIS A 129 99.283 -9.688 -1.490 1.00 1.00 H new ATOM 0 HE1 HIS A 129 102.377 -12.560 -0.945 1.00 1.00 H new ATOM 0 HE2 HIS A 129 100.008 -12.110 -1.804 1.00 1.00 H new ATOM 1849 N LEU A 130 104.123 -8.511 -2.173 1.00 1.00 N ATOM 1850 CA LEU A 130 104.620 -8.917 -3.494 1.00 1.00 C ATOM 1851 C LEU A 130 104.097 -10.289 -3.931 1.00 1.00 C ATOM 1852 O LEU A 130 104.442 -11.312 -3.343 1.00 1.00 O ATOM 1853 CB LEU A 130 106.165 -8.946 -3.505 1.00 1.00 C ATOM 1854 CG LEU A 130 106.723 -8.025 -4.591 1.00 1.00 C ATOM 1855 CD1 LEU A 130 108.242 -7.897 -4.437 1.00 1.00 C ATOM 1856 CD2 LEU A 130 106.399 -8.627 -5.960 1.00 1.00 C ATOM 0 H LEU A 130 104.670 -8.850 -1.382 1.00 1.00 H new ATOM 0 HA LEU A 130 104.248 -8.175 -4.200 1.00 1.00 H new ATOM 0 HB2 LEU A 130 106.545 -8.637 -2.531 1.00 1.00 H new ATOM 0 HB3 LEU A 130 106.512 -9.965 -3.674 1.00 1.00 H new ATOM 0 HG LEU A 130 106.273 -7.036 -4.500 1.00 1.00 H new ATOM 0 HD11 LEU A 130 108.632 -7.240 -5.214 1.00 1.00 H new ATOM 0 HD12 LEU A 130 108.474 -7.479 -3.457 1.00 1.00 H new ATOM 0 HD13 LEU A 130 108.701 -8.881 -4.530 1.00 1.00 H new ATOM 0 HD21 LEU A 130 106.792 -7.980 -6.744 1.00 1.00 H new ATOM 0 HD22 LEU A 130 106.856 -9.613 -6.041 1.00 1.00 H new ATOM 0 HD23 LEU A 130 105.318 -8.717 -6.071 1.00 1.00 H new ATOM 1868 N ILE A 131 103.293 -10.296 -4.992 1.00 1.00 N ATOM 1869 CA ILE A 131 102.758 -11.531 -5.540 1.00 1.00 C ATOM 1870 C ILE A 131 103.615 -12.026 -6.708 1.00 1.00 C ATOM 1871 O ILE A 131 103.940 -13.212 -6.781 1.00 1.00 O ATOM 1872 CB ILE A 131 101.312 -11.305 -5.985 1.00 1.00 C ATOM 1873 CG1 ILE A 131 100.432 -11.009 -4.757 1.00 1.00 C ATOM 1874 CG2 ILE A 131 100.797 -12.568 -6.658 1.00 1.00 C ATOM 1875 CD1 ILE A 131 100.497 -9.544 -4.363 1.00 1.00 C ATOM 0 H ILE A 131 102.999 -9.454 -5.488 1.00 1.00 H new ATOM 0 HA ILE A 131 102.778 -12.300 -4.768 1.00 1.00 H new ATOM 0 HB ILE A 131 101.274 -10.464 -6.677 1.00 1.00 H new ATOM 0 HG12 ILE A 131 99.399 -11.283 -4.974 1.00 1.00 H new ATOM 0 HG13 ILE A 131 100.756 -11.626 -3.919 1.00 1.00 H new ATOM 0 HG21 ILE A 131 99.766 -12.415 -6.978 1.00 1.00 H new ATOM 0 HG22 ILE A 131 101.416 -12.797 -7.525 1.00 1.00 H new ATOM 0 HG23 ILE A 131 100.839 -13.399 -5.953 1.00 1.00 H new ATOM 0 HD11 ILE A 131 99.863 -9.373 -3.493 1.00 1.00 H new ATOM 0 HD12 ILE A 131 101.526 -9.278 -4.121 1.00 1.00 H new ATOM 0 HD13 ILE A 131 100.148 -8.928 -5.192 1.00 1.00 H new ATOM 1882 N SER A 132 103.987 -11.123 -7.619 1.00 1.00 N ATOM 1883 CA SER A 132 104.811 -11.511 -8.770 1.00 1.00 C ATOM 1884 C SER A 132 105.674 -10.341 -9.248 1.00 1.00 C ATOM 1885 O SER A 132 105.380 -9.182 -8.962 1.00 1.00 O ATOM 1886 CB SER A 132 103.906 -12.003 -9.907 1.00 1.00 C ATOM 1887 OG SER A 132 103.472 -10.900 -10.688 1.00 1.00 O ATOM 0 H SER A 132 103.737 -10.135 -7.586 1.00 1.00 H new ATOM 0 HA SER A 132 105.479 -12.316 -8.464 1.00 1.00 H new ATOM 0 HB2 SER A 132 104.446 -12.713 -10.533 1.00 1.00 H new ATOM 0 HB3 SER A 132 103.045 -12.531 -9.496 1.00 1.00 H new ATOM 0 HG SER A 132 102.896 -11.219 -11.413 1.00 1.00 H new ATOM 1893 N VAL A 133 106.767 -10.661 -9.952 1.00 1.00 N ATOM 1894 CA VAL A 133 107.701 -9.645 -10.444 1.00 1.00 C ATOM 1895 C VAL A 133 107.949 -9.794 -11.936 1.00 1.00 C ATOM 1896 O VAL A 133 108.170 -10.894 -12.441 1.00 1.00 O ATOM 1897 CB VAL A 133 109.024 -9.770 -9.696 1.00 1.00 C ATOM 1898 CG1 VAL A 133 109.999 -8.699 -10.195 1.00 1.00 C ATOM 1899 CG2 VAL A 133 108.738 -9.553 -8.225 1.00 1.00 C ATOM 0 H VAL A 133 107.025 -11.618 -10.193 1.00 1.00 H new ATOM 0 HA VAL A 133 107.259 -8.664 -10.269 1.00 1.00 H new ATOM 0 HB VAL A 133 109.470 -10.751 -9.861 1.00 1.00 H new ATOM 0 HG11 VAL A 133 110.944 -8.789 -9.660 1.00 1.00 H new ATOM 0 HG12 VAL A 133 110.172 -8.834 -11.263 1.00 1.00 H new ATOM 0 HG13 VAL A 133 109.575 -7.710 -10.018 1.00 1.00 H new ATOM 0 HG21 VAL A 133 109.665 -9.636 -7.658 1.00 1.00 H new ATOM 0 HG22 VAL A 133 108.311 -8.561 -8.080 1.00 1.00 H new ATOM 0 HG23 VAL A 133 108.031 -10.306 -7.877 1.00 1.00 H new ATOM 1903 N LYS A 134 107.910 -8.665 -12.629 1.00 1.00 N ATOM 1904 CA LYS A 134 108.126 -8.630 -14.061 1.00 1.00 C ATOM 1905 C LYS A 134 109.599 -8.339 -14.392 1.00 1.00 C ATOM 1906 O LYS A 134 110.517 -8.758 -13.686 1.00 1.00 O ATOM 1907 CB LYS A 134 107.281 -7.506 -14.633 1.00 1.00 C ATOM 1908 CG LYS A 134 106.934 -7.776 -16.108 1.00 1.00 C ATOM 1909 CD LYS A 134 105.648 -8.589 -16.184 1.00 1.00 C ATOM 1910 CE LYS A 134 105.402 -8.996 -17.635 1.00 1.00 C ATOM 1911 NZ LYS A 134 104.014 -9.517 -17.778 1.00 1.00 N ATOM 0 H LYS A 134 107.728 -7.752 -12.212 1.00 1.00 H new ATOM 0 HA LYS A 134 107.856 -9.597 -14.485 1.00 1.00 H new ATOM 0 HB2 LYS A 134 106.364 -7.403 -14.052 1.00 1.00 H new ATOM 0 HB3 LYS A 134 107.819 -6.562 -14.549 1.00 1.00 H new ATOM 0 HG2 LYS A 134 106.814 -6.834 -16.643 1.00 1.00 H new ATOM 0 HG3 LYS A 134 107.748 -8.316 -16.592 1.00 1.00 H new ATOM 0 HD2 LYS A 134 105.724 -9.474 -15.553 1.00 1.00 H new ATOM 0 HD3 LYS A 134 104.809 -8.002 -15.810 1.00 1.00 H new ATOM 0 HE2 LYS A 134 105.550 -8.140 -18.294 1.00 1.00 H new ATOM 0 HE3 LYS A 134 106.120 -9.758 -17.937 1.00 1.00 H new ATOM 0 HZ1 LYS A 134 103.847 -9.794 -18.766 1.00 1.00 H new ATOM 0 HZ2 LYS A 134 103.888 -10.345 -17.161 1.00 1.00 H new ATOM 0 HZ3 LYS A 134 103.336 -8.777 -17.507 1.00 1.00 H new ATOM 1925 N LYS A 135 109.782 -7.577 -15.469 1.00 1.00 N ATOM 1926 CA LYS A 135 111.104 -7.161 -15.919 1.00 1.00 C ATOM 1927 C LYS A 135 110.975 -5.945 -16.832 1.00 1.00 C ATOM 1928 O LYS A 135 109.922 -5.700 -17.420 1.00 1.00 O ATOM 1929 CB LYS A 135 111.811 -8.340 -16.617 1.00 1.00 C ATOM 1930 CG LYS A 135 113.157 -8.653 -15.946 1.00 1.00 C ATOM 1931 CD LYS A 135 114.270 -7.750 -16.505 1.00 1.00 C ATOM 1932 CE LYS A 135 114.868 -8.371 -17.770 1.00 1.00 C ATOM 1933 NZ LYS A 135 115.370 -9.740 -17.461 1.00 1.00 N ATOM 0 H LYS A 135 109.018 -7.233 -16.051 1.00 1.00 H new ATOM 0 HA LYS A 135 111.717 -6.870 -15.066 1.00 1.00 H new ATOM 0 HB2 LYS A 135 111.171 -9.222 -16.585 1.00 1.00 H new ATOM 0 HB3 LYS A 135 111.972 -8.101 -17.668 1.00 1.00 H new ATOM 0 HG2 LYS A 135 113.073 -8.510 -14.869 1.00 1.00 H new ATOM 0 HG3 LYS A 135 113.415 -9.699 -16.109 1.00 1.00 H new ATOM 0 HD2 LYS A 135 113.868 -6.762 -16.731 1.00 1.00 H new ATOM 0 HD3 LYS A 135 115.049 -7.613 -15.755 1.00 1.00 H new ATOM 0 HE2 LYS A 135 114.115 -8.417 -18.557 1.00 1.00 H new ATOM 0 HE3 LYS A 135 115.682 -7.749 -18.144 1.00 1.00 H new ATOM 0 HZ1 LYS A 135 116.187 -9.956 -18.068 1.00 1.00 H new ATOM 0 HZ2 LYS A 135 115.658 -9.787 -16.463 1.00 1.00 H new ATOM 0 HZ3 LYS A 135 114.616 -10.434 -17.636 1.00 1.00 H new ATOM 1947 N SER A 136 112.051 -5.177 -16.913 1.00 1.00 N ATOM 1948 CA SER A 136 112.067 -3.962 -17.719 1.00 1.00 C ATOM 1949 C SER A 136 111.454 -4.206 -19.094 1.00 1.00 C ATOM 1950 O SER A 136 110.821 -3.316 -19.663 1.00 1.00 O ATOM 1951 CB SER A 136 113.505 -3.470 -17.883 1.00 1.00 C ATOM 1952 OG SER A 136 114.229 -4.404 -18.675 1.00 1.00 O ATOM 0 H SER A 136 112.928 -5.373 -16.430 1.00 1.00 H new ATOM 0 HA SER A 136 111.473 -3.206 -17.206 1.00 1.00 H new ATOM 0 HB2 SER A 136 113.515 -2.488 -18.356 1.00 1.00 H new ATOM 0 HB3 SER A 136 113.978 -3.358 -16.907 1.00 1.00 H new ATOM 0 HG SER A 136 115.152 -4.093 -18.785 1.00 1.00 H new ATOM 1958 N SER A 137 111.633 -5.415 -19.623 1.00 1.00 N ATOM 1959 CA SER A 137 111.078 -5.757 -20.931 1.00 1.00 C ATOM 1960 C SER A 137 109.654 -6.281 -20.783 1.00 1.00 C ATOM 1961 O SER A 137 108.739 -5.474 -20.816 1.00 1.00 O ATOM 1962 CB SER A 137 111.938 -6.819 -21.614 1.00 1.00 C ATOM 1963 OG SER A 137 111.410 -7.078 -22.909 1.00 1.00 O ATOM 1964 OXT SER A 137 109.498 -7.484 -20.640 1.00 1.00 O ATOM 0 H SER A 137 112.153 -6.167 -19.171 1.00 1.00 H new ATOM 0 HA SER A 137 111.068 -4.854 -21.542 1.00 1.00 H new ATOM 0 HB2 SER A 137 112.970 -6.477 -21.690 1.00 1.00 H new ATOM 0 HB3 SER A 137 111.948 -7.734 -21.021 1.00 1.00 H new ATOM 0 HG SER A 137 111.957 -7.758 -23.355 1.00 1.00 H new TER 1970 SER A 137 HETATM 1971 C1 RAP A 138 101.395 4.948 -7.833 1.00 1.00 C HETATM 1972 O1 RAP A 138 102.695 5.314 -8.001 1.00 1.00 O HETATM 1973 O2 RAP A 138 100.511 5.110 -8.672 1.00 1.00 O HETATM 1974 C2 RAP A 138 101.113 4.303 -6.634 1.00 1.00 C HETATM 1975 C3 RAP A 138 101.922 3.017 -6.575 1.00 1.00 C HETATM 1976 C4 RAP A 138 101.483 2.148 -5.412 1.00 1.00 C HETATM 1977 C5 RAP A 138 100.015 1.799 -5.564 1.00 1.00 C HETATM 1978 C6 RAP A 138 99.177 3.065 -5.529 1.00 1.00 C HETATM 1979 N7 RAP A 138 99.652 4.080 -6.498 1.00 1.00 N HETATM 1980 C8 RAP A 138 98.817 5.074 -6.843 1.00 1.00 C HETATM 1981 O3 RAP A 138 99.291 6.170 -7.136 1.00 1.00 O HETATM 1982 C9 RAP A 138 97.435 4.940 -6.765 1.00 1.00 C HETATM 1983 O4 RAP A 138 96.904 3.840 -6.910 1.00 1.00 O HETATM 1984 C10 RAP A 138 96.658 6.094 -6.787 1.00 1.00 C HETATM 1985 O5 RAP A 138 96.981 6.860 -7.961 1.00 1.00 O HETATM 1986 O6 RAP A 138 95.271 5.726 -6.834 1.00 1.00 O HETATM 1987 C11 RAP A 138 96.935 6.906 -5.530 1.00 1.00 C HETATM 1988 C12 RAP A 138 97.641 8.196 -5.918 1.00 1.00 C HETATM 1989 C13 RAP A 138 96.765 9.002 -6.861 1.00 1.00 C HETATM 1990 C14 RAP A 138 96.242 8.091 -7.962 1.00 1.00 C HETATM 1991 C15 RAP A 138 96.297 8.794 -9.312 1.00 1.00 C HETATM 1992 C16 RAP A 138 97.699 9.290 -9.639 1.00 1.00 C HETATM 1993 O7 RAP A 138 97.627 10.677 -10.002 1.00 1.00 O HETATM 1994 C17 RAP A 138 98.243 8.590 -10.713 1.00 1.00 C HETATM 1995 C18 RAP A 138 99.052 9.278 -11.612 1.00 1.00 C HETATM 1996 C19 RAP A 138 99.621 8.647 -12.712 1.00 1.00 C HETATM 1997 C20 RAP A 138 100.430 9.367 -13.585 1.00 1.00 C HETATM 1998 C21 RAP A 138 100.998 8.737 -14.688 1.00 1.00 C HETATM 1999 C22 RAP A 138 101.814 9.453 -15.558 1.00 1.00 C HETATM 2000 C23 RAP A 138 102.384 8.823 -16.660 1.00 1.00 C HETATM 2001 C24 RAP A 138 103.845 9.224 -16.797 1.00 1.00 C HETATM 2002 C25 RAP A 138 104.735 7.993 -16.876 1.00 1.00 C HETATM 2003 C26 RAP A 138 104.735 7.319 -15.659 1.00 1.00 C HETATM 2004 O8 RAP A 138 105.386 7.769 -14.717 1.00 1.00 O HETATM 2005 C27 RAP A 138 104.056 6.114 -15.515 1.00 1.00 C HETATM 2006 O9 RAP A 138 103.704 5.598 -16.808 1.00 1.00 O HETATM 2007 C28 RAP A 138 102.800 6.349 -14.693 1.00 1.00 C HETATM 2008 O10 RAP A 138 103.015 7.436 -13.781 1.00 1.00 O HETATM 2009 C29 RAP A 138 102.474 5.215 -13.960 1.00 1.00 C HETATM 2010 C30 RAP A 138 103.226 4.949 -12.821 1.00 1.00 C HETATM 2011 C31 RAP A 138 102.953 3.855 -12.008 1.00 1.00 C HETATM 2012 C32 RAP A 138 102.726 4.256 -10.693 1.00 1.00 C HETATM 2013 O11 RAP A 138 102.758 3.415 -9.797 1.00 1.00 O HETATM 2014 C33 RAP A 138 102.259 5.536 -10.411 1.00 1.00 C HETATM 2015 C34 RAP A 138 102.958 6.095 -9.180 1.00 1.00 C HETATM 2016 C35 RAP A 138 102.559 7.544 -8.944 1.00 1.00 C HETATM 2017 C36 RAP A 138 102.813 8.368 -10.208 1.00 1.00 C HETATM 2018 C37 RAP A 138 103.839 9.453 -9.928 1.00 1.00 C HETATM 2019 C38 RAP A 138 103.317 10.391 -8.851 1.00 1.00 C HETATM 2020 C39 RAP A 138 104.334 11.503 -8.660 1.00 1.00 C HETATM 2021 O12 RAP A 138 103.859 12.480 -7.722 1.00 1.00 O HETATM 2022 C40 RAP A 138 105.662 10.919 -8.205 1.00 1.00 C HETATM 2023 O13 RAP A 138 106.616 11.980 -8.044 1.00 1.00 O HETATM 2024 C41 RAP A 138 106.177 9.933 -9.242 1.00 1.00 C HETATM 2025 C42 RAP A 138 105.150 8.835 -9.468 1.00 1.00 C HETATM 2026 C43 RAP A 138 95.638 7.233 -4.810 1.00 1.00 C HETATM 2027 C44 RAP A 138 98.183 7.201 -10.757 1.00 1.00 C HETATM 2028 C45 RAP A 138 101.628 9.246 -17.921 1.00 1.00 C HETATM 2029 C46 RAP A 138 106.167 8.427 -17.195 1.00 1.00 C HETATM 2030 C47 RAP A 138 101.662 4.240 -14.529 1.00 1.00 C HETATM 2031 C48 RAP A 138 104.142 2.895 -12.072 1.00 1.00 C HETATM 2032 C49 RAP A 138 101.093 7.675 -8.526 1.00 1.00 C HETATM 2033 C50 RAP A 138 97.346 11.505 -8.864 1.00 1.00 C HETATM 2034 C51 RAP A 138 104.854 4.953 -17.377 1.00 1.00 C HETATM 2035 C52 RAP A 138 103.727 11.948 -6.397 1.00 1.00 C HETATM 0 H523 RAP A 138 103.019 11.119 -6.406 1.00 1.00 H new HETATM 0 H522 RAP A 138 104.697 11.592 -6.049 1.00 1.00 H new HETATM 0 H521 RAP A 138 103.365 12.727 -5.726 1.00 1.00 H new HETATM 0 H513 RAP A 138 105.665 5.675 -17.476 1.00 1.00 H new HETATM 0 H512 RAP A 138 105.172 4.137 -16.728 1.00 1.00 H new HETATM 0 H511 RAP A 138 104.600 4.556 -18.360 1.00 1.00 H new HETATM 0 H503 RAP A 138 96.390 11.213 -8.428 1.00 1.00 H new HETATM 0 H502 RAP A 138 98.135 11.384 -8.122 1.00 1.00 H new HETATM 0 H501 RAP A 138 97.299 12.548 -9.176 1.00 1.00 H new HETATM 0 H493 RAP A 138 100.453 7.270 -9.310 1.00 1.00 H new HETATM 0 H492 RAP A 138 100.928 7.122 -7.601 1.00 1.00 H new HETATM 0 H491 RAP A 138 100.852 8.726 -8.368 1.00 1.00 H new HETATM 0 H483 RAP A 138 104.289 2.566 -13.101 1.00 1.00 H new HETATM 0 H482 RAP A 138 105.040 3.404 -11.722 1.00 1.00 H new HETATM 0 H481 RAP A 138 103.945 2.030 -11.439 1.00 1.00 H new HETATM 0 H473 RAP A 138 100.698 4.676 -14.790 1.00 1.00 H new HETATM 0 H472 RAP A 138 102.138 3.849 -15.428 1.00 1.00 H new HETATM 0 H471 RAP A 138 101.513 3.429 -13.816 1.00 1.00 H new HETATM 0 H463 RAP A 138 106.184 8.952 -18.150 1.00 1.00 H new HETATM 0 H462 RAP A 138 106.530 9.090 -16.410 1.00 1.00 H new HETATM 0 H461 RAP A 138 106.809 7.548 -17.253 1.00 1.00 H new HETATM 0 H453 RAP A 138 100.581 8.955 -17.832 1.00 1.00 H new HETATM 0 H452 RAP A 138 101.696 10.327 -18.040 1.00 1.00 H new HETATM 0 H451 RAP A 138 102.068 8.757 -18.790 1.00 1.00 H new HETATM 0 H443 RAP A 138 98.701 6.787 -9.892 1.00 1.00 H new HETATM 0 H442 RAP A 138 97.141 6.881 -10.743 1.00 1.00 H new HETATM 0 H441 RAP A 138 98.660 6.845 -11.670 1.00 1.00 H new HETATM 0 H433 RAP A 138 94.992 7.812 -5.470 1.00 1.00 H new HETATM 0 H432 RAP A 138 95.134 6.308 -4.529 1.00 1.00 H new HETATM 0 H431 RAP A 138 95.856 7.814 -3.914 1.00 1.00 H new HETATM 0 H422 RAP A 138 104.996 8.272 -8.548 1.00 1.00 H new HETATM 0 H421 RAP A 138 105.514 8.130 -10.216 1.00 1.00 H new HETATM 0 H412 RAP A 138 106.380 10.451 -10.179 1.00 1.00 H new HETATM 0 H411 RAP A 138 107.119 9.498 -8.907 1.00 1.00 H new HETATM 0 H382 RAP A 138 102.351 10.804 -9.142 1.00 1.00 H new HETATM 0 H381 RAP A 138 103.164 9.850 -7.917 1.00 1.00 H new HETATM 0 H362 RAP A 138 103.168 7.719 -11.009 1.00 1.00 H new HETATM 0 H361 RAP A 138 101.881 8.818 -10.551 1.00 1.00 H new HETATM 0 H332 RAP A 138 102.434 6.190 -11.265 1.00 1.00 H new HETATM 0 H331 RAP A 138 101.182 5.509 -10.245 1.00 1.00 H new HETATM 0 H31A RAP A 138 102.981 3.254 -6.476 1.00 1.00 H new HETATM 0 H242 RAP A 138 103.978 9.833 -17.691 1.00 1.00 H new HETATM 0 H241 RAP A 138 104.140 9.838 -15.946 1.00 1.00 H new HETATM 0 H152 RAP A 138 95.964 8.109 -10.092 1.00 1.00 H new HETATM 0 H151 RAP A 138 95.605 9.636 -9.311 1.00 1.00 H new HETATM 0 H132 RAP A 138 95.933 9.445 -6.314 1.00 1.00 H new HETATM 0 H131 RAP A 138 97.336 9.824 -7.293 1.00 1.00 H new HETATM 0 H122 RAP A 138 97.864 8.781 -5.026 1.00 1.00 H new HETATM 0 H121 RAP A 138 98.594 7.969 -6.397 1.00 1.00 H new HETATM 0 HO6 RAP A 138 95.193 4.751 -6.891 1.00 1.00 H new HETATM 0 HO3 RAP A 138 106.162 12.779 -7.703 1.00 1.00 H new HETATM 0 HO1 RAP A 138 103.977 7.569 -13.651 1.00 1.00 H new HETATM 0 H62 RAP A 138 98.138 2.817 -5.746 1.00 1.00 H new HETATM 0 H61 RAP A 138 99.201 3.486 -4.524 1.00 1.00 H new HETATM 0 H52 RAP A 138 99.853 1.271 -6.504 1.00 1.00 H new HETATM 0 H51 RAP A 138 99.707 1.126 -4.763 1.00 1.00 H new HETATM 0 H42 RAP A 138 102.082 1.238 -5.378 1.00 1.00 H new HETATM 0 H41 RAP A 138 101.647 2.673 -4.471 1.00 1.00 H new HETATM 0 H40 RAP A 138 105.521 10.401 -7.256 1.00 1.00 H new HETATM 0 H39 RAP A 138 104.481 12.006 -9.616 1.00 1.00 H new HETATM 0 H37 RAP A 138 104.013 10.013 -10.847 1.00 1.00 H new HETATM 0 H35 RAP A 138 103.171 7.923 -8.126 1.00 1.00 H new HETATM 0 H34 RAP A 138 104.029 6.045 -9.377 1.00 1.00 H new HETATM 0 H32 RAP A 138 101.805 2.467 -7.509 1.00 1.00 H new HETATM 0 H31 RAP A 138 102.050 3.357 -12.361 1.00 1.00 H new HETATM 0 H30 RAP A 138 104.049 5.614 -12.559 1.00 1.00 H new HETATM 0 H28 RAP A 138 101.984 6.584 -15.377 1.00 1.00 H new HETATM 0 H27 RAP A 138 104.694 5.390 -15.009 1.00 1.00 H new HETATM 0 H25 RAP A 138 104.354 7.333 -17.655 1.00 1.00 H new HETATM 0 H23 RAP A 138 102.322 7.743 -16.527 1.00 1.00 H new HETATM 0 H22 RAP A 138 102.007 10.510 -15.376 1.00 1.00 H new HETATM 0 H21 RAP A 138 100.803 7.680 -14.871 1.00 1.00 H new HETATM 0 H20 RAP A 138 100.619 10.425 -13.405 1.00 1.00 H new HETATM 0 H2 RAP A 138 101.403 4.921 -5.784 1.00 1.00 H new HETATM 0 H19 RAP A 138 99.433 7.588 -12.891 1.00 1.00 H new HETATM 0 H18 RAP A 138 99.244 10.339 -11.450 1.00 1.00 H new HETATM 0 H16 RAP A 138 98.328 9.141 -8.762 1.00 1.00 H new HETATM 0 H14 RAP A 138 95.195 7.854 -7.772 1.00 1.00 H new HETATM 0 H11 RAP A 138 97.566 6.321 -4.860 1.00 1.00 H new