USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1038 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 63 SER OG : rot -41:sc= 1.17 USER MOD Set 1.2: A 66 ASN : amide:sc= 1.45 K(o=2.6,f=-4.1!) USER MOD Single : A 0 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS : no HD1:sc= -0.0118 X(o=-0.012,f=-0.047) USER MOD Single : A -5 HIS N :NH3+ -114:sc= 0.0439 (180deg=-0.0235) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ -123:sc= -0.948 (180deg=-3.11!) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.109) USER MOD Single : A 22 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=-0.094) USER MOD Single : A 24 MET CE :methyl 142:sc= -0.183 (180deg=-1.03) USER MOD Single : A 26 SER OG : rot 180:sc= 0.0676 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.0195 X(o=-0.019,f=-0.019) USER MOD Single : A 48 SER OG : rot 180:sc= 0.00602 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.327 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : A 59 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0528) USER MOD Single : A 60 GLN : amide:sc= -0.801 K(o=-0.8,f=-2.8!) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot -75:sc= 0.687 USER MOD Single : A 77 HIS : no HD1:sc= -2.06 K(o=-2.1,f=-4.2!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 87 ASN : amide:sc= -1.31 K(o=-1.3,f=-0.054) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 169:sc= 0.0417 USER MOD Single : A 101 ASN : amide:sc= -0.582 K(o=-0.58,f=-6!) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 HIS : no HD1:sc= -0.018 X(o=-0.018,f=-0.38) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 153:sc= -0.148 (180deg=-1.03) USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 132 SER OG : rot -58:sc= 1.06 USER MOD Single : A 133 THR OG1 : rot 180:sc= 0 USER MOD Single : A 134 THR OG1 : rot 80:sc= -0.372 USER MOD Single : A 136 ASN : amide:sc= -0.0154 K(o=-0.015,f=-1.7!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N HIS A -5 60.447 -28.146 -3.179 1.00 0.00 N ATOM 2 CA HIS A -5 60.921 -28.306 -4.582 1.00 0.00 C ATOM 3 C HIS A -5 62.159 -27.444 -4.801 1.00 0.00 C ATOM 4 O HIS A -5 62.346 -26.429 -4.130 1.00 0.00 O ATOM 5 CB HIS A -5 59.811 -27.879 -5.544 1.00 0.00 C ATOM 6 CG HIS A -5 58.580 -28.741 -5.458 1.00 0.00 C ATOM 7 ND1 HIS A -5 57.520 -28.434 -4.621 1.00 0.00 N ATOM 8 CD2 HIS A -5 58.227 -29.904 -6.099 1.00 0.00 C ATOM 9 CE1 HIS A -5 56.588 -29.391 -4.777 1.00 0.00 C ATOM 10 NE2 HIS A -5 56.968 -30.312 -5.667 1.00 0.00 N ATOM 0 H1 HIS A -5 60.559 -29.046 -2.670 1.00 0.00 H new ATOM 0 H2 HIS A -5 61.007 -27.409 -2.705 1.00 0.00 H new ATOM 0 H3 HIS A -5 59.444 -27.871 -3.181 1.00 0.00 H new ATOM 0 HA HIS A -5 61.175 -29.350 -4.768 1.00 0.00 H new ATOM 0 HB2 HIS A -5 59.537 -26.845 -5.334 1.00 0.00 H new ATOM 0 HB3 HIS A -5 60.194 -27.907 -6.564 1.00 0.00 H new ATOM 0 HD2 HIS A -5 58.834 -30.422 -6.827 1.00 0.00 H new ATOM 0 HE1 HIS A -5 55.647 -29.412 -4.247 1.00 0.00 H new ATOM 0 HE2 HIS A -5 56.448 -31.137 -5.966 1.00 0.00 H new ATOM 20 N HIS A -4 63.003 -27.854 -5.744 1.00 0.00 N ATOM 21 CA HIS A -4 64.227 -27.117 -6.050 1.00 0.00 C ATOM 22 C HIS A -4 64.205 -26.622 -7.493 1.00 0.00 C ATOM 23 O HIS A -4 63.768 -27.334 -8.396 1.00 0.00 O ATOM 24 CB HIS A -4 65.443 -28.019 -5.840 1.00 0.00 C ATOM 25 CG HIS A -4 65.629 -28.450 -4.411 1.00 0.00 C ATOM 26 ND1 HIS A -4 65.083 -29.624 -3.915 1.00 0.00 N ATOM 27 CD2 HIS A -4 66.296 -27.874 -3.358 1.00 0.00 C ATOM 28 CE1 HIS A -4 65.428 -29.717 -2.619 1.00 0.00 C ATOM 29 NE2 HIS A -4 66.168 -28.678 -2.227 1.00 0.00 N ATOM 0 H HIS A -4 62.863 -28.691 -6.309 1.00 0.00 H new ATOM 0 HA HIS A -4 64.290 -26.258 -5.382 1.00 0.00 H new ATOM 0 HB2 HIS A -4 65.342 -28.904 -6.468 1.00 0.00 H new ATOM 0 HB3 HIS A -4 66.338 -27.493 -6.172 1.00 0.00 H new ATOM 0 HD2 HIS A -4 66.837 -26.940 -3.400 1.00 0.00 H new ATOM 0 HE1 HIS A -4 65.141 -30.534 -1.973 1.00 0.00 H new ATOM 0 HE2 HIS A -4 66.556 -28.509 -1.299 1.00 0.00 H new ATOM 37 N HIS A -3 64.678 -25.396 -7.700 1.00 0.00 N ATOM 38 CA HIS A -3 64.714 -24.805 -9.036 1.00 0.00 C ATOM 39 C HIS A -3 66.147 -24.461 -9.428 1.00 0.00 C ATOM 40 O HIS A -3 66.937 -24.010 -8.599 1.00 0.00 O ATOM 41 CB HIS A -3 63.859 -23.536 -9.065 1.00 0.00 C ATOM 42 CG HIS A -3 62.398 -23.794 -8.822 1.00 0.00 C ATOM 43 ND1 HIS A -3 61.839 -23.744 -7.555 1.00 0.00 N ATOM 44 CD2 HIS A -3 61.366 -24.104 -9.675 1.00 0.00 C ATOM 45 CE1 HIS A -3 60.528 -24.019 -7.678 1.00 0.00 C ATOM 46 NE2 HIS A -3 60.185 -24.245 -8.948 1.00 0.00 N ATOM 0 H HIS A -3 65.041 -24.793 -6.962 1.00 0.00 H new ATOM 0 HA HIS A -3 64.317 -25.529 -9.747 1.00 0.00 H new ATOM 0 HB2 HIS A -3 64.228 -22.841 -8.311 1.00 0.00 H new ATOM 0 HB3 HIS A -3 63.978 -23.049 -10.033 1.00 0.00 H new ATOM 0 HD2 HIS A -3 61.456 -24.221 -10.745 1.00 0.00 H new ATOM 0 HE1 HIS A -3 59.836 -24.053 -6.849 1.00 0.00 H new ATOM 0 HE2 HIS A -3 59.258 -24.472 -9.309 1.00 0.00 H new ATOM 54 N HIS A -2 66.477 -24.680 -10.699 1.00 0.00 N ATOM 55 CA HIS A -2 67.818 -24.393 -11.201 1.00 0.00 C ATOM 56 C HIS A -2 67.772 -23.279 -12.241 1.00 0.00 C ATOM 57 O HIS A -2 66.876 -23.241 -13.085 1.00 0.00 O ATOM 58 CB HIS A -2 68.417 -25.651 -11.830 1.00 0.00 C ATOM 59 CG HIS A -2 68.566 -26.792 -10.860 1.00 0.00 C ATOM 60 ND1 HIS A -2 69.498 -26.773 -9.835 1.00 0.00 N ATOM 61 CD2 HIS A -2 67.909 -27.993 -10.746 1.00 0.00 C ATOM 62 CE1 HIS A -2 69.379 -27.927 -9.155 1.00 0.00 C ATOM 63 NE2 HIS A -2 68.424 -28.708 -9.668 1.00 0.00 N ATOM 0 H HIS A -2 65.836 -25.054 -11.398 1.00 0.00 H new ATOM 0 HA HIS A -2 68.439 -24.071 -10.365 1.00 0.00 H new ATOM 0 HB2 HIS A -2 67.786 -25.969 -12.660 1.00 0.00 H new ATOM 0 HB3 HIS A -2 69.394 -25.409 -12.248 1.00 0.00 H new ATOM 0 HD2 HIS A -2 67.114 -28.331 -11.394 1.00 0.00 H new ATOM 0 HE1 HIS A -2 69.982 -28.190 -8.299 1.00 0.00 H new ATOM 0 HE2 HIS A -2 68.135 -29.630 -9.340 1.00 0.00 H new ATOM 71 N HIS A -1 68.744 -22.372 -12.175 1.00 0.00 N ATOM 72 CA HIS A -1 68.812 -21.253 -13.111 1.00 0.00 C ATOM 73 C HIS A -1 70.158 -21.238 -13.828 1.00 0.00 C ATOM 74 O HIS A -1 71.184 -21.599 -13.251 1.00 0.00 O ATOM 75 CB HIS A -1 68.620 -19.934 -12.359 1.00 0.00 C ATOM 76 CG HIS A -1 67.289 -19.829 -11.666 1.00 0.00 C ATOM 77 ND1 HIS A -1 66.101 -19.688 -12.365 1.00 0.00 N ATOM 78 CD2 HIS A -1 66.942 -19.844 -10.337 1.00 0.00 C ATOM 79 CE1 HIS A -1 65.105 -19.624 -11.465 1.00 0.00 C ATOM 80 NE2 HIS A -1 65.561 -19.713 -10.213 1.00 0.00 N ATOM 0 H HIS A -1 69.494 -22.390 -11.484 1.00 0.00 H new ATOM 0 HA HIS A -1 68.019 -21.371 -13.850 1.00 0.00 H new ATOM 0 HB2 HIS A -1 69.415 -19.826 -11.621 1.00 0.00 H new ATOM 0 HB3 HIS A -1 68.722 -19.106 -13.061 1.00 0.00 H new ATOM 0 HD2 HIS A -1 67.634 -19.942 -9.514 1.00 0.00 H new ATOM 0 HE1 HIS A -1 64.062 -19.514 -11.723 1.00 0.00 H new ATOM 0 HE2 HIS A -1 65.015 -19.690 -9.351 1.00 0.00 H new ATOM 88 N HIS A 0 70.147 -20.818 -15.090 1.00 0.00 N ATOM 89 CA HIS A 0 71.370 -20.755 -15.886 1.00 0.00 C ATOM 90 C HIS A 0 71.719 -19.307 -16.214 1.00 0.00 C ATOM 91 O HIS A 0 70.839 -18.498 -16.510 1.00 0.00 O ATOM 92 CB HIS A 0 71.183 -21.540 -17.186 1.00 0.00 C ATOM 93 CG HIS A 0 70.970 -23.013 -16.971 1.00 0.00 C ATOM 94 ND1 HIS A 0 69.707 -23.567 -16.842 1.00 0.00 N ATOM 95 CD2 HIS A 0 71.852 -24.062 -16.858 1.00 0.00 C ATOM 96 CE1 HIS A 0 69.859 -24.890 -16.662 1.00 0.00 C ATOM 97 NE2 HIS A 0 71.146 -25.247 -16.663 1.00 0.00 N ATOM 0 H HIS A 0 69.307 -20.517 -15.583 1.00 0.00 H new ATOM 0 HA HIS A 0 72.183 -21.193 -15.307 1.00 0.00 H new ATOM 0 HB2 HIS A 0 70.329 -21.133 -17.728 1.00 0.00 H new ATOM 0 HB3 HIS A 0 72.060 -21.396 -17.818 1.00 0.00 H new ATOM 0 HD2 HIS A 0 72.928 -23.980 -16.912 1.00 0.00 H new ATOM 0 HE1 HIS A 0 69.039 -25.581 -16.532 1.00 0.00 H new ATOM 0 HE2 HIS A 0 71.529 -26.185 -16.546 1.00 0.00 H new ATOM 105 N SER A 1 73.007 -18.986 -16.156 1.00 0.00 N ATOM 106 CA SER A 1 73.460 -17.629 -16.439 1.00 0.00 C ATOM 107 C SER A 1 73.105 -17.234 -17.870 1.00 0.00 C ATOM 108 O SER A 1 72.972 -18.089 -18.745 1.00 0.00 O ATOM 109 CB SER A 1 74.973 -17.531 -16.240 1.00 0.00 C ATOM 110 OG SER A 1 75.295 -17.919 -14.912 1.00 0.00 O ATOM 0 H SER A 1 73.751 -19.642 -15.917 1.00 0.00 H new ATOM 0 HA SER A 1 72.960 -16.947 -15.751 1.00 0.00 H new ATOM 0 HB2 SER A 1 75.488 -18.173 -16.954 1.00 0.00 H new ATOM 0 HB3 SER A 1 75.311 -16.512 -16.426 1.00 0.00 H new ATOM 0 HG SER A 1 76.264 -17.860 -14.780 1.00 0.00 H new ATOM 116 N SER A 2 72.956 -15.932 -18.099 1.00 0.00 N ATOM 117 CA SER A 2 72.614 -15.422 -19.424 1.00 0.00 C ATOM 118 C SER A 2 73.660 -14.417 -19.894 1.00 0.00 C ATOM 119 O SER A 2 74.216 -13.664 -19.094 1.00 0.00 O ATOM 120 CB SER A 2 71.242 -14.747 -19.382 1.00 0.00 C ATOM 121 OG SER A 2 70.872 -14.362 -20.699 1.00 0.00 O ATOM 0 H SER A 2 73.067 -15.212 -17.385 1.00 0.00 H new ATOM 0 HA SER A 2 72.588 -16.259 -20.122 1.00 0.00 H new ATOM 0 HB2 SER A 2 70.500 -15.429 -18.967 1.00 0.00 H new ATOM 0 HB3 SER A 2 71.272 -13.874 -18.730 1.00 0.00 H new ATOM 0 HG SER A 2 69.992 -13.930 -20.679 1.00 0.00 H new ATOM 127 N GLY A 3 73.924 -14.410 -21.197 1.00 0.00 N ATOM 128 CA GLY A 3 74.906 -13.491 -21.762 1.00 0.00 C ATOM 129 C GLY A 3 74.291 -12.116 -21.998 1.00 0.00 C ATOM 130 O GLY A 3 73.128 -11.881 -21.669 1.00 0.00 O ATOM 0 H GLY A 3 73.476 -15.025 -21.876 1.00 0.00 H new ATOM 0 HA2 GLY A 3 75.757 -13.402 -21.087 1.00 0.00 H new ATOM 0 HA3 GLY A 3 75.285 -13.891 -22.703 1.00 0.00 H new ATOM 134 N LEU A 4 75.078 -11.210 -22.570 1.00 0.00 N ATOM 135 CA LEU A 4 74.601 -9.859 -22.836 1.00 0.00 C ATOM 136 C LEU A 4 74.050 -9.754 -24.254 1.00 0.00 C ATOM 137 O LEU A 4 74.615 -10.312 -25.194 1.00 0.00 O ATOM 138 CB LEU A 4 75.741 -8.851 -22.654 1.00 0.00 C ATOM 139 CG LEU A 4 76.324 -8.966 -21.243 1.00 0.00 C ATOM 140 CD1 LEU A 4 77.522 -8.023 -21.110 1.00 0.00 C ATOM 141 CD2 LEU A 4 75.262 -8.576 -20.212 1.00 0.00 C ATOM 0 H LEU A 4 76.041 -11.385 -22.856 1.00 0.00 H new ATOM 0 HA LEU A 4 73.803 -9.633 -22.129 1.00 0.00 H new ATOM 0 HB2 LEU A 4 76.520 -9.034 -23.394 1.00 0.00 H new ATOM 0 HB3 LEU A 4 75.373 -7.839 -22.822 1.00 0.00 H new ATOM 0 HG LEU A 4 76.641 -9.994 -21.068 1.00 0.00 H new ATOM 0 HD11 LEU A 4 77.939 -8.103 -20.106 1.00 0.00 H new ATOM 0 HD12 LEU A 4 78.283 -8.296 -21.841 1.00 0.00 H new ATOM 0 HD13 LEU A 4 77.199 -6.997 -21.288 1.00 0.00 H new ATOM 0 HD21 LEU A 4 75.681 -8.659 -19.209 1.00 0.00 H new ATOM 0 HD22 LEU A 4 74.944 -7.549 -20.388 1.00 0.00 H new ATOM 0 HD23 LEU A 4 74.404 -9.242 -20.303 1.00 0.00 H new ATOM 153 N VAL A 5 72.942 -9.034 -24.400 1.00 0.00 N ATOM 154 CA VAL A 5 72.324 -8.856 -25.709 1.00 0.00 C ATOM 155 C VAL A 5 73.173 -7.931 -26.584 1.00 0.00 C ATOM 156 O VAL A 5 73.924 -7.110 -26.052 1.00 0.00 O ATOM 157 CB VAL A 5 70.919 -8.269 -25.551 1.00 0.00 C ATOM 158 CG1 VAL A 5 70.046 -9.242 -24.755 1.00 0.00 C ATOM 159 CG2 VAL A 5 70.999 -6.934 -24.806 1.00 0.00 C ATOM 0 H VAL A 5 72.457 -8.567 -23.634 1.00 0.00 H new ATOM 0 HA VAL A 5 72.256 -9.831 -26.192 1.00 0.00 H new ATOM 0 HB VAL A 5 70.483 -8.108 -26.537 1.00 0.00 H new ATOM 0 HG11 VAL A 5 69.046 -8.824 -24.642 1.00 0.00 H new ATOM 0 HG12 VAL A 5 69.985 -10.193 -25.285 1.00 0.00 H new ATOM 0 HG13 VAL A 5 70.485 -9.403 -23.770 1.00 0.00 H new ATOM 0 HG21 VAL A 5 69.997 -6.519 -24.695 1.00 0.00 H new ATOM 0 HG22 VAL A 5 71.437 -7.093 -23.821 1.00 0.00 H new ATOM 0 HG23 VAL A 5 71.620 -6.239 -25.371 1.00 0.00 H new ATOM 169 N PRO A 6 73.081 -8.031 -27.895 1.00 0.00 N ATOM 170 CA PRO A 6 73.881 -7.152 -28.800 1.00 0.00 C ATOM 171 C PRO A 6 73.402 -5.704 -28.758 1.00 0.00 C ATOM 172 O PRO A 6 72.248 -5.413 -29.073 1.00 0.00 O ATOM 173 CB PRO A 6 73.679 -7.754 -30.192 1.00 0.00 C ATOM 174 CG PRO A 6 72.381 -8.482 -30.121 1.00 0.00 C ATOM 175 CD PRO A 6 72.230 -8.956 -28.676 1.00 0.00 C ATOM 0 HA PRO A 6 74.930 -7.117 -28.505 1.00 0.00 H new ATOM 0 HB2 PRO A 6 73.653 -6.977 -30.956 1.00 0.00 H new ATOM 0 HB3 PRO A 6 74.495 -8.429 -30.451 1.00 0.00 H new ATOM 0 HG2 PRO A 6 71.554 -7.830 -30.404 1.00 0.00 H new ATOM 0 HG3 PRO A 6 72.371 -9.327 -30.810 1.00 0.00 H new ATOM 0 HD2 PRO A 6 71.191 -8.911 -28.350 1.00 0.00 H new ATOM 0 HD3 PRO A 6 72.556 -9.990 -28.561 1.00 0.00 H new ATOM 183 N ARG A 7 74.295 -4.802 -28.365 1.00 0.00 N ATOM 184 CA ARG A 7 73.949 -3.389 -28.271 1.00 0.00 C ATOM 185 C ARG A 7 75.169 -2.508 -28.534 1.00 0.00 C ATOM 186 O ARG A 7 76.304 -2.986 -28.533 1.00 0.00 O ATOM 187 CB ARG A 7 73.351 -3.091 -26.890 1.00 0.00 C ATOM 188 CG ARG A 7 74.392 -3.325 -25.790 1.00 0.00 C ATOM 189 CD ARG A 7 73.723 -3.217 -24.418 1.00 0.00 C ATOM 190 NE ARG A 7 74.726 -3.313 -23.355 1.00 0.00 N ATOM 191 CZ ARG A 7 74.433 -3.215 -22.049 1.00 0.00 C ATOM 192 NH1 ARG A 7 73.209 -3.021 -21.619 1.00 0.00 N ATOM 193 NH2 ARG A 7 75.399 -3.315 -21.178 1.00 0.00 N ATOM 0 H ARG A 7 75.257 -5.022 -28.108 1.00 0.00 H new ATOM 0 HA ARG A 7 73.205 -3.161 -29.035 1.00 0.00 H new ATOM 0 HB2 ARG A 7 73.001 -2.059 -26.854 1.00 0.00 H new ATOM 0 HB3 ARG A 7 72.483 -3.728 -26.718 1.00 0.00 H new ATOM 0 HG2 ARG A 7 74.846 -4.309 -25.908 1.00 0.00 H new ATOM 0 HG3 ARG A 7 75.195 -2.592 -25.873 1.00 0.00 H new ATOM 0 HD2 ARG A 7 73.189 -2.270 -24.339 1.00 0.00 H new ATOM 0 HD3 ARG A 7 72.984 -4.010 -24.303 1.00 0.00 H new ATOM 0 HE ARG A 7 75.699 -3.462 -23.622 1.00 0.00 H new ATOM 0 HH11 ARG A 7 72.441 -2.939 -22.286 1.00 0.00 H new ATOM 0 HH12 ARG A 7 73.025 -2.952 -20.618 1.00 0.00 H new ATOM 0 HH21 ARG A 7 76.357 -3.465 -21.494 1.00 0.00 H new ATOM 0 HH22 ARG A 7 75.196 -3.243 -20.181 1.00 0.00 H new ATOM 207 N GLY A 8 74.926 -1.221 -28.760 1.00 0.00 N ATOM 208 CA GLY A 8 76.011 -0.284 -29.024 1.00 0.00 C ATOM 209 C GLY A 8 76.657 0.182 -27.723 1.00 0.00 C ATOM 210 O GLY A 8 76.307 -0.291 -26.642 1.00 0.00 O ATOM 0 H GLY A 8 73.994 -0.806 -28.766 1.00 0.00 H new ATOM 0 HA2 GLY A 8 76.761 -0.759 -29.657 1.00 0.00 H new ATOM 0 HA3 GLY A 8 75.628 0.576 -29.573 1.00 0.00 H new ATOM 214 N SER A 9 77.600 1.113 -27.836 1.00 0.00 N ATOM 215 CA SER A 9 78.303 1.634 -26.666 1.00 0.00 C ATOM 216 C SER A 9 77.967 3.106 -26.451 1.00 0.00 C ATOM 217 O SER A 9 77.808 3.864 -27.409 1.00 0.00 O ATOM 218 CB SER A 9 79.813 1.480 -26.856 1.00 0.00 C ATOM 219 OG SER A 9 80.477 1.882 -25.666 1.00 0.00 O ATOM 0 H SER A 9 77.895 1.522 -28.723 1.00 0.00 H new ATOM 0 HA SER A 9 77.984 1.067 -25.791 1.00 0.00 H new ATOM 0 HB2 SER A 9 80.058 0.444 -27.091 1.00 0.00 H new ATOM 0 HB3 SER A 9 80.149 2.086 -27.697 1.00 0.00 H new ATOM 0 HG SER A 9 81.445 1.783 -25.782 1.00 0.00 H new ATOM 225 N GLY A 10 77.859 3.504 -25.188 1.00 0.00 N ATOM 226 CA GLY A 10 77.543 4.888 -24.856 1.00 0.00 C ATOM 227 C GLY A 10 77.768 5.157 -23.372 1.00 0.00 C ATOM 228 O GLY A 10 78.243 4.288 -22.641 1.00 0.00 O ATOM 0 H GLY A 10 77.985 2.892 -24.382 1.00 0.00 H new ATOM 0 HA2 GLY A 10 78.164 5.559 -25.449 1.00 0.00 H new ATOM 0 HA3 GLY A 10 76.506 5.101 -25.115 1.00 0.00 H new ATOM 232 N MET A 11 77.424 6.365 -22.934 1.00 0.00 N ATOM 233 CA MET A 11 77.595 6.745 -21.534 1.00 0.00 C ATOM 234 C MET A 11 76.240 6.890 -20.850 1.00 0.00 C ATOM 235 O MET A 11 75.268 7.336 -21.460 1.00 0.00 O ATOM 236 CB MET A 11 78.355 8.070 -21.446 1.00 0.00 C ATOM 237 CG MET A 11 79.773 7.884 -21.988 1.00 0.00 C ATOM 238 SD MET A 11 80.706 9.421 -21.777 1.00 0.00 S ATOM 239 CE MET A 11 82.216 8.886 -22.619 1.00 0.00 C ATOM 0 H MET A 11 77.027 7.095 -23.525 1.00 0.00 H new ATOM 0 HA MET A 11 78.163 5.963 -21.029 1.00 0.00 H new ATOM 0 HB2 MET A 11 77.834 8.838 -22.017 1.00 0.00 H new ATOM 0 HB3 MET A 11 78.392 8.412 -20.412 1.00 0.00 H new ATOM 0 HG2 MET A 11 80.271 7.069 -21.463 1.00 0.00 H new ATOM 0 HG3 MET A 11 79.738 7.609 -23.042 1.00 0.00 H new ATOM 0 HE1 MET A 11 82.945 9.696 -22.607 1.00 0.00 H new ATOM 0 HE2 MET A 11 82.630 8.017 -22.107 1.00 0.00 H new ATOM 0 HE3 MET A 11 81.983 8.622 -23.651 1.00 0.00 H new ATOM 249 N LYS A 12 76.184 6.509 -19.576 1.00 0.00 N ATOM 250 CA LYS A 12 74.947 6.600 -18.804 1.00 0.00 C ATOM 251 C LYS A 12 75.114 7.572 -17.640 1.00 0.00 C ATOM 252 O LYS A 12 76.207 7.715 -17.092 1.00 0.00 O ATOM 253 CB LYS A 12 74.569 5.219 -18.263 1.00 0.00 C ATOM 254 CG LYS A 12 74.266 4.279 -19.432 1.00 0.00 C ATOM 255 CD LYS A 12 74.029 2.860 -18.903 1.00 0.00 C ATOM 256 CE LYS A 12 72.721 2.812 -18.109 1.00 0.00 C ATOM 257 NZ LYS A 12 72.988 3.169 -16.688 1.00 0.00 N ATOM 0 H LYS A 12 76.979 6.135 -19.057 1.00 0.00 H new ATOM 0 HA LYS A 12 74.156 6.965 -19.460 1.00 0.00 H new ATOM 0 HB2 LYS A 12 75.384 4.817 -17.661 1.00 0.00 H new ATOM 0 HB3 LYS A 12 73.699 5.298 -17.611 1.00 0.00 H new ATOM 0 HG2 LYS A 12 73.387 4.628 -19.974 1.00 0.00 H new ATOM 0 HG3 LYS A 12 75.097 4.281 -20.138 1.00 0.00 H new ATOM 0 HD2 LYS A 12 73.987 2.155 -19.733 1.00 0.00 H new ATOM 0 HD3 LYS A 12 74.861 2.555 -18.268 1.00 0.00 H new ATOM 0 HE2 LYS A 12 71.997 3.504 -18.539 1.00 0.00 H new ATOM 0 HE3 LYS A 12 72.284 1.815 -18.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 72.667 2.397 -16.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 74.008 3.319 -16.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 72.475 4.041 -16.447 1.00 0.00 H new ATOM 271 N GLU A 13 74.024 8.235 -17.268 1.00 0.00 N ATOM 272 CA GLU A 13 74.060 9.188 -16.165 1.00 0.00 C ATOM 273 C GLU A 13 74.559 8.516 -14.888 1.00 0.00 C ATOM 274 O GLU A 13 74.294 7.337 -14.653 1.00 0.00 O ATOM 275 CB GLU A 13 72.664 9.773 -15.934 1.00 0.00 C ATOM 276 CG GLU A 13 71.674 8.644 -15.615 1.00 0.00 C ATOM 277 CD GLU A 13 70.236 9.163 -15.499 1.00 0.00 C ATOM 278 OE1 GLU A 13 70.030 10.368 -15.527 1.00 0.00 O ATOM 279 OE2 GLU A 13 69.350 8.333 -15.381 1.00 0.00 O ATOM 0 H GLU A 13 73.111 8.131 -17.711 1.00 0.00 H new ATOM 0 HA GLU A 13 74.749 9.992 -16.426 1.00 0.00 H new ATOM 0 HB2 GLU A 13 72.691 10.489 -15.112 1.00 0.00 H new ATOM 0 HB3 GLU A 13 72.336 10.317 -16.820 1.00 0.00 H new ATOM 0 HG2 GLU A 13 71.725 7.885 -16.396 1.00 0.00 H new ATOM 0 HG3 GLU A 13 71.962 8.161 -14.681 1.00 0.00 H new ATOM 286 N THR A 14 75.282 9.273 -14.067 1.00 0.00 N ATOM 287 CA THR A 14 75.827 8.745 -12.818 1.00 0.00 C ATOM 288 C THR A 14 75.327 9.560 -11.630 1.00 0.00 C ATOM 289 O THR A 14 74.851 10.684 -11.790 1.00 0.00 O ATOM 290 CB THR A 14 77.357 8.785 -12.853 1.00 0.00 C ATOM 291 OG1 THR A 14 77.792 10.134 -12.943 1.00 0.00 O ATOM 292 CG2 THR A 14 77.871 7.996 -14.059 1.00 0.00 C ATOM 0 H THR A 14 75.504 10.253 -14.243 1.00 0.00 H new ATOM 0 HA THR A 14 75.493 7.713 -12.708 1.00 0.00 H new ATOM 0 HB THR A 14 77.750 8.336 -11.941 1.00 0.00 H new ATOM 0 HG1 THR A 14 78.771 10.161 -12.964 1.00 0.00 H new ATOM 0 HG21 THR A 14 78.960 8.029 -14.078 1.00 0.00 H new ATOM 0 HG22 THR A 14 77.540 6.960 -13.984 1.00 0.00 H new ATOM 0 HG23 THR A 14 77.479 8.436 -14.976 1.00 0.00 H new ATOM 300 N ALA A 15 75.438 8.984 -10.437 1.00 0.00 N ATOM 301 CA ALA A 15 74.992 9.661 -9.225 1.00 0.00 C ATOM 302 C ALA A 15 75.800 10.933 -8.991 1.00 0.00 C ATOM 303 O ALA A 15 76.980 11.003 -9.333 1.00 0.00 O ATOM 304 CB ALA A 15 75.142 8.731 -8.021 1.00 0.00 C ATOM 0 H ALA A 15 75.831 8.055 -10.284 1.00 0.00 H new ATOM 0 HA ALA A 15 73.943 9.929 -9.348 1.00 0.00 H new ATOM 0 HB1 ALA A 15 74.807 9.245 -7.120 1.00 0.00 H new ATOM 0 HB2 ALA A 15 74.538 7.837 -8.175 1.00 0.00 H new ATOM 0 HB3 ALA A 15 76.188 8.447 -7.908 1.00 0.00 H new ATOM 310 N ALA A 16 75.156 11.937 -8.405 1.00 0.00 N ATOM 311 CA ALA A 16 75.825 13.203 -8.126 1.00 0.00 C ATOM 312 C ALA A 16 77.016 12.988 -7.199 1.00 0.00 C ATOM 313 O ALA A 16 77.003 12.093 -6.354 1.00 0.00 O ATOM 314 CB ALA A 16 74.842 14.181 -7.479 1.00 0.00 C ATOM 0 H ALA A 16 74.179 11.900 -8.116 1.00 0.00 H new ATOM 0 HA ALA A 16 76.184 13.618 -9.068 1.00 0.00 H new ATOM 0 HB1 ALA A 16 75.349 15.124 -7.274 1.00 0.00 H new ATOM 0 HB2 ALA A 16 74.006 14.358 -8.156 1.00 0.00 H new ATOM 0 HB3 ALA A 16 74.470 13.759 -6.546 1.00 0.00 H new ATOM 320 N ALA A 17 78.045 13.812 -7.365 1.00 0.00 N ATOM 321 CA ALA A 17 79.246 13.695 -6.545 1.00 0.00 C ATOM 322 C ALA A 17 78.901 13.845 -5.066 1.00 0.00 C ATOM 323 O ALA A 17 78.005 14.605 -4.701 1.00 0.00 O ATOM 324 CB ALA A 17 80.258 14.768 -6.946 1.00 0.00 C ATOM 0 H ALA A 17 78.072 14.563 -8.055 1.00 0.00 H new ATOM 0 HA ALA A 17 79.680 12.708 -6.707 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.152 14.674 -6.329 1.00 0.00 H new ATOM 0 HB2 ALA A 17 80.526 14.641 -7.995 1.00 0.00 H new ATOM 0 HB3 ALA A 17 79.819 15.755 -6.800 1.00 0.00 H new ATOM 330 N LYS A 18 79.624 13.117 -4.221 1.00 0.00 N ATOM 331 CA LYS A 18 79.386 13.170 -2.784 1.00 0.00 C ATOM 332 C LYS A 18 80.277 14.219 -2.129 1.00 0.00 C ATOM 333 O LYS A 18 81.368 14.512 -2.617 1.00 0.00 O ATOM 334 CB LYS A 18 79.662 11.800 -2.158 1.00 0.00 C ATOM 335 CG LYS A 18 78.671 10.775 -2.711 1.00 0.00 C ATOM 336 CD LYS A 18 78.878 9.432 -2.008 1.00 0.00 C ATOM 337 CE LYS A 18 77.971 8.376 -2.645 1.00 0.00 C ATOM 338 NZ LYS A 18 76.555 8.648 -2.271 1.00 0.00 N ATOM 0 H LYS A 18 80.375 12.487 -4.504 1.00 0.00 H new ATOM 0 HA LYS A 18 78.344 13.443 -2.618 1.00 0.00 H new ATOM 0 HB2 LYS A 18 80.683 11.488 -2.376 1.00 0.00 H new ATOM 0 HB3 LYS A 18 79.572 11.860 -1.073 1.00 0.00 H new ATOM 0 HG2 LYS A 18 77.649 11.123 -2.559 1.00 0.00 H new ATOM 0 HG3 LYS A 18 78.812 10.660 -3.786 1.00 0.00 H new ATOM 0 HD2 LYS A 18 79.921 9.126 -2.086 1.00 0.00 H new ATOM 0 HD3 LYS A 18 78.653 9.527 -0.946 1.00 0.00 H new ATOM 0 HE2 LYS A 18 78.082 8.392 -3.729 1.00 0.00 H new ATOM 0 HE3 LYS A 18 78.262 7.381 -2.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 75.962 7.837 -2.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 76.490 8.796 -1.244 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 76.223 9.500 -2.766 1.00 0.00 H new ATOM 352 N PHE A 19 79.806 14.781 -1.020 1.00 0.00 N ATOM 353 CA PHE A 19 80.566 15.800 -0.302 1.00 0.00 C ATOM 354 C PHE A 19 81.200 15.206 0.952 1.00 0.00 C ATOM 355 O PHE A 19 80.552 14.476 1.701 1.00 0.00 O ATOM 356 CB PHE A 19 79.646 16.957 0.090 1.00 0.00 C ATOM 357 CG PHE A 19 79.048 17.677 -1.096 1.00 0.00 C ATOM 358 CD1 PHE A 19 79.766 18.698 -1.728 1.00 0.00 C ATOM 359 CD2 PHE A 19 77.776 17.324 -1.561 1.00 0.00 C ATOM 360 CE1 PHE A 19 79.213 19.367 -2.827 1.00 0.00 C ATOM 361 CE2 PHE A 19 77.222 17.993 -2.659 1.00 0.00 C ATOM 362 CZ PHE A 19 77.940 19.014 -3.292 1.00 0.00 C ATOM 0 H PHE A 19 78.906 14.550 -0.600 1.00 0.00 H new ATOM 0 HA PHE A 19 81.355 16.169 -0.957 1.00 0.00 H new ATOM 0 HB2 PHE A 19 78.841 16.575 0.717 1.00 0.00 H new ATOM 0 HB3 PHE A 19 80.208 17.670 0.693 1.00 0.00 H new ATOM 0 HD1 PHE A 19 80.747 18.970 -1.368 1.00 0.00 H new ATOM 0 HD2 PHE A 19 77.222 16.536 -1.073 1.00 0.00 H new ATOM 0 HE1 PHE A 19 79.768 20.154 -3.316 1.00 0.00 H new ATOM 0 HE2 PHE A 19 76.240 17.721 -3.018 1.00 0.00 H new ATOM 0 HZ PHE A 19 77.512 19.530 -4.139 1.00 0.00 H new ATOM 372 N GLU A 20 82.473 15.525 1.172 1.00 0.00 N ATOM 373 CA GLU A 20 83.199 15.010 2.330 1.00 0.00 C ATOM 374 C GLU A 20 83.406 16.110 3.366 1.00 0.00 C ATOM 375 O GLU A 20 83.383 17.297 3.039 1.00 0.00 O ATOM 376 CB GLU A 20 84.560 14.458 1.898 1.00 0.00 C ATOM 377 CG GLU A 20 84.366 13.266 0.952 1.00 0.00 C ATOM 378 CD GLU A 20 83.997 13.725 -0.461 1.00 0.00 C ATOM 379 OE1 GLU A 20 84.243 14.877 -0.791 1.00 0.00 O ATOM 380 OE2 GLU A 20 83.470 12.910 -1.200 1.00 0.00 O ATOM 0 H GLU A 20 83.022 16.135 0.566 1.00 0.00 H new ATOM 0 HA GLU A 20 82.607 14.210 2.774 1.00 0.00 H new ATOM 0 HB2 GLU A 20 85.137 15.238 1.400 1.00 0.00 H new ATOM 0 HB3 GLU A 20 85.131 14.149 2.774 1.00 0.00 H new ATOM 0 HG2 GLU A 20 85.282 12.676 0.916 1.00 0.00 H new ATOM 0 HG3 GLU A 20 83.582 12.616 1.341 1.00 0.00 H new ATOM 387 N ARG A 21 83.605 15.707 4.616 1.00 0.00 N ATOM 388 CA ARG A 21 83.818 16.665 5.695 1.00 0.00 C ATOM 389 C ARG A 21 84.761 16.088 6.748 1.00 0.00 C ATOM 390 O ARG A 21 84.978 14.878 6.803 1.00 0.00 O ATOM 391 CB ARG A 21 82.479 17.036 6.336 1.00 0.00 C ATOM 392 CG ARG A 21 81.803 15.779 6.893 1.00 0.00 C ATOM 393 CD ARG A 21 80.405 16.133 7.404 1.00 0.00 C ATOM 394 NE ARG A 21 80.488 17.177 8.429 1.00 0.00 N ATOM 395 CZ ARG A 21 79.486 18.026 8.704 1.00 0.00 C ATOM 396 NH1 ARG A 21 78.340 17.986 8.067 1.00 0.00 N ATOM 397 NH2 ARG A 21 79.657 18.923 9.637 1.00 0.00 N ATOM 0 H ARG A 21 83.623 14.729 4.906 1.00 0.00 H new ATOM 0 HA ARG A 21 84.275 17.562 5.277 1.00 0.00 H new ATOM 0 HB2 ARG A 21 82.637 17.760 7.136 1.00 0.00 H new ATOM 0 HB3 ARG A 21 81.832 17.511 5.599 1.00 0.00 H new ATOM 0 HG2 ARG A 21 81.736 15.016 6.118 1.00 0.00 H new ATOM 0 HG3 ARG A 21 82.402 15.360 7.702 1.00 0.00 H new ATOM 0 HD2 ARG A 21 79.784 16.475 6.576 1.00 0.00 H new ATOM 0 HD3 ARG A 21 79.926 15.245 7.817 1.00 0.00 H new ATOM 0 HE ARG A 21 81.354 17.263 8.962 1.00 0.00 H new ATOM 0 HH11 ARG A 21 78.188 17.293 7.335 1.00 0.00 H new ATOM 0 HH12 ARG A 21 77.601 18.648 8.304 1.00 0.00 H new ATOM 0 HH21 ARG A 21 80.541 18.970 10.143 1.00 0.00 H new ATOM 0 HH22 ARG A 21 78.906 19.577 9.860 1.00 0.00 H new ATOM 411 N GLN A 22 85.316 16.963 7.582 1.00 0.00 N ATOM 412 CA GLN A 22 86.252 16.538 8.621 1.00 0.00 C ATOM 413 C GLN A 22 85.626 16.690 10.003 1.00 0.00 C ATOM 414 O GLN A 22 84.767 17.545 10.218 1.00 0.00 O ATOM 415 CB GLN A 22 87.527 17.380 8.545 1.00 0.00 C ATOM 416 CG GLN A 22 88.231 17.124 7.210 1.00 0.00 C ATOM 417 CD GLN A 22 89.463 18.016 7.073 1.00 0.00 C ATOM 418 OE1 GLN A 22 89.596 19.019 7.776 1.00 0.00 O ATOM 419 NE2 GLN A 22 90.381 17.708 6.198 1.00 0.00 N ATOM 0 H GLN A 22 85.136 17.967 7.560 1.00 0.00 H new ATOM 0 HA GLN A 22 86.495 15.488 8.458 1.00 0.00 H new ATOM 0 HB2 GLN A 22 87.283 18.438 8.642 1.00 0.00 H new ATOM 0 HB3 GLN A 22 88.191 17.129 9.372 1.00 0.00 H new ATOM 0 HG2 GLN A 22 88.524 16.076 7.142 1.00 0.00 H new ATOM 0 HG3 GLN A 22 87.543 17.316 6.387 1.00 0.00 H new ATOM 0 HE21 GLN A 22 90.272 16.878 5.615 1.00 0.00 H new ATOM 0 HE22 GLN A 22 91.207 18.297 6.097 1.00 0.00 H new ATOM 428 N HIS A 23 86.064 15.851 10.939 1.00 0.00 N ATOM 429 CA HIS A 23 85.551 15.895 12.306 1.00 0.00 C ATOM 430 C HIS A 23 86.703 15.937 13.305 1.00 0.00 C ATOM 431 O HIS A 23 87.831 15.569 12.980 1.00 0.00 O ATOM 432 CB HIS A 23 84.685 14.664 12.577 1.00 0.00 C ATOM 433 CG HIS A 23 83.507 14.545 11.649 1.00 0.00 C ATOM 434 ND1 HIS A 23 82.423 15.407 11.717 1.00 0.00 N ATOM 435 CD2 HIS A 23 83.226 13.671 10.627 1.00 0.00 C ATOM 436 CE1 HIS A 23 81.551 15.038 10.764 1.00 0.00 C ATOM 437 NE2 HIS A 23 81.990 13.985 10.070 1.00 0.00 N ATOM 0 H HIS A 23 86.771 15.134 10.776 1.00 0.00 H new ATOM 0 HA HIS A 23 84.948 16.796 12.422 1.00 0.00 H new ATOM 0 HB2 HIS A 23 85.301 13.769 12.487 1.00 0.00 H new ATOM 0 HB3 HIS A 23 84.325 14.701 13.605 1.00 0.00 H new ATOM 0 HD2 HIS A 23 83.867 12.863 10.305 1.00 0.00 H new ATOM 0 HE1 HIS A 23 80.609 15.533 10.581 1.00 0.00 H new ATOM 0 HE2 HIS A 23 81.520 13.512 9.298 1.00 0.00 H new ATOM 445 N MET A 24 86.412 16.390 14.521 1.00 0.00 N ATOM 446 CA MET A 24 87.436 16.486 15.555 1.00 0.00 C ATOM 447 C MET A 24 87.359 15.292 16.500 1.00 0.00 C ATOM 448 O MET A 24 86.272 14.831 16.849 1.00 0.00 O ATOM 449 CB MET A 24 87.253 17.780 16.351 1.00 0.00 C ATOM 450 CG MET A 24 87.441 18.982 15.422 1.00 0.00 C ATOM 451 SD MET A 24 87.451 20.503 16.402 1.00 0.00 S ATOM 452 CE MET A 24 89.079 20.278 17.157 1.00 0.00 C ATOM 0 H MET A 24 85.483 16.694 14.813 1.00 0.00 H new ATOM 0 HA MET A 24 88.413 16.490 15.072 1.00 0.00 H new ATOM 0 HB2 MET A 24 86.260 17.806 16.800 1.00 0.00 H new ATOM 0 HB3 MET A 24 87.974 17.822 17.168 1.00 0.00 H new ATOM 0 HG2 MET A 24 88.376 18.886 14.870 1.00 0.00 H new ATOM 0 HG3 MET A 24 86.638 19.016 14.686 1.00 0.00 H new ATOM 0 HE1 MET A 24 89.585 21.241 17.225 1.00 0.00 H new ATOM 0 HE2 MET A 24 88.962 19.858 18.156 1.00 0.00 H new ATOM 0 HE3 MET A 24 89.673 19.599 16.546 1.00 0.00 H new ATOM 462 N ASP A 25 88.522 14.795 16.911 1.00 0.00 N ATOM 463 CA ASP A 25 88.579 13.656 17.820 1.00 0.00 C ATOM 464 C ASP A 25 88.521 14.116 19.273 1.00 0.00 C ATOM 465 O ASP A 25 88.580 15.313 19.558 1.00 0.00 O ATOM 466 CB ASP A 25 89.863 12.856 17.576 1.00 0.00 C ATOM 467 CG ASP A 25 91.112 13.721 17.763 1.00 0.00 C ATOM 468 OD1 ASP A 25 91.019 14.773 18.379 1.00 0.00 O ATOM 469 OD2 ASP A 25 92.156 13.315 17.282 1.00 0.00 O ATOM 0 H ASP A 25 89.432 15.161 16.631 1.00 0.00 H new ATOM 0 HA ASP A 25 87.715 13.020 17.627 1.00 0.00 H new ATOM 0 HB2 ASP A 25 89.900 12.009 18.262 1.00 0.00 H new ATOM 0 HB3 ASP A 25 89.851 12.447 16.566 1.00 0.00 H new ATOM 474 N SER A 26 88.405 13.160 20.189 1.00 0.00 N ATOM 475 CA SER A 26 88.339 13.480 21.610 1.00 0.00 C ATOM 476 C SER A 26 89.656 14.102 22.082 1.00 0.00 C ATOM 477 O SER A 26 90.704 13.833 21.494 1.00 0.00 O ATOM 478 CB SER A 26 88.054 12.213 22.417 1.00 0.00 C ATOM 479 OG SER A 26 88.768 11.124 21.847 1.00 0.00 O ATOM 0 H SER A 26 88.355 12.164 19.975 1.00 0.00 H new ATOM 0 HA SER A 26 87.534 14.198 21.765 1.00 0.00 H new ATOM 0 HB2 SER A 26 88.352 12.355 23.456 1.00 0.00 H new ATOM 0 HB3 SER A 26 86.985 12.001 22.418 1.00 0.00 H new ATOM 0 HG SER A 26 88.589 10.310 22.363 1.00 0.00 H new ATOM 485 N PRO A 27 89.638 14.918 23.116 1.00 0.00 N ATOM 486 CA PRO A 27 90.883 15.568 23.619 1.00 0.00 C ATOM 487 C PRO A 27 91.674 14.659 24.555 1.00 0.00 C ATOM 488 O PRO A 27 91.117 13.750 25.171 1.00 0.00 O ATOM 489 CB PRO A 27 90.366 16.799 24.362 1.00 0.00 C ATOM 490 CG PRO A 27 89.019 16.412 24.871 1.00 0.00 C ATOM 491 CD PRO A 27 88.476 15.330 23.934 1.00 0.00 C ATOM 0 HA PRO A 27 91.576 15.807 22.812 1.00 0.00 H new ATOM 0 HB2 PRO A 27 91.032 17.074 25.180 1.00 0.00 H new ATOM 0 HB3 PRO A 27 90.303 17.662 23.699 1.00 0.00 H new ATOM 0 HG2 PRO A 27 89.086 16.038 25.893 1.00 0.00 H new ATOM 0 HG3 PRO A 27 88.353 17.274 24.890 1.00 0.00 H new ATOM 0 HD2 PRO A 27 88.070 14.489 24.495 1.00 0.00 H new ATOM 0 HD3 PRO A 27 87.670 15.716 23.310 1.00 0.00 H new ATOM 499 N ASP A 28 92.975 14.912 24.656 1.00 0.00 N ATOM 500 CA ASP A 28 93.836 14.116 25.522 1.00 0.00 C ATOM 501 C ASP A 28 93.493 14.359 26.989 1.00 0.00 C ATOM 502 O ASP A 28 93.065 15.452 27.363 1.00 0.00 O ATOM 503 CB ASP A 28 95.303 14.474 25.272 1.00 0.00 C ATOM 504 CG ASP A 28 95.706 14.120 23.842 1.00 0.00 C ATOM 505 OD1 ASP A 28 95.153 13.176 23.300 1.00 0.00 O ATOM 506 OD2 ASP A 28 96.565 14.801 23.308 1.00 0.00 O ATOM 0 H ASP A 28 93.454 15.658 24.152 1.00 0.00 H new ATOM 0 HA ASP A 28 93.676 13.062 25.293 1.00 0.00 H new ATOM 0 HB2 ASP A 28 95.458 15.539 25.446 1.00 0.00 H new ATOM 0 HB3 ASP A 28 95.939 13.940 25.978 1.00 0.00 H new ATOM 511 N LEU A 29 93.686 13.335 27.814 1.00 0.00 N ATOM 512 CA LEU A 29 93.393 13.451 29.239 1.00 0.00 C ATOM 513 C LEU A 29 94.576 14.069 29.978 1.00 0.00 C ATOM 514 O LEU A 29 95.732 13.820 29.637 1.00 0.00 O ATOM 515 CB LEU A 29 93.085 12.072 29.828 1.00 0.00 C ATOM 516 CG LEU A 29 91.920 11.425 29.073 1.00 0.00 C ATOM 517 CD1 LEU A 29 91.688 10.012 29.609 1.00 0.00 C ATOM 518 CD2 LEU A 29 90.648 12.255 29.276 1.00 0.00 C ATOM 0 H LEU A 29 94.041 12.423 27.525 1.00 0.00 H new ATOM 0 HA LEU A 29 92.523 14.097 29.359 1.00 0.00 H new ATOM 0 HB2 LEU A 29 93.968 11.436 29.765 1.00 0.00 H new ATOM 0 HB3 LEU A 29 92.836 12.167 30.885 1.00 0.00 H new ATOM 0 HG LEU A 29 92.161 11.382 28.011 1.00 0.00 H new ATOM 0 HD11 LEU A 29 90.859 9.551 29.072 1.00 0.00 H new ATOM 0 HD12 LEU A 29 92.589 9.416 29.466 1.00 0.00 H new ATOM 0 HD13 LEU A 29 91.450 10.060 30.672 1.00 0.00 H new ATOM 0 HD21 LEU A 29 89.821 11.792 28.737 1.00 0.00 H new ATOM 0 HD22 LEU A 29 90.409 12.300 30.338 1.00 0.00 H new ATOM 0 HD23 LEU A 29 90.808 13.264 28.897 1.00 0.00 H new ATOM 530 N GLY A 30 94.279 14.877 30.990 1.00 0.00 N ATOM 531 CA GLY A 30 95.324 15.547 31.754 1.00 0.00 C ATOM 532 C GLY A 30 94.818 15.958 33.132 1.00 0.00 C ATOM 533 O GLY A 30 94.083 15.215 33.783 1.00 0.00 O ATOM 0 H GLY A 30 93.329 15.083 31.299 1.00 0.00 H new ATOM 0 HA2 GLY A 30 96.182 14.884 31.861 1.00 0.00 H new ATOM 0 HA3 GLY A 30 95.667 16.428 31.212 1.00 0.00 H new ATOM 537 N THR A 31 95.218 17.147 33.571 1.00 0.00 N ATOM 538 CA THR A 31 94.810 17.648 34.879 1.00 0.00 C ATOM 539 C THR A 31 93.338 18.047 34.861 1.00 0.00 C ATOM 540 O THR A 31 92.716 18.111 33.801 1.00 0.00 O ATOM 541 CB THR A 31 95.662 18.858 35.275 1.00 0.00 C ATOM 542 OG1 THR A 31 95.430 19.918 34.358 1.00 0.00 O ATOM 543 CG2 THR A 31 97.146 18.479 35.259 1.00 0.00 C ATOM 0 H THR A 31 95.821 17.779 33.044 1.00 0.00 H new ATOM 0 HA THR A 31 94.955 16.852 35.609 1.00 0.00 H new ATOM 0 HB THR A 31 95.388 19.178 36.280 1.00 0.00 H new ATOM 0 HG1 THR A 31 95.973 20.694 34.611 1.00 0.00 H new ATOM 0 HG21 THR A 31 97.746 19.344 35.542 1.00 0.00 H new ATOM 0 HG22 THR A 31 97.322 17.669 35.966 1.00 0.00 H new ATOM 0 HG23 THR A 31 97.428 18.154 34.257 1.00 0.00 H new ATOM 551 N ASP A 32 92.787 18.316 36.041 1.00 0.00 N ATOM 552 CA ASP A 32 91.376 18.671 36.157 1.00 0.00 C ATOM 553 C ASP A 32 91.037 19.863 35.265 1.00 0.00 C ATOM 554 O ASP A 32 91.854 20.766 35.079 1.00 0.00 O ATOM 555 CB ASP A 32 91.035 18.999 37.615 1.00 0.00 C ATOM 556 CG ASP A 32 91.813 20.222 38.098 1.00 0.00 C ATOM 557 OD1 ASP A 32 92.900 20.456 37.593 1.00 0.00 O ATOM 558 OD2 ASP A 32 91.311 20.906 38.975 1.00 0.00 O ATOM 0 H ASP A 32 93.293 18.295 36.926 1.00 0.00 H new ATOM 0 HA ASP A 32 90.783 17.817 35.830 1.00 0.00 H new ATOM 0 HB2 ASP A 32 89.965 19.184 37.709 1.00 0.00 H new ATOM 0 HB3 ASP A 32 91.267 18.143 38.248 1.00 0.00 H new ATOM 563 N ASP A 33 89.826 19.857 34.719 1.00 0.00 N ATOM 564 CA ASP A 33 89.394 20.920 33.821 1.00 0.00 C ATOM 565 C ASP A 33 87.885 21.119 33.917 1.00 0.00 C ATOM 566 O ASP A 33 87.177 20.292 34.495 1.00 0.00 O ATOM 567 CB ASP A 33 89.777 20.571 32.381 1.00 0.00 C ATOM 568 CG ASP A 33 89.571 21.778 31.474 1.00 0.00 C ATOM 569 OD1 ASP A 33 90.463 22.609 31.414 1.00 0.00 O ATOM 570 OD2 ASP A 33 88.525 21.855 30.851 1.00 0.00 O ATOM 0 H ASP A 33 89.129 19.131 34.882 1.00 0.00 H new ATOM 0 HA ASP A 33 89.889 21.846 34.114 1.00 0.00 H new ATOM 0 HB2 ASP A 33 90.818 20.251 32.341 1.00 0.00 H new ATOM 0 HB3 ASP A 33 89.173 19.735 32.029 1.00 0.00 H new ATOM 575 N ASP A 34 87.396 22.218 33.350 1.00 0.00 N ATOM 576 CA ASP A 34 85.966 22.515 33.375 1.00 0.00 C ATOM 577 C ASP A 34 85.160 21.357 32.793 1.00 0.00 C ATOM 578 O ASP A 34 85.659 20.594 31.966 1.00 0.00 O ATOM 579 CB ASP A 34 85.685 23.788 32.573 1.00 0.00 C ATOM 580 CG ASP A 34 84.225 24.197 32.739 1.00 0.00 C ATOM 581 OD1 ASP A 34 83.923 24.855 33.721 1.00 0.00 O ATOM 582 OD2 ASP A 34 83.432 23.847 31.881 1.00 0.00 O ATOM 0 H ASP A 34 87.965 22.915 32.870 1.00 0.00 H new ATOM 0 HA ASP A 34 85.665 22.662 34.412 1.00 0.00 H new ATOM 0 HB2 ASP A 34 86.338 24.593 32.912 1.00 0.00 H new ATOM 0 HB3 ASP A 34 85.907 23.620 31.519 1.00 0.00 H new ATOM 587 N ASP A 35 83.911 21.234 33.230 1.00 0.00 N ATOM 588 CA ASP A 35 83.060 20.138 32.782 1.00 0.00 C ATOM 589 C ASP A 35 82.646 20.337 31.328 1.00 0.00 C ATOM 590 O ASP A 35 82.054 21.355 30.972 1.00 0.00 O ATOM 591 CB ASP A 35 81.811 20.053 33.662 1.00 0.00 C ATOM 592 CG ASP A 35 80.986 18.829 33.280 1.00 0.00 C ATOM 593 OD1 ASP A 35 81.292 17.756 33.772 1.00 0.00 O ATOM 594 OD2 ASP A 35 80.060 18.984 32.501 1.00 0.00 O ATOM 0 H ASP A 35 83.468 21.874 33.889 1.00 0.00 H new ATOM 0 HA ASP A 35 83.626 19.210 32.862 1.00 0.00 H new ATOM 0 HB2 ASP A 35 82.099 19.994 34.712 1.00 0.00 H new ATOM 0 HB3 ASP A 35 81.212 20.956 33.546 1.00 0.00 H new ATOM 599 N LYS A 36 82.965 19.351 30.493 1.00 0.00 N ATOM 600 CA LYS A 36 82.636 19.414 29.072 1.00 0.00 C ATOM 601 C LYS A 36 81.910 18.144 28.639 1.00 0.00 C ATOM 602 O LYS A 36 82.209 17.052 29.120 1.00 0.00 O ATOM 603 CB LYS A 36 83.915 19.576 28.248 1.00 0.00 C ATOM 604 CG LYS A 36 83.553 19.798 26.779 1.00 0.00 C ATOM 605 CD LYS A 36 84.831 19.876 25.942 1.00 0.00 C ATOM 606 CE LYS A 36 84.478 20.252 24.502 1.00 0.00 C ATOM 607 NZ LYS A 36 85.555 19.777 23.587 1.00 0.00 N ATOM 0 H LYS A 36 83.451 18.500 30.776 1.00 0.00 H new ATOM 0 HA LYS A 36 81.984 20.271 28.904 1.00 0.00 H new ATOM 0 HB2 LYS A 36 84.496 20.419 28.621 1.00 0.00 H new ATOM 0 HB3 LYS A 36 84.540 18.689 28.349 1.00 0.00 H new ATOM 0 HG2 LYS A 36 82.922 18.984 26.422 1.00 0.00 H new ATOM 0 HG3 LYS A 36 82.978 20.718 26.671 1.00 0.00 H new ATOM 0 HD2 LYS A 36 85.511 20.615 26.366 1.00 0.00 H new ATOM 0 HD3 LYS A 36 85.350 18.918 25.962 1.00 0.00 H new ATOM 0 HE2 LYS A 36 83.524 19.805 24.221 1.00 0.00 H new ATOM 0 HE3 LYS A 36 84.362 21.332 24.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 85.316 20.032 22.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 86.457 20.223 23.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 85.645 18.744 23.663 1.00 0.00 H new ATOM 621 N THR A 37 80.954 18.295 27.726 1.00 0.00 N ATOM 622 CA THR A 37 80.188 17.152 27.243 1.00 0.00 C ATOM 623 C THR A 37 81.058 16.268 26.355 1.00 0.00 C ATOM 624 O THR A 37 82.105 16.697 25.871 1.00 0.00 O ATOM 625 CB THR A 37 78.967 17.629 26.452 1.00 0.00 C ATOM 626 OG1 THR A 37 79.399 18.335 25.298 1.00 0.00 O ATOM 627 CG2 THR A 37 78.106 18.546 27.325 1.00 0.00 C ATOM 0 H THR A 37 80.694 19.189 27.310 1.00 0.00 H new ATOM 0 HA THR A 37 79.854 16.573 28.104 1.00 0.00 H new ATOM 0 HB THR A 37 78.374 16.766 26.150 1.00 0.00 H new ATOM 0 HG1 THR A 37 78.619 18.640 24.790 1.00 0.00 H new ATOM 0 HG21 THR A 37 77.239 18.882 26.756 1.00 0.00 H new ATOM 0 HG22 THR A 37 77.772 18.000 28.207 1.00 0.00 H new ATOM 0 HG23 THR A 37 78.693 19.410 27.635 1.00 0.00 H new ATOM 635 N GLY A 38 80.618 15.031 26.146 1.00 0.00 N ATOM 636 CA GLY A 38 81.384 14.087 25.341 1.00 0.00 C ATOM 637 C GLY A 38 81.167 14.331 23.852 1.00 0.00 C ATOM 638 O GLY A 38 80.405 15.214 23.461 1.00 0.00 O ATOM 0 H GLY A 38 79.743 14.662 26.519 1.00 0.00 H new ATOM 0 HA2 GLY A 38 82.444 14.180 25.577 1.00 0.00 H new ATOM 0 HA3 GLY A 38 81.090 13.068 25.592 1.00 0.00 H new ATOM 642 N GLY A 39 81.843 13.538 23.027 1.00 0.00 N ATOM 643 CA GLY A 39 81.732 13.680 21.580 1.00 0.00 C ATOM 644 C GLY A 39 80.565 12.863 21.036 1.00 0.00 C ATOM 645 O GLY A 39 79.769 12.315 21.797 1.00 0.00 O ATOM 0 H GLY A 39 82.470 12.794 23.334 1.00 0.00 H new ATOM 0 HA2 GLY A 39 81.595 14.731 21.324 1.00 0.00 H new ATOM 0 HA3 GLY A 39 82.659 13.355 21.107 1.00 0.00 H new ATOM 649 N GLY A 40 80.474 12.787 19.712 1.00 0.00 N ATOM 650 CA GLY A 40 79.407 12.029 19.069 1.00 0.00 C ATOM 651 C GLY A 40 79.683 10.531 19.143 1.00 0.00 C ATOM 652 O GLY A 40 80.413 10.068 20.019 1.00 0.00 O ATOM 0 H GLY A 40 81.122 13.238 19.067 1.00 0.00 H new ATOM 0 HA2 GLY A 40 78.455 12.252 19.552 1.00 0.00 H new ATOM 0 HA3 GLY A 40 79.315 12.335 18.027 1.00 0.00 H new ATOM 656 N ARG A 41 79.093 9.778 18.220 1.00 0.00 N ATOM 657 CA ARG A 41 79.267 8.330 18.196 1.00 0.00 C ATOM 658 C ARG A 41 80.747 7.961 18.137 1.00 0.00 C ATOM 659 O ARG A 41 81.557 8.693 17.568 1.00 0.00 O ATOM 660 CB ARG A 41 78.544 7.738 16.985 1.00 0.00 C ATOM 661 CG ARG A 41 77.041 7.995 17.110 1.00 0.00 C ATOM 662 CD ARG A 41 76.313 7.378 15.915 1.00 0.00 C ATOM 663 NE ARG A 41 76.365 5.915 15.990 1.00 0.00 N ATOM 664 CZ ARG A 41 75.956 5.108 14.999 1.00 0.00 C ATOM 665 NH1 ARG A 41 75.472 5.573 13.873 1.00 0.00 N ATOM 666 NH2 ARG A 41 76.042 3.816 15.163 1.00 0.00 N ATOM 0 H ARG A 41 78.492 10.145 17.482 1.00 0.00 H new ATOM 0 HA ARG A 41 78.842 7.920 19.112 1.00 0.00 H new ATOM 0 HB2 ARG A 41 78.925 8.185 16.067 1.00 0.00 H new ATOM 0 HB3 ARG A 41 78.736 6.667 16.921 1.00 0.00 H new ATOM 0 HG2 ARG A 41 76.665 7.566 18.039 1.00 0.00 H new ATOM 0 HG3 ARG A 41 76.848 9.067 17.152 1.00 0.00 H new ATOM 0 HD2 ARG A 41 75.275 7.712 15.900 1.00 0.00 H new ATOM 0 HD3 ARG A 41 76.771 7.718 14.986 1.00 0.00 H new ATOM 0 HE ARG A 41 76.732 5.488 16.841 1.00 0.00 H new ATOM 0 HH11 ARG A 41 75.396 6.580 13.728 1.00 0.00 H new ATOM 0 HH12 ARG A 41 75.171 4.928 13.142 1.00 0.00 H new ATOM 0 HH21 ARG A 41 76.415 3.436 16.033 1.00 0.00 H new ATOM 0 HH22 ARG A 41 75.736 3.186 14.421 1.00 0.00 H new ATOM 680 N ALA A 42 81.091 6.821 18.728 1.00 0.00 N ATOM 681 CA ALA A 42 82.480 6.379 18.768 1.00 0.00 C ATOM 682 C ALA A 42 83.056 6.275 17.360 1.00 0.00 C ATOM 683 O ALA A 42 82.354 5.918 16.415 1.00 0.00 O ATOM 684 CB ALA A 42 82.573 5.017 19.460 1.00 0.00 C ATOM 0 H ALA A 42 80.431 6.190 19.183 1.00 0.00 H new ATOM 0 HA ALA A 42 83.057 7.115 19.328 1.00 0.00 H new ATOM 0 HB1 ALA A 42 83.613 4.693 19.486 1.00 0.00 H new ATOM 0 HB2 ALA A 42 82.193 5.099 20.478 1.00 0.00 H new ATOM 0 HB3 ALA A 42 81.979 4.288 18.909 1.00 0.00 H new ATOM 690 N ASP A 43 84.341 6.590 17.231 1.00 0.00 N ATOM 691 CA ASP A 43 85.008 6.532 15.935 1.00 0.00 C ATOM 692 C ASP A 43 85.157 5.082 15.468 1.00 0.00 C ATOM 693 O ASP A 43 85.133 4.169 16.294 1.00 0.00 O ATOM 694 CB ASP A 43 86.388 7.185 16.028 1.00 0.00 C ATOM 695 CG ASP A 43 86.242 8.695 16.179 1.00 0.00 C ATOM 696 OD1 ASP A 43 86.052 9.355 15.171 1.00 0.00 O ATOM 697 OD2 ASP A 43 86.321 9.169 17.301 1.00 0.00 O ATOM 0 H ASP A 43 84.938 6.886 18.003 1.00 0.00 H new ATOM 0 HA ASP A 43 84.398 7.072 15.211 1.00 0.00 H new ATOM 0 HB2 ASP A 43 86.935 6.778 16.878 1.00 0.00 H new ATOM 0 HB3 ASP A 43 86.969 6.955 15.135 1.00 0.00 H new ATOM 702 N PRO A 44 85.310 4.842 14.181 1.00 0.00 N ATOM 703 CA PRO A 44 85.456 3.449 13.661 1.00 0.00 C ATOM 704 C PRO A 44 86.843 2.873 13.935 1.00 0.00 C ATOM 705 O PRO A 44 87.633 3.456 14.678 1.00 0.00 O ATOM 706 CB PRO A 44 85.211 3.586 12.158 1.00 0.00 C ATOM 707 CG PRO A 44 85.617 4.979 11.822 1.00 0.00 C ATOM 708 CD PRO A 44 85.369 5.822 13.073 1.00 0.00 C ATOM 0 HA PRO A 44 84.763 2.762 14.146 1.00 0.00 H new ATOM 0 HB2 PRO A 44 85.796 2.859 11.596 1.00 0.00 H new ATOM 0 HB3 PRO A 44 84.164 3.411 11.912 1.00 0.00 H new ATOM 0 HG2 PRO A 44 86.667 5.017 11.532 1.00 0.00 H new ATOM 0 HG3 PRO A 44 85.039 5.358 10.979 1.00 0.00 H new ATOM 0 HD2 PRO A 44 86.169 6.546 13.227 1.00 0.00 H new ATOM 0 HD3 PRO A 44 84.439 6.386 12.993 1.00 0.00 H new ATOM 716 N ALA A 45 87.129 1.725 13.330 1.00 0.00 N ATOM 717 CA ALA A 45 88.417 1.068 13.520 1.00 0.00 C ATOM 718 C ALA A 45 89.543 1.916 12.930 1.00 0.00 C ATOM 719 O ALA A 45 89.319 3.049 12.506 1.00 0.00 O ATOM 720 CB ALA A 45 88.397 -0.310 12.854 1.00 0.00 C ATOM 0 H ALA A 45 86.490 1.232 12.707 1.00 0.00 H new ATOM 0 HA ALA A 45 88.596 0.950 14.589 1.00 0.00 H new ATOM 0 HB1 ALA A 45 89.361 -0.798 12.998 1.00 0.00 H new ATOM 0 HB2 ALA A 45 87.612 -0.919 13.302 1.00 0.00 H new ATOM 0 HB3 ALA A 45 88.204 -0.196 11.787 1.00 0.00 H new ATOM 726 N HIS A 46 90.751 1.359 12.905 1.00 0.00 N ATOM 727 CA HIS A 46 91.907 2.080 12.383 1.00 0.00 C ATOM 728 C HIS A 46 91.653 2.547 10.953 1.00 0.00 C ATOM 729 O HIS A 46 90.675 2.145 10.323 1.00 0.00 O ATOM 730 CB HIS A 46 93.142 1.178 12.413 1.00 0.00 C ATOM 731 CG HIS A 46 93.458 0.642 13.783 1.00 0.00 C ATOM 732 ND1 HIS A 46 93.947 1.449 14.797 1.00 0.00 N ATOM 733 CD2 HIS A 46 93.360 -0.618 14.322 1.00 0.00 C ATOM 734 CE1 HIS A 46 94.124 0.675 15.884 1.00 0.00 C ATOM 735 NE2 HIS A 46 93.782 -0.594 15.649 1.00 0.00 N ATOM 0 H HIS A 46 90.954 0.416 13.238 1.00 0.00 H new ATOM 0 HA HIS A 46 92.077 2.954 13.012 1.00 0.00 H new ATOM 0 HB2 HIS A 46 92.989 0.342 11.730 1.00 0.00 H new ATOM 0 HB3 HIS A 46 94.001 1.738 12.043 1.00 0.00 H new ATOM 0 HD2 HIS A 46 93.009 -1.494 13.797 1.00 0.00 H new ATOM 0 HE1 HIS A 46 94.497 1.036 16.831 1.00 0.00 H new ATOM 0 HE2 HIS A 46 93.821 -1.377 16.301 1.00 0.00 H new ATOM 743 N ARG A 47 92.540 3.401 10.446 1.00 0.00 N ATOM 744 CA ARG A 47 92.387 3.956 9.104 1.00 0.00 C ATOM 745 C ARG A 47 93.538 3.521 8.204 1.00 0.00 C ATOM 746 O ARG A 47 94.668 3.346 8.661 1.00 0.00 O ATOM 747 CB ARG A 47 92.351 5.484 9.179 1.00 0.00 C ATOM 748 CG ARG A 47 91.112 5.930 9.958 1.00 0.00 C ATOM 749 CD ARG A 47 91.009 7.456 9.932 1.00 0.00 C ATOM 750 NE ARG A 47 92.227 8.059 10.484 1.00 0.00 N ATOM 751 CZ ARG A 47 92.648 9.294 10.174 1.00 0.00 C ATOM 752 NH1 ARG A 47 91.994 10.068 9.341 1.00 0.00 N ATOM 753 NH2 ARG A 47 93.746 9.741 10.719 1.00 0.00 N ATOM 0 H ARG A 47 93.370 3.723 10.944 1.00 0.00 H new ATOM 0 HA ARG A 47 91.453 3.584 8.682 1.00 0.00 H new ATOM 0 HB2 ARG A 47 93.253 5.856 9.666 1.00 0.00 H new ATOM 0 HB3 ARG A 47 92.334 5.907 8.175 1.00 0.00 H new ATOM 0 HG2 ARG A 47 90.217 5.488 9.521 1.00 0.00 H new ATOM 0 HG3 ARG A 47 91.171 5.577 10.988 1.00 0.00 H new ATOM 0 HD2 ARG A 47 90.857 7.799 8.909 1.00 0.00 H new ATOM 0 HD3 ARG A 47 90.142 7.778 10.509 1.00 0.00 H new ATOM 0 HE ARG A 47 92.784 7.510 11.139 1.00 0.00 H new ATOM 0 HH11 ARG A 47 91.134 9.736 8.905 1.00 0.00 H new ATOM 0 HH12 ARG A 47 92.346 11.002 9.130 1.00 0.00 H new ATOM 0 HH21 ARG A 47 94.269 9.154 11.369 1.00 0.00 H new ATOM 0 HH22 ARG A 47 94.082 10.678 10.495 1.00 0.00 H new ATOM 767 N SER A 48 93.241 3.348 6.920 1.00 0.00 N ATOM 768 CA SER A 48 94.254 2.949 5.950 1.00 0.00 C ATOM 769 C SER A 48 95.229 4.102 5.695 1.00 0.00 C ATOM 770 O SER A 48 94.923 5.244 6.040 1.00 0.00 O ATOM 771 CB SER A 48 93.588 2.539 4.635 1.00 0.00 C ATOM 772 OG SER A 48 92.374 1.855 4.916 1.00 0.00 O ATOM 0 H SER A 48 92.308 3.478 6.528 1.00 0.00 H new ATOM 0 HA SER A 48 94.806 2.100 6.354 1.00 0.00 H new ATOM 0 HB2 SER A 48 93.389 3.420 4.025 1.00 0.00 H new ATOM 0 HB3 SER A 48 94.256 1.897 4.061 1.00 0.00 H new ATOM 0 HG SER A 48 91.944 1.593 4.075 1.00 0.00 H new ATOM 778 N PRO A 49 96.381 3.847 5.109 1.00 0.00 N ATOM 779 CA PRO A 49 97.376 4.932 4.839 1.00 0.00 C ATOM 780 C PRO A 49 96.734 6.150 4.180 1.00 0.00 C ATOM 781 O PRO A 49 95.635 6.064 3.634 1.00 0.00 O ATOM 782 CB PRO A 49 98.396 4.281 3.904 1.00 0.00 C ATOM 783 CG PRO A 49 98.331 2.825 4.212 1.00 0.00 C ATOM 784 CD PRO A 49 96.893 2.540 4.641 1.00 0.00 C ATOM 0 HA PRO A 49 97.822 5.308 5.759 1.00 0.00 H new ATOM 0 HB2 PRO A 49 98.153 4.474 2.859 1.00 0.00 H new ATOM 0 HB3 PRO A 49 99.397 4.676 4.076 1.00 0.00 H new ATOM 0 HG2 PRO A 49 98.601 2.231 3.339 1.00 0.00 H new ATOM 0 HG3 PRO A 49 99.032 2.564 5.005 1.00 0.00 H new ATOM 0 HD2 PRO A 49 96.300 2.155 3.811 1.00 0.00 H new ATOM 0 HD3 PRO A 49 96.856 1.792 5.433 1.00 0.00 H new ATOM 792 N VAL A 50 97.427 7.283 4.234 1.00 0.00 N ATOM 793 CA VAL A 50 96.888 8.522 3.684 1.00 0.00 C ATOM 794 C VAL A 50 97.306 8.651 2.216 1.00 0.00 C ATOM 795 O VAL A 50 98.441 8.302 1.891 1.00 0.00 O ATOM 796 CB VAL A 50 97.425 9.712 4.491 1.00 0.00 C ATOM 797 CG1 VAL A 50 96.849 11.024 3.952 1.00 0.00 C ATOM 798 CG2 VAL A 50 97.024 9.561 5.960 1.00 0.00 C ATOM 0 H VAL A 50 98.355 7.369 4.649 1.00 0.00 H new ATOM 0 HA VAL A 50 95.800 8.511 3.745 1.00 0.00 H new ATOM 0 HB VAL A 50 98.511 9.731 4.401 1.00 0.00 H new ATOM 0 HG11 VAL A 50 97.239 11.859 4.534 1.00 0.00 H new ATOM 0 HG12 VAL A 50 97.135 11.145 2.907 1.00 0.00 H new ATOM 0 HG13 VAL A 50 95.762 11.003 4.030 1.00 0.00 H new ATOM 0 HG21 VAL A 50 97.407 10.407 6.530 1.00 0.00 H new ATOM 0 HG22 VAL A 50 95.937 9.532 6.039 1.00 0.00 H new ATOM 0 HG23 VAL A 50 97.442 8.636 6.358 1.00 0.00 H new ATOM 808 N PRO A 51 96.467 9.157 1.334 1.00 0.00 N ATOM 809 CA PRO A 51 96.858 9.321 -0.100 1.00 0.00 C ATOM 810 C PRO A 51 98.175 10.080 -0.235 1.00 0.00 C ATOM 811 O PRO A 51 98.600 10.771 0.691 1.00 0.00 O ATOM 812 CB PRO A 51 95.707 10.112 -0.724 1.00 0.00 C ATOM 813 CG PRO A 51 94.528 9.842 0.146 1.00 0.00 C ATOM 814 CD PRO A 51 95.074 9.600 1.552 1.00 0.00 C ATOM 0 HA PRO A 51 97.018 8.361 -0.591 1.00 0.00 H new ATOM 0 HB2 PRO A 51 95.935 11.177 -0.758 1.00 0.00 H new ATOM 0 HB3 PRO A 51 95.521 9.793 -1.749 1.00 0.00 H new ATOM 0 HG2 PRO A 51 93.838 10.686 0.138 1.00 0.00 H new ATOM 0 HG3 PRO A 51 93.974 8.974 -0.210 1.00 0.00 H new ATOM 0 HD2 PRO A 51 95.035 10.507 2.155 1.00 0.00 H new ATOM 0 HD3 PRO A 51 94.494 8.842 2.079 1.00 0.00 H new ATOM 822 N LEU A 52 98.817 9.949 -1.391 1.00 0.00 N ATOM 823 CA LEU A 52 100.111 10.585 -1.608 1.00 0.00 C ATOM 824 C LEU A 52 99.981 12.108 -1.555 1.00 0.00 C ATOM 825 O LEU A 52 98.901 12.637 -1.825 1.00 0.00 O ATOM 826 CB LEU A 52 100.676 10.176 -2.969 1.00 0.00 C ATOM 827 CG LEU A 52 101.149 8.722 -2.923 1.00 0.00 C ATOM 828 CD1 LEU A 52 101.453 8.243 -4.343 1.00 0.00 C ATOM 829 CD2 LEU A 52 102.420 8.623 -2.074 1.00 0.00 C ATOM 0 H LEU A 52 98.467 9.413 -2.185 1.00 0.00 H new ATOM 0 HA LEU A 52 100.786 10.258 -0.817 1.00 0.00 H new ATOM 0 HB2 LEU A 52 99.914 10.295 -3.739 1.00 0.00 H new ATOM 0 HB3 LEU A 52 101.506 10.829 -3.239 1.00 0.00 H new ATOM 0 HG LEU A 52 100.368 8.101 -2.484 1.00 0.00 H new ATOM 0 HD11 LEU A 52 101.790 7.207 -4.313 1.00 0.00 H new ATOM 0 HD12 LEU A 52 100.552 8.314 -4.952 1.00 0.00 H new ATOM 0 HD13 LEU A 52 102.234 8.867 -4.778 1.00 0.00 H new ATOM 0 HD21 LEU A 52 102.756 7.587 -2.042 1.00 0.00 H new ATOM 0 HD22 LEU A 52 103.200 9.244 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 52 102.209 8.968 -1.062 1.00 0.00 H new ATOM 841 N PRO A 53 101.035 12.826 -1.218 1.00 0.00 N ATOM 842 CA PRO A 53 100.980 14.318 -1.193 1.00 0.00 C ATOM 843 C PRO A 53 100.878 14.895 -2.600 1.00 0.00 C ATOM 844 O PRO A 53 101.385 14.308 -3.559 1.00 0.00 O ATOM 845 CB PRO A 53 102.290 14.739 -0.521 1.00 0.00 C ATOM 846 CG PRO A 53 103.232 13.608 -0.753 1.00 0.00 C ATOM 847 CD PRO A 53 102.379 12.342 -0.834 1.00 0.00 C ATOM 0 HA PRO A 53 100.103 14.685 -0.660 1.00 0.00 H new ATOM 0 HB2 PRO A 53 102.673 15.664 -0.951 1.00 0.00 H new ATOM 0 HB3 PRO A 53 102.146 14.918 0.544 1.00 0.00 H new ATOM 0 HG2 PRO A 53 103.796 13.755 -1.674 1.00 0.00 H new ATOM 0 HG3 PRO A 53 103.958 13.535 0.057 1.00 0.00 H new ATOM 0 HD2 PRO A 53 102.775 11.643 -1.571 1.00 0.00 H new ATOM 0 HD3 PRO A 53 102.354 11.818 0.121 1.00 0.00 H new ATOM 855 N SER A 54 100.258 16.069 -2.713 1.00 0.00 N ATOM 856 CA SER A 54 100.020 16.676 -4.020 1.00 0.00 C ATOM 857 C SER A 54 101.340 16.827 -4.781 1.00 0.00 C ATOM 858 O SER A 54 102.331 17.262 -4.190 1.00 0.00 O ATOM 859 CB SER A 54 99.370 18.049 -3.846 1.00 0.00 C ATOM 860 OG SER A 54 98.006 17.879 -3.489 1.00 0.00 O ATOM 0 H SER A 54 99.914 16.614 -1.922 1.00 0.00 H new ATOM 0 HA SER A 54 99.352 16.029 -4.589 1.00 0.00 H new ATOM 0 HB2 SER A 54 99.892 18.616 -3.075 1.00 0.00 H new ATOM 0 HB3 SER A 54 99.448 18.621 -4.771 1.00 0.00 H new ATOM 0 HG SER A 54 97.586 18.757 -3.375 1.00 0.00 H new ATOM 866 N PRO A 55 101.392 16.496 -6.052 1.00 0.00 N ATOM 867 CA PRO A 55 102.689 16.421 -6.779 1.00 0.00 C ATOM 868 C PRO A 55 103.210 17.783 -7.226 1.00 0.00 C ATOM 869 O PRO A 55 102.557 18.491 -7.992 1.00 0.00 O ATOM 870 CB PRO A 55 102.370 15.541 -7.985 1.00 0.00 C ATOM 871 CG PRO A 55 100.931 15.793 -8.285 1.00 0.00 C ATOM 872 CD PRO A 55 100.269 16.221 -6.972 1.00 0.00 C ATOM 0 HA PRO A 55 103.481 16.028 -6.141 1.00 0.00 H new ATOM 0 HB2 PRO A 55 103.000 15.797 -8.837 1.00 0.00 H new ATOM 0 HB3 PRO A 55 102.547 14.489 -7.762 1.00 0.00 H new ATOM 0 HG2 PRO A 55 100.825 16.570 -9.042 1.00 0.00 H new ATOM 0 HG3 PRO A 55 100.457 14.895 -8.682 1.00 0.00 H new ATOM 0 HD2 PRO A 55 99.648 17.106 -7.113 1.00 0.00 H new ATOM 0 HD3 PRO A 55 99.622 15.436 -6.582 1.00 0.00 H new ATOM 880 N THR A 56 104.395 18.138 -6.741 1.00 0.00 N ATOM 881 CA THR A 56 105.122 19.269 -7.302 1.00 0.00 C ATOM 882 C THR A 56 105.867 18.773 -8.535 1.00 0.00 C ATOM 883 O THR A 56 106.144 17.577 -8.642 1.00 0.00 O ATOM 884 CB THR A 56 106.116 19.835 -6.284 1.00 0.00 C ATOM 885 OG1 THR A 56 107.105 18.857 -5.997 1.00 0.00 O ATOM 886 CG2 THR A 56 105.382 20.217 -4.996 1.00 0.00 C ATOM 0 H THR A 56 104.867 17.665 -5.970 1.00 0.00 H new ATOM 0 HA THR A 56 104.426 20.066 -7.564 1.00 0.00 H new ATOM 0 HB THR A 56 106.591 20.724 -6.700 1.00 0.00 H new ATOM 0 HG1 THR A 56 107.743 19.218 -5.347 1.00 0.00 H new ATOM 0 HG21 THR A 56 106.095 20.619 -4.276 1.00 0.00 H new ATOM 0 HG22 THR A 56 104.626 20.971 -5.218 1.00 0.00 H new ATOM 0 HG23 THR A 56 104.901 19.334 -4.576 1.00 0.00 H new ATOM 894 N SER A 57 106.225 19.673 -9.450 1.00 0.00 N ATOM 895 CA SER A 57 106.808 19.239 -10.717 1.00 0.00 C ATOM 896 C SER A 57 108.055 18.388 -10.479 1.00 0.00 C ATOM 897 O SER A 57 108.985 18.805 -9.788 1.00 0.00 O ATOM 898 CB SER A 57 107.175 20.456 -11.567 1.00 0.00 C ATOM 899 OG SER A 57 107.632 20.017 -12.839 1.00 0.00 O ATOM 0 H SER A 57 106.125 20.682 -9.342 1.00 0.00 H new ATOM 0 HA SER A 57 106.069 18.635 -11.243 1.00 0.00 H new ATOM 0 HB2 SER A 57 106.309 21.108 -11.683 1.00 0.00 H new ATOM 0 HB3 SER A 57 107.950 21.041 -11.071 1.00 0.00 H new ATOM 0 HG SER A 57 107.867 20.794 -13.388 1.00 0.00 H new ATOM 905 N ASN A 58 108.051 17.189 -11.056 1.00 0.00 N ATOM 906 CA ASN A 58 109.220 16.314 -11.036 1.00 0.00 C ATOM 907 C ASN A 58 109.614 15.868 -9.624 1.00 0.00 C ATOM 908 O ASN A 58 110.727 15.375 -9.439 1.00 0.00 O ATOM 909 CB ASN A 58 110.410 17.021 -11.692 1.00 0.00 C ATOM 910 CG ASN A 58 110.092 17.343 -13.150 1.00 0.00 C ATOM 911 OD1 ASN A 58 109.244 16.693 -13.763 1.00 0.00 O ATOM 912 ND2 ASN A 58 110.729 18.314 -13.745 1.00 0.00 N ATOM 0 H ASN A 58 107.246 16.799 -11.546 1.00 0.00 H new ATOM 0 HA ASN A 58 108.948 15.418 -11.594 1.00 0.00 H new ATOM 0 HB2 ASN A 58 110.641 17.939 -11.151 1.00 0.00 H new ATOM 0 HB3 ASN A 58 111.295 16.387 -11.636 1.00 0.00 H new ATOM 0 HD21 ASN A 58 110.525 18.536 -14.719 1.00 0.00 H new ATOM 0 HD22 ASN A 58 111.431 18.851 -13.236 1.00 0.00 H new ATOM 919 N LYS A 59 108.737 16.037 -8.631 1.00 0.00 N ATOM 920 CA LYS A 59 109.091 15.692 -7.253 1.00 0.00 C ATOM 921 C LYS A 59 107.868 15.300 -6.423 1.00 0.00 C ATOM 922 O LYS A 59 106.755 15.762 -6.678 1.00 0.00 O ATOM 923 CB LYS A 59 109.781 16.878 -6.572 1.00 0.00 C ATOM 924 CG LYS A 59 111.099 17.209 -7.279 1.00 0.00 C ATOM 925 CD LYS A 59 111.836 18.297 -6.495 1.00 0.00 C ATOM 926 CE LYS A 59 113.089 18.720 -7.263 1.00 0.00 C ATOM 927 NZ LYS A 59 112.706 19.634 -8.375 1.00 0.00 N ATOM 0 H LYS A 59 107.793 16.404 -8.752 1.00 0.00 H new ATOM 0 HA LYS A 59 109.763 14.835 -7.305 1.00 0.00 H new ATOM 0 HB2 LYS A 59 109.124 17.747 -6.589 1.00 0.00 H new ATOM 0 HB3 LYS A 59 109.972 16.643 -5.525 1.00 0.00 H new ATOM 0 HG2 LYS A 59 111.719 16.316 -7.354 1.00 0.00 H new ATOM 0 HG3 LYS A 59 110.904 17.547 -8.297 1.00 0.00 H new ATOM 0 HD2 LYS A 59 111.183 19.156 -6.343 1.00 0.00 H new ATOM 0 HD3 LYS A 59 112.110 17.926 -5.507 1.00 0.00 H new ATOM 0 HE2 LYS A 59 113.788 19.219 -6.592 1.00 0.00 H new ATOM 0 HE3 LYS A 59 113.599 17.842 -7.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 113.564 20.015 -8.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 112.151 19.109 -9.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 112.135 20.418 -7.999 1.00 0.00 H new ATOM 941 N GLN A 60 108.091 14.442 -5.428 1.00 0.00 N ATOM 942 CA GLN A 60 107.064 14.122 -4.436 1.00 0.00 C ATOM 943 C GLN A 60 107.696 13.720 -3.107 1.00 0.00 C ATOM 944 O GLN A 60 108.805 13.188 -3.074 1.00 0.00 O ATOM 945 CB GLN A 60 106.159 12.978 -4.900 1.00 0.00 C ATOM 946 CG GLN A 60 105.251 13.450 -6.034 1.00 0.00 C ATOM 947 CD GLN A 60 104.230 12.366 -6.367 1.00 0.00 C ATOM 948 OE1 GLN A 60 104.529 11.444 -7.126 1.00 0.00 O ATOM 949 NE2 GLN A 60 103.036 12.405 -5.830 1.00 0.00 N ATOM 0 H GLN A 60 108.976 13.955 -5.287 1.00 0.00 H new ATOM 0 HA GLN A 60 106.466 15.025 -4.311 1.00 0.00 H new ATOM 0 HB2 GLN A 60 106.766 12.138 -5.237 1.00 0.00 H new ATOM 0 HB3 GLN A 60 105.555 12.621 -4.066 1.00 0.00 H new ATOM 0 HG2 GLN A 60 104.739 14.367 -5.744 1.00 0.00 H new ATOM 0 HG3 GLN A 60 105.847 13.683 -6.916 1.00 0.00 H new ATOM 0 HE21 GLN A 60 102.785 13.167 -5.201 1.00 0.00 H new ATOM 0 HE22 GLN A 60 102.358 11.673 -6.041 1.00 0.00 H new ATOM 958 N ASP A 61 106.981 13.969 -2.016 1.00 0.00 N ATOM 959 CA ASP A 61 107.421 13.500 -0.706 1.00 0.00 C ATOM 960 C ASP A 61 106.782 12.147 -0.409 1.00 0.00 C ATOM 961 O ASP A 61 105.562 12.001 -0.496 1.00 0.00 O ATOM 962 CB ASP A 61 107.024 14.508 0.375 1.00 0.00 C ATOM 963 CG ASP A 61 107.717 15.848 0.140 1.00 0.00 C ATOM 964 OD1 ASP A 61 108.819 15.846 -0.388 1.00 0.00 O ATOM 965 OD2 ASP A 61 107.135 16.861 0.492 1.00 0.00 O ATOM 0 H ASP A 61 106.103 14.488 -2.011 1.00 0.00 H new ATOM 0 HA ASP A 61 108.506 13.397 -0.710 1.00 0.00 H new ATOM 0 HB2 ASP A 61 105.943 14.646 0.372 1.00 0.00 H new ATOM 0 HB3 ASP A 61 107.293 14.121 1.358 1.00 0.00 H new ATOM 970 N ILE A 62 107.600 11.156 -0.058 1.00 0.00 N ATOM 971 CA ILE A 62 107.095 9.801 0.164 1.00 0.00 C ATOM 972 C ILE A 62 107.549 9.276 1.530 1.00 0.00 C ATOM 973 O ILE A 62 108.656 9.581 1.971 1.00 0.00 O ATOM 974 CB ILE A 62 107.574 8.903 -0.989 1.00 0.00 C ATOM 975 CG1 ILE A 62 106.827 7.569 -0.945 1.00 0.00 C ATOM 976 CG2 ILE A 62 109.087 8.654 -0.921 1.00 0.00 C ATOM 977 CD1 ILE A 62 105.442 7.739 -1.580 1.00 0.00 C ATOM 0 H ILE A 62 108.605 11.263 0.078 1.00 0.00 H new ATOM 0 HA ILE A 62 106.005 9.801 0.175 1.00 0.00 H new ATOM 0 HB ILE A 62 107.362 9.416 -1.927 1.00 0.00 H new ATOM 0 HG12 ILE A 62 107.393 6.805 -1.479 1.00 0.00 H new ATOM 0 HG13 ILE A 62 106.727 7.229 0.086 1.00 0.00 H new ATOM 0 HG21 ILE A 62 109.388 8.016 -1.752 1.00 0.00 H new ATOM 0 HG22 ILE A 62 109.615 9.605 -0.984 1.00 0.00 H new ATOM 0 HG23 ILE A 62 109.333 8.164 0.021 1.00 0.00 H new ATOM 0 HD11 ILE A 62 104.909 6.789 -1.549 1.00 0.00 H new ATOM 0 HD12 ILE A 62 104.878 8.490 -1.027 1.00 0.00 H new ATOM 0 HD13 ILE A 62 105.554 8.059 -2.616 1.00 0.00 H new ATOM 989 N SER A 63 106.707 8.479 2.190 1.00 0.00 N ATOM 990 CA SER A 63 107.023 8.030 3.545 1.00 0.00 C ATOM 991 C SER A 63 106.418 6.663 3.861 1.00 0.00 C ATOM 992 O SER A 63 105.470 6.209 3.217 1.00 0.00 O ATOM 993 CB SER A 63 106.519 9.054 4.563 1.00 0.00 C ATOM 994 OG SER A 63 105.102 8.984 4.637 1.00 0.00 O ATOM 0 H SER A 63 105.821 8.138 1.818 1.00 0.00 H new ATOM 0 HA SER A 63 108.107 7.936 3.608 1.00 0.00 H new ATOM 0 HB2 SER A 63 106.956 8.856 5.542 1.00 0.00 H new ATOM 0 HB3 SER A 63 106.830 10.057 4.272 1.00 0.00 H new ATOM 0 HG SER A 63 104.732 8.873 3.736 1.00 0.00 H new ATOM 1000 N GLU A 64 106.972 6.023 4.887 1.00 0.00 N ATOM 1001 CA GLU A 64 106.503 4.712 5.315 1.00 0.00 C ATOM 1002 C GLU A 64 105.007 4.727 5.626 1.00 0.00 C ATOM 1003 O GLU A 64 104.307 3.753 5.356 1.00 0.00 O ATOM 1004 CB GLU A 64 107.285 4.264 6.554 1.00 0.00 C ATOM 1005 CG GLU A 64 107.069 5.255 7.705 1.00 0.00 C ATOM 1006 CD GLU A 64 107.922 4.905 8.929 1.00 0.00 C ATOM 1007 OE1 GLU A 64 108.572 3.870 8.930 1.00 0.00 O ATOM 1008 OE2 GLU A 64 107.905 5.688 9.865 1.00 0.00 O ATOM 0 H GLU A 64 107.747 6.393 5.437 1.00 0.00 H new ATOM 0 HA GLU A 64 106.670 4.010 4.498 1.00 0.00 H new ATOM 0 HB2 GLU A 64 106.961 3.268 6.857 1.00 0.00 H new ATOM 0 HB3 GLU A 64 108.347 4.196 6.318 1.00 0.00 H new ATOM 0 HG2 GLU A 64 107.314 6.262 7.368 1.00 0.00 H new ATOM 0 HG3 GLU A 64 106.016 5.261 7.986 1.00 0.00 H new ATOM 1015 N ALA A 65 104.513 5.838 6.165 1.00 0.00 N ATOM 1016 CA ALA A 65 103.114 5.917 6.569 1.00 0.00 C ATOM 1017 C ALA A 65 102.187 5.656 5.386 1.00 0.00 C ATOM 1018 O ALA A 65 101.196 4.936 5.514 1.00 0.00 O ATOM 1019 CB ALA A 65 102.814 7.302 7.149 1.00 0.00 C ATOM 0 H ALA A 65 105.054 6.687 6.331 1.00 0.00 H new ATOM 0 HA ALA A 65 102.939 5.153 7.327 1.00 0.00 H new ATOM 0 HB1 ALA A 65 101.767 7.352 7.448 1.00 0.00 H new ATOM 0 HB2 ALA A 65 103.448 7.478 8.018 1.00 0.00 H new ATOM 0 HB3 ALA A 65 103.013 8.063 6.395 1.00 0.00 H new ATOM 1025 N ASN A 66 102.510 6.241 4.237 1.00 0.00 N ATOM 1026 CA ASN A 66 101.641 6.127 3.068 1.00 0.00 C ATOM 1027 C ASN A 66 101.680 4.714 2.491 1.00 0.00 C ATOM 1028 O ASN A 66 100.641 4.127 2.191 1.00 0.00 O ATOM 1029 CB ASN A 66 102.071 7.113 1.975 1.00 0.00 C ATOM 1030 CG ASN A 66 102.243 8.523 2.534 1.00 0.00 C ATOM 1031 OD1 ASN A 66 103.359 8.937 2.845 1.00 0.00 O ATOM 1032 ND2 ASN A 66 101.200 9.293 2.668 1.00 0.00 N ATOM 0 H ASN A 66 103.355 6.792 4.089 1.00 0.00 H new ATOM 0 HA ASN A 66 100.627 6.357 3.395 1.00 0.00 H new ATOM 0 HB2 ASN A 66 103.008 6.779 1.530 1.00 0.00 H new ATOM 0 HB3 ASN A 66 101.326 7.124 1.179 1.00 0.00 H new ATOM 0 HD21 ASN A 66 101.308 10.240 3.031 1.00 0.00 H new ATOM 0 HD22 ASN A 66 100.275 8.949 2.410 1.00 0.00 H new ATOM 1039 N LEU A 67 102.886 4.175 2.338 1.00 0.00 N ATOM 1040 CA LEU A 67 103.056 2.864 1.713 1.00 0.00 C ATOM 1041 C LEU A 67 102.595 1.714 2.608 1.00 0.00 C ATOM 1042 O LEU A 67 102.216 0.656 2.104 1.00 0.00 O ATOM 1043 CB LEU A 67 104.519 2.656 1.312 1.00 0.00 C ATOM 1044 CG LEU A 67 104.797 3.396 0.000 1.00 0.00 C ATOM 1045 CD1 LEU A 67 104.917 4.895 0.279 1.00 0.00 C ATOM 1046 CD2 LEU A 67 106.093 2.879 -0.636 1.00 0.00 C ATOM 0 H LEU A 67 103.754 4.620 2.635 1.00 0.00 H new ATOM 0 HA LEU A 67 102.422 2.854 0.827 1.00 0.00 H new ATOM 0 HB2 LEU A 67 105.179 3.025 2.097 1.00 0.00 H new ATOM 0 HB3 LEU A 67 104.728 1.593 1.194 1.00 0.00 H new ATOM 0 HG LEU A 67 103.974 3.219 -0.692 1.00 0.00 H new ATOM 0 HD11 LEU A 67 105.115 5.424 -0.653 1.00 0.00 H new ATOM 0 HD12 LEU A 67 103.986 5.260 0.713 1.00 0.00 H new ATOM 0 HD13 LEU A 67 105.736 5.071 0.977 1.00 0.00 H new ATOM 0 HD21 LEU A 67 106.279 3.413 -1.568 1.00 0.00 H new ATOM 0 HD22 LEU A 67 106.925 3.043 0.049 1.00 0.00 H new ATOM 0 HD23 LEU A 67 105.997 1.813 -0.842 1.00 0.00 H new ATOM 1058 N ALA A 68 102.631 1.907 3.926 1.00 0.00 N ATOM 1059 CA ALA A 68 102.272 0.848 4.872 1.00 0.00 C ATOM 1060 C ALA A 68 103.357 -0.243 4.837 1.00 0.00 C ATOM 1061 O ALA A 68 104.523 0.085 4.626 1.00 0.00 O ATOM 1062 CB ALA A 68 100.861 0.313 4.560 1.00 0.00 C ATOM 0 H ALA A 68 102.905 2.786 4.364 1.00 0.00 H new ATOM 0 HA ALA A 68 102.232 1.237 5.889 1.00 0.00 H new ATOM 0 HB1 ALA A 68 100.605 -0.474 5.270 1.00 0.00 H new ATOM 0 HB2 ALA A 68 100.138 1.125 4.642 1.00 0.00 H new ATOM 0 HB3 ALA A 68 100.841 -0.091 3.548 1.00 0.00 H new ATOM 1068 N TYR A 69 103.009 -1.523 5.006 1.00 0.00 N ATOM 1069 CA TYR A 69 104.017 -2.585 5.047 1.00 0.00 C ATOM 1070 C TYR A 69 104.908 -2.590 3.798 1.00 0.00 C ATOM 1071 O TYR A 69 106.031 -3.094 3.836 1.00 0.00 O ATOM 1072 CB TYR A 69 103.328 -3.944 5.175 1.00 0.00 C ATOM 1073 CG TYR A 69 102.488 -4.079 6.424 1.00 0.00 C ATOM 1074 CD1 TYR A 69 103.094 -4.412 7.641 1.00 0.00 C ATOM 1075 CD2 TYR A 69 101.105 -3.873 6.363 1.00 0.00 C ATOM 1076 CE1 TYR A 69 102.315 -4.538 8.798 1.00 0.00 C ATOM 1077 CE2 TYR A 69 100.327 -3.999 7.519 1.00 0.00 C ATOM 1078 CZ TYR A 69 100.932 -4.331 8.737 1.00 0.00 C ATOM 1079 OH TYR A 69 100.165 -4.456 9.877 1.00 0.00 O ATOM 0 H TYR A 69 102.048 -1.846 5.115 1.00 0.00 H new ATOM 0 HA TYR A 69 104.653 -2.395 5.911 1.00 0.00 H new ATOM 0 HB2 TYR A 69 102.695 -4.105 4.302 1.00 0.00 H new ATOM 0 HB3 TYR A 69 104.085 -4.728 5.169 1.00 0.00 H new ATOM 0 HD1 TYR A 69 104.161 -4.572 7.688 1.00 0.00 H new ATOM 0 HD2 TYR A 69 100.638 -3.617 5.423 1.00 0.00 H new ATOM 0 HE1 TYR A 69 102.781 -4.795 9.738 1.00 0.00 H new ATOM 0 HE2 TYR A 69 99.260 -3.840 7.472 1.00 0.00 H new ATOM 0 HH TYR A 69 99.226 -4.279 9.660 1.00 0.00 H new ATOM 1089 N LEU A 70 104.411 -2.032 2.696 1.00 0.00 N ATOM 1090 CA LEU A 70 105.156 -2.017 1.436 1.00 0.00 C ATOM 1091 C LEU A 70 106.497 -1.284 1.557 1.00 0.00 C ATOM 1092 O LEU A 70 107.411 -1.535 0.773 1.00 0.00 O ATOM 1093 CB LEU A 70 104.311 -1.354 0.344 1.00 0.00 C ATOM 1094 CG LEU A 70 102.983 -2.098 0.184 1.00 0.00 C ATOM 1095 CD1 LEU A 70 102.104 -1.355 -0.824 1.00 0.00 C ATOM 1096 CD2 LEU A 70 103.244 -3.516 -0.330 1.00 0.00 C ATOM 0 H LEU A 70 103.496 -1.584 2.649 1.00 0.00 H new ATOM 0 HA LEU A 70 105.370 -3.053 1.175 1.00 0.00 H new ATOM 0 HB2 LEU A 70 104.124 -0.311 0.600 1.00 0.00 H new ATOM 0 HB3 LEU A 70 104.855 -1.357 -0.600 1.00 0.00 H new ATOM 0 HG LEU A 70 102.480 -2.147 1.150 1.00 0.00 H new ATOM 0 HD11 LEU A 70 101.157 -1.883 -0.940 1.00 0.00 H new ATOM 0 HD12 LEU A 70 101.914 -0.344 -0.465 1.00 0.00 H new ATOM 0 HD13 LEU A 70 102.614 -1.309 -1.786 1.00 0.00 H new ATOM 0 HD21 LEU A 70 102.296 -4.042 -0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 70 103.748 -3.466 -1.295 1.00 0.00 H new ATOM 0 HD23 LEU A 70 103.874 -4.051 0.381 1.00 0.00 H new ATOM 1108 N TRP A 71 106.620 -0.382 2.530 1.00 0.00 N ATOM 1109 CA TRP A 71 107.834 0.415 2.680 1.00 0.00 C ATOM 1110 C TRP A 71 109.062 -0.500 2.810 1.00 0.00 C ATOM 1111 O TRP A 71 109.197 -1.179 3.829 1.00 0.00 O ATOM 1112 CB TRP A 71 107.722 1.273 3.941 1.00 0.00 C ATOM 1113 CG TRP A 71 108.720 2.387 3.994 1.00 0.00 C ATOM 1114 CD1 TRP A 71 109.707 2.498 4.910 1.00 0.00 C ATOM 1115 CD2 TRP A 71 108.847 3.542 3.114 1.00 0.00 C ATOM 1116 NE1 TRP A 71 110.420 3.655 4.659 1.00 0.00 N ATOM 1117 CE2 TRP A 71 109.936 4.331 3.558 1.00 0.00 C ATOM 1118 CE3 TRP A 71 108.130 3.979 1.989 1.00 0.00 C ATOM 1119 CZ2 TRP A 71 110.299 5.513 2.904 1.00 0.00 C ATOM 1120 CZ3 TRP A 71 108.491 5.163 1.328 1.00 0.00 C ATOM 1121 CH2 TRP A 71 109.574 5.928 1.784 1.00 0.00 C ATOM 0 H TRP A 71 105.897 -0.186 3.222 1.00 0.00 H new ATOM 0 HA TRP A 71 107.949 1.048 1.800 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.718 1.692 3.998 1.00 0.00 H new ATOM 0 HB3 TRP A 71 107.852 0.637 4.817 1.00 0.00 H new ATOM 0 HD1 TRP A 71 109.906 1.797 5.708 1.00 0.00 H new ATOM 0 HE1 TRP A 71 111.210 3.972 5.221 1.00 0.00 H new ATOM 0 HE3 TRP A 71 107.293 3.399 1.629 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 111.132 6.100 3.262 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 107.931 5.487 0.463 1.00 0.00 H new ATOM 0 HH2 TRP A 71 109.848 6.837 1.270 1.00 0.00 H new ATOM 1132 N PRO A 72 109.956 -0.550 1.840 1.00 0.00 N ATOM 1133 CA PRO A 72 111.116 -1.490 1.885 1.00 0.00 C ATOM 1134 C PRO A 72 112.360 -0.914 2.567 1.00 0.00 C ATOM 1135 O PRO A 72 113.305 -1.652 2.845 1.00 0.00 O ATOM 1136 CB PRO A 72 111.392 -1.761 0.408 1.00 0.00 C ATOM 1137 CG PRO A 72 111.025 -0.495 -0.293 1.00 0.00 C ATOM 1138 CD PRO A 72 110.000 0.228 0.586 1.00 0.00 C ATOM 0 HA PRO A 72 110.884 -2.376 2.476 1.00 0.00 H new ATOM 0 HB2 PRO A 72 112.439 -2.014 0.242 1.00 0.00 H new ATOM 0 HB3 PRO A 72 110.799 -2.600 0.043 1.00 0.00 H new ATOM 0 HG2 PRO A 72 111.906 0.128 -0.449 1.00 0.00 H new ATOM 0 HG3 PRO A 72 110.607 -0.707 -1.277 1.00 0.00 H new ATOM 0 HD2 PRO A 72 110.298 1.260 0.772 1.00 0.00 H new ATOM 0 HD3 PRO A 72 109.022 0.260 0.107 1.00 0.00 H new ATOM 1146 N LEU A 73 112.386 0.396 2.795 1.00 0.00 N ATOM 1147 CA LEU A 73 113.571 1.038 3.358 1.00 0.00 C ATOM 1148 C LEU A 73 113.531 1.073 4.882 1.00 0.00 C ATOM 1149 O LEU A 73 112.468 1.214 5.488 1.00 0.00 O ATOM 1150 CB LEU A 73 113.690 2.473 2.842 1.00 0.00 C ATOM 1151 CG LEU A 73 113.742 2.481 1.316 1.00 0.00 C ATOM 1152 CD1 LEU A 73 113.751 3.933 0.838 1.00 0.00 C ATOM 1153 CD2 LEU A 73 115.016 1.778 0.837 1.00 0.00 C ATOM 0 H LEU A 73 111.610 1.028 2.601 1.00 0.00 H new ATOM 0 HA LEU A 73 114.432 0.447 3.045 1.00 0.00 H new ATOM 0 HB2 LEU A 73 112.841 3.063 3.187 1.00 0.00 H new ATOM 0 HB3 LEU A 73 114.588 2.939 3.246 1.00 0.00 H new ATOM 0 HG LEU A 73 112.875 1.957 0.913 1.00 0.00 H new ATOM 0 HD11 LEU A 73 113.788 3.957 -0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 73 112.846 4.435 1.182 1.00 0.00 H new ATOM 0 HD13 LEU A 73 114.625 4.444 1.242 1.00 0.00 H new ATOM 0 HD21 LEU A 73 115.048 1.786 -0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 73 115.889 2.299 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 73 115.018 0.747 1.192 1.00 0.00 H new ATOM 1165 N THR A 74 114.707 0.941 5.486 1.00 0.00 N ATOM 1166 CA THR A 74 114.847 1.078 6.932 1.00 0.00 C ATOM 1167 C THR A 74 114.642 2.532 7.355 1.00 0.00 C ATOM 1168 O THR A 74 114.055 2.794 8.405 1.00 0.00 O ATOM 1169 CB THR A 74 116.236 0.608 7.373 1.00 0.00 C ATOM 1170 OG1 THR A 74 117.225 1.433 6.775 1.00 0.00 O ATOM 1171 CG2 THR A 74 116.450 -0.845 6.942 1.00 0.00 C ATOM 0 H THR A 74 115.579 0.739 4.996 1.00 0.00 H new ATOM 0 HA THR A 74 114.087 0.460 7.410 1.00 0.00 H new ATOM 0 HB THR A 74 116.314 0.675 8.458 1.00 0.00 H new ATOM 0 HG1 THR A 74 117.314 1.202 5.827 1.00 0.00 H new ATOM 0 HG21 THR A 74 117.439 -1.176 7.257 1.00 0.00 H new ATOM 0 HG22 THR A 74 115.691 -1.477 7.404 1.00 0.00 H new ATOM 0 HG23 THR A 74 116.372 -0.918 5.857 1.00 0.00 H new ATOM 1179 N VAL A 75 115.122 3.474 6.539 1.00 0.00 N ATOM 1180 CA VAL A 75 114.871 4.885 6.813 1.00 0.00 C ATOM 1181 C VAL A 75 113.372 5.131 6.724 1.00 0.00 C ATOM 1182 O VAL A 75 112.734 4.727 5.756 1.00 0.00 O ATOM 1183 CB VAL A 75 115.624 5.794 5.833 1.00 0.00 C ATOM 1184 CG1 VAL A 75 117.126 5.689 6.099 1.00 0.00 C ATOM 1185 CG2 VAL A 75 115.344 5.384 4.382 1.00 0.00 C ATOM 0 H VAL A 75 115.674 3.289 5.702 1.00 0.00 H new ATOM 0 HA VAL A 75 115.235 5.125 7.812 1.00 0.00 H new ATOM 0 HB VAL A 75 115.283 6.819 5.980 1.00 0.00 H new ATOM 0 HG11 VAL A 75 117.664 6.334 5.404 1.00 0.00 H new ATOM 0 HG12 VAL A 75 117.337 6.001 7.122 1.00 0.00 H new ATOM 0 HG13 VAL A 75 117.449 4.657 5.961 1.00 0.00 H new ATOM 0 HG21 VAL A 75 115.889 6.043 3.706 1.00 0.00 H new ATOM 0 HG22 VAL A 75 115.668 4.355 4.226 1.00 0.00 H new ATOM 0 HG23 VAL A 75 114.275 5.462 4.182 1.00 0.00 H new ATOM 1195 N ASP A 76 112.809 5.768 7.741 1.00 0.00 N ATOM 1196 CA ASP A 76 111.357 5.839 7.863 1.00 0.00 C ATOM 1197 C ASP A 76 110.720 6.567 6.688 1.00 0.00 C ATOM 1198 O ASP A 76 109.602 6.235 6.292 1.00 0.00 O ATOM 1199 CB ASP A 76 110.970 6.527 9.175 1.00 0.00 C ATOM 1200 CG ASP A 76 111.424 5.695 10.372 1.00 0.00 C ATOM 1201 OD1 ASP A 76 111.472 4.481 10.251 1.00 0.00 O ATOM 1202 OD2 ASP A 76 111.710 6.285 11.401 1.00 0.00 O ATOM 0 H ASP A 76 113.325 6.238 8.485 1.00 0.00 H new ATOM 0 HA ASP A 76 110.980 4.816 7.862 1.00 0.00 H new ATOM 0 HB2 ASP A 76 111.424 7.517 9.220 1.00 0.00 H new ATOM 0 HB3 ASP A 76 109.890 6.669 9.213 1.00 0.00 H new ATOM 1207 N HIS A 77 111.407 7.569 6.148 1.00 0.00 N ATOM 1208 CA HIS A 77 110.864 8.310 5.017 1.00 0.00 C ATOM 1209 C HIS A 77 111.982 8.802 4.114 1.00 0.00 C ATOM 1210 O HIS A 77 113.160 8.586 4.397 1.00 0.00 O ATOM 1211 CB HIS A 77 110.019 9.486 5.510 1.00 0.00 C ATOM 1212 CG HIS A 77 110.743 10.405 6.455 1.00 0.00 C ATOM 1213 ND1 HIS A 77 111.262 9.966 7.661 1.00 0.00 N ATOM 1214 CD2 HIS A 77 111.026 11.748 6.391 1.00 0.00 C ATOM 1215 CE1 HIS A 77 111.825 11.024 8.271 1.00 0.00 C ATOM 1216 NE2 HIS A 77 111.709 12.136 7.540 1.00 0.00 N ATOM 0 H HIS A 77 112.324 7.882 6.468 1.00 0.00 H new ATOM 0 HA HIS A 77 110.227 7.641 4.439 1.00 0.00 H new ATOM 0 HB2 HIS A 77 109.678 10.061 4.649 1.00 0.00 H new ATOM 0 HB3 HIS A 77 109.129 9.098 6.006 1.00 0.00 H new ATOM 0 HD2 HIS A 77 110.759 12.402 5.574 1.00 0.00 H new ATOM 0 HE1 HIS A 77 112.311 10.980 9.234 1.00 0.00 H new ATOM 0 HE2 HIS A 77 112.048 13.069 7.774 1.00 0.00 H new ATOM 1224 N GLY A 78 111.597 9.402 2.997 1.00 0.00 N ATOM 1225 CA GLY A 78 112.554 9.991 2.076 1.00 0.00 C ATOM 1226 C GLY A 78 111.822 10.779 0.997 1.00 0.00 C ATOM 1227 O GLY A 78 110.618 10.619 0.797 1.00 0.00 O ATOM 0 H GLY A 78 110.623 9.493 2.707 1.00 0.00 H new ATOM 0 HA2 GLY A 78 113.236 10.647 2.617 1.00 0.00 H new ATOM 0 HA3 GLY A 78 113.160 9.209 1.619 1.00 0.00 H new ATOM 1231 N THR A 79 112.548 11.658 0.320 1.00 0.00 N ATOM 1232 CA THR A 79 111.963 12.454 -0.752 1.00 0.00 C ATOM 1233 C THR A 79 112.480 11.970 -2.102 1.00 0.00 C ATOM 1234 O THR A 79 113.661 11.667 -2.245 1.00 0.00 O ATOM 1235 CB THR A 79 112.322 13.927 -0.559 1.00 0.00 C ATOM 1236 OG1 THR A 79 112.208 14.261 0.817 1.00 0.00 O ATOM 1237 CG2 THR A 79 111.348 14.782 -1.370 1.00 0.00 C ATOM 0 H THR A 79 113.537 11.838 0.492 1.00 0.00 H new ATOM 0 HA THR A 79 110.879 12.343 -0.725 1.00 0.00 H new ATOM 0 HB THR A 79 113.343 14.109 -0.894 1.00 0.00 H new ATOM 0 HG1 THR A 79 112.439 15.205 0.945 1.00 0.00 H new ATOM 0 HG21 THR A 79 111.594 15.836 -1.240 1.00 0.00 H new ATOM 0 HG22 THR A 79 111.424 14.519 -2.425 1.00 0.00 H new ATOM 0 HG23 THR A 79 110.330 14.602 -1.024 1.00 0.00 H new ATOM 1245 N ILE A 80 111.596 11.896 -3.091 1.00 0.00 N ATOM 1246 CA ILE A 80 111.985 11.440 -4.425 1.00 0.00 C ATOM 1247 C ILE A 80 112.024 12.620 -5.384 1.00 0.00 C ATOM 1248 O ILE A 80 111.118 13.454 -5.387 1.00 0.00 O ATOM 1249 CB ILE A 80 111.002 10.377 -4.934 1.00 0.00 C ATOM 1250 CG1 ILE A 80 109.562 10.905 -4.877 1.00 0.00 C ATOM 1251 CG2 ILE A 80 111.125 9.129 -4.060 1.00 0.00 C ATOM 1252 CD1 ILE A 80 108.612 9.892 -5.519 1.00 0.00 C ATOM 0 H ILE A 80 110.611 12.144 -2.998 1.00 0.00 H new ATOM 0 HA ILE A 80 112.978 10.995 -4.369 1.00 0.00 H new ATOM 0 HB ILE A 80 111.241 10.135 -5.969 1.00 0.00 H new ATOM 0 HG12 ILE A 80 109.272 11.084 -3.842 1.00 0.00 H new ATOM 0 HG13 ILE A 80 109.495 11.861 -5.397 1.00 0.00 H new ATOM 0 HG21 ILE A 80 110.430 8.367 -4.414 1.00 0.00 H new ATOM 0 HG22 ILE A 80 112.144 8.745 -4.115 1.00 0.00 H new ATOM 0 HG23 ILE A 80 110.889 9.384 -3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 80 107.591 10.272 -5.476 1.00 0.00 H new ATOM 0 HD12 ILE A 80 108.897 9.735 -6.559 1.00 0.00 H new ATOM 0 HD13 ILE A 80 108.670 8.946 -4.980 1.00 0.00 H new ATOM 1264 N GLU A 81 113.086 12.701 -6.182 1.00 0.00 N ATOM 1265 CA GLU A 81 113.244 13.830 -7.090 1.00 0.00 C ATOM 1266 C GLU A 81 113.932 13.426 -8.389 1.00 0.00 C ATOM 1267 O GLU A 81 114.801 12.552 -8.411 1.00 0.00 O ATOM 1268 CB GLU A 81 114.061 14.933 -6.413 1.00 0.00 C ATOM 1269 CG GLU A 81 113.336 15.423 -5.154 1.00 0.00 C ATOM 1270 CD GLU A 81 114.068 16.598 -4.497 1.00 0.00 C ATOM 1271 OE1 GLU A 81 115.191 16.892 -4.880 1.00 0.00 O ATOM 1272 OE2 GLU A 81 113.484 17.196 -3.608 1.00 0.00 O ATOM 0 H GLU A 81 113.837 12.011 -6.218 1.00 0.00 H new ATOM 0 HA GLU A 81 112.245 14.193 -7.333 1.00 0.00 H new ATOM 0 HB2 GLU A 81 115.049 14.556 -6.150 1.00 0.00 H new ATOM 0 HB3 GLU A 81 114.210 15.763 -7.104 1.00 0.00 H new ATOM 0 HG2 GLU A 81 112.322 15.726 -5.413 1.00 0.00 H new ATOM 0 HG3 GLU A 81 113.251 14.603 -4.441 1.00 0.00 H new ATOM 1279 N CYS A 82 113.511 14.067 -9.473 1.00 0.00 N ATOM 1280 CA CYS A 82 114.210 13.952 -10.746 1.00 0.00 C ATOM 1281 C CYS A 82 115.044 15.209 -10.970 1.00 0.00 C ATOM 1282 O CYS A 82 114.506 16.313 -11.050 1.00 0.00 O ATOM 1283 CB CYS A 82 113.201 13.781 -11.885 1.00 0.00 C ATOM 1284 SG CYS A 82 112.497 12.114 -11.824 1.00 0.00 S ATOM 0 H CYS A 82 112.690 14.671 -9.495 1.00 0.00 H new ATOM 0 HA CYS A 82 114.863 13.079 -10.727 1.00 0.00 H new ATOM 0 HB2 CYS A 82 112.409 14.525 -11.798 1.00 0.00 H new ATOM 0 HB3 CYS A 82 113.689 13.946 -12.845 1.00 0.00 H new ATOM 1289 N LEU A 83 116.358 15.039 -11.069 1.00 0.00 N ATOM 1290 CA LEU A 83 117.261 16.182 -11.149 1.00 0.00 C ATOM 1291 C LEU A 83 117.340 16.728 -12.576 1.00 0.00 C ATOM 1292 O LEU A 83 117.085 15.992 -13.529 1.00 0.00 O ATOM 1293 CB LEU A 83 118.660 15.773 -10.682 1.00 0.00 C ATOM 1294 CG LEU A 83 118.665 15.613 -9.161 1.00 0.00 C ATOM 1295 CD1 LEU A 83 119.886 14.798 -8.735 1.00 0.00 C ATOM 1296 CD2 LEU A 83 118.723 16.995 -8.506 1.00 0.00 C ATOM 0 H LEU A 83 116.819 14.129 -11.096 1.00 0.00 H new ATOM 0 HA LEU A 83 116.869 16.966 -10.502 1.00 0.00 H new ATOM 0 HB2 LEU A 83 118.954 14.837 -11.157 1.00 0.00 H new ATOM 0 HB3 LEU A 83 119.389 16.526 -10.981 1.00 0.00 H new ATOM 0 HG LEU A 83 117.758 15.097 -8.848 1.00 0.00 H new ATOM 0 HD11 LEU A 83 119.888 14.685 -7.651 1.00 0.00 H new ATOM 0 HD12 LEU A 83 119.848 13.814 -9.202 1.00 0.00 H new ATOM 0 HD13 LEU A 83 120.794 15.313 -9.048 1.00 0.00 H new ATOM 0 HD21 LEU A 83 118.727 16.884 -7.422 1.00 0.00 H new ATOM 0 HD22 LEU A 83 119.631 17.509 -8.821 1.00 0.00 H new ATOM 0 HD23 LEU A 83 117.853 17.578 -8.808 1.00 0.00 H new ATOM 1308 N PRO A 84 117.701 17.983 -12.759 1.00 0.00 N ATOM 1309 CA PRO A 84 117.848 18.561 -14.135 1.00 0.00 C ATOM 1310 C PRO A 84 118.805 17.756 -15.025 1.00 0.00 C ATOM 1311 O PRO A 84 118.796 17.909 -16.246 1.00 0.00 O ATOM 1312 CB PRO A 84 118.371 19.987 -13.904 1.00 0.00 C ATOM 1313 CG PRO A 84 118.851 20.024 -12.493 1.00 0.00 C ATOM 1314 CD PRO A 84 118.022 18.994 -11.732 1.00 0.00 C ATOM 0 HA PRO A 84 116.899 18.541 -14.670 1.00 0.00 H new ATOM 0 HB2 PRO A 84 119.178 20.224 -14.597 1.00 0.00 H new ATOM 0 HB3 PRO A 84 117.584 20.723 -14.068 1.00 0.00 H new ATOM 0 HG2 PRO A 84 119.913 19.786 -12.437 1.00 0.00 H new ATOM 0 HG3 PRO A 84 118.724 21.018 -12.065 1.00 0.00 H new ATOM 0 HD2 PRO A 84 118.582 18.561 -10.904 1.00 0.00 H new ATOM 0 HD3 PRO A 84 117.120 19.437 -11.310 1.00 0.00 H new ATOM 1322 N SER A 85 119.625 16.901 -14.415 1.00 0.00 N ATOM 1323 CA SER A 85 120.574 16.077 -15.166 1.00 0.00 C ATOM 1324 C SER A 85 119.927 14.836 -15.801 1.00 0.00 C ATOM 1325 O SER A 85 120.635 14.014 -16.382 1.00 0.00 O ATOM 1326 CB SER A 85 121.706 15.632 -14.239 1.00 0.00 C ATOM 1327 OG SER A 85 122.441 16.772 -13.818 1.00 0.00 O ATOM 0 H SER A 85 119.652 16.760 -13.405 1.00 0.00 H new ATOM 0 HA SER A 85 120.953 16.695 -15.980 1.00 0.00 H new ATOM 0 HB2 SER A 85 121.299 15.107 -13.375 1.00 0.00 H new ATOM 0 HB3 SER A 85 122.362 14.932 -14.757 1.00 0.00 H new ATOM 0 HG SER A 85 123.167 16.492 -13.222 1.00 0.00 H new ATOM 1333 N ASP A 86 118.608 14.678 -15.663 1.00 0.00 N ATOM 1334 CA ASP A 86 117.901 13.519 -16.195 1.00 0.00 C ATOM 1335 C ASP A 86 118.382 12.246 -15.500 1.00 0.00 C ATOM 1336 O ASP A 86 118.708 11.250 -16.146 1.00 0.00 O ATOM 1337 CB ASP A 86 118.088 13.416 -17.715 1.00 0.00 C ATOM 1338 CG ASP A 86 117.573 14.679 -18.400 1.00 0.00 C ATOM 1339 OD1 ASP A 86 116.629 15.268 -17.895 1.00 0.00 O ATOM 1340 OD2 ASP A 86 118.131 15.040 -19.423 1.00 0.00 O ATOM 0 H ASP A 86 118.007 15.347 -15.182 1.00 0.00 H new ATOM 0 HA ASP A 86 116.836 13.641 -15.998 1.00 0.00 H new ATOM 0 HB2 ASP A 86 119.143 13.272 -17.949 1.00 0.00 H new ATOM 0 HB3 ASP A 86 117.555 12.545 -18.095 1.00 0.00 H new ATOM 1345 N ASN A 87 118.447 12.315 -14.172 1.00 0.00 N ATOM 1346 CA ASN A 87 118.790 11.160 -13.348 1.00 0.00 C ATOM 1347 C ASN A 87 117.779 11.027 -12.213 1.00 0.00 C ATOM 1348 O ASN A 87 117.405 12.025 -11.593 1.00 0.00 O ATOM 1349 CB ASN A 87 120.195 11.330 -12.763 1.00 0.00 C ATOM 1350 CG ASN A 87 121.209 11.587 -13.876 1.00 0.00 C ATOM 1351 OD1 ASN A 87 122.067 12.459 -13.743 1.00 0.00 O ATOM 1352 ND2 ASN A 87 121.162 10.879 -14.972 1.00 0.00 N ATOM 0 H ASN A 87 118.265 13.167 -13.641 1.00 0.00 H new ATOM 0 HA ASN A 87 118.768 10.262 -13.966 1.00 0.00 H new ATOM 0 HB2 ASN A 87 120.203 12.160 -12.056 1.00 0.00 H new ATOM 0 HB3 ASN A 87 120.475 10.435 -12.207 1.00 0.00 H new ATOM 0 HD21 ASN A 87 121.837 11.049 -15.718 1.00 0.00 H new ATOM 0 HD22 ASN A 87 120.451 10.156 -15.082 1.00 0.00 H new ATOM 1359 N ALA A 88 117.327 9.804 -11.951 1.00 0.00 N ATOM 1360 CA ALA A 88 116.352 9.577 -10.890 1.00 0.00 C ATOM 1361 C ALA A 88 117.051 9.174 -9.595 1.00 0.00 C ATOM 1362 O ALA A 88 117.727 8.142 -9.537 1.00 0.00 O ATOM 1363 CB ALA A 88 115.374 8.477 -11.307 1.00 0.00 C ATOM 0 H ALA A 88 117.616 8.964 -12.452 1.00 0.00 H new ATOM 0 HA ALA A 88 115.806 10.505 -10.720 1.00 0.00 H new ATOM 0 HB1 ALA A 88 114.649 8.313 -10.510 1.00 0.00 H new ATOM 0 HB2 ALA A 88 114.852 8.779 -12.215 1.00 0.00 H new ATOM 0 HB3 ALA A 88 115.923 7.554 -11.494 1.00 0.00 H new ATOM 1369 N VAL A 89 116.853 9.967 -8.542 1.00 0.00 N ATOM 1370 CA VAL A 89 117.526 9.715 -7.268 1.00 0.00 C ATOM 1371 C VAL A 89 116.553 9.774 -6.090 1.00 0.00 C ATOM 1372 O VAL A 89 115.506 10.422 -6.152 1.00 0.00 O ATOM 1373 CB VAL A 89 118.633 10.751 -7.048 1.00 0.00 C ATOM 1374 CG1 VAL A 89 119.682 10.630 -8.153 1.00 0.00 C ATOM 1375 CG2 VAL A 89 118.035 12.160 -7.076 1.00 0.00 C ATOM 0 H VAL A 89 116.239 10.781 -8.545 1.00 0.00 H new ATOM 0 HA VAL A 89 117.949 8.712 -7.317 1.00 0.00 H new ATOM 0 HB VAL A 89 119.100 10.570 -6.080 1.00 0.00 H new ATOM 0 HG11 VAL A 89 120.467 11.369 -7.992 1.00 0.00 H new ATOM 0 HG12 VAL A 89 120.116 9.630 -8.135 1.00 0.00 H new ATOM 0 HG13 VAL A 89 119.212 10.805 -9.121 1.00 0.00 H new ATOM 0 HG21 VAL A 89 118.825 12.894 -6.919 1.00 0.00 H new ATOM 0 HG22 VAL A 89 117.563 12.336 -8.043 1.00 0.00 H new ATOM 0 HG23 VAL A 89 117.290 12.255 -6.286 1.00 0.00 H new ATOM 1385 N PHE A 90 116.940 9.100 -5.012 1.00 0.00 N ATOM 1386 CA PHE A 90 116.178 9.084 -3.769 1.00 0.00 C ATOM 1387 C PHE A 90 116.972 9.780 -2.667 1.00 0.00 C ATOM 1388 O PHE A 90 118.132 9.454 -2.435 1.00 0.00 O ATOM 1389 CB PHE A 90 115.905 7.629 -3.377 1.00 0.00 C ATOM 1390 CG PHE A 90 115.233 7.442 -2.036 1.00 0.00 C ATOM 1391 CD1 PHE A 90 113.865 7.700 -1.891 1.00 0.00 C ATOM 1392 CD2 PHE A 90 115.980 6.991 -0.940 1.00 0.00 C ATOM 1393 CE1 PHE A 90 113.244 7.505 -0.651 1.00 0.00 C ATOM 1394 CE2 PHE A 90 115.359 6.798 0.300 1.00 0.00 C ATOM 1395 CZ PHE A 90 113.991 7.053 0.443 1.00 0.00 C ATOM 0 H PHE A 90 117.796 8.546 -4.976 1.00 0.00 H new ATOM 0 HA PHE A 90 115.234 9.611 -3.906 1.00 0.00 H new ATOM 0 HB2 PHE A 90 115.281 7.173 -4.146 1.00 0.00 H new ATOM 0 HB3 PHE A 90 116.851 7.087 -3.371 1.00 0.00 H new ATOM 0 HD1 PHE A 90 113.289 8.049 -2.735 1.00 0.00 H new ATOM 0 HD2 PHE A 90 117.036 6.792 -1.052 1.00 0.00 H new ATOM 0 HE1 PHE A 90 112.188 7.703 -0.539 1.00 0.00 H new ATOM 0 HE2 PHE A 90 115.936 6.453 1.145 1.00 0.00 H new ATOM 0 HZ PHE A 90 113.511 6.901 1.398 1.00 0.00 H new ATOM 1405 N VAL A 91 116.351 10.739 -1.993 1.00 0.00 N ATOM 1406 CA VAL A 91 117.024 11.485 -0.931 1.00 0.00 C ATOM 1407 C VAL A 91 116.472 11.054 0.422 1.00 0.00 C ATOM 1408 O VAL A 91 115.259 11.009 0.610 1.00 0.00 O ATOM 1409 CB VAL A 91 116.793 12.991 -1.124 1.00 0.00 C ATOM 1410 CG1 VAL A 91 117.531 13.807 -0.053 1.00 0.00 C ATOM 1411 CG2 VAL A 91 117.303 13.413 -2.505 1.00 0.00 C ATOM 0 H VAL A 91 115.385 11.020 -2.160 1.00 0.00 H new ATOM 0 HA VAL A 91 118.094 11.279 -0.971 1.00 0.00 H new ATOM 0 HB VAL A 91 115.724 13.184 -1.037 1.00 0.00 H new ATOM 0 HG11 VAL A 91 117.349 14.869 -0.215 1.00 0.00 H new ATOM 0 HG12 VAL A 91 117.168 13.523 0.935 1.00 0.00 H new ATOM 0 HG13 VAL A 91 118.601 13.608 -0.117 1.00 0.00 H new ATOM 0 HG21 VAL A 91 117.139 14.482 -2.642 1.00 0.00 H new ATOM 0 HG22 VAL A 91 118.369 13.196 -2.581 1.00 0.00 H new ATOM 0 HG23 VAL A 91 116.765 12.861 -3.276 1.00 0.00 H new ATOM 1421 N ALA A 92 117.361 10.761 1.365 1.00 0.00 N ATOM 1422 CA ALA A 92 116.925 10.358 2.703 1.00 0.00 C ATOM 1423 C ALA A 92 117.014 11.533 3.682 1.00 0.00 C ATOM 1424 O ALA A 92 117.799 12.452 3.458 1.00 0.00 O ATOM 1425 CB ALA A 92 117.792 9.205 3.208 1.00 0.00 C ATOM 0 H ALA A 92 118.372 10.793 1.235 1.00 0.00 H new ATOM 0 HA ALA A 92 115.886 10.034 2.641 1.00 0.00 H new ATOM 0 HB1 ALA A 92 117.462 8.911 4.204 1.00 0.00 H new ATOM 0 HB2 ALA A 92 117.700 8.357 2.530 1.00 0.00 H new ATOM 0 HB3 ALA A 92 118.833 9.524 3.251 1.00 0.00 H new ATOM 1431 N PRO A 93 116.245 11.536 4.752 1.00 0.00 N ATOM 1432 CA PRO A 93 116.293 12.651 5.750 1.00 0.00 C ATOM 1433 C PRO A 93 117.714 13.005 6.185 1.00 0.00 C ATOM 1434 O PRO A 93 117.986 14.142 6.571 1.00 0.00 O ATOM 1435 CB PRO A 93 115.489 12.132 6.944 1.00 0.00 C ATOM 1436 CG PRO A 93 114.575 11.089 6.401 1.00 0.00 C ATOM 1437 CD PRO A 93 115.226 10.536 5.133 1.00 0.00 C ATOM 0 HA PRO A 93 115.892 13.569 5.321 1.00 0.00 H new ATOM 0 HB2 PRO A 93 116.147 11.715 7.706 1.00 0.00 H new ATOM 0 HB3 PRO A 93 114.926 12.938 7.415 1.00 0.00 H new ATOM 0 HG2 PRO A 93 114.419 10.295 7.132 1.00 0.00 H new ATOM 0 HG3 PRO A 93 113.596 11.513 6.178 1.00 0.00 H new ATOM 0 HD2 PRO A 93 115.680 9.562 5.316 1.00 0.00 H new ATOM 0 HD3 PRO A 93 114.491 10.401 4.340 1.00 0.00 H new ATOM 1445 N ASP A 94 118.613 12.032 6.119 1.00 0.00 N ATOM 1446 CA ASP A 94 119.991 12.250 6.556 1.00 0.00 C ATOM 1447 C ASP A 94 120.734 13.287 5.699 1.00 0.00 C ATOM 1448 O ASP A 94 121.819 13.732 6.074 1.00 0.00 O ATOM 1449 CB ASP A 94 120.748 10.913 6.540 1.00 0.00 C ATOM 1450 CG ASP A 94 120.633 10.208 5.184 1.00 0.00 C ATOM 1451 OD1 ASP A 94 120.200 10.831 4.228 1.00 0.00 O ATOM 1452 OD2 ASP A 94 120.990 9.042 5.116 1.00 0.00 O ATOM 0 H ASP A 94 118.419 11.093 5.771 1.00 0.00 H new ATOM 0 HA ASP A 94 119.952 12.652 7.568 1.00 0.00 H new ATOM 0 HB2 ASP A 94 121.799 11.088 6.770 1.00 0.00 H new ATOM 0 HB3 ASP A 94 120.354 10.263 7.322 1.00 0.00 H new ATOM 1457 N GLY A 95 120.163 13.676 4.558 1.00 0.00 N ATOM 1458 CA GLY A 95 120.828 14.618 3.652 1.00 0.00 C ATOM 1459 C GLY A 95 121.722 13.921 2.614 1.00 0.00 C ATOM 1460 O GLY A 95 122.476 14.584 1.902 1.00 0.00 O ATOM 0 H GLY A 95 119.248 13.357 4.239 1.00 0.00 H new ATOM 0 HA2 GLY A 95 120.073 15.211 3.135 1.00 0.00 H new ATOM 0 HA3 GLY A 95 121.432 15.312 4.237 1.00 0.00 H new ATOM 1464 N THR A 96 121.639 12.594 2.526 1.00 0.00 N ATOM 1465 CA THR A 96 122.437 11.825 1.586 1.00 0.00 C ATOM 1466 C THR A 96 121.593 11.489 0.367 1.00 0.00 C ATOM 1467 O THR A 96 120.409 11.173 0.496 1.00 0.00 O ATOM 1468 CB THR A 96 122.898 10.527 2.252 1.00 0.00 C ATOM 1469 OG1 THR A 96 123.594 10.835 3.452 1.00 0.00 O ATOM 1470 CG2 THR A 96 123.820 9.751 1.308 1.00 0.00 C ATOM 0 H THR A 96 121.018 12.028 3.104 1.00 0.00 H new ATOM 0 HA THR A 96 123.306 12.409 1.283 1.00 0.00 H new ATOM 0 HB THR A 96 122.027 9.912 2.480 1.00 0.00 H new ATOM 0 HG1 THR A 96 123.889 10.005 3.881 1.00 0.00 H new ATOM 0 HG21 THR A 96 124.143 8.829 1.791 1.00 0.00 H new ATOM 0 HG22 THR A 96 123.283 9.511 0.390 1.00 0.00 H new ATOM 0 HG23 THR A 96 124.692 10.360 1.069 1.00 0.00 H new ATOM 1478 N THR A 97 122.199 11.559 -0.812 1.00 0.00 N ATOM 1479 CA THR A 97 121.490 11.214 -2.038 1.00 0.00 C ATOM 1480 C THR A 97 121.927 9.838 -2.526 1.00 0.00 C ATOM 1481 O THR A 97 123.118 9.555 -2.655 1.00 0.00 O ATOM 1482 CB THR A 97 121.776 12.260 -3.118 1.00 0.00 C ATOM 1483 OG1 THR A 97 121.462 13.552 -2.617 1.00 0.00 O ATOM 1484 CG2 THR A 97 120.922 11.969 -4.353 1.00 0.00 C ATOM 0 H THR A 97 123.168 11.848 -0.945 1.00 0.00 H new ATOM 0 HA THR A 97 120.420 11.195 -1.832 1.00 0.00 H new ATOM 0 HB THR A 97 122.830 12.221 -3.392 1.00 0.00 H new ATOM 0 HG1 THR A 97 121.646 14.224 -3.306 1.00 0.00 H new ATOM 0 HG21 THR A 97 121.127 12.715 -5.121 1.00 0.00 H new ATOM 0 HG22 THR A 97 121.163 10.978 -4.737 1.00 0.00 H new ATOM 0 HG23 THR A 97 119.867 12.007 -4.083 1.00 0.00 H new ATOM 1492 N TYR A 98 120.941 8.994 -2.796 1.00 0.00 N ATOM 1493 CA TYR A 98 121.185 7.650 -3.300 1.00 0.00 C ATOM 1494 C TYR A 98 120.623 7.539 -4.713 1.00 0.00 C ATOM 1495 O TYR A 98 119.664 8.226 -5.053 1.00 0.00 O ATOM 1496 CB TYR A 98 120.491 6.627 -2.396 1.00 0.00 C ATOM 1497 CG TYR A 98 120.926 6.679 -0.948 1.00 0.00 C ATOM 1498 CD1 TYR A 98 122.002 5.898 -0.508 1.00 0.00 C ATOM 1499 CD2 TYR A 98 120.245 7.501 -0.040 1.00 0.00 C ATOM 1500 CE1 TYR A 98 122.397 5.940 0.836 1.00 0.00 C ATOM 1501 CE2 TYR A 98 120.641 7.543 1.303 1.00 0.00 C ATOM 1502 CZ TYR A 98 121.716 6.763 1.742 1.00 0.00 C ATOM 1503 OH TYR A 98 122.107 6.802 3.067 1.00 0.00 O ATOM 0 H TYR A 98 119.954 9.220 -2.673 1.00 0.00 H new ATOM 0 HA TYR A 98 122.257 7.452 -3.311 1.00 0.00 H new ATOM 0 HB2 TYR A 98 119.414 6.787 -2.446 1.00 0.00 H new ATOM 0 HB3 TYR A 98 120.683 5.627 -2.785 1.00 0.00 H new ATOM 0 HD1 TYR A 98 122.528 5.263 -1.205 1.00 0.00 H new ATOM 0 HD2 TYR A 98 119.414 8.103 -0.376 1.00 0.00 H new ATOM 0 HE1 TYR A 98 123.227 5.337 1.173 1.00 0.00 H new ATOM 0 HE2 TYR A 98 120.116 8.178 2.000 1.00 0.00 H new ATOM 0 HH TYR A 98 121.649 7.540 3.522 1.00 0.00 H new ATOM 1513 N ALA A 99 121.207 6.670 -5.529 1.00 0.00 N ATOM 1514 CA ALA A 99 120.755 6.511 -6.907 1.00 0.00 C ATOM 1515 C ALA A 99 119.624 5.490 -6.982 1.00 0.00 C ATOM 1516 O ALA A 99 119.769 4.354 -6.531 1.00 0.00 O ATOM 1517 CB ALA A 99 121.919 6.051 -7.790 1.00 0.00 C ATOM 0 H ALA A 99 121.988 6.069 -5.265 1.00 0.00 H new ATOM 0 HA ALA A 99 120.388 7.473 -7.264 1.00 0.00 H new ATOM 0 HB1 ALA A 99 121.573 5.935 -8.817 1.00 0.00 H new ATOM 0 HB2 ALA A 99 122.716 6.794 -7.758 1.00 0.00 H new ATOM 0 HB3 ALA A 99 122.298 5.096 -7.425 1.00 0.00 H new ATOM 1523 N LEU A 100 118.497 5.903 -7.555 1.00 0.00 N ATOM 1524 CA LEU A 100 117.360 5.005 -7.709 1.00 0.00 C ATOM 1525 C LEU A 100 117.575 4.104 -8.913 1.00 0.00 C ATOM 1526 O LEU A 100 117.388 2.890 -8.841 1.00 0.00 O ATOM 1527 CB LEU A 100 116.071 5.802 -7.916 1.00 0.00 C ATOM 1528 CG LEU A 100 115.524 6.270 -6.570 1.00 0.00 C ATOM 1529 CD1 LEU A 100 114.578 7.449 -6.801 1.00 0.00 C ATOM 1530 CD2 LEU A 100 114.750 5.123 -5.918 1.00 0.00 C ATOM 0 H LEU A 100 118.348 6.845 -7.917 1.00 0.00 H new ATOM 0 HA LEU A 100 117.273 4.405 -6.803 1.00 0.00 H new ATOM 0 HB2 LEU A 100 116.264 6.662 -8.558 1.00 0.00 H new ATOM 0 HB3 LEU A 100 115.330 5.185 -8.424 1.00 0.00 H new ATOM 0 HG LEU A 100 116.344 6.576 -5.921 1.00 0.00 H new ATOM 0 HD11 LEU A 100 114.182 7.790 -5.845 1.00 0.00 H new ATOM 0 HD12 LEU A 100 115.122 8.263 -7.280 1.00 0.00 H new ATOM 0 HD13 LEU A 100 113.755 7.135 -7.443 1.00 0.00 H new ATOM 0 HD21 LEU A 100 114.356 5.450 -4.956 1.00 0.00 H new ATOM 0 HD22 LEU A 100 113.925 4.826 -6.566 1.00 0.00 H new ATOM 0 HD23 LEU A 100 115.416 4.274 -5.767 1.00 0.00 H new ATOM 1542 N ASN A 101 117.971 4.718 -10.024 1.00 0.00 N ATOM 1543 CA ASN A 101 118.199 3.971 -11.263 1.00 0.00 C ATOM 1544 C ASN A 101 119.667 4.022 -11.679 1.00 0.00 C ATOM 1545 O ASN A 101 120.458 4.805 -11.153 1.00 0.00 O ATOM 1546 CB ASN A 101 117.304 4.518 -12.382 1.00 0.00 C ATOM 1547 CG ASN A 101 117.691 5.945 -12.763 1.00 0.00 C ATOM 1548 OD1 ASN A 101 118.653 6.501 -12.237 1.00 0.00 O ATOM 1549 ND2 ASN A 101 116.985 6.578 -13.660 1.00 0.00 N ATOM 0 H ASN A 101 118.140 5.721 -10.095 1.00 0.00 H new ATOM 0 HA ASN A 101 117.941 2.928 -11.082 1.00 0.00 H new ATOM 0 HB2 ASN A 101 117.380 3.873 -13.258 1.00 0.00 H new ATOM 0 HB3 ASN A 101 116.263 4.496 -12.060 1.00 0.00 H new ATOM 0 HD21 ASN A 101 117.232 7.532 -13.923 1.00 0.00 H new ATOM 0 HD22 ASN A 101 116.186 6.119 -14.098 1.00 0.00 H new ATOM 1556 N ASP A 102 120.026 3.174 -12.637 1.00 0.00 N ATOM 1557 CA ASP A 102 121.418 3.053 -13.059 1.00 0.00 C ATOM 1558 C ASP A 102 122.010 4.406 -13.449 1.00 0.00 C ATOM 1559 O ASP A 102 123.192 4.658 -13.225 1.00 0.00 O ATOM 1560 CB ASP A 102 121.521 2.082 -14.240 1.00 0.00 C ATOM 1561 CG ASP A 102 120.770 2.622 -15.456 1.00 0.00 C ATOM 1562 OD1 ASP A 102 119.807 3.350 -15.269 1.00 0.00 O ATOM 1563 OD2 ASP A 102 121.170 2.299 -16.562 1.00 0.00 O ATOM 0 H ASP A 102 119.377 2.563 -13.134 1.00 0.00 H new ATOM 0 HA ASP A 102 121.990 2.669 -12.214 1.00 0.00 H new ATOM 0 HB2 ASP A 102 122.569 1.923 -14.495 1.00 0.00 H new ATOM 0 HB3 ASP A 102 121.112 1.112 -13.956 1.00 0.00 H new ATOM 1568 N ARG A 103 121.189 5.280 -14.018 1.00 0.00 N ATOM 1569 CA ARG A 103 121.667 6.575 -14.484 1.00 0.00 C ATOM 1570 C ARG A 103 122.230 7.391 -13.322 1.00 0.00 C ATOM 1571 O ARG A 103 123.349 7.901 -13.381 1.00 0.00 O ATOM 1572 CB ARG A 103 120.499 7.314 -15.136 1.00 0.00 C ATOM 1573 CG ARG A 103 120.052 6.538 -16.378 1.00 0.00 C ATOM 1574 CD ARG A 103 118.775 7.161 -16.940 1.00 0.00 C ATOM 1575 NE ARG A 103 119.043 8.515 -17.423 1.00 0.00 N ATOM 1576 CZ ARG A 103 119.522 8.791 -18.640 1.00 0.00 C ATOM 1577 NH1 ARG A 103 119.787 7.859 -19.522 1.00 0.00 N ATOM 1578 NH2 ARG A 103 119.725 10.042 -18.945 1.00 0.00 N ATOM 0 H ARG A 103 120.193 5.117 -14.167 1.00 0.00 H new ATOM 0 HA ARG A 103 122.469 6.432 -15.208 1.00 0.00 H new ATOM 0 HB2 ARG A 103 119.672 7.407 -14.432 1.00 0.00 H new ATOM 0 HB3 ARG A 103 120.799 8.325 -15.411 1.00 0.00 H new ATOM 0 HG2 ARG A 103 120.839 6.554 -17.132 1.00 0.00 H new ATOM 0 HG3 ARG A 103 119.877 5.493 -16.123 1.00 0.00 H new ATOM 0 HD2 ARG A 103 118.390 6.547 -17.754 1.00 0.00 H new ATOM 0 HD3 ARG A 103 118.005 7.188 -16.169 1.00 0.00 H new ATOM 0 HE ARG A 103 118.853 9.295 -16.794 1.00 0.00 H new ATOM 0 HH11 ARG A 103 119.629 6.878 -19.291 1.00 0.00 H new ATOM 0 HH12 ARG A 103 120.152 8.114 -20.440 1.00 0.00 H new ATOM 0 HH21 ARG A 103 119.519 10.773 -18.264 1.00 0.00 H new ATOM 0 HH22 ARG A 103 120.090 10.290 -19.865 1.00 0.00 H new ATOM 1592 N ALA A 104 121.464 7.470 -12.241 1.00 0.00 N ATOM 1593 CA ALA A 104 121.917 8.173 -11.044 1.00 0.00 C ATOM 1594 C ALA A 104 123.213 7.566 -10.507 1.00 0.00 C ATOM 1595 O ALA A 104 124.082 8.278 -9.999 1.00 0.00 O ATOM 1596 CB ALA A 104 120.838 8.103 -9.963 1.00 0.00 C ATOM 0 H ALA A 104 120.533 7.060 -12.167 1.00 0.00 H new ATOM 0 HA ALA A 104 122.106 9.212 -11.312 1.00 0.00 H new ATOM 0 HB1 ALA A 104 121.181 8.629 -9.072 1.00 0.00 H new ATOM 0 HB2 ALA A 104 119.924 8.569 -10.331 1.00 0.00 H new ATOM 0 HB3 ALA A 104 120.639 7.061 -9.715 1.00 0.00 H new ATOM 1602 N GLU A 105 123.327 6.243 -10.590 1.00 0.00 N ATOM 1603 CA GLU A 105 124.540 5.568 -10.145 1.00 0.00 C ATOM 1604 C GLU A 105 125.736 6.046 -10.967 1.00 0.00 C ATOM 1605 O GLU A 105 126.804 6.328 -10.427 1.00 0.00 O ATOM 1606 CB GLU A 105 124.379 4.054 -10.290 1.00 0.00 C ATOM 1607 CG GLU A 105 125.507 3.353 -9.528 1.00 0.00 C ATOM 1608 CD GLU A 105 125.466 1.832 -9.713 1.00 0.00 C ATOM 1609 OE1 GLU A 105 124.608 1.338 -10.432 1.00 0.00 O ATOM 1610 OE2 GLU A 105 126.307 1.173 -9.124 1.00 0.00 O ATOM 0 H GLU A 105 122.603 5.625 -10.957 1.00 0.00 H new ATOM 0 HA GLU A 105 124.713 5.807 -9.096 1.00 0.00 H new ATOM 0 HB2 GLU A 105 123.411 3.740 -9.900 1.00 0.00 H new ATOM 0 HB3 GLU A 105 124.405 3.773 -11.343 1.00 0.00 H new ATOM 0 HG2 GLU A 105 126.468 3.734 -9.872 1.00 0.00 H new ATOM 0 HG3 GLU A 105 125.431 3.591 -8.467 1.00 0.00 H new ATOM 1617 N LYS A 106 125.537 6.182 -12.274 1.00 0.00 N ATOM 1618 CA LYS A 106 126.575 6.717 -13.156 1.00 0.00 C ATOM 1619 C LYS A 106 127.012 8.116 -12.712 1.00 0.00 C ATOM 1620 O LYS A 106 128.178 8.485 -12.852 1.00 0.00 O ATOM 1621 CB LYS A 106 126.052 6.776 -14.593 1.00 0.00 C ATOM 1622 CG LYS A 106 127.182 7.190 -15.537 1.00 0.00 C ATOM 1623 CD LYS A 106 126.635 7.331 -16.960 1.00 0.00 C ATOM 1624 CE LYS A 106 127.790 7.594 -17.928 1.00 0.00 C ATOM 1625 NZ LYS A 106 127.378 7.212 -19.308 1.00 0.00 N ATOM 0 H LYS A 106 124.669 5.931 -12.748 1.00 0.00 H new ATOM 0 HA LYS A 106 127.439 6.055 -13.104 1.00 0.00 H new ATOM 0 HB2 LYS A 106 125.658 5.803 -14.887 1.00 0.00 H new ATOM 0 HB3 LYS A 106 125.229 7.487 -14.662 1.00 0.00 H new ATOM 0 HG2 LYS A 106 127.617 8.134 -15.208 1.00 0.00 H new ATOM 0 HG3 LYS A 106 127.979 6.447 -15.515 1.00 0.00 H new ATOM 0 HD2 LYS A 106 126.104 6.424 -17.248 1.00 0.00 H new ATOM 0 HD3 LYS A 106 125.916 8.149 -17.005 1.00 0.00 H new ATOM 0 HE2 LYS A 106 128.070 8.647 -17.899 1.00 0.00 H new ATOM 0 HE3 LYS A 106 128.668 7.022 -17.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 128.163 7.391 -19.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 127.131 6.202 -19.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 126.552 7.776 -19.593 1.00 0.00 H new ATOM 1639 N ALA A 107 126.069 8.890 -12.178 1.00 0.00 N ATOM 1640 CA ALA A 107 126.352 10.240 -11.688 1.00 0.00 C ATOM 1641 C ALA A 107 127.063 10.250 -10.326 1.00 0.00 C ATOM 1642 O ALA A 107 127.210 11.310 -9.715 1.00 0.00 O ATOM 1643 CB ALA A 107 125.046 11.028 -11.577 1.00 0.00 C ATOM 0 H ALA A 107 125.096 8.604 -12.073 1.00 0.00 H new ATOM 0 HA ALA A 107 127.027 10.702 -12.409 1.00 0.00 H new ATOM 0 HB1 ALA A 107 125.257 12.033 -11.212 1.00 0.00 H new ATOM 0 HB2 ALA A 107 124.574 11.090 -12.557 1.00 0.00 H new ATOM 0 HB3 ALA A 107 124.375 10.524 -10.882 1.00 0.00 H new ATOM 1649 N GLY A 108 127.502 9.088 -9.846 1.00 0.00 N ATOM 1650 CA GLY A 108 128.270 9.012 -8.607 1.00 0.00 C ATOM 1651 C GLY A 108 127.404 9.100 -7.351 1.00 0.00 C ATOM 1652 O GLY A 108 127.894 9.481 -6.287 1.00 0.00 O ATOM 0 H GLY A 108 127.339 8.188 -10.296 1.00 0.00 H new ATOM 0 HA2 GLY A 108 128.827 8.075 -8.590 1.00 0.00 H new ATOM 0 HA3 GLY A 108 129.002 9.819 -8.592 1.00 0.00 H new ATOM 1656 N HIS A 109 126.123 8.754 -7.467 1.00 0.00 N ATOM 1657 CA HIS A 109 125.273 8.635 -6.288 1.00 0.00 C ATOM 1658 C HIS A 109 125.203 7.162 -5.857 1.00 0.00 C ATOM 1659 O HIS A 109 124.619 6.361 -6.590 1.00 0.00 O ATOM 1660 CB HIS A 109 123.863 9.122 -6.628 1.00 0.00 C ATOM 1661 CG HIS A 109 123.763 10.617 -6.765 1.00 0.00 C ATOM 1662 ND1 HIS A 109 123.971 11.473 -5.695 1.00 0.00 N ATOM 1663 CD2 HIS A 109 123.479 11.423 -7.840 1.00 0.00 C ATOM 1664 CE1 HIS A 109 123.811 12.730 -6.145 1.00 0.00 C ATOM 1665 NE2 HIS A 109 123.509 12.757 -7.446 1.00 0.00 N ATOM 0 H HIS A 109 125.658 8.554 -8.352 1.00 0.00 H new ATOM 0 HA HIS A 109 125.687 9.237 -5.479 1.00 0.00 H new ATOM 0 HB2 HIS A 109 123.541 8.657 -7.560 1.00 0.00 H new ATOM 0 HB3 HIS A 109 123.175 8.789 -5.851 1.00 0.00 H new ATOM 0 HD2 HIS A 109 123.265 11.074 -8.839 1.00 0.00 H new ATOM 0 HE1 HIS A 109 123.914 13.611 -5.529 1.00 0.00 H new ATOM 0 HE2 HIS A 109 123.337 13.579 -8.026 1.00 0.00 H new ATOM 1673 N PRO A 110 125.757 6.768 -4.722 1.00 0.00 N ATOM 1674 CA PRO A 110 125.716 5.331 -4.300 1.00 0.00 C ATOM 1675 C PRO A 110 124.283 4.794 -4.268 1.00 0.00 C ATOM 1676 O PRO A 110 123.357 5.569 -4.037 1.00 0.00 O ATOM 1677 CB PRO A 110 126.330 5.321 -2.898 1.00 0.00 C ATOM 1678 CG PRO A 110 127.164 6.553 -2.823 1.00 0.00 C ATOM 1679 CD PRO A 110 126.489 7.580 -3.730 1.00 0.00 C ATOM 0 HA PRO A 110 126.256 4.691 -4.997 1.00 0.00 H new ATOM 0 HB2 PRO A 110 125.556 5.323 -2.130 1.00 0.00 H new ATOM 0 HB3 PRO A 110 126.934 4.427 -2.740 1.00 0.00 H new ATOM 0 HG2 PRO A 110 127.226 6.920 -1.798 1.00 0.00 H new ATOM 0 HG3 PRO A 110 128.184 6.353 -3.152 1.00 0.00 H new ATOM 0 HD2 PRO A 110 125.813 8.224 -3.167 1.00 0.00 H new ATOM 0 HD3 PRO A 110 127.222 8.229 -4.210 1.00 0.00 H new ATOM 1687 N PRO A 111 124.066 3.516 -4.502 1.00 0.00 N ATOM 1688 CA PRO A 111 122.678 2.956 -4.530 1.00 0.00 C ATOM 1689 C PRO A 111 122.021 2.961 -3.152 1.00 0.00 C ATOM 1690 O PRO A 111 122.704 3.016 -2.129 1.00 0.00 O ATOM 1691 CB PRO A 111 122.851 1.528 -5.056 1.00 0.00 C ATOM 1692 CG PRO A 111 124.265 1.160 -4.766 1.00 0.00 C ATOM 1693 CD PRO A 111 125.067 2.460 -4.753 1.00 0.00 C ATOM 0 HA PRO A 111 122.018 3.557 -5.156 1.00 0.00 H new ATOM 0 HB2 PRO A 111 122.160 0.843 -4.565 1.00 0.00 H new ATOM 0 HB3 PRO A 111 122.644 1.477 -6.125 1.00 0.00 H new ATOM 0 HG2 PRO A 111 124.342 0.649 -3.806 1.00 0.00 H new ATOM 0 HG3 PRO A 111 124.649 0.476 -5.523 1.00 0.00 H new ATOM 0 HD2 PRO A 111 125.831 2.446 -3.976 1.00 0.00 H new ATOM 0 HD3 PRO A 111 125.580 2.618 -5.702 1.00 0.00 H new ATOM 1701 N ILE A 112 120.690 2.904 -3.132 1.00 0.00 N ATOM 1702 CA ILE A 112 119.949 2.892 -1.868 1.00 0.00 C ATOM 1703 C ILE A 112 120.291 1.667 -1.002 1.00 0.00 C ATOM 1704 O ILE A 112 119.943 1.650 0.177 1.00 0.00 O ATOM 1705 CB ILE A 112 118.433 2.942 -2.140 1.00 0.00 C ATOM 1706 CG1 ILE A 112 118.112 4.196 -2.959 1.00 0.00 C ATOM 1707 CG2 ILE A 112 117.658 3.003 -0.813 1.00 0.00 C ATOM 1708 CD1 ILE A 112 116.653 4.170 -3.428 1.00 0.00 C ATOM 0 H ILE A 112 120.106 2.866 -3.967 1.00 0.00 H new ATOM 0 HA ILE A 112 120.249 3.778 -1.309 1.00 0.00 H new ATOM 0 HB ILE A 112 118.140 2.046 -2.687 1.00 0.00 H new ATOM 0 HG12 ILE A 112 118.291 5.087 -2.357 1.00 0.00 H new ATOM 0 HG13 ILE A 112 118.777 4.255 -3.821 1.00 0.00 H new ATOM 0 HG21 ILE A 112 116.588 3.038 -1.018 1.00 0.00 H new ATOM 0 HG22 ILE A 112 117.885 2.118 -0.218 1.00 0.00 H new ATOM 0 HG23 ILE A 112 117.951 3.896 -0.261 1.00 0.00 H new ATOM 0 HD11 ILE A 112 116.441 5.068 -4.008 1.00 0.00 H new ATOM 0 HD12 ILE A 112 116.486 3.289 -4.048 1.00 0.00 H new ATOM 0 HD13 ILE A 112 115.993 4.134 -2.561 1.00 0.00 H new ATOM 1720 N THR A 113 121.006 0.677 -1.545 1.00 0.00 N ATOM 1721 CA THR A 113 121.238 -0.583 -0.837 1.00 0.00 C ATOM 1722 C THR A 113 121.621 -0.447 0.649 1.00 0.00 C ATOM 1723 O THR A 113 121.107 -1.246 1.436 1.00 0.00 O ATOM 1724 CB THR A 113 122.231 -1.478 -1.601 1.00 0.00 C ATOM 1725 OG1 THR A 113 122.078 -2.817 -1.154 1.00 0.00 O ATOM 1726 CG2 THR A 113 123.689 -1.054 -1.398 1.00 0.00 C ATOM 0 H THR A 113 121.433 0.725 -2.470 1.00 0.00 H new ATOM 0 HA THR A 113 120.263 -1.071 -0.817 1.00 0.00 H new ATOM 0 HB THR A 113 122.007 -1.382 -2.663 1.00 0.00 H new ATOM 0 HG1 THR A 113 122.705 -3.396 -1.635 1.00 0.00 H new ATOM 0 HG21 THR A 113 124.343 -1.720 -1.960 1.00 0.00 H new ATOM 0 HG22 THR A 113 123.823 -0.031 -1.751 1.00 0.00 H new ATOM 0 HG23 THR A 113 123.939 -1.108 -0.339 1.00 0.00 H new ATOM 1734 N PRO A 114 122.428 0.507 1.095 1.00 0.00 N ATOM 1735 CA PRO A 114 122.848 0.545 2.535 1.00 0.00 C ATOM 1736 C PRO A 114 121.653 0.650 3.483 1.00 0.00 C ATOM 1737 O PRO A 114 121.679 0.108 4.588 1.00 0.00 O ATOM 1738 CB PRO A 114 123.758 1.771 2.655 1.00 0.00 C ATOM 1739 CG PRO A 114 124.171 2.089 1.260 1.00 0.00 C ATOM 1740 CD PRO A 114 122.995 1.673 0.384 1.00 0.00 C ATOM 0 HA PRO A 114 123.358 -0.375 2.820 1.00 0.00 H new ATOM 0 HB2 PRO A 114 123.231 2.609 3.110 1.00 0.00 H new ATOM 0 HB3 PRO A 114 124.623 1.559 3.283 1.00 0.00 H new ATOM 0 HG2 PRO A 114 124.388 3.151 1.147 1.00 0.00 H new ATOM 0 HG3 PRO A 114 125.076 1.548 0.985 1.00 0.00 H new ATOM 0 HD2 PRO A 114 122.265 2.476 0.285 1.00 0.00 H new ATOM 0 HD3 PRO A 114 123.318 1.410 -0.623 1.00 0.00 H new ATOM 1748 N ILE A 115 120.607 1.349 3.047 1.00 0.00 N ATOM 1749 CA ILE A 115 119.393 1.502 3.856 1.00 0.00 C ATOM 1750 C ILE A 115 118.274 0.532 3.456 1.00 0.00 C ATOM 1751 O ILE A 115 117.165 0.643 3.972 1.00 0.00 O ATOM 1752 CB ILE A 115 118.851 2.939 3.786 1.00 0.00 C ATOM 1753 CG1 ILE A 115 118.753 3.419 2.329 1.00 0.00 C ATOM 1754 CG2 ILE A 115 119.762 3.871 4.589 1.00 0.00 C ATOM 1755 CD1 ILE A 115 117.948 4.721 2.253 1.00 0.00 C ATOM 0 H ILE A 115 120.572 1.818 2.142 1.00 0.00 H new ATOM 0 HA ILE A 115 119.696 1.266 4.876 1.00 0.00 H new ATOM 0 HB ILE A 115 117.849 2.954 4.214 1.00 0.00 H new ATOM 0 HG12 ILE A 115 119.752 3.576 1.922 1.00 0.00 H new ATOM 0 HG13 ILE A 115 118.277 2.653 1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 115 119.376 4.889 4.538 1.00 0.00 H new ATOM 0 HG22 ILE A 115 119.790 3.545 5.629 1.00 0.00 H new ATOM 0 HG23 ILE A 115 120.769 3.843 4.172 1.00 0.00 H new ATOM 0 HD11 ILE A 115 117.886 5.050 1.216 1.00 0.00 H new ATOM 0 HD12 ILE A 115 116.943 4.551 2.640 1.00 0.00 H new ATOM 0 HD13 ILE A 115 118.441 5.489 2.849 1.00 0.00 H new ATOM 1767 N ARG A 116 118.542 -0.410 2.552 1.00 0.00 N ATOM 1768 CA ARG A 116 117.512 -1.339 2.098 1.00 0.00 C ATOM 1769 C ARG A 116 117.269 -2.429 3.138 1.00 0.00 C ATOM 1770 O ARG A 116 118.204 -2.913 3.776 1.00 0.00 O ATOM 1771 CB ARG A 116 117.940 -1.981 0.777 1.00 0.00 C ATOM 1772 CG ARG A 116 116.786 -2.809 0.210 1.00 0.00 C ATOM 1773 CD ARG A 116 117.253 -3.541 -1.049 1.00 0.00 C ATOM 1774 NE ARG A 116 117.686 -2.578 -2.066 1.00 0.00 N ATOM 1775 CZ ARG A 116 117.951 -2.915 -3.338 1.00 0.00 C ATOM 1776 NH1 ARG A 116 117.836 -4.146 -3.775 1.00 0.00 N ATOM 1777 NH2 ARG A 116 118.337 -1.985 -4.169 1.00 0.00 N ATOM 0 H ARG A 116 119.457 -0.548 2.123 1.00 0.00 H new ATOM 0 HA ARG A 116 116.586 -0.782 1.953 1.00 0.00 H new ATOM 0 HB2 ARG A 116 118.232 -1.210 0.064 1.00 0.00 H new ATOM 0 HB3 ARG A 116 118.812 -2.615 0.935 1.00 0.00 H new ATOM 0 HG2 ARG A 116 116.440 -3.527 0.954 1.00 0.00 H new ATOM 0 HG3 ARG A 116 115.941 -2.162 -0.025 1.00 0.00 H new ATOM 0 HD2 ARG A 116 118.074 -4.214 -0.803 1.00 0.00 H new ATOM 0 HD3 ARG A 116 116.443 -4.156 -1.442 1.00 0.00 H new ATOM 0 HE ARG A 116 117.791 -1.601 -1.793 1.00 0.00 H new ATOM 0 HH11 ARG A 116 117.536 -4.886 -3.141 1.00 0.00 H new ATOM 0 HH12 ARG A 116 118.046 -4.363 -4.749 1.00 0.00 H new ATOM 0 HH21 ARG A 116 118.433 -1.022 -3.848 1.00 0.00 H new ATOM 0 HH22 ARG A 116 118.543 -2.222 -5.140 1.00 0.00 H new ATOM 1791 N ALA A 117 116.007 -2.809 3.303 1.00 0.00 N ATOM 1792 CA ALA A 117 115.635 -3.832 4.273 1.00 0.00 C ATOM 1793 C ALA A 117 115.952 -5.231 3.756 1.00 0.00 C ATOM 1794 O ALA A 117 115.846 -5.507 2.560 1.00 0.00 O ATOM 1795 CB ALA A 117 114.138 -3.740 4.561 1.00 0.00 C ATOM 0 H ALA A 117 115.223 -2.423 2.777 1.00 0.00 H new ATOM 0 HA ALA A 117 116.211 -3.659 5.182 1.00 0.00 H new ATOM 0 HB1 ALA A 117 113.859 -4.505 5.286 1.00 0.00 H new ATOM 0 HB2 ALA A 117 113.905 -2.755 4.965 1.00 0.00 H new ATOM 0 HB3 ALA A 117 113.580 -3.895 3.638 1.00 0.00 H new ATOM 1801 N LYS A 118 116.319 -6.117 4.674 1.00 0.00 N ATOM 1802 CA LYS A 118 116.564 -7.509 4.319 1.00 0.00 C ATOM 1803 C LYS A 118 115.259 -8.297 4.370 1.00 0.00 C ATOM 1804 O LYS A 118 114.324 -7.926 5.079 1.00 0.00 O ATOM 1805 CB LYS A 118 117.578 -8.128 5.283 1.00 0.00 C ATOM 1806 CG LYS A 118 118.932 -7.435 5.116 1.00 0.00 C ATOM 1807 CD LYS A 118 119.911 -7.951 6.173 1.00 0.00 C ATOM 1808 CE LYS A 118 120.280 -9.406 5.875 1.00 0.00 C ATOM 1809 NZ LYS A 118 120.857 -9.504 4.504 1.00 0.00 N ATOM 0 H LYS A 118 116.453 -5.899 5.661 1.00 0.00 H new ATOM 0 HA LYS A 118 116.967 -7.547 3.307 1.00 0.00 H new ATOM 0 HB2 LYS A 118 117.229 -8.024 6.310 1.00 0.00 H new ATOM 0 HB3 LYS A 118 117.677 -9.196 5.086 1.00 0.00 H new ATOM 0 HG2 LYS A 118 119.327 -7.624 4.118 1.00 0.00 H new ATOM 0 HG3 LYS A 118 118.813 -6.356 5.213 1.00 0.00 H new ATOM 0 HD2 LYS A 118 120.809 -7.333 6.182 1.00 0.00 H new ATOM 0 HD3 LYS A 118 119.463 -7.876 7.164 1.00 0.00 H new ATOM 0 HE2 LYS A 118 120.999 -9.767 6.610 1.00 0.00 H new ATOM 0 HE3 LYS A 118 119.397 -10.040 5.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 121.502 -10.319 4.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 120.090 -9.628 3.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 121.382 -8.633 4.285 1.00 0.00 H new ATOM 1823 N GLY A 119 115.207 -9.386 3.613 1.00 0.00 N ATOM 1824 CA GLY A 119 114.006 -10.211 3.550 1.00 0.00 C ATOM 1825 C GLY A 119 114.068 -11.381 4.526 1.00 0.00 C ATOM 1826 O GLY A 119 114.930 -11.425 5.404 1.00 0.00 O ATOM 0 H GLY A 119 115.980 -9.718 3.036 1.00 0.00 H new ATOM 0 HA2 GLY A 119 113.133 -9.598 3.773 1.00 0.00 H new ATOM 0 HA3 GLY A 119 113.879 -10.590 2.536 1.00 0.00 H new ATOM 1830 N SER A 120 113.148 -12.325 4.365 1.00 0.00 N ATOM 1831 CA SER A 120 113.025 -13.430 5.310 1.00 0.00 C ATOM 1832 C SER A 120 114.325 -14.220 5.431 1.00 0.00 C ATOM 1833 O SER A 120 114.787 -14.483 6.543 1.00 0.00 O ATOM 1834 CB SER A 120 111.901 -14.367 4.864 1.00 0.00 C ATOM 1835 OG SER A 120 110.707 -13.616 4.695 1.00 0.00 O ATOM 0 H SER A 120 112.480 -12.349 3.595 1.00 0.00 H new ATOM 0 HA SER A 120 112.796 -13.006 6.288 1.00 0.00 H new ATOM 0 HB2 SER A 120 112.171 -14.859 3.930 1.00 0.00 H new ATOM 0 HB3 SER A 120 111.750 -15.152 5.605 1.00 0.00 H new ATOM 0 HG SER A 120 109.984 -14.212 4.407 1.00 0.00 H new ATOM 1841 N GLY A 121 114.913 -14.596 4.298 1.00 0.00 N ATOM 1842 CA GLY A 121 116.137 -15.395 4.326 1.00 0.00 C ATOM 1843 C GLY A 121 116.909 -15.316 3.013 1.00 0.00 C ATOM 1844 O GLY A 121 116.433 -15.769 1.971 1.00 0.00 O ATOM 0 H GLY A 121 114.571 -14.366 3.365 1.00 0.00 H new ATOM 0 HA2 GLY A 121 116.774 -15.051 5.141 1.00 0.00 H new ATOM 0 HA3 GLY A 121 115.885 -16.435 4.535 1.00 0.00 H new ATOM 1848 N GLY A 122 118.106 -14.739 3.071 1.00 0.00 N ATOM 1849 CA GLY A 122 119.004 -14.734 1.920 1.00 0.00 C ATOM 1850 C GLY A 122 118.410 -13.982 0.732 1.00 0.00 C ATOM 1851 O GLY A 122 118.642 -14.354 -0.419 1.00 0.00 O ATOM 0 H GLY A 122 118.475 -14.271 3.899 1.00 0.00 H new ATOM 0 HA2 GLY A 122 119.952 -14.275 2.202 1.00 0.00 H new ATOM 0 HA3 GLY A 122 119.222 -15.761 1.626 1.00 0.00 H new ATOM 1855 N GLY A 123 117.647 -12.930 1.009 1.00 0.00 N ATOM 1856 CA GLY A 123 117.054 -12.133 -0.058 1.00 0.00 C ATOM 1857 C GLY A 123 116.941 -10.669 0.351 1.00 0.00 C ATOM 1858 O GLY A 123 116.891 -10.350 1.536 1.00 0.00 O ATOM 0 H GLY A 123 117.426 -12.612 1.953 1.00 0.00 H new ATOM 0 HA2 GLY A 123 117.661 -12.216 -0.959 1.00 0.00 H new ATOM 0 HA3 GLY A 123 116.066 -12.523 -0.302 1.00 0.00 H new ATOM 1862 N TYR A 124 116.919 -9.782 -0.638 1.00 0.00 N ATOM 1863 CA TYR A 124 116.752 -8.353 -0.383 1.00 0.00 C ATOM 1864 C TYR A 124 115.373 -7.897 -0.850 1.00 0.00 C ATOM 1865 O TYR A 124 114.874 -8.368 -1.873 1.00 0.00 O ATOM 1866 CB TYR A 124 117.847 -7.576 -1.113 1.00 0.00 C ATOM 1867 CG TYR A 124 119.178 -7.620 -0.400 1.00 0.00 C ATOM 1868 CD1 TYR A 124 119.706 -8.847 0.022 1.00 0.00 C ATOM 1869 CD2 TYR A 124 119.894 -6.438 -0.175 1.00 0.00 C ATOM 1870 CE1 TYR A 124 120.944 -8.890 0.673 1.00 0.00 C ATOM 1871 CE2 TYR A 124 121.131 -6.481 0.477 1.00 0.00 C ATOM 1872 CZ TYR A 124 121.658 -7.708 0.901 1.00 0.00 C ATOM 1873 OH TYR A 124 122.879 -7.750 1.541 1.00 0.00 O ATOM 0 H TYR A 124 117.015 -10.026 -1.624 1.00 0.00 H new ATOM 0 HA TYR A 124 116.834 -8.162 0.687 1.00 0.00 H new ATOM 0 HB2 TYR A 124 117.966 -7.983 -2.117 1.00 0.00 H new ATOM 0 HB3 TYR A 124 117.535 -6.538 -1.225 1.00 0.00 H new ATOM 0 HD1 TYR A 124 119.157 -9.760 -0.155 1.00 0.00 H new ATOM 0 HD2 TYR A 124 119.491 -5.492 -0.505 1.00 0.00 H new ATOM 0 HE1 TYR A 124 121.349 -9.836 1.000 1.00 0.00 H new ATOM 0 HE2 TYR A 124 121.680 -5.568 0.654 1.00 0.00 H new ATOM 0 HH TYR A 124 123.240 -6.842 1.617 1.00 0.00 H new ATOM 1883 N ILE A 125 114.760 -6.983 -0.104 1.00 0.00 N ATOM 1884 CA ILE A 125 113.407 -6.542 -0.423 1.00 0.00 C ATOM 1885 C ILE A 125 113.439 -5.540 -1.577 1.00 0.00 C ATOM 1886 O ILE A 125 114.175 -4.554 -1.544 1.00 0.00 O ATOM 1887 CB ILE A 125 112.759 -5.940 0.833 1.00 0.00 C ATOM 1888 CG1 ILE A 125 112.683 -7.018 1.923 1.00 0.00 C ATOM 1889 CG2 ILE A 125 111.341 -5.453 0.521 1.00 0.00 C ATOM 1890 CD1 ILE A 125 112.468 -6.371 3.292 1.00 0.00 C ATOM 0 H ILE A 125 115.173 -6.538 0.716 1.00 0.00 H new ATOM 0 HA ILE A 125 112.806 -7.392 -0.744 1.00 0.00 H new ATOM 0 HB ILE A 125 113.361 -5.096 1.171 1.00 0.00 H new ATOM 0 HG12 ILE A 125 111.867 -7.708 1.706 1.00 0.00 H new ATOM 0 HG13 ILE A 125 113.602 -7.604 1.930 1.00 0.00 H new ATOM 0 HG21 ILE A 125 110.896 -5.029 1.421 1.00 0.00 H new ATOM 0 HG22 ILE A 125 111.381 -4.691 -0.257 1.00 0.00 H new ATOM 0 HG23 ILE A 125 110.736 -6.292 0.177 1.00 0.00 H new ATOM 0 HD11 ILE A 125 112.416 -7.146 4.057 1.00 0.00 H new ATOM 0 HD12 ILE A 125 113.298 -5.700 3.512 1.00 0.00 H new ATOM 0 HD13 ILE A 125 111.536 -5.805 3.285 1.00 0.00 H new ATOM 1902 N SER A 126 112.623 -5.809 -2.593 1.00 0.00 N ATOM 1903 CA SER A 126 112.641 -5.023 -3.823 1.00 0.00 C ATOM 1904 C SER A 126 112.260 -3.568 -3.581 1.00 0.00 C ATOM 1905 O SER A 126 111.342 -3.264 -2.818 1.00 0.00 O ATOM 1906 CB SER A 126 111.668 -5.634 -4.833 1.00 0.00 C ATOM 1907 OG SER A 126 112.050 -6.977 -5.094 1.00 0.00 O ATOM 0 H SER A 126 111.940 -6.567 -2.588 1.00 0.00 H new ATOM 0 HA SER A 126 113.660 -5.043 -4.210 1.00 0.00 H new ATOM 0 HB2 SER A 126 110.651 -5.602 -4.442 1.00 0.00 H new ATOM 0 HB3 SER A 126 111.673 -5.056 -5.757 1.00 0.00 H new ATOM 0 HG SER A 126 111.429 -7.374 -5.739 1.00 0.00 H new ATOM 1913 N LEU A 127 112.985 -2.677 -4.248 1.00 0.00 N ATOM 1914 CA LEU A 127 112.633 -1.255 -4.266 1.00 0.00 C ATOM 1915 C LEU A 127 111.817 -0.880 -5.516 1.00 0.00 C ATOM 1916 O LEU A 127 111.623 0.303 -5.795 1.00 0.00 O ATOM 1917 CB LEU A 127 113.905 -0.397 -4.241 1.00 0.00 C ATOM 1918 CG LEU A 127 114.802 -0.782 -3.059 1.00 0.00 C ATOM 1919 CD1 LEU A 127 116.078 0.062 -3.095 1.00 0.00 C ATOM 1920 CD2 LEU A 127 114.069 -0.523 -1.741 1.00 0.00 C ATOM 0 H LEU A 127 113.821 -2.910 -4.784 1.00 0.00 H new ATOM 0 HA LEU A 127 112.025 -1.066 -3.382 1.00 0.00 H new ATOM 0 HB2 LEU A 127 114.453 -0.524 -5.175 1.00 0.00 H new ATOM 0 HB3 LEU A 127 113.636 0.657 -4.170 1.00 0.00 H new ATOM 0 HG LEU A 127 115.053 -1.840 -3.132 1.00 0.00 H new ATOM 0 HD11 LEU A 127 116.718 -0.210 -2.255 1.00 0.00 H new ATOM 0 HD12 LEU A 127 116.609 -0.120 -4.029 1.00 0.00 H new ATOM 0 HD13 LEU A 127 115.818 1.118 -3.026 1.00 0.00 H new ATOM 0 HD21 LEU A 127 114.713 -0.799 -0.906 1.00 0.00 H new ATOM 0 HD22 LEU A 127 113.814 0.534 -1.668 1.00 0.00 H new ATOM 0 HD23 LEU A 127 113.157 -1.119 -1.708 1.00 0.00 H new ATOM 1932 N GLY A 128 111.343 -1.870 -6.277 1.00 0.00 N ATOM 1933 CA GLY A 128 110.683 -1.609 -7.553 1.00 0.00 C ATOM 1934 C GLY A 128 109.609 -0.527 -7.455 1.00 0.00 C ATOM 1935 O GLY A 128 109.551 0.364 -8.302 1.00 0.00 O ATOM 0 H GLY A 128 111.405 -2.858 -6.030 1.00 0.00 H new ATOM 0 HA2 GLY A 128 111.430 -1.308 -8.288 1.00 0.00 H new ATOM 0 HA3 GLY A 128 110.231 -2.531 -7.918 1.00 0.00 H new ATOM 1939 N ALA A 129 108.776 -0.586 -6.420 1.00 0.00 N ATOM 1940 CA ALA A 129 107.670 0.362 -6.297 1.00 0.00 C ATOM 1941 C ALA A 129 108.188 1.796 -6.255 1.00 0.00 C ATOM 1942 O ALA A 129 107.732 2.659 -7.008 1.00 0.00 O ATOM 1943 CB ALA A 129 106.870 0.069 -5.026 1.00 0.00 C ATOM 0 H ALA A 129 108.842 -1.268 -5.665 1.00 0.00 H new ATOM 0 HA ALA A 129 107.025 0.249 -7.168 1.00 0.00 H new ATOM 0 HB1 ALA A 129 106.048 0.780 -4.942 1.00 0.00 H new ATOM 0 HB2 ALA A 129 106.471 -0.944 -5.073 1.00 0.00 H new ATOM 0 HB3 ALA A 129 107.521 0.162 -4.157 1.00 0.00 H new ATOM 1949 N LEU A 130 109.171 2.040 -5.397 1.00 0.00 N ATOM 1950 CA LEU A 130 109.730 3.379 -5.255 1.00 0.00 C ATOM 1951 C LEU A 130 110.295 3.865 -6.587 1.00 0.00 C ATOM 1952 O LEU A 130 110.091 5.014 -6.980 1.00 0.00 O ATOM 1953 CB LEU A 130 110.832 3.357 -4.193 1.00 0.00 C ATOM 1954 CG LEU A 130 111.369 4.770 -3.958 1.00 0.00 C ATOM 1955 CD1 LEU A 130 110.310 5.606 -3.237 1.00 0.00 C ATOM 1956 CD2 LEU A 130 112.633 4.693 -3.097 1.00 0.00 C ATOM 0 H LEU A 130 109.595 1.335 -4.794 1.00 0.00 H new ATOM 0 HA LEU A 130 108.941 4.065 -4.947 1.00 0.00 H new ATOM 0 HB2 LEU A 130 110.441 2.949 -3.261 1.00 0.00 H new ATOM 0 HB3 LEU A 130 111.642 2.701 -4.513 1.00 0.00 H new ATOM 0 HG LEU A 130 111.606 5.235 -4.915 1.00 0.00 H new ATOM 0 HD11 LEU A 130 110.693 6.613 -3.070 1.00 0.00 H new ATOM 0 HD12 LEU A 130 109.409 5.657 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 130 110.072 5.144 -2.279 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.019 5.698 -2.927 1.00 0.00 H new ATOM 0 HD22 LEU A 130 112.394 4.230 -2.140 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.387 4.097 -3.610 1.00 0.00 H new ATOM 1968 N LEU A 131 110.981 2.973 -7.292 1.00 0.00 N ATOM 1969 CA LEU A 131 111.597 3.335 -8.562 1.00 0.00 C ATOM 1970 C LEU A 131 110.542 3.799 -9.558 1.00 0.00 C ATOM 1971 O LEU A 131 110.721 4.810 -10.234 1.00 0.00 O ATOM 1972 CB LEU A 131 112.352 2.131 -9.131 1.00 0.00 C ATOM 1973 CG LEU A 131 113.105 2.533 -10.401 1.00 0.00 C ATOM 1974 CD1 LEU A 131 114.306 3.404 -10.031 1.00 0.00 C ATOM 1975 CD2 LEU A 131 113.593 1.272 -11.120 1.00 0.00 C ATOM 0 H LEU A 131 111.124 2.003 -7.009 1.00 0.00 H new ATOM 0 HA LEU A 131 112.295 4.154 -8.389 1.00 0.00 H new ATOM 0 HB2 LEU A 131 113.053 1.748 -8.389 1.00 0.00 H new ATOM 0 HB3 LEU A 131 111.652 1.326 -9.354 1.00 0.00 H new ATOM 0 HG LEU A 131 112.439 3.095 -11.056 1.00 0.00 H new ATOM 0 HD11 LEU A 131 114.841 3.689 -10.937 1.00 0.00 H new ATOM 0 HD12 LEU A 131 113.960 4.300 -9.516 1.00 0.00 H new ATOM 0 HD13 LEU A 131 114.974 2.844 -9.376 1.00 0.00 H new ATOM 0 HD21 LEU A 131 114.130 1.554 -12.026 1.00 0.00 H new ATOM 0 HD22 LEU A 131 114.259 0.713 -10.463 1.00 0.00 H new ATOM 0 HD23 LEU A 131 112.738 0.650 -11.384 1.00 0.00 H new ATOM 1987 N SER A 132 109.428 3.079 -9.622 1.00 0.00 N ATOM 1988 CA SER A 132 108.385 3.402 -10.587 1.00 0.00 C ATOM 1989 C SER A 132 107.849 4.809 -10.351 1.00 0.00 C ATOM 1990 O SER A 132 107.668 5.577 -11.295 1.00 0.00 O ATOM 1991 CB SER A 132 107.241 2.392 -10.479 1.00 0.00 C ATOM 1992 OG SER A 132 106.580 2.567 -9.233 1.00 0.00 O ATOM 0 H SER A 132 109.225 2.277 -9.025 1.00 0.00 H new ATOM 0 HA SER A 132 108.817 3.355 -11.587 1.00 0.00 H new ATOM 0 HB2 SER A 132 106.538 2.532 -11.300 1.00 0.00 H new ATOM 0 HB3 SER A 132 107.628 1.376 -10.560 1.00 0.00 H new ATOM 0 HG SER A 132 107.224 2.457 -8.503 1.00 0.00 H new ATOM 1998 N THR A 133 107.639 5.159 -9.085 1.00 0.00 N ATOM 1999 CA THR A 133 107.096 6.473 -8.759 1.00 0.00 C ATOM 2000 C THR A 133 108.029 7.576 -9.246 1.00 0.00 C ATOM 2001 O THR A 133 107.597 8.529 -9.900 1.00 0.00 O ATOM 2002 CB THR A 133 106.892 6.597 -7.248 1.00 0.00 C ATOM 2003 OG1 THR A 133 106.103 5.510 -6.787 1.00 0.00 O ATOM 2004 CG2 THR A 133 106.183 7.915 -6.930 1.00 0.00 C ATOM 0 H THR A 133 107.833 4.562 -8.281 1.00 0.00 H new ATOM 0 HA THR A 133 106.135 6.582 -9.261 1.00 0.00 H new ATOM 0 HB THR A 133 107.861 6.581 -6.750 1.00 0.00 H new ATOM 0 HG1 THR A 133 105.973 5.588 -5.819 1.00 0.00 H new ATOM 0 HG21 THR A 133 106.039 8.000 -5.853 1.00 0.00 H new ATOM 0 HG22 THR A 133 106.790 8.749 -7.282 1.00 0.00 H new ATOM 0 HG23 THR A 133 105.214 7.936 -7.428 1.00 0.00 H new ATOM 2012 N THR A 134 109.317 7.425 -8.958 1.00 0.00 N ATOM 2013 CA THR A 134 110.286 8.451 -9.329 1.00 0.00 C ATOM 2014 C THR A 134 110.358 8.612 -10.845 1.00 0.00 C ATOM 2015 O THR A 134 110.431 9.730 -11.353 1.00 0.00 O ATOM 2016 CB THR A 134 111.664 8.100 -8.767 1.00 0.00 C ATOM 2017 OG1 THR A 134 111.546 7.871 -7.370 1.00 0.00 O ATOM 2018 CG2 THR A 134 112.627 9.264 -9.016 1.00 0.00 C ATOM 0 H THR A 134 109.710 6.616 -8.477 1.00 0.00 H new ATOM 0 HA THR A 134 109.960 9.400 -8.903 1.00 0.00 H new ATOM 0 HB THR A 134 112.048 7.205 -9.257 1.00 0.00 H new ATOM 0 HG1 THR A 134 111.193 6.970 -7.215 1.00 0.00 H new ATOM 0 HG21 THR A 134 113.610 9.015 -8.616 1.00 0.00 H new ATOM 0 HG22 THR A 134 112.707 9.447 -10.088 1.00 0.00 H new ATOM 0 HG23 THR A 134 112.250 10.160 -8.522 1.00 0.00 H new ATOM 2026 N LEU A 135 110.316 7.497 -11.569 1.00 0.00 N ATOM 2027 CA LEU A 135 110.372 7.547 -13.026 1.00 0.00 C ATOM 2028 C LEU A 135 109.202 8.351 -13.586 1.00 0.00 C ATOM 2029 O LEU A 135 109.364 9.108 -14.543 1.00 0.00 O ATOM 2030 CB LEU A 135 110.348 6.131 -13.606 1.00 0.00 C ATOM 2031 CG LEU A 135 111.631 5.393 -13.218 1.00 0.00 C ATOM 2032 CD1 LEU A 135 111.500 3.913 -13.586 1.00 0.00 C ATOM 2033 CD2 LEU A 135 112.815 5.998 -13.976 1.00 0.00 C ATOM 0 H LEU A 135 110.244 6.558 -11.176 1.00 0.00 H new ATOM 0 HA LEU A 135 111.302 8.037 -13.312 1.00 0.00 H new ATOM 0 HB2 LEU A 135 109.479 5.590 -13.233 1.00 0.00 H new ATOM 0 HB3 LEU A 135 110.256 6.174 -14.691 1.00 0.00 H new ATOM 0 HG LEU A 135 111.794 5.490 -12.145 1.00 0.00 H new ATOM 0 HD11 LEU A 135 112.414 3.387 -13.310 1.00 0.00 H new ATOM 0 HD12 LEU A 135 110.655 3.478 -13.051 1.00 0.00 H new ATOM 0 HD13 LEU A 135 111.337 3.818 -14.660 1.00 0.00 H new ATOM 0 HD21 LEU A 135 113.730 5.473 -13.701 1.00 0.00 H new ATOM 0 HD22 LEU A 135 112.649 5.899 -15.049 1.00 0.00 H new ATOM 0 HD23 LEU A 135 112.911 7.053 -13.719 1.00 0.00 H new ATOM 2045 N ASN A 136 108.026 8.184 -12.989 1.00 0.00 N ATOM 2046 CA ASN A 136 106.851 8.927 -13.429 1.00 0.00 C ATOM 2047 C ASN A 136 107.104 10.428 -13.324 1.00 0.00 C ATOM 2048 O ASN A 136 106.750 11.192 -14.221 1.00 0.00 O ATOM 2049 CB ASN A 136 105.641 8.549 -12.571 1.00 0.00 C ATOM 2050 CG ASN A 136 104.355 9.062 -13.215 1.00 0.00 C ATOM 2051 OD1 ASN A 136 104.308 9.283 -14.425 1.00 0.00 O ATOM 2052 ND2 ASN A 136 103.303 9.265 -12.472 1.00 0.00 N ATOM 0 H ASN A 136 107.862 7.548 -12.208 1.00 0.00 H new ATOM 0 HA ASN A 136 106.649 8.673 -14.469 1.00 0.00 H new ATOM 0 HB2 ASN A 136 105.592 7.466 -12.456 1.00 0.00 H new ATOM 0 HB3 ASN A 136 105.749 8.971 -11.572 1.00 0.00 H new ATOM 0 HD21 ASN A 136 102.439 9.607 -12.893 1.00 0.00 H new ATOM 0 HD22 ASN A 136 103.344 9.081 -11.469 1.00 0.00 H new ATOM 2059 N LEU A 137 107.719 10.839 -12.219 1.00 0.00 N ATOM 2060 CA LEU A 137 108.046 12.249 -12.017 1.00 0.00 C ATOM 2061 C LEU A 137 109.012 12.747 -13.089 1.00 0.00 C ATOM 2062 O LEU A 137 108.891 13.872 -13.573 1.00 0.00 O ATOM 2063 CB LEU A 137 108.671 12.449 -10.634 1.00 0.00 C ATOM 2064 CG LEU A 137 107.720 11.939 -9.547 1.00 0.00 C ATOM 2065 CD1 LEU A 137 108.397 12.073 -8.181 1.00 0.00 C ATOM 2066 CD2 LEU A 137 106.430 12.766 -9.552 1.00 0.00 C ATOM 0 H LEU A 137 107.999 10.223 -11.456 1.00 0.00 H new ATOM 0 HA LEU A 137 107.122 12.823 -12.088 1.00 0.00 H new ATOM 0 HB2 LEU A 137 109.621 11.918 -10.575 1.00 0.00 H new ATOM 0 HB3 LEU A 137 108.886 13.505 -10.473 1.00 0.00 H new ATOM 0 HG LEU A 137 107.479 10.894 -9.742 1.00 0.00 H new ATOM 0 HD11 LEU A 137 107.724 11.711 -7.404 1.00 0.00 H new ATOM 0 HD12 LEU A 137 109.314 11.484 -8.170 1.00 0.00 H new ATOM 0 HD13 LEU A 137 108.636 13.120 -7.995 1.00 0.00 H new ATOM 0 HD21 LEU A 137 105.759 12.398 -8.776 1.00 0.00 H new ATOM 0 HD22 LEU A 137 106.668 13.812 -9.359 1.00 0.00 H new ATOM 0 HD23 LEU A 137 105.945 12.677 -10.524 1.00 0.00 H new ATOM 2078 N CYS A 138 109.972 11.904 -13.454 1.00 0.00 N ATOM 2079 CA CYS A 138 110.931 12.253 -14.502 1.00 0.00 C ATOM 2080 C CYS A 138 110.241 12.536 -15.841 1.00 0.00 C ATOM 2081 O CYS A 138 110.783 13.265 -16.673 1.00 0.00 O ATOM 2082 CB CYS A 138 111.931 11.106 -14.682 1.00 0.00 C ATOM 2083 SG CYS A 138 113.267 11.197 -13.456 1.00 0.00 S ATOM 0 H CYS A 138 110.109 10.980 -13.044 1.00 0.00 H new ATOM 0 HA CYS A 138 111.445 13.163 -14.191 1.00 0.00 H new ATOM 0 HB2 CYS A 138 111.413 10.151 -14.589 1.00 0.00 H new ATOM 0 HB3 CYS A 138 112.353 11.143 -15.686 1.00 0.00 H new ATOM 2088 N GLY A 139 109.056 11.968 -16.056 1.00 0.00 N ATOM 2089 CA GLY A 139 108.327 12.186 -17.304 1.00 0.00 C ATOM 2090 C GLY A 139 108.830 11.294 -18.444 1.00 0.00 C ATOM 2091 O GLY A 139 108.644 11.625 -19.615 1.00 0.00 O ATOM 0 H GLY A 139 108.583 11.358 -15.389 1.00 0.00 H new ATOM 0 HA2 GLY A 139 107.267 11.995 -17.139 1.00 0.00 H new ATOM 0 HA3 GLY A 139 108.421 13.232 -17.597 1.00 0.00 H new ATOM 2095 N LYS A 140 109.467 10.173 -18.111 1.00 0.00 N ATOM 2096 CA LYS A 140 109.982 9.264 -19.128 1.00 0.00 C ATOM 2097 C LYS A 140 108.858 8.404 -19.696 1.00 0.00 C ATOM 2098 O LYS A 140 108.050 7.851 -18.950 1.00 0.00 O ATOM 2099 CB LYS A 140 111.062 8.365 -18.525 1.00 0.00 C ATOM 2100 CG LYS A 140 111.718 7.538 -19.633 1.00 0.00 C ATOM 2101 CD LYS A 140 112.740 6.580 -19.019 1.00 0.00 C ATOM 2102 CE LYS A 140 113.507 5.867 -20.133 1.00 0.00 C ATOM 2103 NZ LYS A 140 114.817 5.391 -19.608 1.00 0.00 N ATOM 0 H LYS A 140 109.637 9.875 -17.150 1.00 0.00 H new ATOM 0 HA LYS A 140 110.413 9.857 -19.935 1.00 0.00 H new ATOM 0 HB2 LYS A 140 111.812 8.971 -18.017 1.00 0.00 H new ATOM 0 HB3 LYS A 140 110.624 7.706 -17.776 1.00 0.00 H new ATOM 0 HG2 LYS A 140 110.960 6.977 -20.179 1.00 0.00 H new ATOM 0 HG3 LYS A 140 112.207 8.196 -20.351 1.00 0.00 H new ATOM 0 HD2 LYS A 140 113.432 7.130 -18.381 1.00 0.00 H new ATOM 0 HD3 LYS A 140 112.235 5.850 -18.386 1.00 0.00 H new ATOM 0 HE2 LYS A 140 112.926 5.025 -20.508 1.00 0.00 H new ATOM 0 HE3 LYS A 140 113.664 6.545 -20.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 115.339 4.906 -20.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 115.372 6.203 -19.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 114.656 4.731 -18.821 1.00 0.00 H new ATOM 2117 N GLY A 141 108.814 8.295 -21.020 1.00 0.00 N ATOM 2118 CA GLY A 141 107.784 7.497 -21.676 1.00 0.00 C ATOM 2119 C GLY A 141 108.067 6.007 -21.522 1.00 0.00 C ATOM 2120 O GLY A 141 107.708 5.260 -22.416 1.00 0.00 O ATOM 2121 OXT GLY A 141 108.638 5.636 -20.510 1.00 0.00 O ATOM 0 H GLY A 141 109.473 8.745 -21.655 1.00 0.00 H new ATOM 0 HA2 GLY A 141 106.809 7.732 -21.248 1.00 0.00 H new ATOM 0 HA3 GLY A 141 107.738 7.755 -22.734 1.00 0.00 H new TER 2125 GLY A 141