USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 120 GLN : amide:sc= 0.0899 X(o=-0.28,f=-0.54) USER MOD Set 1.2: A 123 GLN : amide:sc= -0.372 X(o=-0.28,f=-0.54) USER MOD Set 2.1: A 86 SER OG : rot 101:sc= 0.406 USER MOD Set 2.2: A 89 HIS : no HE2:sc= -1.17 K(o=0.87,f=-3!) USER MOD Set 2.3: A 108 ASN : amide:sc= 1.44 K(o=0.87,f=-2.8) USER MOD Set 2.4: A 110 THR OG1 : rot -66:sc= 0.198 USER MOD Set 3.1: A 11 GLN : amide:sc= 0.459 K(o=2.5,f=0.88) USER MOD Set 3.2: A 73 HIS : no HE2:sc= 2.09 K(o=2.5,f=-6.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 171:sc= 2.07 (180deg=1.39) USER MOD Single : A 2 SER OG : rot 180:sc= -0.151 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -178:sc= 1.28 (180deg=1.15) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 77:sc= 1.07 USER MOD Single : A 29 SER OG : rot -82:sc= 0.146! USER MOD Single : A 30 THR OG1 : rot 90:sc= 2.29 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -1:sc= 0.365 USER MOD Single : A 37 THR OG1 : rot 49:sc= 0.04 USER MOD Single : A 41 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.8!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 171:sc=-0.000491 (180deg=-0.0916) USER MOD Single : A 56 ASN : amide:sc= -0.312 K(o=-0.31,f=-4.7!) USER MOD Single : A 65 GLN : amide:sc= 1.18 K(o=1.2,f=-0.046) USER MOD Single : A 67 THR OG1 : rot 180:sc=-0.000423 USER MOD Single : A 68 THR OG1 : rot 180:sc= -0.0642 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 3:sc= 0.871 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -0.0353 X(o=-0.035,f=-0.42) USER MOD Single : A 106 SER OG : rot -25:sc= 1.24 USER MOD Single : A 111 TYR OH : rot 30:sc= -0.0304 USER MOD Single : A 113 ASN : amide:sc= -0.443 K(o=-0.44,f=-1.5) USER MOD Single : A 118 ASN : amide:sc= -0.443 K(o=-0.44,f=-7.1!) USER MOD Single : A 122 MET CE :methyl -126:sc= -1.34 (180deg=-2.8!) USER MOD Single : A 124 THR OG1 : rot 88:sc= 1.46 USER MOD Single : A 129 GLN : amide:sc= -0.0783 K(o=-0.078,f=-1.4) USER MOD Single : A 132 LYS NZ :NH3+ 171:sc= 1.27 (180deg=1.22) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.616 -14.588 7.307 1.00 11.00 N ATOM 2 CA MET A 1 27.160 -14.757 8.658 1.00 43.05 C ATOM 3 C MET A 1 28.296 -13.794 8.824 1.00 24.24 C ATOM 4 O MET A 1 28.928 -13.419 7.834 1.00 15.31 O ATOM 5 CB MET A 1 27.667 -16.189 8.909 1.00 62.25 C ATOM 6 CG MET A 1 26.606 -17.287 8.892 1.00 10.54 C ATOM 7 SD MET A 1 25.843 -17.521 7.278 1.00 1.10 S ATOM 8 CE MET A 1 24.705 -18.863 7.635 1.00 71.23 C ATOM 0 H1 MET A 1 25.930 -15.345 7.112 1.00 11.00 H new ATOM 0 H2 MET A 1 26.143 -13.665 7.236 1.00 11.00 H new ATOM 0 H3 MET A 1 27.389 -14.635 6.613 1.00 11.00 H new ATOM 0 HA MET A 1 26.364 -14.566 9.378 1.00 43.05 H new ATOM 0 HB2 MET A 1 28.418 -16.425 8.155 1.00 62.25 H new ATOM 0 HB3 MET A 1 28.169 -16.211 9.876 1.00 62.25 H new ATOM 0 HG2 MET A 1 27.060 -18.225 9.210 1.00 10.54 H new ATOM 0 HG3 MET A 1 25.832 -17.045 9.620 1.00 10.54 H new ATOM 0 HE1 MET A 1 24.155 -19.124 6.731 1.00 71.23 H new ATOM 0 HE2 MET A 1 25.264 -19.731 7.983 1.00 71.23 H new ATOM 0 HE3 MET A 1 24.003 -18.549 8.408 1.00 71.23 H new ATOM 20 N SER A 2 28.567 -13.381 10.066 1.00 35.40 N ATOM 21 CA SER A 2 29.626 -12.412 10.393 1.00 63.34 C ATOM 22 C SER A 2 29.550 -11.127 9.538 1.00 53.13 C ATOM 23 O SER A 2 30.546 -10.450 9.298 1.00 45.10 O ATOM 24 CB SER A 2 31.031 -13.083 10.405 1.00 15.34 C ATOM 25 OG SER A 2 31.228 -13.981 9.307 1.00 10.11 O ATOM 0 H SER A 2 28.054 -13.711 10.883 1.00 35.40 H new ATOM 0 HA SER A 2 29.448 -12.070 11.413 1.00 63.34 H new ATOM 0 HB2 SER A 2 31.798 -12.309 10.377 1.00 15.34 H new ATOM 0 HB3 SER A 2 31.161 -13.627 11.341 1.00 15.34 H new ATOM 0 HG SER A 2 32.125 -14.373 9.362 1.00 10.11 H new ATOM 31 N ASP A 3 28.351 -10.812 9.098 1.00 43.22 N ATOM 32 CA ASP A 3 28.090 -9.618 8.340 1.00 44.34 C ATOM 33 C ASP A 3 27.338 -8.662 9.231 1.00 75.24 C ATOM 34 O ASP A 3 26.288 -9.004 9.806 1.00 0.40 O ATOM 35 CB ASP A 3 27.324 -9.912 7.018 1.00 20.41 C ATOM 36 CG ASP A 3 25.959 -10.544 7.208 1.00 23.35 C ATOM 37 OD1 ASP A 3 25.881 -11.802 7.389 1.00 11.14 O ATOM 38 OD2 ASP A 3 24.939 -9.822 7.181 1.00 63.53 O ATOM 0 H ASP A 3 27.524 -11.387 9.261 1.00 43.22 H new ATOM 0 HA ASP A 3 29.033 -9.169 8.027 1.00 44.34 H new ATOM 0 HB2 ASP A 3 27.205 -8.979 6.467 1.00 20.41 H new ATOM 0 HB3 ASP A 3 27.933 -10.572 6.400 1.00 20.41 H new ATOM 43 N ASN A 4 27.908 -7.522 9.423 1.00 1.33 N ATOM 44 CA ASN A 4 27.371 -6.528 10.317 1.00 32.33 C ATOM 45 C ASN A 4 26.604 -5.491 9.528 1.00 41.41 C ATOM 46 O ASN A 4 27.086 -5.018 8.493 1.00 23.14 O ATOM 47 CB ASN A 4 28.529 -5.879 11.109 1.00 11.33 C ATOM 48 CG ASN A 4 28.087 -4.812 12.104 1.00 72.44 C ATOM 49 OD1 ASN A 4 27.735 -5.123 13.250 1.00 31.44 O ATOM 50 ND2 ASN A 4 28.162 -3.561 11.712 1.00 21.44 N ATOM 0 H ASN A 4 28.773 -7.241 8.961 1.00 1.33 H new ATOM 0 HA ASN A 4 26.683 -6.994 11.022 1.00 32.33 H new ATOM 0 HB2 ASN A 4 29.068 -6.659 11.646 1.00 11.33 H new ATOM 0 HB3 ASN A 4 29.231 -5.434 10.404 1.00 11.33 H new ATOM 0 HD21 ASN A 4 27.926 -2.809 12.359 1.00 21.44 H new ATOM 0 HD22 ASN A 4 28.456 -3.342 10.760 1.00 21.44 H new ATOM 57 N ASN A 5 25.402 -5.170 9.974 1.00 1.14 N ATOM 58 CA ASN A 5 24.606 -4.132 9.322 1.00 11.04 C ATOM 59 C ASN A 5 25.219 -2.790 9.600 1.00 23.44 C ATOM 60 O ASN A 5 25.528 -2.468 10.755 1.00 64.32 O ATOM 61 CB ASN A 5 23.132 -4.121 9.790 1.00 25.14 C ATOM 62 CG ASN A 5 22.310 -5.314 9.325 1.00 24.04 C ATOM 63 OD1 ASN A 5 22.821 -6.422 9.136 1.00 33.31 O ATOM 64 ND2 ASN A 5 21.033 -5.099 9.132 1.00 33.33 N ATOM 0 H ASN A 5 24.954 -5.607 10.779 1.00 1.14 H new ATOM 0 HA ASN A 5 24.606 -4.350 8.254 1.00 11.04 H new ATOM 0 HB2 ASN A 5 23.111 -4.084 10.879 1.00 25.14 H new ATOM 0 HB3 ASN A 5 22.658 -3.208 9.431 1.00 25.14 H new ATOM 0 HD21 ASN A 5 20.430 -5.859 8.817 1.00 33.33 H new ATOM 0 HD22 ASN A 5 20.641 -4.172 9.297 1.00 33.33 H new ATOM 71 N GLY A 6 25.416 -2.023 8.560 1.00 41.45 N ATOM 72 CA GLY A 6 25.997 -0.716 8.684 1.00 53.54 C ATOM 73 C GLY A 6 25.079 0.248 9.399 1.00 34.54 C ATOM 74 O GLY A 6 23.897 -0.050 9.628 1.00 21.45 O ATOM 0 H GLY A 6 25.178 -2.288 7.604 1.00 41.45 H new ATOM 0 HA2 GLY A 6 26.940 -0.789 9.227 1.00 53.54 H new ATOM 0 HA3 GLY A 6 26.229 -0.327 7.692 1.00 53.54 H new ATOM 78 N THR A 7 25.608 1.380 9.747 1.00 55.23 N ATOM 79 CA THR A 7 24.880 2.392 10.450 1.00 63.34 C ATOM 80 C THR A 7 24.004 3.179 9.459 1.00 0.14 C ATOM 81 O THR A 7 24.522 3.789 8.513 1.00 15.50 O ATOM 82 CB THR A 7 25.881 3.337 11.137 1.00 50.12 C ATOM 83 OG1 THR A 7 26.848 2.542 11.865 1.00 73.35 O ATOM 84 CG2 THR A 7 25.170 4.269 12.105 1.00 71.14 C ATOM 0 H THR A 7 26.576 1.632 9.547 1.00 55.23 H new ATOM 0 HA THR A 7 24.236 1.935 11.201 1.00 63.34 H new ATOM 0 HB THR A 7 26.376 3.941 10.376 1.00 50.12 H new ATOM 0 HG1 THR A 7 27.493 3.134 12.306 1.00 73.35 H new ATOM 0 HG21 THR A 7 25.899 4.927 12.578 1.00 71.14 H new ATOM 0 HG22 THR A 7 24.439 4.868 11.562 1.00 71.14 H new ATOM 0 HG23 THR A 7 24.662 3.681 12.869 1.00 71.14 H new ATOM 92 N PRO A 8 22.675 3.143 9.632 1.00 14.23 N ATOM 93 CA PRO A 8 21.759 3.841 8.742 1.00 61.21 C ATOM 94 C PRO A 8 21.750 5.340 9.031 1.00 50.30 C ATOM 95 O PRO A 8 21.644 5.763 10.191 1.00 22.34 O ATOM 96 CB PRO A 8 20.404 3.220 9.084 1.00 23.12 C ATOM 97 CG PRO A 8 20.527 2.805 10.506 1.00 65.43 C ATOM 98 CD PRO A 8 21.965 2.429 10.714 1.00 22.33 C ATOM 0 HA PRO A 8 22.029 3.742 7.690 1.00 61.21 H new ATOM 0 HB2 PRO A 8 19.594 3.937 8.950 1.00 23.12 H new ATOM 0 HB3 PRO A 8 20.185 2.368 8.440 1.00 23.12 H new ATOM 0 HG2 PRO A 8 20.237 3.616 11.174 1.00 65.43 H new ATOM 0 HG3 PRO A 8 19.870 1.963 10.723 1.00 65.43 H new ATOM 0 HD2 PRO A 8 22.321 2.737 11.697 1.00 22.33 H new ATOM 0 HD3 PRO A 8 22.111 1.351 10.645 1.00 22.33 H new ATOM 106 N GLU A 9 21.861 6.135 8.009 1.00 43.23 N ATOM 107 CA GLU A 9 21.890 7.564 8.179 1.00 0.42 C ATOM 108 C GLU A 9 20.531 8.148 7.824 1.00 52.33 C ATOM 109 O GLU A 9 20.065 8.001 6.684 1.00 14.13 O ATOM 110 CB GLU A 9 22.983 8.168 7.314 1.00 33.04 C ATOM 111 CG GLU A 9 24.338 7.521 7.536 1.00 52.43 C ATOM 112 CD GLU A 9 25.411 8.132 6.701 1.00 53.23 C ATOM 113 OE1 GLU A 9 25.432 7.907 5.469 1.00 31.23 O ATOM 114 OE2 GLU A 9 26.264 8.858 7.251 1.00 45.40 O ATOM 0 H GLU A 9 21.934 5.820 7.042 1.00 43.23 H new ATOM 0 HA GLU A 9 22.109 7.803 9.220 1.00 0.42 H new ATOM 0 HB2 GLU A 9 22.706 8.068 6.265 1.00 33.04 H new ATOM 0 HB3 GLU A 9 23.057 9.235 7.524 1.00 33.04 H new ATOM 0 HG2 GLU A 9 24.609 7.607 8.588 1.00 52.43 H new ATOM 0 HG3 GLU A 9 24.269 6.457 7.310 1.00 52.43 H new ATOM 121 N PRO A 10 19.863 8.784 8.790 1.00 52.22 N ATOM 122 CA PRO A 10 18.542 9.365 8.582 1.00 11.31 C ATOM 123 C PRO A 10 18.609 10.701 7.838 1.00 54.33 C ATOM 124 O PRO A 10 19.647 11.379 7.837 1.00 24.21 O ATOM 125 CB PRO A 10 18.025 9.571 10.008 1.00 3.20 C ATOM 126 CG PRO A 10 19.251 9.808 10.818 1.00 13.01 C ATOM 127 CD PRO A 10 20.348 9.001 10.174 1.00 74.01 C ATOM 0 HA PRO A 10 17.903 8.730 7.968 1.00 11.31 H new ATOM 0 HB2 PRO A 10 17.342 10.419 10.064 1.00 3.20 H new ATOM 0 HB3 PRO A 10 17.478 8.697 10.362 1.00 3.20 H new ATOM 0 HG2 PRO A 10 19.507 10.867 10.835 1.00 13.01 H new ATOM 0 HG3 PRO A 10 19.099 9.500 11.853 1.00 13.01 H new ATOM 0 HD2 PRO A 10 21.298 9.536 10.186 1.00 74.01 H new ATOM 0 HD3 PRO A 10 20.508 8.057 10.694 1.00 74.01 H new ATOM 135 N GLN A 11 17.521 11.060 7.209 1.00 12.11 N ATOM 136 CA GLN A 11 17.418 12.299 6.487 1.00 24.21 C ATOM 137 C GLN A 11 16.275 13.099 7.046 1.00 61.23 C ATOM 138 O GLN A 11 15.178 12.565 7.241 1.00 44.34 O ATOM 139 CB GLN A 11 17.148 12.037 5.007 1.00 22.03 C ATOM 140 CG GLN A 11 18.273 11.346 4.264 1.00 45.45 C ATOM 141 CD GLN A 11 17.947 11.106 2.802 1.00 15.43 C ATOM 142 OE1 GLN A 11 18.835 11.143 1.953 1.00 5.01 O ATOM 143 NE2 GLN A 11 16.700 10.818 2.494 1.00 30.32 N ATOM 0 H GLN A 11 16.673 10.494 7.184 1.00 12.11 H new ATOM 0 HA GLN A 11 18.357 12.843 6.590 1.00 24.21 H new ATOM 0 HB2 GLN A 11 16.248 11.429 4.919 1.00 22.03 H new ATOM 0 HB3 GLN A 11 16.939 12.988 4.517 1.00 22.03 H new ATOM 0 HG2 GLN A 11 19.177 11.951 4.336 1.00 45.45 H new ATOM 0 HG3 GLN A 11 18.489 10.392 4.745 1.00 45.45 H new ATOM 0 HE21 GLN A 11 15.987 10.796 3.223 1.00 30.32 H new ATOM 0 HE22 GLN A 11 16.447 10.617 1.527 1.00 30.32 H new ATOM 152 N VAL A 12 16.506 14.353 7.313 1.00 11.21 N ATOM 153 CA VAL A 12 15.455 15.223 7.793 1.00 62.24 C ATOM 154 C VAL A 12 15.560 16.555 7.075 1.00 73.21 C ATOM 155 O VAL A 12 16.589 17.241 7.147 1.00 72.12 O ATOM 156 CB VAL A 12 15.506 15.473 9.340 1.00 23.04 C ATOM 157 CG1 VAL A 12 14.299 16.289 9.788 1.00 20.24 C ATOM 158 CG2 VAL A 12 15.587 14.173 10.140 1.00 42.11 C ATOM 0 H VAL A 12 17.415 14.803 7.208 1.00 11.21 H new ATOM 0 HA VAL A 12 14.508 14.725 7.586 1.00 62.24 H new ATOM 0 HB VAL A 12 16.419 16.034 9.540 1.00 23.04 H new ATOM 0 HG11 VAL A 12 14.350 16.453 10.864 1.00 20.24 H new ATOM 0 HG12 VAL A 12 14.298 17.250 9.274 1.00 20.24 H new ATOM 0 HG13 VAL A 12 13.384 15.748 9.547 1.00 20.24 H new ATOM 0 HG21 VAL A 12 15.620 14.403 11.205 1.00 42.11 H new ATOM 0 HG22 VAL A 12 14.711 13.560 9.928 1.00 42.11 H new ATOM 0 HG23 VAL A 12 16.488 13.628 9.858 1.00 42.11 H new ATOM 168 N GLU A 13 14.508 16.916 6.409 1.00 54.03 N ATOM 169 CA GLU A 13 14.407 18.145 5.675 1.00 63.45 C ATOM 170 C GLU A 13 13.113 18.772 6.110 1.00 72.41 C ATOM 171 O GLU A 13 12.306 18.089 6.739 1.00 65.03 O ATOM 172 CB GLU A 13 14.392 17.861 4.176 1.00 24.42 C ATOM 173 CG GLU A 13 15.639 17.151 3.672 1.00 0.40 C ATOM 174 CD GLU A 13 15.512 16.726 2.242 1.00 73.42 C ATOM 175 OE1 GLU A 13 14.891 15.674 1.980 1.00 52.10 O ATOM 176 OE2 GLU A 13 15.991 17.436 1.348 1.00 24.01 O ATOM 0 H GLU A 13 13.664 16.345 6.358 1.00 54.03 H new ATOM 0 HA GLU A 13 15.253 18.805 5.867 1.00 63.45 H new ATOM 0 HB2 GLU A 13 13.519 17.253 3.940 1.00 24.42 H new ATOM 0 HB3 GLU A 13 14.279 18.803 3.639 1.00 24.42 H new ATOM 0 HG2 GLU A 13 16.499 17.813 3.777 1.00 0.40 H new ATOM 0 HG3 GLU A 13 15.832 16.276 4.293 1.00 0.40 H new ATOM 183 N THR A 14 12.889 20.006 5.777 1.00 14.22 N ATOM 184 CA THR A 14 11.734 20.701 6.275 1.00 72.23 C ATOM 185 C THR A 14 10.428 20.168 5.648 1.00 70.20 C ATOM 186 O THR A 14 10.165 20.336 4.451 1.00 4.33 O ATOM 187 CB THR A 14 11.886 22.208 6.006 1.00 30.32 C ATOM 188 OG1 THR A 14 13.210 22.613 6.424 1.00 35.13 O ATOM 189 CG2 THR A 14 10.851 23.006 6.791 1.00 0.34 C ATOM 0 H THR A 14 13.489 20.556 5.162 1.00 14.22 H new ATOM 0 HA THR A 14 11.669 20.527 7.349 1.00 72.23 H new ATOM 0 HB THR A 14 11.736 22.399 4.943 1.00 30.32 H new ATOM 0 HG1 THR A 14 13.326 23.572 6.258 1.00 35.13 H new ATOM 0 HG21 THR A 14 10.978 24.069 6.585 1.00 0.34 H new ATOM 0 HG22 THR A 14 9.850 22.696 6.493 1.00 0.34 H new ATOM 0 HG23 THR A 14 10.984 22.825 7.858 1.00 0.34 H new HETATM 197 N TPO A 15 9.665 19.477 6.452 1.00 33.42 N HETATM 198 CA TPO A 15 8.361 19.011 6.080 1.00 73.41 C HETATM 199 CB TPO A 15 8.166 17.556 6.515 1.00 75.00 C HETATM 200 CG2 TPO A 15 6.938 16.959 5.843 1.00 40.11 C HETATM 201 OG1 TPO A 15 9.280 16.764 6.074 1.00 2.54 O HETATM 202 P TPO A 15 9.765 15.374 6.747 1.00 24.41 P HETATM 203 O1P TPO A 15 11.177 15.494 7.296 1.00 60.13 O HETATM 204 O2P TPO A 15 9.823 14.314 5.652 1.00 34.24 O HETATM 205 O3P TPO A 15 8.802 14.948 7.867 1.00 51.31 O HETATM 206 C TPO A 15 7.315 19.856 6.803 1.00 73.25 C HETATM 207 O TPO A 15 7.308 19.920 8.039 1.00 11.21 O HETATM 0 HG23 TPO A 15 6.055 17.533 6.123 1.00 40.11 H new HETATM 0 HG22 TPO A 15 7.064 16.991 4.761 1.00 40.11 H new HETATM 0 HG21 TPO A 15 6.815 15.925 6.164 1.00 40.11 H new HETATM 0 HB TPO A 15 8.065 17.549 7.600 1.00 75.00 H new HETATM 0 HA TPO A 15 8.258 19.087 4.998 1.00 73.41 H new HETATM 0 H TPO A 15 10.310 18.854 6.938 1.00 33.42 H new ATOM 214 N SER A 16 6.462 20.502 6.058 1.00 52.21 N ATOM 215 CA SER A 16 5.417 21.305 6.636 1.00 33.45 C ATOM 216 C SER A 16 4.186 20.429 6.857 1.00 2.23 C ATOM 217 O SER A 16 3.943 19.482 6.103 1.00 13.31 O ATOM 218 CB SER A 16 5.088 22.495 5.706 1.00 20.50 C ATOM 219 OG SER A 16 4.093 23.356 6.261 1.00 31.02 O ATOM 0 H SER A 16 6.470 20.488 5.038 1.00 52.21 H new ATOM 0 HA SER A 16 5.744 21.709 7.594 1.00 33.45 H new ATOM 0 HB2 SER A 16 5.996 23.067 5.516 1.00 20.50 H new ATOM 0 HB3 SER A 16 4.743 22.117 4.744 1.00 20.50 H new ATOM 0 HG SER A 16 3.917 24.095 5.642 1.00 31.02 H new ATOM 225 N VAL A 17 3.451 20.717 7.902 1.00 61.40 N ATOM 226 CA VAL A 17 2.250 19.993 8.212 1.00 71.05 C ATOM 227 C VAL A 17 1.108 20.615 7.433 1.00 12.35 C ATOM 228 O VAL A 17 0.769 21.790 7.638 1.00 21.20 O ATOM 229 CB VAL A 17 1.928 20.051 9.735 1.00 43.23 C ATOM 230 CG1 VAL A 17 0.677 19.242 10.071 1.00 72.14 C ATOM 231 CG2 VAL A 17 3.117 19.572 10.560 1.00 70.31 C ATOM 0 H VAL A 17 3.672 21.463 8.562 1.00 61.40 H new ATOM 0 HA VAL A 17 2.386 18.946 7.939 1.00 71.05 H new ATOM 0 HB VAL A 17 1.730 21.092 9.991 1.00 43.23 H new ATOM 0 HG11 VAL A 17 0.481 19.304 11.141 1.00 72.14 H new ATOM 0 HG12 VAL A 17 -0.175 19.644 9.522 1.00 72.14 H new ATOM 0 HG13 VAL A 17 0.831 18.200 9.790 1.00 72.14 H new ATOM 0 HG21 VAL A 17 2.868 19.622 11.620 1.00 70.31 H new ATOM 0 HG22 VAL A 17 3.355 18.543 10.291 1.00 70.31 H new ATOM 0 HG23 VAL A 17 3.979 20.208 10.360 1.00 70.31 H new ATOM 241 N PHE A 18 0.537 19.867 6.539 1.00 55.23 N ATOM 242 CA PHE A 18 -0.543 20.367 5.739 1.00 74.20 C ATOM 243 C PHE A 18 -1.797 19.590 6.057 1.00 31.24 C ATOM 244 O PHE A 18 -1.764 18.364 6.157 1.00 35.21 O ATOM 245 CB PHE A 18 -0.203 20.314 4.219 1.00 3.33 C ATOM 246 CG PHE A 18 -0.123 18.928 3.598 1.00 74.42 C ATOM 247 CD1 PHE A 18 0.838 18.013 3.999 1.00 1.34 C ATOM 248 CD2 PHE A 18 -1.021 18.552 2.610 1.00 15.53 C ATOM 249 CE1 PHE A 18 0.899 16.760 3.429 1.00 31.11 C ATOM 250 CE2 PHE A 18 -0.960 17.298 2.035 1.00 4.10 C ATOM 251 CZ PHE A 18 0.000 16.401 2.446 1.00 72.25 C ATOM 0 H PHE A 18 0.802 18.902 6.343 1.00 55.23 H new ATOM 0 HA PHE A 18 -0.707 21.417 5.981 1.00 74.20 H new ATOM 0 HB2 PHE A 18 -0.956 20.889 3.679 1.00 3.33 H new ATOM 0 HB3 PHE A 18 0.753 20.815 4.064 1.00 3.33 H new ATOM 0 HD1 PHE A 18 1.547 18.285 4.767 1.00 1.34 H new ATOM 0 HD2 PHE A 18 -1.779 19.250 2.286 1.00 15.53 H new ATOM 0 HE1 PHE A 18 1.652 16.057 3.753 1.00 31.11 H new ATOM 0 HE2 PHE A 18 -1.664 17.021 1.264 1.00 4.10 H new ATOM 0 HZ PHE A 18 0.049 15.419 2.000 1.00 72.25 H new ATOM 261 N ARG A 19 -2.885 20.275 6.259 1.00 62.41 N ATOM 262 CA ARG A 19 -4.101 19.579 6.530 1.00 23.02 C ATOM 263 C ARG A 19 -4.795 19.210 5.240 1.00 62.05 C ATOM 264 O ARG A 19 -5.488 20.020 4.613 1.00 54.43 O ATOM 265 CB ARG A 19 -5.038 20.290 7.526 1.00 43.43 C ATOM 266 CG ARG A 19 -5.553 21.667 7.129 1.00 4.11 C ATOM 267 CD ARG A 19 -6.646 22.108 8.091 1.00 53.35 C ATOM 268 NE ARG A 19 -7.791 21.169 8.077 1.00 61.33 N ATOM 269 CZ ARG A 19 -8.606 20.904 9.117 1.00 13.13 C ATOM 270 NH1 ARG A 19 -8.416 21.483 10.298 1.00 1.15 N ATOM 271 NH2 ARG A 19 -9.604 20.037 8.974 1.00 52.54 N ATOM 0 H ARG A 19 -2.953 21.293 6.241 1.00 62.41 H new ATOM 0 HA ARG A 19 -3.821 18.662 7.048 1.00 23.02 H new ATOM 0 HB2 ARG A 19 -5.898 19.644 7.702 1.00 43.43 H new ATOM 0 HB3 ARG A 19 -4.512 20.386 8.476 1.00 43.43 H new ATOM 0 HG2 ARG A 19 -4.735 22.388 7.139 1.00 4.11 H new ATOM 0 HG3 ARG A 19 -5.942 21.640 6.111 1.00 4.11 H new ATOM 0 HD2 ARG A 19 -6.240 22.173 9.100 1.00 53.35 H new ATOM 0 HD3 ARG A 19 -6.989 23.107 7.821 1.00 53.35 H new ATOM 0 HE ARG A 19 -7.980 20.679 7.202 1.00 61.33 H new ATOM 0 HH11 ARG A 19 -7.645 22.138 10.427 1.00 1.15 H new ATOM 0 HH12 ARG A 19 -9.041 21.272 11.076 1.00 1.15 H new ATOM 0 HH21 ARG A 19 -9.752 19.573 8.078 1.00 52.54 H new ATOM 0 HH22 ARG A 19 -10.221 19.836 9.761 1.00 52.54 H new ATOM 285 N ALA A 20 -4.526 18.011 4.807 1.00 34.03 N ATOM 286 CA ALA A 20 -5.142 17.454 3.636 1.00 43.22 C ATOM 287 C ALA A 20 -6.555 16.986 3.993 1.00 1.34 C ATOM 288 O ALA A 20 -7.177 17.511 4.912 1.00 2.51 O ATOM 289 CB ALA A 20 -4.287 16.304 3.103 1.00 3.12 C ATOM 0 H ALA A 20 -3.863 17.384 5.264 1.00 34.03 H new ATOM 0 HA ALA A 20 -5.215 18.206 2.850 1.00 43.22 H new ATOM 0 HB1 ALA A 20 -4.757 15.883 2.214 1.00 3.12 H new ATOM 0 HB2 ALA A 20 -3.295 16.676 2.847 1.00 3.12 H new ATOM 0 HB3 ALA A 20 -4.199 15.532 3.867 1.00 3.12 H new ATOM 295 N ASP A 21 -7.049 16.007 3.302 1.00 4.44 N ATOM 296 CA ASP A 21 -8.413 15.556 3.509 1.00 30.22 C ATOM 297 C ASP A 21 -8.460 14.370 4.442 1.00 22.44 C ATOM 298 O ASP A 21 -9.506 13.837 4.675 1.00 32.40 O ATOM 299 CB ASP A 21 -9.059 15.171 2.174 1.00 32.24 C ATOM 300 CG ASP A 21 -9.052 16.290 1.171 1.00 21.31 C ATOM 301 OD1 ASP A 21 -8.074 16.407 0.407 1.00 41.23 O ATOM 302 OD2 ASP A 21 -10.023 17.076 1.108 1.00 71.45 O ATOM 0 H ASP A 21 -6.536 15.495 2.584 1.00 4.44 H new ATOM 0 HA ASP A 21 -8.966 16.381 3.959 1.00 30.22 H new ATOM 0 HB2 ASP A 21 -8.532 14.313 1.756 1.00 32.24 H new ATOM 0 HB3 ASP A 21 -10.088 14.857 2.352 1.00 32.24 H new ATOM 307 N LEU A 22 -7.327 14.025 5.026 1.00 62.23 N ATOM 308 CA LEU A 22 -7.164 12.797 5.802 1.00 14.10 C ATOM 309 C LEU A 22 -8.151 12.631 6.984 1.00 33.02 C ATOM 310 O LEU A 22 -8.856 11.613 7.069 1.00 45.12 O ATOM 311 CB LEU A 22 -5.660 12.585 6.215 1.00 51.21 C ATOM 312 CG LEU A 22 -4.910 13.613 7.146 1.00 1.11 C ATOM 313 CD1 LEU A 22 -5.038 15.068 6.738 1.00 53.25 C ATOM 314 CD2 LEU A 22 -5.183 13.407 8.626 1.00 24.14 C ATOM 0 H LEU A 22 -6.481 14.593 4.978 1.00 62.23 H new ATOM 0 HA LEU A 22 -7.445 11.985 5.131 1.00 14.10 H new ATOM 0 HB2 LEU A 22 -5.599 11.612 6.703 1.00 51.21 H new ATOM 0 HB3 LEU A 22 -5.085 12.515 5.292 1.00 51.21 H new ATOM 0 HG LEU A 22 -3.860 13.369 6.983 1.00 1.11 H new ATOM 0 HD11 LEU A 22 -4.487 15.693 7.441 1.00 53.25 H new ATOM 0 HD12 LEU A 22 -4.629 15.202 5.736 1.00 53.25 H new ATOM 0 HD13 LEU A 22 -6.089 15.356 6.743 1.00 53.25 H new ATOM 0 HD21 LEU A 22 -4.634 14.150 9.204 1.00 24.14 H new ATOM 0 HD22 LEU A 22 -6.251 13.515 8.817 1.00 24.14 H new ATOM 0 HD23 LEU A 22 -4.861 12.408 8.920 1.00 24.14 H new ATOM 326 N LEU A 23 -8.273 13.641 7.826 1.00 74.44 N ATOM 327 CA LEU A 23 -9.112 13.532 9.019 1.00 40.23 C ATOM 328 C LEU A 23 -10.575 13.557 8.610 1.00 34.12 C ATOM 329 O LEU A 23 -11.401 12.800 9.126 1.00 63.11 O ATOM 330 CB LEU A 23 -8.746 14.657 10.038 1.00 65.14 C ATOM 331 CG LEU A 23 -9.406 14.639 11.441 1.00 34.52 C ATOM 332 CD1 LEU A 23 -8.615 15.528 12.385 1.00 52.33 C ATOM 333 CD2 LEU A 23 -10.845 15.146 11.396 1.00 75.52 C ATOM 0 H LEU A 23 -7.808 14.542 7.713 1.00 74.44 H new ATOM 0 HA LEU A 23 -8.931 12.583 9.524 1.00 40.23 H new ATOM 0 HB2 LEU A 23 -7.666 14.633 10.181 1.00 65.14 H new ATOM 0 HB3 LEU A 23 -8.985 15.614 9.573 1.00 65.14 H new ATOM 0 HG LEU A 23 -9.410 13.606 11.789 1.00 34.52 H new ATOM 0 HD11 LEU A 23 -9.079 15.515 13.371 1.00 52.33 H new ATOM 0 HD12 LEU A 23 -7.592 15.159 12.461 1.00 52.33 H new ATOM 0 HD13 LEU A 23 -8.606 16.548 12.002 1.00 52.33 H new ATOM 0 HD21 LEU A 23 -11.272 15.118 12.398 1.00 75.52 H new ATOM 0 HD22 LEU A 23 -10.858 16.171 11.025 1.00 75.52 H new ATOM 0 HD23 LEU A 23 -11.434 14.512 10.733 1.00 75.52 H new ATOM 345 N LYS A 24 -10.880 14.384 7.646 1.00 15.23 N ATOM 346 CA LYS A 24 -12.230 14.495 7.154 1.00 25.30 C ATOM 347 C LYS A 24 -12.625 13.224 6.391 1.00 20.24 C ATOM 348 O LYS A 24 -13.787 12.796 6.427 1.00 30.03 O ATOM 349 CB LYS A 24 -12.381 15.739 6.269 1.00 15.35 C ATOM 350 CG LYS A 24 -13.808 16.011 5.814 1.00 31.03 C ATOM 351 CD LYS A 24 -14.737 16.232 7.002 1.00 1.40 C ATOM 352 CE LYS A 24 -16.158 16.505 6.560 1.00 53.33 C ATOM 353 NZ LYS A 24 -17.044 16.753 7.712 1.00 3.01 N ATOM 0 H LYS A 24 -10.208 14.995 7.182 1.00 15.23 H new ATOM 0 HA LYS A 24 -12.904 14.605 8.004 1.00 25.30 H new ATOM 0 HB2 LYS A 24 -12.014 16.607 6.816 1.00 15.35 H new ATOM 0 HB3 LYS A 24 -11.747 15.625 5.390 1.00 15.35 H new ATOM 0 HG2 LYS A 24 -13.825 16.889 5.169 1.00 31.03 H new ATOM 0 HG3 LYS A 24 -14.168 15.172 5.219 1.00 31.03 H new ATOM 0 HD2 LYS A 24 -14.719 15.353 7.646 1.00 1.40 H new ATOM 0 HD3 LYS A 24 -14.374 17.070 7.597 1.00 1.40 H new ATOM 0 HE2 LYS A 24 -16.174 17.369 5.895 1.00 53.33 H new ATOM 0 HE3 LYS A 24 -16.532 15.656 5.988 1.00 53.33 H new ATOM 0 HZ1 LYS A 24 -18.017 16.903 7.376 1.00 3.01 H new ATOM 0 HZ2 LYS A 24 -17.021 15.933 8.351 1.00 3.01 H new ATOM 0 HZ3 LYS A 24 -16.720 17.599 8.223 1.00 3.01 H new ATOM 367 N GLU A 25 -11.651 12.615 5.737 1.00 62.33 N ATOM 368 CA GLU A 25 -11.850 11.409 4.968 1.00 54.14 C ATOM 369 C GLU A 25 -12.258 10.271 5.879 1.00 42.22 C ATOM 370 O GLU A 25 -13.172 9.517 5.558 1.00 12.23 O ATOM 371 CB GLU A 25 -10.574 11.027 4.200 1.00 1.23 C ATOM 372 CG GLU A 25 -10.756 9.897 3.197 1.00 52.31 C ATOM 373 CD GLU A 25 -11.624 10.293 2.019 1.00 1.30 C ATOM 374 OE1 GLU A 25 -12.827 10.521 2.194 1.00 31.42 O ATOM 375 OE2 GLU A 25 -11.102 10.366 0.879 1.00 33.43 O ATOM 0 H GLU A 25 -10.689 12.953 5.728 1.00 62.33 H new ATOM 0 HA GLU A 25 -12.644 11.597 4.246 1.00 54.14 H new ATOM 0 HB2 GLU A 25 -10.205 11.907 3.674 1.00 1.23 H new ATOM 0 HB3 GLU A 25 -9.806 10.739 4.917 1.00 1.23 H new ATOM 0 HG2 GLU A 25 -9.779 9.580 2.832 1.00 52.31 H new ATOM 0 HG3 GLU A 25 -11.203 9.039 3.700 1.00 52.31 H new ATOM 382 N MET A 26 -11.614 10.160 7.042 1.00 71.32 N ATOM 383 CA MET A 26 -11.949 9.076 7.965 1.00 5.12 C ATOM 384 C MET A 26 -13.360 9.232 8.505 1.00 14.30 C ATOM 385 O MET A 26 -14.042 8.254 8.754 1.00 5.12 O ATOM 386 CB MET A 26 -10.893 8.877 9.094 1.00 41.11 C ATOM 387 CG MET A 26 -10.772 9.972 10.166 1.00 72.45 C ATOM 388 SD MET A 26 -12.110 9.975 11.390 1.00 4.53 S ATOM 389 CE MET A 26 -11.618 11.361 12.415 1.00 74.45 C ATOM 0 H MET A 26 -10.877 10.789 7.361 1.00 71.32 H new ATOM 0 HA MET A 26 -11.920 8.153 7.386 1.00 5.12 H new ATOM 0 HB2 MET A 26 -11.117 7.937 9.599 1.00 41.11 H new ATOM 0 HB3 MET A 26 -9.917 8.761 8.623 1.00 41.11 H new ATOM 0 HG2 MET A 26 -9.821 9.851 10.685 1.00 72.45 H new ATOM 0 HG3 MET A 26 -10.745 10.944 9.673 1.00 72.45 H new ATOM 0 HE1 MET A 26 -12.343 11.495 13.218 1.00 74.45 H new ATOM 0 HE2 MET A 26 -10.634 11.166 12.842 1.00 74.45 H new ATOM 0 HE3 MET A 26 -11.578 12.266 11.809 1.00 74.45 H new ATOM 399 N GLU A 27 -13.803 10.464 8.625 1.00 5.10 N ATOM 400 CA GLU A 27 -15.140 10.754 9.095 1.00 34.12 C ATOM 401 C GLU A 27 -16.158 10.405 8.008 1.00 4.42 C ATOM 402 O GLU A 27 -17.130 9.684 8.247 1.00 3.43 O ATOM 403 CB GLU A 27 -15.251 12.237 9.443 1.00 0.24 C ATOM 404 CG GLU A 27 -16.588 12.637 10.034 1.00 3.15 C ATOM 405 CD GLU A 27 -16.744 14.124 10.140 1.00 74.12 C ATOM 406 OE1 GLU A 27 -16.096 14.753 10.993 1.00 25.52 O ATOM 407 OE2 GLU A 27 -17.521 14.710 9.351 1.00 32.33 O ATOM 0 H GLU A 27 -13.249 11.291 8.400 1.00 5.10 H new ATOM 0 HA GLU A 27 -15.345 10.157 9.984 1.00 34.12 H new ATOM 0 HB2 GLU A 27 -14.462 12.493 10.151 1.00 0.24 H new ATOM 0 HB3 GLU A 27 -15.074 12.825 8.542 1.00 0.24 H new ATOM 0 HG2 GLU A 27 -17.390 12.233 9.417 1.00 3.15 H new ATOM 0 HG3 GLU A 27 -16.693 12.192 11.024 1.00 3.15 H new ATOM 414 N SER A 28 -15.892 10.886 6.813 1.00 22.44 N ATOM 415 CA SER A 28 -16.792 10.744 5.685 1.00 30.04 C ATOM 416 C SER A 28 -16.881 9.291 5.177 1.00 25.24 C ATOM 417 O SER A 28 -17.901 8.882 4.629 1.00 44.30 O ATOM 418 CB SER A 28 -16.349 11.699 4.580 1.00 53.13 C ATOM 419 OG SER A 28 -16.225 13.026 5.099 1.00 24.35 O ATOM 0 H SER A 28 -15.035 11.393 6.593 1.00 22.44 H new ATOM 0 HA SER A 28 -17.800 11.002 6.010 1.00 30.04 H new ATOM 0 HB2 SER A 28 -15.395 11.371 4.166 1.00 53.13 H new ATOM 0 HB3 SER A 28 -17.072 11.685 3.765 1.00 53.13 H new ATOM 0 HG SER A 28 -15.391 13.102 5.608 1.00 24.35 H new ATOM 425 N SER A 29 -15.837 8.520 5.381 1.00 65.14 N ATOM 426 CA SER A 29 -15.829 7.130 4.968 1.00 23.31 C ATOM 427 C SER A 29 -16.578 6.254 5.973 1.00 60.22 C ATOM 428 O SER A 29 -16.936 5.109 5.680 1.00 34.44 O ATOM 429 CB SER A 29 -14.398 6.642 4.767 1.00 44.21 C ATOM 430 OG SER A 29 -13.602 6.914 5.918 1.00 61.22 O ATOM 0 H SER A 29 -14.977 8.832 5.833 1.00 65.14 H new ATOM 0 HA SER A 29 -16.350 7.053 4.014 1.00 23.31 H new ATOM 0 HB2 SER A 29 -14.400 5.571 4.566 1.00 44.21 H new ATOM 0 HB3 SER A 29 -13.962 7.130 3.895 1.00 44.21 H new ATOM 0 HG SER A 29 -13.288 7.842 5.887 1.00 61.22 H new ATOM 436 N THR A 30 -16.794 6.784 7.161 1.00 54.24 N ATOM 437 CA THR A 30 -17.481 6.067 8.184 1.00 12.52 C ATOM 438 C THR A 30 -18.979 5.997 7.895 1.00 14.14 C ATOM 439 O THR A 30 -19.704 6.991 7.949 1.00 2.32 O ATOM 440 CB THR A 30 -17.177 6.643 9.589 1.00 74.54 C ATOM 441 OG1 THR A 30 -15.769 6.512 9.825 1.00 63.23 O ATOM 442 CG2 THR A 30 -17.922 5.882 10.673 1.00 52.22 C ATOM 0 H THR A 30 -16.494 7.721 7.431 1.00 54.24 H new ATOM 0 HA THR A 30 -17.107 5.043 8.183 1.00 12.52 H new ATOM 0 HB THR A 30 -17.496 7.685 9.621 1.00 74.54 H new ATOM 0 HG1 THR A 30 -15.308 7.318 9.511 1.00 63.23 H new ATOM 0 HG21 THR A 30 -17.686 6.312 11.647 1.00 52.22 H new ATOM 0 HG22 THR A 30 -18.995 5.953 10.495 1.00 52.22 H new ATOM 0 HG23 THR A 30 -17.620 4.835 10.656 1.00 52.22 H new ATOM 450 N GLY A 31 -19.374 4.832 7.500 1.00 3.45 N ATOM 451 CA GLY A 31 -20.731 4.474 7.233 1.00 70.42 C ATOM 452 C GLY A 31 -20.757 2.997 7.307 1.00 72.44 C ATOM 453 O GLY A 31 -21.333 2.404 8.216 1.00 41.53 O ATOM 0 H GLY A 31 -18.724 4.061 7.346 1.00 3.45 H new ATOM 0 HA2 GLY A 31 -21.408 4.918 7.963 1.00 70.42 H new ATOM 0 HA3 GLY A 31 -21.046 4.826 6.251 1.00 70.42 H new ATOM 457 N THR A 32 -20.069 2.409 6.389 1.00 60.44 N ATOM 458 CA THR A 32 -19.768 1.026 6.431 1.00 51.12 C ATOM 459 C THR A 32 -18.254 0.937 6.564 1.00 51.00 C ATOM 460 O THR A 32 -17.524 1.518 5.750 1.00 5.42 O ATOM 461 CB THR A 32 -20.216 0.301 5.132 1.00 44.52 C ATOM 462 OG1 THR A 32 -21.622 0.528 4.902 1.00 64.22 O ATOM 463 CG2 THR A 32 -19.959 -1.199 5.233 1.00 51.21 C ATOM 0 H THR A 32 -19.694 2.890 5.572 1.00 60.44 H new ATOM 0 HA THR A 32 -20.292 0.546 7.258 1.00 51.12 H new ATOM 0 HB THR A 32 -19.637 0.703 4.301 1.00 44.52 H new ATOM 0 HG1 THR A 32 -21.897 0.070 4.081 1.00 64.22 H new ATOM 0 HG21 THR A 32 -20.280 -1.686 4.312 1.00 51.21 H new ATOM 0 HG22 THR A 32 -18.894 -1.376 5.385 1.00 51.21 H new ATOM 0 HG23 THR A 32 -20.518 -1.608 6.074 1.00 51.21 H new ATOM 471 N ALA A 33 -17.789 0.311 7.605 1.00 21.42 N ATOM 472 CA ALA A 33 -16.379 0.113 7.777 1.00 44.50 C ATOM 473 C ALA A 33 -16.068 -1.257 7.235 1.00 30.01 C ATOM 474 O ALA A 33 -16.575 -2.247 7.770 1.00 63.31 O ATOM 475 CB ALA A 33 -16.002 0.220 9.248 1.00 32.04 C ATOM 0 H ALA A 33 -18.368 -0.073 8.351 1.00 21.42 H new ATOM 0 HA ALA A 33 -15.805 0.874 7.249 1.00 44.50 H new ATOM 0 HB1 ALA A 33 -14.929 0.067 9.361 1.00 32.04 H new ATOM 0 HB2 ALA A 33 -16.269 1.209 9.621 1.00 32.04 H new ATOM 0 HB3 ALA A 33 -16.538 -0.539 9.817 1.00 32.04 H new ATOM 481 N PRO A 34 -15.267 -1.352 6.156 1.00 22.23 N ATOM 482 CA PRO A 34 -15.038 -2.629 5.467 1.00 35.43 C ATOM 483 C PRO A 34 -14.445 -3.686 6.390 1.00 71.21 C ATOM 484 O PRO A 34 -13.579 -3.393 7.230 1.00 54.53 O ATOM 485 CB PRO A 34 -14.047 -2.263 4.354 1.00 11.24 C ATOM 486 CG PRO A 34 -13.444 -0.967 4.783 1.00 23.21 C ATOM 487 CD PRO A 34 -14.517 -0.251 5.535 1.00 62.10 C ATOM 0 HA PRO A 34 -15.966 -3.066 5.098 1.00 35.43 H new ATOM 0 HB2 PRO A 34 -13.285 -3.033 4.236 1.00 11.24 H new ATOM 0 HB3 PRO A 34 -14.552 -2.164 3.393 1.00 11.24 H new ATOM 0 HG2 PRO A 34 -12.569 -1.132 5.411 1.00 23.21 H new ATOM 0 HG3 PRO A 34 -13.114 -0.385 3.923 1.00 23.21 H new ATOM 0 HD2 PRO A 34 -14.104 0.429 6.280 1.00 62.10 H new ATOM 0 HD3 PRO A 34 -15.146 0.345 4.874 1.00 62.10 H new ATOM 495 N ALA A 35 -14.916 -4.891 6.235 1.00 45.24 N ATOM 496 CA ALA A 35 -14.507 -5.990 7.052 1.00 44.14 C ATOM 497 C ALA A 35 -14.226 -7.212 6.207 1.00 4.45 C ATOM 498 O ALA A 35 -15.047 -7.610 5.382 1.00 30.00 O ATOM 499 CB ALA A 35 -15.567 -6.295 8.104 1.00 24.13 C ATOM 0 H ALA A 35 -15.606 -5.138 5.525 1.00 45.24 H new ATOM 0 HA ALA A 35 -13.585 -5.713 7.562 1.00 44.14 H new ATOM 0 HB1 ALA A 35 -15.240 -7.134 8.718 1.00 24.13 H new ATOM 0 HB2 ALA A 35 -15.715 -5.419 8.736 1.00 24.13 H new ATOM 0 HB3 ALA A 35 -16.506 -6.550 7.612 1.00 24.13 H new ATOM 505 N SER A 36 -13.069 -7.761 6.371 1.00 21.02 N ATOM 506 CA SER A 36 -12.704 -9.007 5.765 1.00 22.02 C ATOM 507 C SER A 36 -11.756 -9.722 6.708 1.00 3.51 C ATOM 508 O SER A 36 -10.644 -9.257 6.941 1.00 3.34 O ATOM 509 CB SER A 36 -12.047 -8.792 4.390 1.00 51.34 C ATOM 510 OG SER A 36 -12.947 -8.183 3.455 1.00 13.14 O ATOM 0 H SER A 36 -12.331 -7.350 6.942 1.00 21.02 H new ATOM 0 HA SER A 36 -13.597 -9.609 5.595 1.00 22.02 H new ATOM 0 HB2 SER A 36 -11.163 -8.164 4.504 1.00 51.34 H new ATOM 0 HB3 SER A 36 -11.708 -9.750 3.996 1.00 51.34 H new ATOM 0 HG SER A 36 -13.815 -8.034 3.885 1.00 13.14 H new ATOM 516 N THR A 37 -12.205 -10.780 7.315 1.00 35.01 N ATOM 517 CA THR A 37 -11.360 -11.515 8.219 1.00 44.33 C ATOM 518 C THR A 37 -10.517 -12.562 7.498 1.00 54.55 C ATOM 519 O THR A 37 -11.008 -13.647 7.153 1.00 62.12 O ATOM 520 CB THR A 37 -12.175 -12.146 9.363 1.00 41.54 C ATOM 521 OG1 THR A 37 -13.362 -12.764 8.826 1.00 55.02 O ATOM 522 CG2 THR A 37 -12.561 -11.093 10.391 1.00 34.21 C ATOM 0 H THR A 37 -13.147 -11.155 7.204 1.00 35.01 H new ATOM 0 HA THR A 37 -10.668 -10.796 8.658 1.00 44.33 H new ATOM 0 HB THR A 37 -11.561 -12.900 9.856 1.00 41.54 H new ATOM 0 HG1 THR A 37 -13.120 -13.329 8.062 1.00 55.02 H new ATOM 0 HG21 THR A 37 -13.136 -11.559 11.191 1.00 34.21 H new ATOM 0 HG22 THR A 37 -11.660 -10.643 10.807 1.00 34.21 H new ATOM 0 HG23 THR A 37 -13.164 -10.321 9.913 1.00 34.21 H new ATOM 530 N GLY A 38 -9.288 -12.197 7.192 1.00 1.21 N ATOM 531 CA GLY A 38 -8.363 -13.125 6.586 1.00 63.21 C ATOM 532 C GLY A 38 -6.915 -12.745 6.836 1.00 0.23 C ATOM 533 O GLY A 38 -5.995 -13.393 6.326 1.00 45.24 O ATOM 0 H GLY A 38 -8.910 -11.264 7.354 1.00 1.21 H new ATOM 0 HA2 GLY A 38 -8.546 -14.125 6.979 1.00 63.21 H new ATOM 0 HA3 GLY A 38 -8.545 -13.166 5.512 1.00 63.21 H new ATOM 537 N ALA A 39 -6.696 -11.746 7.669 1.00 23.12 N ATOM 538 CA ALA A 39 -5.348 -11.234 7.906 1.00 23.45 C ATOM 539 C ALA A 39 -4.687 -11.996 9.022 1.00 55.21 C ATOM 540 O ALA A 39 -3.477 -12.022 9.151 1.00 52.43 O ATOM 541 CB ALA A 39 -5.399 -9.766 8.241 1.00 21.21 C ATOM 0 H ALA A 39 -7.429 -11.269 8.195 1.00 23.12 H new ATOM 0 HA ALA A 39 -4.762 -11.367 6.997 1.00 23.45 H new ATOM 0 HB1 ALA A 39 -4.388 -9.397 8.415 1.00 21.21 H new ATOM 0 HB2 ALA A 39 -5.847 -9.219 7.411 1.00 21.21 H new ATOM 0 HB3 ALA A 39 -5.999 -9.618 9.139 1.00 21.21 H new ATOM 547 N GLU A 40 -5.505 -12.609 9.818 1.00 1.45 N ATOM 548 CA GLU A 40 -5.077 -13.420 10.930 1.00 60.21 C ATOM 549 C GLU A 40 -4.946 -14.878 10.468 1.00 34.45 C ATOM 550 O GLU A 40 -4.469 -15.759 11.197 1.00 71.23 O ATOM 551 CB GLU A 40 -6.102 -13.271 12.087 1.00 50.21 C ATOM 552 CG GLU A 40 -7.505 -13.902 11.870 1.00 12.22 C ATOM 553 CD GLU A 40 -8.166 -13.564 10.538 1.00 23.11 C ATOM 554 OE1 GLU A 40 -8.245 -12.366 10.173 1.00 0.22 O ATOM 555 OE2 GLU A 40 -8.518 -14.503 9.802 1.00 33.42 O ATOM 0 H GLU A 40 -6.519 -12.562 9.715 1.00 1.45 H new ATOM 0 HA GLU A 40 -4.103 -13.095 11.296 1.00 60.21 H new ATOM 0 HB2 GLU A 40 -5.667 -13.712 12.984 1.00 50.21 H new ATOM 0 HB3 GLU A 40 -6.236 -12.208 12.287 1.00 50.21 H new ATOM 0 HG2 GLU A 40 -7.415 -14.985 11.949 1.00 12.22 H new ATOM 0 HG3 GLU A 40 -8.162 -13.577 12.677 1.00 12.22 H new ATOM 562 N ASN A 41 -5.372 -15.100 9.245 1.00 73.20 N ATOM 563 CA ASN A 41 -5.375 -16.411 8.619 1.00 34.41 C ATOM 564 C ASN A 41 -4.174 -16.539 7.697 1.00 24.30 C ATOM 565 O ASN A 41 -3.473 -17.549 7.720 1.00 61.43 O ATOM 566 CB ASN A 41 -6.686 -16.552 7.808 1.00 62.33 C ATOM 567 CG ASN A 41 -6.933 -17.913 7.140 1.00 44.10 C ATOM 568 OD1 ASN A 41 -6.022 -18.629 6.742 1.00 73.22 O ATOM 569 ND2 ASN A 41 -8.188 -18.260 7.010 1.00 11.13 N ATOM 0 H ASN A 41 -5.734 -14.362 8.642 1.00 73.20 H new ATOM 0 HA ASN A 41 -5.316 -17.195 9.374 1.00 34.41 H new ATOM 0 HB2 ASN A 41 -7.523 -16.341 8.473 1.00 62.33 H new ATOM 0 HB3 ASN A 41 -6.693 -15.785 7.033 1.00 62.33 H new ATOM 0 HD21 ASN A 41 -8.429 -19.147 6.568 1.00 11.13 H new ATOM 0 HD22 ASN A 41 -8.926 -17.643 7.351 1.00 11.13 H new ATOM 576 N LEU A 42 -3.904 -15.464 6.946 1.00 42.00 N ATOM 577 CA LEU A 42 -2.867 -15.441 5.911 1.00 21.01 C ATOM 578 C LEU A 42 -3.112 -16.561 4.894 1.00 41.45 C ATOM 579 O LEU A 42 -2.484 -17.618 4.959 1.00 25.22 O ATOM 580 CB LEU A 42 -1.419 -15.517 6.466 1.00 0.43 C ATOM 581 CG LEU A 42 -0.898 -14.346 7.323 1.00 3.35 C ATOM 582 CD1 LEU A 42 -1.177 -13.000 6.673 1.00 53.54 C ATOM 583 CD2 LEU A 42 -1.414 -14.405 8.752 1.00 63.10 C ATOM 0 H LEU A 42 -4.404 -14.580 7.042 1.00 42.00 H new ATOM 0 HA LEU A 42 -2.946 -14.470 5.422 1.00 21.01 H new ATOM 0 HB2 LEU A 42 -1.340 -16.426 7.063 1.00 0.43 H new ATOM 0 HB3 LEU A 42 -0.744 -15.633 5.618 1.00 0.43 H new ATOM 0 HG LEU A 42 0.185 -14.455 7.378 1.00 3.35 H new ATOM 0 HD11 LEU A 42 -0.794 -12.202 7.309 1.00 53.54 H new ATOM 0 HD12 LEU A 42 -0.686 -12.956 5.701 1.00 53.54 H new ATOM 0 HD13 LEU A 42 -2.252 -12.875 6.542 1.00 53.54 H new ATOM 0 HD21 LEU A 42 -1.020 -13.560 9.316 1.00 63.10 H new ATOM 0 HD22 LEU A 42 -2.503 -14.362 8.748 1.00 63.10 H new ATOM 0 HD23 LEU A 42 -1.089 -15.335 9.218 1.00 63.10 H new ATOM 595 N PRO A 43 -4.059 -16.356 3.957 1.00 74.32 N ATOM 596 CA PRO A 43 -4.457 -17.401 3.009 1.00 54.13 C ATOM 597 C PRO A 43 -3.318 -17.846 2.092 1.00 42.33 C ATOM 598 O PRO A 43 -2.964 -19.017 2.047 1.00 45.13 O ATOM 599 CB PRO A 43 -5.593 -16.759 2.195 1.00 23.23 C ATOM 600 CG PRO A 43 -5.460 -15.286 2.409 1.00 74.23 C ATOM 601 CD PRO A 43 -4.830 -15.106 3.759 1.00 63.20 C ATOM 0 HA PRO A 43 -4.758 -18.309 3.531 1.00 54.13 H new ATOM 0 HB2 PRO A 43 -5.508 -17.010 1.138 1.00 23.23 H new ATOM 0 HB3 PRO A 43 -6.566 -17.117 2.531 1.00 23.23 H new ATOM 0 HG2 PRO A 43 -4.844 -14.835 1.631 1.00 74.23 H new ATOM 0 HG3 PRO A 43 -6.434 -14.799 2.368 1.00 74.23 H new ATOM 0 HD2 PRO A 43 -4.184 -14.229 3.785 1.00 63.20 H new ATOM 0 HD3 PRO A 43 -5.582 -14.972 4.537 1.00 63.20 H new ATOM 609 N ALA A 44 -2.735 -16.899 1.403 1.00 73.24 N ATOM 610 CA ALA A 44 -1.686 -17.190 0.452 1.00 4.33 C ATOM 611 C ALA A 44 -0.309 -16.933 1.034 1.00 61.45 C ATOM 612 O ALA A 44 0.704 -17.203 0.396 1.00 40.51 O ATOM 613 CB ALA A 44 -1.884 -16.344 -0.779 1.00 33.51 C ATOM 0 H ALA A 44 -2.970 -15.910 1.482 1.00 73.24 H new ATOM 0 HA ALA A 44 -1.744 -18.248 0.197 1.00 4.33 H new ATOM 0 HB1 ALA A 44 -1.095 -16.560 -1.500 1.00 33.51 H new ATOM 0 HB2 ALA A 44 -2.853 -16.570 -1.224 1.00 33.51 H new ATOM 0 HB3 ALA A 44 -1.847 -15.289 -0.506 1.00 33.51 H new ATOM 619 N GLY A 45 -0.276 -16.356 2.221 1.00 42.25 N ATOM 620 CA GLY A 45 0.990 -16.025 2.880 1.00 50.33 C ATOM 621 C GLY A 45 1.651 -14.775 2.302 1.00 45.31 C ATOM 622 O GLY A 45 2.571 -14.217 2.896 1.00 4.32 O ATOM 0 H GLY A 45 -1.108 -16.104 2.755 1.00 42.25 H new ATOM 0 HA2 GLY A 45 0.812 -15.876 3.945 1.00 50.33 H new ATOM 0 HA3 GLY A 45 1.674 -16.868 2.786 1.00 50.33 H new ATOM 626 N SER A 46 1.155 -14.341 1.172 1.00 54.43 N ATOM 627 CA SER A 46 1.604 -13.157 0.508 1.00 40.20 C ATOM 628 C SER A 46 0.383 -12.280 0.304 1.00 2.34 C ATOM 629 O SER A 46 -0.755 -12.796 0.240 1.00 34.00 O ATOM 630 CB SER A 46 2.243 -13.513 -0.838 1.00 42.13 C ATOM 631 OG SER A 46 3.275 -14.488 -0.675 1.00 2.11 O ATOM 0 H SER A 46 0.403 -14.822 0.677 1.00 54.43 H new ATOM 0 HA SER A 46 2.359 -12.638 1.098 1.00 40.20 H new ATOM 0 HB2 SER A 46 1.480 -13.896 -1.516 1.00 42.13 H new ATOM 0 HB3 SER A 46 2.656 -12.615 -1.297 1.00 42.13 H new ATOM 0 HG SER A 46 3.666 -14.700 -1.548 1.00 2.11 H new ATOM 637 N ALA A 47 0.583 -10.996 0.223 1.00 30.03 N ATOM 638 CA ALA A 47 -0.510 -10.068 0.132 1.00 41.22 C ATOM 639 C ALA A 47 -0.089 -8.813 -0.600 1.00 43.22 C ATOM 640 O ALA A 47 1.119 -8.508 -0.684 1.00 4.00 O ATOM 641 CB ALA A 47 -1.005 -9.741 1.513 1.00 15.22 C ATOM 0 H ALA A 47 1.506 -10.562 0.218 1.00 30.03 H new ATOM 0 HA ALA A 47 -1.320 -10.526 -0.436 1.00 41.22 H new ATOM 0 HB1 ALA A 47 -1.834 -9.037 1.445 1.00 15.22 H new ATOM 0 HB2 ALA A 47 -1.343 -10.654 2.004 1.00 15.22 H new ATOM 0 HB3 ALA A 47 -0.197 -9.295 2.093 1.00 15.22 H new ATOM 647 N LEU A 48 -1.052 -8.108 -1.151 1.00 24.13 N ATOM 648 CA LEU A 48 -0.770 -6.903 -1.893 1.00 70.24 C ATOM 649 C LEU A 48 -1.585 -5.715 -1.417 1.00 70.41 C ATOM 650 O LEU A 48 -2.647 -5.867 -0.809 1.00 22.44 O ATOM 651 CB LEU A 48 -0.945 -7.131 -3.419 1.00 30.20 C ATOM 652 CG LEU A 48 -2.291 -7.717 -3.943 1.00 35.04 C ATOM 653 CD1 LEU A 48 -3.452 -6.734 -3.835 1.00 71.22 C ATOM 654 CD2 LEU A 48 -2.133 -8.183 -5.377 1.00 43.10 C ATOM 0 H LEU A 48 -2.041 -8.351 -1.098 1.00 24.13 H new ATOM 0 HA LEU A 48 0.275 -6.657 -1.702 1.00 70.24 H new ATOM 0 HB2 LEU A 48 -0.787 -6.174 -3.916 1.00 30.20 H new ATOM 0 HB3 LEU A 48 -0.146 -7.796 -3.747 1.00 30.20 H new ATOM 0 HG LEU A 48 -2.536 -8.564 -3.303 1.00 35.04 H new ATOM 0 HD11 LEU A 48 -4.361 -7.201 -4.216 1.00 71.22 H new ATOM 0 HD12 LEU A 48 -3.597 -6.455 -2.791 1.00 71.22 H new ATOM 0 HD13 LEU A 48 -3.229 -5.842 -4.421 1.00 71.22 H new ATOM 0 HD21 LEU A 48 -3.079 -8.591 -5.733 1.00 43.10 H new ATOM 0 HD22 LEU A 48 -1.842 -7.340 -6.004 1.00 43.10 H new ATOM 0 HD23 LEU A 48 -1.364 -8.954 -5.426 1.00 43.10 H new ATOM 666 N LEU A 49 -1.083 -4.556 -1.687 1.00 53.21 N ATOM 667 CA LEU A 49 -1.795 -3.348 -1.449 1.00 3.14 C ATOM 668 C LEU A 49 -1.924 -2.618 -2.764 1.00 34.23 C ATOM 669 O LEU A 49 -0.997 -2.628 -3.582 1.00 54.15 O ATOM 670 CB LEU A 49 -1.171 -2.489 -0.298 1.00 50.41 C ATOM 671 CG LEU A 49 0.338 -2.110 -0.356 1.00 35.02 C ATOM 672 CD1 LEU A 49 0.645 -1.063 -1.417 1.00 20.14 C ATOM 673 CD2 LEU A 49 0.810 -1.630 1.007 1.00 43.31 C ATOM 0 H LEU A 49 -0.153 -4.421 -2.085 1.00 53.21 H new ATOM 0 HA LEU A 49 -2.794 -3.573 -1.076 1.00 3.14 H new ATOM 0 HB2 LEU A 49 -1.739 -1.561 -0.239 1.00 50.41 H new ATOM 0 HB3 LEU A 49 -1.338 -3.025 0.637 1.00 50.41 H new ATOM 0 HG LEU A 49 0.881 -3.013 -0.637 1.00 35.02 H new ATOM 0 HD11 LEU A 49 1.712 -0.840 -1.410 1.00 20.14 H new ATOM 0 HD12 LEU A 49 0.361 -1.445 -2.398 1.00 20.14 H new ATOM 0 HD13 LEU A 49 0.083 -0.154 -1.204 1.00 20.14 H new ATOM 0 HD21 LEU A 49 1.867 -1.368 0.955 1.00 43.31 H new ATOM 0 HD22 LEU A 49 0.233 -0.754 1.304 1.00 43.31 H new ATOM 0 HD23 LEU A 49 0.669 -2.423 1.741 1.00 43.31 H new ATOM 685 N VAL A 50 -3.056 -2.070 -3.014 1.00 33.15 N ATOM 686 CA VAL A 50 -3.279 -1.396 -4.257 1.00 62.54 C ATOM 687 C VAL A 50 -3.714 0.030 -3.999 1.00 71.03 C ATOM 688 O VAL A 50 -4.522 0.289 -3.084 1.00 43.50 O ATOM 689 CB VAL A 50 -4.323 -2.160 -5.149 1.00 11.43 C ATOM 690 CG1 VAL A 50 -5.682 -2.279 -4.465 1.00 53.24 C ATOM 691 CG2 VAL A 50 -4.462 -1.524 -6.532 1.00 4.32 C ATOM 0 H VAL A 50 -3.852 -2.070 -2.376 1.00 33.15 H new ATOM 0 HA VAL A 50 -2.341 -1.379 -4.812 1.00 62.54 H new ATOM 0 HB VAL A 50 -3.935 -3.169 -5.285 1.00 11.43 H new ATOM 0 HG11 VAL A 50 -6.372 -2.814 -5.117 1.00 53.24 H new ATOM 0 HG12 VAL A 50 -5.571 -2.825 -3.528 1.00 53.24 H new ATOM 0 HG13 VAL A 50 -6.075 -1.283 -4.260 1.00 53.24 H new ATOM 0 HG21 VAL A 50 -5.193 -2.082 -7.117 1.00 4.32 H new ATOM 0 HG22 VAL A 50 -4.794 -0.491 -6.426 1.00 4.32 H new ATOM 0 HG23 VAL A 50 -3.498 -1.545 -7.041 1.00 4.32 H new ATOM 701 N VAL A 51 -3.151 0.958 -4.737 1.00 41.30 N ATOM 702 CA VAL A 51 -3.564 2.319 -4.619 1.00 20.04 C ATOM 703 C VAL A 51 -4.822 2.438 -5.440 1.00 4.33 C ATOM 704 O VAL A 51 -4.804 2.240 -6.659 1.00 25.43 O ATOM 705 CB VAL A 51 -2.485 3.302 -5.154 1.00 23.14 C ATOM 706 CG1 VAL A 51 -2.884 4.748 -4.888 1.00 51.11 C ATOM 707 CG2 VAL A 51 -1.122 3.002 -4.542 1.00 63.04 C ATOM 0 H VAL A 51 -2.411 0.788 -5.419 1.00 41.30 H new ATOM 0 HA VAL A 51 -3.724 2.580 -3.573 1.00 20.04 H new ATOM 0 HB VAL A 51 -2.413 3.161 -6.232 1.00 23.14 H new ATOM 0 HG11 VAL A 51 -2.112 5.415 -5.272 1.00 51.11 H new ATOM 0 HG12 VAL A 51 -3.829 4.962 -5.386 1.00 51.11 H new ATOM 0 HG13 VAL A 51 -2.996 4.903 -3.815 1.00 51.11 H new ATOM 0 HG21 VAL A 51 -0.385 3.704 -4.933 1.00 63.04 H new ATOM 0 HG22 VAL A 51 -1.180 3.103 -3.458 1.00 63.04 H new ATOM 0 HG23 VAL A 51 -0.825 1.985 -4.797 1.00 63.04 H new ATOM 717 N LYS A 52 -5.893 2.752 -4.786 1.00 24.12 N ATOM 718 CA LYS A 52 -7.173 2.801 -5.423 1.00 63.45 C ATOM 719 C LYS A 52 -7.416 4.181 -5.955 1.00 70.12 C ATOM 720 O LYS A 52 -8.007 4.354 -7.018 1.00 24.32 O ATOM 721 CB LYS A 52 -8.279 2.387 -4.442 1.00 4.21 C ATOM 722 CG LYS A 52 -9.678 2.315 -5.044 1.00 12.33 C ATOM 723 CD LYS A 52 -9.751 1.299 -6.179 1.00 60.42 C ATOM 724 CE LYS A 52 -11.157 1.191 -6.755 1.00 60.12 C ATOM 725 NZ LYS A 52 -11.635 2.467 -7.340 1.00 33.01 N ATOM 0 H LYS A 52 -5.907 2.983 -3.793 1.00 24.12 H new ATOM 0 HA LYS A 52 -7.187 2.097 -6.255 1.00 63.45 H new ATOM 0 HB2 LYS A 52 -8.028 1.412 -4.025 1.00 4.21 H new ATOM 0 HB3 LYS A 52 -8.292 3.094 -3.613 1.00 4.21 H new ATOM 0 HG2 LYS A 52 -10.395 2.046 -4.268 1.00 12.33 H new ATOM 0 HG3 LYS A 52 -9.965 3.298 -5.417 1.00 12.33 H new ATOM 0 HD2 LYS A 52 -9.056 1.586 -6.968 1.00 60.42 H new ATOM 0 HD3 LYS A 52 -9.432 0.323 -5.813 1.00 60.42 H new ATOM 0 HE2 LYS A 52 -11.173 0.416 -7.521 1.00 60.12 H new ATOM 0 HE3 LYS A 52 -11.844 0.876 -5.969 1.00 60.12 H new ATOM 0 HZ1 LYS A 52 -12.526 2.303 -7.850 1.00 33.01 H new ATOM 0 HZ2 LYS A 52 -11.793 3.159 -6.580 1.00 33.01 H new ATOM 0 HZ3 LYS A 52 -10.921 2.835 -8.001 1.00 33.01 H new ATOM 739 N ARG A 53 -6.930 5.158 -5.244 1.00 64.02 N ATOM 740 CA ARG A 53 -7.101 6.518 -5.660 1.00 22.23 C ATOM 741 C ARG A 53 -5.914 7.327 -5.207 1.00 73.33 C ATOM 742 O ARG A 53 -5.419 7.139 -4.090 1.00 42.24 O ATOM 743 CB ARG A 53 -8.400 7.115 -5.119 1.00 54.12 C ATOM 744 CG ARG A 53 -8.731 8.467 -5.723 1.00 1.33 C ATOM 745 CD ARG A 53 -9.977 9.073 -5.122 1.00 22.14 C ATOM 746 NE ARG A 53 -11.179 8.239 -5.293 1.00 61.24 N ATOM 747 CZ ARG A 53 -12.410 8.734 -5.517 1.00 74.33 C ATOM 748 NH1 ARG A 53 -12.582 10.035 -5.703 1.00 61.32 N ATOM 749 NH2 ARG A 53 -13.466 7.930 -5.543 1.00 64.33 N ATOM 0 H ARG A 53 -6.412 5.037 -4.374 1.00 64.02 H new ATOM 0 HA ARG A 53 -7.167 6.543 -6.748 1.00 22.23 H new ATOM 0 HB2 ARG A 53 -9.220 6.425 -5.317 1.00 54.12 H new ATOM 0 HB3 ARG A 53 -8.323 7.216 -4.036 1.00 54.12 H new ATOM 0 HG2 ARG A 53 -7.891 9.145 -5.573 1.00 1.33 H new ATOM 0 HG3 ARG A 53 -8.865 8.359 -6.799 1.00 1.33 H new ATOM 0 HD2 ARG A 53 -9.811 9.243 -4.058 1.00 22.14 H new ATOM 0 HD3 ARG A 53 -10.153 10.048 -5.577 1.00 22.14 H new ATOM 0 HE ARG A 53 -11.072 7.226 -5.238 1.00 61.24 H new ATOM 0 HH11 ARG A 53 -11.780 10.664 -5.677 1.00 61.32 H new ATOM 0 HH12 ARG A 53 -13.517 10.407 -5.873 1.00 61.32 H new ATOM 0 HH21 ARG A 53 -13.348 6.928 -5.392 1.00 64.33 H new ATOM 0 HH22 ARG A 53 -14.395 8.314 -5.714 1.00 64.33 H new ATOM 763 N GLY A 54 -5.450 8.173 -6.074 1.00 44.31 N ATOM 764 CA GLY A 54 -4.327 8.997 -5.800 1.00 11.01 C ATOM 765 C GLY A 54 -3.545 9.189 -7.065 1.00 13.44 C ATOM 766 O GLY A 54 -3.982 8.716 -8.120 1.00 1.23 O ATOM 0 H GLY A 54 -5.850 8.308 -7.003 1.00 44.31 H new ATOM 0 HA2 GLY A 54 -4.653 9.961 -5.409 1.00 11.01 H new ATOM 0 HA3 GLY A 54 -3.700 8.538 -5.035 1.00 11.01 H new ATOM 770 N PRO A 55 -2.426 9.896 -7.023 1.00 4.20 N ATOM 771 CA PRO A 55 -1.557 10.087 -8.193 1.00 2.45 C ATOM 772 C PRO A 55 -1.104 8.756 -8.825 1.00 14.35 C ATOM 773 O PRO A 55 -1.281 8.538 -10.022 1.00 2.34 O ATOM 774 CB PRO A 55 -0.366 10.848 -7.615 1.00 12.43 C ATOM 775 CG PRO A 55 -0.931 11.576 -6.456 1.00 3.10 C ATOM 776 CD PRO A 55 -1.937 10.649 -5.856 1.00 13.44 C ATOM 0 HA PRO A 55 -2.067 10.610 -9.001 1.00 2.45 H new ATOM 0 HB2 PRO A 55 0.431 10.169 -7.310 1.00 12.43 H new ATOM 0 HB3 PRO A 55 0.062 11.534 -8.346 1.00 12.43 H new ATOM 0 HG2 PRO A 55 -0.154 11.831 -5.736 1.00 3.10 H new ATOM 0 HG3 PRO A 55 -1.396 12.511 -6.768 1.00 3.10 H new ATOM 0 HD2 PRO A 55 -1.488 9.993 -5.111 1.00 13.44 H new ATOM 0 HD3 PRO A 55 -2.741 11.192 -5.359 1.00 13.44 H new ATOM 784 N ASN A 56 -0.573 7.858 -8.014 1.00 23.24 N ATOM 785 CA ASN A 56 -0.078 6.559 -8.501 1.00 51.11 C ATOM 786 C ASN A 56 -1.160 5.464 -8.448 1.00 55.51 C ATOM 787 O ASN A 56 -0.854 4.265 -8.439 1.00 10.41 O ATOM 788 CB ASN A 56 1.171 6.116 -7.714 1.00 32.32 C ATOM 789 CG ASN A 56 0.917 5.856 -6.237 1.00 54.44 C ATOM 790 OD1 ASN A 56 0.051 6.470 -5.617 1.00 0.54 O ATOM 791 ND2 ASN A 56 1.681 4.967 -5.665 1.00 0.31 N ATOM 0 H ASN A 56 -0.468 7.995 -7.009 1.00 23.24 H new ATOM 0 HA ASN A 56 0.195 6.698 -9.547 1.00 51.11 H new ATOM 0 HB2 ASN A 56 1.570 5.209 -8.168 1.00 32.32 H new ATOM 0 HB3 ASN A 56 1.938 6.884 -7.810 1.00 32.32 H new ATOM 0 HD21 ASN A 56 1.570 4.762 -4.672 1.00 0.31 H new ATOM 0 HD22 ASN A 56 2.390 4.477 -6.211 1.00 0.31 H new ATOM 798 N ALA A 57 -2.422 5.883 -8.447 1.00 34.04 N ATOM 799 CA ALA A 57 -3.557 4.959 -8.384 1.00 62.11 C ATOM 800 C ALA A 57 -3.553 3.983 -9.543 1.00 22.34 C ATOM 801 O ALA A 57 -3.178 4.333 -10.676 1.00 1.45 O ATOM 802 CB ALA A 57 -4.865 5.714 -8.364 1.00 62.31 C ATOM 0 H ALA A 57 -2.689 6.866 -8.490 1.00 34.04 H new ATOM 0 HA ALA A 57 -3.454 4.392 -7.459 1.00 62.11 H new ATOM 0 HB1 ALA A 57 -5.693 5.006 -8.317 1.00 62.31 H new ATOM 0 HB2 ALA A 57 -4.895 6.366 -7.491 1.00 62.31 H new ATOM 0 HB3 ALA A 57 -4.952 6.315 -9.269 1.00 62.31 H new ATOM 808 N GLY A 58 -3.948 2.774 -9.263 1.00 4.25 N ATOM 809 CA GLY A 58 -3.987 1.756 -10.267 1.00 41.04 C ATOM 810 C GLY A 58 -2.846 0.798 -10.115 1.00 24.34 C ATOM 811 O GLY A 58 -2.919 -0.348 -10.560 1.00 55.33 O ATOM 0 H GLY A 58 -4.250 2.470 -8.337 1.00 4.25 H new ATOM 0 HA2 GLY A 58 -4.931 1.214 -10.202 1.00 41.04 H new ATOM 0 HA3 GLY A 58 -3.950 2.215 -11.255 1.00 41.04 H new ATOM 815 N ALA A 59 -1.797 1.256 -9.478 1.00 42.15 N ATOM 816 CA ALA A 59 -0.633 0.440 -9.278 1.00 1.23 C ATOM 817 C ALA A 59 -0.814 -0.455 -8.063 1.00 54.01 C ATOM 818 O ALA A 59 -1.286 -0.005 -7.000 1.00 21.12 O ATOM 819 CB ALA A 59 0.607 1.308 -9.136 1.00 12.34 C ATOM 0 H ALA A 59 -1.729 2.196 -9.088 1.00 42.15 H new ATOM 0 HA ALA A 59 -0.500 -0.198 -10.152 1.00 1.23 H new ATOM 0 HB1 ALA A 59 1.480 0.673 -8.985 1.00 12.34 H new ATOM 0 HB2 ALA A 59 0.742 1.901 -10.041 1.00 12.34 H new ATOM 0 HB3 ALA A 59 0.490 1.973 -8.280 1.00 12.34 H new ATOM 825 N ARG A 60 -0.470 -1.713 -8.219 1.00 11.30 N ATOM 826 CA ARG A 60 -0.554 -2.660 -7.136 1.00 41.42 C ATOM 827 C ARG A 60 0.859 -2.970 -6.676 1.00 64.41 C ATOM 828 O ARG A 60 1.782 -3.076 -7.502 1.00 75.32 O ATOM 829 CB ARG A 60 -1.284 -3.967 -7.564 1.00 13.22 C ATOM 830 CG ARG A 60 -0.509 -4.850 -8.547 1.00 50.31 C ATOM 831 CD ARG A 60 -1.279 -6.104 -8.938 1.00 50.32 C ATOM 832 NE ARG A 60 -0.428 -7.038 -9.699 1.00 30.34 N ATOM 833 CZ ARG A 60 -0.843 -8.148 -10.342 1.00 11.12 C ATOM 834 NH1 ARG A 60 -2.134 -8.451 -10.400 1.00 72.01 N ATOM 835 NH2 ARG A 60 0.045 -8.948 -10.924 1.00 32.44 N ATOM 0 H ARG A 60 -0.126 -2.105 -9.096 1.00 11.30 H new ATOM 0 HA ARG A 60 -1.138 -2.226 -6.324 1.00 41.42 H new ATOM 0 HB2 ARG A 60 -1.505 -4.551 -6.671 1.00 13.22 H new ATOM 0 HB3 ARG A 60 -2.240 -3.700 -8.015 1.00 13.22 H new ATOM 0 HG2 ARG A 60 -0.279 -4.274 -9.444 1.00 50.31 H new ATOM 0 HG3 ARG A 60 0.443 -5.137 -8.100 1.00 50.31 H new ATOM 0 HD2 ARG A 60 -1.654 -6.598 -8.042 1.00 50.32 H new ATOM 0 HD3 ARG A 60 -2.147 -5.829 -9.537 1.00 50.32 H new ATOM 0 HE ARG A 60 0.568 -6.824 -9.743 1.00 30.34 H new ATOM 0 HH11 ARG A 60 -2.821 -7.842 -9.956 1.00 72.01 H new ATOM 0 HH12 ARG A 60 -2.439 -9.293 -10.889 1.00 72.01 H new ATOM 0 HH21 ARG A 60 1.039 -8.722 -10.884 1.00 32.44 H new ATOM 0 HH22 ARG A 60 -0.267 -9.788 -11.411 1.00 32.44 H new ATOM 849 N PHE A 61 1.056 -3.057 -5.402 1.00 41.54 N ATOM 850 CA PHE A 61 2.354 -3.367 -4.867 1.00 52.24 C ATOM 851 C PHE A 61 2.239 -4.529 -3.915 1.00 44.34 C ATOM 852 O PHE A 61 1.388 -4.528 -3.016 1.00 63.33 O ATOM 853 CB PHE A 61 2.948 -2.150 -4.159 1.00 62.34 C ATOM 854 CG PHE A 61 3.093 -0.942 -5.046 1.00 75.53 C ATOM 855 CD1 PHE A 61 4.087 -0.893 -6.005 1.00 44.44 C ATOM 856 CD2 PHE A 61 2.235 0.141 -4.918 1.00 1.50 C ATOM 857 CE1 PHE A 61 4.225 0.209 -6.823 1.00 14.13 C ATOM 858 CE2 PHE A 61 2.368 1.247 -5.734 1.00 42.13 C ATOM 859 CZ PHE A 61 3.366 1.280 -6.688 1.00 41.04 C ATOM 0 H PHE A 61 0.330 -2.917 -4.700 1.00 41.54 H new ATOM 0 HA PHE A 61 3.022 -3.639 -5.685 1.00 52.24 H new ATOM 0 HB2 PHE A 61 2.316 -1.891 -3.309 1.00 62.34 H new ATOM 0 HB3 PHE A 61 3.927 -2.416 -3.760 1.00 62.34 H new ATOM 0 HD1 PHE A 61 4.764 -1.727 -6.115 1.00 44.44 H new ATOM 0 HD2 PHE A 61 1.454 0.119 -4.172 1.00 1.50 H new ATOM 0 HE1 PHE A 61 5.005 0.233 -7.569 1.00 14.13 H new ATOM 0 HE2 PHE A 61 1.694 2.084 -5.626 1.00 42.13 H new ATOM 0 HZ PHE A 61 3.474 2.143 -7.328 1.00 41.04 H new ATOM 869 N LEU A 62 3.043 -5.529 -4.130 1.00 12.14 N ATOM 870 CA LEU A 62 3.037 -6.699 -3.291 1.00 74.42 C ATOM 871 C LEU A 62 4.066 -6.543 -2.212 1.00 72.14 C ATOM 872 O LEU A 62 5.178 -6.051 -2.464 1.00 24.22 O ATOM 873 CB LEU A 62 3.325 -7.995 -4.086 1.00 62.35 C ATOM 874 CG LEU A 62 2.200 -8.585 -4.965 1.00 31.31 C ATOM 875 CD1 LEU A 62 1.773 -7.651 -6.091 1.00 0.15 C ATOM 876 CD2 LEU A 62 2.635 -9.920 -5.525 1.00 45.35 C ATOM 0 H LEU A 62 3.722 -5.560 -4.890 1.00 12.14 H new ATOM 0 HA LEU A 62 2.039 -6.789 -2.862 1.00 74.42 H new ATOM 0 HB2 LEU A 62 4.184 -7.805 -4.730 1.00 62.35 H new ATOM 0 HB3 LEU A 62 3.625 -8.762 -3.372 1.00 62.35 H new ATOM 0 HG LEU A 62 1.328 -8.717 -4.325 1.00 31.31 H new ATOM 0 HD11 LEU A 62 0.980 -8.121 -6.673 1.00 0.15 H new ATOM 0 HD12 LEU A 62 1.407 -6.715 -5.668 1.00 0.15 H new ATOM 0 HD13 LEU A 62 2.626 -7.447 -6.738 1.00 0.15 H new ATOM 0 HD21 LEU A 62 1.838 -10.332 -6.144 1.00 45.35 H new ATOM 0 HD22 LEU A 62 3.532 -9.786 -6.130 1.00 45.35 H new ATOM 0 HD23 LEU A 62 2.849 -10.606 -4.705 1.00 45.35 H new ATOM 888 N LEU A 63 3.719 -6.922 -1.018 1.00 40.20 N ATOM 889 CA LEU A 63 4.670 -6.873 0.045 1.00 15.34 C ATOM 890 C LEU A 63 5.465 -8.158 -0.013 1.00 13.21 C ATOM 891 O LEU A 63 4.976 -9.226 0.360 1.00 31.20 O ATOM 892 CB LEU A 63 3.994 -6.710 1.427 1.00 1.25 C ATOM 893 CG LEU A 63 3.174 -5.421 1.701 1.00 62.31 C ATOM 894 CD1 LEU A 63 3.972 -4.163 1.385 1.00 61.54 C ATOM 895 CD2 LEU A 63 1.826 -5.428 0.981 1.00 12.43 C ATOM 0 H LEU A 63 2.794 -7.265 -0.760 1.00 40.20 H new ATOM 0 HA LEU A 63 5.315 -6.003 -0.078 1.00 15.34 H new ATOM 0 HB2 LEU A 63 3.331 -7.563 1.575 1.00 1.25 H new ATOM 0 HB3 LEU A 63 4.773 -6.776 2.187 1.00 1.25 H new ATOM 0 HG LEU A 63 2.961 -5.410 2.770 1.00 62.31 H new ATOM 0 HD11 LEU A 63 3.362 -3.284 1.591 1.00 61.54 H new ATOM 0 HD12 LEU A 63 4.868 -4.135 2.005 1.00 61.54 H new ATOM 0 HD13 LEU A 63 4.258 -4.168 0.333 1.00 61.54 H new ATOM 0 HD21 LEU A 63 1.290 -4.506 1.204 1.00 12.43 H new ATOM 0 HD22 LEU A 63 1.988 -5.503 -0.094 1.00 12.43 H new ATOM 0 HD23 LEU A 63 1.237 -6.281 1.319 1.00 12.43 H new ATOM 907 N ASP A 64 6.663 -8.055 -0.520 1.00 42.35 N ATOM 908 CA ASP A 64 7.518 -9.220 -0.722 1.00 65.00 C ATOM 909 C ASP A 64 8.851 -9.053 -0.015 1.00 72.13 C ATOM 910 O ASP A 64 9.579 -10.015 0.221 1.00 71.23 O ATOM 911 CB ASP A 64 7.714 -9.452 -2.231 1.00 5.32 C ATOM 912 CG ASP A 64 8.635 -10.606 -2.563 1.00 54.11 C ATOM 913 OD1 ASP A 64 8.308 -11.760 -2.245 1.00 5.54 O ATOM 914 OD2 ASP A 64 9.713 -10.369 -3.168 1.00 30.12 O ATOM 0 H ASP A 64 7.084 -7.171 -0.807 1.00 42.35 H new ATOM 0 HA ASP A 64 7.034 -10.095 -0.288 1.00 65.00 H new ATOM 0 HB2 ASP A 64 6.742 -9.633 -2.689 1.00 5.32 H new ATOM 0 HB3 ASP A 64 8.113 -8.542 -2.679 1.00 5.32 H new ATOM 919 N GLN A 65 9.147 -7.847 0.371 1.00 62.52 N ATOM 920 CA GLN A 65 10.387 -7.568 1.041 1.00 54.43 C ATOM 921 C GLN A 65 10.126 -7.300 2.495 1.00 62.40 C ATOM 922 O GLN A 65 9.127 -6.677 2.825 1.00 5.35 O ATOM 923 CB GLN A 65 11.143 -6.404 0.374 1.00 53.30 C ATOM 924 CG GLN A 65 10.313 -5.160 0.120 1.00 1.25 C ATOM 925 CD GLN A 65 11.060 -4.125 -0.698 1.00 74.45 C ATOM 926 OE1 GLN A 65 11.047 -4.166 -1.924 1.00 40.54 O ATOM 927 NE2 GLN A 65 11.687 -3.189 -0.049 1.00 3.42 N ATOM 0 H GLN A 65 8.545 -7.036 0.233 1.00 62.52 H new ATOM 0 HA GLN A 65 11.032 -8.443 0.959 1.00 54.43 H new ATOM 0 HB2 GLN A 65 11.991 -6.134 1.003 1.00 53.30 H new ATOM 0 HB3 GLN A 65 11.549 -6.752 -0.576 1.00 53.30 H new ATOM 0 HG2 GLN A 65 9.396 -5.438 -0.400 1.00 1.25 H new ATOM 0 HG3 GLN A 65 10.018 -4.722 1.074 1.00 1.25 H new ATOM 0 HE21 GLN A 65 11.679 -3.182 0.971 1.00 3.42 H new ATOM 0 HE22 GLN A 65 12.187 -2.461 -0.560 1.00 3.42 H new ATOM 936 N PRO A 66 11.030 -7.765 3.383 1.00 3.12 N ATOM 937 CA PRO A 66 10.882 -7.650 4.849 1.00 4.12 C ATOM 938 C PRO A 66 10.651 -6.217 5.338 1.00 12.23 C ATOM 939 O PRO A 66 10.160 -5.995 6.447 1.00 72.53 O ATOM 940 CB PRO A 66 12.211 -8.193 5.393 1.00 60.11 C ATOM 941 CG PRO A 66 13.136 -8.224 4.224 1.00 21.41 C ATOM 942 CD PRO A 66 12.272 -8.479 3.036 1.00 54.04 C ATOM 0 HA PRO A 66 10.002 -8.194 5.193 1.00 4.12 H new ATOM 0 HB2 PRO A 66 12.601 -7.554 6.185 1.00 60.11 H new ATOM 0 HB3 PRO A 66 12.084 -9.188 5.819 1.00 60.11 H new ATOM 0 HG2 PRO A 66 13.672 -7.280 4.123 1.00 21.41 H new ATOM 0 HG3 PRO A 66 13.886 -9.006 4.338 1.00 21.41 H new ATOM 0 HD2 PRO A 66 12.719 -8.093 2.120 1.00 54.04 H new ATOM 0 HD3 PRO A 66 12.098 -9.544 2.882 1.00 54.04 H new ATOM 950 N THR A 67 10.999 -5.255 4.532 1.00 34.22 N ATOM 951 CA THR A 67 10.780 -3.884 4.863 1.00 42.34 C ATOM 952 C THR A 67 10.501 -3.136 3.577 1.00 62.13 C ATOM 953 O THR A 67 11.296 -3.174 2.655 1.00 71.22 O ATOM 954 CB THR A 67 12.016 -3.265 5.579 1.00 25.32 C ATOM 955 OG1 THR A 67 12.350 -4.044 6.748 1.00 24.33 O ATOM 956 CG2 THR A 67 11.735 -1.827 6.009 1.00 4.23 C ATOM 0 H THR A 67 11.443 -5.404 3.626 1.00 34.22 H new ATOM 0 HA THR A 67 9.937 -3.808 5.550 1.00 42.34 H new ATOM 0 HB THR A 67 12.848 -3.270 4.875 1.00 25.32 H new ATOM 0 HG1 THR A 67 13.129 -3.649 7.192 1.00 24.33 H new ATOM 0 HG21 THR A 67 12.614 -1.418 6.507 1.00 4.23 H new ATOM 0 HG22 THR A 67 11.501 -1.224 5.132 1.00 4.23 H new ATOM 0 HG23 THR A 67 10.889 -1.811 6.696 1.00 4.23 H new ATOM 964 N THR A 68 9.371 -2.514 3.505 1.00 10.22 N ATOM 965 CA THR A 68 8.992 -1.755 2.353 1.00 41.12 C ATOM 966 C THR A 68 8.753 -0.314 2.813 1.00 24.53 C ATOM 967 O THR A 68 7.863 -0.065 3.600 1.00 41.23 O ATOM 968 CB THR A 68 7.687 -2.344 1.777 1.00 32.33 C ATOM 969 OG1 THR A 68 7.806 -3.779 1.706 1.00 52.21 O ATOM 970 CG2 THR A 68 7.427 -1.819 0.389 1.00 70.12 C ATOM 0 H THR A 68 8.675 -2.517 4.251 1.00 10.22 H new ATOM 0 HA THR A 68 9.765 -1.785 1.585 1.00 41.12 H new ATOM 0 HB THR A 68 6.863 -2.055 2.429 1.00 32.33 H new ATOM 0 HG1 THR A 68 6.979 -4.158 1.342 1.00 52.21 H new ATOM 0 HG21 THR A 68 6.502 -2.249 0.005 1.00 70.12 H new ATOM 0 HG22 THR A 68 7.337 -0.733 0.422 1.00 70.12 H new ATOM 0 HG23 THR A 68 8.254 -2.095 -0.265 1.00 70.12 H new ATOM 978 N THR A 69 9.561 0.607 2.378 1.00 61.25 N ATOM 979 CA THR A 69 9.413 1.981 2.804 1.00 11.12 C ATOM 980 C THR A 69 8.523 2.762 1.822 1.00 4.34 C ATOM 981 O THR A 69 8.534 2.491 0.607 1.00 4.32 O ATOM 982 CB THR A 69 10.807 2.640 2.940 1.00 63.41 C ATOM 983 OG1 THR A 69 11.626 1.794 3.761 1.00 65.53 O ATOM 984 CG2 THR A 69 10.716 4.021 3.593 1.00 64.24 C ATOM 0 H THR A 69 10.330 0.440 1.729 1.00 61.25 H new ATOM 0 HA THR A 69 8.924 2.000 3.778 1.00 11.12 H new ATOM 0 HB THR A 69 11.233 2.763 1.944 1.00 63.41 H new ATOM 0 HG1 THR A 69 12.515 2.194 3.858 1.00 65.53 H new ATOM 0 HG21 THR A 69 11.714 4.453 3.672 1.00 64.24 H new ATOM 0 HG22 THR A 69 10.087 4.670 2.985 1.00 64.24 H new ATOM 0 HG23 THR A 69 10.283 3.925 4.589 1.00 64.24 H new ATOM 992 N ALA A 70 7.731 3.670 2.356 1.00 51.43 N ATOM 993 CA ALA A 70 6.872 4.521 1.577 1.00 45.41 C ATOM 994 C ALA A 70 7.254 5.973 1.806 1.00 31.34 C ATOM 995 O ALA A 70 7.578 6.379 2.951 1.00 62.53 O ATOM 996 CB ALA A 70 5.417 4.296 1.956 1.00 52.55 C ATOM 0 H ALA A 70 7.670 3.835 3.361 1.00 51.43 H new ATOM 0 HA ALA A 70 6.993 4.278 0.521 1.00 45.41 H new ATOM 0 HB1 ALA A 70 4.780 4.947 1.358 1.00 52.55 H new ATOM 0 HB2 ALA A 70 5.149 3.256 1.770 1.00 52.55 H new ATOM 0 HB3 ALA A 70 5.277 4.523 3.013 1.00 52.55 H new ATOM 1002 N GLY A 71 7.252 6.733 0.749 1.00 10.11 N ATOM 1003 CA GLY A 71 7.582 8.128 0.817 1.00 74.30 C ATOM 1004 C GLY A 71 8.230 8.561 -0.461 1.00 4.23 C ATOM 1005 O GLY A 71 7.753 8.196 -1.550 1.00 41.32 O ATOM 0 H GLY A 71 7.021 6.402 -0.188 1.00 10.11 H new ATOM 0 HA2 GLY A 71 6.681 8.715 0.995 1.00 74.30 H new ATOM 0 HA3 GLY A 71 8.254 8.311 1.656 1.00 74.30 H new ATOM 1009 N ARG A 72 9.294 9.326 -0.356 1.00 64.45 N ATOM 1010 CA ARG A 72 10.040 9.721 -1.521 1.00 3.31 C ATOM 1011 C ARG A 72 11.460 9.182 -1.379 1.00 20.10 C ATOM 1012 O ARG A 72 12.017 9.239 -0.270 1.00 42.03 O ATOM 1013 CB ARG A 72 10.095 11.262 -1.715 1.00 21.50 C ATOM 1014 CG ARG A 72 11.076 11.979 -0.787 1.00 61.53 C ATOM 1015 CD ARG A 72 11.395 13.383 -1.258 1.00 30.12 C ATOM 1016 NE ARG A 72 12.581 13.933 -0.565 1.00 53.04 N ATOM 1017 CZ ARG A 72 13.813 14.043 -1.130 1.00 3.14 C ATOM 1018 NH1 ARG A 72 14.041 13.540 -2.345 1.00 72.44 N ATOM 1019 NH2 ARG A 72 14.817 14.614 -0.461 1.00 75.31 N ATOM 0 H ARG A 72 9.659 9.685 0.526 1.00 64.45 H new ATOM 0 HA ARG A 72 9.536 9.312 -2.397 1.00 3.31 H new ATOM 0 HB2 ARG A 72 10.368 11.477 -2.748 1.00 21.50 H new ATOM 0 HB3 ARG A 72 9.098 11.672 -1.557 1.00 21.50 H new ATOM 0 HG2 ARG A 72 10.656 12.022 0.218 1.00 61.53 H new ATOM 0 HG3 ARG A 72 11.998 11.402 -0.722 1.00 61.53 H new ATOM 0 HD2 ARG A 72 11.572 13.375 -2.333 1.00 30.12 H new ATOM 0 HD3 ARG A 72 10.536 14.031 -1.081 1.00 30.12 H new ATOM 0 HE ARG A 72 12.467 14.250 0.398 1.00 53.04 H new ATOM 0 HH11 ARG A 72 13.290 13.072 -2.852 1.00 72.44 H new ATOM 0 HH12 ARG A 72 14.966 13.624 -2.766 1.00 72.44 H new ATOM 0 HH21 ARG A 72 14.663 14.972 0.482 1.00 75.31 H new ATOM 0 HH22 ARG A 72 15.738 14.692 -0.892 1.00 75.31 H new ATOM 1033 N HIS A 73 11.968 8.601 -2.472 1.00 42.04 N ATOM 1034 CA HIS A 73 13.357 8.093 -2.672 1.00 3.53 C ATOM 1035 C HIS A 73 13.303 6.853 -3.536 1.00 23.12 C ATOM 1036 O HIS A 73 12.272 6.191 -3.594 1.00 34.43 O ATOM 1037 CB HIS A 73 14.122 7.736 -1.365 1.00 75.24 C ATOM 1038 CG HIS A 73 15.202 8.728 -1.014 1.00 22.44 C ATOM 1039 ND1 HIS A 73 16.549 8.439 -1.061 1.00 23.04 N ATOM 1040 CD2 HIS A 73 15.116 10.021 -0.613 1.00 33.35 C ATOM 1041 CE1 HIS A 73 17.224 9.519 -0.704 1.00 24.32 C ATOM 1042 NE2 HIS A 73 16.405 10.523 -0.417 1.00 34.00 N ATOM 0 H HIS A 73 11.394 8.457 -3.303 1.00 42.04 H new ATOM 0 HA HIS A 73 13.905 8.912 -3.137 1.00 3.53 H new ATOM 0 HB2 HIS A 73 13.411 7.677 -0.541 1.00 75.24 H new ATOM 0 HB3 HIS A 73 14.568 6.747 -1.472 1.00 75.24 H new ATOM 0 HD1 HIS A 73 16.957 7.543 -1.327 1.00 23.04 H new ATOM 0 HD2 HIS A 73 14.199 10.573 -0.469 1.00 33.35 H new ATOM 0 HE1 HIS A 73 18.301 9.576 -0.653 1.00 24.32 H new ATOM 1050 N PRO A 74 14.390 6.498 -4.232 1.00 45.34 N ATOM 1051 CA PRO A 74 14.441 5.255 -4.997 1.00 24.34 C ATOM 1052 C PRO A 74 14.575 4.056 -4.058 1.00 15.22 C ATOM 1053 O PRO A 74 14.360 2.905 -4.441 1.00 41.32 O ATOM 1054 CB PRO A 74 15.695 5.409 -5.872 1.00 33.32 C ATOM 1055 CG PRO A 74 16.077 6.845 -5.760 1.00 64.43 C ATOM 1056 CD PRO A 74 15.621 7.277 -4.406 1.00 64.35 C ATOM 0 HA PRO A 74 13.541 5.082 -5.586 1.00 24.34 H new ATOM 0 HB2 PRO A 74 16.499 4.760 -5.525 1.00 33.32 H new ATOM 0 HB3 PRO A 74 15.489 5.136 -6.907 1.00 33.32 H new ATOM 0 HG2 PRO A 74 17.154 6.974 -5.871 1.00 64.43 H new ATOM 0 HG3 PRO A 74 15.603 7.439 -6.541 1.00 64.43 H new ATOM 0 HD2 PRO A 74 16.359 7.050 -3.636 1.00 64.35 H new ATOM 0 HD3 PRO A 74 15.434 8.350 -4.362 1.00 64.35 H new ATOM 1064 N GLU A 75 14.933 4.350 -2.818 1.00 62.34 N ATOM 1065 CA GLU A 75 15.059 3.350 -1.779 1.00 22.13 C ATOM 1066 C GLU A 75 13.690 2.974 -1.235 1.00 0.34 C ATOM 1067 O GLU A 75 13.501 1.882 -0.695 1.00 13.22 O ATOM 1068 CB GLU A 75 15.975 3.818 -0.634 1.00 4.43 C ATOM 1069 CG GLU A 75 17.465 3.936 -0.987 1.00 51.43 C ATOM 1070 CD GLU A 75 17.773 4.979 -2.037 1.00 50.40 C ATOM 1071 OE1 GLU A 75 17.718 6.171 -1.726 1.00 73.15 O ATOM 1072 OE2 GLU A 75 18.103 4.614 -3.185 1.00 41.41 O ATOM 0 H GLU A 75 15.145 5.298 -2.506 1.00 62.34 H new ATOM 0 HA GLU A 75 15.520 2.471 -2.230 1.00 22.13 H new ATOM 0 HB2 GLU A 75 15.624 4.789 -0.285 1.00 4.43 H new ATOM 0 HB3 GLU A 75 15.871 3.123 0.199 1.00 4.43 H new ATOM 0 HG2 GLU A 75 18.024 4.172 -0.081 1.00 51.43 H new ATOM 0 HG3 GLU A 75 17.821 2.967 -1.338 1.00 51.43 H new ATOM 1079 N SER A 76 12.732 3.867 -1.373 1.00 63.51 N ATOM 1080 CA SER A 76 11.404 3.561 -0.952 1.00 32.34 C ATOM 1081 C SER A 76 10.701 2.822 -2.070 1.00 13.21 C ATOM 1082 O SER A 76 10.647 3.307 -3.207 1.00 12.35 O ATOM 1083 CB SER A 76 10.648 4.830 -0.496 1.00 35.30 C ATOM 1084 OG SER A 76 10.706 5.866 -1.452 1.00 1.21 O ATOM 0 H SER A 76 12.857 4.798 -1.771 1.00 63.51 H new ATOM 0 HA SER A 76 11.431 2.913 -0.076 1.00 32.34 H new ATOM 0 HB2 SER A 76 9.606 4.578 -0.301 1.00 35.30 H new ATOM 0 HB3 SER A 76 11.072 5.183 0.444 1.00 35.30 H new ATOM 0 HG SER A 76 11.180 5.549 -2.249 1.00 1.21 H new ATOM 1090 N ASP A 77 10.246 1.622 -1.778 1.00 51.42 N ATOM 1091 CA ASP A 77 9.594 0.799 -2.780 1.00 11.44 C ATOM 1092 C ASP A 77 8.241 1.375 -3.148 1.00 63.12 C ATOM 1093 O ASP A 77 7.834 1.348 -4.313 1.00 61.55 O ATOM 1094 CB ASP A 77 9.471 -0.653 -2.320 1.00 30.23 C ATOM 1095 CG ASP A 77 8.872 -1.550 -3.390 1.00 63.20 C ATOM 1096 OD1 ASP A 77 9.419 -1.592 -4.516 1.00 71.21 O ATOM 1097 OD2 ASP A 77 7.843 -2.206 -3.150 1.00 4.34 O ATOM 0 H ASP A 77 10.315 1.193 -0.855 1.00 51.42 H new ATOM 0 HA ASP A 77 10.219 0.803 -3.673 1.00 11.44 H new ATOM 0 HB2 ASP A 77 10.456 -1.029 -2.044 1.00 30.23 H new ATOM 0 HB3 ASP A 77 8.851 -0.696 -1.424 1.00 30.23 H new ATOM 1102 N ILE A 78 7.558 1.941 -2.176 1.00 21.50 N ATOM 1103 CA ILE A 78 6.290 2.562 -2.451 1.00 24.33 C ATOM 1104 C ILE A 78 6.544 4.053 -2.615 1.00 45.21 C ATOM 1105 O ILE A 78 6.692 4.787 -1.628 1.00 65.31 O ATOM 1106 CB ILE A 78 5.246 2.341 -1.309 1.00 33.02 C ATOM 1107 CG1 ILE A 78 5.195 0.864 -0.870 1.00 70.40 C ATOM 1108 CG2 ILE A 78 3.854 2.799 -1.756 1.00 71.12 C ATOM 1109 CD1 ILE A 78 4.843 -0.116 -1.967 1.00 22.02 C ATOM 0 H ILE A 78 7.858 1.982 -1.202 1.00 21.50 H new ATOM 0 HA ILE A 78 5.870 2.112 -3.351 1.00 24.33 H new ATOM 0 HB ILE A 78 5.563 2.940 -0.455 1.00 33.02 H new ATOM 0 HG12 ILE A 78 6.165 0.590 -0.456 1.00 70.40 H new ATOM 0 HG13 ILE A 78 4.466 0.764 -0.066 1.00 70.40 H new ATOM 0 HG21 ILE A 78 3.141 2.637 -0.948 1.00 71.12 H new ATOM 0 HG22 ILE A 78 3.883 3.859 -2.008 1.00 71.12 H new ATOM 0 HG23 ILE A 78 3.546 2.227 -2.631 1.00 71.12 H new ATOM 0 HD11 ILE A 78 4.832 -1.128 -1.561 1.00 22.02 H new ATOM 0 HD12 ILE A 78 3.858 0.125 -2.368 1.00 22.02 H new ATOM 0 HD13 ILE A 78 5.584 -0.052 -2.763 1.00 22.02 H new ATOM 1121 N PHE A 79 6.637 4.484 -3.844 1.00 14.11 N ATOM 1122 CA PHE A 79 6.915 5.866 -4.131 1.00 42.42 C ATOM 1123 C PHE A 79 5.612 6.621 -4.312 1.00 14.24 C ATOM 1124 O PHE A 79 4.840 6.348 -5.248 1.00 60.12 O ATOM 1125 CB PHE A 79 7.810 5.995 -5.378 1.00 34.42 C ATOM 1126 CG PHE A 79 8.280 7.402 -5.660 1.00 41.12 C ATOM 1127 CD1 PHE A 79 9.398 7.910 -5.017 1.00 53.00 C ATOM 1128 CD2 PHE A 79 7.606 8.214 -6.565 1.00 54.21 C ATOM 1129 CE1 PHE A 79 9.836 9.195 -5.270 1.00 74.11 C ATOM 1130 CE2 PHE A 79 8.040 9.500 -6.820 1.00 45.02 C ATOM 1131 CZ PHE A 79 9.158 9.991 -6.171 1.00 21.10 C ATOM 0 H PHE A 79 6.523 3.894 -4.668 1.00 14.11 H new ATOM 0 HA PHE A 79 7.457 6.302 -3.292 1.00 42.42 H new ATOM 0 HB2 PHE A 79 8.681 5.351 -5.255 1.00 34.42 H new ATOM 0 HB3 PHE A 79 7.261 5.627 -6.245 1.00 34.42 H new ATOM 0 HD1 PHE A 79 9.933 7.294 -4.310 1.00 53.00 H new ATOM 0 HD2 PHE A 79 6.733 7.835 -7.075 1.00 54.21 H new ATOM 0 HE1 PHE A 79 10.709 9.577 -4.763 1.00 74.11 H new ATOM 0 HE2 PHE A 79 7.507 10.121 -7.525 1.00 45.02 H new ATOM 0 HZ PHE A 79 9.500 10.996 -6.369 1.00 21.10 H new ATOM 1141 N LEU A 80 5.371 7.539 -3.421 1.00 24.33 N ATOM 1142 CA LEU A 80 4.174 8.348 -3.429 1.00 52.02 C ATOM 1143 C LEU A 80 4.584 9.764 -3.764 1.00 32.43 C ATOM 1144 O LEU A 80 5.579 10.266 -3.230 1.00 23.33 O ATOM 1145 CB LEU A 80 3.521 8.325 -2.034 1.00 42.32 C ATOM 1146 CG LEU A 80 3.147 6.945 -1.464 1.00 23.53 C ATOM 1147 CD1 LEU A 80 2.585 7.087 -0.061 1.00 42.42 C ATOM 1148 CD2 LEU A 80 2.140 6.237 -2.361 1.00 22.33 C ATOM 0 H LEU A 80 6.008 7.754 -2.654 1.00 24.33 H new ATOM 0 HA LEU A 80 3.460 7.966 -4.158 1.00 52.02 H new ATOM 0 HB2 LEU A 80 4.201 8.809 -1.333 1.00 42.32 H new ATOM 0 HB3 LEU A 80 2.617 8.933 -2.072 1.00 42.32 H new ATOM 0 HG LEU A 80 4.053 6.341 -1.424 1.00 23.53 H new ATOM 0 HD11 LEU A 80 2.325 6.103 0.328 1.00 42.42 H new ATOM 0 HD12 LEU A 80 3.332 7.547 0.585 1.00 42.42 H new ATOM 0 HD13 LEU A 80 1.693 7.713 -0.088 1.00 42.42 H new ATOM 0 HD21 LEU A 80 1.893 5.265 -1.935 1.00 22.33 H new ATOM 0 HD22 LEU A 80 1.235 6.839 -2.438 1.00 22.33 H new ATOM 0 HD23 LEU A 80 2.570 6.100 -3.353 1.00 22.33 H new ATOM 1160 N ASP A 81 3.868 10.392 -4.648 1.00 41.31 N ATOM 1161 CA ASP A 81 4.185 11.743 -5.033 1.00 61.32 C ATOM 1162 C ASP A 81 3.041 12.675 -4.683 1.00 72.24 C ATOM 1163 O ASP A 81 1.878 12.425 -5.018 1.00 44.54 O ATOM 1164 CB ASP A 81 4.562 11.843 -6.520 1.00 52.21 C ATOM 1165 CG ASP A 81 3.425 11.544 -7.470 1.00 73.20 C ATOM 1166 OD1 ASP A 81 3.026 10.364 -7.600 1.00 30.41 O ATOM 1167 OD2 ASP A 81 2.932 12.477 -8.128 1.00 54.02 O ATOM 0 H ASP A 81 3.057 9.993 -5.120 1.00 41.31 H new ATOM 0 HA ASP A 81 5.063 12.054 -4.468 1.00 61.32 H new ATOM 0 HB2 ASP A 81 4.934 12.847 -6.722 1.00 52.21 H new ATOM 0 HB3 ASP A 81 5.381 11.153 -6.723 1.00 52.21 H new ATOM 1172 N ASP A 82 3.375 13.726 -3.997 1.00 65.13 N ATOM 1173 CA ASP A 82 2.426 14.712 -3.519 1.00 64.32 C ATOM 1174 C ASP A 82 3.183 16.038 -3.518 1.00 64.42 C ATOM 1175 O ASP A 82 4.365 16.068 -3.895 1.00 51.22 O ATOM 1176 CB ASP A 82 1.981 14.348 -2.068 1.00 40.32 C ATOM 1177 CG ASP A 82 0.687 15.027 -1.597 1.00 30.33 C ATOM 1178 OD1 ASP A 82 0.434 16.212 -1.949 1.00 51.14 O ATOM 1179 OD2 ASP A 82 -0.103 14.380 -0.909 1.00 35.41 O ATOM 0 H ASP A 82 4.340 13.936 -3.742 1.00 65.13 H new ATOM 0 HA ASP A 82 1.531 14.758 -4.140 1.00 64.32 H new ATOM 0 HB2 ASP A 82 1.851 13.268 -2.004 1.00 40.32 H new ATOM 0 HB3 ASP A 82 2.784 14.613 -1.380 1.00 40.32 H new ATOM 1184 N VAL A 83 2.549 17.095 -3.101 1.00 23.50 N ATOM 1185 CA VAL A 83 3.173 18.401 -3.033 1.00 30.34 C ATOM 1186 C VAL A 83 3.968 18.478 -1.725 1.00 44.03 C ATOM 1187 O VAL A 83 4.928 19.233 -1.586 1.00 35.25 O ATOM 1188 CB VAL A 83 2.103 19.539 -3.077 1.00 11.53 C ATOM 1189 CG1 VAL A 83 2.753 20.919 -3.141 1.00 45.15 C ATOM 1190 CG2 VAL A 83 1.153 19.344 -4.253 1.00 55.15 C ATOM 0 H VAL A 83 1.576 17.084 -2.794 1.00 23.50 H new ATOM 0 HA VAL A 83 3.831 18.536 -3.891 1.00 30.34 H new ATOM 0 HB VAL A 83 1.529 19.483 -2.152 1.00 11.53 H new ATOM 0 HG11 VAL A 83 1.978 21.685 -3.170 1.00 45.15 H new ATOM 0 HG12 VAL A 83 3.378 21.068 -2.260 1.00 45.15 H new ATOM 0 HG13 VAL A 83 3.368 20.990 -4.038 1.00 45.15 H new ATOM 0 HG21 VAL A 83 0.417 20.148 -4.263 1.00 55.15 H new ATOM 0 HG22 VAL A 83 1.719 19.358 -5.184 1.00 55.15 H new ATOM 0 HG23 VAL A 83 0.643 18.386 -4.153 1.00 55.15 H new ATOM 1200 N THR A 84 3.553 17.685 -0.767 1.00 41.33 N ATOM 1201 CA THR A 84 4.225 17.603 0.492 1.00 63.40 C ATOM 1202 C THR A 84 4.333 16.139 0.942 1.00 64.35 C ATOM 1203 O THR A 84 3.426 15.577 1.548 1.00 14.04 O ATOM 1204 CB THR A 84 3.522 18.486 1.547 1.00 54.43 C ATOM 1205 OG1 THR A 84 3.492 19.839 1.046 1.00 43.41 O ATOM 1206 CG2 THR A 84 4.267 18.466 2.877 1.00 74.02 C ATOM 0 H THR A 84 2.736 17.079 -0.846 1.00 41.33 H new ATOM 0 HA THR A 84 5.239 17.988 0.379 1.00 63.40 H new ATOM 0 HB THR A 84 2.517 18.102 1.719 1.00 54.43 H new ATOM 0 HG1 THR A 84 3.048 20.420 1.699 1.00 43.41 H new ATOM 0 HG21 THR A 84 3.745 19.098 3.596 1.00 74.02 H new ATOM 0 HG22 THR A 84 4.309 17.445 3.255 1.00 74.02 H new ATOM 0 HG23 THR A 84 5.280 18.842 2.732 1.00 74.02 H new ATOM 1214 N VAL A 85 5.413 15.520 0.548 1.00 42.14 N ATOM 1215 CA VAL A 85 5.688 14.147 0.883 1.00 23.35 C ATOM 1216 C VAL A 85 6.702 14.130 2.015 1.00 64.10 C ATOM 1217 O VAL A 85 7.520 15.067 2.151 1.00 61.15 O ATOM 1218 CB VAL A 85 6.309 13.381 -0.335 1.00 64.13 C ATOM 1219 CG1 VAL A 85 6.375 11.878 -0.091 1.00 14.33 C ATOM 1220 CG2 VAL A 85 5.565 13.672 -1.612 1.00 50.24 C ATOM 0 H VAL A 85 6.136 15.959 -0.022 1.00 42.14 H new ATOM 0 HA VAL A 85 4.754 13.661 1.167 1.00 23.35 H new ATOM 0 HB VAL A 85 7.330 13.748 -0.443 1.00 64.13 H new ATOM 0 HG11 VAL A 85 6.812 11.387 -0.961 1.00 14.33 H new ATOM 0 HG12 VAL A 85 6.991 11.678 0.786 1.00 14.33 H new ATOM 0 HG13 VAL A 85 5.369 11.492 0.076 1.00 14.33 H new ATOM 0 HG21 VAL A 85 6.025 13.123 -2.434 1.00 50.24 H new ATOM 0 HG22 VAL A 85 4.525 13.363 -1.506 1.00 50.24 H new ATOM 0 HG23 VAL A 85 5.606 14.741 -1.822 1.00 50.24 H new ATOM 1230 N SER A 86 6.650 13.127 2.825 1.00 12.14 N ATOM 1231 CA SER A 86 7.627 12.942 3.838 1.00 45.23 C ATOM 1232 C SER A 86 8.737 12.042 3.282 1.00 75.15 C ATOM 1233 O SER A 86 8.476 11.175 2.445 1.00 31.24 O ATOM 1234 CB SER A 86 6.973 12.362 5.084 1.00 2.23 C ATOM 1235 OG SER A 86 5.978 13.252 5.556 1.00 20.31 O ATOM 0 H SER A 86 5.924 12.410 2.801 1.00 12.14 H new ATOM 0 HA SER A 86 8.074 13.892 4.130 1.00 45.23 H new ATOM 0 HB2 SER A 86 6.530 11.392 4.857 1.00 2.23 H new ATOM 0 HB3 SER A 86 7.723 12.196 5.857 1.00 2.23 H new ATOM 0 HG SER A 86 5.095 12.936 5.272 1.00 20.31 H new ATOM 1241 N ARG A 87 9.962 12.269 3.705 1.00 71.12 N ATOM 1242 CA ARG A 87 11.089 11.505 3.186 1.00 5.45 C ATOM 1243 C ARG A 87 11.195 10.132 3.844 1.00 31.22 C ATOM 1244 O ARG A 87 11.873 9.237 3.359 1.00 11.05 O ATOM 1245 CB ARG A 87 12.403 12.321 3.158 1.00 65.13 C ATOM 1246 CG ARG A 87 12.714 13.131 4.414 1.00 54.30 C ATOM 1247 CD ARG A 87 12.831 14.630 4.094 1.00 24.21 C ATOM 1248 NE ARG A 87 11.543 15.233 3.635 1.00 21.15 N ATOM 1249 CZ ARG A 87 11.341 15.865 2.447 1.00 54.14 C ATOM 1250 NH1 ARG A 87 12.358 16.152 1.647 1.00 52.51 N ATOM 1251 NH2 ARG A 87 10.119 16.221 2.082 1.00 32.23 N ATOM 0 H ARG A 87 10.208 12.971 4.403 1.00 71.12 H new ATOM 0 HA ARG A 87 10.890 11.297 2.135 1.00 5.45 H new ATOM 0 HB2 ARG A 87 13.230 11.634 2.978 1.00 65.13 H new ATOM 0 HB3 ARG A 87 12.365 13.004 2.309 1.00 65.13 H new ATOM 0 HG2 ARG A 87 11.929 12.975 5.154 1.00 54.30 H new ATOM 0 HG3 ARG A 87 13.645 12.777 4.857 1.00 54.30 H new ATOM 0 HD2 ARG A 87 13.177 15.159 4.982 1.00 24.21 H new ATOM 0 HD3 ARG A 87 13.588 14.773 3.323 1.00 24.21 H new ATOM 0 HE ARG A 87 10.746 15.165 4.267 1.00 21.15 H new ATOM 0 HH11 ARG A 87 13.308 15.899 1.919 1.00 52.51 H new ATOM 0 HH12 ARG A 87 12.191 16.626 0.759 1.00 52.51 H new ATOM 0 HH21 ARG A 87 9.326 16.022 2.692 1.00 32.23 H new ATOM 0 HH22 ARG A 87 9.971 16.695 1.191 1.00 32.23 H new ATOM 1265 N ARG A 88 10.539 10.005 4.956 1.00 65.32 N ATOM 1266 CA ARG A 88 10.286 8.741 5.590 1.00 12.31 C ATOM 1267 C ARG A 88 8.883 8.855 6.114 1.00 12.44 C ATOM 1268 O ARG A 88 8.652 9.455 7.156 1.00 71.13 O ATOM 1269 CB ARG A 88 11.268 8.446 6.734 1.00 4.00 C ATOM 1270 CG ARG A 88 11.044 7.102 7.420 1.00 43.21 C ATOM 1271 CD ARG A 88 11.981 6.935 8.603 1.00 41.40 C ATOM 1272 NE ARG A 88 11.721 5.701 9.363 1.00 72.32 N ATOM 1273 CZ ARG A 88 12.003 5.522 10.663 1.00 25.02 C ATOM 1274 NH1 ARG A 88 12.624 6.470 11.362 1.00 40.42 N ATOM 1275 NH2 ARG A 88 11.684 4.391 11.242 1.00 32.20 N ATOM 0 H ARG A 88 10.152 10.800 5.465 1.00 65.32 H new ATOM 0 HA ARG A 88 10.414 7.918 4.887 1.00 12.31 H new ATOM 0 HB2 ARG A 88 12.285 8.476 6.342 1.00 4.00 H new ATOM 0 HB3 ARG A 88 11.190 9.239 7.478 1.00 4.00 H new ATOM 0 HG2 ARG A 88 10.010 7.029 7.757 1.00 43.21 H new ATOM 0 HG3 ARG A 88 11.205 6.294 6.707 1.00 43.21 H new ATOM 0 HD2 ARG A 88 13.011 6.928 8.247 1.00 41.40 H new ATOM 0 HD3 ARG A 88 11.879 7.794 9.266 1.00 41.40 H new ATOM 0 HE ARG A 88 11.293 4.922 8.863 1.00 72.32 H new ATOM 0 HH11 ARG A 88 12.891 7.345 10.910 1.00 40.42 H new ATOM 0 HH12 ARG A 88 12.833 6.322 12.349 1.00 40.42 H new ATOM 0 HH21 ARG A 88 11.225 3.655 10.705 1.00 32.20 H new ATOM 0 HH22 ARG A 88 11.895 4.246 12.229 1.00 32.20 H new ATOM 1289 N HIS A 89 7.945 8.406 5.343 1.00 71.34 N ATOM 1290 CA HIS A 89 6.557 8.564 5.702 1.00 52.22 C ATOM 1291 C HIS A 89 6.046 7.356 6.482 1.00 32.22 C ATOM 1292 O HIS A 89 5.554 7.482 7.605 1.00 33.34 O ATOM 1293 CB HIS A 89 5.740 8.785 4.410 1.00 53.43 C ATOM 1294 CG HIS A 89 4.268 8.693 4.589 1.00 2.10 C ATOM 1295 ND1 HIS A 89 3.608 7.568 4.206 1.00 5.42 N ATOM 1296 CD2 HIS A 89 3.398 9.559 5.147 1.00 24.41 C ATOM 1297 CE1 HIS A 89 2.369 7.752 4.540 1.00 15.25 C ATOM 1298 NE2 HIS A 89 2.180 8.945 5.112 1.00 63.41 N ATOM 0 H HIS A 89 8.107 7.925 4.458 1.00 71.34 H new ATOM 0 HA HIS A 89 6.445 9.428 6.357 1.00 52.22 H new ATOM 0 HB2 HIS A 89 5.983 9.767 4.005 1.00 53.43 H new ATOM 0 HB3 HIS A 89 6.050 8.049 3.669 1.00 53.43 H new ATOM 0 HD1 HIS A 89 4.006 6.747 3.749 1.00 5.42 H new ATOM 0 HD2 HIS A 89 3.620 10.540 5.542 1.00 24.41 H new ATOM 0 HE1 HIS A 89 1.584 7.028 4.376 1.00 15.25 H new ATOM 1306 N ALA A 90 6.227 6.205 5.931 1.00 74.43 N ATOM 1307 CA ALA A 90 5.751 5.015 6.552 1.00 24.02 C ATOM 1308 C ALA A 90 6.598 3.877 6.117 1.00 45.01 C ATOM 1309 O ALA A 90 7.257 3.941 5.067 1.00 44.32 O ATOM 1310 CB ALA A 90 4.295 4.753 6.158 1.00 42.21 C ATOM 0 H ALA A 90 6.706 6.061 5.042 1.00 74.43 H new ATOM 0 HA ALA A 90 5.801 5.128 7.635 1.00 24.02 H new ATOM 0 HB1 ALA A 90 3.946 3.840 6.641 1.00 42.21 H new ATOM 0 HB2 ALA A 90 3.675 5.591 6.476 1.00 42.21 H new ATOM 0 HB3 ALA A 90 4.225 4.641 5.076 1.00 42.21 H new ATOM 1316 N GLU A 91 6.629 2.875 6.902 1.00 32.00 N ATOM 1317 CA GLU A 91 7.335 1.689 6.558 1.00 4.12 C ATOM 1318 C GLU A 91 6.469 0.490 6.832 1.00 12.24 C ATOM 1319 O GLU A 91 5.791 0.418 7.850 1.00 3.33 O ATOM 1320 CB GLU A 91 8.706 1.611 7.258 1.00 3.43 C ATOM 1321 CG GLU A 91 8.659 1.715 8.774 1.00 41.15 C ATOM 1322 CD GLU A 91 10.033 1.748 9.388 1.00 40.24 C ATOM 1323 OE1 GLU A 91 10.638 2.824 9.449 1.00 70.01 O ATOM 1324 OE2 GLU A 91 10.529 0.697 9.835 1.00 25.11 O ATOM 0 H GLU A 91 6.165 2.845 7.810 1.00 32.00 H new ATOM 0 HA GLU A 91 7.557 1.706 5.491 1.00 4.12 H new ATOM 0 HB2 GLU A 91 9.182 0.668 6.988 1.00 3.43 H new ATOM 0 HB3 GLU A 91 9.340 2.410 6.873 1.00 3.43 H new ATOM 0 HG2 GLU A 91 8.115 2.616 9.057 1.00 41.15 H new ATOM 0 HG3 GLU A 91 8.104 0.868 9.177 1.00 41.15 H new ATOM 1331 N PHE A 92 6.447 -0.409 5.910 1.00 31.43 N ATOM 1332 CA PHE A 92 5.684 -1.605 6.035 1.00 54.51 C ATOM 1333 C PHE A 92 6.659 -2.704 6.329 1.00 12.21 C ATOM 1334 O PHE A 92 7.570 -2.967 5.535 1.00 64.51 O ATOM 1335 CB PHE A 92 4.940 -1.922 4.727 1.00 23.11 C ATOM 1336 CG PHE A 92 4.074 -0.806 4.201 1.00 12.45 C ATOM 1337 CD1 PHE A 92 2.865 -0.514 4.793 1.00 71.22 C ATOM 1338 CD2 PHE A 92 4.477 -0.049 3.109 1.00 74.01 C ATOM 1339 CE1 PHE A 92 2.066 0.506 4.314 1.00 71.12 C ATOM 1340 CE2 PHE A 92 3.683 0.970 2.625 1.00 74.02 C ATOM 1341 CZ PHE A 92 2.476 1.249 3.228 1.00 13.42 C ATOM 0 H PHE A 92 6.966 -0.334 5.035 1.00 31.43 H new ATOM 0 HA PHE A 92 4.938 -1.499 6.823 1.00 54.51 H new ATOM 0 HB2 PHE A 92 5.673 -2.184 3.964 1.00 23.11 H new ATOM 0 HB3 PHE A 92 4.317 -2.802 4.885 1.00 23.11 H new ATOM 0 HD1 PHE A 92 2.537 -1.091 5.645 1.00 71.22 H new ATOM 0 HD2 PHE A 92 5.423 -0.260 2.633 1.00 74.01 H new ATOM 0 HE1 PHE A 92 1.121 0.721 4.790 1.00 71.12 H new ATOM 0 HE2 PHE A 92 4.008 1.549 1.773 1.00 74.02 H new ATOM 0 HZ PHE A 92 1.853 2.047 2.851 1.00 13.42 H new ATOM 1351 N ARG A 93 6.525 -3.294 7.462 1.00 21.51 N ATOM 1352 CA ARG A 93 7.429 -4.328 7.870 1.00 33.53 C ATOM 1353 C ARG A 93 6.770 -5.659 7.715 1.00 1.45 C ATOM 1354 O ARG A 93 5.627 -5.848 8.120 1.00 31.55 O ATOM 1355 CB ARG A 93 7.882 -4.130 9.308 1.00 54.11 C ATOM 1356 CG ARG A 93 8.610 -2.831 9.554 1.00 12.24 C ATOM 1357 CD ARG A 93 8.970 -2.689 11.010 1.00 41.33 C ATOM 1358 NE ARG A 93 9.705 -1.458 11.274 1.00 52.43 N ATOM 1359 CZ ARG A 93 10.221 -1.106 12.447 1.00 64.14 C ATOM 1360 NH1 ARG A 93 10.070 -1.875 13.522 1.00 21.03 N ATOM 1361 NH2 ARG A 93 10.870 0.027 12.533 1.00 43.22 N ATOM 0 H ARG A 93 5.790 -3.080 8.137 1.00 21.51 H new ATOM 0 HA ARG A 93 8.313 -4.283 7.234 1.00 33.53 H new ATOM 0 HB2 ARG A 93 7.010 -4.174 9.961 1.00 54.11 H new ATOM 0 HB3 ARG A 93 8.533 -4.957 9.589 1.00 54.11 H new ATOM 0 HG2 ARG A 93 9.514 -2.794 8.946 1.00 12.24 H new ATOM 0 HG3 ARG A 93 7.984 -1.994 9.246 1.00 12.24 H new ATOM 0 HD2 ARG A 93 8.061 -2.704 11.611 1.00 41.33 H new ATOM 0 HD3 ARG A 93 9.571 -3.544 11.320 1.00 41.33 H new ATOM 0 HE ARG A 93 9.834 -0.814 10.494 1.00 52.43 H new ATOM 0 HH11 ARG A 93 9.551 -2.751 13.454 1.00 21.03 H new ATOM 0 HH12 ARG A 93 10.473 -1.589 14.414 1.00 21.03 H new ATOM 0 HH21 ARG A 93 10.972 0.620 11.710 1.00 43.22 H new ATOM 0 HH22 ARG A 93 11.274 0.317 13.423 1.00 43.22 H new ATOM 1375 N ILE A 94 7.455 -6.554 7.093 1.00 41.34 N ATOM 1376 CA ILE A 94 6.962 -7.875 6.903 1.00 32.33 C ATOM 1377 C ILE A 94 7.860 -8.787 7.692 1.00 2.52 C ATOM 1378 O ILE A 94 9.054 -8.904 7.397 1.00 32.43 O ATOM 1379 CB ILE A 94 6.938 -8.317 5.390 1.00 32.44 C ATOM 1380 CG1 ILE A 94 5.969 -7.459 4.539 1.00 70.54 C ATOM 1381 CG2 ILE A 94 6.555 -9.789 5.259 1.00 2.41 C ATOM 1382 CD1 ILE A 94 6.395 -6.025 4.262 1.00 50.24 C ATOM 0 H ILE A 94 8.381 -6.389 6.698 1.00 41.34 H new ATOM 0 HA ILE A 94 5.926 -7.921 7.239 1.00 32.33 H new ATOM 0 HB ILE A 94 7.948 -8.165 5.009 1.00 32.44 H new ATOM 0 HG12 ILE A 94 5.819 -7.961 3.583 1.00 70.54 H new ATOM 0 HG13 ILE A 94 5.002 -7.436 5.042 1.00 70.54 H new ATOM 0 HG21 ILE A 94 6.545 -10.070 4.206 1.00 2.41 H new ATOM 0 HG22 ILE A 94 7.281 -10.403 5.792 1.00 2.41 H new ATOM 0 HG23 ILE A 94 5.564 -9.947 5.686 1.00 2.41 H new ATOM 0 HD11 ILE A 94 5.635 -5.530 3.658 1.00 50.24 H new ATOM 0 HD12 ILE A 94 6.513 -5.492 5.205 1.00 50.24 H new ATOM 0 HD13 ILE A 94 7.343 -6.025 3.724 1.00 50.24 H new ATOM 1394 N ASN A 95 7.324 -9.379 8.709 1.00 0.12 N ATOM 1395 CA ASN A 95 8.106 -10.221 9.575 1.00 74.34 C ATOM 1396 C ASN A 95 7.320 -11.457 9.931 1.00 12.44 C ATOM 1397 O ASN A 95 6.190 -11.355 10.431 1.00 63.13 O ATOM 1398 CB ASN A 95 8.510 -9.450 10.840 1.00 34.41 C ATOM 1399 CG ASN A 95 9.471 -10.216 11.736 1.00 30.42 C ATOM 1400 OD1 ASN A 95 9.063 -10.949 12.634 1.00 25.40 O ATOM 1401 ND2 ASN A 95 10.751 -10.042 11.505 1.00 51.53 N ATOM 0 H ASN A 95 6.341 -9.298 8.968 1.00 0.12 H new ATOM 0 HA ASN A 95 9.015 -10.524 9.056 1.00 74.34 H new ATOM 0 HB2 ASN A 95 8.971 -8.506 10.549 1.00 34.41 H new ATOM 0 HB3 ASN A 95 7.613 -9.205 11.408 1.00 34.41 H new ATOM 0 HD21 ASN A 95 11.443 -10.523 12.080 1.00 51.53 H new ATOM 0 HD22 ASN A 95 11.054 -9.426 10.751 1.00 51.53 H new ATOM 1408 N GLU A 96 7.899 -12.606 9.622 1.00 22.51 N ATOM 1409 CA GLU A 96 7.326 -13.929 9.886 1.00 61.41 C ATOM 1410 C GLU A 96 5.947 -14.111 9.268 1.00 3.01 C ATOM 1411 O GLU A 96 5.080 -14.795 9.825 1.00 14.25 O ATOM 1412 CB GLU A 96 7.327 -14.242 11.383 1.00 60.45 C ATOM 1413 CG GLU A 96 8.727 -14.336 11.960 1.00 64.33 C ATOM 1414 CD GLU A 96 9.586 -15.319 11.198 1.00 52.04 C ATOM 1415 OE1 GLU A 96 9.431 -16.530 11.395 1.00 14.25 O ATOM 1416 OE2 GLU A 96 10.446 -14.890 10.381 1.00 63.41 O ATOM 0 H GLU A 96 8.810 -12.652 9.166 1.00 22.51 H new ATOM 0 HA GLU A 96 7.972 -14.655 9.393 1.00 61.41 H new ATOM 0 HB2 GLU A 96 6.771 -13.468 11.912 1.00 60.45 H new ATOM 0 HB3 GLU A 96 6.804 -15.183 11.554 1.00 60.45 H new ATOM 0 HG2 GLU A 96 9.195 -13.352 11.939 1.00 64.33 H new ATOM 0 HG3 GLU A 96 8.669 -14.639 13.006 1.00 64.33 H new ATOM 1423 N GLY A 97 5.786 -13.560 8.084 1.00 44.41 N ATOM 1424 CA GLY A 97 4.550 -13.691 7.349 1.00 45.23 C ATOM 1425 C GLY A 97 3.467 -12.749 7.826 1.00 22.55 C ATOM 1426 O GLY A 97 2.296 -12.939 7.513 1.00 2.53 O ATOM 0 H GLY A 97 6.503 -13.013 7.608 1.00 44.41 H new ATOM 0 HA2 GLY A 97 4.743 -13.506 6.292 1.00 45.23 H new ATOM 0 HA3 GLY A 97 4.192 -14.717 7.433 1.00 45.23 H new ATOM 1430 N GLU A 98 3.839 -11.772 8.617 1.00 31.45 N ATOM 1431 CA GLU A 98 2.900 -10.788 9.088 1.00 43.34 C ATOM 1432 C GLU A 98 3.300 -9.440 8.539 1.00 64.12 C ATOM 1433 O GLU A 98 4.492 -9.141 8.435 1.00 42.25 O ATOM 1434 CB GLU A 98 2.853 -10.767 10.603 1.00 54.35 C ATOM 1435 CG GLU A 98 2.659 -12.143 11.198 1.00 5.23 C ATOM 1436 CD GLU A 98 2.402 -12.119 12.669 1.00 22.24 C ATOM 1437 OE1 GLU A 98 3.306 -11.732 13.436 1.00 55.31 O ATOM 1438 OE2 GLU A 98 1.291 -12.511 13.085 1.00 20.12 O ATOM 0 H GLU A 98 4.794 -11.638 8.949 1.00 31.45 H new ATOM 0 HA GLU A 98 1.899 -11.040 8.739 1.00 43.34 H new ATOM 0 HB2 GLU A 98 3.779 -10.337 10.986 1.00 54.35 H new ATOM 0 HB3 GLU A 98 2.041 -10.117 10.929 1.00 54.35 H new ATOM 0 HG2 GLU A 98 1.824 -12.633 10.698 1.00 5.23 H new ATOM 0 HG3 GLU A 98 3.546 -12.745 11.001 1.00 5.23 H new ATOM 1445 N PHE A 99 2.326 -8.648 8.187 1.00 12.45 N ATOM 1446 CA PHE A 99 2.554 -7.386 7.521 1.00 4.34 C ATOM 1447 C PHE A 99 2.085 -6.243 8.436 1.00 33.32 C ATOM 1448 O PHE A 99 0.895 -6.169 8.776 1.00 34.13 O ATOM 1449 CB PHE A 99 1.724 -7.355 6.212 1.00 70.40 C ATOM 1450 CG PHE A 99 1.885 -8.554 5.296 1.00 50.13 C ATOM 1451 CD1 PHE A 99 1.152 -9.716 5.512 1.00 51.12 C ATOM 1452 CD2 PHE A 99 2.749 -8.519 4.226 1.00 33.21 C ATOM 1453 CE1 PHE A 99 1.291 -10.807 4.679 1.00 61.03 C ATOM 1454 CE2 PHE A 99 2.893 -9.610 3.387 1.00 31.31 C ATOM 1455 CZ PHE A 99 2.164 -10.755 3.619 1.00 32.31 C ATOM 0 H PHE A 99 1.342 -8.857 8.353 1.00 12.45 H new ATOM 0 HA PHE A 99 3.614 -7.269 7.296 1.00 4.34 H new ATOM 0 HB2 PHE A 99 0.670 -7.262 6.475 1.00 70.40 H new ATOM 0 HB3 PHE A 99 1.994 -6.458 5.655 1.00 70.40 H new ATOM 0 HD1 PHE A 99 0.464 -9.765 6.343 1.00 51.12 H new ATOM 0 HD2 PHE A 99 3.325 -7.625 4.038 1.00 33.21 H new ATOM 0 HE1 PHE A 99 0.714 -11.702 4.860 1.00 61.03 H new ATOM 0 HE2 PHE A 99 3.576 -9.564 2.552 1.00 31.31 H new ATOM 0 HZ PHE A 99 2.278 -11.610 2.969 1.00 32.31 H new ATOM 1465 N GLU A 100 2.984 -5.375 8.838 1.00 73.44 N ATOM 1466 CA GLU A 100 2.627 -4.259 9.707 1.00 24.43 C ATOM 1467 C GLU A 100 2.982 -2.917 9.069 1.00 72.12 C ATOM 1468 O GLU A 100 3.961 -2.802 8.335 1.00 15.10 O ATOM 1469 CB GLU A 100 3.285 -4.392 11.097 1.00 25.53 C ATOM 1470 CG GLU A 100 4.807 -4.437 11.070 1.00 1.22 C ATOM 1471 CD GLU A 100 5.428 -4.547 12.442 1.00 72.44 C ATOM 1472 OE1 GLU A 100 5.415 -5.641 13.029 1.00 63.12 O ATOM 1473 OE2 GLU A 100 5.967 -3.551 12.952 1.00 10.40 O ATOM 0 H GLU A 100 3.970 -5.413 8.581 1.00 73.44 H new ATOM 0 HA GLU A 100 1.546 -4.292 9.842 1.00 24.43 H new ATOM 0 HB2 GLU A 100 2.969 -3.553 11.717 1.00 25.53 H new ATOM 0 HB3 GLU A 100 2.915 -5.299 11.576 1.00 25.53 H new ATOM 0 HG2 GLU A 100 5.127 -5.285 10.465 1.00 1.22 H new ATOM 0 HG3 GLU A 100 5.181 -3.538 10.581 1.00 1.22 H new ATOM 1480 N VAL A 101 2.163 -1.930 9.326 1.00 23.15 N ATOM 1481 CA VAL A 101 2.378 -0.578 8.857 1.00 11.13 C ATOM 1482 C VAL A 101 2.877 0.225 10.034 1.00 10.43 C ATOM 1483 O VAL A 101 2.229 0.243 11.081 1.00 73.33 O ATOM 1484 CB VAL A 101 1.046 0.108 8.414 1.00 1.14 C ATOM 1485 CG1 VAL A 101 1.298 1.480 7.794 1.00 12.04 C ATOM 1486 CG2 VAL A 101 0.226 -0.759 7.488 1.00 33.20 C ATOM 0 H VAL A 101 1.312 -2.041 9.877 1.00 23.15 H new ATOM 0 HA VAL A 101 3.068 -0.616 8.014 1.00 11.13 H new ATOM 0 HB VAL A 101 0.460 0.249 9.322 1.00 1.14 H new ATOM 0 HG11 VAL A 101 0.348 1.926 7.498 1.00 12.04 H new ATOM 0 HG12 VAL A 101 1.790 2.124 8.523 1.00 12.04 H new ATOM 0 HG13 VAL A 101 1.936 1.371 6.917 1.00 12.04 H new ATOM 0 HG21 VAL A 101 -0.688 -0.233 7.212 1.00 33.20 H new ATOM 0 HG22 VAL A 101 0.803 -0.980 6.590 1.00 33.20 H new ATOM 0 HG23 VAL A 101 -0.030 -1.691 7.993 1.00 33.20 H new ATOM 1496 N VAL A 102 3.997 0.851 9.889 1.00 0.23 N ATOM 1497 CA VAL A 102 4.504 1.727 10.906 1.00 50.45 C ATOM 1498 C VAL A 102 4.540 3.129 10.314 1.00 53.23 C ATOM 1499 O VAL A 102 5.169 3.346 9.273 1.00 1.54 O ATOM 1500 CB VAL A 102 5.938 1.327 11.360 1.00 60.31 C ATOM 1501 CG1 VAL A 102 6.421 2.209 12.506 1.00 2.05 C ATOM 1502 CG2 VAL A 102 6.002 -0.144 11.747 1.00 42.13 C ATOM 0 H VAL A 102 4.591 0.773 9.064 1.00 0.23 H new ATOM 0 HA VAL A 102 3.860 1.669 11.783 1.00 50.45 H new ATOM 0 HB VAL A 102 6.606 1.482 10.512 1.00 60.31 H new ATOM 0 HG11 VAL A 102 7.425 1.905 12.801 1.00 2.05 H new ATOM 0 HG12 VAL A 102 6.437 3.250 12.182 1.00 2.05 H new ATOM 0 HG13 VAL A 102 5.746 2.104 13.355 1.00 2.05 H new ATOM 0 HG21 VAL A 102 7.016 -0.394 12.060 1.00 42.13 H new ATOM 0 HG22 VAL A 102 5.311 -0.334 12.569 1.00 42.13 H new ATOM 0 HG23 VAL A 102 5.725 -0.758 10.890 1.00 42.13 H new ATOM 1512 N ASP A 103 3.873 4.053 10.946 1.00 74.24 N ATOM 1513 CA ASP A 103 3.788 5.423 10.446 1.00 42.00 C ATOM 1514 C ASP A 103 4.668 6.358 11.228 1.00 44.12 C ATOM 1515 O ASP A 103 4.717 6.296 12.465 1.00 45.31 O ATOM 1516 CB ASP A 103 2.338 5.940 10.484 1.00 71.13 C ATOM 1517 CG ASP A 103 2.240 7.450 10.279 1.00 70.23 C ATOM 1518 OD1 ASP A 103 2.651 7.940 9.220 1.00 22.43 O ATOM 1519 OD2 ASP A 103 1.720 8.164 11.185 1.00 43.35 O ATOM 0 H ASP A 103 3.370 3.893 11.819 1.00 74.24 H new ATOM 0 HA ASP A 103 4.135 5.400 9.413 1.00 42.00 H new ATOM 0 HB2 ASP A 103 1.757 5.435 9.712 1.00 71.13 H new ATOM 0 HB3 ASP A 103 1.889 5.679 11.442 1.00 71.13 H new ATOM 1524 N VAL A 104 5.390 7.188 10.513 1.00 1.34 N ATOM 1525 CA VAL A 104 6.183 8.240 11.118 1.00 62.23 C ATOM 1526 C VAL A 104 5.876 9.588 10.452 1.00 55.32 C ATOM 1527 O VAL A 104 6.404 10.636 10.853 1.00 41.21 O ATOM 1528 CB VAL A 104 7.718 7.949 11.089 1.00 14.23 C ATOM 1529 CG1 VAL A 104 8.069 6.784 11.992 1.00 31.53 C ATOM 1530 CG2 VAL A 104 8.191 7.659 9.685 1.00 62.22 C ATOM 0 H VAL A 104 5.446 7.156 9.495 1.00 1.34 H new ATOM 0 HA VAL A 104 5.899 8.280 12.169 1.00 62.23 H new ATOM 0 HB VAL A 104 8.223 8.844 11.453 1.00 14.23 H new ATOM 0 HG11 VAL A 104 9.143 6.604 11.952 1.00 31.53 H new ATOM 0 HG12 VAL A 104 7.778 7.017 13.016 1.00 31.53 H new ATOM 0 HG13 VAL A 104 7.539 5.892 11.658 1.00 31.53 H new ATOM 0 HG21 VAL A 104 9.263 7.460 9.696 1.00 62.22 H new ATOM 0 HG22 VAL A 104 7.664 6.787 9.296 1.00 62.22 H new ATOM 0 HG23 VAL A 104 7.988 8.520 9.048 1.00 62.22 H new ATOM 1540 N GLY A 105 4.973 9.559 9.491 1.00 44.25 N ATOM 1541 CA GLY A 105 4.607 10.732 8.750 1.00 22.53 C ATOM 1542 C GLY A 105 3.185 11.109 9.049 1.00 44.42 C ATOM 1543 O GLY A 105 2.338 11.222 8.148 1.00 14.32 O ATOM 0 H GLY A 105 4.476 8.715 9.208 1.00 44.25 H new ATOM 0 HA2 GLY A 105 5.272 11.556 9.008 1.00 22.53 H new ATOM 0 HA3 GLY A 105 4.726 10.549 7.682 1.00 22.53 H new ATOM 1547 N SER A 106 2.930 11.355 10.307 1.00 62.14 N ATOM 1548 CA SER A 106 1.616 11.648 10.809 1.00 60.51 C ATOM 1549 C SER A 106 1.119 13.034 10.353 1.00 31.34 C ATOM 1550 O SER A 106 -0.045 13.376 10.548 1.00 72.32 O ATOM 1551 CB SER A 106 1.638 11.528 12.320 1.00 52.40 C ATOM 1552 OG SER A 106 2.221 10.280 12.688 1.00 34.44 O ATOM 0 H SER A 106 3.651 11.357 11.029 1.00 62.14 H new ATOM 0 HA SER A 106 0.908 10.928 10.398 1.00 60.51 H new ATOM 0 HB2 SER A 106 2.208 12.350 12.753 1.00 52.40 H new ATOM 0 HB3 SER A 106 0.625 11.600 12.716 1.00 52.40 H new ATOM 0 HG SER A 106 2.113 9.639 11.954 1.00 34.44 H new ATOM 1558 N LEU A 107 2.002 13.815 9.735 1.00 5.01 N ATOM 1559 CA LEU A 107 1.610 15.089 9.157 1.00 13.10 C ATOM 1560 C LEU A 107 0.826 14.857 7.867 1.00 24.44 C ATOM 1561 O LEU A 107 0.037 15.695 7.450 1.00 71.14 O ATOM 1562 CB LEU A 107 2.808 16.098 8.980 1.00 30.21 C ATOM 1563 CG LEU A 107 3.966 15.818 7.966 1.00 5.11 C ATOM 1564 CD1 LEU A 107 4.660 14.491 8.190 1.00 3.22 C ATOM 1565 CD2 LEU A 107 3.531 15.998 6.511 1.00 63.53 C ATOM 0 H LEU A 107 2.990 13.585 9.624 1.00 5.01 H new ATOM 0 HA LEU A 107 0.951 15.585 9.870 1.00 13.10 H new ATOM 0 HB2 LEU A 107 2.375 17.061 8.709 1.00 30.21 H new ATOM 0 HB3 LEU A 107 3.268 16.220 9.961 1.00 30.21 H new ATOM 0 HG LEU A 107 4.714 16.584 8.171 1.00 5.11 H new ATOM 0 HD11 LEU A 107 5.451 14.365 7.451 1.00 3.22 H new ATOM 0 HD12 LEU A 107 5.092 14.471 9.191 1.00 3.22 H new ATOM 0 HD13 LEU A 107 3.937 13.681 8.090 1.00 3.22 H new ATOM 0 HD21 LEU A 107 4.374 15.791 5.851 1.00 63.53 H new ATOM 0 HD22 LEU A 107 2.717 15.309 6.287 1.00 63.53 H new ATOM 0 HD23 LEU A 107 3.192 17.022 6.357 1.00 63.53 H new ATOM 1577 N ASN A 108 1.053 13.696 7.244 1.00 32.13 N ATOM 1578 CA ASN A 108 0.274 13.301 6.075 1.00 12.43 C ATOM 1579 C ASN A 108 -0.965 12.586 6.566 1.00 51.32 C ATOM 1580 O ASN A 108 -1.938 12.431 5.843 1.00 44.25 O ATOM 1581 CB ASN A 108 1.058 12.378 5.105 1.00 51.43 C ATOM 1582 CG ASN A 108 2.250 13.043 4.422 1.00 22.40 C ATOM 1583 OD1 ASN A 108 3.376 12.991 4.915 1.00 50.00 O ATOM 1584 ND2 ASN A 108 2.020 13.646 3.277 1.00 75.55 N ATOM 0 H ASN A 108 1.763 13.022 7.529 1.00 32.13 H new ATOM 0 HA ASN A 108 0.026 14.200 5.510 1.00 12.43 H new ATOM 0 HB2 ASN A 108 1.411 11.508 5.658 1.00 51.43 H new ATOM 0 HB3 ASN A 108 0.374 12.013 4.339 1.00 51.43 H new ATOM 0 HD21 ASN A 108 2.787 14.088 2.770 1.00 75.55 H new ATOM 0 HD22 ASN A 108 1.075 13.672 2.895 1.00 75.55 H new ATOM 1591 N GLY A 109 -0.896 12.153 7.817 1.00 4.22 N ATOM 1592 CA GLY A 109 -2.011 11.525 8.480 1.00 22.14 C ATOM 1593 C GLY A 109 -2.291 10.141 7.986 1.00 41.32 C ATOM 1594 O GLY A 109 -3.393 9.862 7.533 1.00 45.45 O ATOM 0 H GLY A 109 -0.059 12.231 8.395 1.00 4.22 H new ATOM 0 HA2 GLY A 109 -1.813 11.488 9.551 1.00 22.14 H new ATOM 0 HA3 GLY A 109 -2.900 12.140 8.341 1.00 22.14 H new ATOM 1598 N THR A 110 -1.293 9.287 8.045 1.00 13.11 N ATOM 1599 CA THR A 110 -1.447 7.918 7.642 1.00 40.12 C ATOM 1600 C THR A 110 -2.463 7.218 8.553 1.00 50.43 C ATOM 1601 O THR A 110 -2.342 7.251 9.795 1.00 74.32 O ATOM 1602 CB THR A 110 -0.106 7.236 7.802 1.00 10.11 C ATOM 1603 OG1 THR A 110 0.901 8.130 7.323 1.00 34.43 O ATOM 1604 CG2 THR A 110 -0.049 5.927 7.019 1.00 63.44 C ATOM 0 H THR A 110 -0.357 9.527 8.373 1.00 13.11 H new ATOM 0 HA THR A 110 -1.795 7.869 6.610 1.00 40.12 H new ATOM 0 HB THR A 110 0.053 6.995 8.853 1.00 10.11 H new ATOM 0 HG1 THR A 110 0.794 8.256 6.357 1.00 34.43 H new ATOM 0 HG21 THR A 110 0.928 5.463 7.156 1.00 63.44 H new ATOM 0 HG22 THR A 110 -0.825 5.252 7.381 1.00 63.44 H new ATOM 0 HG23 THR A 110 -0.209 6.129 5.960 1.00 63.44 H new ATOM 1612 N TYR A 111 -3.420 6.581 7.954 1.00 61.53 N ATOM 1613 CA TYR A 111 -4.448 5.882 8.676 1.00 20.33 C ATOM 1614 C TYR A 111 -4.500 4.448 8.237 1.00 34.24 C ATOM 1615 O TYR A 111 -4.376 4.171 7.062 1.00 42.55 O ATOM 1616 CB TYR A 111 -5.830 6.509 8.431 1.00 44.25 C ATOM 1617 CG TYR A 111 -6.076 7.891 9.011 1.00 23.43 C ATOM 1618 CD1 TYR A 111 -5.270 8.432 10.002 1.00 55.34 C ATOM 1619 CD2 TYR A 111 -7.163 8.627 8.595 1.00 21.33 C ATOM 1620 CE1 TYR A 111 -5.543 9.664 10.555 1.00 3.21 C ATOM 1621 CE2 TYR A 111 -7.435 9.861 9.136 1.00 72.43 C ATOM 1622 CZ TYR A 111 -6.631 10.372 10.116 1.00 34.33 C ATOM 1623 OH TYR A 111 -6.929 11.594 10.676 1.00 0.31 O ATOM 0 H TYR A 111 -3.515 6.528 6.940 1.00 61.53 H new ATOM 0 HA TYR A 111 -4.205 5.950 9.736 1.00 20.33 H new ATOM 0 HB2 TYR A 111 -5.992 6.560 7.354 1.00 44.25 H new ATOM 0 HB3 TYR A 111 -6.584 5.834 8.835 1.00 44.25 H new ATOM 0 HD1 TYR A 111 -4.411 7.876 10.347 1.00 55.34 H new ATOM 0 HD2 TYR A 111 -7.813 8.228 7.830 1.00 21.33 H new ATOM 0 HE1 TYR A 111 -4.905 10.068 11.327 1.00 3.21 H new ATOM 0 HE2 TYR A 111 -8.285 10.428 8.786 1.00 72.43 H new ATOM 0 HH TYR A 111 -6.103 12.026 10.978 1.00 0.31 H new ATOM 1633 N VAL A 112 -4.691 3.555 9.175 1.00 61.15 N ATOM 1634 CA VAL A 112 -4.835 2.136 8.879 1.00 33.22 C ATOM 1635 C VAL A 112 -6.261 1.762 9.260 1.00 30.32 C ATOM 1636 O VAL A 112 -6.667 1.956 10.422 1.00 14.33 O ATOM 1637 CB VAL A 112 -3.821 1.265 9.677 1.00 35.23 C ATOM 1638 CG1 VAL A 112 -3.948 -0.205 9.298 1.00 34.33 C ATOM 1639 CG2 VAL A 112 -2.392 1.750 9.454 1.00 34.33 C ATOM 0 H VAL A 112 -4.752 3.782 10.167 1.00 61.15 H new ATOM 0 HA VAL A 112 -4.632 1.951 7.824 1.00 33.22 H new ATOM 0 HB VAL A 112 -4.057 1.367 10.736 1.00 35.23 H new ATOM 0 HG11 VAL A 112 -3.229 -0.792 9.870 1.00 34.33 H new ATOM 0 HG12 VAL A 112 -4.957 -0.552 9.520 1.00 34.33 H new ATOM 0 HG13 VAL A 112 -3.749 -0.325 8.233 1.00 34.33 H new ATOM 0 HG21 VAL A 112 -1.703 1.125 10.022 1.00 34.33 H new ATOM 0 HG22 VAL A 112 -2.148 1.688 8.393 1.00 34.33 H new ATOM 0 HG23 VAL A 112 -2.303 2.784 9.787 1.00 34.33 H new ATOM 1649 N ASN A 113 -7.007 1.257 8.292 1.00 22.24 N ATOM 1650 CA ASN A 113 -8.465 1.030 8.375 1.00 41.21 C ATOM 1651 C ASN A 113 -9.132 2.347 8.752 1.00 31.15 C ATOM 1652 O ASN A 113 -10.093 2.401 9.532 1.00 40.34 O ATOM 1653 CB ASN A 113 -8.866 -0.093 9.367 1.00 3.20 C ATOM 1654 CG ASN A 113 -10.282 -0.657 9.070 1.00 31.13 C ATOM 1655 OD1 ASN A 113 -11.162 0.024 8.521 1.00 34.21 O ATOM 1656 ND2 ASN A 113 -10.511 -1.899 9.422 1.00 33.44 N ATOM 0 H ASN A 113 -6.615 0.980 7.392 1.00 22.24 H new ATOM 0 HA ASN A 113 -8.806 0.685 7.399 1.00 41.21 H new ATOM 0 HB2 ASN A 113 -8.136 -0.901 9.314 1.00 3.20 H new ATOM 0 HB3 ASN A 113 -8.837 0.296 10.385 1.00 3.20 H new ATOM 0 HD21 ASN A 113 -11.424 -2.319 9.245 1.00 33.44 H new ATOM 0 HD22 ASN A 113 -9.777 -2.445 9.872 1.00 33.44 H new ATOM 1663 N ARG A 114 -8.590 3.427 8.157 1.00 32.12 N ATOM 1664 CA ARG A 114 -9.092 4.808 8.314 1.00 62.45 C ATOM 1665 C ARG A 114 -8.990 5.286 9.784 1.00 25.34 C ATOM 1666 O ARG A 114 -9.669 6.226 10.188 1.00 10.32 O ATOM 1667 CB ARG A 114 -10.538 4.877 7.839 1.00 54.11 C ATOM 1668 CG ARG A 114 -10.781 4.241 6.471 1.00 45.32 C ATOM 1669 CD ARG A 114 -12.260 4.023 6.252 1.00 53.43 C ATOM 1670 NE ARG A 114 -12.856 3.285 7.384 1.00 14.12 N ATOM 1671 CZ ARG A 114 -13.740 3.814 8.250 1.00 40.55 C ATOM 1672 NH1 ARG A 114 -14.162 5.076 8.094 1.00 64.55 N ATOM 1673 NH2 ARG A 114 -14.175 3.092 9.275 1.00 70.02 N ATOM 0 H ARG A 114 -7.778 3.365 7.543 1.00 32.12 H new ATOM 0 HA ARG A 114 -8.472 5.470 7.709 1.00 62.45 H new ATOM 0 HB2 ARG A 114 -11.174 4.384 8.574 1.00 54.11 H new ATOM 0 HB3 ARG A 114 -10.846 5.922 7.801 1.00 54.11 H new ATOM 0 HG2 ARG A 114 -10.381 4.884 5.687 1.00 45.32 H new ATOM 0 HG3 ARG A 114 -10.252 3.290 6.405 1.00 45.32 H new ATOM 0 HD2 ARG A 114 -12.760 4.984 6.135 1.00 53.43 H new ATOM 0 HD3 ARG A 114 -12.417 3.468 5.327 1.00 53.43 H new ATOM 0 HE ARG A 114 -12.580 2.312 7.518 1.00 14.12 H new ATOM 0 HH11 ARG A 114 -13.813 5.638 7.318 1.00 64.55 H new ATOM 0 HH12 ARG A 114 -14.832 5.475 8.752 1.00 64.55 H new ATOM 0 HH21 ARG A 114 -13.839 2.138 9.406 1.00 70.02 H new ATOM 0 HH22 ARG A 114 -14.845 3.491 9.932 1.00 70.02 H new ATOM 1687 N GLU A 115 -8.145 4.637 10.554 1.00 4.23 N ATOM 1688 CA GLU A 115 -7.910 4.992 11.931 1.00 44.32 C ATOM 1689 C GLU A 115 -6.504 5.542 12.094 1.00 54.42 C ATOM 1690 O GLU A 115 -5.554 4.993 11.505 1.00 44.02 O ATOM 1691 CB GLU A 115 -8.084 3.765 12.830 1.00 44.24 C ATOM 1692 CG GLU A 115 -9.522 3.350 13.060 1.00 72.02 C ATOM 1693 CD GLU A 115 -10.263 4.352 13.906 1.00 32.12 C ATOM 1694 OE1 GLU A 115 -10.085 4.346 15.137 1.00 73.23 O ATOM 1695 OE2 GLU A 115 -11.046 5.160 13.377 1.00 42.11 O ATOM 0 H GLU A 115 -7.596 3.838 10.235 1.00 4.23 H new ATOM 0 HA GLU A 115 -8.632 5.755 12.221 1.00 44.32 H new ATOM 0 HB2 GLU A 115 -7.544 2.928 12.388 1.00 44.24 H new ATOM 0 HB3 GLU A 115 -7.620 3.969 13.795 1.00 44.24 H new ATOM 0 HG2 GLU A 115 -10.027 3.240 12.100 1.00 72.02 H new ATOM 0 HG3 GLU A 115 -9.546 2.375 13.546 1.00 72.02 H new ATOM 1702 N PRO A 116 -6.345 6.649 12.857 1.00 71.43 N ATOM 1703 CA PRO A 116 -5.023 7.214 13.171 1.00 72.24 C ATOM 1704 C PRO A 116 -4.218 6.176 13.910 1.00 13.30 C ATOM 1705 O PRO A 116 -4.665 5.673 14.946 1.00 10.41 O ATOM 1706 CB PRO A 116 -5.335 8.389 14.109 1.00 32.44 C ATOM 1707 CG PRO A 116 -6.774 8.710 13.881 1.00 10.44 C ATOM 1708 CD PRO A 116 -7.439 7.432 13.458 1.00 63.31 C ATOM 0 HA PRO A 116 -4.459 7.519 12.289 1.00 72.24 H new ATOM 0 HB2 PRO A 116 -5.153 8.120 15.149 1.00 32.44 H new ATOM 0 HB3 PRO A 116 -4.701 9.248 13.887 1.00 32.44 H new ATOM 0 HG2 PRO A 116 -7.232 9.102 14.789 1.00 10.44 H new ATOM 0 HG3 PRO A 116 -6.883 9.476 13.113 1.00 10.44 H new ATOM 0 HD2 PRO A 116 -7.883 6.912 14.307 1.00 63.31 H new ATOM 0 HD3 PRO A 116 -8.240 7.616 12.742 1.00 63.31 H new ATOM 1716 N ARG A 117 -3.056 5.838 13.403 1.00 12.25 N ATOM 1717 CA ARG A 117 -2.351 4.726 13.958 1.00 73.52 C ATOM 1718 C ARG A 117 -0.844 4.944 13.984 1.00 32.41 C ATOM 1719 O ARG A 117 -0.285 5.544 13.074 1.00 11.33 O ATOM 1720 CB ARG A 117 -2.677 3.487 13.134 1.00 13.14 C ATOM 1721 CG ARG A 117 -2.155 2.200 13.713 1.00 35.02 C ATOM 1722 CD ARG A 117 -2.831 1.862 15.038 1.00 64.31 C ATOM 1723 NE ARG A 117 -4.276 1.659 14.872 1.00 5.04 N ATOM 1724 CZ ARG A 117 -5.233 2.224 15.622 1.00 3.43 C ATOM 1725 NH1 ARG A 117 -4.926 3.134 16.538 1.00 3.53 N ATOM 1726 NH2 ARG A 117 -6.497 1.894 15.418 1.00 20.34 N ATOM 0 H ARG A 117 -2.594 6.309 12.625 1.00 12.25 H new ATOM 0 HA ARG A 117 -2.671 4.603 14.993 1.00 73.52 H new ATOM 0 HB2 ARG A 117 -3.759 3.411 13.028 1.00 13.14 H new ATOM 0 HB3 ARG A 117 -2.266 3.613 12.132 1.00 13.14 H new ATOM 0 HG2 ARG A 117 -2.319 1.389 13.004 1.00 35.02 H new ATOM 0 HG3 ARG A 117 -1.078 2.279 13.864 1.00 35.02 H new ATOM 0 HD2 ARG A 117 -2.382 0.961 15.457 1.00 64.31 H new ATOM 0 HD3 ARG A 117 -2.656 2.667 15.752 1.00 64.31 H new ATOM 0 HE ARG A 117 -4.577 1.036 14.123 1.00 5.04 H new ATOM 0 HH11 ARG A 117 -3.954 3.410 16.677 1.00 3.53 H new ATOM 0 HH12 ARG A 117 -5.662 3.557 17.103 1.00 3.53 H new ATOM 0 HH21 ARG A 117 -6.737 1.215 14.695 1.00 20.34 H new ATOM 0 HH22 ARG A 117 -7.232 2.318 15.983 1.00 20.34 H new ATOM 1740 N ASN A 118 -0.210 4.470 15.046 1.00 54.42 N ATOM 1741 CA ASN A 118 1.245 4.481 15.192 1.00 64.45 C ATOM 1742 C ASN A 118 1.859 3.330 14.388 1.00 53.20 C ATOM 1743 O ASN A 118 2.667 3.542 13.480 1.00 74.22 O ATOM 1744 CB ASN A 118 1.671 4.402 16.697 1.00 3.25 C ATOM 1745 CG ASN A 118 1.136 3.177 17.467 1.00 73.41 C ATOM 1746 OD1 ASN A 118 0.045 2.671 17.186 1.00 75.25 O ATOM 1747 ND2 ASN A 118 1.890 2.694 18.416 1.00 72.24 N ATOM 0 H ASN A 118 -0.695 4.060 15.844 1.00 54.42 H new ATOM 0 HA ASN A 118 1.621 5.426 14.799 1.00 64.45 H new ATOM 0 HB2 ASN A 118 2.760 4.398 16.750 1.00 3.25 H new ATOM 0 HB3 ASN A 118 1.331 5.306 17.202 1.00 3.25 H new ATOM 0 HD21 ASN A 118 1.583 1.879 18.946 1.00 72.24 H new ATOM 0 HD22 ASN A 118 2.787 3.132 18.627 1.00 72.24 H new ATOM 1754 N ALA A 119 1.453 2.128 14.717 1.00 71.23 N ATOM 1755 CA ALA A 119 1.875 0.931 14.043 1.00 70.51 C ATOM 1756 C ALA A 119 0.766 -0.077 14.168 1.00 41.34 C ATOM 1757 O ALA A 119 0.141 -0.181 15.227 1.00 54.41 O ATOM 1758 CB ALA A 119 3.157 0.389 14.651 1.00 24.35 C ATOM 0 H ALA A 119 0.802 1.954 15.483 1.00 71.23 H new ATOM 0 HA ALA A 119 2.081 1.145 12.994 1.00 70.51 H new ATOM 0 HB1 ALA A 119 3.455 -0.517 14.123 1.00 24.35 H new ATOM 0 HB2 ALA A 119 3.946 1.136 14.563 1.00 24.35 H new ATOM 0 HB3 ALA A 119 2.991 0.158 15.703 1.00 24.35 H new ATOM 1764 N GLN A 120 0.469 -0.756 13.101 1.00 35.14 N ATOM 1765 CA GLN A 120 -0.630 -1.717 13.094 1.00 22.02 C ATOM 1766 C GLN A 120 -0.403 -2.795 12.072 1.00 32.42 C ATOM 1767 O GLN A 120 0.106 -2.525 10.996 1.00 24.11 O ATOM 1768 CB GLN A 120 -1.951 -0.980 12.794 1.00 31.12 C ATOM 1769 CG GLN A 120 -3.196 -1.840 12.586 1.00 40.42 C ATOM 1770 CD GLN A 120 -3.593 -2.657 13.795 1.00 53.11 C ATOM 1771 OE1 GLN A 120 -3.360 -2.264 14.931 1.00 61.34 O ATOM 1772 NE2 GLN A 120 -4.187 -3.794 13.555 1.00 34.31 N ATOM 0 H GLN A 120 0.965 -0.673 12.214 1.00 35.14 H new ATOM 0 HA GLN A 120 -0.683 -2.189 14.075 1.00 22.02 H new ATOM 0 HB2 GLN A 120 -2.149 -0.292 13.616 1.00 31.12 H new ATOM 0 HB3 GLN A 120 -1.805 -0.374 11.900 1.00 31.12 H new ATOM 0 HG2 GLN A 120 -4.029 -1.193 12.309 1.00 40.42 H new ATOM 0 HG3 GLN A 120 -3.023 -2.514 11.747 1.00 40.42 H new ATOM 0 HE21 GLN A 120 -4.363 -4.085 12.593 1.00 34.31 H new ATOM 0 HE22 GLN A 120 -4.476 -4.392 14.329 1.00 34.31 H new ATOM 1781 N VAL A 121 -0.767 -4.006 12.417 1.00 32.03 N ATOM 1782 CA VAL A 121 -0.790 -5.097 11.470 1.00 32.40 C ATOM 1783 C VAL A 121 -1.884 -4.765 10.449 1.00 50.42 C ATOM 1784 O VAL A 121 -2.985 -4.379 10.840 1.00 12.34 O ATOM 1785 CB VAL A 121 -1.114 -6.450 12.177 1.00 64.24 C ATOM 1786 CG1 VAL A 121 -1.122 -7.611 11.184 1.00 0.42 C ATOM 1787 CG2 VAL A 121 -0.119 -6.720 13.300 1.00 20.22 C ATOM 0 H VAL A 121 -1.056 -4.264 13.361 1.00 32.03 H new ATOM 0 HA VAL A 121 0.184 -5.210 10.994 1.00 32.40 H new ATOM 0 HB VAL A 121 -2.113 -6.368 12.605 1.00 64.24 H new ATOM 0 HG11 VAL A 121 -1.351 -8.538 11.710 1.00 0.42 H new ATOM 0 HG12 VAL A 121 -1.878 -7.431 10.420 1.00 0.42 H new ATOM 0 HG13 VAL A 121 -0.143 -7.694 10.713 1.00 0.42 H new ATOM 0 HG21 VAL A 121 -0.361 -7.668 13.781 1.00 20.22 H new ATOM 0 HG22 VAL A 121 0.889 -6.769 12.889 1.00 20.22 H new ATOM 0 HG23 VAL A 121 -0.172 -5.916 14.034 1.00 20.22 H new ATOM 1797 N MET A 122 -1.599 -4.901 9.187 1.00 53.43 N ATOM 1798 CA MET A 122 -2.551 -4.484 8.167 1.00 34.21 C ATOM 1799 C MET A 122 -3.487 -5.643 7.891 1.00 54.40 C ATOM 1800 O MET A 122 -3.076 -6.814 7.953 1.00 41.45 O ATOM 1801 CB MET A 122 -1.812 -4.023 6.888 1.00 42.00 C ATOM 1802 CG MET A 122 -1.015 -5.115 6.190 1.00 2.10 C ATOM 1803 SD MET A 122 0.039 -4.519 4.834 1.00 25.14 S ATOM 1804 CE MET A 122 1.308 -3.645 5.723 1.00 71.22 C ATOM 0 H MET A 122 -0.728 -5.292 8.829 1.00 53.43 H new ATOM 0 HA MET A 122 -3.133 -3.631 8.516 1.00 34.21 H new ATOM 0 HB2 MET A 122 -2.543 -3.620 6.187 1.00 42.00 H new ATOM 0 HB3 MET A 122 -1.137 -3.208 7.148 1.00 42.00 H new ATOM 0 HG2 MET A 122 -0.389 -5.619 6.926 1.00 2.10 H new ATOM 0 HG3 MET A 122 -1.707 -5.859 5.797 1.00 2.10 H new ATOM 0 HE1 MET A 122 1.386 -2.628 5.339 1.00 71.22 H new ATOM 0 HE2 MET A 122 1.055 -3.615 6.783 1.00 71.22 H new ATOM 0 HE3 MET A 122 2.262 -4.156 5.592 1.00 71.22 H new ATOM 1814 N GLN A 123 -4.728 -5.337 7.621 1.00 13.11 N ATOM 1815 CA GLN A 123 -5.733 -6.340 7.542 1.00 64.55 C ATOM 1816 C GLN A 123 -6.516 -6.299 6.248 1.00 54.11 C ATOM 1817 O GLN A 123 -6.663 -5.260 5.617 1.00 70.32 O ATOM 1818 CB GLN A 123 -6.663 -6.380 8.795 1.00 23.23 C ATOM 1819 CG GLN A 123 -7.290 -5.050 9.260 1.00 23.14 C ATOM 1820 CD GLN A 123 -6.351 -4.161 10.088 1.00 33.04 C ATOM 1821 OE1 GLN A 123 -6.293 -4.277 11.314 1.00 14.33 O ATOM 1822 NE2 GLN A 123 -5.673 -3.246 9.463 1.00 55.42 N ATOM 0 H GLN A 123 -5.061 -4.388 7.452 1.00 13.11 H new ATOM 0 HA GLN A 123 -5.189 -7.285 7.538 1.00 64.55 H new ATOM 0 HB2 GLN A 123 -7.473 -7.080 8.590 1.00 23.23 H new ATOM 0 HB3 GLN A 123 -6.090 -6.790 9.626 1.00 23.23 H new ATOM 0 HG2 GLN A 123 -7.620 -4.492 8.384 1.00 23.14 H new ATOM 0 HG3 GLN A 123 -8.179 -5.269 9.852 1.00 23.14 H new ATOM 0 HE21 GLN A 123 -5.736 -3.168 8.448 1.00 55.42 H new ATOM 0 HE22 GLN A 123 -5.077 -2.605 9.987 1.00 55.42 H new ATOM 1831 N THR A 124 -7.014 -7.440 5.870 1.00 30.03 N ATOM 1832 CA THR A 124 -7.709 -7.651 4.670 1.00 51.31 C ATOM 1833 C THR A 124 -8.956 -6.778 4.554 1.00 1.41 C ATOM 1834 O THR A 124 -9.861 -6.852 5.383 1.00 42.52 O ATOM 1835 CB THR A 124 -8.075 -9.121 4.649 1.00 31.25 C ATOM 1836 OG1 THR A 124 -8.211 -9.564 6.020 1.00 14.15 O ATOM 1837 CG2 THR A 124 -7.015 -9.940 3.955 1.00 41.35 C ATOM 0 H THR A 124 -6.932 -8.285 6.435 1.00 30.03 H new ATOM 0 HA THR A 124 -7.084 -7.376 3.820 1.00 51.31 H new ATOM 0 HB THR A 124 -9.007 -9.254 4.100 1.00 31.25 H new ATOM 0 HG1 THR A 124 -9.131 -9.413 6.323 1.00 14.15 H new ATOM 0 HG21 THR A 124 -7.307 -10.990 3.957 1.00 41.35 H new ATOM 0 HG22 THR A 124 -6.904 -9.596 2.927 1.00 41.35 H new ATOM 0 HG23 THR A 124 -6.066 -9.827 4.479 1.00 41.35 H new ATOM 1845 N GLY A 125 -8.969 -5.930 3.556 1.00 73.12 N ATOM 1846 CA GLY A 125 -10.114 -5.111 3.306 1.00 32.05 C ATOM 1847 C GLY A 125 -9.981 -3.734 3.898 1.00 44.41 C ATOM 1848 O GLY A 125 -10.824 -2.868 3.644 1.00 70.45 O ATOM 0 H GLY A 125 -8.195 -5.793 2.906 1.00 73.12 H new ATOM 0 HA2 GLY A 125 -10.268 -5.027 2.230 1.00 32.05 H new ATOM 0 HA3 GLY A 125 -10.999 -5.595 3.718 1.00 32.05 H new ATOM 1852 N ASP A 126 -8.935 -3.508 4.668 1.00 63.31 N ATOM 1853 CA ASP A 126 -8.758 -2.219 5.288 1.00 3.52 C ATOM 1854 C ASP A 126 -8.114 -1.258 4.336 1.00 43.11 C ATOM 1855 O ASP A 126 -7.426 -1.663 3.372 1.00 23.13 O ATOM 1856 CB ASP A 126 -8.020 -2.273 6.652 1.00 61.00 C ATOM 1857 CG ASP A 126 -6.520 -1.923 6.652 1.00 35.53 C ATOM 1858 OD1 ASP A 126 -6.184 -0.721 6.591 1.00 13.20 O ATOM 1859 OD2 ASP A 126 -5.686 -2.845 6.829 1.00 41.44 O ATOM 0 H ASP A 126 -8.207 -4.192 4.875 1.00 63.31 H new ATOM 0 HA ASP A 126 -9.756 -1.852 5.526 1.00 3.52 H new ATOM 0 HB2 ASP A 126 -8.526 -1.593 7.338 1.00 61.00 H new ATOM 0 HB3 ASP A 126 -8.133 -3.278 7.058 1.00 61.00 H new ATOM 1864 N GLU A 127 -8.390 -0.008 4.546 1.00 55.51 N ATOM 1865 CA GLU A 127 -7.864 1.015 3.728 1.00 24.21 C ATOM 1866 C GLU A 127 -6.882 1.839 4.496 1.00 11.02 C ATOM 1867 O GLU A 127 -7.177 2.343 5.600 1.00 5.50 O ATOM 1868 CB GLU A 127 -8.959 1.908 3.170 1.00 10.45 C ATOM 1869 CG GLU A 127 -9.844 1.231 2.152 1.00 44.34 C ATOM 1870 CD GLU A 127 -10.882 2.159 1.598 1.00 25.13 C ATOM 1871 OE1 GLU A 127 -10.551 3.027 0.762 1.00 61.41 O ATOM 1872 OE2 GLU A 127 -12.054 2.054 1.989 1.00 33.24 O ATOM 0 H GLU A 127 -8.993 0.323 5.299 1.00 55.51 H new ATOM 0 HA GLU A 127 -7.360 0.536 2.889 1.00 24.21 H new ATOM 0 HB2 GLU A 127 -9.577 2.265 3.994 1.00 10.45 H new ATOM 0 HB3 GLU A 127 -8.501 2.785 2.712 1.00 10.45 H new ATOM 0 HG2 GLU A 127 -9.230 0.847 1.337 1.00 44.34 H new ATOM 0 HG3 GLU A 127 -10.334 0.373 2.613 1.00 44.34 H new ATOM 1879 N ILE A 128 -5.771 2.035 3.888 1.00 35.32 N ATOM 1880 CA ILE A 128 -4.701 2.771 4.442 1.00 43.20 C ATOM 1881 C ILE A 128 -4.711 4.090 3.699 1.00 32.51 C ATOM 1882 O ILE A 128 -4.557 4.136 2.472 1.00 1.44 O ATOM 1883 CB ILE A 128 -3.341 2.042 4.205 1.00 42.11 C ATOM 1884 CG1 ILE A 128 -3.414 0.591 4.728 1.00 3.31 C ATOM 1885 CG2 ILE A 128 -2.206 2.797 4.905 1.00 41.21 C ATOM 1886 CD1 ILE A 128 -2.172 -0.239 4.456 1.00 53.43 C ATOM 0 H ILE A 128 -5.576 1.672 2.955 1.00 35.32 H new ATOM 0 HA ILE A 128 -4.812 2.893 5.519 1.00 43.20 H new ATOM 0 HB ILE A 128 -3.140 2.019 3.134 1.00 42.11 H new ATOM 0 HG12 ILE A 128 -3.592 0.614 5.803 1.00 3.31 H new ATOM 0 HG13 ILE A 128 -4.273 0.097 4.273 1.00 3.31 H new ATOM 0 HG21 ILE A 128 -1.263 2.278 4.732 1.00 41.21 H new ATOM 0 HG22 ILE A 128 -2.142 3.809 4.506 1.00 41.21 H new ATOM 0 HG23 ILE A 128 -2.405 2.841 5.976 1.00 41.21 H new ATOM 0 HD11 ILE A 128 -2.310 -1.243 4.857 1.00 53.43 H new ATOM 0 HD12 ILE A 128 -2.002 -0.298 3.381 1.00 53.43 H new ATOM 0 HD13 ILE A 128 -1.311 0.227 4.935 1.00 53.43 H new ATOM 1898 N GLN A 129 -4.962 5.133 4.417 1.00 23.45 N ATOM 1899 CA GLN A 129 -5.150 6.439 3.840 1.00 54.13 C ATOM 1900 C GLN A 129 -3.896 7.245 4.114 1.00 1.11 C ATOM 1901 O GLN A 129 -3.366 7.210 5.227 1.00 2.00 O ATOM 1902 CB GLN A 129 -6.405 7.080 4.491 1.00 44.42 C ATOM 1903 CG GLN A 129 -7.066 8.258 3.746 1.00 55.43 C ATOM 1904 CD GLN A 129 -6.262 9.546 3.714 1.00 51.33 C ATOM 1905 OE1 GLN A 129 -5.488 9.835 4.604 1.00 74.41 O ATOM 1906 NE2 GLN A 129 -6.476 10.336 2.703 1.00 72.54 N ATOM 0 H GLN A 129 -5.045 5.111 5.433 1.00 23.45 H new ATOM 0 HA GLN A 129 -5.311 6.398 2.763 1.00 54.13 H new ATOM 0 HB2 GLN A 129 -7.154 6.299 4.619 1.00 44.42 H new ATOM 0 HB3 GLN A 129 -6.129 7.424 5.488 1.00 44.42 H new ATOM 0 HG2 GLN A 129 -7.266 7.950 2.720 1.00 55.43 H new ATOM 0 HG3 GLN A 129 -8.030 8.464 4.211 1.00 55.43 H new ATOM 0 HE21 GLN A 129 -7.133 10.063 1.972 1.00 72.54 H new ATOM 0 HE22 GLN A 129 -5.987 11.229 2.641 1.00 72.54 H new ATOM 1915 N ILE A 130 -3.382 7.881 3.090 1.00 73.40 N ATOM 1916 CA ILE A 130 -2.197 8.706 3.203 1.00 32.03 C ATOM 1917 C ILE A 130 -2.502 10.042 2.574 1.00 41.30 C ATOM 1918 O ILE A 130 -2.529 10.124 1.370 1.00 74.14 O ATOM 1919 CB ILE A 130 -0.946 8.108 2.437 1.00 54.22 C ATOM 1920 CG1 ILE A 130 -0.475 6.745 2.986 1.00 22.33 C ATOM 1921 CG2 ILE A 130 0.215 9.099 2.386 1.00 64.25 C ATOM 1922 CD1 ILE A 130 -1.297 5.556 2.553 1.00 34.51 C ATOM 0 H ILE A 130 -3.773 7.843 2.149 1.00 73.40 H new ATOM 0 HA ILE A 130 -1.947 8.772 4.262 1.00 32.03 H new ATOM 0 HB ILE A 130 -1.294 7.927 1.420 1.00 54.22 H new ATOM 0 HG12 ILE A 130 0.558 6.584 2.676 1.00 22.33 H new ATOM 0 HG13 ILE A 130 -0.477 6.790 4.075 1.00 22.33 H new ATOM 0 HG21 ILE A 130 1.053 8.651 1.852 1.00 64.25 H new ATOM 0 HG22 ILE A 130 -0.102 10.004 1.868 1.00 64.25 H new ATOM 0 HG23 ILE A 130 0.524 9.350 3.401 1.00 64.25 H new ATOM 0 HD11 ILE A 130 -0.883 4.648 2.992 1.00 34.51 H new ATOM 0 HD12 ILE A 130 -2.327 5.684 2.887 1.00 34.51 H new ATOM 0 HD13 ILE A 130 -1.276 5.475 1.466 1.00 34.51 H new ATOM 1934 N GLY A 131 -2.739 11.065 3.375 1.00 40.41 N ATOM 1935 CA GLY A 131 -3.017 12.424 2.863 1.00 41.42 C ATOM 1936 C GLY A 131 -4.224 12.529 1.906 1.00 11.24 C ATOM 1937 O GLY A 131 -5.313 12.947 2.304 1.00 30.15 O ATOM 0 H GLY A 131 -2.748 10.994 4.393 1.00 40.41 H new ATOM 0 HA2 GLY A 131 -3.187 13.087 3.711 1.00 41.42 H new ATOM 0 HA3 GLY A 131 -2.130 12.789 2.345 1.00 41.42 H new ATOM 1941 N LYS A 132 -4.009 12.139 0.663 1.00 24.22 N ATOM 1942 CA LYS A 132 -4.997 12.198 -0.412 1.00 74.53 C ATOM 1943 C LYS A 132 -5.004 10.869 -1.195 1.00 74.40 C ATOM 1944 O LYS A 132 -5.623 10.757 -2.259 1.00 20.11 O ATOM 1945 CB LYS A 132 -4.609 13.333 -1.355 1.00 51.03 C ATOM 1946 CG LYS A 132 -3.192 13.170 -1.905 1.00 40.43 C ATOM 1947 CD LYS A 132 -2.736 14.346 -2.743 1.00 22.20 C ATOM 1948 CE LYS A 132 -2.804 15.647 -1.968 1.00 63.44 C ATOM 1949 NZ LYS A 132 -2.077 16.721 -2.654 1.00 64.33 N ATOM 0 H LYS A 132 -3.113 11.759 0.358 1.00 24.22 H new ATOM 0 HA LYS A 132 -5.989 12.367 0.006 1.00 74.53 H new ATOM 0 HB2 LYS A 132 -5.316 13.372 -2.184 1.00 51.03 H new ATOM 0 HB3 LYS A 132 -4.684 14.283 -0.827 1.00 51.03 H new ATOM 0 HG2 LYS A 132 -2.500 13.035 -1.074 1.00 40.43 H new ATOM 0 HG3 LYS A 132 -3.146 12.263 -2.508 1.00 40.43 H new ATOM 0 HD2 LYS A 132 -1.714 14.177 -3.081 1.00 22.20 H new ATOM 0 HD3 LYS A 132 -3.359 14.421 -3.635 1.00 22.20 H new ATOM 0 HE2 LYS A 132 -3.846 15.939 -1.836 1.00 63.44 H new ATOM 0 HE3 LYS A 132 -2.385 15.501 -0.972 1.00 63.44 H new ATOM 0 HZ1 LYS A 132 -2.269 17.627 -2.181 1.00 64.33 H new ATOM 0 HZ2 LYS A 132 -1.056 16.524 -2.624 1.00 64.33 H new ATOM 0 HZ3 LYS A 132 -2.390 16.774 -3.644 1.00 64.33 H new ATOM 1963 N PHE A 133 -4.299 9.894 -0.676 1.00 60.34 N ATOM 1964 CA PHE A 133 -4.173 8.587 -1.299 1.00 33.21 C ATOM 1965 C PHE A 133 -5.082 7.598 -0.589 1.00 64.02 C ATOM 1966 O PHE A 133 -5.241 7.658 0.637 1.00 12.05 O ATOM 1967 CB PHE A 133 -2.731 8.047 -1.173 1.00 40.04 C ATOM 1968 CG PHE A 133 -1.628 8.823 -1.859 1.00 3.04 C ATOM 1969 CD1 PHE A 133 -1.149 10.011 -1.329 1.00 75.42 C ATOM 1970 CD2 PHE A 133 -1.045 8.336 -3.012 1.00 14.03 C ATOM 1971 CE1 PHE A 133 -0.121 10.699 -1.939 1.00 31.23 C ATOM 1972 CE2 PHE A 133 -0.009 9.016 -3.623 1.00 50.32 C ATOM 1973 CZ PHE A 133 0.449 10.199 -3.086 1.00 22.22 C ATOM 0 H PHE A 133 -3.788 9.981 0.202 1.00 60.34 H new ATOM 0 HA PHE A 133 -4.440 8.696 -2.350 1.00 33.21 H new ATOM 0 HB2 PHE A 133 -2.488 7.984 -0.112 1.00 40.04 H new ATOM 0 HB3 PHE A 133 -2.718 7.029 -1.564 1.00 40.04 H new ATOM 0 HD1 PHE A 133 -1.588 10.404 -0.424 1.00 75.42 H new ATOM 0 HD2 PHE A 133 -1.403 7.412 -3.442 1.00 14.03 H new ATOM 0 HE1 PHE A 133 0.235 11.627 -1.517 1.00 31.23 H new ATOM 0 HE2 PHE A 133 0.442 8.620 -4.521 1.00 50.32 H new ATOM 0 HZ PHE A 133 1.256 10.734 -3.566 1.00 22.22 H new ATOM 1983 N ARG A 134 -5.664 6.704 -1.341 1.00 63.44 N ATOM 1984 CA ARG A 134 -6.466 5.630 -0.790 1.00 50.24 C ATOM 1985 C ARG A 134 -5.813 4.323 -1.208 1.00 22.13 C ATOM 1986 O ARG A 134 -5.683 4.053 -2.408 1.00 65.34 O ATOM 1987 CB ARG A 134 -7.887 5.673 -1.381 1.00 53.15 C ATOM 1988 CG ARG A 134 -8.679 6.942 -1.095 1.00 33.20 C ATOM 1989 CD ARG A 134 -9.164 7.021 0.349 1.00 12.42 C ATOM 1990 NE ARG A 134 -10.129 5.947 0.666 1.00 2.13 N ATOM 1991 CZ ARG A 134 -11.418 6.130 1.035 1.00 60.13 C ATOM 1992 NH1 ARG A 134 -11.966 7.341 1.055 1.00 64.12 N ATOM 1993 NH2 ARG A 134 -12.152 5.085 1.348 1.00 44.41 N ATOM 0 H ARG A 134 -5.599 6.694 -2.359 1.00 63.44 H new ATOM 0 HA ARG A 134 -6.529 5.725 0.294 1.00 50.24 H new ATOM 0 HB2 ARG A 134 -7.816 5.546 -2.461 1.00 53.15 H new ATOM 0 HB3 ARG A 134 -8.448 4.821 -0.996 1.00 53.15 H new ATOM 0 HG2 ARG A 134 -8.057 7.810 -1.313 1.00 33.20 H new ATOM 0 HG3 ARG A 134 -9.537 6.988 -1.765 1.00 33.20 H new ATOM 0 HD2 ARG A 134 -8.310 6.952 1.023 1.00 12.42 H new ATOM 0 HD3 ARG A 134 -9.630 7.991 0.523 1.00 12.42 H new ATOM 0 HE ARG A 134 -9.795 4.986 0.601 1.00 2.13 H new ATOM 0 HH11 ARG A 134 -11.413 8.156 0.789 1.00 64.12 H new ATOM 0 HH12 ARG A 134 -12.940 7.456 1.337 1.00 64.12 H new ATOM 0 HH21 ARG A 134 -11.749 4.149 1.311 1.00 44.41 H new ATOM 0 HH22 ARG A 134 -13.125 5.210 1.628 1.00 44.41 H new ATOM 2007 N LEU A 135 -5.388 3.540 -0.256 1.00 43.12 N ATOM 2008 CA LEU A 135 -4.789 2.246 -0.530 1.00 3.20 C ATOM 2009 C LEU A 135 -5.619 1.176 0.119 1.00 63.32 C ATOM 2010 O LEU A 135 -6.039 1.335 1.248 1.00 0.34 O ATOM 2011 CB LEU A 135 -3.329 2.150 -0.013 1.00 22.31 C ATOM 2012 CG LEU A 135 -2.210 2.845 -0.830 1.00 10.11 C ATOM 2013 CD1 LEU A 135 -2.398 4.348 -0.922 1.00 54.43 C ATOM 2014 CD2 LEU A 135 -0.850 2.520 -0.237 1.00 2.32 C ATOM 0 H LEU A 135 -5.443 3.773 0.735 1.00 43.12 H new ATOM 0 HA LEU A 135 -4.761 2.114 -1.612 1.00 3.20 H new ATOM 0 HB2 LEU A 135 -3.307 2.561 0.996 1.00 22.31 H new ATOM 0 HB3 LEU A 135 -3.074 1.093 0.067 1.00 22.31 H new ATOM 0 HG LEU A 135 -2.269 2.456 -1.846 1.00 10.11 H new ATOM 0 HD11 LEU A 135 -1.585 4.781 -1.505 1.00 54.43 H new ATOM 0 HD12 LEU A 135 -3.349 4.567 -1.407 1.00 54.43 H new ATOM 0 HD13 LEU A 135 -2.394 4.777 0.080 1.00 54.43 H new ATOM 0 HD21 LEU A 135 -0.072 3.014 -0.819 1.00 2.32 H new ATOM 0 HD22 LEU A 135 -0.809 2.871 0.794 1.00 2.32 H new ATOM 0 HD23 LEU A 135 -0.691 1.442 -0.260 1.00 2.32 H new ATOM 2026 N VAL A 136 -5.877 0.117 -0.591 1.00 30.12 N ATOM 2027 CA VAL A 136 -6.662 -0.976 -0.056 1.00 70.34 C ATOM 2028 C VAL A 136 -5.757 -2.194 0.057 1.00 21.23 C ATOM 2029 O VAL A 136 -5.027 -2.513 -0.899 1.00 34.23 O ATOM 2030 CB VAL A 136 -7.872 -1.332 -0.979 1.00 55.44 C ATOM 2031 CG1 VAL A 136 -8.813 -2.318 -0.291 1.00 30.23 C ATOM 2032 CG2 VAL A 136 -8.630 -0.085 -1.429 1.00 32.00 C ATOM 0 H VAL A 136 -5.556 -0.021 -1.549 1.00 30.12 H new ATOM 0 HA VAL A 136 -7.059 -0.677 0.914 1.00 70.34 H new ATOM 0 HB VAL A 136 -7.467 -1.809 -1.872 1.00 55.44 H new ATOM 0 HG11 VAL A 136 -9.646 -2.549 -0.955 1.00 30.23 H new ATOM 0 HG12 VAL A 136 -8.271 -3.234 -0.056 1.00 30.23 H new ATOM 0 HG13 VAL A 136 -9.194 -1.876 0.629 1.00 30.23 H new ATOM 0 HG21 VAL A 136 -9.463 -0.377 -2.069 1.00 32.00 H new ATOM 0 HG22 VAL A 136 -9.011 0.444 -0.556 1.00 32.00 H new ATOM 0 HG23 VAL A 136 -7.958 0.569 -1.985 1.00 32.00 H new ATOM 2042 N PHE A 137 -5.761 -2.837 1.195 1.00 24.31 N ATOM 2043 CA PHE A 137 -4.948 -4.018 1.399 1.00 12.33 C ATOM 2044 C PHE A 137 -5.761 -5.289 1.143 1.00 51.55 C ATOM 2045 O PHE A 137 -6.826 -5.495 1.746 1.00 11.23 O ATOM 2046 CB PHE A 137 -4.354 -4.028 2.811 1.00 34.34 C ATOM 2047 CG PHE A 137 -3.558 -5.264 3.123 1.00 30.42 C ATOM 2048 CD1 PHE A 137 -2.334 -5.484 2.527 1.00 32.42 C ATOM 2049 CD2 PHE A 137 -4.041 -6.202 4.016 1.00 32.33 C ATOM 2050 CE1 PHE A 137 -1.608 -6.615 2.820 1.00 53.45 C ATOM 2051 CE2 PHE A 137 -3.321 -7.334 4.314 1.00 53.54 C ATOM 2052 CZ PHE A 137 -2.106 -7.540 3.718 1.00 45.55 C ATOM 0 H PHE A 137 -6.321 -2.564 2.003 1.00 24.31 H new ATOM 0 HA PHE A 137 -4.126 -3.993 0.684 1.00 12.33 H new ATOM 0 HB2 PHE A 137 -3.714 -3.154 2.932 1.00 34.34 H new ATOM 0 HB3 PHE A 137 -5.162 -3.934 3.536 1.00 34.34 H new ATOM 0 HD1 PHE A 137 -1.942 -4.763 1.825 1.00 32.42 H new ATOM 0 HD2 PHE A 137 -5.000 -6.043 4.487 1.00 32.33 H new ATOM 0 HE1 PHE A 137 -0.650 -6.780 2.349 1.00 53.45 H new ATOM 0 HE2 PHE A 137 -3.712 -8.057 5.015 1.00 53.54 H new ATOM 0 HZ PHE A 137 -1.535 -8.427 3.950 1.00 45.55 H new ATOM 2062 N LEU A 138 -5.264 -6.136 0.252 1.00 70.41 N ATOM 2063 CA LEU A 138 -5.934 -7.380 -0.078 1.00 53.44 C ATOM 2064 C LEU A 138 -4.966 -8.543 0.004 1.00 73.03 C ATOM 2065 O LEU A 138 -3.846 -8.488 -0.526 1.00 73.51 O ATOM 2066 CB LEU A 138 -6.557 -7.388 -1.504 1.00 25.12 C ATOM 2067 CG LEU A 138 -7.680 -6.391 -1.848 1.00 12.24 C ATOM 2068 CD1 LEU A 138 -8.797 -6.383 -0.812 1.00 65.55 C ATOM 2069 CD2 LEU A 138 -7.148 -4.997 -2.138 1.00 62.41 C ATOM 0 H LEU A 138 -4.394 -5.980 -0.256 1.00 70.41 H new ATOM 0 HA LEU A 138 -6.738 -7.477 0.651 1.00 53.44 H new ATOM 0 HB2 LEU A 138 -5.747 -7.225 -2.215 1.00 25.12 H new ATOM 0 HB3 LEU A 138 -6.944 -8.391 -1.686 1.00 25.12 H new ATOM 0 HG LEU A 138 -8.129 -6.749 -2.774 1.00 12.24 H new ATOM 0 HD11 LEU A 138 -9.560 -5.663 -1.106 1.00 65.55 H new ATOM 0 HD12 LEU A 138 -9.241 -7.376 -0.748 1.00 65.55 H new ATOM 0 HD13 LEU A 138 -8.390 -6.104 0.160 1.00 65.55 H new ATOM 0 HD21 LEU A 138 -7.979 -4.332 -2.375 1.00 62.41 H new ATOM 0 HD22 LEU A 138 -6.620 -4.620 -1.262 1.00 62.41 H new ATOM 0 HD23 LEU A 138 -6.463 -5.038 -2.985 1.00 62.41 H new ATOM 2081 N ALA A 139 -5.379 -9.578 0.655 1.00 31.41 N ATOM 2082 CA ALA A 139 -4.611 -10.787 0.685 1.00 31.35 C ATOM 2083 C ALA A 139 -5.429 -11.814 -0.027 1.00 2.51 C ATOM 2084 O ALA A 139 -6.538 -12.142 0.417 1.00 21.12 O ATOM 2085 CB ALA A 139 -4.312 -11.225 2.113 1.00 0.05 C ATOM 0 H ALA A 139 -6.253 -9.615 1.180 1.00 31.41 H new ATOM 0 HA ALA A 139 -3.643 -10.644 0.205 1.00 31.35 H new ATOM 0 HB1 ALA A 139 -3.728 -12.145 2.097 1.00 0.05 H new ATOM 0 HB2 ALA A 139 -3.746 -10.445 2.622 1.00 0.05 H new ATOM 0 HB3 ALA A 139 -5.248 -11.399 2.644 1.00 0.05 H new ATOM 2091 N GLY A 140 -4.918 -12.331 -1.100 1.00 44.33 N ATOM 2092 CA GLY A 140 -5.732 -13.227 -1.879 1.00 25.03 C ATOM 2093 C GLY A 140 -5.006 -13.989 -2.956 1.00 23.04 C ATOM 2094 O GLY A 140 -5.116 -15.219 -2.987 1.00 15.35 O ATOM 0 H GLY A 140 -3.976 -12.161 -1.453 1.00 44.33 H new ATOM 0 HA2 GLY A 140 -6.201 -13.943 -1.205 1.00 25.03 H new ATOM 0 HA3 GLY A 140 -6.534 -12.652 -2.342 1.00 25.03 H new ATOM 2098 N PRO A 141 -4.275 -13.316 -3.894 1.00 61.25 N ATOM 2099 CA PRO A 141 -3.588 -14.024 -4.967 1.00 24.35 C ATOM 2100 C PRO A 141 -2.582 -15.006 -4.416 1.00 75.15 C ATOM 2101 O PRO A 141 -1.867 -14.713 -3.454 1.00 50.35 O ATOM 2102 CB PRO A 141 -2.878 -12.927 -5.761 1.00 23.53 C ATOM 2103 CG PRO A 141 -3.590 -11.671 -5.402 1.00 10.22 C ATOM 2104 CD PRO A 141 -4.081 -11.857 -3.997 1.00 74.31 C ATOM 0 HA PRO A 141 -4.280 -14.604 -5.578 1.00 24.35 H new ATOM 0 HB2 PRO A 141 -1.821 -12.871 -5.499 1.00 23.53 H new ATOM 0 HB3 PRO A 141 -2.931 -13.118 -6.833 1.00 23.53 H new ATOM 0 HG2 PRO A 141 -2.923 -10.812 -5.471 1.00 10.22 H new ATOM 0 HG3 PRO A 141 -4.420 -11.485 -6.083 1.00 10.22 H new ATOM 0 HD2 PRO A 141 -3.357 -11.495 -3.267 1.00 74.31 H new ATOM 0 HD3 PRO A 141 -5.010 -11.315 -3.821 1.00 74.31 H new ATOM 2112 N ALA A 142 -2.502 -16.125 -5.055 1.00 44.02 N ATOM 2113 CA ALA A 142 -1.672 -17.208 -4.624 1.00 72.41 C ATOM 2114 C ALA A 142 -1.064 -17.838 -5.826 1.00 12.33 C ATOM 2115 O ALA A 142 -1.577 -18.809 -6.367 1.00 72.25 O ATOM 2116 CB ALA A 142 -2.464 -18.235 -3.816 1.00 15.35 C ATOM 0 H ALA A 142 -3.022 -16.320 -5.911 1.00 44.02 H new ATOM 0 HA ALA A 142 -0.892 -16.824 -3.967 1.00 72.41 H new ATOM 0 HB1 ALA A 142 -1.801 -19.043 -3.505 1.00 15.35 H new ATOM 0 HB2 ALA A 142 -2.889 -17.755 -2.934 1.00 15.35 H new ATOM 0 HB3 ALA A 142 -3.267 -18.641 -4.431 1.00 15.35 H new ATOM 2122 N GLU A 143 -0.060 -17.208 -6.308 1.00 11.22 N ATOM 2123 CA GLU A 143 0.638 -17.632 -7.432 1.00 3.24 C ATOM 2124 C GLU A 143 2.105 -17.763 -7.077 1.00 23.53 C ATOM 2125 O GLU A 143 2.868 -16.799 -7.218 1.00 37.38 O ATOM 2126 CB GLU A 143 0.365 -16.649 -8.566 1.00 22.20 C ATOM 2127 CG GLU A 143 0.305 -15.183 -8.139 1.00 72.00 C ATOM 2128 CD GLU A 143 -0.223 -14.287 -9.220 1.00 13.14 C ATOM 2129 OE1 GLU A 143 -1.460 -14.146 -9.339 1.00 34.03 O ATOM 2130 OE2 GLU A 143 0.583 -13.686 -9.969 1.00 31.51 O ATOM 2131 OXT GLU A 143 2.491 -18.830 -6.566 1.00 37.38 O ATOM 0 H GLU A 143 0.304 -16.346 -5.902 1.00 11.22 H new ATOM 0 HA GLU A 143 0.311 -18.614 -7.773 1.00 3.24 H new ATOM 0 HB2 GLU A 143 1.143 -16.762 -9.322 1.00 22.20 H new ATOM 0 HB3 GLU A 143 -0.580 -16.915 -9.039 1.00 22.20 H new ATOM 0 HG2 GLU A 143 -0.327 -15.092 -7.256 1.00 72.00 H new ATOM 0 HG3 GLU A 143 1.303 -14.851 -7.853 1.00 72.00 H new TER 2138 GLU A 143