USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 987 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 22 MET CE :methyl -160:sc= -0.14 (180deg=-0.595) USER MOD Set 1.2: A 71 THR OG1 : rot -23:sc= 0.0429 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0402) USER MOD Single : A 3 HIS : no HD1:sc=-0.00889 X(o=-0.0089,f=-0.0031) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS :FLIP no HE2:sc= -0.329 F(o=-1,f=-0.33) USER MOD Single : A 7 HIS : no HD1:sc= -0.166 X(o=-0.17,f=0) USER MOD Single : A 8 HIS : no HE2:sc= -0.248 K(o=-0.25,f=-1.2) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN :FLIP amide:sc= -0.227 F(o=-3.5!,f=-0.23) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0.0123 USER MOD Single : A 25 GLN : amide:sc= -0.101 K(o=-0.1,f=-0.72) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 164:sc= 1.19 (180deg=0.998) USER MOD Single : A 36 THR OG1 : rot -74:sc= 1.17 USER MOD Single : A 37 SER OG : rot -30:sc= 0.282 USER MOD Single : A 38 CYS SG : rot -86:sc= -3.56! USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : A 41 ASN : amide:sc= 0.365 X(o=0.36,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= -0.555 K(o=-0.56,f=-1.4) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.888 K(o=-0.89,f=-4.9!) USER MOD Single : A 69 GLN :FLIP amide:sc= -0.0128 F(o=-0.84,f=-0.013) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 ASN :FLIP amide:sc= -1.09 F(o=-2.4!,f=-1.1) USER MOD Single : A 75 LYS NZ :NH3+ -164:sc= 1.02 (180deg=0.301) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ 163:sc= -0.593 (180deg=-1.79!) USER MOD Single : A 80 ASN : amide:sc= -2.73 K(o=-2.7,f=-5.6!) USER MOD Single : A 84 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.9!) USER MOD Single : A 85 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.221 X(o=-0.22,f=-0.44) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 56:sc= -1.29! USER MOD Single : A 101 MET CE :methyl -113:sc= 0 (180deg=-2.53!) USER MOD Single : A 103 LYS NZ :NH3+ 154:sc= 1.28 (180deg=0.905) USER MOD Single : A 104 ASN : amide:sc= 0.389 K(o=0.39,f=-9.4!) USER MOD Single : A 106 LYS NZ :NH3+ 165:sc= -0.0307 (180deg=-0.235) USER MOD Single : A 107 LYS NZ :NH3+ -165:sc= -0.0392 (180deg=-0.27) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -0.817 X(o=-0.82,f=-0.78) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -138:sc= -1.16! (180deg=-4.03!) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN :FLIP amide:sc= -0.877 F(o=-3.8!,f=-0.88) USER MOD Single : A 125 ASN : amide:sc= 0.55 K(o=0.55,f=-0.35) USER MOD Single : A 126 ASN : amide:sc= 0.968 K(o=0.97,f=-2.2!) USER MOD Single : A 128 ASN : amide:sc= 0.489 X(o=0.49,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 38.170 -9.564 -20.576 1.00 73.24 N ATOM 2 CA MET A 1 37.238 -8.415 -20.518 1.00 53.02 C ATOM 3 C MET A 1 35.875 -8.800 -21.083 1.00 61.40 C ATOM 4 O MET A 1 35.673 -8.812 -22.301 1.00 10.15 O ATOM 5 CB MET A 1 37.800 -7.213 -21.293 1.00 60.25 C ATOM 6 CG MET A 1 39.077 -6.629 -20.707 1.00 75.42 C ATOM 7 SD MET A 1 39.665 -5.191 -21.628 1.00 33.20 S ATOM 8 CE MET A 1 41.121 -4.753 -20.677 1.00 63.14 C ATOM 0 H1 MET A 1 39.058 -9.315 -20.096 1.00 73.24 H new ATOM 0 H2 MET A 1 37.739 -10.385 -20.104 1.00 73.24 H new ATOM 0 H3 MET A 1 38.368 -9.801 -21.569 1.00 73.24 H new ATOM 0 HA MET A 1 37.122 -8.133 -19.472 1.00 53.02 H new ATOM 0 HB2 MET A 1 37.993 -7.517 -22.322 1.00 60.25 H new ATOM 0 HB3 MET A 1 37.041 -6.432 -21.329 1.00 60.25 H new ATOM 0 HG2 MET A 1 38.900 -6.345 -19.670 1.00 75.42 H new ATOM 0 HG3 MET A 1 39.853 -7.394 -20.700 1.00 75.42 H new ATOM 0 HE1 MET A 1 41.597 -3.879 -21.122 1.00 63.14 H new ATOM 0 HE2 MET A 1 40.831 -4.525 -19.651 1.00 63.14 H new ATOM 0 HE3 MET A 1 41.821 -5.588 -20.679 1.00 63.14 H new ATOM 20 N ALA A 2 34.942 -9.121 -20.192 1.00 4.20 N ATOM 21 CA ALA A 2 33.586 -9.485 -20.583 1.00 23.41 C ATOM 22 C ALA A 2 32.664 -8.274 -20.483 1.00 34.04 C ATOM 23 O ALA A 2 32.388 -7.784 -19.383 1.00 4.43 O ATOM 24 CB ALA A 2 33.071 -10.631 -19.716 1.00 14.54 C ATOM 0 H ALA A 2 35.104 -9.136 -19.185 1.00 4.20 H new ATOM 0 HA ALA A 2 33.599 -9.822 -21.620 1.00 23.41 H new ATOM 0 HB1 ALA A 2 32.057 -10.891 -20.021 1.00 14.54 H new ATOM 0 HB2 ALA A 2 33.720 -11.499 -19.837 1.00 14.54 H new ATOM 0 HB3 ALA A 2 33.068 -10.323 -18.670 1.00 14.54 H new ATOM 30 N HIS A 3 32.217 -7.770 -21.631 1.00 52.43 N ATOM 31 CA HIS A 3 31.304 -6.629 -21.674 1.00 23.31 C ATOM 32 C HIS A 3 30.249 -6.827 -22.760 1.00 63.32 C ATOM 33 O HIS A 3 30.576 -6.999 -23.937 1.00 44.40 O ATOM 34 CB HIS A 3 32.072 -5.306 -21.877 1.00 42.32 C ATOM 35 CG HIS A 3 33.048 -5.309 -23.018 1.00 31.34 C ATOM 36 ND1 HIS A 3 32.810 -4.688 -24.223 1.00 43.53 N ATOM 37 CD2 HIS A 3 34.290 -5.841 -23.115 1.00 4.31 C ATOM 38 CE1 HIS A 3 33.858 -4.837 -25.008 1.00 23.24 C ATOM 39 NE2 HIS A 3 34.773 -5.532 -24.361 1.00 65.04 N ATOM 0 H HIS A 3 32.473 -8.135 -22.548 1.00 52.43 H new ATOM 0 HA HIS A 3 30.794 -6.567 -20.713 1.00 23.31 H new ATOM 0 HB2 HIS A 3 31.350 -4.505 -22.038 1.00 42.32 H new ATOM 0 HB3 HIS A 3 32.610 -5.071 -20.959 1.00 42.32 H new ATOM 0 HD2 HIS A 3 34.805 -6.405 -22.351 1.00 4.31 H new ATOM 0 HE1 HIS A 3 33.952 -4.454 -26.013 1.00 23.24 H new ATOM 0 HE2 HIS A 3 35.688 -5.796 -24.726 1.00 65.04 H new ATOM 48 N HIS A 4 28.987 -6.817 -22.332 1.00 71.22 N ATOM 49 CA HIS A 4 27.826 -7.001 -23.207 1.00 40.44 C ATOM 50 C HIS A 4 27.750 -8.421 -23.764 1.00 42.51 C ATOM 51 O HIS A 4 28.077 -8.675 -24.924 1.00 15.33 O ATOM 52 CB HIS A 4 27.784 -5.953 -24.333 1.00 22.12 C ATOM 53 CG HIS A 4 27.513 -4.568 -23.833 1.00 24.11 C ATOM 54 ND1 HIS A 4 26.256 -4.133 -23.472 1.00 5.22 N ATOM 55 CD2 HIS A 4 28.345 -3.524 -23.611 1.00 70.13 C ATOM 56 CE1 HIS A 4 26.327 -2.887 -23.052 1.00 43.14 C ATOM 57 NE2 HIS A 4 27.582 -2.494 -23.126 1.00 33.43 N ATOM 0 H HIS A 4 28.737 -6.679 -21.353 1.00 71.22 H new ATOM 0 HA HIS A 4 26.941 -6.849 -22.589 1.00 40.44 H new ATOM 0 HB2 HIS A 4 28.735 -5.962 -24.865 1.00 22.12 H new ATOM 0 HB3 HIS A 4 27.014 -6.231 -25.052 1.00 22.12 H new ATOM 0 HD2 HIS A 4 29.411 -3.506 -23.784 1.00 70.13 H new ATOM 0 HE1 HIS A 4 25.497 -2.289 -22.706 1.00 43.14 H new ATOM 0 HE2 HIS A 4 27.930 -1.572 -22.864 1.00 33.43 H new ATOM 66 N HIS A 5 27.356 -9.347 -22.897 1.00 33.03 N ATOM 67 CA HIS A 5 27.042 -10.720 -23.285 1.00 63.31 C ATOM 68 C HIS A 5 25.697 -11.099 -22.665 1.00 14.45 C ATOM 69 O HIS A 5 25.629 -11.497 -21.502 1.00 33.53 O ATOM 70 CB HIS A 5 28.144 -11.695 -22.829 1.00 65.22 C ATOM 71 CG HIS A 5 29.461 -11.507 -23.532 1.00 2.32 C ATOM 72 ND1 HIS A 5 29.917 -12.359 -24.516 1.00 51.22 N ATOM 73 CD2 HIS A 5 30.423 -10.561 -23.387 1.00 52.42 C ATOM 74 CE1 HIS A 5 31.096 -11.948 -24.942 1.00 32.40 C ATOM 75 NE2 HIS A 5 31.427 -10.860 -24.275 1.00 53.32 N ATOM 0 H HIS A 5 27.244 -9.167 -21.899 1.00 33.03 H new ATOM 0 HA HIS A 5 26.985 -10.786 -24.372 1.00 63.31 H new ATOM 0 HB2 HIS A 5 28.297 -11.577 -21.756 1.00 65.22 H new ATOM 0 HB3 HIS A 5 27.800 -12.717 -22.992 1.00 65.22 H new ATOM 0 HD2 HIS A 5 30.403 -9.727 -22.701 1.00 52.42 H new ATOM 0 HE1 HIS A 5 31.690 -12.423 -25.708 1.00 32.40 H new ATOM 0 HE2 HIS A 5 32.288 -10.327 -24.398 1.00 53.32 H new ATOM 84 N HIS A 6 24.628 -10.936 -23.441 1.00 75.12 N ATOM 85 CA HIS A 6 23.261 -11.073 -22.932 1.00 34.43 C ATOM 86 C HIS A 6 22.982 -12.479 -22.393 1.00 23.31 C ATOM 87 O HIS A 6 22.842 -13.435 -23.155 1.00 54.44 O ATOM 88 CB HIS A 6 22.237 -10.689 -24.023 1.00 42.00 C ATOM 89 CG HIS A 6 22.438 -11.372 -25.348 1.00 13.52 C ATOM 90 ND1 HIS A 6 22.146 -12.629 -25.763 1.00 32.33 N flip ATOM 91 CD2 HIS A 6 22.990 -10.732 -26.437 1.00 12.01 C flip ATOM 92 CE1 HIS A 6 22.525 -12.719 -27.079 1.00 63.32 C flip ATOM 93 NE2 HIS A 6 23.029 -11.564 -27.462 1.00 73.40 N flip ATOM 0 H HIS A 6 24.681 -10.707 -24.434 1.00 75.12 H new ATOM 0 HA HIS A 6 23.156 -10.385 -22.093 1.00 34.43 H new ATOM 0 HB2 HIS A 6 21.236 -10.921 -23.659 1.00 42.00 H new ATOM 0 HB3 HIS A 6 22.278 -9.611 -24.176 1.00 42.00 H new ATOM 0 HD1 HIS A 6 21.724 -13.369 -25.202 1.00 32.33 H new ATOM 0 HD2 HIS A 6 23.337 -9.709 -26.450 1.00 12.01 H new ATOM 0 HE1 HIS A 6 22.426 -13.596 -27.701 1.00 63.32 H new ATOM 102 N HIS A 7 22.928 -12.601 -21.070 1.00 62.42 N ATOM 103 CA HIS A 7 22.504 -13.844 -20.434 1.00 65.13 C ATOM 104 C HIS A 7 21.002 -13.796 -20.180 1.00 32.10 C ATOM 105 O HIS A 7 20.552 -13.329 -19.130 1.00 12.14 O ATOM 106 CB HIS A 7 23.263 -14.086 -19.122 1.00 65.21 C ATOM 107 CG HIS A 7 24.717 -14.384 -19.314 1.00 32.15 C ATOM 108 ND1 HIS A 7 25.204 -15.661 -19.473 1.00 30.24 N ATOM 109 CD2 HIS A 7 25.790 -13.566 -19.365 1.00 1.33 C ATOM 110 CE1 HIS A 7 26.513 -15.616 -19.611 1.00 0.14 C ATOM 111 NE2 HIS A 7 26.896 -14.356 -19.551 1.00 45.42 N ATOM 0 H HIS A 7 23.172 -11.855 -20.418 1.00 62.42 H new ATOM 0 HA HIS A 7 22.733 -14.673 -21.103 1.00 65.13 H new ATOM 0 HB2 HIS A 7 23.162 -13.206 -18.487 1.00 65.21 H new ATOM 0 HB3 HIS A 7 22.798 -14.917 -18.591 1.00 65.21 H new ATOM 0 HD2 HIS A 7 25.780 -12.490 -19.276 1.00 1.33 H new ATOM 0 HE1 HIS A 7 27.163 -16.467 -19.750 1.00 0.14 H new ATOM 0 HE2 HIS A 7 27.857 -14.023 -19.630 1.00 45.42 H new ATOM 120 N HIS A 8 20.233 -14.238 -21.169 1.00 13.45 N ATOM 121 CA HIS A 8 18.777 -14.215 -21.091 1.00 23.23 C ATOM 122 C HIS A 8 18.168 -15.226 -22.058 1.00 74.33 C ATOM 123 O HIS A 8 18.200 -15.029 -23.275 1.00 52.42 O ATOM 124 CB HIS A 8 18.234 -12.811 -21.410 1.00 33.02 C ATOM 125 CG HIS A 8 16.735 -12.760 -21.516 1.00 23.32 C ATOM 126 ND1 HIS A 8 16.053 -13.120 -22.660 1.00 24.34 N ATOM 127 CD2 HIS A 8 15.786 -12.411 -20.615 1.00 53.33 C ATOM 128 CE1 HIS A 8 14.757 -12.997 -22.457 1.00 31.13 C ATOM 129 NE2 HIS A 8 14.567 -12.569 -21.227 1.00 15.55 N ATOM 0 H HIS A 8 20.598 -14.620 -22.042 1.00 13.45 H new ATOM 0 HA HIS A 8 18.496 -14.482 -20.072 1.00 23.23 H new ATOM 0 HB2 HIS A 8 18.560 -12.119 -20.634 1.00 33.02 H new ATOM 0 HB3 HIS A 8 18.669 -12.466 -22.348 1.00 33.02 H new ATOM 0 HD1 HIS A 8 16.485 -13.433 -23.529 1.00 24.34 H new ATOM 0 HD2 HIS A 8 15.956 -12.072 -19.604 1.00 53.33 H new ATOM 0 HE1 HIS A 8 13.982 -13.211 -23.178 1.00 31.13 H new ATOM 138 N MET A 9 17.633 -16.309 -21.516 1.00 13.43 N ATOM 139 CA MET A 9 16.872 -17.274 -22.308 1.00 15.14 C ATOM 140 C MET A 9 15.382 -17.112 -22.003 1.00 73.11 C ATOM 141 O MET A 9 15.016 -16.452 -21.025 1.00 44.24 O ATOM 142 CB MET A 9 17.338 -18.714 -22.017 1.00 12.04 C ATOM 143 CG MET A 9 17.068 -19.200 -20.596 1.00 32.20 C ATOM 144 SD MET A 9 15.316 -19.489 -20.274 1.00 63.45 S ATOM 145 CE MET A 9 15.369 -20.007 -18.561 1.00 61.35 C ATOM 0 H MET A 9 17.710 -16.546 -20.527 1.00 13.43 H new ATOM 0 HA MET A 9 17.044 -17.082 -23.367 1.00 15.14 H new ATOM 0 HB2 MET A 9 16.844 -19.389 -22.716 1.00 12.04 H new ATOM 0 HB3 MET A 9 18.408 -18.781 -22.211 1.00 12.04 H new ATOM 0 HG2 MET A 9 17.621 -20.123 -20.422 1.00 32.20 H new ATOM 0 HG3 MET A 9 17.446 -18.463 -19.887 1.00 32.20 H new ATOM 0 HE1 MET A 9 14.358 -20.223 -18.215 1.00 61.35 H new ATOM 0 HE2 MET A 9 15.983 -20.903 -18.471 1.00 61.35 H new ATOM 0 HE3 MET A 9 15.798 -19.211 -17.953 1.00 61.35 H new ATOM 155 N GLY A 10 14.530 -17.700 -22.835 1.00 21.04 N ATOM 156 CA GLY A 10 13.095 -17.612 -22.626 1.00 12.25 C ATOM 157 C GLY A 10 12.394 -18.928 -22.916 1.00 70.45 C ATOM 158 O GLY A 10 12.410 -19.405 -24.051 1.00 34.22 O ATOM 0 H GLY A 10 14.808 -18.239 -23.655 1.00 21.04 H new ATOM 0 HA2 GLY A 10 12.897 -17.315 -21.596 1.00 12.25 H new ATOM 0 HA3 GLY A 10 12.683 -16.833 -23.267 1.00 12.25 H new ATOM 162 N THR A 11 11.794 -19.526 -21.887 1.00 23.34 N ATOM 163 CA THR A 11 11.064 -20.783 -22.036 1.00 5.34 C ATOM 164 C THR A 11 9.565 -20.532 -22.219 1.00 73.25 C ATOM 165 O THR A 11 8.760 -21.465 -22.225 1.00 41.22 O ATOM 166 CB THR A 11 11.302 -21.705 -20.816 1.00 3.23 C ATOM 167 OG1 THR A 11 11.014 -21.005 -19.597 1.00 31.45 O ATOM 168 CG2 THR A 11 12.744 -22.203 -20.784 1.00 54.52 C ATOM 0 H THR A 11 11.800 -19.157 -20.936 1.00 23.34 H new ATOM 0 HA THR A 11 11.442 -21.280 -22.930 1.00 5.34 H new ATOM 0 HB THR A 11 10.634 -22.561 -20.909 1.00 3.23 H new ATOM 0 HG1 THR A 11 11.167 -21.600 -18.834 1.00 31.45 H new ATOM 0 HG21 THR A 11 12.887 -22.849 -19.918 1.00 54.52 H new ATOM 0 HG22 THR A 11 12.955 -22.764 -21.694 1.00 54.52 H new ATOM 0 HG23 THR A 11 13.422 -21.352 -20.717 1.00 54.52 H new ATOM 176 N LEU A 12 9.201 -19.266 -22.407 1.00 74.23 N ATOM 177 CA LEU A 12 7.799 -18.875 -22.603 1.00 43.44 C ATOM 178 C LEU A 12 7.380 -19.065 -24.067 1.00 71.21 C ATOM 179 O LEU A 12 6.464 -18.402 -24.562 1.00 3.42 O ATOM 180 CB LEU A 12 7.565 -17.413 -22.160 1.00 12.22 C ATOM 181 CG LEU A 12 8.194 -16.311 -23.041 1.00 24.24 C ATOM 182 CD1 LEU A 12 7.676 -14.937 -22.624 1.00 50.32 C ATOM 183 CD2 LEU A 12 9.722 -16.345 -22.973 1.00 34.25 C ATOM 0 H LEU A 12 9.858 -18.486 -22.429 1.00 74.23 H new ATOM 0 HA LEU A 12 7.181 -19.523 -21.981 1.00 43.44 H new ATOM 0 HB2 LEU A 12 6.490 -17.239 -22.114 1.00 12.22 H new ATOM 0 HB3 LEU A 12 7.950 -17.299 -21.147 1.00 12.22 H new ATOM 0 HG LEU A 12 7.901 -16.502 -24.073 1.00 24.24 H new ATOM 0 HD11 LEU A 12 8.128 -14.171 -23.254 1.00 50.32 H new ATOM 0 HD12 LEU A 12 6.592 -14.907 -22.738 1.00 50.32 H new ATOM 0 HD13 LEU A 12 7.937 -14.751 -21.582 1.00 50.32 H new ATOM 0 HD21 LEU A 12 10.132 -15.557 -23.604 1.00 34.25 H new ATOM 0 HD22 LEU A 12 10.044 -16.190 -21.943 1.00 34.25 H new ATOM 0 HD23 LEU A 12 10.080 -17.313 -23.323 1.00 34.25 H new ATOM 195 N GLU A 13 8.036 -20.011 -24.741 1.00 14.14 N ATOM 196 CA GLU A 13 7.783 -20.299 -26.151 1.00 12.15 C ATOM 197 C GLU A 13 6.370 -20.840 -26.370 1.00 4.31 C ATOM 198 O GLU A 13 5.840 -20.781 -27.482 1.00 75.42 O ATOM 199 CB GLU A 13 8.805 -21.322 -26.667 1.00 73.01 C ATOM 200 CG GLU A 13 10.244 -20.818 -26.654 1.00 3.41 C ATOM 201 CD GLU A 13 10.438 -19.585 -27.522 1.00 32.20 C ATOM 202 OE1 GLU A 13 10.688 -18.493 -26.972 1.00 74.13 O ATOM 203 OE2 GLU A 13 10.326 -19.700 -28.762 1.00 51.23 O1- ATOM 0 H GLU A 13 8.758 -20.598 -24.323 1.00 14.14 H new ATOM 0 HA GLU A 13 7.880 -19.364 -26.703 1.00 12.15 H new ATOM 0 HB2 GLU A 13 8.741 -22.224 -26.058 1.00 73.01 H new ATOM 0 HB3 GLU A 13 8.539 -21.605 -27.685 1.00 73.01 H new ATOM 0 HG2 GLU A 13 10.535 -20.586 -25.629 1.00 3.41 H new ATOM 0 HG3 GLU A 13 10.906 -21.611 -27.002 1.00 3.41 H new ATOM 210 N ALA A 14 5.770 -21.369 -25.310 1.00 44.53 N ATOM 211 CA ALA A 14 4.460 -22.000 -25.402 1.00 21.22 C ATOM 212 C ALA A 14 3.408 -21.200 -24.642 1.00 50.53 C ATOM 213 O ALA A 14 3.643 -20.756 -23.518 1.00 52.13 O ATOM 214 CB ALA A 14 4.532 -23.426 -24.869 1.00 0.11 C ATOM 0 H ALA A 14 6.173 -21.373 -24.373 1.00 44.53 H new ATOM 0 HA ALA A 14 4.165 -22.026 -26.451 1.00 21.22 H new ATOM 0 HB1 ALA A 14 3.549 -23.891 -24.941 1.00 0.11 H new ATOM 0 HB2 ALA A 14 5.249 -23.999 -25.458 1.00 0.11 H new ATOM 0 HB3 ALA A 14 4.850 -23.409 -23.827 1.00 0.11 H new ATOM 220 N GLN A 15 2.255 -21.012 -25.278 1.00 4.44 N ATOM 221 CA GLN A 15 1.094 -20.396 -24.638 1.00 35.21 C ATOM 222 C GLN A 15 0.140 -21.496 -24.164 1.00 15.42 C ATOM 223 O GLN A 15 -0.894 -21.231 -23.547 1.00 13.51 O ATOM 224 CB GLN A 15 0.388 -19.454 -25.632 1.00 23.33 C ATOM 225 CG GLN A 15 -0.830 -18.711 -25.067 1.00 20.14 C ATOM 226 CD GLN A 15 -0.491 -17.509 -24.187 1.00 2.31 C ATOM 227 OE1 GLN A 15 0.640 -17.540 -23.496 1.00 15.13 O flip ATOM 228 NE2 GLN A 15 -1.258 -16.545 -24.128 1.00 70.34 N flip ATOM 0 H GLN A 15 2.098 -21.281 -26.249 1.00 4.44 H new ATOM 0 HA GLN A 15 1.413 -19.808 -23.777 1.00 35.21 H new ATOM 0 HB2 GLN A 15 1.110 -18.719 -25.988 1.00 23.33 H new ATOM 0 HB3 GLN A 15 0.071 -20.035 -26.498 1.00 23.33 H new ATOM 0 HG2 GLN A 15 -1.450 -18.373 -25.897 1.00 20.14 H new ATOM 0 HG3 GLN A 15 -1.429 -19.412 -24.486 1.00 20.14 H new ATOM 0 HE21 GLN A 15 -2.122 -16.547 -24.670 1.00 70.34 H new ATOM 0 HE22 GLN A 15 -1.028 -15.746 -23.537 1.00 70.34 H new ATOM 237 N THR A 16 0.513 -22.738 -24.463 1.00 54.35 N ATOM 238 CA THR A 16 -0.287 -23.906 -24.128 1.00 70.15 C ATOM 239 C THR A 16 -0.496 -24.028 -22.613 1.00 32.44 C ATOM 240 O THR A 16 0.410 -24.428 -21.877 1.00 63.23 O ATOM 241 CB THR A 16 0.386 -25.193 -24.666 1.00 55.41 C ATOM 242 OG1 THR A 16 0.743 -25.013 -26.048 1.00 33.34 O ATOM 243 CG2 THR A 16 -0.534 -26.405 -24.522 1.00 42.31 C ATOM 0 H THR A 16 1.383 -22.960 -24.947 1.00 54.35 H new ATOM 0 HA THR A 16 -1.262 -23.782 -24.599 1.00 70.15 H new ATOM 0 HB THR A 16 1.283 -25.379 -24.075 1.00 55.41 H new ATOM 0 HG1 THR A 16 1.170 -25.828 -26.384 1.00 33.34 H new ATOM 0 HG21 THR A 16 -0.031 -27.291 -24.909 1.00 42.31 H new ATOM 0 HG22 THR A 16 -0.776 -26.555 -23.470 1.00 42.31 H new ATOM 0 HG23 THR A 16 -1.452 -26.234 -25.084 1.00 42.31 H new ATOM 251 N GLN A 17 -1.685 -23.650 -22.155 1.00 5.12 N ATOM 252 CA GLN A 17 -2.065 -23.790 -20.752 1.00 31.24 C ATOM 253 C GLN A 17 -3.306 -24.673 -20.635 1.00 21.02 C ATOM 254 O GLN A 17 -3.907 -25.052 -21.647 1.00 15.31 O ATOM 255 CB GLN A 17 -2.328 -22.414 -20.116 1.00 44.40 C ATOM 256 CG GLN A 17 -1.087 -21.532 -20.017 1.00 20.35 C ATOM 257 CD GLN A 17 -1.366 -20.197 -19.344 1.00 71.40 C ATOM 258 OE1 GLN A 17 -1.268 -20.070 -18.121 1.00 24.53 O ATOM 259 NE2 GLN A 17 -1.716 -19.195 -20.137 1.00 70.42 N ATOM 0 H GLN A 17 -2.411 -23.239 -22.743 1.00 5.12 H new ATOM 0 HA GLN A 17 -1.241 -24.260 -20.215 1.00 31.24 H new ATOM 0 HB2 GLN A 17 -3.086 -21.893 -20.701 1.00 44.40 H new ATOM 0 HB3 GLN A 17 -2.740 -22.559 -19.117 1.00 44.40 H new ATOM 0 HG2 GLN A 17 -0.314 -22.061 -19.459 1.00 20.35 H new ATOM 0 HG3 GLN A 17 -0.692 -21.354 -21.017 1.00 20.35 H new ATOM 0 HE21 GLN A 17 -1.785 -19.342 -21.144 1.00 70.42 H new ATOM 0 HE22 GLN A 17 -1.916 -18.277 -19.741 1.00 70.42 H new ATOM 268 N GLY A 18 -3.686 -24.994 -19.399 1.00 22.20 N ATOM 269 CA GLY A 18 -4.836 -25.851 -19.161 1.00 74.21 C ATOM 270 C GLY A 18 -6.149 -25.086 -19.200 1.00 24.32 C ATOM 271 O GLY A 18 -6.199 -23.955 -19.689 1.00 62.33 O ATOM 0 H GLY A 18 -3.214 -24.673 -18.554 1.00 22.20 H new ATOM 0 HA2 GLY A 18 -4.857 -26.642 -19.911 1.00 74.21 H new ATOM 0 HA3 GLY A 18 -4.730 -26.335 -18.190 1.00 74.21 H new ATOM 275 N PRO A 19 -7.235 -25.675 -18.670 1.00 54.21 N ATOM 276 CA PRO A 19 -8.563 -25.049 -18.670 1.00 75.33 C ATOM 277 C PRO A 19 -8.743 -24.040 -17.532 1.00 4.25 C ATOM 278 O PRO A 19 -9.868 -23.697 -17.169 1.00 21.34 O ATOM 279 CB PRO A 19 -9.495 -26.251 -18.484 1.00 30.43 C ATOM 280 CG PRO A 19 -8.706 -27.203 -17.645 1.00 41.32 C ATOM 281 CD PRO A 19 -7.258 -27.012 -18.037 1.00 21.44 C ATOM 0 HA PRO A 19 -8.750 -24.471 -19.575 1.00 75.33 H new ATOM 0 HB2 PRO A 19 -10.423 -25.962 -17.992 1.00 30.43 H new ATOM 0 HB3 PRO A 19 -9.767 -26.696 -19.441 1.00 30.43 H new ATOM 0 HG2 PRO A 19 -8.852 -27.000 -16.584 1.00 41.32 H new ATOM 0 HG3 PRO A 19 -9.024 -28.231 -17.819 1.00 41.32 H new ATOM 0 HD2 PRO A 19 -6.600 -27.055 -17.169 1.00 21.44 H new ATOM 0 HD3 PRO A 19 -6.925 -27.787 -18.728 1.00 21.44 H new ATOM 289 N GLY A 20 -7.629 -23.567 -16.975 1.00 0.13 N ATOM 290 CA GLY A 20 -7.684 -22.620 -15.872 1.00 11.40 C ATOM 291 C GLY A 20 -7.897 -23.305 -14.535 1.00 30.41 C ATOM 292 O GLY A 20 -8.140 -22.648 -13.521 1.00 31.00 O ATOM 0 H GLY A 20 -6.687 -23.824 -17.269 1.00 0.13 H new ATOM 0 HA2 GLY A 20 -6.757 -22.048 -15.841 1.00 11.40 H new ATOM 0 HA3 GLY A 20 -8.492 -21.909 -16.046 1.00 11.40 H new ATOM 296 N SER A 21 -7.797 -24.629 -14.535 1.00 65.42 N ATOM 297 CA SER A 21 -7.980 -25.424 -13.328 1.00 70.35 C ATOM 298 C SER A 21 -7.123 -26.684 -13.398 1.00 61.03 C ATOM 299 O SER A 21 -6.744 -27.125 -14.486 1.00 35.42 O ATOM 300 CB SER A 21 -9.463 -25.794 -13.156 1.00 2.21 C ATOM 301 OG SER A 21 -9.680 -26.549 -11.973 1.00 14.23 O ATOM 0 H SER A 21 -7.588 -25.179 -15.368 1.00 65.42 H new ATOM 0 HA SER A 21 -7.667 -24.835 -12.466 1.00 70.35 H new ATOM 0 HB2 SER A 21 -10.064 -24.885 -13.124 1.00 2.21 H new ATOM 0 HB3 SER A 21 -9.798 -26.367 -14.021 1.00 2.21 H new ATOM 0 HG SER A 21 -10.632 -26.766 -11.893 1.00 14.23 H new ATOM 307 N MET A 22 -6.807 -27.248 -12.232 1.00 71.32 N ATOM 308 CA MET A 22 -6.041 -28.492 -12.156 1.00 14.44 C ATOM 309 C MET A 22 -6.904 -29.683 -12.561 1.00 34.21 C ATOM 310 O MET A 22 -6.389 -30.744 -12.924 1.00 25.22 O ATOM 311 CB MET A 22 -5.491 -28.704 -10.739 1.00 32.01 C ATOM 312 CG MET A 22 -4.394 -27.723 -10.352 1.00 64.35 C ATOM 313 SD MET A 22 -2.906 -27.898 -11.363 1.00 62.34 S ATOM 314 CE MET A 22 -2.414 -29.577 -10.970 1.00 41.55 C ATOM 0 H MET A 22 -7.070 -26.862 -11.325 1.00 71.32 H new ATOM 0 HA MET A 22 -5.204 -28.414 -12.850 1.00 14.44 H new ATOM 0 HB2 MET A 22 -6.310 -28.619 -10.025 1.00 32.01 H new ATOM 0 HB3 MET A 22 -5.102 -29.719 -10.658 1.00 32.01 H new ATOM 0 HG2 MET A 22 -4.774 -26.706 -10.446 1.00 64.35 H new ATOM 0 HG3 MET A 22 -4.134 -27.871 -9.304 1.00 64.35 H new ATOM 0 HE1 MET A 22 -1.361 -29.715 -11.216 1.00 41.55 H new ATOM 0 HE2 MET A 22 -2.565 -29.761 -9.906 1.00 41.55 H new ATOM 0 HE3 MET A 22 -3.016 -30.277 -11.549 1.00 41.55 H new ATOM 324 N ILE A 23 -8.222 -29.502 -12.490 1.00 11.52 N ATOM 325 CA ILE A 23 -9.163 -30.538 -12.891 1.00 62.20 C ATOM 326 C ILE A 23 -9.254 -30.555 -14.416 1.00 11.52 C ATOM 327 O ILE A 23 -10.085 -29.862 -15.011 1.00 51.53 O ATOM 328 CB ILE A 23 -10.571 -30.307 -12.277 1.00 4.53 C ATOM 329 CG1 ILE A 23 -10.463 -29.934 -10.785 1.00 14.53 C ATOM 330 CG2 ILE A 23 -11.445 -31.548 -12.459 1.00 3.25 C ATOM 331 CD1 ILE A 23 -9.786 -30.985 -9.928 1.00 12.43 C ATOM 0 H ILE A 23 -8.660 -28.643 -12.157 1.00 11.52 H new ATOM 0 HA ILE A 23 -8.802 -31.498 -12.521 1.00 62.20 H new ATOM 0 HB ILE A 23 -11.040 -29.475 -12.802 1.00 4.53 H new ATOM 0 HG12 ILE A 23 -9.912 -28.998 -10.695 1.00 14.53 H new ATOM 0 HG13 ILE A 23 -11.464 -29.753 -10.394 1.00 14.53 H new ATOM 0 HG21 ILE A 23 -12.428 -31.368 -12.023 1.00 3.25 H new ATOM 0 HG22 ILE A 23 -11.554 -31.764 -13.522 1.00 3.25 H new ATOM 0 HG23 ILE A 23 -10.978 -32.398 -11.962 1.00 3.25 H new ATOM 0 HD11 ILE A 23 -9.751 -30.644 -8.893 1.00 12.43 H new ATOM 0 HD12 ILE A 23 -10.348 -31.917 -9.984 1.00 12.43 H new ATOM 0 HD13 ILE A 23 -8.771 -31.151 -10.290 1.00 12.43 H new ATOM 343 N GLU A 24 -8.368 -31.323 -15.035 1.00 63.12 N ATOM 344 CA GLU A 24 -8.200 -31.300 -16.486 1.00 10.03 C ATOM 345 C GLU A 24 -9.345 -32.027 -17.190 1.00 51.50 C ATOM 346 O GLU A 24 -9.480 -33.245 -17.080 1.00 10.23 O ATOM 347 CB GLU A 24 -6.851 -31.935 -16.854 1.00 41.42 C ATOM 348 CG GLU A 24 -6.520 -31.893 -18.342 1.00 40.21 C ATOM 349 CD GLU A 24 -5.135 -32.449 -18.639 1.00 32.25 C ATOM 350 OE1 GLU A 24 -5.029 -33.608 -19.083 1.00 35.10 O ATOM 351 OE2 GLU A 24 -4.138 -31.732 -18.405 1.00 70.14 O1- ATOM 0 H GLU A 24 -7.749 -31.975 -14.553 1.00 63.12 H new ATOM 0 HA GLU A 24 -8.216 -30.263 -16.822 1.00 10.03 H new ATOM 0 HB2 GLU A 24 -6.061 -31.424 -16.304 1.00 41.42 H new ATOM 0 HB3 GLU A 24 -6.850 -32.974 -16.523 1.00 41.42 H new ATOM 0 HG2 GLU A 24 -7.265 -32.465 -18.894 1.00 40.21 H new ATOM 0 HG3 GLU A 24 -6.580 -30.864 -18.697 1.00 40.21 H new ATOM 358 N GLN A 25 -10.169 -31.269 -17.911 1.00 3.42 N ATOM 359 CA GLN A 25 -11.271 -31.839 -18.681 1.00 70.21 C ATOM 360 C GLN A 25 -10.721 -32.562 -19.909 1.00 62.55 C ATOM 361 O GLN A 25 -9.872 -32.024 -20.627 1.00 71.41 O ATOM 362 CB GLN A 25 -12.268 -30.742 -19.099 1.00 35.52 C ATOM 363 CG GLN A 25 -11.685 -29.690 -20.040 1.00 35.52 C ATOM 364 CD GLN A 25 -12.714 -28.669 -20.499 1.00 34.41 C ATOM 365 OE1 GLN A 25 -13.905 -28.963 -20.589 1.00 41.35 O ATOM 366 NE2 GLN A 25 -12.257 -27.468 -20.821 1.00 13.53 N ATOM 0 H GLN A 25 -10.093 -30.254 -17.978 1.00 3.42 H new ATOM 0 HA GLN A 25 -11.804 -32.556 -18.056 1.00 70.21 H new ATOM 0 HB2 GLN A 25 -13.125 -31.211 -19.583 1.00 35.52 H new ATOM 0 HB3 GLN A 25 -12.641 -30.245 -18.203 1.00 35.52 H new ATOM 0 HG2 GLN A 25 -10.868 -29.173 -19.537 1.00 35.52 H new ATOM 0 HG3 GLN A 25 -11.259 -30.186 -20.912 1.00 35.52 H new ATOM 0 HE21 GLN A 25 -11.262 -27.261 -20.733 1.00 13.53 H new ATOM 0 HE22 GLN A 25 -12.900 -26.751 -21.157 1.00 13.53 H new ATOM 375 N ILE A 26 -11.189 -33.780 -20.143 1.00 73.45 N ATOM 376 CA ILE A 26 -10.684 -34.596 -21.244 1.00 30.23 C ATOM 377 C ILE A 26 -11.832 -35.217 -22.034 1.00 44.22 C ATOM 378 O ILE A 26 -12.960 -35.304 -21.545 1.00 73.54 O ATOM 379 CB ILE A 26 -9.735 -35.715 -20.736 1.00 32.02 C ATOM 380 CG1 ILE A 26 -10.466 -36.650 -19.757 1.00 24.53 C ATOM 381 CG2 ILE A 26 -8.493 -35.106 -20.081 1.00 54.44 C ATOM 382 CD1 ILE A 26 -9.632 -37.823 -19.288 1.00 35.42 C ATOM 0 H ILE A 26 -11.918 -34.227 -19.587 1.00 73.45 H new ATOM 0 HA ILE A 26 -10.118 -33.934 -21.899 1.00 30.23 H new ATOM 0 HB ILE A 26 -9.416 -36.309 -21.593 1.00 32.02 H new ATOM 0 HG12 ILE A 26 -10.784 -36.073 -18.889 1.00 24.53 H new ATOM 0 HG13 ILE A 26 -11.369 -37.028 -20.237 1.00 24.53 H new ATOM 0 HG21 ILE A 26 -7.838 -35.904 -19.730 1.00 54.44 H new ATOM 0 HG22 ILE A 26 -7.961 -34.494 -20.809 1.00 54.44 H new ATOM 0 HG23 ILE A 26 -8.794 -34.486 -19.236 1.00 54.44 H new ATOM 0 HD11 ILE A 26 -10.218 -38.434 -18.601 1.00 35.42 H new ATOM 0 HD12 ILE A 26 -9.335 -38.425 -20.147 1.00 35.42 H new ATOM 0 HD13 ILE A 26 -8.742 -37.456 -18.778 1.00 35.42 H new ATOM 394 N GLY A 27 -11.535 -35.632 -23.262 1.00 62.23 N ATOM 395 CA GLY A 27 -12.536 -36.221 -24.132 1.00 35.05 C ATOM 396 C GLY A 27 -12.582 -37.735 -24.041 1.00 75.43 C ATOM 397 O GLY A 27 -11.836 -38.347 -23.269 1.00 55.43 O ATOM 0 H GLY A 27 -10.604 -35.569 -23.674 1.00 62.23 H new ATOM 0 HA2 GLY A 27 -13.515 -35.817 -23.876 1.00 35.05 H new ATOM 0 HA3 GLY A 27 -12.331 -35.930 -25.162 1.00 35.05 H new ATOM 401 N ASP A 28 -13.445 -38.327 -24.859 1.00 55.22 N ATOM 402 CA ASP A 28 -13.684 -39.772 -24.855 1.00 30.13 C ATOM 403 C ASP A 28 -12.418 -40.554 -25.213 1.00 31.43 C ATOM 404 O ASP A 28 -12.104 -41.567 -24.581 1.00 52.43 O ATOM 405 CB ASP A 28 -14.810 -40.115 -25.841 1.00 2.44 C ATOM 406 CG ASP A 28 -15.147 -41.601 -25.864 1.00 31.34 C ATOM 407 OD1 ASP A 28 -15.729 -42.101 -24.877 1.00 33.35 O ATOM 408 OD2 ASP A 28 -14.846 -42.276 -26.874 1.00 65.03 O1- ATOM 0 H ASP A 28 -14.002 -37.820 -25.547 1.00 55.22 H new ATOM 0 HA ASP A 28 -13.979 -40.062 -23.846 1.00 30.13 H new ATOM 0 HB2 ASP A 28 -15.703 -39.549 -25.576 1.00 2.44 H new ATOM 0 HB3 ASP A 28 -14.518 -39.798 -26.842 1.00 2.44 H new ATOM 413 N SER A 29 -11.694 -40.081 -26.224 1.00 43.14 N ATOM 414 CA SER A 29 -10.470 -40.743 -26.668 1.00 21.41 C ATOM 415 C SER A 29 -9.334 -40.499 -25.675 1.00 74.42 C ATOM 416 O SER A 29 -8.521 -41.388 -25.406 1.00 31.25 O ATOM 417 CB SER A 29 -10.076 -40.240 -28.062 1.00 13.32 C ATOM 418 OG SER A 29 -11.112 -40.478 -29.000 1.00 44.32 O ATOM 0 H SER A 29 -11.934 -39.242 -26.752 1.00 43.14 H new ATOM 0 HA SER A 29 -10.655 -41.816 -26.719 1.00 21.41 H new ATOM 0 HB2 SER A 29 -9.858 -39.173 -28.019 1.00 13.32 H new ATOM 0 HB3 SER A 29 -9.164 -40.739 -28.388 1.00 13.32 H new ATOM 0 HG SER A 29 -10.838 -40.147 -29.881 1.00 44.32 H new ATOM 424 N GLU A 30 -9.301 -39.291 -25.119 1.00 44.24 N ATOM 425 CA GLU A 30 -8.272 -38.907 -24.161 1.00 41.13 C ATOM 426 C GLU A 30 -8.366 -39.756 -22.897 1.00 44.35 C ATOM 427 O GLU A 30 -7.369 -39.951 -22.214 1.00 55.03 O ATOM 428 CB GLU A 30 -8.387 -37.419 -23.799 1.00 34.32 C ATOM 429 CG GLU A 30 -8.247 -36.483 -24.994 1.00 30.32 C ATOM 430 CD GLU A 30 -8.210 -35.017 -24.590 1.00 70.04 C ATOM 431 OE1 GLU A 30 -9.286 -34.397 -24.474 1.00 75.54 O ATOM 432 OE2 GLU A 30 -7.103 -34.478 -24.391 1.00 72.31 O1- ATOM 0 H GLU A 30 -9.981 -38.557 -25.318 1.00 44.24 H new ATOM 0 HA GLU A 30 -7.303 -39.078 -24.629 1.00 41.13 H new ATOM 0 HB2 GLU A 30 -9.352 -37.244 -23.323 1.00 34.32 H new ATOM 0 HB3 GLU A 30 -7.620 -37.173 -23.065 1.00 34.32 H new ATOM 0 HG2 GLU A 30 -7.335 -36.729 -25.538 1.00 30.32 H new ATOM 0 HG3 GLU A 30 -9.080 -36.646 -25.678 1.00 30.32 H new ATOM 439 N PHE A 31 -9.566 -40.254 -22.600 1.00 52.35 N ATOM 440 CA PHE A 31 -9.798 -41.083 -21.415 1.00 4.33 C ATOM 441 C PHE A 31 -8.715 -42.157 -21.272 1.00 54.44 C ATOM 442 O PHE A 31 -7.953 -42.159 -20.298 1.00 42.52 O ATOM 443 CB PHE A 31 -11.190 -41.736 -21.489 1.00 52.22 C ATOM 444 CG PHE A 31 -11.495 -42.672 -20.341 1.00 11.55 C ATOM 445 CD1 PHE A 31 -11.486 -44.051 -20.525 1.00 31.15 C ATOM 446 CD2 PHE A 31 -11.786 -42.173 -19.077 1.00 33.32 C ATOM 447 CE1 PHE A 31 -11.761 -44.906 -19.473 1.00 3.32 C ATOM 448 CE2 PHE A 31 -12.062 -43.026 -18.025 1.00 65.25 C ATOM 449 CZ PHE A 31 -12.048 -44.394 -18.222 1.00 11.43 C ATOM 0 H PHE A 31 -10.399 -40.097 -23.168 1.00 52.35 H new ATOM 0 HA PHE A 31 -9.753 -40.440 -20.536 1.00 4.33 H new ATOM 0 HB2 PHE A 31 -11.946 -40.952 -21.515 1.00 52.22 H new ATOM 0 HB3 PHE A 31 -11.271 -42.288 -22.425 1.00 52.22 H new ATOM 0 HD1 PHE A 31 -11.262 -44.458 -21.500 1.00 31.15 H new ATOM 0 HD2 PHE A 31 -11.797 -41.105 -18.915 1.00 33.32 H new ATOM 0 HE1 PHE A 31 -11.751 -45.975 -19.629 1.00 3.32 H new ATOM 0 HE2 PHE A 31 -12.289 -42.623 -17.049 1.00 65.25 H new ATOM 0 HZ PHE A 31 -12.261 -45.061 -17.400 1.00 11.43 H new ATOM 459 N ASP A 32 -8.633 -43.038 -22.269 1.00 24.45 N ATOM 460 CA ASP A 32 -7.668 -44.137 -22.259 1.00 14.44 C ATOM 461 C ASP A 32 -6.250 -43.613 -22.073 1.00 54.45 C ATOM 462 O ASP A 32 -5.508 -44.079 -21.205 1.00 73.42 O ATOM 463 CB ASP A 32 -7.757 -44.939 -23.568 1.00 2.53 C ATOM 464 CG ASP A 32 -6.621 -45.945 -23.723 1.00 22.33 C ATOM 465 OD1 ASP A 32 -5.643 -45.644 -24.440 1.00 54.10 O ATOM 466 OD2 ASP A 32 -6.696 -47.040 -23.127 1.00 35.01 O1- ATOM 0 H ASP A 32 -9.227 -43.011 -23.098 1.00 24.45 H new ATOM 0 HA ASP A 32 -7.911 -44.790 -21.421 1.00 14.44 H new ATOM 0 HB2 ASP A 32 -8.710 -45.466 -23.602 1.00 2.53 H new ATOM 0 HB3 ASP A 32 -7.744 -44.250 -24.413 1.00 2.53 H new ATOM 471 N ASN A 33 -5.892 -42.627 -22.887 1.00 43.22 N ATOM 472 CA ASN A 33 -4.545 -42.064 -22.878 1.00 4.32 C ATOM 473 C ASN A 33 -4.182 -41.553 -21.487 1.00 12.24 C ATOM 474 O ASN A 33 -3.210 -41.999 -20.873 1.00 43.20 O ATOM 475 CB ASN A 33 -4.449 -40.912 -23.886 1.00 4.00 C ATOM 476 CG ASN A 33 -3.019 -40.417 -24.062 1.00 1.45 C ATOM 477 OD1 ASN A 33 -2.582 -39.477 -23.392 1.00 34.52 O ATOM 478 ND2 ASN A 33 -2.275 -41.064 -24.945 1.00 23.04 N ATOM 0 H ASN A 33 -6.520 -42.198 -23.567 1.00 43.22 H new ATOM 0 HA ASN A 33 -3.845 -42.852 -23.157 1.00 4.32 H new ATOM 0 HB2 ASN A 33 -4.838 -41.241 -24.849 1.00 4.00 H new ATOM 0 HB3 ASN A 33 -5.079 -40.087 -23.553 1.00 4.00 H new ATOM 0 HD21 ASN A 33 -1.303 -40.791 -25.091 1.00 23.04 H new ATOM 0 HD22 ASN A 33 -2.673 -41.836 -25.479 1.00 23.04 H new ATOM 485 N LYS A 34 -5.007 -40.640 -20.989 1.00 32.10 N ATOM 486 CA LYS A 34 -4.769 -39.971 -19.717 1.00 63.34 C ATOM 487 C LYS A 34 -4.657 -40.980 -18.575 1.00 13.43 C ATOM 488 O LYS A 34 -3.759 -40.874 -17.739 1.00 20.22 O ATOM 489 CB LYS A 34 -5.898 -38.967 -19.440 1.00 42.13 C ATOM 490 CG LYS A 34 -6.025 -37.870 -20.499 1.00 54.23 C ATOM 491 CD LYS A 34 -4.856 -36.888 -20.458 1.00 2.25 C ATOM 492 CE LYS A 34 -5.023 -35.773 -21.486 1.00 10.31 C ATOM 493 NZ LYS A 34 -3.955 -34.742 -21.374 1.00 61.25 N1+ ATOM 0 H LYS A 34 -5.862 -40.342 -21.458 1.00 32.10 H new ATOM 0 HA LYS A 34 -3.821 -39.436 -19.780 1.00 63.34 H new ATOM 0 HB2 LYS A 34 -6.843 -39.506 -19.375 1.00 42.13 H new ATOM 0 HB3 LYS A 34 -5.728 -38.503 -18.469 1.00 42.13 H new ATOM 0 HG2 LYS A 34 -6.079 -38.326 -21.487 1.00 54.23 H new ATOM 0 HG3 LYS A 34 -6.958 -37.327 -20.347 1.00 54.23 H new ATOM 0 HD2 LYS A 34 -4.778 -36.455 -19.461 1.00 2.25 H new ATOM 0 HD3 LYS A 34 -3.925 -37.422 -20.647 1.00 2.25 H new ATOM 0 HE2 LYS A 34 -5.010 -36.200 -22.489 1.00 10.31 H new ATOM 0 HE3 LYS A 34 -5.997 -35.301 -21.353 1.00 10.31 H new ATOM 0 HZ1 LYS A 34 -3.940 -34.162 -22.237 1.00 61.25 H new ATOM 0 HZ2 LYS A 34 -4.144 -34.134 -20.552 1.00 61.25 H new ATOM 0 HZ3 LYS A 34 -3.033 -35.209 -21.255 1.00 61.25 H new ATOM 507 N VAL A 35 -5.557 -41.963 -18.553 1.00 1.14 N ATOM 508 CA VAL A 35 -5.558 -42.976 -17.496 1.00 22.00 C ATOM 509 C VAL A 35 -4.279 -43.820 -17.532 1.00 74.14 C ATOM 510 O VAL A 35 -3.626 -44.017 -16.506 1.00 12.35 O ATOM 511 CB VAL A 35 -6.800 -43.906 -17.591 1.00 71.34 C ATOM 512 CG1 VAL A 35 -6.712 -45.055 -16.586 1.00 55.41 C ATOM 513 CG2 VAL A 35 -8.088 -43.110 -17.384 1.00 4.12 C ATOM 0 H VAL A 35 -6.292 -42.080 -19.251 1.00 1.14 H new ATOM 0 HA VAL A 35 -5.600 -42.439 -16.548 1.00 22.00 H new ATOM 0 HB VAL A 35 -6.816 -44.337 -18.592 1.00 71.34 H new ATOM 0 HG11 VAL A 35 -7.595 -45.687 -16.678 1.00 55.41 H new ATOM 0 HG12 VAL A 35 -5.819 -45.647 -16.788 1.00 55.41 H new ATOM 0 HG13 VAL A 35 -6.658 -44.651 -15.575 1.00 55.41 H new ATOM 0 HG21 VAL A 35 -8.945 -43.780 -17.454 1.00 4.12 H new ATOM 0 HG22 VAL A 35 -8.073 -42.643 -16.399 1.00 4.12 H new ATOM 0 HG23 VAL A 35 -8.166 -42.339 -18.150 1.00 4.12 H new ATOM 523 N THR A 36 -3.914 -44.303 -18.717 1.00 14.23 N ATOM 524 CA THR A 36 -2.741 -45.165 -18.860 1.00 5.43 C ATOM 525 C THR A 36 -1.439 -44.357 -18.821 1.00 53.41 C ATOM 526 O THR A 36 -0.358 -44.915 -18.626 1.00 51.32 O ATOM 527 CB THR A 36 -2.807 -45.999 -20.167 1.00 11.34 C ATOM 528 OG1 THR A 36 -2.944 -45.134 -21.305 1.00 35.24 O ATOM 529 CG2 THR A 36 -3.977 -46.978 -20.132 1.00 31.14 C ATOM 0 H THR A 36 -4.410 -44.114 -19.588 1.00 14.23 H new ATOM 0 HA THR A 36 -2.747 -45.849 -18.011 1.00 5.43 H new ATOM 0 HB THR A 36 -1.878 -46.564 -20.249 1.00 11.34 H new ATOM 0 HG1 THR A 36 -3.856 -44.776 -21.336 1.00 35.24 H new ATOM 0 HG21 THR A 36 -4.001 -47.550 -21.060 1.00 31.14 H new ATOM 0 HG22 THR A 36 -3.857 -47.658 -19.289 1.00 31.14 H new ATOM 0 HG23 THR A 36 -4.910 -46.426 -20.022 1.00 31.14 H new ATOM 537 N SER A 37 -1.556 -43.038 -18.986 1.00 74.54 N ATOM 538 CA SER A 37 -0.395 -42.144 -19.001 1.00 42.32 C ATOM 539 C SER A 37 0.259 -42.027 -17.615 1.00 73.45 C ATOM 540 O SER A 37 1.297 -41.377 -17.474 1.00 65.42 O ATOM 541 CB SER A 37 -0.816 -40.753 -19.508 1.00 1.24 C ATOM 542 OG SER A 37 0.305 -39.919 -19.750 1.00 11.40 O ATOM 0 H SER A 37 -2.449 -42.562 -19.112 1.00 74.54 H new ATOM 0 HA SER A 37 0.346 -42.572 -19.676 1.00 42.32 H new ATOM 0 HB2 SER A 37 -1.394 -40.860 -20.426 1.00 1.24 H new ATOM 0 HB3 SER A 37 -1.469 -40.281 -18.774 1.00 1.24 H new ATOM 0 HG SER A 37 1.033 -40.166 -19.143 1.00 11.40 H new ATOM 548 N CYS A 38 -0.352 -42.634 -16.598 1.00 31.04 N ATOM 549 CA CYS A 38 0.206 -42.617 -15.247 1.00 10.42 C ATOM 550 C CYS A 38 1.566 -43.318 -15.220 1.00 51.55 C ATOM 551 O CYS A 38 1.645 -44.542 -15.355 1.00 23.12 O ATOM 552 CB CYS A 38 -0.762 -43.288 -14.269 1.00 55.23 C ATOM 553 SG CYS A 38 -1.278 -44.942 -14.777 1.00 22.33 S ATOM 0 H CYS A 38 -1.232 -43.143 -16.684 1.00 31.04 H new ATOM 0 HA CYS A 38 0.349 -41.581 -14.941 1.00 10.42 H new ATOM 0 HB2 CYS A 38 -0.289 -43.350 -13.289 1.00 55.23 H new ATOM 0 HB3 CYS A 38 -1.646 -42.660 -14.158 1.00 55.23 H new ATOM 0 HG CYS A 38 -2.300 -44.852 -15.575 1.00 22.33 H new ATOM 559 N ASN A 39 2.632 -42.530 -15.059 1.00 72.42 N ATOM 560 CA ASN A 39 4.001 -43.052 -15.096 1.00 15.33 C ATOM 561 C ASN A 39 4.223 -44.130 -14.031 1.00 11.44 C ATOM 562 O ASN A 39 4.299 -45.321 -14.346 1.00 34.54 O ATOM 563 CB ASN A 39 5.026 -41.920 -14.907 1.00 42.12 C ATOM 564 CG ASN A 39 6.464 -42.411 -15.036 1.00 14.24 C ATOM 565 OD1 ASN A 39 6.760 -43.300 -15.835 1.00 23.53 O ATOM 566 ND2 ASN A 39 7.359 -41.855 -14.235 1.00 10.15 N ATOM 0 H ASN A 39 2.573 -41.524 -14.901 1.00 72.42 H new ATOM 0 HA ASN A 39 4.144 -43.504 -16.078 1.00 15.33 H new ATOM 0 HB2 ASN A 39 4.843 -41.141 -15.647 1.00 42.12 H new ATOM 0 HB3 ASN A 39 4.886 -41.467 -13.926 1.00 42.12 H new ATOM 0 HD21 ASN A 39 8.332 -42.161 -14.267 1.00 10.15 H new ATOM 0 HD22 ASN A 39 7.076 -41.121 -13.586 1.00 10.15 H new ATOM 573 N ASP A 40 4.319 -43.713 -12.770 1.00 2.41 N ATOM 574 CA ASP A 40 4.590 -44.644 -11.677 1.00 42.21 C ATOM 575 C ASP A 40 4.039 -44.110 -10.357 1.00 11.11 C ATOM 576 O ASP A 40 4.391 -43.014 -9.928 1.00 52.12 O ATOM 577 CB ASP A 40 6.101 -44.882 -11.566 1.00 54.20 C ATOM 578 CG ASP A 40 6.468 -45.826 -10.434 1.00 63.42 C ATOM 579 OD1 ASP A 40 6.176 -47.039 -10.546 1.00 24.22 O ATOM 580 OD2 ASP A 40 7.055 -45.364 -9.432 1.00 1.42 O1- ATOM 0 H ASP A 40 4.214 -42.741 -12.481 1.00 2.41 H new ATOM 0 HA ASP A 40 4.091 -45.589 -11.892 1.00 42.21 H new ATOM 0 HB2 ASP A 40 6.470 -45.290 -12.507 1.00 54.20 H new ATOM 0 HB3 ASP A 40 6.604 -43.927 -11.414 1.00 54.20 H new ATOM 585 N ASN A 41 3.155 -44.894 -9.735 1.00 20.22 N ATOM 586 CA ASN A 41 2.508 -44.541 -8.460 1.00 43.41 C ATOM 587 C ASN A 41 1.674 -43.266 -8.576 1.00 72.45 C ATOM 588 O ASN A 41 1.159 -42.759 -7.579 1.00 25.45 O ATOM 589 CB ASN A 41 3.539 -44.406 -7.325 1.00 53.22 C ATOM 590 CG ASN A 41 4.094 -45.747 -6.875 1.00 43.00 C ATOM 591 OD1 ASN A 41 3.527 -46.405 -6.003 1.00 12.13 O ATOM 592 ND2 ASN A 41 5.203 -46.163 -7.460 1.00 51.54 N ATOM 0 H ASN A 41 2.863 -45.800 -10.102 1.00 20.22 H new ATOM 0 HA ASN A 41 1.832 -45.360 -8.215 1.00 43.41 H new ATOM 0 HB2 ASN A 41 4.360 -43.771 -7.659 1.00 53.22 H new ATOM 0 HB3 ASN A 41 3.074 -43.906 -6.475 1.00 53.22 H new ATOM 0 HD21 ASN A 41 5.617 -47.056 -7.193 1.00 51.54 H new ATOM 0 HD22 ASN A 41 5.646 -45.591 -8.179 1.00 51.54 H new ATOM 599 N ILE A 42 1.515 -42.778 -9.800 1.00 4.44 N ATOM 600 CA ILE A 42 0.767 -41.555 -10.052 1.00 53.42 C ATOM 601 C ILE A 42 -0.728 -41.813 -9.897 1.00 61.41 C ATOM 602 O ILE A 42 -1.319 -42.577 -10.668 1.00 70.51 O ATOM 603 CB ILE A 42 1.056 -40.997 -11.472 1.00 60.24 C ATOM 604 CG1 ILE A 42 2.563 -40.727 -11.653 1.00 24.42 C ATOM 605 CG2 ILE A 42 0.244 -39.725 -11.733 1.00 31.35 C ATOM 606 CD1 ILE A 42 3.130 -39.698 -10.697 1.00 11.11 C ATOM 0 H ILE A 42 1.898 -43.215 -10.638 1.00 4.44 H new ATOM 0 HA ILE A 42 1.087 -40.812 -9.321 1.00 53.42 H new ATOM 0 HB ILE A 42 0.752 -41.749 -12.201 1.00 60.24 H new ATOM 0 HG12 ILE A 42 3.106 -41.663 -11.525 1.00 24.42 H new ATOM 0 HG13 ILE A 42 2.740 -40.393 -12.675 1.00 24.42 H new ATOM 0 HG21 ILE A 42 0.463 -39.352 -12.734 1.00 31.35 H new ATOM 0 HG22 ILE A 42 -0.820 -39.950 -11.654 1.00 31.35 H new ATOM 0 HG23 ILE A 42 0.510 -38.966 -10.997 1.00 31.35 H new ATOM 0 HD11 ILE A 42 4.195 -39.568 -10.892 1.00 11.11 H new ATOM 0 HD12 ILE A 42 2.616 -38.747 -10.839 1.00 11.11 H new ATOM 0 HD13 ILE A 42 2.988 -40.037 -9.671 1.00 11.11 H new ATOM 618 N LEU A 43 -1.325 -41.194 -8.889 1.00 61.41 N ATOM 619 CA LEU A 43 -2.743 -41.373 -8.605 1.00 72.33 C ATOM 620 C LEU A 43 -3.569 -40.461 -9.514 1.00 70.42 C ATOM 621 O LEU A 43 -3.427 -39.231 -9.486 1.00 24.44 O ATOM 622 CB LEU A 43 -3.040 -41.075 -7.121 1.00 53.01 C ATOM 623 CG LEU A 43 -4.161 -41.922 -6.473 1.00 15.11 C ATOM 624 CD1 LEU A 43 -4.381 -41.505 -5.024 1.00 20.34 C ATOM 625 CD2 LEU A 43 -5.465 -41.830 -7.265 1.00 60.11 C ATOM 0 H LEU A 43 -0.846 -40.559 -8.250 1.00 61.41 H new ATOM 0 HA LEU A 43 -3.016 -42.410 -8.802 1.00 72.33 H new ATOM 0 HB2 LEU A 43 -2.123 -41.223 -6.550 1.00 53.01 H new ATOM 0 HB3 LEU A 43 -3.307 -40.022 -7.028 1.00 53.01 H new ATOM 0 HG LEU A 43 -3.838 -42.963 -6.489 1.00 15.11 H new ATOM 0 HD11 LEU A 43 -5.173 -42.113 -4.587 1.00 20.34 H new ATOM 0 HD12 LEU A 43 -3.460 -41.649 -4.460 1.00 20.34 H new ATOM 0 HD13 LEU A 43 -4.668 -40.454 -4.987 1.00 20.34 H new ATOM 0 HD21 LEU A 43 -6.229 -42.438 -6.780 1.00 60.11 H new ATOM 0 HD22 LEU A 43 -5.796 -40.792 -7.302 1.00 60.11 H new ATOM 0 HD23 LEU A 43 -5.301 -42.195 -8.279 1.00 60.11 H new ATOM 637 N ILE A 44 -4.417 -41.077 -10.325 1.00 53.43 N ATOM 638 CA ILE A 44 -5.305 -40.360 -11.227 1.00 3.43 C ATOM 639 C ILE A 44 -6.737 -40.390 -10.702 1.00 52.32 C ATOM 640 O ILE A 44 -7.317 -41.463 -10.517 1.00 63.21 O ATOM 641 CB ILE A 44 -5.264 -40.977 -12.649 1.00 54.14 C ATOM 642 CG1 ILE A 44 -3.886 -40.733 -13.291 1.00 72.45 C ATOM 643 CG2 ILE A 44 -6.389 -40.419 -13.524 1.00 35.25 C ATOM 644 CD1 ILE A 44 -3.744 -41.327 -14.674 1.00 52.24 C ATOM 0 H ILE A 44 -4.508 -42.092 -10.376 1.00 53.43 H new ATOM 0 HA ILE A 44 -4.962 -39.327 -11.281 1.00 3.43 H new ATOM 0 HB ILE A 44 -5.420 -42.053 -12.565 1.00 54.14 H new ATOM 0 HG12 ILE A 44 -3.706 -39.659 -13.347 1.00 72.45 H new ATOM 0 HG13 ILE A 44 -3.115 -41.152 -12.645 1.00 72.45 H new ATOM 0 HG21 ILE A 44 -6.336 -40.869 -14.515 1.00 35.25 H new ATOM 0 HG22 ILE A 44 -7.352 -40.652 -13.071 1.00 35.25 H new ATOM 0 HG23 ILE A 44 -6.281 -39.338 -13.610 1.00 35.25 H new ATOM 0 HD11 ILE A 44 -2.747 -41.114 -15.061 1.00 52.24 H new ATOM 0 HD12 ILE A 44 -3.891 -42.406 -14.623 1.00 52.24 H new ATOM 0 HD13 ILE A 44 -4.491 -40.890 -15.336 1.00 52.24 H new ATOM 656 N LEU A 45 -7.293 -39.212 -10.448 1.00 65.44 N ATOM 657 CA LEU A 45 -8.679 -39.092 -10.007 1.00 1.02 C ATOM 658 C LEU A 45 -9.533 -38.615 -11.175 1.00 41.11 C ATOM 659 O LEU A 45 -9.117 -37.742 -11.938 1.00 73.21 O ATOM 660 CB LEU A 45 -8.822 -38.114 -8.822 1.00 45.12 C ATOM 661 CG LEU A 45 -8.049 -38.475 -7.536 1.00 11.25 C ATOM 662 CD1 LEU A 45 -6.541 -38.323 -7.724 1.00 71.43 C ATOM 663 CD2 LEU A 45 -8.537 -37.618 -6.369 1.00 43.24 C ATOM 0 H LEU A 45 -6.804 -38.322 -10.540 1.00 65.44 H new ATOM 0 HA LEU A 45 -9.015 -40.071 -9.666 1.00 1.02 H new ATOM 0 HB2 LEU A 45 -8.495 -37.128 -9.152 1.00 45.12 H new ATOM 0 HB3 LEU A 45 -9.880 -38.032 -8.573 1.00 45.12 H new ATOM 0 HG LEU A 45 -8.245 -39.523 -7.310 1.00 11.25 H new ATOM 0 HD11 LEU A 45 -6.031 -38.586 -6.798 1.00 71.43 H new ATOM 0 HD12 LEU A 45 -6.206 -38.984 -8.523 1.00 71.43 H new ATOM 0 HD13 LEU A 45 -6.309 -37.291 -7.986 1.00 71.43 H new ATOM 0 HD21 LEU A 45 -7.984 -37.882 -5.468 1.00 43.24 H new ATOM 0 HD22 LEU A 45 -8.375 -36.565 -6.598 1.00 43.24 H new ATOM 0 HD23 LEU A 45 -9.600 -37.795 -6.207 1.00 43.24 H new ATOM 675 N VAL A 46 -10.710 -39.200 -11.326 1.00 52.30 N ATOM 676 CA VAL A 46 -11.629 -38.820 -12.392 1.00 52.42 C ATOM 677 C VAL A 46 -12.904 -38.228 -11.798 1.00 21.23 C ATOM 678 O VAL A 46 -13.696 -38.942 -11.180 1.00 14.33 O ATOM 679 CB VAL A 46 -11.990 -40.030 -13.291 1.00 13.25 C ATOM 680 CG1 VAL A 46 -12.984 -39.620 -14.377 1.00 25.32 C ATOM 681 CG2 VAL A 46 -10.730 -40.644 -13.907 1.00 72.45 C ATOM 0 H VAL A 46 -11.055 -39.945 -10.721 1.00 52.30 H new ATOM 0 HA VAL A 46 -11.129 -38.074 -13.009 1.00 52.42 H new ATOM 0 HB VAL A 46 -12.464 -40.788 -12.668 1.00 13.25 H new ATOM 0 HG11 VAL A 46 -13.223 -40.484 -14.996 1.00 25.32 H new ATOM 0 HG12 VAL A 46 -13.895 -39.243 -13.913 1.00 25.32 H new ATOM 0 HG13 VAL A 46 -12.543 -38.840 -14.998 1.00 25.32 H new ATOM 0 HG21 VAL A 46 -11.007 -41.491 -14.534 1.00 72.45 H new ATOM 0 HG22 VAL A 46 -10.220 -39.896 -14.513 1.00 72.45 H new ATOM 0 HG23 VAL A 46 -10.065 -40.983 -13.113 1.00 72.45 H new ATOM 691 N ASP A 47 -13.078 -36.924 -11.970 1.00 11.12 N ATOM 692 CA ASP A 47 -14.258 -36.221 -11.464 1.00 51.13 C ATOM 693 C ASP A 47 -15.417 -36.261 -12.459 1.00 54.22 C ATOM 694 O ASP A 47 -15.257 -35.920 -13.635 1.00 62.13 O ATOM 695 CB ASP A 47 -13.911 -34.759 -11.139 1.00 0.54 C ATOM 696 CG ASP A 47 -15.150 -33.902 -10.894 1.00 13.50 C ATOM 697 OD1 ASP A 47 -15.758 -34.021 -9.814 1.00 30.41 O ATOM 698 OD2 ASP A 47 -15.509 -33.103 -11.790 1.00 0.25 O1- ATOM 0 H ASP A 47 -12.413 -36.325 -12.459 1.00 11.12 H new ATOM 0 HA ASP A 47 -14.574 -36.735 -10.556 1.00 51.13 H new ATOM 0 HB2 ASP A 47 -13.272 -34.729 -10.256 1.00 0.54 H new ATOM 0 HB3 ASP A 47 -13.337 -34.334 -11.962 1.00 0.54 H new ATOM 703 N PHE A 48 -16.582 -36.690 -11.979 1.00 33.43 N ATOM 704 CA PHE A 48 -17.820 -36.589 -12.745 1.00 51.34 C ATOM 705 C PHE A 48 -18.632 -35.403 -12.240 1.00 61.52 C ATOM 706 O PHE A 48 -19.467 -35.538 -11.340 1.00 13.11 O ATOM 707 CB PHE A 48 -18.640 -37.886 -12.657 1.00 65.22 C ATOM 708 CG PHE A 48 -18.111 -38.989 -13.540 1.00 13.55 C ATOM 709 CD1 PHE A 48 -16.955 -39.676 -13.203 1.00 62.52 C ATOM 710 CD2 PHE A 48 -18.768 -39.331 -14.715 1.00 12.32 C ATOM 711 CE1 PHE A 48 -16.467 -40.680 -14.016 1.00 14.23 C ATOM 712 CE2 PHE A 48 -18.281 -40.336 -15.531 1.00 3.03 C ATOM 713 CZ PHE A 48 -17.130 -41.011 -15.180 1.00 0.02 C ATOM 0 H PHE A 48 -16.694 -37.113 -11.058 1.00 33.43 H new ATOM 0 HA PHE A 48 -17.569 -36.434 -13.794 1.00 51.34 H new ATOM 0 HB2 PHE A 48 -18.650 -38.231 -11.623 1.00 65.22 H new ATOM 0 HB3 PHE A 48 -19.673 -37.674 -12.933 1.00 65.22 H new ATOM 0 HD1 PHE A 48 -16.430 -39.423 -12.294 1.00 62.52 H new ATOM 0 HD2 PHE A 48 -19.669 -38.806 -14.995 1.00 12.32 H new ATOM 0 HE1 PHE A 48 -15.565 -41.207 -13.740 1.00 14.23 H new ATOM 0 HE2 PHE A 48 -18.801 -40.592 -16.442 1.00 3.03 H new ATOM 0 HZ PHE A 48 -16.749 -41.797 -15.815 1.00 0.02 H new ATOM 723 N TRP A 49 -18.347 -34.234 -12.806 1.00 62.40 N ATOM 724 CA TRP A 49 -19.018 -32.999 -12.424 1.00 3.51 C ATOM 725 C TRP A 49 -20.503 -33.061 -12.788 1.00 41.31 C ATOM 726 O TRP A 49 -20.860 -33.230 -13.958 1.00 63.54 O ATOM 727 CB TRP A 49 -18.342 -31.805 -13.120 1.00 40.21 C ATOM 728 CG TRP A 49 -18.868 -30.466 -12.685 1.00 42.53 C ATOM 729 CD1 TRP A 49 -18.476 -29.745 -11.593 1.00 65.23 C ATOM 730 CD2 TRP A 49 -19.875 -29.684 -13.343 1.00 72.13 C ATOM 731 NE1 TRP A 49 -19.180 -28.568 -11.529 1.00 33.30 N ATOM 732 CE2 TRP A 49 -20.046 -28.507 -12.591 1.00 34.35 C ATOM 733 CE3 TRP A 49 -20.651 -29.869 -14.493 1.00 22.14 C ATOM 734 CZ2 TRP A 49 -20.958 -27.516 -12.954 1.00 54.21 C ATOM 735 CZ3 TRP A 49 -21.555 -28.885 -14.852 1.00 74.34 C ATOM 736 CH2 TRP A 49 -21.703 -27.723 -14.084 1.00 43.42 C ATOM 0 H TRP A 49 -17.647 -34.118 -13.539 1.00 62.40 H new ATOM 0 HA TRP A 49 -18.938 -32.872 -11.344 1.00 3.51 H new ATOM 0 HB2 TRP A 49 -17.270 -31.843 -12.926 1.00 40.21 H new ATOM 0 HB3 TRP A 49 -18.474 -31.903 -14.197 1.00 40.21 H new ATOM 0 HD1 TRP A 49 -17.723 -30.055 -10.884 1.00 65.23 H new ATOM 0 HE1 TRP A 49 -19.076 -27.854 -10.808 1.00 33.30 H new ATOM 0 HE3 TRP A 49 -20.546 -30.763 -15.089 1.00 22.14 H new ATOM 0 HZ2 TRP A 49 -21.072 -26.618 -12.365 1.00 54.21 H new ATOM 0 HZ3 TRP A 49 -22.157 -29.015 -15.739 1.00 74.34 H new ATOM 0 HH2 TRP A 49 -22.420 -26.975 -14.389 1.00 43.42 H new ATOM 747 N ALA A 50 -21.359 -32.941 -11.781 1.00 41.34 N ATOM 748 CA ALA A 50 -22.804 -32.966 -11.983 1.00 51.22 C ATOM 749 C ALA A 50 -23.338 -31.547 -12.192 1.00 20.23 C ATOM 750 O ALA A 50 -22.839 -30.602 -11.578 1.00 33.32 O ATOM 751 CB ALA A 50 -23.488 -33.631 -10.795 1.00 54.33 C ATOM 0 H ALA A 50 -21.075 -32.824 -10.808 1.00 41.34 H new ATOM 0 HA ALA A 50 -23.024 -33.548 -12.878 1.00 51.22 H new ATOM 0 HB1 ALA A 50 -24.566 -33.644 -10.956 1.00 54.33 H new ATOM 0 HB2 ALA A 50 -23.124 -34.653 -10.691 1.00 54.33 H new ATOM 0 HB3 ALA A 50 -23.264 -33.072 -9.886 1.00 54.33 H new ATOM 757 N PRO A 51 -24.361 -31.381 -13.058 1.00 55.40 N ATOM 758 CA PRO A 51 -24.912 -30.059 -13.393 1.00 12.22 C ATOM 759 C PRO A 51 -25.496 -29.342 -12.175 1.00 34.03 C ATOM 760 O PRO A 51 -25.423 -28.115 -12.066 1.00 2.20 O ATOM 761 CB PRO A 51 -26.006 -30.369 -14.433 1.00 62.34 C ATOM 762 CG PRO A 51 -26.335 -31.810 -14.231 1.00 64.33 C ATOM 763 CD PRO A 51 -25.055 -32.464 -13.783 1.00 24.12 C ATOM 0 HA PRO A 51 -24.143 -29.383 -13.767 1.00 12.22 H new ATOM 0 HB2 PRO A 51 -26.883 -29.739 -14.283 1.00 62.34 H new ATOM 0 HB3 PRO A 51 -25.651 -30.184 -15.447 1.00 62.34 H new ATOM 0 HG2 PRO A 51 -27.119 -31.931 -13.483 1.00 64.33 H new ATOM 0 HG3 PRO A 51 -26.702 -32.260 -15.153 1.00 64.33 H new ATOM 0 HD2 PRO A 51 -25.245 -33.323 -13.139 1.00 24.12 H new ATOM 0 HD3 PRO A 51 -24.469 -32.823 -14.629 1.00 24.12 H new ATOM 771 N TRP A 52 -26.077 -30.114 -11.261 1.00 52.31 N ATOM 772 CA TRP A 52 -26.673 -29.565 -10.043 1.00 61.04 C ATOM 773 C TRP A 52 -25.982 -30.147 -8.813 1.00 61.45 C ATOM 774 O TRP A 52 -25.991 -31.363 -8.604 1.00 73.15 O ATOM 775 CB TRP A 52 -28.176 -29.872 -9.992 1.00 34.34 C ATOM 776 CG TRP A 52 -28.930 -29.381 -11.200 1.00 2.33 C ATOM 777 CD1 TRP A 52 -29.113 -30.049 -12.377 1.00 55.55 C ATOM 778 CD2 TRP A 52 -29.598 -28.120 -11.348 1.00 2.31 C ATOM 779 NE1 TRP A 52 -29.851 -29.283 -13.245 1.00 21.24 N ATOM 780 CE2 TRP A 52 -30.162 -28.094 -12.637 1.00 34.23 C ATOM 781 CE3 TRP A 52 -29.775 -27.011 -10.514 1.00 4.45 C ATOM 782 CZ2 TRP A 52 -30.888 -27.002 -13.112 1.00 10.31 C ATOM 783 CZ3 TRP A 52 -30.495 -25.928 -10.985 1.00 4.30 C ATOM 784 CH2 TRP A 52 -31.045 -25.931 -12.273 1.00 60.21 C ATOM 0 H TRP A 52 -26.149 -31.128 -11.340 1.00 52.31 H new ATOM 0 HA TRP A 52 -26.538 -28.483 -10.050 1.00 61.04 H new ATOM 0 HB2 TRP A 52 -28.316 -30.949 -9.899 1.00 34.34 H new ATOM 0 HB3 TRP A 52 -28.602 -29.417 -9.098 1.00 34.34 H new ATOM 0 HD1 TRP A 52 -28.732 -31.036 -12.593 1.00 55.55 H new ATOM 0 HE1 TRP A 52 -30.124 -29.555 -14.190 1.00 21.24 H new ATOM 0 HE3 TRP A 52 -29.356 -27.001 -9.519 1.00 4.45 H new ATOM 0 HZ2 TRP A 52 -31.311 -27.001 -14.106 1.00 10.31 H new ATOM 0 HZ3 TRP A 52 -30.635 -25.066 -10.349 1.00 4.30 H new ATOM 0 HH2 TRP A 52 -31.604 -25.071 -12.611 1.00 60.21 H new ATOM 795 N CYS A 53 -25.377 -29.277 -8.012 1.00 50.22 N ATOM 796 CA CYS A 53 -24.682 -29.695 -6.799 1.00 20.35 C ATOM 797 C CYS A 53 -24.434 -28.499 -5.884 1.00 44.23 C ATOM 798 O CYS A 53 -24.110 -27.407 -6.354 1.00 40.01 O ATOM 799 CB CYS A 53 -23.350 -30.366 -7.142 1.00 43.12 C ATOM 800 SG CYS A 53 -22.402 -30.899 -5.679 1.00 63.30 S ATOM 0 H CYS A 53 -25.354 -28.272 -8.182 1.00 50.22 H new ATOM 0 HA CYS A 53 -25.316 -30.414 -6.280 1.00 20.35 H new ATOM 0 HB2 CYS A 53 -23.542 -31.232 -7.775 1.00 43.12 H new ATOM 0 HB3 CYS A 53 -22.743 -29.673 -7.725 1.00 43.12 H new ATOM 805 N GLY A 54 -24.588 -28.715 -4.578 1.00 43.40 N ATOM 806 CA GLY A 54 -24.370 -27.659 -3.604 1.00 13.40 C ATOM 807 C GLY A 54 -22.945 -27.634 -3.077 1.00 4.44 C ATOM 808 O GLY A 54 -22.167 -26.749 -3.435 1.00 31.03 O ATOM 0 H GLY A 54 -24.862 -29.611 -4.176 1.00 43.40 H new ATOM 0 HA2 GLY A 54 -24.602 -26.696 -4.060 1.00 13.40 H new ATOM 0 HA3 GLY A 54 -25.059 -27.791 -2.770 1.00 13.40 H new ATOM 812 N PRO A 55 -22.562 -28.617 -2.235 1.00 11.55 N ATOM 813 CA PRO A 55 -21.234 -28.657 -1.597 1.00 25.30 C ATOM 814 C PRO A 55 -20.078 -28.550 -2.597 1.00 32.04 C ATOM 815 O PRO A 55 -18.966 -28.154 -2.233 1.00 53.41 O ATOM 816 CB PRO A 55 -21.216 -30.021 -0.896 1.00 54.22 C ATOM 817 CG PRO A 55 -22.651 -30.346 -0.659 1.00 31.01 C ATOM 818 CD PRO A 55 -23.399 -29.767 -1.831 1.00 51.53 C ATOM 0 HA PRO A 55 -21.090 -27.810 -0.926 1.00 25.30 H new ATOM 0 HB2 PRO A 55 -20.736 -30.778 -1.516 1.00 54.22 H new ATOM 0 HB3 PRO A 55 -20.660 -29.977 0.041 1.00 54.22 H new ATOM 0 HG2 PRO A 55 -22.802 -31.423 -0.591 1.00 31.01 H new ATOM 0 HG3 PRO A 55 -23.000 -29.916 0.280 1.00 31.01 H new ATOM 0 HD2 PRO A 55 -23.504 -30.491 -2.639 1.00 51.53 H new ATOM 0 HD3 PRO A 55 -24.405 -29.454 -1.551 1.00 51.53 H new ATOM 826 N CYS A 56 -20.346 -28.895 -3.859 1.00 70.12 N ATOM 827 CA CYS A 56 -19.334 -28.830 -4.916 1.00 20.13 C ATOM 828 C CYS A 56 -18.701 -27.440 -4.997 1.00 71.35 C ATOM 829 O CYS A 56 -17.560 -27.301 -5.426 1.00 52.03 O ATOM 830 CB CYS A 56 -19.945 -29.226 -6.266 1.00 24.21 C ATOM 831 SG CYS A 56 -20.486 -30.964 -6.339 1.00 62.21 S ATOM 0 H CYS A 56 -21.259 -29.223 -4.174 1.00 70.12 H new ATOM 0 HA CYS A 56 -18.544 -29.539 -4.669 1.00 20.13 H new ATOM 0 HB2 CYS A 56 -20.798 -28.580 -6.473 1.00 24.21 H new ATOM 0 HB3 CYS A 56 -19.212 -29.049 -7.053 1.00 24.21 H new ATOM 836 N ARG A 57 -19.435 -26.423 -4.541 1.00 42.14 N ATOM 837 CA ARG A 57 -18.925 -25.052 -4.502 1.00 30.24 C ATOM 838 C ARG A 57 -17.603 -25.005 -3.748 1.00 54.23 C ATOM 839 O ARG A 57 -16.620 -24.428 -4.213 1.00 53.21 O ATOM 840 CB ARG A 57 -19.938 -24.135 -3.805 1.00 42.45 C ATOM 841 CG ARG A 57 -21.279 -24.039 -4.520 1.00 14.45 C ATOM 842 CD ARG A 57 -22.379 -23.566 -3.577 1.00 71.53 C ATOM 843 NE ARG A 57 -22.052 -22.295 -2.930 1.00 20.02 N ATOM 844 CZ ARG A 57 -22.761 -21.758 -1.931 1.00 74.44 C ATOM 845 NH1 ARG A 57 -23.833 -22.383 -1.452 1.00 35.42 N1+ ATOM 846 NH2 ARG A 57 -22.384 -20.604 -1.398 1.00 33.01 N ATOM 0 H ARG A 57 -20.388 -26.524 -4.192 1.00 42.14 H new ATOM 0 HA ARG A 57 -18.769 -24.710 -5.525 1.00 30.24 H new ATOM 0 HB2 ARG A 57 -20.104 -24.498 -2.791 1.00 42.45 H new ATOM 0 HB3 ARG A 57 -19.510 -23.136 -3.720 1.00 42.45 H new ATOM 0 HG2 ARG A 57 -21.197 -23.350 -5.360 1.00 14.45 H new ATOM 0 HG3 ARG A 57 -21.544 -25.013 -4.932 1.00 14.45 H new ATOM 0 HD2 ARG A 57 -23.310 -23.458 -4.134 1.00 71.53 H new ATOM 0 HD3 ARG A 57 -22.551 -24.325 -2.814 1.00 71.53 H new ATOM 0 HE ARG A 57 -21.232 -21.787 -3.262 1.00 20.02 H new ATOM 0 HH11 ARG A 57 -24.120 -23.279 -1.847 1.00 35.42 H new ATOM 0 HH12 ARG A 57 -24.368 -21.967 -0.690 1.00 35.42 H new ATOM 0 HH21 ARG A 57 -21.554 -20.127 -1.750 1.00 33.01 H new ATOM 0 HH22 ARG A 57 -22.924 -20.194 -0.636 1.00 33.01 H new ATOM 860 N SER A 58 -17.602 -25.601 -2.566 1.00 22.42 N ATOM 861 CA SER A 58 -16.399 -25.703 -1.748 1.00 70.35 C ATOM 862 C SER A 58 -15.440 -26.765 -2.306 1.00 50.02 C ATOM 863 O SER A 58 -14.216 -26.578 -2.342 1.00 63.20 O ATOM 864 CB SER A 58 -16.791 -26.053 -0.308 1.00 12.11 C ATOM 865 OG SER A 58 -17.820 -25.192 0.160 1.00 40.31 O ATOM 0 H SER A 58 -18.429 -26.026 -2.147 1.00 22.42 H new ATOM 0 HA SER A 58 -15.883 -24.743 -1.765 1.00 70.35 H new ATOM 0 HB2 SER A 58 -17.128 -27.089 -0.260 1.00 12.11 H new ATOM 0 HB3 SER A 58 -15.919 -25.971 0.341 1.00 12.11 H new ATOM 0 HG SER A 58 -18.056 -25.434 1.080 1.00 40.31 H new ATOM 871 N LEU A 59 -16.006 -27.883 -2.748 1.00 35.33 N ATOM 872 CA LEU A 59 -15.211 -29.033 -3.171 1.00 33.30 C ATOM 873 C LEU A 59 -14.315 -28.724 -4.370 1.00 51.22 C ATOM 874 O LEU A 59 -13.167 -29.144 -4.388 1.00 44.13 O ATOM 875 CB LEU A 59 -16.106 -30.244 -3.468 1.00 34.51 C ATOM 876 CG LEU A 59 -16.397 -31.162 -2.266 1.00 64.10 C ATOM 877 CD1 LEU A 59 -15.105 -31.794 -1.746 1.00 21.22 C ATOM 878 CD2 LEU A 59 -17.113 -30.404 -1.148 1.00 63.33 C ATOM 0 H LEU A 59 -17.014 -28.018 -2.823 1.00 35.33 H new ATOM 0 HA LEU A 59 -14.554 -29.276 -2.336 1.00 33.30 H new ATOM 0 HB2 LEU A 59 -17.055 -29.884 -3.866 1.00 34.51 H new ATOM 0 HB3 LEU A 59 -15.636 -30.838 -4.252 1.00 34.51 H new ATOM 0 HG LEU A 59 -17.060 -31.957 -2.607 1.00 64.10 H new ATOM 0 HD11 LEU A 59 -15.331 -32.439 -0.897 1.00 21.22 H new ATOM 0 HD12 LEU A 59 -14.645 -32.385 -2.538 1.00 21.22 H new ATOM 0 HD13 LEU A 59 -14.417 -31.009 -1.432 1.00 21.22 H new ATOM 0 HD21 LEU A 59 -17.304 -31.080 -0.314 1.00 63.33 H new ATOM 0 HD22 LEU A 59 -16.487 -29.578 -0.810 1.00 63.33 H new ATOM 0 HD23 LEU A 59 -18.059 -30.013 -1.522 1.00 63.33 H new ATOM 890 N GLU A 60 -14.826 -27.990 -5.356 1.00 25.40 N ATOM 891 CA GLU A 60 -14.054 -27.706 -6.572 1.00 51.24 C ATOM 892 C GLU A 60 -12.698 -27.048 -6.234 1.00 31.13 C ATOM 893 O GLU A 60 -11.646 -27.559 -6.636 1.00 60.23 O ATOM 894 CB GLU A 60 -14.873 -26.853 -7.561 1.00 44.05 C ATOM 895 CG GLU A 60 -16.083 -27.586 -8.143 1.00 51.15 C ATOM 896 CD GLU A 60 -16.907 -26.721 -9.088 1.00 40.34 C ATOM 897 OE1 GLU A 60 -17.965 -26.203 -8.669 1.00 65.12 O ATOM 898 OE2 GLU A 60 -16.498 -26.548 -10.256 1.00 25.24 O1- ATOM 0 H GLU A 60 -15.761 -27.583 -5.342 1.00 25.40 H new ATOM 0 HA GLU A 60 -13.837 -28.655 -7.062 1.00 51.24 H new ATOM 0 HB2 GLU A 60 -15.214 -25.951 -7.054 1.00 44.05 H new ATOM 0 HB3 GLU A 60 -14.224 -26.534 -8.377 1.00 44.05 H new ATOM 0 HG2 GLU A 60 -15.741 -28.473 -8.677 1.00 51.15 H new ATOM 0 HG3 GLU A 60 -16.719 -27.930 -7.327 1.00 51.15 H new ATOM 905 N PRO A 61 -12.677 -25.922 -5.478 1.00 40.44 N ATOM 906 CA PRO A 61 -11.417 -25.328 -5.023 1.00 20.54 C ATOM 907 C PRO A 61 -10.644 -26.266 -4.090 1.00 64.23 C ATOM 908 O PRO A 61 -9.409 -26.309 -4.131 1.00 41.33 O ATOM 909 CB PRO A 61 -11.842 -24.040 -4.296 1.00 61.44 C ATOM 910 CG PRO A 61 -13.283 -24.235 -3.971 1.00 3.54 C ATOM 911 CD PRO A 61 -13.842 -25.124 -5.051 1.00 61.33 C ATOM 0 HA PRO A 61 -10.737 -25.134 -5.853 1.00 20.54 H new ATOM 0 HB2 PRO A 61 -11.252 -23.884 -3.393 1.00 61.44 H new ATOM 0 HB3 PRO A 61 -11.695 -23.164 -4.928 1.00 61.44 H new ATOM 0 HG2 PRO A 61 -13.402 -24.694 -2.989 1.00 3.54 H new ATOM 0 HG3 PRO A 61 -13.808 -23.280 -3.942 1.00 3.54 H new ATOM 0 HD2 PRO A 61 -14.645 -25.757 -4.674 1.00 61.33 H new ATOM 0 HD3 PRO A 61 -14.254 -24.543 -5.876 1.00 61.33 H new ATOM 919 N GLN A 62 -11.364 -27.029 -3.253 1.00 1.31 N ATOM 920 CA GLN A 62 -10.704 -27.995 -2.366 1.00 64.23 C ATOM 921 C GLN A 62 -10.002 -29.086 -3.184 1.00 72.30 C ATOM 922 O GLN A 62 -8.960 -29.612 -2.778 1.00 45.13 O ATOM 923 CB GLN A 62 -11.696 -28.622 -1.374 1.00 52.44 C ATOM 924 CG GLN A 62 -12.281 -27.627 -0.379 1.00 75.21 C ATOM 925 CD GLN A 62 -13.092 -28.292 0.719 1.00 5.22 C ATOM 926 OE1 GLN A 62 -12.565 -28.626 1.781 1.00 5.12 O ATOM 927 NE2 GLN A 62 -14.375 -28.500 0.470 1.00 34.41 N ATOM 0 H GLN A 62 -12.380 -26.997 -3.173 1.00 1.31 H new ATOM 0 HA GLN A 62 -9.955 -27.453 -1.788 1.00 64.23 H new ATOM 0 HB2 GLN A 62 -12.510 -29.085 -1.932 1.00 52.44 H new ATOM 0 HB3 GLN A 62 -11.193 -29.418 -0.825 1.00 52.44 H new ATOM 0 HG2 GLN A 62 -11.471 -27.054 0.072 1.00 75.21 H new ATOM 0 HG3 GLN A 62 -12.915 -26.918 -0.912 1.00 75.21 H new ATOM 0 HE21 GLN A 62 -14.775 -28.209 -0.422 1.00 34.41 H new ATOM 0 HE22 GLN A 62 -14.964 -28.951 1.170 1.00 34.41 H new ATOM 936 N LEU A 63 -10.562 -29.400 -4.350 1.00 4.32 N ATOM 937 CA LEU A 63 -9.973 -30.393 -5.241 1.00 24.11 C ATOM 938 C LEU A 63 -8.686 -29.853 -5.842 1.00 34.30 C ATOM 939 O LEU A 63 -7.693 -30.574 -5.935 1.00 14.04 O ATOM 940 CB LEU A 63 -10.959 -30.794 -6.348 1.00 72.32 C ATOM 941 CG LEU A 63 -12.154 -31.647 -5.886 1.00 45.24 C ATOM 942 CD1 LEU A 63 -13.116 -31.906 -7.043 1.00 73.33 C ATOM 943 CD2 LEU A 63 -11.671 -32.962 -5.275 1.00 74.14 C ATOM 0 H LEU A 63 -11.424 -28.980 -4.699 1.00 4.32 H new ATOM 0 HA LEU A 63 -9.744 -31.286 -4.659 1.00 24.11 H new ATOM 0 HB2 LEU A 63 -11.341 -29.888 -6.818 1.00 72.32 H new ATOM 0 HB3 LEU A 63 -10.415 -31.345 -7.115 1.00 72.32 H new ATOM 0 HG LEU A 63 -12.693 -31.092 -5.118 1.00 45.24 H new ATOM 0 HD11 LEU A 63 -13.952 -32.511 -6.692 1.00 73.33 H new ATOM 0 HD12 LEU A 63 -13.490 -30.956 -7.425 1.00 73.33 H new ATOM 0 HD13 LEU A 63 -12.593 -32.436 -7.839 1.00 73.33 H new ATOM 0 HD21 LEU A 63 -12.530 -33.551 -4.954 1.00 74.14 H new ATOM 0 HD22 LEU A 63 -11.104 -33.522 -6.019 1.00 74.14 H new ATOM 0 HD23 LEU A 63 -11.034 -32.752 -4.416 1.00 74.14 H new ATOM 955 N GLU A 64 -8.703 -28.580 -6.241 1.00 4.53 N ATOM 956 CA GLU A 64 -7.494 -27.938 -6.749 1.00 14.32 C ATOM 957 C GLU A 64 -6.432 -27.870 -5.658 1.00 63.35 C ATOM 958 O GLU A 64 -5.241 -27.980 -5.945 1.00 10.34 O ATOM 959 CB GLU A 64 -7.773 -26.535 -7.301 1.00 61.33 C ATOM 960 CG GLU A 64 -8.550 -26.535 -8.614 1.00 42.54 C ATOM 961 CD GLU A 64 -8.339 -25.258 -9.413 1.00 13.44 C ATOM 962 OE1 GLU A 64 -7.330 -25.177 -10.147 1.00 52.13 O ATOM 963 OE2 GLU A 64 -9.173 -24.334 -9.311 1.00 65.51 O1- ATOM 0 H GLU A 64 -9.529 -27.982 -6.222 1.00 4.53 H new ATOM 0 HA GLU A 64 -7.127 -28.548 -7.574 1.00 14.32 H new ATOM 0 HB2 GLU A 64 -8.333 -25.967 -6.558 1.00 61.33 H new ATOM 0 HB3 GLU A 64 -6.825 -26.018 -7.450 1.00 61.33 H new ATOM 0 HG2 GLU A 64 -8.243 -27.391 -9.215 1.00 42.54 H new ATOM 0 HG3 GLU A 64 -9.613 -26.658 -8.404 1.00 42.54 H new ATOM 970 N LYS A 65 -6.869 -27.696 -4.408 1.00 0.43 N ATOM 971 CA LYS A 65 -5.950 -27.716 -3.270 1.00 4.21 C ATOM 972 C LYS A 65 -5.156 -29.018 -3.254 1.00 63.22 C ATOM 973 O LYS A 65 -3.923 -29.006 -3.288 1.00 64.34 O ATOM 974 CB LYS A 65 -6.700 -27.556 -1.935 1.00 2.10 C ATOM 975 CG LYS A 65 -5.816 -27.823 -0.712 1.00 73.25 C ATOM 976 CD LYS A 65 -6.594 -27.767 0.602 1.00 53.43 C ATOM 977 CE LYS A 65 -7.228 -26.403 0.842 1.00 74.54 C ATOM 978 NZ LYS A 65 -7.840 -26.314 2.193 1.00 62.51 N1+ ATOM 0 H LYS A 65 -7.846 -27.541 -4.161 1.00 0.43 H new ATOM 0 HA LYS A 65 -5.269 -26.873 -3.384 1.00 4.21 H new ATOM 0 HB2 LYS A 65 -7.103 -26.545 -1.871 1.00 2.10 H new ATOM 0 HB3 LYS A 65 -7.549 -28.239 -1.918 1.00 2.10 H new ATOM 0 HG2 LYS A 65 -5.351 -28.804 -0.812 1.00 73.25 H new ATOM 0 HG3 LYS A 65 -5.010 -27.089 -0.684 1.00 73.25 H new ATOM 0 HD2 LYS A 65 -7.372 -28.530 0.593 1.00 53.43 H new ATOM 0 HD3 LYS A 65 -5.924 -28.004 1.428 1.00 53.43 H new ATOM 0 HE2 LYS A 65 -6.472 -25.625 0.733 1.00 74.54 H new ATOM 0 HE3 LYS A 65 -7.989 -26.217 0.084 1.00 74.54 H new ATOM 0 HZ1 LYS A 65 -8.262 -25.372 2.322 1.00 62.51 H new ATOM 0 HZ2 LYS A 65 -8.578 -27.040 2.288 1.00 62.51 H new ATOM 0 HZ3 LYS A 65 -7.109 -26.467 2.916 1.00 62.51 H new ATOM 992 N LEU A 66 -5.871 -30.140 -3.216 1.00 12.42 N ATOM 993 CA LEU A 66 -5.231 -31.450 -3.145 1.00 2.43 C ATOM 994 C LEU A 66 -4.464 -31.737 -4.433 1.00 60.12 C ATOM 995 O LEU A 66 -3.368 -32.297 -4.405 1.00 51.14 O ATOM 996 CB LEU A 66 -6.266 -32.557 -2.895 1.00 45.35 C ATOM 997 CG LEU A 66 -7.252 -32.290 -1.747 1.00 74.51 C ATOM 998 CD1 LEU A 66 -8.211 -33.468 -1.577 1.00 61.45 C ATOM 999 CD2 LEU A 66 -6.506 -31.999 -0.446 1.00 41.11 C ATOM 0 H LEU A 66 -6.890 -30.168 -3.233 1.00 12.42 H new ATOM 0 HA LEU A 66 -4.532 -31.437 -2.309 1.00 2.43 H new ATOM 0 HB2 LEU A 66 -6.835 -32.713 -3.811 1.00 45.35 H new ATOM 0 HB3 LEU A 66 -5.736 -33.487 -2.687 1.00 45.35 H new ATOM 0 HG LEU A 66 -7.840 -31.408 -2.000 1.00 74.51 H new ATOM 0 HD11 LEU A 66 -8.901 -33.260 -0.759 1.00 61.45 H new ATOM 0 HD12 LEU A 66 -8.774 -33.615 -2.499 1.00 61.45 H new ATOM 0 HD13 LEU A 66 -7.643 -34.370 -1.351 1.00 61.45 H new ATOM 0 HD21 LEU A 66 -7.225 -31.813 0.352 1.00 41.11 H new ATOM 0 HD22 LEU A 66 -5.885 -32.856 -0.183 1.00 41.11 H new ATOM 0 HD23 LEU A 66 -5.875 -31.120 -0.577 1.00 41.11 H new ATOM 1011 N ALA A 67 -5.046 -31.326 -5.555 1.00 43.32 N ATOM 1012 CA ALA A 67 -4.449 -31.548 -6.865 1.00 1.23 C ATOM 1013 C ALA A 67 -3.077 -30.893 -6.944 1.00 3.40 C ATOM 1014 O ALA A 67 -2.123 -31.505 -7.398 1.00 21.23 O ATOM 1015 CB ALA A 67 -5.360 -31.017 -7.965 1.00 34.31 C ATOM 0 H ALA A 67 -5.939 -30.833 -5.581 1.00 43.32 H new ATOM 0 HA ALA A 67 -4.326 -32.621 -7.010 1.00 1.23 H new ATOM 0 HB1 ALA A 67 -4.897 -31.192 -8.936 1.00 34.31 H new ATOM 0 HB2 ALA A 67 -6.320 -31.532 -7.922 1.00 34.31 H new ATOM 0 HB3 ALA A 67 -5.515 -29.947 -7.824 1.00 34.31 H new ATOM 1021 N GLN A 68 -2.988 -29.651 -6.481 1.00 30.24 N ATOM 1022 CA GLN A 68 -1.724 -28.908 -6.476 1.00 34.53 C ATOM 1023 C GLN A 68 -0.753 -29.491 -5.456 1.00 14.40 C ATOM 1024 O GLN A 68 0.419 -29.710 -5.757 1.00 34.01 O ATOM 1025 CB GLN A 68 -1.975 -27.424 -6.171 1.00 73.12 C ATOM 1026 CG GLN A 68 -2.609 -26.652 -7.326 1.00 63.23 C ATOM 1027 CD GLN A 68 -1.654 -26.419 -8.493 1.00 72.52 C ATOM 1028 OE1 GLN A 68 -0.744 -27.212 -8.745 1.00 74.13 O ATOM 1029 NE2 GLN A 68 -1.863 -25.334 -9.223 1.00 35.24 N ATOM 0 H GLN A 68 -3.779 -29.131 -6.101 1.00 30.24 H new ATOM 0 HA GLN A 68 -1.279 -28.996 -7.467 1.00 34.53 H new ATOM 0 HB2 GLN A 68 -2.622 -27.347 -5.297 1.00 73.12 H new ATOM 0 HB3 GLN A 68 -1.028 -26.952 -5.908 1.00 73.12 H new ATOM 0 HG2 GLN A 68 -3.482 -27.199 -7.683 1.00 63.23 H new ATOM 0 HG3 GLN A 68 -2.964 -25.689 -6.959 1.00 63.23 H new ATOM 0 HE21 GLN A 68 -2.625 -24.699 -8.986 1.00 35.24 H new ATOM 0 HE22 GLN A 68 -1.262 -25.133 -10.022 1.00 35.24 H new ATOM 1038 N GLN A 69 -1.261 -29.754 -4.257 1.00 23.22 N ATOM 1039 CA GLN A 69 -0.448 -30.277 -3.160 1.00 22.40 C ATOM 1040 C GLN A 69 0.221 -31.596 -3.555 1.00 3.21 C ATOM 1041 O GLN A 69 1.394 -31.828 -3.262 1.00 75.41 O ATOM 1042 CB GLN A 69 -1.332 -30.480 -1.916 1.00 11.52 C ATOM 1043 CG GLN A 69 -0.598 -31.037 -0.700 1.00 32.44 C ATOM 1044 CD GLN A 69 0.504 -30.123 -0.189 1.00 50.30 C ATOM 1045 OE1 GLN A 69 0.327 -28.818 -0.347 1.00 65.51 O flip ATOM 1046 NE2 GLN A 69 1.502 -30.589 0.363 1.00 31.30 N flip ATOM 0 H GLN A 69 -2.242 -29.612 -4.017 1.00 23.22 H new ATOM 0 HA GLN A 69 0.338 -29.556 -2.933 1.00 22.40 H new ATOM 0 HB2 GLN A 69 -1.782 -29.525 -1.646 1.00 11.52 H new ATOM 0 HB3 GLN A 69 -2.148 -31.156 -2.173 1.00 11.52 H new ATOM 0 HG2 GLN A 69 -1.317 -31.210 0.101 1.00 32.44 H new ATOM 0 HG3 GLN A 69 -0.167 -32.005 -0.957 1.00 32.44 H new ATOM 0 HE21 GLN A 69 1.603 -31.599 0.466 1.00 31.30 H new ATOM 0 HE22 GLN A 69 2.227 -29.965 0.717 1.00 31.30 H new ATOM 1055 N TYR A 70 -0.539 -32.446 -4.228 1.00 14.41 N ATOM 1056 CA TYR A 70 -0.094 -33.793 -4.575 1.00 60.14 C ATOM 1057 C TYR A 70 0.284 -33.916 -6.058 1.00 40.42 C ATOM 1058 O TYR A 70 0.590 -35.008 -6.518 1.00 75.22 O ATOM 1059 CB TYR A 70 -1.175 -34.816 -4.202 1.00 23.30 C ATOM 1060 CG TYR A 70 -1.519 -34.832 -2.718 1.00 14.04 C ATOM 1061 CD1 TYR A 70 -2.766 -34.411 -2.261 1.00 64.52 C ATOM 1062 CD2 TYR A 70 -0.591 -35.264 -1.775 1.00 13.23 C ATOM 1063 CE1 TYR A 70 -3.074 -34.421 -0.914 1.00 62.24 C ATOM 1064 CE2 TYR A 70 -0.895 -35.277 -0.424 1.00 4.24 C ATOM 1065 CZ TYR A 70 -2.139 -34.855 -0.002 1.00 51.45 C ATOM 1066 OH TYR A 70 -2.451 -34.866 1.341 1.00 12.52 O ATOM 0 H TYR A 70 -1.481 -32.225 -4.550 1.00 14.41 H new ATOM 0 HA TYR A 70 0.809 -34.001 -4.001 1.00 60.14 H new ATOM 0 HB2 TYR A 70 -2.078 -34.601 -4.773 1.00 23.30 H new ATOM 0 HB3 TYR A 70 -0.840 -35.810 -4.499 1.00 23.30 H new ATOM 0 HD1 TYR A 70 -3.505 -34.071 -2.972 1.00 64.52 H new ATOM 0 HD2 TYR A 70 0.383 -35.595 -2.103 1.00 13.23 H new ATOM 0 HE1 TYR A 70 -4.045 -34.089 -0.578 1.00 62.24 H new ATOM 0 HE2 TYR A 70 -0.163 -35.615 0.295 1.00 4.24 H new ATOM 0 HH TYR A 70 -1.685 -35.201 1.852 1.00 12.52 H new ATOM 1076 N THR A 71 0.249 -32.803 -6.796 1.00 61.35 N ATOM 1077 CA THR A 71 0.399 -32.815 -8.266 1.00 51.44 C ATOM 1078 C THR A 71 1.658 -33.550 -8.750 1.00 2.11 C ATOM 1079 O THR A 71 1.725 -33.982 -9.907 1.00 63.31 O ATOM 1080 CB THR A 71 0.410 -31.376 -8.846 1.00 32.42 C ATOM 1081 OG1 THR A 71 0.324 -31.418 -10.277 1.00 20.15 O ATOM 1082 CG2 THR A 71 1.673 -30.617 -8.435 1.00 4.22 C ATOM 0 H THR A 71 0.117 -31.872 -6.402 1.00 61.35 H new ATOM 0 HA THR A 71 -0.469 -33.362 -8.632 1.00 51.44 H new ATOM 0 HB THR A 71 -0.455 -30.851 -8.441 1.00 32.42 H new ATOM 0 HG1 THR A 71 0.640 -32.288 -10.598 1.00 20.15 H new ATOM 0 HG21 THR A 71 1.648 -29.613 -8.858 1.00 4.22 H new ATOM 0 HG22 THR A 71 1.721 -30.551 -7.348 1.00 4.22 H new ATOM 0 HG23 THR A 71 2.552 -31.145 -8.805 1.00 4.22 H new ATOM 1090 N GLU A 72 2.654 -33.689 -7.885 1.00 51.24 N ATOM 1091 CA GLU A 72 3.894 -34.369 -8.254 1.00 74.02 C ATOM 1092 C GLU A 72 3.681 -35.884 -8.346 1.00 60.10 C ATOM 1093 O GLU A 72 4.478 -36.596 -8.954 1.00 53.34 O ATOM 1094 CB GLU A 72 5.015 -34.034 -7.257 1.00 21.44 C ATOM 1095 CG GLU A 72 5.396 -32.553 -7.235 1.00 35.12 C ATOM 1096 CD GLU A 72 5.809 -32.028 -8.606 1.00 32.11 C ATOM 1097 OE1 GLU A 72 5.049 -31.238 -9.210 1.00 53.51 O ATOM 1098 OE2 GLU A 72 6.900 -32.403 -9.090 1.00 0.13 O1- ATOM 0 H GLU A 72 2.631 -33.342 -6.926 1.00 51.24 H new ATOM 0 HA GLU A 72 4.196 -34.012 -9.238 1.00 74.02 H new ATOM 0 HB2 GLU A 72 4.702 -34.334 -6.257 1.00 21.44 H new ATOM 0 HB3 GLU A 72 5.898 -34.623 -7.505 1.00 21.44 H new ATOM 0 HG2 GLU A 72 4.551 -31.971 -6.868 1.00 35.12 H new ATOM 0 HG3 GLU A 72 6.216 -32.404 -6.532 1.00 35.12 H new ATOM 1105 N ASN A 73 2.602 -36.366 -7.731 1.00 54.34 N ATOM 1106 CA ASN A 73 2.260 -37.791 -7.754 1.00 53.33 C ATOM 1107 C ASN A 73 0.763 -37.991 -8.040 1.00 50.23 C ATOM 1108 O ASN A 73 0.263 -39.112 -8.018 1.00 40.15 O ATOM 1109 CB ASN A 73 2.637 -38.440 -6.410 1.00 52.25 C ATOM 1110 CG ASN A 73 2.586 -39.960 -6.445 1.00 60.25 C ATOM 1111 OD1 ASN A 73 1.436 -40.529 -6.124 1.00 52.33 O flip ATOM 1112 ND2 ASN A 73 3.578 -40.616 -6.751 1.00 3.30 N flip ATOM 0 H ASN A 73 1.945 -35.788 -7.207 1.00 54.34 H new ATOM 0 HA ASN A 73 2.824 -38.270 -8.554 1.00 53.33 H new ATOM 0 HB2 ASN A 73 3.641 -38.123 -6.129 1.00 52.25 H new ATOM 0 HB3 ASN A 73 1.960 -38.078 -5.636 1.00 52.25 H new ATOM 0 HD21 ASN A 73 4.448 -40.142 -6.993 1.00 3.30 H new ATOM 0 HD22 ASN A 73 3.532 -41.635 -6.763 1.00 3.30 H new ATOM 1119 N VAL A 74 0.053 -36.897 -8.319 1.00 42.24 N ATOM 1120 CA VAL A 74 -1.402 -36.937 -8.515 1.00 72.51 C ATOM 1121 C VAL A 74 -1.832 -36.036 -9.672 1.00 33.41 C ATOM 1122 O VAL A 74 -1.243 -34.980 -9.904 1.00 74.22 O ATOM 1123 CB VAL A 74 -2.149 -36.503 -7.221 1.00 15.53 C ATOM 1124 CG1 VAL A 74 -3.633 -36.242 -7.481 1.00 23.10 C ATOM 1125 CG2 VAL A 74 -1.979 -37.553 -6.127 1.00 50.05 C ATOM 0 H VAL A 74 0.461 -35.967 -8.415 1.00 42.24 H new ATOM 0 HA VAL A 74 -1.666 -37.967 -8.754 1.00 72.51 H new ATOM 0 HB VAL A 74 -1.703 -35.566 -6.886 1.00 15.53 H new ATOM 0 HG11 VAL A 74 -4.118 -35.941 -6.552 1.00 23.10 H new ATOM 0 HG12 VAL A 74 -3.739 -35.447 -8.219 1.00 23.10 H new ATOM 0 HG13 VAL A 74 -4.102 -37.151 -7.857 1.00 23.10 H new ATOM 0 HG21 VAL A 74 -2.508 -37.232 -5.230 1.00 50.05 H new ATOM 0 HG22 VAL A 74 -2.387 -38.504 -6.469 1.00 50.05 H new ATOM 0 HG23 VAL A 74 -0.920 -37.674 -5.900 1.00 50.05 H new ATOM 1135 N LYS A 75 -2.861 -36.470 -10.396 1.00 71.33 N ATOM 1136 CA LYS A 75 -3.466 -35.670 -11.458 1.00 20.41 C ATOM 1137 C LYS A 75 -4.956 -35.996 -11.558 1.00 63.15 C ATOM 1138 O LYS A 75 -5.336 -37.165 -11.638 1.00 32.02 O ATOM 1139 CB LYS A 75 -2.769 -35.931 -12.805 1.00 33.32 C ATOM 1140 CG LYS A 75 -3.338 -35.119 -13.973 1.00 15.44 C ATOM 1141 CD LYS A 75 -3.160 -33.613 -13.777 1.00 32.33 C ATOM 1142 CE LYS A 75 -3.723 -32.815 -14.953 1.00 62.53 C ATOM 1143 NZ LYS A 75 -3.056 -33.163 -16.241 1.00 41.05 N1+ ATOM 0 H LYS A 75 -3.297 -37.382 -10.264 1.00 71.33 H new ATOM 0 HA LYS A 75 -3.344 -34.614 -11.216 1.00 20.41 H new ATOM 0 HB2 LYS A 75 -1.708 -35.704 -12.702 1.00 33.32 H new ATOM 0 HB3 LYS A 75 -2.847 -36.992 -13.042 1.00 33.32 H new ATOM 0 HG2 LYS A 75 -2.846 -35.423 -14.897 1.00 15.44 H new ATOM 0 HG3 LYS A 75 -4.398 -35.345 -14.087 1.00 15.44 H new ATOM 0 HD2 LYS A 75 -3.658 -33.305 -12.858 1.00 32.33 H new ATOM 0 HD3 LYS A 75 -2.101 -33.385 -13.657 1.00 32.33 H new ATOM 0 HE2 LYS A 75 -4.793 -33.003 -15.038 1.00 62.53 H new ATOM 0 HE3 LYS A 75 -3.601 -31.749 -14.759 1.00 62.53 H new ATOM 0 HZ1 LYS A 75 -3.264 -32.430 -16.949 1.00 41.05 H new ATOM 0 HZ2 LYS A 75 -2.028 -33.222 -16.095 1.00 41.05 H new ATOM 0 HZ3 LYS A 75 -3.411 -34.080 -16.579 1.00 41.05 H new ATOM 1157 N ILE A 76 -5.795 -34.962 -11.532 1.00 10.31 N ATOM 1158 CA ILE A 76 -7.243 -35.140 -11.606 1.00 43.12 C ATOM 1159 C ILE A 76 -7.764 -34.718 -12.979 1.00 51.15 C ATOM 1160 O ILE A 76 -7.464 -33.619 -13.461 1.00 60.02 O ATOM 1161 CB ILE A 76 -7.982 -34.321 -10.514 1.00 3.10 C ATOM 1162 CG1 ILE A 76 -7.398 -34.627 -9.123 1.00 3.44 C ATOM 1163 CG2 ILE A 76 -9.489 -34.614 -10.545 1.00 13.44 C ATOM 1164 CD1 ILE A 76 -8.036 -33.835 -7.998 1.00 73.14 C ATOM 0 H ILE A 76 -5.495 -33.990 -11.460 1.00 10.31 H new ATOM 0 HA ILE A 76 -7.442 -36.199 -11.441 1.00 43.12 H new ATOM 0 HB ILE A 76 -7.836 -33.261 -10.722 1.00 3.10 H new ATOM 0 HG12 ILE A 76 -7.516 -35.691 -8.917 1.00 3.44 H new ATOM 0 HG13 ILE A 76 -6.328 -34.422 -9.136 1.00 3.44 H new ATOM 0 HG21 ILE A 76 -9.989 -34.030 -9.772 1.00 13.44 H new ATOM 0 HG22 ILE A 76 -9.892 -34.344 -11.521 1.00 13.44 H new ATOM 0 HG23 ILE A 76 -9.657 -35.676 -10.364 1.00 13.44 H new ATOM 0 HD11 ILE A 76 -7.570 -34.108 -7.051 1.00 73.14 H new ATOM 0 HD12 ILE A 76 -7.895 -32.769 -8.178 1.00 73.14 H new ATOM 0 HD13 ILE A 76 -9.102 -34.058 -7.955 1.00 73.14 H new ATOM 1176 N TYR A 77 -8.530 -35.602 -13.603 1.00 3.34 N ATOM 1177 CA TYR A 77 -9.152 -35.327 -14.891 1.00 12.22 C ATOM 1178 C TYR A 77 -10.660 -35.196 -14.722 1.00 34.33 C ATOM 1179 O TYR A 77 -11.211 -35.537 -13.673 1.00 1.44 O ATOM 1180 CB TYR A 77 -8.839 -36.443 -15.898 1.00 23.15 C ATOM 1181 CG TYR A 77 -7.357 -36.664 -16.132 1.00 51.23 C ATOM 1182 CD1 TYR A 77 -6.722 -37.801 -15.649 1.00 62.14 C ATOM 1183 CD2 TYR A 77 -6.593 -35.734 -16.826 1.00 61.02 C ATOM 1184 CE1 TYR A 77 -5.371 -38.006 -15.854 1.00 25.40 C ATOM 1185 CE2 TYR A 77 -5.242 -35.934 -17.035 1.00 34.01 C ATOM 1186 CZ TYR A 77 -4.636 -37.071 -16.546 1.00 2.40 C ATOM 1187 OH TYR A 77 -3.289 -37.271 -16.751 1.00 22.34 O ATOM 0 H TYR A 77 -8.738 -36.529 -13.231 1.00 3.34 H new ATOM 0 HA TYR A 77 -8.747 -34.391 -15.274 1.00 12.22 H new ATOM 0 HB2 TYR A 77 -9.283 -37.373 -15.544 1.00 23.15 H new ATOM 0 HB3 TYR A 77 -9.315 -36.204 -16.849 1.00 23.15 H new ATOM 0 HD1 TYR A 77 -7.294 -38.537 -15.104 1.00 62.14 H new ATOM 0 HD2 TYR A 77 -7.063 -34.840 -17.208 1.00 61.02 H new ATOM 0 HE1 TYR A 77 -4.894 -38.897 -15.473 1.00 25.40 H new ATOM 0 HE2 TYR A 77 -4.663 -35.202 -17.579 1.00 34.01 H new ATOM 0 HH TYR A 77 -2.920 -36.518 -17.257 1.00 22.34 H new ATOM 1197 N LYS A 78 -11.321 -34.710 -15.761 1.00 10.01 N ATOM 1198 CA LYS A 78 -12.771 -34.577 -15.768 1.00 3.41 C ATOM 1199 C LYS A 78 -13.315 -35.085 -17.098 1.00 25.15 C ATOM 1200 O LYS A 78 -13.248 -34.387 -18.113 1.00 45.21 O ATOM 1201 CB LYS A 78 -13.179 -33.110 -15.551 1.00 53.32 C ATOM 1202 CG LYS A 78 -14.686 -32.901 -15.393 1.00 32.43 C ATOM 1203 CD LYS A 78 -15.076 -31.421 -15.462 1.00 31.14 C ATOM 1204 CE LYS A 78 -14.426 -30.590 -14.358 1.00 3.31 C ATOM 1205 NZ LYS A 78 -14.893 -30.988 -13.003 1.00 62.33 N1+ ATOM 0 H LYS A 78 -10.870 -34.397 -16.621 1.00 10.01 H new ATOM 0 HA LYS A 78 -13.189 -35.169 -14.954 1.00 3.41 H new ATOM 0 HB2 LYS A 78 -12.675 -32.731 -14.662 1.00 53.32 H new ATOM 0 HB3 LYS A 78 -12.827 -32.517 -16.395 1.00 53.32 H new ATOM 0 HG2 LYS A 78 -15.211 -33.450 -16.175 1.00 32.43 H new ATOM 0 HG3 LYS A 78 -15.011 -33.316 -14.439 1.00 32.43 H new ATOM 0 HD2 LYS A 78 -14.787 -31.018 -16.433 1.00 31.14 H new ATOM 0 HD3 LYS A 78 -16.160 -31.331 -15.389 1.00 31.14 H new ATOM 0 HE2 LYS A 78 -13.343 -30.700 -14.413 1.00 3.31 H new ATOM 0 HE3 LYS A 78 -14.648 -29.535 -14.521 1.00 3.31 H new ATOM 0 HZ1 LYS A 78 -14.237 -30.617 -12.287 1.00 62.33 H new ATOM 0 HZ2 LYS A 78 -15.843 -30.600 -12.836 1.00 62.33 H new ATOM 0 HZ3 LYS A 78 -14.926 -32.025 -12.938 1.00 62.33 H new ATOM 1219 N ILE A 79 -13.805 -36.320 -17.101 1.00 35.25 N ATOM 1220 CA ILE A 79 -14.399 -36.912 -18.294 1.00 51.22 C ATOM 1221 C ILE A 79 -15.859 -37.263 -18.000 1.00 13.33 C ATOM 1222 O ILE A 79 -16.171 -38.282 -17.383 1.00 3.23 O ATOM 1223 CB ILE A 79 -13.577 -38.146 -18.801 1.00 11.23 C ATOM 1224 CG1 ILE A 79 -14.096 -38.675 -20.164 1.00 75.13 C ATOM 1225 CG2 ILE A 79 -13.536 -39.263 -17.762 1.00 32.21 C ATOM 1226 CD1 ILE A 79 -15.325 -39.570 -20.091 1.00 50.20 C ATOM 0 H ILE A 79 -13.802 -36.933 -16.286 1.00 35.25 H new ATOM 0 HA ILE A 79 -14.373 -36.188 -19.108 1.00 51.22 H new ATOM 0 HB ILE A 79 -12.556 -37.796 -18.955 1.00 11.23 H new ATOM 0 HG12 ILE A 79 -14.326 -37.822 -20.802 1.00 75.13 H new ATOM 0 HG13 ILE A 79 -13.292 -39.229 -20.650 1.00 75.13 H new ATOM 0 HG21 ILE A 79 -12.957 -40.101 -18.151 1.00 32.21 H new ATOM 0 HG22 ILE A 79 -13.070 -38.893 -16.848 1.00 32.21 H new ATOM 0 HG23 ILE A 79 -14.551 -39.594 -17.543 1.00 32.21 H new ATOM 0 HD11 ILE A 79 -15.606 -39.885 -21.096 1.00 50.20 H new ATOM 0 HD12 ILE A 79 -15.100 -40.448 -19.485 1.00 50.20 H new ATOM 0 HD13 ILE A 79 -16.150 -39.019 -19.640 1.00 50.20 H new ATOM 1238 N ASN A 80 -16.746 -36.364 -18.398 1.00 52.33 N ATOM 1239 CA ASN A 80 -18.174 -36.527 -18.169 1.00 2.04 C ATOM 1240 C ASN A 80 -18.965 -35.830 -19.273 1.00 60.11 C ATOM 1241 O ASN A 80 -19.197 -34.620 -19.229 1.00 23.20 O ATOM 1242 CB ASN A 80 -18.570 -35.978 -16.782 1.00 23.44 C ATOM 1243 CG ASN A 80 -18.244 -34.498 -16.597 1.00 12.41 C ATOM 1244 OD1 ASN A 80 -17.273 -33.980 -17.150 1.00 32.04 O ATOM 1245 ND2 ASN A 80 -19.058 -33.807 -15.815 1.00 24.31 N ATOM 0 H ASN A 80 -16.498 -35.504 -18.887 1.00 52.33 H new ATOM 0 HA ASN A 80 -18.412 -37.591 -18.190 1.00 2.04 H new ATOM 0 HB2 ASN A 80 -19.639 -36.128 -16.633 1.00 23.44 H new ATOM 0 HB3 ASN A 80 -18.057 -36.554 -16.012 1.00 23.44 H new ATOM 0 HD21 ASN A 80 -18.890 -32.814 -15.655 1.00 24.31 H new ATOM 0 HD22 ASN A 80 -19.853 -34.268 -15.372 1.00 24.31 H new ATOM 1252 N ILE A 81 -19.343 -36.591 -20.290 1.00 22.21 N ATOM 1253 CA ILE A 81 -20.153 -36.055 -21.375 1.00 54.13 C ATOM 1254 C ILE A 81 -21.573 -35.844 -20.863 1.00 65.23 C ATOM 1255 O ILE A 81 -22.286 -36.809 -20.585 1.00 21.40 O ATOM 1256 CB ILE A 81 -20.168 -36.985 -22.625 1.00 63.43 C ATOM 1257 CG1 ILE A 81 -18.758 -37.132 -23.237 1.00 0.10 C ATOM 1258 CG2 ILE A 81 -21.146 -36.453 -23.677 1.00 45.20 C ATOM 1259 CD1 ILE A 81 -17.785 -37.943 -22.402 1.00 64.23 C ATOM 0 H ILE A 81 -19.103 -37.578 -20.387 1.00 22.21 H new ATOM 0 HA ILE A 81 -19.713 -35.110 -21.694 1.00 54.13 H new ATOM 0 HB ILE A 81 -20.498 -37.971 -22.299 1.00 63.43 H new ATOM 0 HG12 ILE A 81 -18.850 -37.598 -24.218 1.00 0.10 H new ATOM 0 HG13 ILE A 81 -18.340 -36.138 -23.394 1.00 0.10 H new ATOM 0 HG21 ILE A 81 -21.144 -37.115 -24.543 1.00 45.20 H new ATOM 0 HG22 ILE A 81 -22.150 -36.413 -23.254 1.00 45.20 H new ATOM 0 HG23 ILE A 81 -20.841 -35.452 -23.984 1.00 45.20 H new ATOM 0 HD11 ILE A 81 -16.822 -37.992 -22.911 1.00 64.23 H new ATOM 0 HD12 ILE A 81 -17.658 -37.469 -21.429 1.00 64.23 H new ATOM 0 HD13 ILE A 81 -18.175 -38.952 -22.266 1.00 64.23 H new ATOM 1271 N GLU A 82 -21.965 -34.583 -20.716 1.00 34.03 N ATOM 1272 CA GLU A 82 -23.253 -34.225 -20.122 1.00 12.21 C ATOM 1273 C GLU A 82 -24.404 -34.846 -20.923 1.00 64.13 C ATOM 1274 O GLU A 82 -25.444 -35.204 -20.368 1.00 42.22 O ATOM 1275 CB GLU A 82 -23.364 -32.687 -20.056 1.00 14.33 C ATOM 1276 CG GLU A 82 -24.395 -32.147 -19.064 1.00 12.32 C ATOM 1277 CD GLU A 82 -25.808 -32.101 -19.621 1.00 44.14 C ATOM 1278 OE1 GLU A 82 -26.041 -31.338 -20.580 1.00 64.21 O ATOM 1279 OE2 GLU A 82 -26.697 -32.793 -19.079 1.00 51.21 O1- ATOM 0 H GLU A 82 -21.403 -33.781 -21.003 1.00 34.03 H new ATOM 0 HA GLU A 82 -23.319 -34.622 -19.109 1.00 12.21 H new ATOM 0 HB2 GLU A 82 -22.387 -32.280 -19.797 1.00 14.33 H new ATOM 0 HB3 GLU A 82 -23.611 -32.314 -21.050 1.00 14.33 H new ATOM 0 HG2 GLU A 82 -24.386 -32.769 -18.169 1.00 12.32 H new ATOM 0 HG3 GLU A 82 -24.101 -31.143 -18.758 1.00 12.32 H new ATOM 1286 N ASP A 83 -24.189 -35.000 -22.228 1.00 63.52 N ATOM 1287 CA ASP A 83 -25.190 -35.592 -23.123 1.00 11.04 C ATOM 1288 C ASP A 83 -25.195 -37.120 -23.031 1.00 33.50 C ATOM 1289 O ASP A 83 -26.168 -37.765 -23.418 1.00 21.21 O ATOM 1290 CB ASP A 83 -24.937 -35.160 -24.575 1.00 23.45 C ATOM 1291 CG ASP A 83 -25.309 -33.708 -24.830 1.00 52.42 C ATOM 1292 OD1 ASP A 83 -24.552 -32.808 -24.405 1.00 43.25 O ATOM 1293 OD2 ASP A 83 -26.360 -33.462 -25.465 1.00 25.20 O1- ATOM 0 H ASP A 83 -23.326 -34.722 -22.695 1.00 63.52 H new ATOM 0 HA ASP A 83 -26.167 -35.229 -22.804 1.00 11.04 H new ATOM 0 HB2 ASP A 83 -23.884 -35.308 -24.815 1.00 23.45 H new ATOM 0 HB3 ASP A 83 -25.510 -35.800 -25.245 1.00 23.45 H new ATOM 1298 N ASN A 84 -24.114 -37.697 -22.517 1.00 32.21 N ATOM 1299 CA ASN A 84 -24.003 -39.155 -22.393 1.00 13.34 C ATOM 1300 C ASN A 84 -23.826 -39.546 -20.927 1.00 61.05 C ATOM 1301 O ASN A 84 -22.713 -39.793 -20.458 1.00 23.22 O ATOM 1302 CB ASN A 84 -22.839 -39.689 -23.252 1.00 61.11 C ATOM 1303 CG ASN A 84 -22.614 -41.193 -23.105 1.00 73.53 C ATOM 1304 OD1 ASN A 84 -23.527 -41.949 -22.760 1.00 44.50 O ATOM 1305 ND2 ASN A 84 -21.399 -41.642 -23.393 1.00 3.45 N ATOM 0 H ASN A 84 -23.301 -37.183 -22.179 1.00 32.21 H new ATOM 0 HA ASN A 84 -24.923 -39.608 -22.761 1.00 13.34 H new ATOM 0 HB2 ASN A 84 -23.036 -39.460 -24.299 1.00 61.11 H new ATOM 0 HB3 ASN A 84 -21.924 -39.164 -22.977 1.00 61.11 H new ATOM 0 HD21 ASN A 84 -21.196 -42.640 -23.332 1.00 3.45 H new ATOM 0 HD22 ASN A 84 -20.668 -40.989 -23.675 1.00 3.45 H new ATOM 1312 N GLN A 85 -24.939 -39.567 -20.204 1.00 14.34 N ATOM 1313 CA GLN A 85 -24.941 -39.894 -18.778 1.00 73.43 C ATOM 1314 C GLN A 85 -24.694 -41.388 -18.556 1.00 30.44 C ATOM 1315 O GLN A 85 -24.248 -41.797 -17.485 1.00 11.40 O ATOM 1316 CB GLN A 85 -26.285 -39.486 -18.158 1.00 62.01 C ATOM 1317 CG GLN A 85 -26.381 -39.723 -16.654 1.00 14.43 C ATOM 1318 CD GLN A 85 -27.759 -39.411 -16.102 1.00 52.52 C ATOM 1319 OE1 GLN A 85 -28.040 -38.280 -15.700 1.00 30.11 O ATOM 1320 NE2 GLN A 85 -28.628 -40.409 -16.075 1.00 22.33 N ATOM 0 H GLN A 85 -25.862 -39.359 -20.584 1.00 14.34 H new ATOM 0 HA GLN A 85 -24.134 -39.343 -18.296 1.00 73.43 H new ATOM 0 HB2 GLN A 85 -26.458 -38.429 -18.359 1.00 62.01 H new ATOM 0 HB3 GLN A 85 -27.083 -40.040 -18.653 1.00 62.01 H new ATOM 0 HG2 GLN A 85 -26.133 -40.762 -16.437 1.00 14.43 H new ATOM 0 HG3 GLN A 85 -25.641 -39.106 -16.145 1.00 14.43 H new ATOM 0 HE21 GLN A 85 -28.357 -41.331 -16.417 1.00 22.33 H new ATOM 0 HE22 GLN A 85 -29.569 -40.256 -15.712 1.00 22.33 H new ATOM 1329 N ASP A 86 -24.968 -42.186 -19.589 1.00 11.41 N ATOM 1330 CA ASP A 86 -24.878 -43.650 -19.507 1.00 44.11 C ATOM 1331 C ASP A 86 -23.587 -44.103 -18.819 1.00 63.32 C ATOM 1332 O ASP A 86 -23.620 -44.933 -17.909 1.00 33.14 O ATOM 1333 CB ASP A 86 -24.975 -44.262 -20.911 1.00 54.34 C ATOM 1334 CG ASP A 86 -24.759 -45.770 -20.921 1.00 51.54 C ATOM 1335 OD1 ASP A 86 -25.648 -46.510 -20.433 1.00 24.41 O ATOM 1336 OD2 ASP A 86 -23.713 -46.222 -21.436 1.00 5.23 O1- ATOM 0 H ASP A 86 -25.258 -41.840 -20.504 1.00 11.41 H new ATOM 0 HA ASP A 86 -25.713 -44.001 -18.901 1.00 44.11 H new ATOM 0 HB2 ASP A 86 -25.955 -44.038 -21.331 1.00 54.34 H new ATOM 0 HB3 ASP A 86 -24.236 -43.791 -21.558 1.00 54.34 H new ATOM 1341 N VAL A 87 -22.462 -43.528 -19.238 1.00 53.31 N ATOM 1342 CA VAL A 87 -21.156 -43.860 -18.664 1.00 43.31 C ATOM 1343 C VAL A 87 -21.171 -43.705 -17.141 1.00 71.01 C ATOM 1344 O VAL A 87 -20.650 -44.555 -16.411 1.00 44.23 O ATOM 1345 CB VAL A 87 -20.039 -42.963 -19.260 1.00 24.23 C ATOM 1346 CG1 VAL A 87 -18.677 -43.295 -18.645 1.00 42.44 C ATOM 1347 CG2 VAL A 87 -19.998 -43.096 -20.782 1.00 22.14 C ATOM 0 H VAL A 87 -22.427 -42.826 -19.977 1.00 53.31 H new ATOM 0 HA VAL A 87 -20.948 -44.900 -18.915 1.00 43.31 H new ATOM 0 HB VAL A 87 -20.270 -41.927 -19.013 1.00 24.23 H new ATOM 0 HG11 VAL A 87 -17.914 -42.651 -19.082 1.00 42.44 H new ATOM 0 HG12 VAL A 87 -18.715 -43.134 -17.568 1.00 42.44 H new ATOM 0 HG13 VAL A 87 -18.431 -44.337 -18.847 1.00 42.44 H new ATOM 0 HG21 VAL A 87 -19.209 -42.460 -21.182 1.00 22.14 H new ATOM 0 HG22 VAL A 87 -19.799 -44.133 -21.051 1.00 22.14 H new ATOM 0 HG23 VAL A 87 -20.957 -42.790 -21.200 1.00 22.14 H new ATOM 1357 N ALA A 88 -21.800 -42.634 -16.670 1.00 74.24 N ATOM 1358 CA ALA A 88 -21.847 -42.334 -15.244 1.00 11.24 C ATOM 1359 C ALA A 88 -22.627 -43.410 -14.496 1.00 40.14 C ATOM 1360 O ALA A 88 -22.195 -43.900 -13.451 1.00 31.23 O ATOM 1361 CB ALA A 88 -22.468 -40.957 -15.015 1.00 44.41 C ATOM 0 H ALA A 88 -22.286 -41.957 -17.258 1.00 74.24 H new ATOM 0 HA ALA A 88 -20.829 -42.322 -14.856 1.00 11.24 H new ATOM 0 HB1 ALA A 88 -22.498 -40.744 -13.946 1.00 44.41 H new ATOM 0 HB2 ALA A 88 -21.869 -40.199 -15.519 1.00 44.41 H new ATOM 0 HB3 ALA A 88 -23.482 -40.944 -15.416 1.00 44.41 H new ATOM 1367 N THR A 89 -23.769 -43.790 -15.054 1.00 43.13 N ATOM 1368 CA THR A 89 -24.623 -44.801 -14.446 1.00 3.03 C ATOM 1369 C THR A 89 -23.949 -46.178 -14.497 1.00 72.34 C ATOM 1370 O THR A 89 -24.161 -47.015 -13.619 1.00 54.24 O ATOM 1371 CB THR A 89 -25.996 -44.849 -15.158 1.00 23.32 C ATOM 1372 OG1 THR A 89 -26.518 -43.516 -15.282 1.00 72.42 O ATOM 1373 CG2 THR A 89 -26.997 -45.714 -14.396 1.00 3.52 C ATOM 0 H THR A 89 -24.126 -43.411 -15.931 1.00 43.13 H new ATOM 0 HA THR A 89 -24.782 -44.532 -13.402 1.00 3.03 H new ATOM 0 HB THR A 89 -25.847 -45.291 -16.143 1.00 23.32 H new ATOM 0 HG1 THR A 89 -27.387 -43.546 -15.734 1.00 72.42 H new ATOM 0 HG21 THR A 89 -27.949 -45.723 -14.927 1.00 3.52 H new ATOM 0 HG22 THR A 89 -26.614 -46.732 -14.320 1.00 3.52 H new ATOM 0 HG23 THR A 89 -27.143 -45.306 -13.396 1.00 3.52 H new ATOM 1381 N GLN A 90 -23.120 -46.395 -15.522 1.00 45.13 N ATOM 1382 CA GLN A 90 -22.398 -47.659 -15.678 1.00 11.14 C ATOM 1383 C GLN A 90 -21.309 -47.804 -14.618 1.00 24.42 C ATOM 1384 O GLN A 90 -21.170 -48.862 -13.999 1.00 33.43 O ATOM 1385 CB GLN A 90 -21.779 -47.763 -17.083 1.00 21.33 C ATOM 1386 CG GLN A 90 -22.804 -47.922 -18.198 1.00 23.40 C ATOM 1387 CD GLN A 90 -23.695 -49.139 -18.000 1.00 32.12 C ATOM 1388 OE1 GLN A 90 -24.754 -49.058 -17.372 1.00 31.51 O ATOM 1389 NE2 GLN A 90 -23.273 -50.275 -18.528 1.00 52.44 N ATOM 0 H GLN A 90 -22.933 -45.711 -16.256 1.00 45.13 H new ATOM 0 HA GLN A 90 -23.117 -48.468 -15.549 1.00 11.14 H new ATOM 0 HB2 GLN A 90 -21.184 -46.870 -17.274 1.00 21.33 H new ATOM 0 HB3 GLN A 90 -21.096 -48.612 -17.107 1.00 21.33 H new ATOM 0 HG2 GLN A 90 -23.423 -47.026 -18.248 1.00 23.40 H new ATOM 0 HG3 GLN A 90 -22.287 -48.006 -19.154 1.00 23.40 H new ATOM 0 HE21 GLN A 90 -22.392 -50.303 -19.041 1.00 52.44 H new ATOM 0 HE22 GLN A 90 -23.829 -51.124 -18.423 1.00 52.44 H new ATOM 1398 N TYR A 91 -20.533 -46.743 -14.423 1.00 23.00 N ATOM 1399 CA TYR A 91 -19.448 -46.755 -13.443 1.00 63.04 C ATOM 1400 C TYR A 91 -19.982 -46.529 -12.028 1.00 53.41 C ATOM 1401 O TYR A 91 -19.295 -46.809 -11.044 1.00 53.15 O ATOM 1402 CB TYR A 91 -18.380 -45.713 -13.808 1.00 50.03 C ATOM 1403 CG TYR A 91 -17.512 -46.142 -14.983 1.00 40.41 C ATOM 1404 CD1 TYR A 91 -16.179 -46.495 -14.798 1.00 1.24 C ATOM 1405 CD2 TYR A 91 -18.034 -46.218 -16.270 1.00 62.23 C ATOM 1406 CE1 TYR A 91 -15.395 -46.909 -15.860 1.00 31.01 C ATOM 1407 CE2 TYR A 91 -17.257 -46.629 -17.337 1.00 43.30 C ATOM 1408 CZ TYR A 91 -15.938 -46.974 -17.125 1.00 51.11 C ATOM 1409 OH TYR A 91 -15.161 -47.396 -18.181 1.00 21.33 O ATOM 0 H TYR A 91 -20.634 -45.863 -14.929 1.00 23.00 H new ATOM 0 HA TYR A 91 -18.981 -47.740 -13.464 1.00 63.04 H new ATOM 0 HB2 TYR A 91 -18.868 -44.769 -14.049 1.00 50.03 H new ATOM 0 HB3 TYR A 91 -17.745 -45.531 -12.941 1.00 50.03 H new ATOM 0 HD1 TYR A 91 -15.749 -46.445 -13.809 1.00 1.24 H new ATOM 0 HD2 TYR A 91 -19.067 -45.951 -16.439 1.00 62.23 H new ATOM 0 HE1 TYR A 91 -14.362 -47.180 -15.698 1.00 31.01 H new ATOM 0 HE2 TYR A 91 -17.680 -46.680 -18.330 1.00 43.30 H new ATOM 0 HH TYR A 91 -15.694 -47.386 -19.004 1.00 21.33 H new ATOM 1419 N GLY A 92 -21.205 -46.020 -11.932 1.00 22.12 N ATOM 1420 CA GLY A 92 -21.865 -45.909 -10.642 1.00 65.55 C ATOM 1421 C GLY A 92 -21.713 -44.540 -10.013 1.00 41.00 C ATOM 1422 O GLY A 92 -21.072 -44.394 -8.970 1.00 12.12 O ATOM 0 H GLY A 92 -21.752 -45.682 -12.724 1.00 22.12 H new ATOM 0 HA2 GLY A 92 -22.925 -46.131 -10.763 1.00 65.55 H new ATOM 0 HA3 GLY A 92 -21.457 -46.660 -9.966 1.00 65.55 H new ATOM 1426 N VAL A 93 -22.280 -43.530 -10.664 1.00 13.51 N ATOM 1427 CA VAL A 93 -22.368 -42.195 -10.086 1.00 13.34 C ATOM 1428 C VAL A 93 -23.740 -42.008 -9.451 1.00 30.02 C ATOM 1429 O VAL A 93 -24.763 -42.324 -10.064 1.00 73.22 O ATOM 1430 CB VAL A 93 -22.142 -41.085 -11.140 1.00 53.43 C ATOM 1431 CG1 VAL A 93 -22.354 -39.706 -10.516 1.00 75.31 C ATOM 1432 CG2 VAL A 93 -20.746 -41.200 -11.751 1.00 13.21 C ATOM 0 H VAL A 93 -22.687 -43.612 -11.596 1.00 13.51 H new ATOM 0 HA VAL A 93 -21.581 -42.109 -9.337 1.00 13.34 H new ATOM 0 HB VAL A 93 -22.871 -41.212 -11.940 1.00 53.43 H new ATOM 0 HG11 VAL A 93 -22.191 -38.936 -11.270 1.00 75.31 H new ATOM 0 HG12 VAL A 93 -23.373 -39.632 -10.136 1.00 75.31 H new ATOM 0 HG13 VAL A 93 -21.649 -39.565 -9.696 1.00 75.31 H new ATOM 0 HG21 VAL A 93 -20.606 -40.411 -12.490 1.00 13.21 H new ATOM 0 HG22 VAL A 93 -19.996 -41.100 -10.966 1.00 13.21 H new ATOM 0 HG23 VAL A 93 -20.639 -42.172 -12.233 1.00 13.21 H new ATOM 1442 N SER A 94 -23.761 -41.487 -8.232 1.00 15.51 N ATOM 1443 CA SER A 94 -25.002 -41.356 -7.482 1.00 63.12 C ATOM 1444 C SER A 94 -25.057 -40.014 -6.752 1.00 52.01 C ATOM 1445 O SER A 94 -25.904 -39.170 -7.049 1.00 33.01 O ATOM 1446 CB SER A 94 -25.113 -42.512 -6.484 1.00 45.35 C ATOM 1447 OG SER A 94 -25.008 -43.768 -7.137 1.00 22.42 O ATOM 0 H SER A 94 -22.933 -41.148 -7.742 1.00 15.51 H new ATOM 0 HA SER A 94 -25.842 -41.393 -8.176 1.00 63.12 H new ATOM 0 HB2 SER A 94 -24.328 -42.423 -5.733 1.00 45.35 H new ATOM 0 HB3 SER A 94 -26.066 -42.451 -5.958 1.00 45.35 H new ATOM 0 HG SER A 94 -25.081 -44.488 -6.476 1.00 22.42 H new ATOM 1453 N ALA A 95 -24.146 -39.822 -5.797 1.00 12.01 N ATOM 1454 CA ALA A 95 -24.094 -38.587 -5.018 1.00 52.44 C ATOM 1455 C ALA A 95 -23.276 -37.527 -5.751 1.00 22.24 C ATOM 1456 O ALA A 95 -22.613 -37.821 -6.751 1.00 22.21 O ATOM 1457 CB ALA A 95 -23.518 -38.853 -3.627 1.00 0.24 C ATOM 0 H ALA A 95 -23.434 -40.508 -5.545 1.00 12.01 H new ATOM 0 HA ALA A 95 -25.110 -38.211 -4.898 1.00 52.44 H new ATOM 0 HB1 ALA A 95 -23.487 -37.922 -3.062 1.00 0.24 H new ATOM 0 HB2 ALA A 95 -24.147 -39.574 -3.105 1.00 0.24 H new ATOM 0 HB3 ALA A 95 -22.509 -39.254 -3.722 1.00 0.24 H new ATOM 1463 N ILE A 96 -23.316 -36.300 -5.239 1.00 40.13 N ATOM 1464 CA ILE A 96 -22.666 -35.167 -5.887 1.00 41.53 C ATOM 1465 C ILE A 96 -21.457 -34.667 -5.080 1.00 24.21 C ATOM 1466 O ILE A 96 -21.591 -34.294 -3.914 1.00 22.54 O ATOM 1467 CB ILE A 96 -23.685 -34.009 -6.149 1.00 44.03 C ATOM 1468 CG1 ILE A 96 -24.727 -33.870 -5.007 1.00 70.20 C ATOM 1469 CG2 ILE A 96 -24.400 -34.231 -7.481 1.00 72.40 C ATOM 1470 CD1 ILE A 96 -24.222 -33.183 -3.752 1.00 75.51 C ATOM 0 H ILE A 96 -23.796 -36.065 -4.370 1.00 40.13 H new ATOM 0 HA ILE A 96 -22.293 -35.514 -6.851 1.00 41.53 H new ATOM 0 HB ILE A 96 -23.116 -33.080 -6.186 1.00 44.03 H new ATOM 0 HG12 ILE A 96 -25.585 -33.315 -5.386 1.00 70.20 H new ATOM 0 HG13 ILE A 96 -25.084 -34.865 -4.739 1.00 70.20 H new ATOM 0 HG21 ILE A 96 -25.107 -33.420 -7.654 1.00 72.40 H new ATOM 0 HG22 ILE A 96 -23.668 -34.252 -8.288 1.00 72.40 H new ATOM 0 HG23 ILE A 96 -24.936 -35.180 -7.452 1.00 72.40 H new ATOM 0 HD11 ILE A 96 -25.024 -33.135 -3.015 1.00 75.51 H new ATOM 0 HD12 ILE A 96 -23.385 -33.747 -3.341 1.00 75.51 H new ATOM 0 HD13 ILE A 96 -23.894 -32.173 -3.997 1.00 75.51 H new ATOM 1482 N PRO A 97 -20.239 -34.714 -5.665 1.00 41.14 N ATOM 1483 CA PRO A 97 -19.978 -35.343 -6.961 1.00 50.44 C ATOM 1484 C PRO A 97 -19.549 -36.805 -6.794 1.00 2.04 C ATOM 1485 O PRO A 97 -19.804 -37.423 -5.756 1.00 63.12 O ATOM 1486 CB PRO A 97 -18.831 -34.487 -7.501 1.00 4.13 C ATOM 1487 CG PRO A 97 -18.040 -34.114 -6.285 1.00 64.14 C ATOM 1488 CD PRO A 97 -19.004 -34.128 -5.111 1.00 35.15 C ATOM 0 HA PRO A 97 -20.848 -35.379 -7.616 1.00 50.44 H new ATOM 0 HB2 PRO A 97 -18.223 -35.042 -8.216 1.00 4.13 H new ATOM 0 HB3 PRO A 97 -19.204 -33.603 -8.019 1.00 4.13 H new ATOM 0 HG2 PRO A 97 -17.224 -34.819 -6.124 1.00 64.14 H new ATOM 0 HG3 PRO A 97 -17.590 -33.128 -6.404 1.00 64.14 H new ATOM 0 HD2 PRO A 97 -18.616 -34.723 -4.284 1.00 35.15 H new ATOM 0 HD3 PRO A 97 -19.178 -33.123 -4.726 1.00 35.15 H new ATOM 1496 N THR A 98 -18.908 -37.356 -7.815 1.00 51.24 N ATOM 1497 CA THR A 98 -18.396 -38.722 -7.761 1.00 74.00 C ATOM 1498 C THR A 98 -16.994 -38.784 -8.372 1.00 5.01 C ATOM 1499 O THR A 98 -16.768 -38.297 -9.485 1.00 43.51 O ATOM 1500 CB THR A 98 -19.342 -39.708 -8.487 1.00 21.00 C ATOM 1501 OG1 THR A 98 -20.621 -39.724 -7.830 1.00 33.40 O ATOM 1502 CG2 THR A 98 -18.768 -41.121 -8.510 1.00 73.42 C ATOM 0 H THR A 98 -18.728 -36.876 -8.697 1.00 51.24 H new ATOM 0 HA THR A 98 -18.343 -39.020 -6.714 1.00 74.00 H new ATOM 0 HB THR A 98 -19.453 -39.369 -9.517 1.00 21.00 H new ATOM 0 HG1 THR A 98 -20.983 -38.814 -7.796 1.00 33.40 H new ATOM 0 HG21 THR A 98 -19.459 -41.786 -9.028 1.00 73.42 H new ATOM 0 HG22 THR A 98 -17.810 -41.116 -9.031 1.00 73.42 H new ATOM 0 HG23 THR A 98 -18.624 -41.472 -7.488 1.00 73.42 H new ATOM 1510 N ILE A 99 -16.062 -39.381 -7.632 1.00 33.32 N ATOM 1511 CA ILE A 99 -14.652 -39.408 -8.012 1.00 62.41 C ATOM 1512 C ILE A 99 -14.164 -40.848 -8.180 1.00 30.42 C ATOM 1513 O ILE A 99 -14.230 -41.643 -7.239 1.00 23.12 O ATOM 1514 CB ILE A 99 -13.774 -38.718 -6.930 1.00 11.51 C ATOM 1515 CG1 ILE A 99 -14.282 -37.292 -6.628 1.00 44.42 C ATOM 1516 CG2 ILE A 99 -12.305 -38.689 -7.362 1.00 43.23 C ATOM 1517 CD1 ILE A 99 -14.219 -36.346 -7.808 1.00 13.43 C ATOM 0 H ILE A 99 -16.263 -39.859 -6.754 1.00 33.32 H new ATOM 0 HA ILE A 99 -14.561 -38.873 -8.957 1.00 62.41 H new ATOM 0 HB ILE A 99 -13.851 -39.303 -6.013 1.00 11.51 H new ATOM 0 HG12 ILE A 99 -15.313 -37.352 -6.280 1.00 44.42 H new ATOM 0 HG13 ILE A 99 -13.694 -36.875 -5.811 1.00 44.42 H new ATOM 0 HG21 ILE A 99 -11.708 -38.202 -6.591 1.00 43.23 H new ATOM 0 HG22 ILE A 99 -11.948 -39.709 -7.507 1.00 43.23 H new ATOM 0 HG23 ILE A 99 -12.211 -38.136 -8.296 1.00 43.23 H new ATOM 0 HD11 ILE A 99 -14.594 -35.367 -7.510 1.00 13.43 H new ATOM 0 HD12 ILE A 99 -13.186 -36.252 -8.144 1.00 13.43 H new ATOM 0 HD13 ILE A 99 -14.831 -36.737 -8.621 1.00 13.43 H new ATOM 1529 N LEU A 100 -13.693 -41.184 -9.376 1.00 43.14 N ATOM 1530 CA LEU A 100 -13.046 -42.475 -9.617 1.00 54.31 C ATOM 1531 C LEU A 100 -11.553 -42.353 -9.316 1.00 72.51 C ATOM 1532 O LEU A 100 -10.967 -41.292 -9.522 1.00 11.02 O ATOM 1533 CB LEU A 100 -13.226 -42.920 -11.078 1.00 62.44 C ATOM 1534 CG LEU A 100 -14.657 -42.857 -11.638 1.00 2.41 C ATOM 1535 CD1 LEU A 100 -14.707 -43.443 -13.048 1.00 3.04 C ATOM 1536 CD2 LEU A 100 -15.640 -43.573 -10.719 1.00 53.13 C ATOM 0 H LEU A 100 -13.746 -40.581 -10.197 1.00 43.14 H new ATOM 0 HA LEU A 100 -13.508 -43.218 -8.967 1.00 54.31 H new ATOM 0 HB2 LEU A 100 -12.585 -42.301 -11.706 1.00 62.44 H new ATOM 0 HB3 LEU A 100 -12.867 -43.945 -11.170 1.00 62.44 H new ATOM 0 HG LEU A 100 -14.953 -41.809 -11.690 1.00 2.41 H new ATOM 0 HD11 LEU A 100 -15.727 -43.390 -13.428 1.00 3.04 H new ATOM 0 HD12 LEU A 100 -14.046 -42.874 -13.702 1.00 3.04 H new ATOM 0 HD13 LEU A 100 -14.383 -44.484 -13.021 1.00 3.04 H new ATOM 0 HD21 LEU A 100 -16.643 -43.512 -11.141 1.00 53.13 H new ATOM 0 HD22 LEU A 100 -15.351 -44.619 -10.621 1.00 53.13 H new ATOM 0 HD23 LEU A 100 -15.630 -43.101 -9.737 1.00 53.13 H new ATOM 1548 N MET A 101 -10.946 -43.422 -8.818 1.00 11.43 N ATOM 1549 CA MET A 101 -9.500 -43.462 -8.604 1.00 4.10 C ATOM 1550 C MET A 101 -8.867 -44.467 -9.570 1.00 43.12 C ATOM 1551 O MET A 101 -9.459 -45.504 -9.871 1.00 65.12 O ATOM 1552 CB MET A 101 -9.182 -43.854 -7.143 1.00 31.24 C ATOM 1553 CG MET A 101 -9.692 -42.870 -6.099 1.00 63.31 C ATOM 1554 SD MET A 101 -8.611 -41.448 -5.872 1.00 12.02 S ATOM 1555 CE MET A 101 -9.388 -40.696 -4.445 1.00 54.53 C ATOM 0 H MET A 101 -11.433 -44.278 -8.553 1.00 11.43 H new ATOM 0 HA MET A 101 -9.085 -42.472 -8.792 1.00 4.10 H new ATOM 0 HB2 MET A 101 -9.614 -44.834 -6.941 1.00 31.24 H new ATOM 0 HB3 MET A 101 -8.102 -43.953 -7.034 1.00 31.24 H new ATOM 0 HG2 MET A 101 -10.682 -42.522 -6.392 1.00 63.31 H new ATOM 0 HG3 MET A 101 -9.805 -43.388 -5.146 1.00 63.31 H new ATOM 0 HE1 MET A 101 -9.824 -39.739 -4.731 1.00 54.53 H new ATOM 0 HE2 MET A 101 -10.171 -41.354 -4.068 1.00 54.53 H new ATOM 0 HE3 MET A 101 -8.642 -40.537 -3.666 1.00 54.53 H new ATOM 1565 N PHE A 102 -7.675 -44.148 -10.067 1.00 13.11 N ATOM 1566 CA PHE A 102 -6.899 -45.055 -10.917 1.00 71.35 C ATOM 1567 C PHE A 102 -5.417 -44.882 -10.606 1.00 34.00 C ATOM 1568 O PHE A 102 -5.003 -43.802 -10.185 1.00 61.02 O ATOM 1569 CB PHE A 102 -7.151 -44.774 -12.407 1.00 21.10 C ATOM 1570 CG PHE A 102 -8.551 -45.096 -12.867 1.00 2.32 C ATOM 1571 CD1 PHE A 102 -9.488 -44.088 -13.055 1.00 2.42 C ATOM 1572 CD2 PHE A 102 -8.929 -46.409 -13.115 1.00 24.22 C ATOM 1573 CE1 PHE A 102 -10.769 -44.386 -13.480 1.00 61.40 C ATOM 1574 CE2 PHE A 102 -10.209 -46.710 -13.538 1.00 73.14 C ATOM 1575 CZ PHE A 102 -11.130 -45.698 -13.722 1.00 3.41 C ATOM 0 H PHE A 102 -7.217 -43.253 -9.893 1.00 13.11 H new ATOM 0 HA PHE A 102 -7.211 -46.079 -10.710 1.00 71.35 H new ATOM 0 HB2 PHE A 102 -6.948 -43.722 -12.607 1.00 21.10 H new ATOM 0 HB3 PHE A 102 -6.443 -45.354 -13.000 1.00 21.10 H new ATOM 0 HD1 PHE A 102 -9.213 -43.061 -12.867 1.00 2.42 H new ATOM 0 HD2 PHE A 102 -8.213 -47.205 -12.975 1.00 24.22 H new ATOM 0 HE1 PHE A 102 -11.488 -43.593 -13.623 1.00 61.40 H new ATOM 0 HE2 PHE A 102 -10.489 -47.736 -13.725 1.00 73.14 H new ATOM 0 HZ PHE A 102 -12.131 -45.931 -14.054 1.00 3.41 H new ATOM 1585 N LYS A 103 -4.618 -45.931 -10.788 1.00 14.01 N ATOM 1586 CA LYS A 103 -3.174 -45.816 -10.543 1.00 2.12 C ATOM 1587 C LYS A 103 -2.401 -46.873 -11.319 1.00 22.12 C ATOM 1588 O LYS A 103 -2.683 -48.059 -11.193 1.00 72.21 O ATOM 1589 CB LYS A 103 -2.875 -45.947 -9.041 1.00 74.24 C ATOM 1590 CG LYS A 103 -1.399 -45.785 -8.683 1.00 43.03 C ATOM 1591 CD LYS A 103 -1.147 -45.971 -7.185 1.00 41.12 C ATOM 1592 CE LYS A 103 -1.510 -47.378 -6.711 1.00 53.33 C ATOM 1593 NZ LYS A 103 -1.151 -47.598 -5.283 1.00 71.52 N1+ ATOM 0 H LYS A 103 -4.931 -46.851 -11.097 1.00 14.01 H new ATOM 0 HA LYS A 103 -2.853 -44.833 -10.887 1.00 2.12 H new ATOM 0 HB2 LYS A 103 -3.453 -45.198 -8.500 1.00 74.24 H new ATOM 0 HB3 LYS A 103 -3.216 -46.923 -8.697 1.00 74.24 H new ATOM 0 HG2 LYS A 103 -0.809 -46.511 -9.242 1.00 43.03 H new ATOM 0 HG3 LYS A 103 -1.059 -44.795 -8.987 1.00 43.03 H new ATOM 0 HD2 LYS A 103 -0.097 -45.775 -6.967 1.00 41.12 H new ATOM 0 HD3 LYS A 103 -1.730 -45.239 -6.626 1.00 41.12 H new ATOM 0 HE2 LYS A 103 -2.580 -47.540 -6.845 1.00 53.33 H new ATOM 0 HE3 LYS A 103 -0.996 -48.113 -7.331 1.00 53.33 H new ATOM 0 HZ1 LYS A 103 -1.768 -48.332 -4.879 1.00 71.52 H new ATOM 0 HZ2 LYS A 103 -0.159 -47.905 -5.218 1.00 71.52 H new ATOM 0 HZ3 LYS A 103 -1.275 -46.712 -4.753 1.00 71.52 H new ATOM 1607 N ASN A 104 -1.428 -46.431 -12.121 1.00 41.43 N ATOM 1608 CA ASN A 104 -0.584 -47.338 -12.915 1.00 72.22 C ATOM 1609 C ASN A 104 -1.430 -48.146 -13.899 1.00 0.14 C ATOM 1610 O ASN A 104 -1.074 -49.263 -14.284 1.00 72.20 O ATOM 1611 CB ASN A 104 0.223 -48.282 -12.001 1.00 20.21 C ATOM 1612 CG ASN A 104 1.376 -47.582 -11.300 1.00 24.30 C ATOM 1613 OD1 ASN A 104 1.329 -46.380 -11.036 1.00 10.43 O ATOM 1614 ND2 ASN A 104 2.423 -48.333 -10.995 1.00 31.24 N ATOM 0 H ASN A 104 -1.202 -45.444 -12.240 1.00 41.43 H new ATOM 0 HA ASN A 104 0.118 -46.728 -13.483 1.00 72.22 H new ATOM 0 HB2 ASN A 104 -0.443 -48.713 -11.253 1.00 20.21 H new ATOM 0 HB3 ASN A 104 0.613 -49.109 -12.595 1.00 20.21 H new ATOM 0 HD21 ASN A 104 3.228 -47.919 -10.525 1.00 31.24 H new ATOM 0 HD22 ASN A 104 2.425 -49.326 -11.230 1.00 31.24 H new ATOM 1621 N GLY A 105 -2.541 -47.556 -14.328 1.00 32.31 N ATOM 1622 CA GLY A 105 -3.470 -48.252 -15.201 1.00 42.31 C ATOM 1623 C GLY A 105 -4.223 -49.348 -14.472 1.00 34.43 C ATOM 1624 O GLY A 105 -4.880 -50.183 -15.094 1.00 43.11 O ATOM 0 H GLY A 105 -2.816 -46.604 -14.086 1.00 32.31 H new ATOM 0 HA2 GLY A 105 -4.181 -47.538 -15.616 1.00 42.31 H new ATOM 0 HA3 GLY A 105 -2.925 -48.683 -16.040 1.00 42.31 H new ATOM 1628 N LYS A 106 -4.112 -49.349 -13.150 1.00 12.22 N ATOM 1629 CA LYS A 106 -4.799 -50.318 -12.304 1.00 63.04 C ATOM 1630 C LYS A 106 -6.065 -49.683 -11.743 1.00 35.11 C ATOM 1631 O LYS A 106 -6.081 -48.471 -11.452 1.00 44.30 O ATOM 1632 CB LYS A 106 -3.879 -50.771 -11.159 1.00 13.01 C ATOM 1633 CG LYS A 106 -4.414 -51.951 -10.353 1.00 24.15 C ATOM 1634 CD LYS A 106 -3.524 -52.259 -9.151 1.00 53.23 C ATOM 1635 CE LYS A 106 -3.918 -53.561 -8.466 1.00 13.04 C ATOM 1636 NZ LYS A 106 -3.671 -54.742 -9.337 1.00 41.10 N1+ ATOM 0 H LYS A 106 -3.543 -48.678 -12.633 1.00 12.22 H new ATOM 0 HA LYS A 106 -5.064 -51.193 -12.897 1.00 63.04 H new ATOM 0 HB2 LYS A 106 -2.908 -51.040 -11.574 1.00 13.01 H new ATOM 0 HB3 LYS A 106 -3.716 -49.930 -10.485 1.00 13.01 H new ATOM 0 HG2 LYS A 106 -5.425 -51.730 -10.011 1.00 24.15 H new ATOM 0 HG3 LYS A 106 -4.479 -52.831 -10.994 1.00 24.15 H new ATOM 0 HD2 LYS A 106 -2.485 -52.320 -9.476 1.00 53.23 H new ATOM 0 HD3 LYS A 106 -3.586 -51.440 -8.435 1.00 53.23 H new ATOM 0 HE2 LYS A 106 -3.354 -53.669 -7.539 1.00 13.04 H new ATOM 0 HE3 LYS A 106 -4.973 -53.524 -8.195 1.00 13.04 H new ATOM 0 HZ1 LYS A 106 -3.706 -55.609 -8.764 1.00 41.10 H new ATOM 0 HZ2 LYS A 106 -4.400 -54.786 -10.077 1.00 41.10 H new ATOM 0 HZ3 LYS A 106 -2.734 -54.657 -9.780 1.00 41.10 H new ATOM 1650 N LYS A 107 -7.114 -50.495 -11.595 1.00 44.23 N ATOM 1651 CA LYS A 107 -8.405 -50.010 -11.128 1.00 71.41 C ATOM 1652 C LYS A 107 -8.338 -49.724 -9.628 1.00 52.45 C ATOM 1653 O LYS A 107 -8.080 -50.610 -8.810 1.00 11.33 O ATOM 1654 CB LYS A 107 -9.520 -51.020 -11.464 1.00 63.10 C ATOM 1655 CG LYS A 107 -10.930 -50.415 -11.508 1.00 42.24 C ATOM 1656 CD LYS A 107 -11.528 -50.182 -10.119 1.00 71.43 C ATOM 1657 CE LYS A 107 -11.788 -51.491 -9.381 1.00 14.53 C ATOM 1658 NZ LYS A 107 -12.747 -52.363 -10.112 1.00 70.01 N1+ ATOM 0 H LYS A 107 -7.089 -51.495 -11.794 1.00 44.23 H new ATOM 0 HA LYS A 107 -8.646 -49.079 -11.642 1.00 71.41 H new ATOM 0 HB2 LYS A 107 -9.303 -51.475 -12.430 1.00 63.10 H new ATOM 0 HB3 LYS A 107 -9.504 -51.820 -10.724 1.00 63.10 H new ATOM 0 HG2 LYS A 107 -10.895 -49.467 -12.046 1.00 42.24 H new ATOM 0 HG3 LYS A 107 -11.586 -51.078 -12.073 1.00 42.24 H new ATOM 0 HD2 LYS A 107 -10.850 -49.563 -9.532 1.00 71.43 H new ATOM 0 HD3 LYS A 107 -12.462 -49.628 -10.215 1.00 71.43 H new ATOM 0 HE2 LYS A 107 -10.847 -52.023 -9.244 1.00 14.53 H new ATOM 0 HE3 LYS A 107 -12.180 -51.275 -8.387 1.00 14.53 H new ATOM 0 HZ1 LYS A 107 -13.091 -53.110 -9.476 1.00 70.01 H new ATOM 0 HZ2 LYS A 107 -13.551 -51.793 -10.443 1.00 70.01 H new ATOM 0 HZ3 LYS A 107 -12.270 -52.796 -10.928 1.00 70.01 H new ATOM 1672 N LEU A 108 -8.566 -48.469 -9.308 1.00 60.01 N ATOM 1673 CA LEU A 108 -8.467 -47.926 -7.961 1.00 60.42 C ATOM 1674 C LEU A 108 -9.841 -47.496 -7.465 1.00 41.03 C ATOM 1675 O LEU A 108 -10.809 -47.472 -8.228 1.00 12.22 O ATOM 1676 CB LEU A 108 -7.438 -46.788 -7.868 1.00 52.31 C ATOM 1677 CG LEU A 108 -6.042 -47.205 -7.375 1.00 61.41 C ATOM 1678 CD1 LEU A 108 -6.126 -47.762 -5.958 1.00 21.14 C ATOM 1679 CD2 LEU A 108 -5.413 -48.229 -8.315 1.00 11.12 C ATOM 0 H LEU A 108 -8.835 -47.770 -10.000 1.00 60.01 H new ATOM 0 HA LEU A 108 -8.101 -48.716 -7.305 1.00 60.42 H new ATOM 0 HB2 LEU A 108 -7.336 -46.330 -8.852 1.00 52.31 H new ATOM 0 HB3 LEU A 108 -7.828 -46.021 -7.199 1.00 52.31 H new ATOM 0 HG LEU A 108 -5.406 -46.320 -7.366 1.00 61.41 H new ATOM 0 HD11 LEU A 108 -5.131 -48.053 -5.622 1.00 21.14 H new ATOM 0 HD12 LEU A 108 -6.526 -46.999 -5.290 1.00 21.14 H new ATOM 0 HD13 LEU A 108 -6.782 -48.633 -5.948 1.00 21.14 H new ATOM 0 HD21 LEU A 108 -4.427 -48.507 -7.943 1.00 11.12 H new ATOM 0 HD22 LEU A 108 -6.045 -49.115 -8.363 1.00 11.12 H new ATOM 0 HD23 LEU A 108 -5.317 -47.797 -9.311 1.00 11.12 H new ATOM 1691 N SER A 109 -9.919 -47.186 -6.181 1.00 60.43 N ATOM 1692 CA SER A 109 -11.176 -47.089 -5.453 1.00 11.20 C ATOM 1693 C SER A 109 -12.014 -45.880 -5.890 1.00 20.34 C ATOM 1694 O SER A 109 -11.664 -45.169 -6.830 1.00 72.41 O ATOM 1695 CB SER A 109 -10.822 -46.926 -3.973 1.00 32.42 C ATOM 1696 OG SER A 109 -10.470 -48.168 -3.378 1.00 42.25 O ATOM 0 H SER A 109 -9.099 -46.992 -5.606 1.00 60.43 H new ATOM 0 HA SER A 109 -11.768 -47.983 -5.650 1.00 11.20 H new ATOM 0 HB2 SER A 109 -9.993 -46.226 -3.872 1.00 32.42 H new ATOM 0 HB3 SER A 109 -11.670 -46.495 -3.441 1.00 32.42 H new ATOM 0 HG SER A 109 -10.248 -48.027 -2.434 1.00 42.25 H new ATOM 1702 N GLN A 110 -13.157 -45.683 -5.238 1.00 61.23 N ATOM 1703 CA GLN A 110 -14.115 -44.676 -5.673 1.00 74.54 C ATOM 1704 C GLN A 110 -14.749 -43.981 -4.501 1.00 60.21 C ATOM 1705 O GLN A 110 -15.140 -44.592 -3.507 1.00 10.33 O ATOM 1706 CB GLN A 110 -15.178 -45.322 -6.569 1.00 11.44 C ATOM 1707 CG GLN A 110 -16.095 -44.332 -7.276 1.00 71.21 C ATOM 1708 CD GLN A 110 -17.148 -45.017 -8.132 1.00 13.41 C ATOM 1709 OE1 GLN A 110 -16.945 -46.137 -8.609 1.00 25.31 O ATOM 1710 NE2 GLN A 110 -18.259 -44.335 -8.370 1.00 4.42 N ATOM 0 H GLN A 110 -13.440 -46.206 -4.410 1.00 61.23 H new ATOM 0 HA GLN A 110 -13.582 -43.919 -6.248 1.00 74.54 H new ATOM 0 HB2 GLN A 110 -14.679 -45.935 -7.319 1.00 11.44 H new ATOM 0 HB3 GLN A 110 -15.787 -45.993 -5.963 1.00 11.44 H new ATOM 0 HG2 GLN A 110 -16.588 -43.705 -6.533 1.00 71.21 H new ATOM 0 HG3 GLN A 110 -15.496 -43.672 -7.903 1.00 71.21 H new ATOM 0 HE21 GLN A 110 -18.389 -43.412 -7.957 1.00 4.42 H new ATOM 0 HE22 GLN A 110 -18.984 -44.733 -8.966 1.00 4.42 H new ATOM 1719 N VAL A 111 -14.834 -42.678 -4.652 1.00 70.11 N ATOM 1720 CA VAL A 111 -15.333 -41.802 -3.636 1.00 60.35 C ATOM 1721 C VAL A 111 -16.612 -41.134 -4.129 1.00 22.32 C ATOM 1722 O VAL A 111 -16.571 -40.273 -5.011 1.00 33.31 O ATOM 1723 CB VAL A 111 -14.268 -40.736 -3.308 1.00 32.14 C ATOM 1724 CG1 VAL A 111 -14.741 -39.867 -2.175 1.00 22.02 C ATOM 1725 CG2 VAL A 111 -12.924 -41.385 -2.971 1.00 44.03 C ATOM 0 H VAL A 111 -14.550 -42.196 -5.505 1.00 70.11 H new ATOM 0 HA VAL A 111 -15.554 -42.371 -2.733 1.00 60.35 H new ATOM 0 HB VAL A 111 -14.121 -40.113 -4.190 1.00 32.14 H new ATOM 0 HG11 VAL A 111 -13.982 -39.117 -1.950 1.00 22.02 H new ATOM 0 HG12 VAL A 111 -15.669 -39.371 -2.460 1.00 22.02 H new ATOM 0 HG13 VAL A 111 -14.915 -40.483 -1.292 1.00 22.02 H new ATOM 0 HG21 VAL A 111 -12.192 -40.610 -2.744 1.00 44.03 H new ATOM 0 HG22 VAL A 111 -13.042 -42.037 -2.106 1.00 44.03 H new ATOM 0 HG23 VAL A 111 -12.579 -41.971 -3.823 1.00 44.03 H new ATOM 1735 N ILE A 112 -17.746 -41.549 -3.584 1.00 51.33 N ATOM 1736 CA ILE A 112 -19.037 -41.013 -3.998 1.00 62.14 C ATOM 1737 C ILE A 112 -19.577 -40.065 -2.930 1.00 15.21 C ATOM 1738 O ILE A 112 -19.804 -40.470 -1.787 1.00 22.02 O ATOM 1739 CB ILE A 112 -20.067 -42.145 -4.254 1.00 32.24 C ATOM 1740 CG1 ILE A 112 -19.501 -43.183 -5.241 1.00 3.11 C ATOM 1741 CG2 ILE A 112 -21.381 -41.568 -4.779 1.00 52.53 C ATOM 1742 CD1 ILE A 112 -20.433 -44.349 -5.517 1.00 61.34 C ATOM 0 H ILE A 112 -17.800 -42.257 -2.852 1.00 51.33 H new ATOM 0 HA ILE A 112 -18.887 -40.470 -4.931 1.00 62.14 H new ATOM 0 HB ILE A 112 -20.265 -42.646 -3.306 1.00 32.24 H new ATOM 0 HG12 ILE A 112 -19.271 -42.685 -6.183 1.00 3.11 H new ATOM 0 HG13 ILE A 112 -18.561 -43.569 -4.846 1.00 3.11 H new ATOM 0 HG21 ILE A 112 -22.090 -42.377 -4.952 1.00 52.53 H new ATOM 0 HG22 ILE A 112 -21.793 -40.875 -4.045 1.00 52.53 H new ATOM 0 HG23 ILE A 112 -21.198 -41.039 -5.714 1.00 52.53 H new ATOM 0 HD11 ILE A 112 -19.960 -45.034 -6.221 1.00 61.34 H new ATOM 0 HD12 ILE A 112 -20.644 -44.874 -4.586 1.00 61.34 H new ATOM 0 HD13 ILE A 112 -21.365 -43.977 -5.943 1.00 61.34 H new ATOM 1754 N GLY A 113 -19.768 -38.806 -3.307 1.00 41.41 N ATOM 1755 CA GLY A 113 -20.273 -37.806 -2.383 1.00 14.45 C ATOM 1756 C GLY A 113 -19.238 -36.746 -2.069 1.00 3.03 C ATOM 1757 O GLY A 113 -18.033 -37.011 -2.120 1.00 60.32 O ATOM 0 H GLY A 113 -19.580 -38.457 -4.247 1.00 41.41 H new ATOM 0 HA2 GLY A 113 -21.158 -37.333 -2.809 1.00 14.45 H new ATOM 0 HA3 GLY A 113 -20.585 -38.292 -1.459 1.00 14.45 H new ATOM 1761 N ALA A 114 -19.704 -35.544 -1.750 1.00 12.52 N ATOM 1762 CA ALA A 114 -18.822 -34.436 -1.421 1.00 24.52 C ATOM 1763 C ALA A 114 -18.191 -34.625 -0.044 1.00 0.33 C ATOM 1764 O ALA A 114 -18.654 -34.062 0.954 1.00 33.13 O ATOM 1765 CB ALA A 114 -19.578 -33.115 -1.491 1.00 15.11 C ATOM 0 H ALA A 114 -20.697 -35.313 -1.713 1.00 12.52 H new ATOM 0 HA ALA A 114 -18.017 -34.414 -2.156 1.00 24.52 H new ATOM 0 HB1 ALA A 114 -18.903 -32.296 -1.242 1.00 15.11 H new ATOM 0 HB2 ALA A 114 -19.967 -32.971 -2.499 1.00 15.11 H new ATOM 0 HB3 ALA A 114 -20.406 -33.131 -0.782 1.00 15.11 H new ATOM 1771 N ASP A 115 -17.149 -35.445 0.010 1.00 64.24 N ATOM 1772 CA ASP A 115 -16.408 -35.678 1.242 1.00 1.22 C ATOM 1773 C ASP A 115 -14.923 -35.419 1.010 1.00 22.24 C ATOM 1774 O ASP A 115 -14.174 -36.323 0.627 1.00 33.32 O ATOM 1775 CB ASP A 115 -16.630 -37.114 1.745 1.00 64.14 C ATOM 1776 CG ASP A 115 -16.029 -37.380 3.123 1.00 52.23 C ATOM 1777 OD1 ASP A 115 -15.231 -36.560 3.619 1.00 51.14 O ATOM 1778 OD2 ASP A 115 -16.356 -38.428 3.720 1.00 30.13 O1- ATOM 0 H ASP A 115 -16.796 -35.964 -0.794 1.00 64.24 H new ATOM 0 HA ASP A 115 -16.773 -34.991 2.005 1.00 1.22 H new ATOM 0 HB2 ASP A 115 -17.701 -37.316 1.780 1.00 64.14 H new ATOM 0 HB3 ASP A 115 -16.197 -37.812 1.028 1.00 64.14 H new ATOM 1783 N ILE A 116 -14.511 -34.173 1.227 1.00 10.14 N ATOM 1784 CA ILE A 116 -13.128 -33.764 1.010 1.00 23.23 C ATOM 1785 C ILE A 116 -12.176 -34.583 1.881 1.00 50.32 C ATOM 1786 O ILE A 116 -11.054 -34.896 1.471 1.00 24.53 O ATOM 1787 CB ILE A 116 -12.940 -32.252 1.297 1.00 35.22 C ATOM 1788 CG1 ILE A 116 -11.515 -31.803 0.930 1.00 23.43 C ATOM 1789 CG2 ILE A 116 -13.255 -31.928 2.758 1.00 34.43 C ATOM 1790 CD1 ILE A 116 -11.167 -32.021 -0.530 1.00 62.15 C ATOM 0 H ILE A 116 -15.121 -33.425 1.555 1.00 10.14 H new ATOM 0 HA ILE A 116 -12.891 -33.948 -0.038 1.00 23.23 H new ATOM 0 HB ILE A 116 -13.643 -31.699 0.673 1.00 35.22 H new ATOM 0 HG12 ILE A 116 -11.404 -30.745 1.167 1.00 23.43 H new ATOM 0 HG13 ILE A 116 -10.801 -32.345 1.550 1.00 23.43 H new ATOM 0 HG21 ILE A 116 -13.115 -30.861 2.932 1.00 34.43 H new ATOM 0 HG22 ILE A 116 -14.288 -32.199 2.976 1.00 34.43 H new ATOM 0 HG23 ILE A 116 -12.587 -32.493 3.408 1.00 34.43 H new ATOM 0 HD11 ILE A 116 -10.148 -31.682 -0.716 1.00 62.15 H new ATOM 0 HD12 ILE A 116 -11.245 -33.082 -0.768 1.00 62.15 H new ATOM 0 HD13 ILE A 116 -11.857 -31.457 -1.157 1.00 62.15 H new ATOM 1802 N SER A 117 -12.647 -34.952 3.068 1.00 64.32 N ATOM 1803 CA SER A 117 -11.861 -35.752 3.996 1.00 24.52 C ATOM 1804 C SER A 117 -11.575 -37.121 3.388 1.00 72.20 C ATOM 1805 O SER A 117 -10.440 -37.598 3.406 1.00 63.13 O ATOM 1806 CB SER A 117 -12.605 -35.901 5.331 1.00 2.24 C ATOM 1807 OG SER A 117 -11.901 -36.746 6.231 1.00 54.32 O ATOM 0 H SER A 117 -13.576 -34.707 3.410 1.00 64.32 H new ATOM 0 HA SER A 117 -10.913 -35.248 4.185 1.00 24.52 H new ATOM 0 HB2 SER A 117 -12.741 -34.919 5.784 1.00 2.24 H new ATOM 0 HB3 SER A 117 -13.599 -36.309 5.150 1.00 2.24 H new ATOM 0 HG SER A 117 -12.401 -36.818 7.071 1.00 54.32 H new ATOM 1813 N LYS A 118 -12.611 -37.738 2.827 1.00 24.02 N ATOM 1814 CA LYS A 118 -12.477 -39.059 2.226 1.00 23.25 C ATOM 1815 C LYS A 118 -11.577 -38.984 0.996 1.00 51.14 C ATOM 1816 O LYS A 118 -10.767 -39.880 0.754 1.00 44.54 O ATOM 1817 CB LYS A 118 -13.855 -39.615 1.844 1.00 55.14 C ATOM 1818 CG LYS A 118 -13.861 -41.111 1.542 1.00 21.34 C ATOM 1819 CD LYS A 118 -13.527 -41.959 2.774 1.00 32.24 C ATOM 1820 CE LYS A 118 -14.655 -41.976 3.813 1.00 45.55 C ATOM 1821 NZ LYS A 118 -14.820 -40.675 4.522 1.00 20.35 N1+ ATOM 0 H LYS A 118 -13.551 -37.344 2.777 1.00 24.02 H new ATOM 0 HA LYS A 118 -12.023 -39.731 2.954 1.00 23.25 H new ATOM 0 HB2 LYS A 118 -14.553 -39.417 2.657 1.00 55.14 H new ATOM 0 HB3 LYS A 118 -14.222 -39.077 0.970 1.00 55.14 H new ATOM 0 HG2 LYS A 118 -14.842 -41.398 1.162 1.00 21.34 H new ATOM 0 HG3 LYS A 118 -13.139 -41.322 0.753 1.00 21.34 H new ATOM 0 HD2 LYS A 118 -13.315 -42.981 2.459 1.00 32.24 H new ATOM 0 HD3 LYS A 118 -12.619 -41.574 3.238 1.00 32.24 H new ATOM 0 HE2 LYS A 118 -15.592 -42.234 3.319 1.00 45.55 H new ATOM 0 HE3 LYS A 118 -14.454 -42.758 4.545 1.00 45.55 H new ATOM 0 HZ1 LYS A 118 -14.981 -40.849 5.535 1.00 20.35 H new ATOM 0 HZ2 LYS A 118 -13.960 -40.103 4.402 1.00 20.35 H new ATOM 0 HZ3 LYS A 118 -15.634 -40.164 4.125 1.00 20.35 H new ATOM 1835 N ILE A 119 -11.718 -37.901 0.231 1.00 22.14 N ATOM 1836 CA ILE A 119 -10.912 -37.698 -0.971 1.00 2.21 C ATOM 1837 C ILE A 119 -9.423 -37.609 -0.628 1.00 62.22 C ATOM 1838 O ILE A 119 -8.619 -38.392 -1.135 1.00 24.10 O ATOM 1839 CB ILE A 119 -11.347 -36.421 -1.741 1.00 43.35 C ATOM 1840 CG1 ILE A 119 -12.819 -36.533 -2.175 1.00 44.33 C ATOM 1841 CG2 ILE A 119 -10.444 -36.188 -2.952 1.00 11.44 C ATOM 1842 CD1 ILE A 119 -13.361 -35.287 -2.850 1.00 40.14 C ATOM 0 H ILE A 119 -12.383 -37.152 0.423 1.00 22.14 H new ATOM 0 HA ILE A 119 -11.077 -38.563 -1.614 1.00 2.21 H new ATOM 0 HB ILE A 119 -11.248 -35.565 -1.074 1.00 43.35 H new ATOM 0 HG12 ILE A 119 -12.923 -37.377 -2.857 1.00 44.33 H new ATOM 0 HG13 ILE A 119 -13.429 -36.754 -1.299 1.00 44.33 H new ATOM 0 HG21 ILE A 119 -10.765 -35.289 -3.478 1.00 11.44 H new ATOM 0 HG22 ILE A 119 -9.413 -36.065 -2.619 1.00 11.44 H new ATOM 0 HG23 ILE A 119 -10.508 -37.044 -3.624 1.00 11.44 H new ATOM 0 HD11 ILE A 119 -14.404 -35.447 -3.125 1.00 40.14 H new ATOM 0 HD12 ILE A 119 -13.292 -34.442 -2.164 1.00 40.14 H new ATOM 0 HD13 ILE A 119 -12.777 -35.076 -3.746 1.00 40.14 H new ATOM 1854 N ILE A 120 -9.061 -36.674 0.254 1.00 71.14 N ATOM 1855 CA ILE A 120 -7.661 -36.478 0.636 1.00 1.52 C ATOM 1856 C ILE A 120 -7.113 -37.747 1.295 1.00 44.53 C ATOM 1857 O ILE A 120 -5.974 -38.161 1.028 1.00 2.32 O ATOM 1858 CB ILE A 120 -7.493 -35.234 1.568 1.00 41.41 C ATOM 1859 CG1 ILE A 120 -6.003 -34.902 1.826 1.00 72.14 C ATOM 1860 CG2 ILE A 120 -8.238 -35.423 2.890 1.00 5.22 C ATOM 1861 CD1 ILE A 120 -5.350 -35.689 2.950 1.00 43.13 C ATOM 0 H ILE A 120 -9.716 -36.043 0.716 1.00 71.14 H new ATOM 0 HA ILE A 120 -7.082 -36.281 -0.267 1.00 1.52 H new ATOM 0 HB ILE A 120 -7.935 -34.386 1.045 1.00 41.41 H new ATOM 0 HG12 ILE A 120 -5.444 -35.079 0.907 1.00 72.14 H new ATOM 0 HG13 ILE A 120 -5.918 -33.839 2.051 1.00 72.14 H new ATOM 0 HG21 ILE A 120 -8.101 -34.540 3.514 1.00 5.22 H new ATOM 0 HG22 ILE A 120 -9.300 -35.566 2.692 1.00 5.22 H new ATOM 0 HG23 ILE A 120 -7.845 -36.298 3.407 1.00 5.22 H new ATOM 0 HD11 ILE A 120 -4.309 -35.384 3.051 1.00 43.13 H new ATOM 0 HD12 ILE A 120 -5.877 -35.495 3.884 1.00 43.13 H new ATOM 0 HD13 ILE A 120 -5.395 -36.754 2.723 1.00 43.13 H new ATOM 1873 N SER A 121 -7.948 -38.373 2.124 1.00 33.33 N ATOM 1874 CA SER A 121 -7.598 -39.623 2.781 1.00 32.12 C ATOM 1875 C SER A 121 -7.185 -40.657 1.739 1.00 12.31 C ATOM 1876 O SER A 121 -6.114 -41.257 1.833 1.00 23.30 O ATOM 1877 CB SER A 121 -8.791 -40.136 3.602 1.00 43.12 C ATOM 1878 OG SER A 121 -8.463 -41.298 4.349 1.00 42.33 O ATOM 0 H SER A 121 -8.879 -38.027 2.355 1.00 33.33 H new ATOM 0 HA SER A 121 -6.759 -39.451 3.456 1.00 32.12 H new ATOM 0 HB2 SER A 121 -9.128 -39.352 4.280 1.00 43.12 H new ATOM 0 HB3 SER A 121 -9.623 -40.358 2.933 1.00 43.12 H new ATOM 0 HG SER A 121 -9.247 -41.592 4.858 1.00 42.33 H new ATOM 1884 N GLU A 122 -8.028 -40.829 0.728 1.00 14.44 N ATOM 1885 CA GLU A 122 -7.772 -41.798 -0.326 1.00 72.13 C ATOM 1886 C GLU A 122 -6.557 -41.410 -1.159 1.00 73.04 C ATOM 1887 O GLU A 122 -5.829 -42.283 -1.636 1.00 20.21 O ATOM 1888 CB GLU A 122 -9.008 -41.976 -1.216 1.00 32.23 C ATOM 1889 CG GLU A 122 -10.046 -42.920 -0.630 1.00 71.24 C ATOM 1890 CD GLU A 122 -9.482 -44.317 -0.420 1.00 22.22 C ATOM 1891 OE1 GLU A 122 -9.453 -45.105 -1.387 1.00 61.24 O ATOM 1892 OE2 GLU A 122 -9.038 -44.627 0.709 1.00 70.43 O1- ATOM 0 H GLU A 122 -8.897 -40.307 0.617 1.00 14.44 H new ATOM 0 HA GLU A 122 -7.553 -42.753 0.152 1.00 72.13 H new ATOM 0 HB2 GLU A 122 -9.468 -41.002 -1.385 1.00 32.23 H new ATOM 0 HB3 GLU A 122 -8.694 -42.353 -2.189 1.00 32.23 H new ATOM 0 HG2 GLU A 122 -10.402 -42.524 0.321 1.00 71.24 H new ATOM 0 HG3 GLU A 122 -10.908 -42.972 -1.296 1.00 71.24 H new ATOM 1899 N ILE A 123 -6.325 -40.114 -1.335 1.00 11.43 N ATOM 1900 CA ILE A 123 -5.154 -39.671 -2.082 1.00 32.41 C ATOM 1901 C ILE A 123 -3.880 -40.148 -1.382 1.00 5.24 C ATOM 1902 O ILE A 123 -3.084 -40.896 -1.961 1.00 71.51 O ATOM 1903 CB ILE A 123 -5.120 -38.128 -2.263 1.00 73.41 C ATOM 1904 CG1 ILE A 123 -6.325 -37.657 -3.100 1.00 51.34 C ATOM 1905 CG2 ILE A 123 -3.812 -37.696 -2.925 1.00 71.34 C ATOM 1906 CD1 ILE A 123 -6.489 -36.154 -3.149 1.00 15.35 C ATOM 0 H ILE A 123 -6.919 -39.365 -0.979 1.00 11.43 H new ATOM 0 HA ILE A 123 -5.214 -40.111 -3.077 1.00 32.41 H new ATOM 0 HB ILE A 123 -5.180 -37.665 -1.278 1.00 73.41 H new ATOM 0 HG12 ILE A 123 -6.218 -38.034 -4.117 1.00 51.34 H new ATOM 0 HG13 ILE A 123 -7.234 -38.098 -2.691 1.00 51.34 H new ATOM 0 HG21 ILE A 123 -3.805 -36.613 -3.044 1.00 71.34 H new ATOM 0 HG22 ILE A 123 -2.971 -37.998 -2.301 1.00 71.34 H new ATOM 0 HG23 ILE A 123 -3.726 -38.169 -3.903 1.00 71.34 H new ATOM 0 HD11 ILE A 123 -7.358 -35.902 -3.757 1.00 15.35 H new ATOM 0 HD12 ILE A 123 -6.629 -35.770 -2.139 1.00 15.35 H new ATOM 0 HD13 ILE A 123 -5.598 -35.705 -3.587 1.00 15.35 H new ATOM 1918 N ASN A 124 -3.727 -39.788 -0.108 1.00 61.24 N ATOM 1919 CA ASN A 124 -2.511 -40.144 0.634 1.00 42.31 C ATOM 1920 C ASN A 124 -2.466 -41.647 0.914 1.00 20.40 C ATOM 1921 O ASN A 124 -1.388 -42.227 1.083 1.00 70.22 O ATOM 1922 CB ASN A 124 -2.383 -39.350 1.947 1.00 5.10 C ATOM 1923 CG ASN A 124 -3.384 -39.764 3.014 1.00 40.22 C ATOM 1924 OD1 ASN A 124 -4.506 -39.071 3.080 1.00 31.24 O flip ATOM 1925 ND2 ASN A 124 -3.141 -40.691 3.787 1.00 15.41 N flip ATOM 0 H ASN A 124 -4.415 -39.259 0.427 1.00 61.24 H new ATOM 0 HA ASN A 124 -1.662 -39.878 0.005 1.00 42.31 H new ATOM 0 HB2 ASN A 124 -1.374 -39.476 2.340 1.00 5.10 H new ATOM 0 HB3 ASN A 124 -2.512 -38.289 1.733 1.00 5.10 H new ATOM 0 HD21 ASN A 124 -2.264 -41.205 3.707 1.00 15.41 H new ATOM 0 HD22 ASN A 124 -3.817 -40.945 4.507 1.00 15.41 H new ATOM 1932 N ASN A 125 -3.643 -42.271 0.952 1.00 31.14 N ATOM 1933 CA ASN A 125 -3.748 -43.713 1.177 1.00 72.20 C ATOM 1934 C ASN A 125 -3.231 -44.486 -0.032 1.00 71.23 C ATOM 1935 O ASN A 125 -2.355 -45.341 0.094 1.00 34.51 O ATOM 1936 CB ASN A 125 -5.208 -44.110 1.461 1.00 65.54 C ATOM 1937 CG ASN A 125 -5.394 -45.607 1.689 1.00 44.14 C ATOM 1938 OD1 ASN A 125 -4.503 -46.289 2.201 1.00 32.44 O ATOM 1939 ND2 ASN A 125 -6.559 -46.127 1.321 1.00 44.23 N ATOM 0 H ASN A 125 -4.539 -41.800 0.830 1.00 31.14 H new ATOM 0 HA ASN A 125 -3.136 -43.964 2.044 1.00 72.20 H new ATOM 0 HB2 ASN A 125 -5.560 -43.569 2.340 1.00 65.54 H new ATOM 0 HB3 ASN A 125 -5.832 -43.797 0.624 1.00 65.54 H new ATOM 0 HD21 ASN A 125 -6.740 -47.121 1.459 1.00 44.23 H new ATOM 0 HD22 ASN A 125 -7.273 -45.532 0.900 1.00 44.23 H new ATOM 1946 N ASN A 126 -3.768 -44.171 -1.210 1.00 24.21 N ATOM 1947 CA ASN A 126 -3.455 -44.930 -2.421 1.00 34.20 C ATOM 1948 C ASN A 126 -2.119 -44.505 -3.035 1.00 61.32 C ATOM 1949 O ASN A 126 -1.557 -45.239 -3.852 1.00 63.21 O ATOM 1950 CB ASN A 126 -4.585 -44.818 -3.457 1.00 71.20 C ATOM 1951 CG ASN A 126 -5.870 -45.493 -2.995 1.00 53.32 C ATOM 1952 OD1 ASN A 126 -6.029 -46.708 -3.120 1.00 60.30 O ATOM 1953 ND2 ASN A 126 -6.805 -44.711 -2.482 1.00 41.12 N ATOM 0 H ASN A 126 -4.419 -43.399 -1.352 1.00 24.21 H new ATOM 0 HA ASN A 126 -3.363 -45.975 -2.124 1.00 34.20 H new ATOM 0 HB2 ASN A 126 -4.784 -43.766 -3.660 1.00 71.20 H new ATOM 0 HB3 ASN A 126 -4.259 -45.268 -4.395 1.00 71.20 H new ATOM 0 HD21 ASN A 126 -7.692 -45.110 -2.175 1.00 41.12 H new ATOM 0 HD22 ASN A 126 -6.639 -43.708 -2.393 1.00 41.12 H new ATOM 1960 N ILE A 127 -1.617 -43.317 -2.670 1.00 24.11 N ATOM 1961 CA ILE A 127 -0.248 -42.935 -3.042 1.00 45.52 C ATOM 1962 C ILE A 127 0.754 -43.888 -2.390 1.00 24.03 C ATOM 1963 O ILE A 127 1.638 -44.436 -3.055 1.00 24.55 O ATOM 1964 CB ILE A 127 0.096 -41.473 -2.629 1.00 23.43 C ATOM 1965 CG1 ILE A 127 -0.613 -40.459 -3.541 1.00 53.10 C ATOM 1966 CG2 ILE A 127 1.610 -41.239 -2.647 1.00 51.22 C ATOM 1967 CD1 ILE A 127 -0.373 -39.018 -3.140 1.00 54.51 C ATOM 0 H ILE A 127 -2.126 -42.617 -2.129 1.00 24.11 H new ATOM 0 HA ILE A 127 -0.184 -42.998 -4.128 1.00 45.52 H new ATOM 0 HB ILE A 127 -0.262 -41.325 -1.610 1.00 23.43 H new ATOM 0 HG12 ILE A 127 -0.273 -40.604 -4.566 1.00 53.10 H new ATOM 0 HG13 ILE A 127 -1.685 -40.658 -3.529 1.00 53.10 H new ATOM 0 HG21 ILE A 127 1.823 -40.211 -2.355 1.00 51.22 H new ATOM 0 HG22 ILE A 127 2.092 -41.922 -1.948 1.00 51.22 H new ATOM 0 HG23 ILE A 127 1.994 -41.418 -3.651 1.00 51.22 H new ATOM 0 HD11 ILE A 127 -0.902 -38.356 -3.826 1.00 54.51 H new ATOM 0 HD12 ILE A 127 -0.738 -38.857 -2.126 1.00 54.51 H new ATOM 0 HD13 ILE A 127 0.695 -38.802 -3.179 1.00 54.51 H new ATOM 1979 N ASN A 128 0.601 -44.088 -1.084 1.00 64.33 N ATOM 1980 CA ASN A 128 1.503 -44.950 -0.321 1.00 71.43 C ATOM 1981 C ASN A 128 0.864 -46.323 -0.110 1.00 23.15 C ATOM 1982 O ASN A 128 0.888 -47.140 -1.051 1.00 65.33 O ATOM 1983 CB ASN A 128 1.854 -44.304 1.032 1.00 24.12 C ATOM 1984 CG ASN A 128 2.460 -42.919 0.880 1.00 23.51 C ATOM 1985 OD1 ASN A 128 3.672 -42.769 0.718 1.00 5.34 O ATOM 1986 ND2 ASN A 128 1.622 -41.892 0.939 1.00 22.35 N ATOM 1987 OXT ASN A 128 0.329 -46.582 0.991 1.00 0.00 O1- ATOM 0 H ASN A 128 -0.142 -43.664 -0.529 1.00 64.33 H new ATOM 0 HA ASN A 128 2.426 -45.077 -0.887 1.00 71.43 H new ATOM 0 HB2 ASN A 128 0.954 -44.237 1.643 1.00 24.12 H new ATOM 0 HB3 ASN A 128 2.554 -44.946 1.566 1.00 24.12 H new ATOM 0 HD21 ASN A 128 1.976 -40.939 0.849 1.00 22.35 H new ATOM 0 HD22 ASN A 128 0.624 -42.055 1.074 1.00 22.35 H new TER 1994 ASN A 128