USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1306 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 7 MET CE :methyl -111:sc= -0.257 (180deg=-3.15!) USER MOD Set 1.2: B 81 THR OG1 : rot 73:sc= 0.824 USER MOD Set 2.1: B 29 LYS NZ :NH3+ 171:sc= -4.8! (180deg=-2.51!) USER MOD Set 2.2: B 50 GLN : amide:sc= -3.24 K(o=-8,f=-1.1) USER MOD Set 3.1: A 81 THR OG1 : rot 74:sc= 0.805 USER MOD Set 3.2: B 7 MET CE :methyl -110:sc= -0.445 (180deg=-3.33!) USER MOD Set 4.1: A 29 LYS NZ :NH3+ 169:sc= -4.31! (180deg=-2.42!) USER MOD Set 4.2: A 50 GLN : amide:sc= -2.74 K(o=-7.1,f=-0.73) USER MOD Single : A 1 SER N :NH3+ -131:sc= -2.95 (180deg=-4.2!) USER MOD Single : A 1 SER OG : rot 174:sc= 0.765 USER MOD Single : A 5 LYS NZ :NH3+ 141:sc= -0.36 (180deg=-1.43!) USER MOD Single : A 15 HIS : no HE2:sc= -0.155 K(o=-0.15,f=-0.95) USER MOD Single : A 16 GLN : amide:sc= -1.38 K(o=-1.4,f=0) USER MOD Single : A 17 TYR OH : rot -171:sc= -0.88 USER MOD Single : A 18 SER OG : rot -64:sc= 0.333 USER MOD Single : A 24 LYS NZ :NH3+ -114:sc= -1.21 (180deg=-3.4!) USER MOD Single : A 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0697 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 38 ASN : amide:sc= -0.263 K(o=-0.26,f=-1.6!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -0.0441 X(o=-0.044,f=0) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 84:sc= 0.00347 USER MOD Single : A 68 CYS SG : rot -160:sc= -0.821 USER MOD Single : A 71 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl -152:sc= -0.0548 (180deg=-0.582) USER MOD Single : A 82 THR OG1 : rot -20:sc= -0.27 USER MOD Single : A 84 CYS SG : rot -32:sc= 0.927 USER MOD Single : B 1 SER N :NH3+ -138:sc= -2.75! (180deg=-4.49!) USER MOD Single : B 1 SER OG : rot 175:sc= 0.93 USER MOD Single : B 5 LYS NZ :NH3+ 143:sc= -0.314 (180deg=-1.34!) USER MOD Single : B 15 HIS : no HE2:sc= -0.145 K(o=-0.15,f=-1) USER MOD Single : B 16 GLN : amide:sc= -1.31 K(o=-1.3,f=0) USER MOD Single : B 17 TYR OH : rot -173:sc= -0.905 USER MOD Single : B 18 SER OG : rot -64:sc= 0.333 USER MOD Single : B 24 LYS NZ :NH3+ -119:sc= -1.16 (180deg=-3.07!) USER MOD Single : B 25 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= -0.0877 USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 ASN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : B 38 ASN : amide:sc= -0.312 K(o=-0.31,f=-1.4!) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -0.0385 X(o=-0.039,f=0) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 79:sc= 0.00169 USER MOD Single : B 68 CYS SG : rot 180:sc= -0.852 USER MOD Single : B 71 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : B 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 78 SER OG : rot 180:sc= 0 USER MOD Single : B 79 MET CE :methyl -158:sc= -0.0764 (180deg=-0.667) USER MOD Single : B 82 THR OG1 : rot -17:sc= -0.322 USER MOD Single : B 84 CYS SG : rot -40:sc= 0.845 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 68.229 12.767 -9.209 1.00 0.00 N ATOM 2 CA SER A 1 68.562 11.854 -10.339 1.00 0.00 C ATOM 3 C SER A 1 67.851 10.515 -10.138 1.00 0.00 C ATOM 4 O SER A 1 67.054 10.352 -9.237 1.00 0.00 O ATOM 5 CB SER A 1 70.072 11.618 -10.376 1.00 0.00 C ATOM 6 OG SER A 1 70.531 11.313 -9.066 1.00 0.00 O ATOM 0 H1 SER A 1 67.935 13.691 -9.584 1.00 0.00 H new ATOM 0 H2 SER A 1 67.454 12.358 -8.649 1.00 0.00 H new ATOM 0 H3 SER A 1 69.066 12.889 -8.604 1.00 0.00 H new ATOM 0 HA SER A 1 68.238 12.306 -11.276 1.00 0.00 H new ATOM 0 HB2 SER A 1 70.307 10.799 -11.056 1.00 0.00 H new ATOM 0 HB3 SER A 1 70.581 12.504 -10.755 1.00 0.00 H new ATOM 0 HG SER A 1 71.480 11.072 -9.100 1.00 0.00 H new ATOM 14 N GLU A 2 68.128 9.556 -10.977 1.00 0.00 N ATOM 15 CA GLU A 2 67.474 8.227 -10.844 1.00 0.00 C ATOM 16 C GLU A 2 67.892 7.567 -9.527 1.00 0.00 C ATOM 17 O GLU A 2 67.137 6.829 -8.926 1.00 0.00 O ATOM 18 CB GLU A 2 67.893 7.347 -12.020 1.00 0.00 C ATOM 19 CG GLU A 2 67.247 7.876 -13.304 1.00 0.00 C ATOM 20 CD GLU A 2 67.806 7.116 -14.509 1.00 0.00 C ATOM 21 OE1 GLU A 2 68.656 6.266 -14.305 1.00 0.00 O ATOM 22 OE2 GLU A 2 67.377 7.401 -15.614 1.00 0.00 O ATOM 0 H GLU A 2 68.784 9.638 -11.754 1.00 0.00 H new ATOM 0 HA GLU A 2 66.391 8.352 -10.845 1.00 0.00 H new ATOM 0 HB2 GLU A 2 68.978 7.346 -12.119 1.00 0.00 H new ATOM 0 HB3 GLU A 2 67.588 6.316 -11.844 1.00 0.00 H new ATOM 0 HG2 GLU A 2 66.165 7.756 -13.255 1.00 0.00 H new ATOM 0 HG3 GLU A 2 67.445 8.943 -13.410 1.00 0.00 H new ATOM 29 N LEU A 3 69.085 7.832 -9.066 1.00 0.00 N ATOM 30 CA LEU A 3 69.543 7.230 -7.783 1.00 0.00 C ATOM 31 C LEU A 3 68.767 7.857 -6.627 1.00 0.00 C ATOM 32 O LEU A 3 68.537 7.237 -5.608 1.00 0.00 O ATOM 33 CB LEU A 3 71.029 7.520 -7.574 1.00 0.00 C ATOM 34 CG LEU A 3 71.865 6.916 -8.708 1.00 0.00 C ATOM 35 CD1 LEU A 3 73.335 7.296 -8.495 1.00 0.00 C ATOM 36 CD2 LEU A 3 71.721 5.384 -8.716 1.00 0.00 C ATOM 0 H LEU A 3 69.763 8.441 -9.525 1.00 0.00 H new ATOM 0 HA LEU A 3 69.375 6.154 -7.818 1.00 0.00 H new ATOM 0 HB2 LEU A 3 71.191 8.597 -7.530 1.00 0.00 H new ATOM 0 HB3 LEU A 3 71.354 7.109 -6.618 1.00 0.00 H new ATOM 0 HG LEU A 3 71.515 7.303 -9.665 1.00 0.00 H new ATOM 0 HD11 LEU A 3 73.940 6.872 -9.296 1.00 0.00 H new ATOM 0 HD12 LEU A 3 73.435 8.381 -8.501 1.00 0.00 H new ATOM 0 HD13 LEU A 3 73.677 6.905 -7.536 1.00 0.00 H new ATOM 0 HD21 LEU A 3 72.319 4.967 -9.526 1.00 0.00 H new ATOM 0 HD22 LEU A 3 72.067 4.981 -7.764 1.00 0.00 H new ATOM 0 HD23 LEU A 3 70.674 5.118 -8.864 1.00 0.00 H new ATOM 48 N GLU A 4 68.371 9.092 -6.774 1.00 0.00 N ATOM 49 CA GLU A 4 67.620 9.770 -5.684 1.00 0.00 C ATOM 50 C GLU A 4 66.274 9.080 -5.473 1.00 0.00 C ATOM 51 O GLU A 4 65.830 8.895 -4.357 1.00 0.00 O ATOM 52 CB GLU A 4 67.399 11.233 -6.075 1.00 0.00 C ATOM 53 CG GLU A 4 68.739 11.975 -6.033 1.00 0.00 C ATOM 54 CD GLU A 4 68.532 13.440 -6.425 1.00 0.00 C ATOM 55 OE1 GLU A 4 67.451 13.764 -6.887 1.00 0.00 O ATOM 56 OE2 GLU A 4 69.464 14.212 -6.264 1.00 0.00 O ATOM 0 H GLU A 4 68.537 9.660 -7.605 1.00 0.00 H new ATOM 0 HA GLU A 4 68.189 9.717 -4.756 1.00 0.00 H new ATOM 0 HB2 GLU A 4 66.968 11.293 -7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 4 66.689 11.701 -5.393 1.00 0.00 H new ATOM 0 HG2 GLU A 4 69.168 11.914 -5.033 1.00 0.00 H new ATOM 0 HG3 GLU A 4 69.448 11.503 -6.714 1.00 0.00 H new ATOM 63 N LYS A 5 65.623 8.688 -6.529 1.00 0.00 N ATOM 64 CA LYS A 5 64.308 8.003 -6.385 1.00 0.00 C ATOM 65 C LYS A 5 64.495 6.666 -5.662 1.00 0.00 C ATOM 66 O LYS A 5 63.694 6.282 -4.834 1.00 0.00 O ATOM 67 CB LYS A 5 63.697 7.771 -7.771 1.00 0.00 C ATOM 68 CG LYS A 5 63.270 9.119 -8.364 1.00 0.00 C ATOM 69 CD LYS A 5 62.825 8.942 -9.824 1.00 0.00 C ATOM 70 CE LYS A 5 61.407 8.357 -9.879 1.00 0.00 C ATOM 71 NZ LYS A 5 60.484 9.207 -9.076 1.00 0.00 N ATOM 0 H LYS A 5 65.944 8.812 -7.489 1.00 0.00 H new ATOM 0 HA LYS A 5 63.636 8.629 -5.798 1.00 0.00 H new ATOM 0 HB2 LYS A 5 64.422 7.285 -8.425 1.00 0.00 H new ATOM 0 HB3 LYS A 5 62.838 7.104 -7.696 1.00 0.00 H new ATOM 0 HG2 LYS A 5 62.454 9.540 -7.777 1.00 0.00 H new ATOM 0 HG3 LYS A 5 64.098 9.826 -8.312 1.00 0.00 H new ATOM 0 HD2 LYS A 5 62.850 9.903 -10.338 1.00 0.00 H new ATOM 0 HD3 LYS A 5 63.519 8.283 -10.346 1.00 0.00 H new ATOM 0 HE2 LYS A 5 61.064 8.306 -10.912 1.00 0.00 H new ATOM 0 HE3 LYS A 5 61.408 7.338 -9.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 59.569 9.283 -9.564 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 60.343 8.777 -8.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 60.895 10.155 -8.963 1.00 0.00 H new ATOM 85 N ALA A 6 65.543 5.957 -5.973 1.00 0.00 N ATOM 86 CA ALA A 6 65.778 4.647 -5.305 1.00 0.00 C ATOM 87 C ALA A 6 65.908 4.861 -3.792 1.00 0.00 C ATOM 88 O ALA A 6 65.288 4.176 -3.005 1.00 0.00 O ATOM 89 CB ALA A 6 67.065 4.015 -5.848 1.00 0.00 C ATOM 0 H ALA A 6 66.247 6.227 -6.660 1.00 0.00 H new ATOM 0 HA ALA A 6 64.938 3.982 -5.506 1.00 0.00 H new ATOM 0 HB1 ALA A 6 67.235 3.056 -5.358 1.00 0.00 H new ATOM 0 HB2 ALA A 6 66.969 3.861 -6.923 1.00 0.00 H new ATOM 0 HB3 ALA A 6 67.907 4.678 -5.650 1.00 0.00 H new ATOM 95 N MET A 7 66.702 5.816 -3.381 1.00 0.00 N ATOM 96 CA MET A 7 66.856 6.073 -1.921 1.00 0.00 C ATOM 97 C MET A 7 65.493 6.436 -1.335 1.00 0.00 C ATOM 98 O MET A 7 65.079 5.913 -0.319 1.00 0.00 O ATOM 99 CB MET A 7 67.819 7.241 -1.709 1.00 0.00 C ATOM 100 CG MET A 7 68.153 7.356 -0.219 1.00 0.00 C ATOM 101 SD MET A 7 69.238 8.781 0.057 1.00 0.00 S ATOM 102 CE MET A 7 70.805 8.021 -0.445 1.00 0.00 C ATOM 0 H MET A 7 67.247 6.425 -3.991 1.00 0.00 H new ATOM 0 HA MET A 7 67.249 5.183 -1.430 1.00 0.00 H new ATOM 0 HB2 MET A 7 68.730 7.086 -2.287 1.00 0.00 H new ATOM 0 HB3 MET A 7 67.369 8.168 -2.065 1.00 0.00 H new ATOM 0 HG2 MET A 7 67.237 7.467 0.361 1.00 0.00 H new ATOM 0 HG3 MET A 7 68.640 6.444 0.126 1.00 0.00 H new ATOM 0 HE1 MET A 7 71.445 7.895 0.429 1.00 0.00 H new ATOM 0 HE2 MET A 7 70.610 7.048 -0.895 1.00 0.00 H new ATOM 0 HE3 MET A 7 71.304 8.662 -1.171 1.00 0.00 H new ATOM 112 N VAL A 8 64.804 7.341 -1.968 1.00 0.00 N ATOM 113 CA VAL A 8 63.476 7.767 -1.454 1.00 0.00 C ATOM 114 C VAL A 8 62.555 6.551 -1.408 1.00 0.00 C ATOM 115 O VAL A 8 61.785 6.386 -0.483 1.00 0.00 O ATOM 116 CB VAL A 8 62.894 8.837 -2.385 1.00 0.00 C ATOM 117 CG1 VAL A 8 61.443 9.144 -1.997 1.00 0.00 C ATOM 118 CG2 VAL A 8 63.731 10.114 -2.262 1.00 0.00 C ATOM 0 H VAL A 8 65.106 7.806 -2.824 1.00 0.00 H new ATOM 0 HA VAL A 8 63.573 8.185 -0.452 1.00 0.00 H new ATOM 0 HB VAL A 8 62.916 8.470 -3.411 1.00 0.00 H new ATOM 0 HG11 VAL A 8 61.041 9.905 -2.665 1.00 0.00 H new ATOM 0 HG12 VAL A 8 60.845 8.237 -2.079 1.00 0.00 H new ATOM 0 HG13 VAL A 8 61.410 9.509 -0.970 1.00 0.00 H new ATOM 0 HG21 VAL A 8 63.324 10.881 -2.921 1.00 0.00 H new ATOM 0 HG22 VAL A 8 63.704 10.469 -1.232 1.00 0.00 H new ATOM 0 HG23 VAL A 8 64.762 9.902 -2.545 1.00 0.00 H new ATOM 128 N ALA A 9 62.612 5.700 -2.393 1.00 0.00 N ATOM 129 CA ALA A 9 61.721 4.509 -2.377 1.00 0.00 C ATOM 130 C ALA A 9 61.999 3.673 -1.122 1.00 0.00 C ATOM 131 O ALA A 9 61.089 3.207 -0.468 1.00 0.00 O ATOM 132 CB ALA A 9 61.991 3.661 -3.627 1.00 0.00 C ATOM 0 H ALA A 9 63.230 5.776 -3.201 1.00 0.00 H new ATOM 0 HA ALA A 9 60.680 4.832 -2.369 1.00 0.00 H new ATOM 0 HB1 ALA A 9 61.341 2.786 -3.621 1.00 0.00 H new ATOM 0 HB2 ALA A 9 61.792 4.255 -4.519 1.00 0.00 H new ATOM 0 HB3 ALA A 9 63.032 3.339 -3.630 1.00 0.00 H new ATOM 138 N LEU A 10 63.243 3.483 -0.776 1.00 0.00 N ATOM 139 CA LEU A 10 63.565 2.672 0.443 1.00 0.00 C ATOM 140 C LEU A 10 62.947 3.297 1.701 1.00 0.00 C ATOM 141 O LEU A 10 62.308 2.625 2.486 1.00 0.00 O ATOM 142 CB LEU A 10 65.090 2.600 0.631 1.00 0.00 C ATOM 143 CG LEU A 10 65.729 1.672 -0.415 1.00 0.00 C ATOM 144 CD1 LEU A 10 67.236 1.939 -0.471 1.00 0.00 C ATOM 145 CD2 LEU A 10 65.509 0.198 -0.030 1.00 0.00 C ATOM 0 H LEU A 10 64.050 3.851 -1.279 1.00 0.00 H new ATOM 0 HA LEU A 10 63.151 1.674 0.300 1.00 0.00 H new ATOM 0 HB2 LEU A 10 65.518 3.599 0.547 1.00 0.00 H new ATOM 0 HB3 LEU A 10 65.320 2.238 1.633 1.00 0.00 H new ATOM 0 HG LEU A 10 65.268 1.867 -1.383 1.00 0.00 H new ATOM 0 HD11 LEU A 10 67.694 1.283 -1.211 1.00 0.00 H new ATOM 0 HD12 LEU A 10 67.411 2.978 -0.749 1.00 0.00 H new ATOM 0 HD13 LEU A 10 67.676 1.745 0.507 1.00 0.00 H new ATOM 0 HD21 LEU A 10 65.967 -0.446 -0.780 1.00 0.00 H new ATOM 0 HD22 LEU A 10 65.964 0.004 0.941 1.00 0.00 H new ATOM 0 HD23 LEU A 10 64.440 -0.009 0.022 1.00 0.00 H new ATOM 157 N ILE A 11 63.150 4.569 1.914 1.00 0.00 N ATOM 158 CA ILE A 11 62.588 5.219 3.137 1.00 0.00 C ATOM 159 C ILE A 11 61.063 5.135 3.126 1.00 0.00 C ATOM 160 O ILE A 11 60.441 4.754 4.099 1.00 0.00 O ATOM 161 CB ILE A 11 63.016 6.685 3.177 1.00 0.00 C ATOM 162 CG1 ILE A 11 64.543 6.768 3.256 1.00 0.00 C ATOM 163 CG2 ILE A 11 62.407 7.361 4.409 1.00 0.00 C ATOM 164 CD1 ILE A 11 64.987 8.216 3.045 1.00 0.00 C ATOM 0 H ILE A 11 63.679 5.186 1.297 1.00 0.00 H new ATOM 0 HA ILE A 11 62.966 4.701 4.019 1.00 0.00 H new ATOM 0 HB ILE A 11 62.669 7.189 2.275 1.00 0.00 H new ATOM 0 HG12 ILE A 11 64.888 6.408 4.226 1.00 0.00 H new ATOM 0 HG13 ILE A 11 64.992 6.125 2.499 1.00 0.00 H new ATOM 0 HG21 ILE A 11 62.712 8.407 4.438 1.00 0.00 H new ATOM 0 HG22 ILE A 11 61.320 7.301 4.357 1.00 0.00 H new ATOM 0 HG23 ILE A 11 62.755 6.856 5.310 1.00 0.00 H new ATOM 0 HD11 ILE A 11 66.074 8.275 3.101 1.00 0.00 H new ATOM 0 HD12 ILE A 11 64.655 8.559 2.065 1.00 0.00 H new ATOM 0 HD13 ILE A 11 64.549 8.847 3.818 1.00 0.00 H new ATOM 176 N ASP A 12 60.454 5.515 2.042 1.00 0.00 N ATOM 177 CA ASP A 12 58.970 5.487 1.978 1.00 0.00 C ATOM 178 C ASP A 12 58.478 4.056 2.201 1.00 0.00 C ATOM 179 O ASP A 12 57.496 3.827 2.878 1.00 0.00 O ATOM 180 CB ASP A 12 58.520 5.980 0.601 1.00 0.00 C ATOM 181 CG ASP A 12 58.799 7.481 0.481 1.00 0.00 C ATOM 182 OD1 ASP A 12 58.895 8.128 1.510 1.00 0.00 O ATOM 183 OD2 ASP A 12 58.908 7.956 -0.637 1.00 0.00 O ATOM 0 H ASP A 12 60.920 5.844 1.196 1.00 0.00 H new ATOM 0 HA ASP A 12 58.554 6.133 2.751 1.00 0.00 H new ATOM 0 HB2 ASP A 12 59.049 5.437 -0.182 1.00 0.00 H new ATOM 0 HB3 ASP A 12 57.457 5.784 0.462 1.00 0.00 H new ATOM 188 N VAL A 13 59.153 3.092 1.642 1.00 0.00 N ATOM 189 CA VAL A 13 58.720 1.678 1.834 1.00 0.00 C ATOM 190 C VAL A 13 58.980 1.250 3.290 1.00 0.00 C ATOM 191 O VAL A 13 58.185 0.556 3.894 1.00 0.00 O ATOM 192 CB VAL A 13 59.498 0.767 0.873 1.00 0.00 C ATOM 193 CG1 VAL A 13 59.249 -0.703 1.225 1.00 0.00 C ATOM 194 CG2 VAL A 13 59.031 1.024 -0.565 1.00 0.00 C ATOM 0 H VAL A 13 59.983 3.219 1.062 1.00 0.00 H new ATOM 0 HA VAL A 13 57.654 1.593 1.623 1.00 0.00 H new ATOM 0 HB VAL A 13 60.562 0.984 0.963 1.00 0.00 H new ATOM 0 HG11 VAL A 13 59.805 -1.341 0.538 1.00 0.00 H new ATOM 0 HG12 VAL A 13 59.580 -0.894 2.246 1.00 0.00 H new ATOM 0 HG13 VAL A 13 58.184 -0.922 1.142 1.00 0.00 H new ATOM 0 HG21 VAL A 13 59.583 0.378 -1.248 1.00 0.00 H new ATOM 0 HG22 VAL A 13 57.965 0.811 -0.645 1.00 0.00 H new ATOM 0 HG23 VAL A 13 59.213 2.067 -0.826 1.00 0.00 H new ATOM 204 N PHE A 14 60.098 1.639 3.851 1.00 0.00 N ATOM 205 CA PHE A 14 60.418 1.234 5.253 1.00 0.00 C ATOM 206 C PHE A 14 59.394 1.797 6.241 1.00 0.00 C ATOM 207 O PHE A 14 58.817 1.072 7.028 1.00 0.00 O ATOM 208 CB PHE A 14 61.804 1.769 5.627 1.00 0.00 C ATOM 209 CG PHE A 14 62.148 1.373 7.046 1.00 0.00 C ATOM 210 CD1 PHE A 14 61.785 2.206 8.111 1.00 0.00 C ATOM 211 CD2 PHE A 14 62.847 0.183 7.296 1.00 0.00 C ATOM 212 CE1 PHE A 14 62.117 1.850 9.424 1.00 0.00 C ATOM 213 CE2 PHE A 14 63.177 -0.173 8.611 1.00 0.00 C ATOM 214 CZ PHE A 14 62.812 0.662 9.674 1.00 0.00 C ATOM 0 H PHE A 14 60.803 2.220 3.397 1.00 0.00 H new ATOM 0 HA PHE A 14 60.395 0.146 5.307 1.00 0.00 H new ATOM 0 HB2 PHE A 14 62.552 1.375 4.939 1.00 0.00 H new ATOM 0 HB3 PHE A 14 61.822 2.854 5.529 1.00 0.00 H new ATOM 0 HD1 PHE A 14 61.249 3.124 7.920 1.00 0.00 H new ATOM 0 HD2 PHE A 14 63.131 -0.459 6.475 1.00 0.00 H new ATOM 0 HE1 PHE A 14 61.836 2.493 10.245 1.00 0.00 H new ATOM 0 HE2 PHE A 14 63.712 -1.091 8.804 1.00 0.00 H new ATOM 0 HZ PHE A 14 63.067 0.389 10.687 1.00 0.00 H new ATOM 224 N HIS A 15 59.201 3.090 6.254 1.00 0.00 N ATOM 225 CA HIS A 15 58.266 3.691 7.245 1.00 0.00 C ATOM 226 C HIS A 15 56.853 3.134 7.077 1.00 0.00 C ATOM 227 O HIS A 15 56.195 2.829 8.052 1.00 0.00 O ATOM 228 CB HIS A 15 58.240 5.211 7.056 1.00 0.00 C ATOM 229 CG HIS A 15 57.302 5.832 8.058 1.00 0.00 C ATOM 230 ND1 HIS A 15 55.944 5.993 7.809 1.00 0.00 N ATOM 231 CD2 HIS A 15 57.514 6.345 9.316 1.00 0.00 C ATOM 232 CE1 HIS A 15 55.399 6.577 8.894 1.00 0.00 C ATOM 233 NE2 HIS A 15 56.312 6.812 9.836 1.00 0.00 N ATOM 0 H HIS A 15 59.650 3.753 5.622 1.00 0.00 H new ATOM 0 HA HIS A 15 58.616 3.441 8.247 1.00 0.00 H new ATOM 0 HB2 HIS A 15 59.243 5.620 7.180 1.00 0.00 H new ATOM 0 HB3 HIS A 15 57.920 5.456 6.043 1.00 0.00 H new ATOM 0 HD1 HIS A 15 55.450 5.719 6.960 1.00 0.00 H new ATOM 0 HD2 HIS A 15 58.467 6.380 9.822 1.00 0.00 H new ATOM 0 HE1 HIS A 15 54.352 6.824 8.989 1.00 0.00 H new ATOM 242 N GLN A 16 56.361 2.975 5.880 1.00 0.00 N ATOM 243 CA GLN A 16 54.986 2.413 5.736 1.00 0.00 C ATOM 244 C GLN A 16 54.993 0.932 6.120 1.00 0.00 C ATOM 245 O GLN A 16 54.091 0.440 6.766 1.00 0.00 O ATOM 246 CB GLN A 16 54.522 2.570 4.286 1.00 0.00 C ATOM 247 CG GLN A 16 54.268 4.050 3.987 1.00 0.00 C ATOM 248 CD GLN A 16 53.803 4.207 2.538 1.00 0.00 C ATOM 249 OE1 GLN A 16 53.269 5.233 2.166 1.00 0.00 O ATOM 250 NE2 GLN A 16 53.984 3.225 1.699 1.00 0.00 N ATOM 0 H GLN A 16 56.840 3.204 5.009 1.00 0.00 H new ATOM 0 HA GLN A 16 54.303 2.949 6.394 1.00 0.00 H new ATOM 0 HB2 GLN A 16 55.278 2.176 3.607 1.00 0.00 H new ATOM 0 HB3 GLN A 16 53.612 1.993 4.120 1.00 0.00 H new ATOM 0 HG2 GLN A 16 53.513 4.445 4.667 1.00 0.00 H new ATOM 0 HG3 GLN A 16 55.178 4.626 4.152 1.00 0.00 H new ATOM 0 HE21 GLN A 16 54.432 2.364 2.011 1.00 0.00 H new ATOM 0 HE22 GLN A 16 53.677 3.318 0.731 1.00 0.00 H new ATOM 259 N TYR A 17 56.016 0.224 5.727 1.00 0.00 N ATOM 260 CA TYR A 17 56.097 -1.225 6.074 1.00 0.00 C ATOM 261 C TYR A 17 56.339 -1.367 7.574 1.00 0.00 C ATOM 262 O TYR A 17 55.696 -2.140 8.255 1.00 0.00 O ATOM 263 CB TYR A 17 57.248 -1.881 5.312 1.00 0.00 C ATOM 264 CG TYR A 17 57.228 -3.359 5.599 1.00 0.00 C ATOM 265 CD1 TYR A 17 56.353 -4.191 4.894 1.00 0.00 C ATOM 266 CD2 TYR A 17 58.065 -3.895 6.583 1.00 0.00 C ATOM 267 CE1 TYR A 17 56.316 -5.562 5.169 1.00 0.00 C ATOM 268 CE2 TYR A 17 58.027 -5.266 6.861 1.00 0.00 C ATOM 269 CZ TYR A 17 57.152 -6.100 6.154 1.00 0.00 C ATOM 270 OH TYR A 17 57.113 -7.452 6.429 1.00 0.00 O ATOM 0 H TYR A 17 56.799 0.585 5.181 1.00 0.00 H new ATOM 0 HA TYR A 17 55.162 -1.714 5.800 1.00 0.00 H new ATOM 0 HB2 TYR A 17 57.145 -1.701 4.242 1.00 0.00 H new ATOM 0 HB3 TYR A 17 58.201 -1.448 5.618 1.00 0.00 H new ATOM 0 HD1 TYR A 17 55.705 -3.775 4.137 1.00 0.00 H new ATOM 0 HD2 TYR A 17 58.740 -3.251 7.128 1.00 0.00 H new ATOM 0 HE1 TYR A 17 55.643 -6.205 4.622 1.00 0.00 H new ATOM 0 HE2 TYR A 17 58.673 -5.681 7.621 1.00 0.00 H new ATOM 0 HH TYR A 17 57.646 -7.638 7.230 1.00 0.00 H new ATOM 280 N SER A 18 57.264 -0.611 8.086 1.00 0.00 N ATOM 281 CA SER A 18 57.561 -0.674 9.542 1.00 0.00 C ATOM 282 C SER A 18 56.401 -0.048 10.315 1.00 0.00 C ATOM 283 O SER A 18 56.279 -0.214 11.513 1.00 0.00 O ATOM 284 CB SER A 18 58.855 0.083 9.845 1.00 0.00 C ATOM 285 OG SER A 18 59.284 -0.239 11.163 1.00 0.00 O ATOM 0 H SER A 18 57.831 0.052 7.557 1.00 0.00 H new ATOM 0 HA SER A 18 57.685 -1.714 9.844 1.00 0.00 H new ATOM 0 HB2 SER A 18 59.626 -0.185 9.122 1.00 0.00 H new ATOM 0 HB3 SER A 18 58.693 1.157 9.754 1.00 0.00 H new ATOM 0 HG SER A 18 58.622 0.083 11.810 1.00 0.00 H new ATOM 291 N GLY A 19 55.545 0.674 9.637 1.00 0.00 N ATOM 292 CA GLY A 19 54.385 1.319 10.321 1.00 0.00 C ATOM 293 C GLY A 19 53.176 0.374 10.321 1.00 0.00 C ATOM 294 O GLY A 19 52.067 0.783 10.604 1.00 0.00 O ATOM 0 H GLY A 19 55.601 0.845 8.633 1.00 0.00 H new ATOM 0 HA2 GLY A 19 54.655 1.576 11.345 1.00 0.00 H new ATOM 0 HA3 GLY A 19 54.128 2.250 9.816 1.00 0.00 H new ATOM 298 N ARG A 20 53.370 -0.884 10.026 1.00 0.00 N ATOM 299 CA ARG A 20 52.215 -1.831 10.038 1.00 0.00 C ATOM 300 C ARG A 20 51.807 -2.102 11.487 1.00 0.00 C ATOM 301 O ARG A 20 50.641 -2.189 11.814 1.00 0.00 O ATOM 302 CB ARG A 20 52.631 -3.154 9.385 1.00 0.00 C ATOM 303 CG ARG A 20 52.902 -2.957 7.887 1.00 0.00 C ATOM 304 CD ARG A 20 51.589 -2.947 7.095 1.00 0.00 C ATOM 305 NE ARG A 20 51.908 -2.892 5.639 1.00 0.00 N ATOM 306 CZ ARG A 20 52.178 -1.750 5.069 1.00 0.00 C ATOM 307 NH1 ARG A 20 52.122 -0.644 5.761 1.00 0.00 N ATOM 308 NH2 ARG A 20 52.503 -1.711 3.806 1.00 0.00 N ATOM 0 H ARG A 20 54.270 -1.295 9.779 1.00 0.00 H new ATOM 0 HA ARG A 20 51.381 -1.395 9.488 1.00 0.00 H new ATOM 0 HB2 ARG A 20 53.525 -3.541 9.874 1.00 0.00 H new ATOM 0 HB3 ARG A 20 51.845 -3.897 9.523 1.00 0.00 H new ATOM 0 HG2 ARG A 20 53.435 -2.019 7.729 1.00 0.00 H new ATOM 0 HG3 ARG A 20 53.547 -3.756 7.521 1.00 0.00 H new ATOM 0 HD2 ARG A 20 51.005 -3.840 7.320 1.00 0.00 H new ATOM 0 HD3 ARG A 20 50.982 -2.088 7.381 1.00 0.00 H new ATOM 0 HE ARG A 20 51.915 -3.750 5.087 1.00 0.00 H new ATOM 0 HH11 ARG A 20 51.867 -0.672 6.748 1.00 0.00 H new ATOM 0 HH12 ARG A 20 52.333 0.248 5.314 1.00 0.00 H new ATOM 0 HH21 ARG A 20 52.546 -2.574 3.264 1.00 0.00 H new ATOM 0 HH22 ARG A 20 52.714 -0.818 3.361 1.00 0.00 H new ATOM 322 N GLU A 21 52.777 -2.244 12.354 1.00 0.00 N ATOM 323 CA GLU A 21 52.491 -2.520 13.792 1.00 0.00 C ATOM 324 C GLU A 21 52.694 -1.240 14.602 1.00 0.00 C ATOM 325 O GLU A 21 52.563 -1.228 15.811 1.00 0.00 O ATOM 326 CB GLU A 21 53.451 -3.602 14.294 1.00 0.00 C ATOM 327 CG GLU A 21 53.200 -4.899 13.522 1.00 0.00 C ATOM 328 CD GLU A 21 51.825 -5.458 13.894 1.00 0.00 C ATOM 329 OE1 GLU A 21 51.320 -5.087 14.941 1.00 0.00 O ATOM 330 OE2 GLU A 21 51.300 -6.246 13.125 1.00 0.00 O ATOM 0 H GLU A 21 53.768 -2.179 12.122 1.00 0.00 H new ATOM 0 HA GLU A 21 51.462 -2.861 13.907 1.00 0.00 H new ATOM 0 HB2 GLU A 21 54.483 -3.279 14.159 1.00 0.00 H new ATOM 0 HB3 GLU A 21 53.305 -3.767 15.362 1.00 0.00 H new ATOM 0 HG2 GLU A 21 53.250 -4.711 12.449 1.00 0.00 H new ATOM 0 HG3 GLU A 21 53.976 -5.629 13.754 1.00 0.00 H new ATOM 337 N GLY A 22 53.025 -0.164 13.943 1.00 0.00 N ATOM 338 CA GLY A 22 53.250 1.118 14.667 1.00 0.00 C ATOM 339 C GLY A 22 54.656 1.114 15.262 1.00 0.00 C ATOM 340 O GLY A 22 55.056 2.033 15.951 1.00 0.00 O ATOM 0 H GLY A 22 53.150 -0.118 12.932 1.00 0.00 H new ATOM 0 HA2 GLY A 22 53.132 1.961 13.986 1.00 0.00 H new ATOM 0 HA3 GLY A 22 52.508 1.240 15.456 1.00 0.00 H new ATOM 344 N ASP A 23 55.413 0.079 15.002 1.00 0.00 N ATOM 345 CA ASP A 23 56.799 0.004 15.549 1.00 0.00 C ATOM 346 C ASP A 23 57.785 0.636 14.566 1.00 0.00 C ATOM 347 O ASP A 23 58.415 -0.041 13.779 1.00 0.00 O ATOM 348 CB ASP A 23 57.181 -1.462 15.774 1.00 0.00 C ATOM 349 CG ASP A 23 56.397 -2.017 16.964 1.00 0.00 C ATOM 350 OD1 ASP A 23 55.952 -1.223 17.776 1.00 0.00 O ATOM 351 OD2 ASP A 23 56.258 -3.227 17.046 1.00 0.00 O ATOM 0 H ASP A 23 55.129 -0.719 14.433 1.00 0.00 H new ATOM 0 HA ASP A 23 56.837 0.545 16.495 1.00 0.00 H new ATOM 0 HB2 ASP A 23 56.966 -2.046 14.879 1.00 0.00 H new ATOM 0 HB3 ASP A 23 58.252 -1.545 15.960 1.00 0.00 H new ATOM 356 N LYS A 24 57.943 1.928 14.626 1.00 0.00 N ATOM 357 CA LYS A 24 58.909 2.605 13.718 1.00 0.00 C ATOM 358 C LYS A 24 60.317 2.331 14.253 1.00 0.00 C ATOM 359 O LYS A 24 60.479 1.984 15.406 1.00 0.00 O ATOM 360 CB LYS A 24 58.636 4.112 13.714 1.00 0.00 C ATOM 361 CG LYS A 24 57.293 4.382 13.030 1.00 0.00 C ATOM 362 CD LYS A 24 57.006 5.890 13.017 1.00 0.00 C ATOM 363 CE LYS A 24 56.862 6.420 14.453 1.00 0.00 C ATOM 364 NZ LYS A 24 58.201 6.823 14.964 1.00 0.00 N ATOM 0 H LYS A 24 57.444 2.546 15.266 1.00 0.00 H new ATOM 0 HA LYS A 24 58.810 2.232 12.699 1.00 0.00 H new ATOM 0 HB2 LYS A 24 58.620 4.493 14.735 1.00 0.00 H new ATOM 0 HB3 LYS A 24 59.435 4.637 13.191 1.00 0.00 H new ATOM 0 HG2 LYS A 24 57.311 3.998 12.010 1.00 0.00 H new ATOM 0 HG3 LYS A 24 56.496 3.856 13.555 1.00 0.00 H new ATOM 0 HD2 LYS A 24 57.813 6.416 12.508 1.00 0.00 H new ATOM 0 HD3 LYS A 24 56.093 6.088 12.456 1.00 0.00 H new ATOM 0 HE2 LYS A 24 56.181 7.271 14.472 1.00 0.00 H new ATOM 0 HE3 LYS A 24 56.431 5.652 15.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 58.476 6.197 15.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 58.902 6.748 14.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 58.162 7.806 15.303 1.00 0.00 H new ATOM 378 N HIS A 25 61.341 2.501 13.459 1.00 0.00 N ATOM 379 CA HIS A 25 62.719 2.270 13.962 1.00 0.00 C ATOM 380 C HIS A 25 62.794 0.971 14.765 1.00 0.00 C ATOM 381 O HIS A 25 63.547 0.868 15.711 1.00 0.00 O ATOM 382 CB HIS A 25 63.107 3.447 14.845 1.00 0.00 C ATOM 383 CG HIS A 25 63.342 4.662 13.991 1.00 0.00 C ATOM 384 ND1 HIS A 25 64.559 4.904 13.370 1.00 0.00 N ATOM 385 CD2 HIS A 25 62.525 5.707 13.638 1.00 0.00 C ATOM 386 CE1 HIS A 25 64.441 6.053 12.681 1.00 0.00 C ATOM 387 NE2 HIS A 25 63.223 6.582 12.813 1.00 0.00 N ATOM 0 H HIS A 25 61.278 2.790 12.483 1.00 0.00 H new ATOM 0 HA HIS A 25 63.405 2.183 13.119 1.00 0.00 H new ATOM 0 HB2 HIS A 25 62.318 3.647 15.570 1.00 0.00 H new ATOM 0 HB3 HIS A 25 64.007 3.209 15.411 1.00 0.00 H new ATOM 0 HD2 HIS A 25 61.499 5.830 13.952 1.00 0.00 H new ATOM 0 HE1 HIS A 25 65.234 6.493 12.094 1.00 0.00 H new ATOM 0 HE2 HIS A 25 62.877 7.446 12.396 1.00 0.00 H new ATOM 396 N LYS A 26 62.031 -0.024 14.402 1.00 0.00 N ATOM 397 CA LYS A 26 62.099 -1.299 15.175 1.00 0.00 C ATOM 398 C LYS A 26 61.337 -2.423 14.463 1.00 0.00 C ATOM 399 O LYS A 26 60.134 -2.547 14.591 1.00 0.00 O ATOM 400 CB LYS A 26 61.496 -1.084 16.565 1.00 0.00 C ATOM 401 CG LYS A 26 61.609 -2.377 17.375 1.00 0.00 C ATOM 402 CD LYS A 26 61.241 -2.109 18.839 1.00 0.00 C ATOM 403 CE LYS A 26 59.773 -1.685 18.941 1.00 0.00 C ATOM 404 NZ LYS A 26 59.304 -1.863 20.343 1.00 0.00 N ATOM 0 H LYS A 26 61.376 -0.013 13.620 1.00 0.00 H new ATOM 0 HA LYS A 26 63.146 -1.591 15.258 1.00 0.00 H new ATOM 0 HB2 LYS A 26 62.016 -0.275 17.077 1.00 0.00 H new ATOM 0 HB3 LYS A 26 60.451 -0.787 16.478 1.00 0.00 H new ATOM 0 HG2 LYS A 26 60.948 -3.137 16.958 1.00 0.00 H new ATOM 0 HG3 LYS A 26 62.624 -2.768 17.312 1.00 0.00 H new ATOM 0 HD2 LYS A 26 61.411 -3.005 19.435 1.00 0.00 H new ATOM 0 HD3 LYS A 26 61.883 -1.328 19.247 1.00 0.00 H new ATOM 0 HE2 LYS A 26 59.662 -0.644 18.638 1.00 0.00 H new ATOM 0 HE3 LYS A 26 59.163 -2.281 18.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 58.307 -1.576 20.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 59.397 -2.862 20.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 59.880 -1.276 20.979 1.00 0.00 H new ATOM 418 N LEU A 27 62.032 -3.253 13.726 1.00 0.00 N ATOM 419 CA LEU A 27 61.352 -4.387 13.021 1.00 0.00 C ATOM 420 C LEU A 27 61.493 -5.651 13.881 1.00 0.00 C ATOM 421 O LEU A 27 62.571 -6.005 14.317 1.00 0.00 O ATOM 422 CB LEU A 27 62.010 -4.605 11.649 1.00 0.00 C ATOM 423 CG LEU A 27 61.374 -3.669 10.613 1.00 0.00 C ATOM 424 CD1 LEU A 27 61.580 -2.214 11.042 1.00 0.00 C ATOM 425 CD2 LEU A 27 62.034 -3.896 9.251 1.00 0.00 C ATOM 0 H LEU A 27 63.040 -3.196 13.581 1.00 0.00 H new ATOM 0 HA LEU A 27 60.296 -4.161 12.871 1.00 0.00 H new ATOM 0 HB2 LEU A 27 63.081 -4.415 11.715 1.00 0.00 H new ATOM 0 HB3 LEU A 27 61.889 -5.643 11.338 1.00 0.00 H new ATOM 0 HG LEU A 27 60.307 -3.878 10.542 1.00 0.00 H new ATOM 0 HD11 LEU A 27 61.128 -1.550 10.305 1.00 0.00 H new ATOM 0 HD12 LEU A 27 61.112 -2.051 12.013 1.00 0.00 H new ATOM 0 HD13 LEU A 27 62.647 -2.003 11.114 1.00 0.00 H new ATOM 0 HD21 LEU A 27 61.584 -3.232 8.513 1.00 0.00 H new ATOM 0 HD22 LEU A 27 63.101 -3.686 9.324 1.00 0.00 H new ATOM 0 HD23 LEU A 27 61.888 -4.932 8.944 1.00 0.00 H new ATOM 437 N LYS A 28 60.402 -6.318 14.137 1.00 0.00 N ATOM 438 CA LYS A 28 60.441 -7.550 14.983 1.00 0.00 C ATOM 439 C LYS A 28 60.747 -8.778 14.118 1.00 0.00 C ATOM 440 O LYS A 28 60.543 -8.776 12.920 1.00 0.00 O ATOM 441 CB LYS A 28 59.086 -7.722 15.676 1.00 0.00 C ATOM 442 CG LYS A 28 59.173 -8.825 16.735 1.00 0.00 C ATOM 443 CD LYS A 28 57.817 -8.967 17.429 1.00 0.00 C ATOM 444 CE LYS A 28 57.902 -10.056 18.500 1.00 0.00 C ATOM 445 NZ LYS A 28 56.655 -10.045 19.316 1.00 0.00 N ATOM 0 H LYS A 28 59.476 -6.062 13.795 1.00 0.00 H new ATOM 0 HA LYS A 28 61.227 -7.451 15.732 1.00 0.00 H new ATOM 0 HB2 LYS A 28 58.785 -6.783 16.141 1.00 0.00 H new ATOM 0 HB3 LYS A 28 58.322 -7.973 14.940 1.00 0.00 H new ATOM 0 HG2 LYS A 28 59.458 -9.769 16.271 1.00 0.00 H new ATOM 0 HG3 LYS A 28 59.945 -8.584 17.466 1.00 0.00 H new ATOM 0 HD2 LYS A 28 57.528 -8.019 17.882 1.00 0.00 H new ATOM 0 HD3 LYS A 28 57.048 -9.219 16.699 1.00 0.00 H new ATOM 0 HE2 LYS A 28 58.036 -11.032 18.033 1.00 0.00 H new ATOM 0 HE3 LYS A 28 58.769 -9.887 19.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 56.711 -10.785 20.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 56.547 -9.117 19.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 55.836 -10.226 18.701 1.00 0.00 H new ATOM 459 N LYS A 29 61.253 -9.825 14.718 1.00 0.00 N ATOM 460 CA LYS A 29 61.592 -11.048 13.937 1.00 0.00 C ATOM 461 C LYS A 29 60.358 -11.524 13.163 1.00 0.00 C ATOM 462 O LYS A 29 60.430 -11.818 11.986 1.00 0.00 O ATOM 463 CB LYS A 29 62.039 -12.146 14.906 1.00 0.00 C ATOM 464 CG LYS A 29 62.428 -13.401 14.121 1.00 0.00 C ATOM 465 CD LYS A 29 63.136 -14.392 15.051 1.00 0.00 C ATOM 466 CE LYS A 29 62.186 -14.837 16.167 1.00 0.00 C ATOM 467 NZ LYS A 29 62.725 -16.069 16.807 1.00 0.00 N ATOM 0 H LYS A 29 61.446 -9.884 15.718 1.00 0.00 H new ATOM 0 HA LYS A 29 62.393 -10.824 13.232 1.00 0.00 H new ATOM 0 HB2 LYS A 29 62.886 -11.799 15.498 1.00 0.00 H new ATOM 0 HB3 LYS A 29 61.235 -12.377 15.605 1.00 0.00 H new ATOM 0 HG2 LYS A 29 61.539 -13.863 13.690 1.00 0.00 H new ATOM 0 HG3 LYS A 29 63.083 -13.135 13.291 1.00 0.00 H new ATOM 0 HD2 LYS A 29 63.473 -15.259 14.483 1.00 0.00 H new ATOM 0 HD3 LYS A 29 64.023 -13.928 15.482 1.00 0.00 H new ATOM 0 HE2 LYS A 29 62.080 -14.045 16.908 1.00 0.00 H new ATOM 0 HE3 LYS A 29 61.193 -15.029 15.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 62.192 -16.270 17.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 62.631 -16.870 16.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 63.729 -15.928 17.041 1.00 0.00 H new ATOM 481 N SER A 30 59.220 -11.585 13.801 1.00 0.00 N ATOM 482 CA SER A 30 57.990 -12.020 13.079 1.00 0.00 C ATOM 483 C SER A 30 57.737 -11.047 11.926 1.00 0.00 C ATOM 484 O SER A 30 57.350 -11.428 10.840 1.00 0.00 O ATOM 485 CB SER A 30 56.798 -12.006 14.036 1.00 0.00 C ATOM 486 OG SER A 30 56.504 -10.665 14.405 1.00 0.00 O ATOM 0 H SER A 30 59.089 -11.354 14.786 1.00 0.00 H new ATOM 0 HA SER A 30 58.120 -13.031 12.694 1.00 0.00 H new ATOM 0 HB2 SER A 30 55.930 -12.462 13.560 1.00 0.00 H new ATOM 0 HB3 SER A 30 57.023 -12.598 14.923 1.00 0.00 H new ATOM 0 HG SER A 30 55.739 -10.654 15.017 1.00 0.00 H new ATOM 492 N GLU A 31 58.000 -9.793 12.160 1.00 0.00 N ATOM 493 CA GLU A 31 57.828 -8.775 11.086 1.00 0.00 C ATOM 494 C GLU A 31 58.917 -9.003 10.032 1.00 0.00 C ATOM 495 O GLU A 31 58.684 -8.915 8.842 1.00 0.00 O ATOM 496 CB GLU A 31 57.960 -7.367 11.675 1.00 0.00 C ATOM 497 CG GLU A 31 57.773 -6.329 10.565 1.00 0.00 C ATOM 498 CD GLU A 31 57.832 -4.924 11.165 1.00 0.00 C ATOM 499 OE1 GLU A 31 57.870 -4.820 12.380 1.00 0.00 O ATOM 500 OE2 GLU A 31 57.836 -3.976 10.399 1.00 0.00 O ATOM 0 H GLU A 31 58.328 -9.427 13.053 1.00 0.00 H new ATOM 0 HA GLU A 31 56.841 -8.869 10.634 1.00 0.00 H new ATOM 0 HB2 GLU A 31 57.215 -7.217 12.457 1.00 0.00 H new ATOM 0 HB3 GLU A 31 58.939 -7.246 12.140 1.00 0.00 H new ATOM 0 HG2 GLU A 31 58.549 -6.446 9.809 1.00 0.00 H new ATOM 0 HG3 GLU A 31 56.816 -6.483 10.066 1.00 0.00 H new ATOM 507 N LEU A 32 60.104 -9.309 10.481 1.00 0.00 N ATOM 508 CA LEU A 32 61.226 -9.564 9.533 1.00 0.00 C ATOM 509 C LEU A 32 60.860 -10.760 8.649 1.00 0.00 C ATOM 510 O LEU A 32 61.018 -10.732 7.444 1.00 0.00 O ATOM 511 CB LEU A 32 62.510 -9.869 10.318 1.00 0.00 C ATOM 512 CG LEU A 32 63.683 -10.126 9.357 1.00 0.00 C ATOM 513 CD1 LEU A 32 63.980 -8.858 8.537 1.00 0.00 C ATOM 514 CD2 LEU A 32 64.925 -10.509 10.174 1.00 0.00 C ATOM 0 H LEU A 32 60.346 -9.394 11.468 1.00 0.00 H new ATOM 0 HA LEU A 32 61.395 -8.684 8.913 1.00 0.00 H new ATOM 0 HB2 LEU A 32 62.748 -9.033 10.976 1.00 0.00 H new ATOM 0 HB3 LEU A 32 62.356 -10.741 10.954 1.00 0.00 H new ATOM 0 HG LEU A 32 63.422 -10.936 8.676 1.00 0.00 H new ATOM 0 HD11 LEU A 32 64.812 -9.049 7.859 1.00 0.00 H new ATOM 0 HD12 LEU A 32 63.097 -8.583 7.959 1.00 0.00 H new ATOM 0 HD13 LEU A 32 64.241 -8.042 9.211 1.00 0.00 H new ATOM 0 HD21 LEU A 32 65.761 -10.693 9.500 1.00 0.00 H new ATOM 0 HD22 LEU A 32 65.179 -9.695 10.853 1.00 0.00 H new ATOM 0 HD23 LEU A 32 64.718 -11.411 10.750 1.00 0.00 H new ATOM 526 N LYS A 33 60.370 -11.813 9.246 1.00 0.00 N ATOM 527 CA LYS A 33 59.988 -13.019 8.454 1.00 0.00 C ATOM 528 C LYS A 33 58.892 -12.651 7.451 1.00 0.00 C ATOM 529 O LYS A 33 58.896 -13.094 6.320 1.00 0.00 O ATOM 530 CB LYS A 33 59.466 -14.104 9.405 1.00 0.00 C ATOM 531 CG LYS A 33 59.117 -15.369 8.609 1.00 0.00 C ATOM 532 CD LYS A 33 58.594 -16.452 9.557 1.00 0.00 C ATOM 533 CE LYS A 33 58.269 -17.713 8.753 1.00 0.00 C ATOM 534 NZ LYS A 33 57.689 -18.748 9.656 1.00 0.00 N ATOM 0 H LYS A 33 60.217 -11.891 10.251 1.00 0.00 H new ATOM 0 HA LYS A 33 60.859 -13.391 7.915 1.00 0.00 H new ATOM 0 HB2 LYS A 33 60.220 -14.334 10.158 1.00 0.00 H new ATOM 0 HB3 LYS A 33 58.585 -13.742 9.935 1.00 0.00 H new ATOM 0 HG2 LYS A 33 58.364 -15.139 7.855 1.00 0.00 H new ATOM 0 HG3 LYS A 33 59.998 -15.731 8.080 1.00 0.00 H new ATOM 0 HD2 LYS A 33 59.340 -16.675 10.320 1.00 0.00 H new ATOM 0 HD3 LYS A 33 57.703 -16.098 10.076 1.00 0.00 H new ATOM 0 HE2 LYS A 33 57.565 -17.476 7.955 1.00 0.00 H new ATOM 0 HE3 LYS A 33 59.172 -18.096 8.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 57.469 -19.604 9.107 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 58.375 -18.982 10.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 56.818 -18.381 10.090 1.00 0.00 H new ATOM 548 N GLU A 34 57.946 -11.854 7.865 1.00 0.00 N ATOM 549 CA GLU A 34 56.845 -11.466 6.939 1.00 0.00 C ATOM 550 C GLU A 34 57.434 -10.749 5.725 1.00 0.00 C ATOM 551 O GLU A 34 57.059 -10.998 4.599 1.00 0.00 O ATOM 552 CB GLU A 34 55.858 -10.542 7.664 1.00 0.00 C ATOM 553 CG GLU A 34 54.714 -10.150 6.718 1.00 0.00 C ATOM 554 CD GLU A 34 53.737 -9.230 7.454 1.00 0.00 C ATOM 555 OE1 GLU A 34 53.875 -9.092 8.658 1.00 0.00 O ATOM 556 OE2 GLU A 34 52.864 -8.683 6.800 1.00 0.00 O ATOM 0 H GLU A 34 57.888 -11.455 8.802 1.00 0.00 H new ATOM 0 HA GLU A 34 56.315 -12.360 6.609 1.00 0.00 H new ATOM 0 HB2 GLU A 34 55.457 -11.044 8.545 1.00 0.00 H new ATOM 0 HB3 GLU A 34 56.374 -9.648 8.014 1.00 0.00 H new ATOM 0 HG2 GLU A 34 55.112 -9.646 5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 34 54.196 -11.042 6.367 1.00 0.00 H new ATOM 563 N LEU A 35 58.348 -9.851 5.957 1.00 0.00 N ATOM 564 CA LEU A 35 58.970 -9.093 4.833 1.00 0.00 C ATOM 565 C LEU A 35 59.667 -10.058 3.861 1.00 0.00 C ATOM 566 O LEU A 35 59.524 -9.949 2.659 1.00 0.00 O ATOM 567 CB LEU A 35 59.992 -8.103 5.419 1.00 0.00 C ATOM 568 CG LEU A 35 60.675 -7.282 4.309 1.00 0.00 C ATOM 569 CD1 LEU A 35 59.678 -6.296 3.688 1.00 0.00 C ATOM 570 CD2 LEU A 35 61.839 -6.493 4.919 1.00 0.00 C ATOM 0 H LEU A 35 58.695 -9.606 6.884 1.00 0.00 H new ATOM 0 HA LEU A 35 58.201 -8.552 4.282 1.00 0.00 H new ATOM 0 HB2 LEU A 35 59.492 -7.431 6.116 1.00 0.00 H new ATOM 0 HB3 LEU A 35 60.746 -8.648 5.987 1.00 0.00 H new ATOM 0 HG LEU A 35 61.037 -7.959 3.535 1.00 0.00 H new ATOM 0 HD11 LEU A 35 60.174 -5.722 2.905 1.00 0.00 H new ATOM 0 HD12 LEU A 35 58.841 -6.847 3.259 1.00 0.00 H new ATOM 0 HD13 LEU A 35 59.310 -5.617 4.458 1.00 0.00 H new ATOM 0 HD21 LEU A 35 62.329 -5.908 4.141 1.00 0.00 H new ATOM 0 HD22 LEU A 35 61.460 -5.824 5.691 1.00 0.00 H new ATOM 0 HD23 LEU A 35 62.557 -7.185 5.359 1.00 0.00 H new ATOM 582 N ILE A 36 60.440 -10.984 4.367 1.00 0.00 N ATOM 583 CA ILE A 36 61.171 -11.926 3.465 1.00 0.00 C ATOM 584 C ILE A 36 60.196 -12.734 2.602 1.00 0.00 C ATOM 585 O ILE A 36 60.360 -12.833 1.402 1.00 0.00 O ATOM 586 CB ILE A 36 62.016 -12.892 4.303 1.00 0.00 C ATOM 587 CG1 ILE A 36 63.044 -12.095 5.111 1.00 0.00 C ATOM 588 CG2 ILE A 36 62.743 -13.865 3.373 1.00 0.00 C ATOM 589 CD1 ILE A 36 63.729 -13.008 6.134 1.00 0.00 C ATOM 0 H ILE A 36 60.597 -11.129 5.364 1.00 0.00 H new ATOM 0 HA ILE A 36 61.812 -11.337 2.809 1.00 0.00 H new ATOM 0 HB ILE A 36 61.371 -13.450 4.982 1.00 0.00 H new ATOM 0 HG12 ILE A 36 63.788 -11.662 4.442 1.00 0.00 H new ATOM 0 HG13 ILE A 36 62.554 -11.266 5.622 1.00 0.00 H new ATOM 0 HG21 ILE A 36 63.345 -14.554 3.966 1.00 0.00 H new ATOM 0 HG22 ILE A 36 62.012 -14.429 2.793 1.00 0.00 H new ATOM 0 HG23 ILE A 36 63.390 -13.307 2.697 1.00 0.00 H new ATOM 0 HD11 ILE A 36 64.458 -12.433 6.704 1.00 0.00 H new ATOM 0 HD12 ILE A 36 62.982 -13.420 6.812 1.00 0.00 H new ATOM 0 HD13 ILE A 36 64.235 -13.822 5.614 1.00 0.00 H new ATOM 601 N ASN A 37 59.200 -13.326 3.192 1.00 0.00 N ATOM 602 CA ASN A 37 58.239 -14.141 2.395 1.00 0.00 C ATOM 603 C ASN A 37 57.561 -13.266 1.333 1.00 0.00 C ATOM 604 O ASN A 37 57.334 -13.688 0.216 1.00 0.00 O ATOM 605 CB ASN A 37 57.174 -14.722 3.328 1.00 0.00 C ATOM 606 CG ASN A 37 56.198 -15.586 2.527 1.00 0.00 C ATOM 607 OD1 ASN A 37 56.605 -16.350 1.674 1.00 0.00 O ATOM 608 ND2 ASN A 37 54.918 -15.499 2.766 1.00 0.00 N ATOM 0 H ASN A 37 59.007 -13.283 4.193 1.00 0.00 H new ATOM 0 HA ASN A 37 58.779 -14.948 1.900 1.00 0.00 H new ATOM 0 HB2 ASN A 37 57.647 -15.319 4.107 1.00 0.00 H new ATOM 0 HB3 ASN A 37 56.636 -13.916 3.827 1.00 0.00 H new ATOM 0 HD21 ASN A 37 54.260 -16.072 2.237 1.00 0.00 H new ATOM 0 HD22 ASN A 37 54.575 -14.858 3.482 1.00 0.00 H new ATOM 615 N ASN A 38 57.221 -12.059 1.683 1.00 0.00 N ATOM 616 CA ASN A 38 56.541 -11.156 0.709 1.00 0.00 C ATOM 617 C ASN A 38 57.542 -10.595 -0.311 1.00 0.00 C ATOM 618 O ASN A 38 57.280 -10.560 -1.497 1.00 0.00 O ATOM 619 CB ASN A 38 55.908 -9.994 1.475 1.00 0.00 C ATOM 620 CG ASN A 38 54.725 -10.506 2.298 1.00 0.00 C ATOM 621 OD1 ASN A 38 54.105 -11.489 1.945 1.00 0.00 O ATOM 622 ND2 ASN A 38 54.386 -9.879 3.391 1.00 0.00 N ATOM 0 H ASN A 38 57.384 -11.655 2.605 1.00 0.00 H new ATOM 0 HA ASN A 38 55.782 -11.726 0.173 1.00 0.00 H new ATOM 0 HB2 ASN A 38 56.647 -9.532 2.130 1.00 0.00 H new ATOM 0 HB3 ASN A 38 55.574 -9.225 0.778 1.00 0.00 H new ATOM 0 HD21 ASN A 38 53.601 -10.214 3.949 1.00 0.00 H new ATOM 0 HD22 ASN A 38 54.906 -9.053 3.688 1.00 0.00 H new ATOM 629 N GLU A 39 58.663 -10.107 0.149 1.00 0.00 N ATOM 630 CA GLU A 39 59.657 -9.488 -0.785 1.00 0.00 C ATOM 631 C GLU A 39 60.576 -10.525 -1.441 1.00 0.00 C ATOM 632 O GLU A 39 60.497 -10.765 -2.630 1.00 0.00 O ATOM 633 CB GLU A 39 60.516 -8.481 -0.015 1.00 0.00 C ATOM 634 CG GLU A 39 59.669 -7.265 0.363 1.00 0.00 C ATOM 635 CD GLU A 39 59.336 -6.460 -0.896 1.00 0.00 C ATOM 636 OE1 GLU A 39 60.103 -6.531 -1.841 1.00 0.00 O ATOM 637 OE2 GLU A 39 58.319 -5.785 -0.892 1.00 0.00 O ATOM 0 H GLU A 39 58.936 -10.109 1.132 1.00 0.00 H new ATOM 0 HA GLU A 39 59.093 -8.997 -1.578 1.00 0.00 H new ATOM 0 HB2 GLU A 39 60.923 -8.947 0.883 1.00 0.00 H new ATOM 0 HB3 GLU A 39 61.364 -8.170 -0.625 1.00 0.00 H new ATOM 0 HG2 GLU A 39 58.751 -7.587 0.854 1.00 0.00 H new ATOM 0 HG3 GLU A 39 60.209 -6.640 1.074 1.00 0.00 H new ATOM 644 N LEU A 40 61.486 -11.103 -0.701 1.00 0.00 N ATOM 645 CA LEU A 40 62.442 -12.074 -1.322 1.00 0.00 C ATOM 646 C LEU A 40 61.921 -13.507 -1.240 1.00 0.00 C ATOM 647 O LEU A 40 61.701 -14.046 -0.174 1.00 0.00 O ATOM 648 CB LEU A 40 63.784 -11.997 -0.589 1.00 0.00 C ATOM 649 CG LEU A 40 64.327 -10.561 -0.632 1.00 0.00 C ATOM 650 CD1 LEU A 40 65.662 -10.509 0.116 1.00 0.00 C ATOM 651 CD2 LEU A 40 64.535 -10.116 -2.091 1.00 0.00 C ATOM 0 H LEU A 40 61.610 -10.948 0.299 1.00 0.00 H new ATOM 0 HA LEU A 40 62.556 -11.808 -2.373 1.00 0.00 H new ATOM 0 HB2 LEU A 40 63.661 -12.317 0.446 1.00 0.00 H new ATOM 0 HB3 LEU A 40 64.499 -12.678 -1.050 1.00 0.00 H new ATOM 0 HG LEU A 40 63.610 -9.890 -0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 40 66.054 -9.492 0.090 1.00 0.00 H new ATOM 0 HD12 LEU A 40 65.511 -10.813 1.152 1.00 0.00 H new ATOM 0 HD13 LEU A 40 66.373 -11.184 -0.361 1.00 0.00 H new ATOM 0 HD21 LEU A 40 64.920 -9.096 -2.109 1.00 0.00 H new ATOM 0 HD22 LEU A 40 65.248 -10.782 -2.576 1.00 0.00 H new ATOM 0 HD23 LEU A 40 63.584 -10.154 -2.622 1.00 0.00 H new ATOM 663 N SER A 41 61.761 -14.135 -2.376 1.00 0.00 N ATOM 664 CA SER A 41 61.296 -15.552 -2.418 1.00 0.00 C ATOM 665 C SER A 41 62.163 -16.305 -3.426 1.00 0.00 C ATOM 666 O SER A 41 62.683 -17.369 -3.153 1.00 0.00 O ATOM 667 CB SER A 41 59.833 -15.607 -2.862 1.00 0.00 C ATOM 668 OG SER A 41 59.031 -14.898 -1.927 1.00 0.00 O ATOM 0 H SER A 41 61.936 -13.718 -3.290 1.00 0.00 H new ATOM 0 HA SER A 41 61.379 -16.004 -1.429 1.00 0.00 H new ATOM 0 HB2 SER A 41 59.726 -15.171 -3.855 1.00 0.00 H new ATOM 0 HB3 SER A 41 59.501 -16.643 -2.932 1.00 0.00 H new ATOM 0 HG SER A 41 58.093 -14.930 -2.210 1.00 0.00 H new ATOM 674 N HIS A 42 62.329 -15.743 -4.594 1.00 0.00 N ATOM 675 CA HIS A 42 63.167 -16.397 -5.638 1.00 0.00 C ATOM 676 C HIS A 42 64.651 -16.173 -5.317 1.00 0.00 C ATOM 677 O HIS A 42 65.512 -16.878 -5.805 1.00 0.00 O ATOM 678 CB HIS A 42 62.839 -15.789 -7.004 1.00 0.00 C ATOM 679 CG HIS A 42 61.439 -16.173 -7.410 1.00 0.00 C ATOM 680 ND1 HIS A 42 60.604 -15.297 -8.091 1.00 0.00 N ATOM 681 CD2 HIS A 42 60.712 -17.328 -7.241 1.00 0.00 C ATOM 682 CE1 HIS A 42 59.436 -15.932 -8.304 1.00 0.00 C ATOM 683 NE2 HIS A 42 59.452 -17.168 -7.806 1.00 0.00 N ATOM 0 H HIS A 42 61.916 -14.852 -4.870 1.00 0.00 H new ATOM 0 HA HIS A 42 62.960 -17.467 -5.657 1.00 0.00 H new ATOM 0 HB2 HIS A 42 62.930 -14.704 -6.961 1.00 0.00 H new ATOM 0 HB3 HIS A 42 63.553 -16.140 -7.749 1.00 0.00 H new ATOM 0 HD2 HIS A 42 61.065 -18.221 -6.746 1.00 0.00 H new ATOM 0 HE1 HIS A 42 58.591 -15.494 -8.815 1.00 0.00 H new ATOM 0 HE2 HIS A 42 58.697 -17.854 -7.834 1.00 0.00 H new ATOM 692 N PHE A 43 64.955 -15.185 -4.512 1.00 0.00 N ATOM 693 CA PHE A 43 66.386 -14.898 -4.169 1.00 0.00 C ATOM 694 C PHE A 43 66.723 -15.492 -2.798 1.00 0.00 C ATOM 695 O PHE A 43 67.876 -15.676 -2.460 1.00 0.00 O ATOM 696 CB PHE A 43 66.599 -13.383 -4.114 1.00 0.00 C ATOM 697 CG PHE A 43 66.522 -12.797 -5.505 1.00 0.00 C ATOM 698 CD1 PHE A 43 65.292 -12.363 -6.016 1.00 0.00 C ATOM 699 CD2 PHE A 43 67.683 -12.679 -6.278 1.00 0.00 C ATOM 700 CE1 PHE A 43 65.226 -11.811 -7.302 1.00 0.00 C ATOM 701 CE2 PHE A 43 67.615 -12.128 -7.564 1.00 0.00 C ATOM 702 CZ PHE A 43 66.387 -11.695 -8.076 1.00 0.00 C ATOM 0 H PHE A 43 64.274 -14.563 -4.076 1.00 0.00 H new ATOM 0 HA PHE A 43 67.030 -15.342 -4.928 1.00 0.00 H new ATOM 0 HB2 PHE A 43 65.844 -12.925 -3.476 1.00 0.00 H new ATOM 0 HB3 PHE A 43 67.569 -13.160 -3.670 1.00 0.00 H new ATOM 0 HD1 PHE A 43 64.396 -12.454 -5.420 1.00 0.00 H new ATOM 0 HD2 PHE A 43 68.631 -13.013 -5.883 1.00 0.00 H new ATOM 0 HE1 PHE A 43 64.279 -11.475 -7.697 1.00 0.00 H new ATOM 0 HE2 PHE A 43 68.511 -12.037 -8.161 1.00 0.00 H new ATOM 0 HZ PHE A 43 66.335 -11.271 -9.068 1.00 0.00 H new ATOM 712 N LEU A 44 65.732 -15.808 -2.010 1.00 0.00 N ATOM 713 CA LEU A 44 66.009 -16.403 -0.670 1.00 0.00 C ATOM 714 C LEU A 44 64.778 -17.166 -0.192 1.00 0.00 C ATOM 715 O LEU A 44 63.664 -16.691 -0.280 1.00 0.00 O ATOM 716 CB LEU A 44 66.344 -15.298 0.336 1.00 0.00 C ATOM 717 CG LEU A 44 66.631 -15.897 1.725 1.00 0.00 C ATOM 718 CD1 LEU A 44 67.859 -16.822 1.663 1.00 0.00 C ATOM 719 CD2 LEU A 44 66.894 -14.757 2.715 1.00 0.00 C ATOM 0 H LEU A 44 64.745 -15.681 -2.234 1.00 0.00 H new ATOM 0 HA LEU A 44 66.857 -17.083 -0.749 1.00 0.00 H new ATOM 0 HB2 LEU A 44 67.211 -14.735 -0.009 1.00 0.00 H new ATOM 0 HB3 LEU A 44 65.514 -14.595 0.402 1.00 0.00 H new ATOM 0 HG LEU A 44 65.770 -16.481 2.051 1.00 0.00 H new ATOM 0 HD11 LEU A 44 68.051 -17.239 2.652 1.00 0.00 H new ATOM 0 HD12 LEU A 44 67.669 -17.632 0.958 1.00 0.00 H new ATOM 0 HD13 LEU A 44 68.728 -16.252 1.335 1.00 0.00 H new ATOM 0 HD21 LEU A 44 67.098 -15.172 3.702 1.00 0.00 H new ATOM 0 HD22 LEU A 44 67.753 -14.176 2.381 1.00 0.00 H new ATOM 0 HD23 LEU A 44 66.018 -14.111 2.767 1.00 0.00 H new ATOM 731 N GLU A 45 64.978 -18.337 0.328 1.00 0.00 N ATOM 732 CA GLU A 45 63.830 -19.133 0.832 1.00 0.00 C ATOM 733 C GLU A 45 64.372 -20.357 1.579 1.00 0.00 C ATOM 734 O GLU A 45 65.277 -20.250 2.381 1.00 0.00 O ATOM 735 CB GLU A 45 62.958 -19.576 -0.353 1.00 0.00 C ATOM 736 CG GLU A 45 61.541 -19.911 0.132 1.00 0.00 C ATOM 737 CD GLU A 45 60.655 -20.240 -1.070 1.00 0.00 C ATOM 738 OE1 GLU A 45 61.172 -20.255 -2.176 1.00 0.00 O ATOM 739 OE2 GLU A 45 59.476 -20.477 -0.865 1.00 0.00 O ATOM 0 H GLU A 45 65.891 -18.781 0.427 1.00 0.00 H new ATOM 0 HA GLU A 45 63.222 -18.534 1.510 1.00 0.00 H new ATOM 0 HB2 GLU A 45 62.917 -18.784 -1.101 1.00 0.00 H new ATOM 0 HB3 GLU A 45 63.401 -20.447 -0.835 1.00 0.00 H new ATOM 0 HG2 GLU A 45 61.571 -20.758 0.818 1.00 0.00 H new ATOM 0 HG3 GLU A 45 61.125 -19.068 0.684 1.00 0.00 H new ATOM 746 N GLU A 46 63.834 -21.515 1.320 1.00 0.00 N ATOM 747 CA GLU A 46 64.321 -22.743 2.012 1.00 0.00 C ATOM 748 C GLU A 46 64.284 -22.531 3.528 1.00 0.00 C ATOM 749 O GLU A 46 65.065 -23.104 4.262 1.00 0.00 O ATOM 750 CB GLU A 46 65.755 -23.060 1.571 1.00 0.00 C ATOM 751 CG GLU A 46 65.765 -23.399 0.079 1.00 0.00 C ATOM 752 CD GLU A 46 65.062 -24.738 -0.148 1.00 0.00 C ATOM 753 OE1 GLU A 46 64.956 -25.499 0.799 1.00 0.00 O ATOM 754 OE2 GLU A 46 64.641 -24.979 -1.268 1.00 0.00 O ATOM 0 H GLU A 46 63.074 -21.666 0.656 1.00 0.00 H new ATOM 0 HA GLU A 46 63.674 -23.579 1.748 1.00 0.00 H new ATOM 0 HB2 GLU A 46 66.404 -22.206 1.765 1.00 0.00 H new ATOM 0 HB3 GLU A 46 66.148 -23.897 2.148 1.00 0.00 H new ATOM 0 HG2 GLU A 46 65.264 -22.613 -0.486 1.00 0.00 H new ATOM 0 HG3 GLU A 46 66.791 -23.449 -0.286 1.00 0.00 H new ATOM 761 N ILE A 47 63.371 -21.724 4.007 1.00 0.00 N ATOM 762 CA ILE A 47 63.271 -21.487 5.481 1.00 0.00 C ATOM 763 C ILE A 47 62.212 -22.429 6.053 1.00 0.00 C ATOM 764 O ILE A 47 61.047 -22.346 5.717 1.00 0.00 O ATOM 765 CB ILE A 47 62.862 -20.034 5.739 1.00 0.00 C ATOM 766 CG1 ILE A 47 63.983 -19.101 5.276 1.00 0.00 C ATOM 767 CG2 ILE A 47 62.619 -19.834 7.237 1.00 0.00 C ATOM 768 CD1 ILE A 47 63.492 -17.652 5.297 1.00 0.00 C ATOM 0 H ILE A 47 62.690 -21.218 3.441 1.00 0.00 H new ATOM 0 HA ILE A 47 64.233 -21.675 5.958 1.00 0.00 H new ATOM 0 HB ILE A 47 61.949 -19.808 5.188 1.00 0.00 H new ATOM 0 HG12 ILE A 47 64.851 -19.210 5.926 1.00 0.00 H new ATOM 0 HG13 ILE A 47 64.302 -19.372 4.270 1.00 0.00 H new ATOM 0 HG21 ILE A 47 62.328 -18.800 7.424 1.00 0.00 H new ATOM 0 HG22 ILE A 47 61.823 -20.501 7.569 1.00 0.00 H new ATOM 0 HG23 ILE A 47 63.533 -20.058 7.787 1.00 0.00 H new ATOM 0 HD11 ILE A 47 64.294 -16.991 4.967 1.00 0.00 H new ATOM 0 HD12 ILE A 47 62.637 -17.548 4.629 1.00 0.00 H new ATOM 0 HD13 ILE A 47 63.195 -17.383 6.311 1.00 0.00 H new ATOM 780 N LYS A 48 62.609 -23.340 6.901 1.00 0.00 N ATOM 781 CA LYS A 48 61.633 -24.307 7.484 1.00 0.00 C ATOM 782 C LYS A 48 61.035 -23.753 8.777 1.00 0.00 C ATOM 783 O LYS A 48 59.919 -23.273 8.802 1.00 0.00 O ATOM 784 CB LYS A 48 62.346 -25.629 7.781 1.00 0.00 C ATOM 785 CG LYS A 48 62.700 -26.317 6.462 1.00 0.00 C ATOM 786 CD LYS A 48 63.625 -27.511 6.733 1.00 0.00 C ATOM 787 CE LYS A 48 62.858 -28.616 7.467 1.00 0.00 C ATOM 788 NZ LYS A 48 63.604 -29.902 7.342 1.00 0.00 N ATOM 0 H LYS A 48 63.572 -23.457 7.217 1.00 0.00 H new ATOM 0 HA LYS A 48 60.828 -24.469 6.767 1.00 0.00 H new ATOM 0 HB2 LYS A 48 63.249 -25.446 8.363 1.00 0.00 H new ATOM 0 HB3 LYS A 48 61.705 -26.275 8.381 1.00 0.00 H new ATOM 0 HG2 LYS A 48 61.792 -26.654 5.962 1.00 0.00 H new ATOM 0 HG3 LYS A 48 63.190 -25.610 5.792 1.00 0.00 H new ATOM 0 HD2 LYS A 48 64.020 -27.895 5.793 1.00 0.00 H new ATOM 0 HD3 LYS A 48 64.478 -27.191 7.331 1.00 0.00 H new ATOM 0 HE2 LYS A 48 62.737 -28.354 8.518 1.00 0.00 H new ATOM 0 HE3 LYS A 48 61.858 -28.721 7.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 63.085 -30.654 7.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 63.698 -30.153 6.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 64.549 -29.797 7.762 1.00 0.00 H new ATOM 802 N GLU A 49 61.760 -23.850 9.862 1.00 0.00 N ATOM 803 CA GLU A 49 61.233 -23.369 11.177 1.00 0.00 C ATOM 804 C GLU A 49 61.842 -22.011 11.541 1.00 0.00 C ATOM 805 O GLU A 49 62.808 -21.565 10.956 1.00 0.00 O ATOM 806 CB GLU A 49 61.598 -24.385 12.257 1.00 0.00 C ATOM 807 CG GLU A 49 60.985 -25.743 11.916 1.00 0.00 C ATOM 808 CD GLU A 49 61.355 -26.753 13.004 1.00 0.00 C ATOM 809 OE1 GLU A 49 62.180 -26.418 13.838 1.00 0.00 O ATOM 810 OE2 GLU A 49 60.802 -27.840 12.988 1.00 0.00 O ATOM 0 H GLU A 49 62.700 -24.244 9.895 1.00 0.00 H new ATOM 0 HA GLU A 49 60.151 -23.259 11.105 1.00 0.00 H new ATOM 0 HB2 GLU A 49 62.682 -24.474 12.335 1.00 0.00 H new ATOM 0 HB3 GLU A 49 61.235 -24.045 13.227 1.00 0.00 H new ATOM 0 HG2 GLU A 49 59.901 -25.656 11.838 1.00 0.00 H new ATOM 0 HG3 GLU A 49 61.348 -26.086 10.947 1.00 0.00 H new ATOM 817 N GLN A 50 61.271 -21.361 12.518 1.00 0.00 N ATOM 818 CA GLN A 50 61.782 -20.032 12.959 1.00 0.00 C ATOM 819 C GLN A 50 63.235 -20.178 13.426 1.00 0.00 C ATOM 820 O GLN A 50 64.064 -19.323 13.194 1.00 0.00 O ATOM 821 CB GLN A 50 60.908 -19.531 14.115 1.00 0.00 C ATOM 822 CG GLN A 50 61.371 -18.146 14.567 1.00 0.00 C ATOM 823 CD GLN A 50 60.420 -17.623 15.647 1.00 0.00 C ATOM 824 OE1 GLN A 50 59.439 -16.971 15.345 1.00 0.00 O ATOM 825 NE2 GLN A 50 60.674 -17.873 16.903 1.00 0.00 N ATOM 0 H GLN A 50 60.461 -21.700 13.037 1.00 0.00 H new ATOM 0 HA GLN A 50 61.744 -19.319 12.135 1.00 0.00 H new ATOM 0 HB2 GLN A 50 59.865 -19.489 13.800 1.00 0.00 H new ATOM 0 HB3 GLN A 50 60.961 -20.230 14.950 1.00 0.00 H new ATOM 0 HG2 GLN A 50 62.388 -18.199 14.956 1.00 0.00 H new ATOM 0 HG3 GLN A 50 61.389 -17.461 13.719 1.00 0.00 H new ATOM 0 HE21 GLN A 50 61.496 -18.420 17.158 1.00 0.00 H new ATOM 0 HE22 GLN A 50 60.050 -17.522 17.629 1.00 0.00 H new ATOM 834 N GLU A 51 63.547 -21.260 14.078 1.00 0.00 N ATOM 835 CA GLU A 51 64.950 -21.465 14.553 1.00 0.00 C ATOM 836 C GLU A 51 65.918 -21.170 13.400 1.00 0.00 C ATOM 837 O GLU A 51 67.017 -20.694 13.607 1.00 0.00 O ATOM 838 CB GLU A 51 65.141 -22.908 15.032 1.00 0.00 C ATOM 839 CG GLU A 51 64.397 -23.119 16.356 1.00 0.00 C ATOM 840 CD GLU A 51 62.889 -23.139 16.105 1.00 0.00 C ATOM 841 OE1 GLU A 51 62.503 -23.237 14.955 1.00 0.00 O ATOM 842 OE2 GLU A 51 62.147 -23.062 17.069 1.00 0.00 O ATOM 0 H GLU A 51 62.897 -22.012 14.304 1.00 0.00 H new ATOM 0 HA GLU A 51 65.151 -20.791 15.386 1.00 0.00 H new ATOM 0 HB2 GLU A 51 64.768 -23.603 14.280 1.00 0.00 H new ATOM 0 HB3 GLU A 51 66.202 -23.120 15.163 1.00 0.00 H new ATOM 0 HG2 GLU A 51 64.711 -24.057 16.815 1.00 0.00 H new ATOM 0 HG3 GLU A 51 64.648 -22.322 17.056 1.00 0.00 H new ATOM 849 N VAL A 52 65.506 -21.410 12.185 1.00 0.00 N ATOM 850 CA VAL A 52 66.385 -21.105 11.016 1.00 0.00 C ATOM 851 C VAL A 52 66.463 -19.581 10.850 1.00 0.00 C ATOM 852 O VAL A 52 67.487 -19.026 10.503 1.00 0.00 O ATOM 853 CB VAL A 52 65.791 -21.729 9.749 1.00 0.00 C ATOM 854 CG1 VAL A 52 66.632 -21.326 8.535 1.00 0.00 C ATOM 855 CG2 VAL A 52 65.790 -23.254 9.882 1.00 0.00 C ATOM 0 H VAL A 52 64.596 -21.805 11.949 1.00 0.00 H new ATOM 0 HA VAL A 52 67.381 -21.516 11.180 1.00 0.00 H new ATOM 0 HB VAL A 52 64.769 -21.374 9.617 1.00 0.00 H new ATOM 0 HG11 VAL A 52 66.208 -21.771 7.635 1.00 0.00 H new ATOM 0 HG12 VAL A 52 66.633 -20.240 8.437 1.00 0.00 H new ATOM 0 HG13 VAL A 52 67.655 -21.679 8.667 1.00 0.00 H new ATOM 0 HG21 VAL A 52 65.367 -23.698 8.980 1.00 0.00 H new ATOM 0 HG22 VAL A 52 66.812 -23.608 10.016 1.00 0.00 H new ATOM 0 HG23 VAL A 52 65.190 -23.544 10.745 1.00 0.00 H new ATOM 865 N VAL A 53 65.373 -18.914 11.118 1.00 0.00 N ATOM 866 CA VAL A 53 65.340 -17.423 11.003 1.00 0.00 C ATOM 867 C VAL A 53 66.250 -16.820 12.077 1.00 0.00 C ATOM 868 O VAL A 53 66.957 -15.860 11.842 1.00 0.00 O ATOM 869 CB VAL A 53 63.903 -16.921 11.181 1.00 0.00 C ATOM 870 CG1 VAL A 53 63.898 -15.394 11.310 1.00 0.00 C ATOM 871 CG2 VAL A 53 63.069 -17.329 9.964 1.00 0.00 C ATOM 0 H VAL A 53 64.495 -19.340 11.415 1.00 0.00 H new ATOM 0 HA VAL A 53 65.694 -17.120 10.018 1.00 0.00 H new ATOM 0 HB VAL A 53 63.478 -17.360 12.084 1.00 0.00 H new ATOM 0 HG11 VAL A 53 62.874 -15.043 11.436 1.00 0.00 H new ATOM 0 HG12 VAL A 53 64.492 -15.100 12.176 1.00 0.00 H new ATOM 0 HG13 VAL A 53 64.325 -14.951 10.410 1.00 0.00 H new ATOM 0 HG21 VAL A 53 62.046 -16.973 10.088 1.00 0.00 H new ATOM 0 HG22 VAL A 53 63.499 -16.890 9.064 1.00 0.00 H new ATOM 0 HG23 VAL A 53 63.067 -18.415 9.872 1.00 0.00 H new ATOM 881 N ASP A 54 66.232 -17.378 13.255 1.00 0.00 N ATOM 882 CA ASP A 54 67.089 -16.848 14.353 1.00 0.00 C ATOM 883 C ASP A 54 68.552 -16.927 13.928 1.00 0.00 C ATOM 884 O ASP A 54 69.338 -16.038 14.193 1.00 0.00 O ATOM 885 CB ASP A 54 66.883 -17.686 15.618 1.00 0.00 C ATOM 886 CG ASP A 54 65.489 -17.427 16.186 1.00 0.00 C ATOM 887 OD1 ASP A 54 64.951 -16.366 15.917 1.00 0.00 O ATOM 888 OD2 ASP A 54 64.986 -18.289 16.886 1.00 0.00 O ATOM 0 H ASP A 54 65.658 -18.183 13.506 1.00 0.00 H new ATOM 0 HA ASP A 54 66.818 -15.812 14.558 1.00 0.00 H new ATOM 0 HB2 ASP A 54 67.001 -18.745 15.388 1.00 0.00 H new ATOM 0 HB3 ASP A 54 67.641 -17.435 16.360 1.00 0.00 H new ATOM 893 N LYS A 55 68.924 -17.987 13.270 1.00 0.00 N ATOM 894 CA LYS A 55 70.336 -18.127 12.829 1.00 0.00 C ATOM 895 C LYS A 55 70.685 -16.961 11.901 1.00 0.00 C ATOM 896 O LYS A 55 71.699 -16.311 12.059 1.00 0.00 O ATOM 897 CB LYS A 55 70.488 -19.447 12.067 1.00 0.00 C ATOM 898 CG LYS A 55 71.939 -19.627 11.612 1.00 0.00 C ATOM 899 CD LYS A 55 72.075 -20.948 10.855 1.00 0.00 C ATOM 900 CE LYS A 55 73.522 -21.124 10.392 1.00 0.00 C ATOM 901 NZ LYS A 55 73.661 -22.421 9.673 1.00 0.00 N ATOM 0 H LYS A 55 68.311 -18.762 13.019 1.00 0.00 H new ATOM 0 HA LYS A 55 71.002 -18.121 13.692 1.00 0.00 H new ATOM 0 HB2 LYS A 55 70.192 -20.280 12.705 1.00 0.00 H new ATOM 0 HB3 LYS A 55 69.824 -19.456 11.203 1.00 0.00 H new ATOM 0 HG2 LYS A 55 72.236 -18.796 10.972 1.00 0.00 H new ATOM 0 HG3 LYS A 55 72.606 -19.619 12.474 1.00 0.00 H new ATOM 0 HD2 LYS A 55 71.784 -21.779 11.497 1.00 0.00 H new ATOM 0 HD3 LYS A 55 71.403 -20.958 9.996 1.00 0.00 H new ATOM 0 HE2 LYS A 55 73.808 -20.301 9.737 1.00 0.00 H new ATOM 0 HE3 LYS A 55 74.195 -21.098 11.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 74.645 -22.540 9.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 73.405 -23.201 10.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 73.030 -22.429 8.846 1.00 0.00 H new ATOM 915 N VAL A 56 69.853 -16.692 10.938 1.00 0.00 N ATOM 916 CA VAL A 56 70.131 -15.570 9.997 1.00 0.00 C ATOM 917 C VAL A 56 70.028 -14.230 10.733 1.00 0.00 C ATOM 918 O VAL A 56 70.820 -13.332 10.524 1.00 0.00 O ATOM 919 CB VAL A 56 69.105 -15.621 8.855 1.00 0.00 C ATOM 920 CG1 VAL A 56 69.196 -14.351 8.004 1.00 0.00 C ATOM 921 CG2 VAL A 56 69.395 -16.839 7.974 1.00 0.00 C ATOM 0 H VAL A 56 68.988 -17.202 10.759 1.00 0.00 H new ATOM 0 HA VAL A 56 71.139 -15.667 9.594 1.00 0.00 H new ATOM 0 HB VAL A 56 68.103 -15.694 9.279 1.00 0.00 H new ATOM 0 HG11 VAL A 56 68.464 -14.400 7.198 1.00 0.00 H new ATOM 0 HG12 VAL A 56 68.992 -13.480 8.627 1.00 0.00 H new ATOM 0 HG13 VAL A 56 70.197 -14.268 7.580 1.00 0.00 H new ATOM 0 HG21 VAL A 56 68.670 -16.881 7.161 1.00 0.00 H new ATOM 0 HG22 VAL A 56 70.400 -16.758 7.560 1.00 0.00 H new ATOM 0 HG23 VAL A 56 69.322 -17.747 8.573 1.00 0.00 H new ATOM 931 N MET A 57 69.050 -14.086 11.580 1.00 0.00 N ATOM 932 CA MET A 57 68.879 -12.800 12.318 1.00 0.00 C ATOM 933 C MET A 57 70.060 -12.544 13.260 1.00 0.00 C ATOM 934 O MET A 57 70.532 -11.432 13.384 1.00 0.00 O ATOM 935 CB MET A 57 67.585 -12.864 13.132 1.00 0.00 C ATOM 936 CG MET A 57 67.315 -11.506 13.779 1.00 0.00 C ATOM 937 SD MET A 57 65.698 -11.534 14.592 1.00 0.00 S ATOM 938 CE MET A 57 65.386 -9.752 14.535 1.00 0.00 C ATOM 0 H MET A 57 68.358 -14.804 11.796 1.00 0.00 H new ATOM 0 HA MET A 57 68.835 -11.985 11.596 1.00 0.00 H new ATOM 0 HB2 MET A 57 66.752 -13.142 12.487 1.00 0.00 H new ATOM 0 HB3 MET A 57 67.665 -13.634 13.900 1.00 0.00 H new ATOM 0 HG2 MET A 57 68.095 -11.276 14.505 1.00 0.00 H new ATOM 0 HG3 MET A 57 67.341 -10.720 13.024 1.00 0.00 H new ATOM 0 HE1 MET A 57 64.420 -9.537 14.993 1.00 0.00 H new ATOM 0 HE2 MET A 57 66.171 -9.228 15.080 1.00 0.00 H new ATOM 0 HE3 MET A 57 65.379 -9.417 13.498 1.00 0.00 H new ATOM 948 N GLU A 58 70.529 -13.554 13.940 1.00 0.00 N ATOM 949 CA GLU A 58 71.665 -13.345 14.887 1.00 0.00 C ATOM 950 C GLU A 58 72.886 -12.821 14.128 1.00 0.00 C ATOM 951 O GLU A 58 73.586 -11.941 14.588 1.00 0.00 O ATOM 952 CB GLU A 58 72.008 -14.673 15.569 1.00 0.00 C ATOM 953 CG GLU A 58 73.118 -14.454 16.602 1.00 0.00 C ATOM 954 CD GLU A 58 73.451 -15.785 17.281 1.00 0.00 C ATOM 955 OE1 GLU A 58 72.741 -16.747 17.037 1.00 0.00 O ATOM 956 OE2 GLU A 58 74.405 -15.817 18.040 1.00 0.00 O ATOM 0 H GLU A 58 70.179 -14.510 13.883 1.00 0.00 H new ATOM 0 HA GLU A 58 71.377 -12.613 15.642 1.00 0.00 H new ATOM 0 HB2 GLU A 58 71.122 -15.082 16.055 1.00 0.00 H new ATOM 0 HB3 GLU A 58 72.329 -15.402 14.825 1.00 0.00 H new ATOM 0 HG2 GLU A 58 74.006 -14.048 16.117 1.00 0.00 H new ATOM 0 HG3 GLU A 58 72.799 -13.724 17.346 1.00 0.00 H new ATOM 963 N THR A 59 73.138 -13.348 12.970 1.00 0.00 N ATOM 964 CA THR A 59 74.306 -12.882 12.171 1.00 0.00 C ATOM 965 C THR A 59 74.057 -11.457 11.669 1.00 0.00 C ATOM 966 O THR A 59 74.950 -10.633 11.633 1.00 0.00 O ATOM 967 CB THR A 59 74.516 -13.815 10.975 1.00 0.00 C ATOM 968 OG1 THR A 59 74.761 -15.135 11.440 1.00 0.00 O ATOM 969 CG2 THR A 59 75.709 -13.331 10.148 1.00 0.00 C ATOM 0 H THR A 59 72.584 -14.086 12.536 1.00 0.00 H new ATOM 0 HA THR A 59 75.196 -12.891 12.800 1.00 0.00 H new ATOM 0 HB THR A 59 73.622 -13.811 10.352 1.00 0.00 H new ATOM 0 HG1 THR A 59 73.908 -15.581 11.623 1.00 0.00 H new ATOM 0 HG21 THR A 59 75.856 -13.997 9.298 1.00 0.00 H new ATOM 0 HG22 THR A 59 75.516 -12.320 9.788 1.00 0.00 H new ATOM 0 HG23 THR A 59 76.605 -13.331 10.768 1.00 0.00 H new ATOM 977 N LEU A 60 72.847 -11.166 11.283 1.00 0.00 N ATOM 978 CA LEU A 60 72.534 -9.794 10.781 1.00 0.00 C ATOM 979 C LEU A 60 72.582 -8.785 11.927 1.00 0.00 C ATOM 980 O LEU A 60 73.050 -7.676 11.766 1.00 0.00 O ATOM 981 CB LEU A 60 71.136 -9.770 10.155 1.00 0.00 C ATOM 982 CG LEU A 60 71.100 -10.607 8.868 1.00 0.00 C ATOM 983 CD1 LEU A 60 69.640 -10.834 8.472 1.00 0.00 C ATOM 984 CD2 LEU A 60 71.815 -9.870 7.721 1.00 0.00 C ATOM 0 H LEU A 60 72.061 -11.815 11.292 1.00 0.00 H new ATOM 0 HA LEU A 60 73.278 -9.526 10.031 1.00 0.00 H new ATOM 0 HB2 LEU A 60 70.407 -10.158 10.867 1.00 0.00 H new ATOM 0 HB3 LEU A 60 70.849 -8.742 9.934 1.00 0.00 H new ATOM 0 HG LEU A 60 71.606 -11.556 9.048 1.00 0.00 H new ATOM 0 HD11 LEU A 60 69.599 -11.428 7.559 1.00 0.00 H new ATOM 0 HD12 LEU A 60 69.124 -11.364 9.273 1.00 0.00 H new ATOM 0 HD13 LEU A 60 69.155 -9.873 8.302 1.00 0.00 H new ATOM 0 HD21 LEU A 60 71.778 -10.480 6.818 1.00 0.00 H new ATOM 0 HD22 LEU A 60 71.319 -8.917 7.536 1.00 0.00 H new ATOM 0 HD23 LEU A 60 72.854 -9.691 7.996 1.00 0.00 H new ATOM 996 N ASP A 61 72.090 -9.147 13.079 1.00 0.00 N ATOM 997 CA ASP A 61 72.093 -8.189 14.222 1.00 0.00 C ATOM 998 C ASP A 61 73.526 -7.903 14.669 1.00 0.00 C ATOM 999 O ASP A 61 74.146 -8.688 15.359 1.00 0.00 O ATOM 1000 CB ASP A 61 71.302 -8.783 15.389 1.00 0.00 C ATOM 1001 CG ASP A 61 69.807 -8.764 15.061 1.00 0.00 C ATOM 1002 OD1 ASP A 61 69.418 -8.000 14.191 1.00 0.00 O ATOM 1003 OD2 ASP A 61 69.075 -9.508 15.690 1.00 0.00 O ATOM 0 H ASP A 61 71.687 -10.062 13.279 1.00 0.00 H new ATOM 0 HA ASP A 61 71.630 -7.256 13.902 1.00 0.00 H new ATOM 0 HB2 ASP A 61 71.629 -9.805 15.580 1.00 0.00 H new ATOM 0 HB3 ASP A 61 71.492 -8.212 16.298 1.00 0.00 H new ATOM 1008 N GLU A 62 74.051 -6.774 14.278 1.00 0.00 N ATOM 1009 CA GLU A 62 75.439 -6.414 14.674 1.00 0.00 C ATOM 1010 C GLU A 62 75.505 -6.214 16.188 1.00 0.00 C ATOM 1011 O GLU A 62 76.461 -6.594 16.834 1.00 0.00 O ATOM 1012 CB GLU A 62 75.839 -5.117 13.966 1.00 0.00 C ATOM 1013 CG GLU A 62 77.283 -4.754 14.316 1.00 0.00 C ATOM 1014 CD GLU A 62 77.667 -3.462 13.597 1.00 0.00 C ATOM 1015 OE1 GLU A 62 76.868 -2.989 12.807 1.00 0.00 O ATOM 1016 OE2 GLU A 62 78.756 -2.970 13.845 1.00 0.00 O ATOM 0 H GLU A 62 73.574 -6.083 13.698 1.00 0.00 H new ATOM 0 HA GLU A 62 76.122 -7.214 14.389 1.00 0.00 H new ATOM 0 HB2 GLU A 62 75.736 -5.235 12.887 1.00 0.00 H new ATOM 0 HB3 GLU A 62 75.170 -4.309 14.263 1.00 0.00 H new ATOM 0 HG2 GLU A 62 77.388 -4.629 15.394 1.00 0.00 H new ATOM 0 HG3 GLU A 62 77.954 -5.561 14.022 1.00 0.00 H new ATOM 1023 N ASP A 63 74.502 -5.600 16.760 1.00 0.00 N ATOM 1024 CA ASP A 63 74.510 -5.350 18.232 1.00 0.00 C ATOM 1025 C ASP A 63 73.868 -6.522 18.982 1.00 0.00 C ATOM 1026 O ASP A 63 73.955 -6.612 20.191 1.00 0.00 O ATOM 1027 CB ASP A 63 73.733 -4.063 18.522 1.00 0.00 C ATOM 1028 CG ASP A 63 72.310 -4.187 17.974 1.00 0.00 C ATOM 1029 OD1 ASP A 63 72.050 -5.147 17.267 1.00 0.00 O ATOM 1030 OD2 ASP A 63 71.505 -3.320 18.269 1.00 0.00 O ATOM 0 H ASP A 63 73.675 -5.260 16.269 1.00 0.00 H new ATOM 0 HA ASP A 63 75.541 -5.249 18.572 1.00 0.00 H new ATOM 0 HB2 ASP A 63 73.705 -3.878 19.596 1.00 0.00 H new ATOM 0 HB3 ASP A 63 74.237 -3.211 18.064 1.00 0.00 H new ATOM 1035 N GLY A 64 73.226 -7.422 18.288 1.00 0.00 N ATOM 1036 CA GLY A 64 72.591 -8.578 18.986 1.00 0.00 C ATOM 1037 C GLY A 64 71.415 -8.086 19.835 1.00 0.00 C ATOM 1038 O GLY A 64 71.095 -8.658 20.859 1.00 0.00 O ATOM 0 H GLY A 64 73.114 -7.408 17.274 1.00 0.00 H new ATOM 0 HA2 GLY A 64 72.244 -9.310 18.256 1.00 0.00 H new ATOM 0 HA3 GLY A 64 73.323 -9.080 19.618 1.00 0.00 H new ATOM 1042 N ASP A 65 70.784 -7.016 19.431 1.00 0.00 N ATOM 1043 CA ASP A 65 69.643 -6.474 20.228 1.00 0.00 C ATOM 1044 C ASP A 65 68.381 -7.309 19.985 1.00 0.00 C ATOM 1045 O ASP A 65 67.346 -7.062 20.572 1.00 0.00 O ATOM 1046 CB ASP A 65 69.383 -5.023 19.821 1.00 0.00 C ATOM 1047 CG ASP A 65 68.918 -4.974 18.365 1.00 0.00 C ATOM 1048 OD1 ASP A 65 69.154 -5.937 17.655 1.00 0.00 O ATOM 1049 OD2 ASP A 65 68.338 -3.971 17.982 1.00 0.00 O ATOM 0 H ASP A 65 71.008 -6.493 18.584 1.00 0.00 H new ATOM 0 HA ASP A 65 69.897 -6.519 21.287 1.00 0.00 H new ATOM 0 HB2 ASP A 65 68.626 -4.583 20.470 1.00 0.00 H new ATOM 0 HB3 ASP A 65 70.291 -4.432 19.944 1.00 0.00 H new ATOM 1054 N GLY A 66 68.460 -8.313 19.157 1.00 0.00 N ATOM 1055 CA GLY A 66 67.267 -9.181 18.918 1.00 0.00 C ATOM 1056 C GLY A 66 66.282 -8.531 17.938 1.00 0.00 C ATOM 1057 O GLY A 66 65.282 -9.124 17.585 1.00 0.00 O ATOM 0 H GLY A 66 69.297 -8.572 18.635 1.00 0.00 H new ATOM 0 HA2 GLY A 66 67.591 -10.144 18.524 1.00 0.00 H new ATOM 0 HA3 GLY A 66 66.763 -9.377 19.865 1.00 0.00 H new ATOM 1061 N GLU A 67 66.544 -7.330 17.489 1.00 0.00 N ATOM 1062 CA GLU A 67 65.618 -6.645 16.529 1.00 0.00 C ATOM 1063 C GLU A 67 66.449 -6.092 15.374 1.00 0.00 C ATOM 1064 O GLU A 67 67.655 -5.983 15.478 1.00 0.00 O ATOM 1065 CB GLU A 67 64.914 -5.486 17.236 1.00 0.00 C ATOM 1066 CG GLU A 67 63.928 -6.032 18.270 1.00 0.00 C ATOM 1067 CD GLU A 67 63.408 -4.877 19.128 1.00 0.00 C ATOM 1068 OE1 GLU A 67 63.911 -3.777 18.969 1.00 0.00 O ATOM 1069 OE2 GLU A 67 62.527 -5.115 19.937 1.00 0.00 O ATOM 0 H GLU A 67 67.368 -6.787 17.748 1.00 0.00 H new ATOM 0 HA GLU A 67 64.872 -7.350 16.161 1.00 0.00 H new ATOM 0 HB2 GLU A 67 65.649 -4.845 17.724 1.00 0.00 H new ATOM 0 HB3 GLU A 67 64.387 -4.870 16.508 1.00 0.00 H new ATOM 0 HG2 GLU A 67 63.098 -6.532 17.770 1.00 0.00 H new ATOM 0 HG3 GLU A 67 64.417 -6.776 18.899 1.00 0.00 H new ATOM 1076 N CYS A 68 65.832 -5.739 14.268 1.00 0.00 N ATOM 1077 CA CYS A 68 66.615 -5.191 13.111 1.00 0.00 C ATOM 1078 C CYS A 68 66.418 -3.671 13.022 1.00 0.00 C ATOM 1079 O CYS A 68 65.383 -3.190 12.602 1.00 0.00 O ATOM 1080 CB CYS A 68 66.115 -5.845 11.818 1.00 0.00 C ATOM 1081 SG CYS A 68 67.150 -5.316 10.432 1.00 0.00 S ATOM 0 H CYS A 68 64.825 -5.806 14.117 1.00 0.00 H new ATOM 0 HA CYS A 68 67.674 -5.406 13.253 1.00 0.00 H new ATOM 0 HB2 CYS A 68 66.143 -6.930 11.913 1.00 0.00 H new ATOM 0 HB3 CYS A 68 65.077 -5.568 11.636 1.00 0.00 H new ATOM 0 HG CYS A 68 66.511 -5.506 9.316 1.00 0.00 H new ATOM 1087 N ASP A 69 67.397 -2.913 13.446 1.00 0.00 N ATOM 1088 CA ASP A 69 67.272 -1.423 13.421 1.00 0.00 C ATOM 1089 C ASP A 69 67.332 -0.891 11.982 1.00 0.00 C ATOM 1090 O ASP A 69 67.530 -1.625 11.034 1.00 0.00 O ATOM 1091 CB ASP A 69 68.415 -0.812 14.239 1.00 0.00 C ATOM 1092 CG ASP A 69 68.064 0.626 14.633 1.00 0.00 C ATOM 1093 OD1 ASP A 69 67.077 1.136 14.128 1.00 0.00 O ATOM 1094 OD2 ASP A 69 68.785 1.190 15.439 1.00 0.00 O ATOM 0 H ASP A 69 68.283 -3.264 13.811 1.00 0.00 H new ATOM 0 HA ASP A 69 66.309 -1.145 13.850 1.00 0.00 H new ATOM 0 HB2 ASP A 69 68.594 -1.410 15.133 1.00 0.00 H new ATOM 0 HB3 ASP A 69 69.337 -0.824 13.657 1.00 0.00 H new ATOM 1099 N PHE A 70 67.163 0.397 11.834 1.00 0.00 N ATOM 1100 CA PHE A 70 67.208 1.025 10.479 1.00 0.00 C ATOM 1101 C PHE A 70 68.577 0.771 9.841 1.00 0.00 C ATOM 1102 O PHE A 70 68.680 0.360 8.704 1.00 0.00 O ATOM 1103 CB PHE A 70 66.989 2.535 10.605 1.00 0.00 C ATOM 1104 CG PHE A 70 66.929 3.153 9.228 1.00 0.00 C ATOM 1105 CD1 PHE A 70 68.103 3.588 8.599 1.00 0.00 C ATOM 1106 CD2 PHE A 70 65.695 3.296 8.580 1.00 0.00 C ATOM 1107 CE1 PHE A 70 68.042 4.164 7.323 1.00 0.00 C ATOM 1108 CE2 PHE A 70 65.635 3.873 7.306 1.00 0.00 C ATOM 1109 CZ PHE A 70 66.808 4.306 6.677 1.00 0.00 C ATOM 0 H PHE A 70 66.994 1.047 12.601 1.00 0.00 H new ATOM 0 HA PHE A 70 66.425 0.590 9.857 1.00 0.00 H new ATOM 0 HB2 PHE A 70 66.064 2.735 11.145 1.00 0.00 H new ATOM 0 HB3 PHE A 70 67.798 2.984 11.181 1.00 0.00 H new ATOM 0 HD1 PHE A 70 69.055 3.479 9.098 1.00 0.00 H new ATOM 0 HD2 PHE A 70 64.789 2.961 9.064 1.00 0.00 H new ATOM 0 HE1 PHE A 70 68.947 4.498 6.838 1.00 0.00 H new ATOM 0 HE2 PHE A 70 64.683 3.984 6.808 1.00 0.00 H new ATOM 0 HZ PHE A 70 66.761 4.750 5.693 1.00 0.00 H new ATOM 1119 N GLN A 71 69.630 1.046 10.556 1.00 0.00 N ATOM 1120 CA GLN A 71 70.984 0.845 9.962 1.00 0.00 C ATOM 1121 C GLN A 71 71.133 -0.629 9.571 1.00 0.00 C ATOM 1122 O GLN A 71 71.474 -0.946 8.449 1.00 0.00 O ATOM 1123 CB GLN A 71 72.062 1.222 10.981 1.00 0.00 C ATOM 1124 CG GLN A 71 71.932 2.705 11.337 1.00 0.00 C ATOM 1125 CD GLN A 71 73.002 3.079 12.364 1.00 0.00 C ATOM 1126 OE1 GLN A 71 73.512 2.226 13.065 1.00 0.00 O ATOM 1127 NE2 GLN A 71 73.368 4.326 12.485 1.00 0.00 N ATOM 0 H GLN A 71 69.616 1.397 11.514 1.00 0.00 H new ATOM 0 HA GLN A 71 71.099 1.477 9.082 1.00 0.00 H new ATOM 0 HB2 GLN A 71 71.959 0.611 11.878 1.00 0.00 H new ATOM 0 HB3 GLN A 71 73.052 1.021 10.571 1.00 0.00 H new ATOM 0 HG2 GLN A 71 72.043 3.316 10.441 1.00 0.00 H new ATOM 0 HG3 GLN A 71 70.940 2.908 11.740 1.00 0.00 H new ATOM 0 HE21 GLN A 71 72.941 5.042 11.898 1.00 0.00 H new ATOM 0 HE22 GLN A 71 74.081 4.584 13.167 1.00 0.00 H new ATOM 1136 N GLU A 72 70.882 -1.533 10.479 1.00 0.00 N ATOM 1137 CA GLU A 72 71.014 -2.977 10.131 1.00 0.00 C ATOM 1138 C GLU A 72 70.047 -3.280 8.986 1.00 0.00 C ATOM 1139 O GLU A 72 70.377 -3.961 8.033 1.00 0.00 O ATOM 1140 CB GLU A 72 70.636 -3.818 11.352 1.00 0.00 C ATOM 1141 CG GLU A 72 71.695 -3.641 12.443 1.00 0.00 C ATOM 1142 CD GLU A 72 71.315 -4.477 13.667 1.00 0.00 C ATOM 1143 OE1 GLU A 72 70.219 -5.013 13.675 1.00 0.00 O ATOM 1144 OE2 GLU A 72 72.122 -4.560 14.578 1.00 0.00 O ATOM 0 H GLU A 72 70.594 -1.337 11.438 1.00 0.00 H new ATOM 0 HA GLU A 72 72.036 -3.210 9.833 1.00 0.00 H new ATOM 0 HB2 GLU A 72 69.658 -3.515 11.727 1.00 0.00 H new ATOM 0 HB3 GLU A 72 70.558 -4.869 11.073 1.00 0.00 H new ATOM 0 HG2 GLU A 72 72.672 -3.948 12.069 1.00 0.00 H new ATOM 0 HG3 GLU A 72 71.775 -2.590 12.719 1.00 0.00 H new ATOM 1151 N PHE A 73 68.847 -2.778 9.091 1.00 0.00 N ATOM 1152 CA PHE A 73 67.837 -3.037 8.022 1.00 0.00 C ATOM 1153 C PHE A 73 68.498 -2.760 6.668 1.00 0.00 C ATOM 1154 O PHE A 73 68.377 -3.528 5.735 1.00 0.00 O ATOM 1155 CB PHE A 73 66.613 -2.133 8.208 1.00 0.00 C ATOM 1156 CG PHE A 73 65.712 -2.262 7.003 1.00 0.00 C ATOM 1157 CD1 PHE A 73 64.799 -3.318 6.927 1.00 0.00 C ATOM 1158 CD2 PHE A 73 65.793 -1.328 5.965 1.00 0.00 C ATOM 1159 CE1 PHE A 73 63.964 -3.443 5.811 1.00 0.00 C ATOM 1160 CE2 PHE A 73 64.958 -1.451 4.848 1.00 0.00 C ATOM 1161 CZ PHE A 73 64.043 -2.509 4.771 1.00 0.00 C ATOM 0 H PHE A 73 68.522 -2.202 9.867 1.00 0.00 H new ATOM 0 HA PHE A 73 67.498 -4.072 8.073 1.00 0.00 H new ATOM 0 HB2 PHE A 73 66.073 -2.414 9.112 1.00 0.00 H new ATOM 0 HB3 PHE A 73 66.927 -1.097 8.333 1.00 0.00 H new ATOM 0 HD1 PHE A 73 64.738 -4.038 7.730 1.00 0.00 H new ATOM 0 HD2 PHE A 73 66.499 -0.513 6.025 1.00 0.00 H new ATOM 0 HE1 PHE A 73 63.259 -4.259 5.752 1.00 0.00 H new ATOM 0 HE2 PHE A 73 65.019 -0.730 4.046 1.00 0.00 H new ATOM 0 HZ PHE A 73 63.399 -2.604 3.910 1.00 0.00 H new ATOM 1171 N MET A 74 69.237 -1.693 6.576 1.00 0.00 N ATOM 1172 CA MET A 74 69.955 -1.387 5.308 1.00 0.00 C ATOM 1173 C MET A 74 71.076 -2.417 5.130 1.00 0.00 C ATOM 1174 O MET A 74 71.353 -2.880 4.044 1.00 0.00 O ATOM 1175 CB MET A 74 70.550 0.026 5.384 1.00 0.00 C ATOM 1176 CG MET A 74 71.296 0.362 4.086 1.00 0.00 C ATOM 1177 SD MET A 74 70.144 0.329 2.685 1.00 0.00 S ATOM 1178 CE MET A 74 70.820 1.748 1.784 1.00 0.00 C ATOM 0 H MET A 74 69.376 -1.016 7.326 1.00 0.00 H new ATOM 0 HA MET A 74 69.269 -1.433 4.462 1.00 0.00 H new ATOM 0 HB2 MET A 74 69.756 0.753 5.553 1.00 0.00 H new ATOM 0 HB3 MET A 74 71.232 0.095 6.231 1.00 0.00 H new ATOM 0 HG2 MET A 74 71.757 1.346 4.166 1.00 0.00 H new ATOM 0 HG3 MET A 74 72.101 -0.355 3.923 1.00 0.00 H new ATOM 0 HE1 MET A 74 70.246 1.906 0.871 1.00 0.00 H new ATOM 0 HE2 MET A 74 70.760 2.639 2.410 1.00 0.00 H new ATOM 0 HE3 MET A 74 71.862 1.554 1.529 1.00 0.00 H new ATOM 1188 N ALA A 75 71.736 -2.764 6.198 1.00 0.00 N ATOM 1189 CA ALA A 75 72.853 -3.747 6.119 1.00 0.00 C ATOM 1190 C ALA A 75 72.380 -5.072 5.516 1.00 0.00 C ATOM 1191 O ALA A 75 73.181 -5.874 5.077 1.00 0.00 O ATOM 1192 CB ALA A 75 73.379 -4.008 7.524 1.00 0.00 C ATOM 0 H ALA A 75 71.547 -2.405 7.134 1.00 0.00 H new ATOM 0 HA ALA A 75 73.635 -3.334 5.482 1.00 0.00 H new ATOM 0 HB1 ALA A 75 74.197 -4.727 7.478 1.00 0.00 H new ATOM 0 HB2 ALA A 75 73.739 -3.075 7.957 1.00 0.00 H new ATOM 0 HB3 ALA A 75 72.577 -4.410 8.144 1.00 0.00 H new ATOM 1198 N PHE A 76 71.099 -5.299 5.431 1.00 0.00 N ATOM 1199 CA PHE A 76 70.592 -6.547 4.793 1.00 0.00 C ATOM 1200 C PHE A 76 70.351 -6.234 3.316 1.00 0.00 C ATOM 1201 O PHE A 76 70.404 -7.084 2.450 1.00 0.00 O ATOM 1202 CB PHE A 76 69.269 -6.939 5.460 1.00 0.00 C ATOM 1203 CG PHE A 76 68.655 -8.114 4.742 1.00 0.00 C ATOM 1204 CD1 PHE A 76 67.824 -7.902 3.637 1.00 0.00 C ATOM 1205 CD2 PHE A 76 68.913 -9.414 5.183 1.00 0.00 C ATOM 1206 CE1 PHE A 76 67.251 -8.994 2.974 1.00 0.00 C ATOM 1207 CE2 PHE A 76 68.341 -10.506 4.524 1.00 0.00 C ATOM 1208 CZ PHE A 76 67.509 -10.298 3.419 1.00 0.00 C ATOM 0 H PHE A 76 70.376 -4.669 5.779 1.00 0.00 H new ATOM 0 HA PHE A 76 71.302 -7.367 4.900 1.00 0.00 H new ATOM 0 HB2 PHE A 76 69.441 -7.192 6.506 1.00 0.00 H new ATOM 0 HB3 PHE A 76 68.581 -6.094 5.445 1.00 0.00 H new ATOM 0 HD1 PHE A 76 67.625 -6.897 3.296 1.00 0.00 H new ATOM 0 HD2 PHE A 76 69.556 -9.576 6.035 1.00 0.00 H new ATOM 0 HE1 PHE A 76 66.610 -8.832 2.120 1.00 0.00 H new ATOM 0 HE2 PHE A 76 68.541 -11.510 4.868 1.00 0.00 H new ATOM 0 HZ PHE A 76 67.066 -11.141 2.909 1.00 0.00 H new ATOM 1218 N VAL A 77 70.096 -4.982 3.053 1.00 0.00 N ATOM 1219 CA VAL A 77 69.854 -4.535 1.654 1.00 0.00 C ATOM 1220 C VAL A 77 71.157 -4.691 0.866 1.00 0.00 C ATOM 1221 O VAL A 77 71.160 -5.137 -0.264 1.00 0.00 O ATOM 1222 CB VAL A 77 69.392 -3.072 1.626 1.00 0.00 C ATOM 1223 CG1 VAL A 77 69.348 -2.575 0.181 1.00 0.00 C ATOM 1224 CG2 VAL A 77 67.995 -2.969 2.244 1.00 0.00 C ATOM 0 H VAL A 77 70.045 -4.243 3.755 1.00 0.00 H new ATOM 0 HA VAL A 77 69.068 -5.143 1.205 1.00 0.00 H new ATOM 0 HB VAL A 77 70.090 -2.460 2.197 1.00 0.00 H new ATOM 0 HG11 VAL A 77 69.020 -1.536 0.164 1.00 0.00 H new ATOM 0 HG12 VAL A 77 70.342 -2.649 -0.260 1.00 0.00 H new ATOM 0 HG13 VAL A 77 68.651 -3.186 -0.393 1.00 0.00 H new ATOM 0 HG21 VAL A 77 67.665 -1.930 2.225 1.00 0.00 H new ATOM 0 HG22 VAL A 77 67.298 -3.582 1.672 1.00 0.00 H new ATOM 0 HG23 VAL A 77 68.026 -3.321 3.275 1.00 0.00 H new ATOM 1234 N SER A 78 72.270 -4.335 1.458 1.00 0.00 N ATOM 1235 CA SER A 78 73.574 -4.474 0.746 1.00 0.00 C ATOM 1236 C SER A 78 73.951 -5.953 0.631 1.00 0.00 C ATOM 1237 O SER A 78 74.317 -6.430 -0.424 1.00 0.00 O ATOM 1238 CB SER A 78 74.662 -3.732 1.525 1.00 0.00 C ATOM 1239 OG SER A 78 75.900 -3.859 0.837 1.00 0.00 O ATOM 0 H SER A 78 72.330 -3.955 2.403 1.00 0.00 H new ATOM 0 HA SER A 78 73.482 -4.048 -0.253 1.00 0.00 H new ATOM 0 HB2 SER A 78 74.397 -2.680 1.630 1.00 0.00 H new ATOM 0 HB3 SER A 78 74.748 -4.141 2.532 1.00 0.00 H new ATOM 0 HG SER A 78 76.600 -3.384 1.332 1.00 0.00 H new ATOM 1245 N MET A 79 73.893 -6.678 1.714 1.00 0.00 N ATOM 1246 CA MET A 79 74.286 -8.118 1.665 1.00 0.00 C ATOM 1247 C MET A 79 73.569 -8.804 0.505 1.00 0.00 C ATOM 1248 O MET A 79 74.150 -9.589 -0.219 1.00 0.00 O ATOM 1249 CB MET A 79 73.895 -8.800 2.977 1.00 0.00 C ATOM 1250 CG MET A 79 74.513 -10.200 3.026 1.00 0.00 C ATOM 1251 SD MET A 79 74.021 -11.035 4.557 1.00 0.00 S ATOM 1252 CE MET A 79 75.041 -10.078 5.708 1.00 0.00 C ATOM 0 H MET A 79 73.592 -6.339 2.628 1.00 0.00 H new ATOM 0 HA MET A 79 75.364 -8.193 1.522 1.00 0.00 H new ATOM 0 HB2 MET A 79 74.241 -8.208 3.824 1.00 0.00 H new ATOM 0 HB3 MET A 79 72.810 -8.866 3.056 1.00 0.00 H new ATOM 0 HG2 MET A 79 74.188 -10.781 2.163 1.00 0.00 H new ATOM 0 HG3 MET A 79 75.599 -10.130 2.972 1.00 0.00 H new ATOM 0 HE1 MET A 79 75.285 -10.692 6.575 1.00 0.00 H new ATOM 0 HE2 MET A 79 75.961 -9.771 5.210 1.00 0.00 H new ATOM 0 HE3 MET A 79 74.492 -9.194 6.032 1.00 0.00 H new ATOM 1262 N VAL A 80 72.322 -8.501 0.306 1.00 0.00 N ATOM 1263 CA VAL A 80 71.581 -9.122 -0.826 1.00 0.00 C ATOM 1264 C VAL A 80 72.187 -8.609 -2.133 1.00 0.00 C ATOM 1265 O VAL A 80 72.147 -9.267 -3.153 1.00 0.00 O ATOM 1266 CB VAL A 80 70.096 -8.750 -0.750 1.00 0.00 C ATOM 1267 CG1 VAL A 80 69.378 -9.238 -2.012 1.00 0.00 C ATOM 1268 CG2 VAL A 80 69.470 -9.421 0.476 1.00 0.00 C ATOM 0 H VAL A 80 71.781 -7.851 0.876 1.00 0.00 H new ATOM 0 HA VAL A 80 71.663 -10.208 -0.777 1.00 0.00 H new ATOM 0 HB VAL A 80 69.997 -7.667 -0.671 1.00 0.00 H new ATOM 0 HG11 VAL A 80 68.322 -8.972 -1.956 1.00 0.00 H new ATOM 0 HG12 VAL A 80 69.824 -8.769 -2.889 1.00 0.00 H new ATOM 0 HG13 VAL A 80 69.476 -10.321 -2.091 1.00 0.00 H new ATOM 0 HG21 VAL A 80 68.414 -9.159 0.534 1.00 0.00 H new ATOM 0 HG22 VAL A 80 69.572 -10.503 0.390 1.00 0.00 H new ATOM 0 HG23 VAL A 80 69.979 -9.079 1.377 1.00 0.00 H new ATOM 1278 N THR A 81 72.780 -7.446 -2.094 1.00 0.00 N ATOM 1279 CA THR A 81 73.429 -6.896 -3.317 1.00 0.00 C ATOM 1280 C THR A 81 74.782 -7.585 -3.496 1.00 0.00 C ATOM 1281 O THR A 81 75.110 -8.082 -4.556 1.00 0.00 O ATOM 1282 CB THR A 81 73.639 -5.385 -3.159 1.00 0.00 C ATOM 1283 OG1 THR A 81 72.422 -4.776 -2.749 1.00 0.00 O ATOM 1284 CG2 THR A 81 74.082 -4.791 -4.494 1.00 0.00 C ATOM 0 H THR A 81 72.843 -6.853 -1.266 1.00 0.00 H new ATOM 0 HA THR A 81 72.797 -7.074 -4.187 1.00 0.00 H new ATOM 0 HB THR A 81 74.406 -5.202 -2.407 1.00 0.00 H new ATOM 0 HG1 THR A 81 72.249 -4.991 -1.809 1.00 0.00 H new ATOM 0 HG21 THR A 81 74.231 -3.717 -4.383 1.00 0.00 H new ATOM 0 HG22 THR A 81 75.016 -5.257 -4.807 1.00 0.00 H new ATOM 0 HG23 THR A 81 73.315 -4.974 -5.246 1.00 0.00 H new ATOM 1292 N THR A 82 75.563 -7.621 -2.451 1.00 0.00 N ATOM 1293 CA THR A 82 76.898 -8.274 -2.508 1.00 0.00 C ATOM 1294 C THR A 82 76.726 -9.792 -2.597 1.00 0.00 C ATOM 1295 O THR A 82 77.648 -10.513 -2.920 1.00 0.00 O ATOM 1296 CB THR A 82 77.675 -7.933 -1.235 1.00 0.00 C ATOM 1297 OG1 THR A 82 77.024 -8.517 -0.116 1.00 0.00 O ATOM 1298 CG2 THR A 82 77.736 -6.416 -1.054 1.00 0.00 C ATOM 0 H THR A 82 75.326 -7.217 -1.545 1.00 0.00 H new ATOM 0 HA THR A 82 77.440 -7.918 -3.384 1.00 0.00 H new ATOM 0 HB THR A 82 78.689 -8.325 -1.316 1.00 0.00 H new ATOM 0 HG1 THR A 82 76.092 -8.715 -0.346 1.00 0.00 H new ATOM 0 HG21 THR A 82 78.291 -6.180 -0.146 1.00 0.00 H new ATOM 0 HG22 THR A 82 78.237 -5.967 -1.912 1.00 0.00 H new ATOM 0 HG23 THR A 82 76.724 -6.018 -0.975 1.00 0.00 H new ATOM 1306 N ALA A 83 75.552 -10.281 -2.308 1.00 0.00 N ATOM 1307 CA ALA A 83 75.319 -11.752 -2.372 1.00 0.00 C ATOM 1308 C ALA A 83 75.276 -12.215 -3.831 1.00 0.00 C ATOM 1309 O ALA A 83 75.836 -13.233 -4.185 1.00 0.00 O ATOM 1310 CB ALA A 83 73.989 -12.082 -1.694 1.00 0.00 C ATOM 0 H ALA A 83 74.743 -9.725 -2.030 1.00 0.00 H new ATOM 0 HA ALA A 83 76.133 -12.266 -1.860 1.00 0.00 H new ATOM 0 HB1 ALA A 83 73.815 -13.157 -1.739 1.00 0.00 H new ATOM 0 HB2 ALA A 83 74.023 -11.763 -0.652 1.00 0.00 H new ATOM 0 HB3 ALA A 83 73.180 -11.562 -2.207 1.00 0.00 H new ATOM 1316 N CYS A 84 74.591 -11.491 -4.676 1.00 0.00 N ATOM 1317 CA CYS A 84 74.488 -11.911 -6.103 1.00 0.00 C ATOM 1318 C CYS A 84 75.841 -11.756 -6.797 1.00 0.00 C ATOM 1319 O CYS A 84 76.709 -11.035 -6.344 1.00 0.00 O ATOM 1320 CB CYS A 84 73.452 -11.041 -6.819 1.00 0.00 C ATOM 1321 SG CYS A 84 73.963 -9.308 -6.744 1.00 0.00 S ATOM 0 H CYS A 84 74.100 -10.629 -4.440 1.00 0.00 H new ATOM 0 HA CYS A 84 74.183 -12.957 -6.142 1.00 0.00 H new ATOM 0 HB2 CYS A 84 73.352 -11.357 -7.857 1.00 0.00 H new ATOM 0 HB3 CYS A 84 72.474 -11.163 -6.353 1.00 0.00 H new ATOM 0 HG CYS A 84 74.615 -9.095 -5.640 1.00 0.00 H new ATOM 1450 N SER B 1 60.312 -7.192 -7.303 1.00 0.00 N ATOM 1451 CA SER B 1 59.414 -6.115 -6.801 1.00 0.00 C ATOM 1452 C SER B 1 60.041 -4.752 -7.096 1.00 0.00 C ATOM 1453 O SER B 1 61.056 -4.654 -7.757 1.00 0.00 O ATOM 1454 CB SER B 1 59.229 -6.271 -5.291 1.00 0.00 C ATOM 1455 OG SER B 1 60.498 -6.465 -4.681 1.00 0.00 O ATOM 0 H1 SER B 1 59.744 -7.931 -7.765 1.00 0.00 H new ATOM 0 H2 SER B 1 60.984 -6.792 -7.989 1.00 0.00 H new ATOM 0 H3 SER B 1 60.837 -7.606 -6.506 1.00 0.00 H new ATOM 0 HA SER B 1 58.446 -6.187 -7.297 1.00 0.00 H new ATOM 0 HB2 SER B 1 58.746 -5.385 -4.879 1.00 0.00 H new ATOM 0 HB3 SER B 1 58.577 -7.118 -5.078 1.00 0.00 H new ATOM 0 HG SER B 1 60.392 -6.490 -3.707 1.00 0.00 H new ATOM 1463 N GLU B 2 59.443 -3.699 -6.616 1.00 0.00 N ATOM 1464 CA GLU B 2 59.994 -2.340 -6.870 1.00 0.00 C ATOM 1465 C GLU B 2 61.365 -2.203 -6.200 1.00 0.00 C ATOM 1466 O GLU B 2 62.231 -1.498 -6.678 1.00 0.00 O ATOM 1467 CB GLU B 2 59.031 -1.302 -6.294 1.00 0.00 C ATOM 1468 CG GLU B 2 57.746 -1.291 -7.128 1.00 0.00 C ATOM 1469 CD GLU B 2 56.718 -0.371 -6.471 1.00 0.00 C ATOM 1470 OE1 GLU B 2 57.010 0.150 -5.407 1.00 0.00 O ATOM 1471 OE2 GLU B 2 55.650 -0.206 -7.041 1.00 0.00 O ATOM 0 H GLU B 2 58.591 -3.721 -6.055 1.00 0.00 H new ATOM 0 HA GLU B 2 60.109 -2.182 -7.942 1.00 0.00 H new ATOM 0 HB2 GLU B 2 58.802 -1.538 -5.255 1.00 0.00 H new ATOM 0 HB3 GLU B 2 59.493 -0.315 -6.303 1.00 0.00 H new ATOM 0 HG2 GLU B 2 57.960 -0.949 -8.141 1.00 0.00 H new ATOM 0 HG3 GLU B 2 57.345 -2.301 -7.211 1.00 0.00 H new ATOM 1478 N LEU B 3 61.577 -2.878 -5.102 1.00 0.00 N ATOM 1479 CA LEU B 3 62.895 -2.797 -4.413 1.00 0.00 C ATOM 1480 C LEU B 3 63.951 -3.508 -5.258 1.00 0.00 C ATOM 1481 O LEU B 3 65.117 -3.161 -5.239 1.00 0.00 O ATOM 1482 CB LEU B 3 62.812 -3.500 -3.056 1.00 0.00 C ATOM 1483 CG LEU B 3 61.770 -2.821 -2.160 1.00 0.00 C ATOM 1484 CD1 LEU B 3 61.658 -3.609 -0.850 1.00 0.00 C ATOM 1485 CD2 LEU B 3 62.198 -1.374 -1.859 1.00 0.00 C ATOM 0 H LEU B 3 60.891 -3.484 -4.652 1.00 0.00 H new ATOM 0 HA LEU B 3 63.161 -1.749 -4.275 1.00 0.00 H new ATOM 0 HB2 LEU B 3 62.549 -4.548 -3.199 1.00 0.00 H new ATOM 0 HB3 LEU B 3 63.787 -3.479 -2.569 1.00 0.00 H new ATOM 0 HG LEU B 3 60.806 -2.803 -2.668 1.00 0.00 H new ATOM 0 HD11 LEU B 3 60.919 -3.136 -0.203 1.00 0.00 H new ATOM 0 HD12 LEU B 3 61.349 -4.632 -1.066 1.00 0.00 H new ATOM 0 HD13 LEU B 3 62.626 -3.620 -0.348 1.00 0.00 H new ATOM 0 HD21 LEU B 3 61.452 -0.899 -1.222 1.00 0.00 H new ATOM 0 HD22 LEU B 3 63.161 -1.378 -1.349 1.00 0.00 H new ATOM 0 HD23 LEU B 3 62.284 -0.818 -2.793 1.00 0.00 H new ATOM 1497 N GLU B 4 63.554 -4.510 -5.992 1.00 0.00 N ATOM 1498 CA GLU B 4 64.528 -5.257 -6.830 1.00 0.00 C ATOM 1499 C GLU B 4 65.089 -4.338 -7.913 1.00 0.00 C ATOM 1500 O GLU B 4 66.265 -4.368 -8.219 1.00 0.00 O ATOM 1501 CB GLU B 4 63.814 -6.447 -7.475 1.00 0.00 C ATOM 1502 CG GLU B 4 63.482 -7.481 -6.395 1.00 0.00 C ATOM 1503 CD GLU B 4 62.764 -8.674 -7.027 1.00 0.00 C ATOM 1504 OE1 GLU B 4 62.391 -8.573 -8.184 1.00 0.00 O ATOM 1505 OE2 GLU B 4 62.595 -9.669 -6.340 1.00 0.00 O ATOM 0 H GLU B 4 62.592 -4.844 -6.046 1.00 0.00 H new ATOM 0 HA GLU B 4 65.352 -5.614 -6.211 1.00 0.00 H new ATOM 0 HB2 GLU B 4 62.901 -6.114 -7.970 1.00 0.00 H new ATOM 0 HB3 GLU B 4 64.447 -6.894 -8.241 1.00 0.00 H new ATOM 0 HG2 GLU B 4 64.396 -7.813 -5.903 1.00 0.00 H new ATOM 0 HG3 GLU B 4 62.853 -7.030 -5.628 1.00 0.00 H new ATOM 1512 N LYS B 5 64.265 -3.515 -8.497 1.00 0.00 N ATOM 1513 CA LYS B 5 64.758 -2.591 -9.555 1.00 0.00 C ATOM 1514 C LYS B 5 65.759 -1.603 -8.956 1.00 0.00 C ATOM 1515 O LYS B 5 66.761 -1.276 -9.560 1.00 0.00 O ATOM 1516 CB LYS B 5 63.575 -1.832 -10.164 1.00 0.00 C ATOM 1517 CG LYS B 5 62.725 -2.805 -10.988 1.00 0.00 C ATOM 1518 CD LYS B 5 61.433 -2.120 -11.455 1.00 0.00 C ATOM 1519 CE LYS B 5 61.718 -1.204 -12.650 1.00 0.00 C ATOM 1520 NZ LYS B 5 62.386 -1.983 -13.733 1.00 0.00 N ATOM 0 H LYS B 5 63.270 -3.442 -8.287 1.00 0.00 H new ATOM 0 HA LYS B 5 65.255 -3.168 -10.335 1.00 0.00 H new ATOM 0 HB2 LYS B 5 62.972 -1.381 -9.376 1.00 0.00 H new ATOM 0 HB3 LYS B 5 63.935 -1.019 -10.795 1.00 0.00 H new ATOM 0 HG2 LYS B 5 63.292 -3.153 -11.851 1.00 0.00 H new ATOM 0 HG3 LYS B 5 62.483 -3.684 -10.390 1.00 0.00 H new ATOM 0 HD2 LYS B 5 60.695 -2.872 -11.733 1.00 0.00 H new ATOM 0 HD3 LYS B 5 61.005 -1.540 -10.637 1.00 0.00 H new ATOM 0 HE2 LYS B 5 60.788 -0.773 -13.020 1.00 0.00 H new ATOM 0 HE3 LYS B 5 62.353 -0.374 -12.341 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 62.043 -1.655 -14.659 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 63.415 -1.845 -13.676 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 62.166 -2.993 -13.621 1.00 0.00 H new ATOM 1534 N ALA B 6 65.495 -1.120 -7.772 1.00 0.00 N ATOM 1535 CA ALA B 6 66.437 -0.151 -7.140 1.00 0.00 C ATOM 1536 C ALA B 6 67.813 -0.807 -6.981 1.00 0.00 C ATOM 1537 O ALA B 6 68.826 -0.238 -7.335 1.00 0.00 O ATOM 1538 CB ALA B 6 65.905 0.272 -5.768 1.00 0.00 C ATOM 0 H ALA B 6 64.672 -1.353 -7.217 1.00 0.00 H new ATOM 0 HA ALA B 6 66.526 0.731 -7.774 1.00 0.00 H new ATOM 0 HB1 ALA B 6 66.597 0.980 -5.312 1.00 0.00 H new ATOM 0 HB2 ALA B 6 64.929 0.743 -5.886 1.00 0.00 H new ATOM 0 HB3 ALA B 6 65.809 -0.606 -5.129 1.00 0.00 H new ATOM 1544 N MET B 7 67.859 -2.004 -6.458 1.00 0.00 N ATOM 1545 CA MET B 7 69.172 -2.691 -6.291 1.00 0.00 C ATOM 1546 C MET B 7 69.828 -2.850 -7.660 1.00 0.00 C ATOM 1547 O MET B 7 70.990 -2.549 -7.848 1.00 0.00 O ATOM 1548 CB MET B 7 68.946 -4.075 -5.682 1.00 0.00 C ATOM 1549 CG MET B 7 70.295 -4.680 -5.288 1.00 0.00 C ATOM 1550 SD MET B 7 70.045 -6.355 -4.644 1.00 0.00 S ATOM 1551 CE MET B 7 69.560 -5.912 -2.955 1.00 0.00 C ATOM 0 H MET B 7 67.047 -2.533 -6.141 1.00 0.00 H new ATOM 0 HA MET B 7 69.814 -2.102 -5.636 1.00 0.00 H new ATOM 0 HB2 MET B 7 68.299 -3.999 -4.808 1.00 0.00 H new ATOM 0 HB3 MET B 7 68.439 -4.722 -6.398 1.00 0.00 H new ATOM 0 HG2 MET B 7 70.959 -4.707 -6.152 1.00 0.00 H new ATOM 0 HG3 MET B 7 70.778 -4.058 -4.534 1.00 0.00 H new ATOM 0 HE1 MET B 7 70.352 -6.196 -2.263 1.00 0.00 H new ATOM 0 HE2 MET B 7 69.394 -4.836 -2.894 1.00 0.00 H new ATOM 0 HE3 MET B 7 68.642 -6.437 -2.691 1.00 0.00 H new ATOM 1561 N VAL B 8 69.087 -3.336 -8.613 1.00 0.00 N ATOM 1562 CA VAL B 8 69.650 -3.545 -9.971 1.00 0.00 C ATOM 1563 C VAL B 8 70.130 -2.201 -10.516 1.00 0.00 C ATOM 1564 O VAL B 8 71.160 -2.115 -11.153 1.00 0.00 O ATOM 1565 CB VAL B 8 68.571 -4.131 -10.886 1.00 0.00 C ATOM 1566 CG1 VAL B 8 69.063 -4.144 -12.335 1.00 0.00 C ATOM 1567 CG2 VAL B 8 68.260 -5.562 -10.445 1.00 0.00 C ATOM 0 H VAL B 8 68.107 -3.599 -8.507 1.00 0.00 H new ATOM 0 HA VAL B 8 70.489 -4.240 -9.928 1.00 0.00 H new ATOM 0 HB VAL B 8 67.672 -3.518 -10.819 1.00 0.00 H new ATOM 0 HG11 VAL B 8 68.289 -4.562 -12.978 1.00 0.00 H new ATOM 0 HG12 VAL B 8 69.287 -3.126 -12.652 1.00 0.00 H new ATOM 0 HG13 VAL B 8 69.964 -4.753 -12.408 1.00 0.00 H new ATOM 0 HG21 VAL B 8 67.492 -5.984 -11.093 1.00 0.00 H new ATOM 0 HG22 VAL B 8 69.164 -6.168 -10.511 1.00 0.00 H new ATOM 0 HG23 VAL B 8 67.902 -5.556 -9.415 1.00 0.00 H new ATOM 1577 N ALA B 9 69.398 -1.148 -10.285 1.00 0.00 N ATOM 1578 CA ALA B 9 69.837 0.173 -10.809 1.00 0.00 C ATOM 1579 C ALA B 9 71.211 0.526 -10.226 1.00 0.00 C ATOM 1580 O ALA B 9 72.083 1.001 -10.924 1.00 0.00 O ATOM 1581 CB ALA B 9 68.814 1.241 -10.403 1.00 0.00 C ATOM 0 H ALA B 9 68.523 -1.144 -9.761 1.00 0.00 H new ATOM 0 HA ALA B 9 69.909 0.131 -11.896 1.00 0.00 H new ATOM 0 HB1 ALA B 9 69.131 2.212 -10.784 1.00 0.00 H new ATOM 0 HB2 ALA B 9 67.839 0.988 -10.819 1.00 0.00 H new ATOM 0 HB3 ALA B 9 68.744 1.283 -9.316 1.00 0.00 H new ATOM 1587 N LEU B 10 71.419 0.292 -8.959 1.00 0.00 N ATOM 1588 CA LEU B 10 72.745 0.621 -8.345 1.00 0.00 C ATOM 1589 C LEU B 10 73.876 -0.159 -9.031 1.00 0.00 C ATOM 1590 O LEU B 10 74.887 0.405 -9.404 1.00 0.00 O ATOM 1591 CB LEU B 10 72.732 0.246 -6.854 1.00 0.00 C ATOM 1592 CG LEU B 10 71.881 1.240 -6.046 1.00 0.00 C ATOM 1593 CD1 LEU B 10 71.563 0.630 -4.677 1.00 0.00 C ATOM 1594 CD2 LEU B 10 72.649 2.560 -5.840 1.00 0.00 C ATOM 0 H LEU B 10 70.733 -0.111 -8.321 1.00 0.00 H new ATOM 0 HA LEU B 10 72.918 1.690 -8.469 1.00 0.00 H new ATOM 0 HB2 LEU B 10 72.335 -0.762 -6.732 1.00 0.00 H new ATOM 0 HB3 LEU B 10 73.751 0.236 -6.468 1.00 0.00 H new ATOM 0 HG LEU B 10 70.961 1.445 -6.593 1.00 0.00 H new ATOM 0 HD11 LEU B 10 70.960 1.329 -4.098 1.00 0.00 H new ATOM 0 HD12 LEU B 10 71.011 -0.300 -4.812 1.00 0.00 H new ATOM 0 HD13 LEU B 10 72.492 0.426 -4.145 1.00 0.00 H new ATOM 0 HD21 LEU B 10 72.034 3.253 -5.267 1.00 0.00 H new ATOM 0 HD22 LEU B 10 73.574 2.362 -5.298 1.00 0.00 H new ATOM 0 HD23 LEU B 10 72.883 3.000 -6.809 1.00 0.00 H new ATOM 1606 N ILE B 11 73.730 -1.448 -9.182 1.00 0.00 N ATOM 1607 CA ILE B 11 74.813 -2.253 -9.823 1.00 0.00 C ATOM 1608 C ILE B 11 75.035 -1.789 -11.261 1.00 0.00 C ATOM 1609 O ILE B 11 76.149 -1.554 -11.687 1.00 0.00 O ATOM 1610 CB ILE B 11 74.424 -3.731 -9.820 1.00 0.00 C ATOM 1611 CG1 ILE B 11 74.285 -4.220 -8.377 1.00 0.00 C ATOM 1612 CG2 ILE B 11 75.511 -4.545 -10.531 1.00 0.00 C ATOM 1613 CD1 ILE B 11 73.637 -5.606 -8.373 1.00 0.00 C ATOM 0 H ILE B 11 72.909 -1.979 -8.890 1.00 0.00 H new ATOM 0 HA ILE B 11 75.735 -2.115 -9.259 1.00 0.00 H new ATOM 0 HB ILE B 11 73.474 -3.858 -10.340 1.00 0.00 H new ATOM 0 HG12 ILE B 11 75.264 -4.262 -7.899 1.00 0.00 H new ATOM 0 HG13 ILE B 11 73.679 -3.521 -7.801 1.00 0.00 H new ATOM 0 HG21 ILE B 11 75.235 -5.600 -10.530 1.00 0.00 H new ATOM 0 HG22 ILE B 11 75.612 -4.197 -11.559 1.00 0.00 H new ATOM 0 HG23 ILE B 11 76.460 -4.418 -10.010 1.00 0.00 H new ATOM 0 HD11 ILE B 11 73.536 -5.958 -7.346 1.00 0.00 H new ATOM 0 HD12 ILE B 11 72.651 -5.548 -8.835 1.00 0.00 H new ATOM 0 HD13 ILE B 11 74.261 -6.301 -8.935 1.00 0.00 H new ATOM 1625 N ASP B 12 73.984 -1.682 -12.020 1.00 0.00 N ATOM 1626 CA ASP B 12 74.134 -1.265 -13.440 1.00 0.00 C ATOM 1627 C ASP B 12 74.776 0.123 -13.498 1.00 0.00 C ATOM 1628 O ASP B 12 75.621 0.390 -14.330 1.00 0.00 O ATOM 1629 CB ASP B 12 72.751 -1.220 -14.095 1.00 0.00 C ATOM 1630 CG ASP B 12 72.218 -2.646 -14.255 1.00 0.00 C ATOM 1631 OD1 ASP B 12 73.026 -3.560 -14.273 1.00 0.00 O ATOM 1632 OD2 ASP B 12 71.012 -2.799 -14.358 1.00 0.00 O ATOM 0 H ASP B 12 73.027 -1.865 -11.719 1.00 0.00 H new ATOM 0 HA ASP B 12 74.768 -1.976 -13.970 1.00 0.00 H new ATOM 0 HB2 ASP B 12 72.067 -0.630 -13.485 1.00 0.00 H new ATOM 0 HB3 ASP B 12 72.813 -0.732 -15.068 1.00 0.00 H new ATOM 1637 N VAL B 13 74.393 1.003 -12.617 1.00 0.00 N ATOM 1638 CA VAL B 13 74.995 2.365 -12.624 1.00 0.00 C ATOM 1639 C VAL B 13 76.462 2.288 -12.163 1.00 0.00 C ATOM 1640 O VAL B 13 77.324 2.959 -12.694 1.00 0.00 O ATOM 1641 CB VAL B 13 74.196 3.280 -11.685 1.00 0.00 C ATOM 1642 CG1 VAL B 13 74.936 4.606 -11.485 1.00 0.00 C ATOM 1643 CG2 VAL B 13 72.819 3.564 -12.296 1.00 0.00 C ATOM 0 H VAL B 13 73.692 0.840 -11.895 1.00 0.00 H new ATOM 0 HA VAL B 13 74.964 2.772 -13.635 1.00 0.00 H new ATOM 0 HB VAL B 13 74.081 2.782 -10.722 1.00 0.00 H new ATOM 0 HG11 VAL B 13 74.360 5.247 -10.817 1.00 0.00 H new ATOM 0 HG12 VAL B 13 75.916 4.414 -11.048 1.00 0.00 H new ATOM 0 HG13 VAL B 13 75.060 5.103 -12.447 1.00 0.00 H new ATOM 0 HG21 VAL B 13 72.252 4.214 -11.629 1.00 0.00 H new ATOM 0 HG22 VAL B 13 72.943 4.055 -13.261 1.00 0.00 H new ATOM 0 HG23 VAL B 13 72.281 2.626 -12.433 1.00 0.00 H new ATOM 1653 N PHE B 14 76.746 1.488 -11.166 1.00 0.00 N ATOM 1654 CA PHE B 14 78.150 1.388 -10.657 1.00 0.00 C ATOM 1655 C PHE B 14 79.093 0.846 -11.734 1.00 0.00 C ATOM 1656 O PHE B 14 80.111 1.441 -12.031 1.00 0.00 O ATOM 1657 CB PHE B 14 78.179 0.441 -9.453 1.00 0.00 C ATOM 1658 CG PHE B 14 79.591 0.322 -8.921 1.00 0.00 C ATOM 1659 CD1 PHE B 14 80.450 -0.658 -9.436 1.00 0.00 C ATOM 1660 CD2 PHE B 14 80.037 1.177 -7.906 1.00 0.00 C ATOM 1661 CE1 PHE B 14 81.753 -0.781 -8.936 1.00 0.00 C ATOM 1662 CE2 PHE B 14 81.341 1.055 -7.407 1.00 0.00 C ATOM 1663 CZ PHE B 14 82.197 0.076 -7.923 1.00 0.00 C ATOM 0 H PHE B 14 76.067 0.900 -10.682 1.00 0.00 H new ATOM 0 HA PHE B 14 78.484 2.386 -10.373 1.00 0.00 H new ATOM 0 HB2 PHE B 14 77.517 0.814 -8.671 1.00 0.00 H new ATOM 0 HB3 PHE B 14 77.807 -0.542 -9.744 1.00 0.00 H new ATOM 0 HD1 PHE B 14 80.108 -1.319 -10.219 1.00 0.00 H new ATOM 0 HD2 PHE B 14 79.375 1.932 -7.507 1.00 0.00 H new ATOM 0 HE1 PHE B 14 82.415 -1.537 -9.332 1.00 0.00 H new ATOM 0 HE2 PHE B 14 81.685 1.716 -6.625 1.00 0.00 H new ATOM 0 HZ PHE B 14 83.202 -0.018 -7.539 1.00 0.00 H new ATOM 1673 N HIS B 15 78.803 -0.304 -12.281 1.00 0.00 N ATOM 1674 CA HIS B 15 79.728 -0.904 -13.283 1.00 0.00 C ATOM 1675 C HIS B 15 79.904 0.017 -14.489 1.00 0.00 C ATOM 1676 O HIS B 15 81.007 0.201 -14.964 1.00 0.00 O ATOM 1677 CB HIS B 15 79.165 -2.252 -13.747 1.00 0.00 C ATOM 1678 CG HIS B 15 80.097 -2.874 -14.751 1.00 0.00 C ATOM 1679 ND1 HIS B 15 80.006 -2.613 -16.110 1.00 0.00 N ATOM 1680 CD2 HIS B 15 81.141 -3.755 -14.606 1.00 0.00 C ATOM 1681 CE1 HIS B 15 80.973 -3.322 -16.725 1.00 0.00 C ATOM 1682 NE2 HIS B 15 81.689 -4.033 -15.852 1.00 0.00 N ATOM 0 H HIS B 15 77.967 -0.852 -12.077 1.00 0.00 H new ATOM 0 HA HIS B 15 80.702 -1.045 -12.815 1.00 0.00 H new ATOM 0 HB2 HIS B 15 79.039 -2.917 -12.893 1.00 0.00 H new ATOM 0 HB3 HIS B 15 78.179 -2.112 -14.190 1.00 0.00 H new ATOM 0 HD1 HIS B 15 79.330 -1.997 -16.562 1.00 0.00 H new ATOM 0 HD2 HIS B 15 81.483 -4.168 -13.668 1.00 0.00 H new ATOM 0 HE1 HIS B 15 81.147 -3.316 -17.791 1.00 0.00 H new ATOM 1691 N GLN B 16 78.863 0.619 -14.995 1.00 0.00 N ATOM 1692 CA GLN B 16 79.055 1.530 -16.159 1.00 0.00 C ATOM 1693 C GLN B 16 79.794 2.794 -15.715 1.00 0.00 C ATOM 1694 O GLN B 16 80.661 3.296 -16.404 1.00 0.00 O ATOM 1695 CB GLN B 16 77.689 1.906 -16.736 1.00 0.00 C ATOM 1696 CG GLN B 16 77.068 0.684 -17.416 1.00 0.00 C ATOM 1697 CD GLN B 16 75.702 1.059 -17.993 1.00 0.00 C ATOM 1698 OE1 GLN B 16 75.157 0.348 -18.814 1.00 0.00 O ATOM 1699 NE2 GLN B 16 75.122 2.159 -17.599 1.00 0.00 N ATOM 0 H GLN B 16 77.904 0.523 -14.661 1.00 0.00 H new ATOM 0 HA GLN B 16 79.647 1.024 -16.921 1.00 0.00 H new ATOM 0 HB2 GLN B 16 77.034 2.266 -15.943 1.00 0.00 H new ATOM 0 HB3 GLN B 16 77.797 2.719 -17.454 1.00 0.00 H new ATOM 0 HG2 GLN B 16 77.723 0.324 -18.209 1.00 0.00 H new ATOM 0 HG3 GLN B 16 76.960 -0.129 -16.698 1.00 0.00 H new ATOM 0 HE21 GLN B 16 75.578 2.757 -16.910 1.00 0.00 H new ATOM 0 HE22 GLN B 16 74.213 2.421 -17.980 1.00 0.00 H new ATOM 1708 N TYR B 17 79.462 3.300 -14.562 1.00 0.00 N ATOM 1709 CA TYR B 17 80.149 4.523 -14.059 1.00 0.00 C ATOM 1710 C TYR B 17 81.590 4.172 -13.693 1.00 0.00 C ATOM 1711 O TYR B 17 82.525 4.857 -14.051 1.00 0.00 O ATOM 1712 CB TYR B 17 79.428 5.053 -12.819 1.00 0.00 C ATOM 1713 CG TYR B 17 80.076 6.349 -12.407 1.00 0.00 C ATOM 1714 CD1 TYR B 17 79.728 7.536 -13.055 1.00 0.00 C ATOM 1715 CD2 TYR B 17 81.043 6.359 -11.395 1.00 0.00 C ATOM 1716 CE1 TYR B 17 80.344 8.739 -12.691 1.00 0.00 C ATOM 1717 CE2 TYR B 17 81.662 7.561 -11.031 1.00 0.00 C ATOM 1718 CZ TYR B 17 81.312 8.751 -11.680 1.00 0.00 C ATOM 1719 OH TYR B 17 81.924 9.936 -11.326 1.00 0.00 O ATOM 0 H TYR B 17 78.744 2.920 -13.945 1.00 0.00 H new ATOM 0 HA TYR B 17 80.137 5.289 -14.835 1.00 0.00 H new ATOM 0 HB2 TYR B 17 78.371 5.209 -13.033 1.00 0.00 H new ATOM 0 HB3 TYR B 17 79.485 4.327 -12.008 1.00 0.00 H new ATOM 0 HD1 TYR B 17 78.983 7.526 -13.837 1.00 0.00 H new ATOM 0 HD2 TYR B 17 81.312 5.440 -10.895 1.00 0.00 H new ATOM 0 HE1 TYR B 17 80.073 9.658 -13.190 1.00 0.00 H new ATOM 0 HE2 TYR B 17 82.408 7.570 -10.251 1.00 0.00 H new ATOM 0 HH TYR B 17 82.643 9.754 -10.686 1.00 0.00 H new ATOM 1729 N SER B 18 81.762 3.096 -12.986 1.00 0.00 N ATOM 1730 CA SER B 18 83.132 2.670 -12.592 1.00 0.00 C ATOM 1731 C SER B 18 83.873 2.166 -13.829 1.00 0.00 C ATOM 1732 O SER B 18 85.079 2.018 -13.824 1.00 0.00 O ATOM 1733 CB SER B 18 83.054 1.557 -11.549 1.00 0.00 C ATOM 1734 OG SER B 18 84.333 1.388 -10.949 1.00 0.00 O ATOM 0 H SER B 18 81.010 2.488 -12.661 1.00 0.00 H new ATOM 0 HA SER B 18 83.666 3.517 -12.162 1.00 0.00 H new ATOM 0 HB2 SER B 18 82.313 1.805 -10.789 1.00 0.00 H new ATOM 0 HB3 SER B 18 82.732 0.626 -12.016 1.00 0.00 H new ATOM 0 HG SER B 18 84.974 1.084 -11.625 1.00 0.00 H new ATOM 1740 N GLY B 19 83.158 1.902 -14.892 1.00 0.00 N ATOM 1741 CA GLY B 19 83.809 1.405 -16.140 1.00 0.00 C ATOM 1742 C GLY B 19 84.210 2.584 -17.034 1.00 0.00 C ATOM 1743 O GLY B 19 84.528 2.405 -18.193 1.00 0.00 O ATOM 0 H GLY B 19 82.145 2.010 -14.949 1.00 0.00 H new ATOM 0 HA2 GLY B 19 84.690 0.814 -15.889 1.00 0.00 H new ATOM 0 HA3 GLY B 19 83.126 0.747 -16.678 1.00 0.00 H new ATOM 1747 N ARG B 20 84.221 3.784 -16.516 1.00 0.00 N ATOM 1748 CA ARG B 20 84.630 4.947 -17.357 1.00 0.00 C ATOM 1749 C ARG B 20 86.140 4.895 -17.582 1.00 0.00 C ATOM 1750 O ARG B 20 86.634 5.176 -18.657 1.00 0.00 O ATOM 1751 CB ARG B 20 84.281 6.249 -16.627 1.00 0.00 C ATOM 1752 CG ARG B 20 82.760 6.415 -16.519 1.00 0.00 C ATOM 1753 CD ARG B 20 82.179 6.968 -17.825 1.00 0.00 C ATOM 1754 NE ARG B 20 80.729 7.243 -17.623 1.00 0.00 N ATOM 1755 CZ ARG B 20 79.858 6.277 -17.730 1.00 0.00 C ATOM 1756 NH1 ARG B 20 80.249 5.079 -18.068 1.00 0.00 N ATOM 1757 NH2 ARG B 20 78.596 6.509 -17.500 1.00 0.00 N ATOM 0 H ARG B 20 83.966 4.008 -15.554 1.00 0.00 H new ATOM 0 HA ARG B 20 84.108 4.908 -18.313 1.00 0.00 H new ATOM 0 HB2 ARG B 20 84.724 6.244 -15.631 1.00 0.00 H new ATOM 0 HB3 ARG B 20 84.708 7.098 -17.161 1.00 0.00 H new ATOM 0 HG2 ARG B 20 82.300 5.454 -16.289 1.00 0.00 H new ATOM 0 HG3 ARG B 20 82.521 7.088 -15.696 1.00 0.00 H new ATOM 0 HD2 ARG B 20 82.700 7.881 -18.114 1.00 0.00 H new ATOM 0 HD3 ARG B 20 82.319 6.251 -18.634 1.00 0.00 H new ATOM 0 HE ARG B 20 80.416 8.188 -17.401 1.00 0.00 H new ATOM 0 HH11 ARG B 20 81.236 4.897 -18.249 1.00 0.00 H new ATOM 0 HH12 ARG B 20 79.568 4.325 -18.151 1.00 0.00 H new ATOM 0 HH21 ARG B 20 78.289 7.445 -17.236 1.00 0.00 H new ATOM 0 HH22 ARG B 20 77.915 5.754 -17.584 1.00 0.00 H new ATOM 1771 N GLU B 21 86.875 4.538 -16.560 1.00 0.00 N ATOM 1772 CA GLU B 21 88.362 4.460 -16.667 1.00 0.00 C ATOM 1773 C GLU B 21 88.785 2.996 -16.776 1.00 0.00 C ATOM 1774 O GLU B 21 89.958 2.677 -16.824 1.00 0.00 O ATOM 1775 CB GLU B 21 88.986 5.081 -15.413 1.00 0.00 C ATOM 1776 CG GLU B 21 88.610 6.564 -15.339 1.00 0.00 C ATOM 1777 CD GLU B 21 89.297 7.323 -16.475 1.00 0.00 C ATOM 1778 OE1 GLU B 21 90.272 6.811 -16.997 1.00 0.00 O ATOM 1779 OE2 GLU B 21 88.835 8.403 -16.802 1.00 0.00 O ATOM 0 H GLU B 21 86.501 4.294 -15.643 1.00 0.00 H new ATOM 0 HA GLU B 21 88.699 5.001 -17.551 1.00 0.00 H new ATOM 0 HB2 GLU B 21 88.634 4.560 -14.522 1.00 0.00 H new ATOM 0 HB3 GLU B 21 90.070 4.970 -15.440 1.00 0.00 H new ATOM 0 HG2 GLU B 21 87.529 6.680 -15.412 1.00 0.00 H new ATOM 0 HG3 GLU B 21 88.911 6.979 -14.377 1.00 0.00 H new ATOM 1786 N GLY B 22 87.836 2.102 -16.804 1.00 0.00 N ATOM 1787 CA GLY B 22 88.173 0.655 -16.898 1.00 0.00 C ATOM 1788 C GLY B 22 88.552 0.141 -15.509 1.00 0.00 C ATOM 1789 O GLY B 22 88.928 -1.002 -15.340 1.00 0.00 O ATOM 0 H GLY B 22 86.839 2.312 -16.766 1.00 0.00 H new ATOM 0 HA2 GLY B 22 87.323 0.095 -17.288 1.00 0.00 H new ATOM 0 HA3 GLY B 22 88.999 0.505 -17.593 1.00 0.00 H new ATOM 1793 N ASP B 23 88.458 0.981 -14.509 1.00 0.00 N ATOM 1794 CA ASP B 23 88.813 0.548 -13.126 1.00 0.00 C ATOM 1795 C ASP B 23 87.576 -0.009 -12.417 1.00 0.00 C ATOM 1796 O ASP B 23 86.907 0.683 -11.675 1.00 0.00 O ATOM 1797 CB ASP B 23 89.349 1.747 -12.340 1.00 0.00 C ATOM 1798 CG ASP B 23 90.737 2.121 -12.861 1.00 0.00 C ATOM 1799 OD1 ASP B 23 91.374 1.269 -13.459 1.00 0.00 O ATOM 1800 OD2 ASP B 23 91.142 3.252 -12.650 1.00 0.00 O ATOM 0 H ASP B 23 88.150 1.950 -14.593 1.00 0.00 H new ATOM 0 HA ASP B 23 89.575 -0.229 -13.181 1.00 0.00 H new ATOM 0 HB2 ASP B 23 88.671 2.594 -12.442 1.00 0.00 H new ATOM 0 HB3 ASP B 23 89.401 1.505 -11.278 1.00 0.00 H new ATOM 1805 N LYS B 24 87.285 -1.263 -12.622 1.00 0.00 N ATOM 1806 CA LYS B 24 86.114 -1.883 -11.945 1.00 0.00 C ATOM 1807 C LYS B 24 86.504 -2.133 -10.487 1.00 0.00 C ATOM 1808 O LYS B 24 87.675 -2.176 -10.164 1.00 0.00 O ATOM 1809 CB LYS B 24 85.769 -3.207 -12.631 1.00 0.00 C ATOM 1810 CG LYS B 24 85.238 -2.921 -14.039 1.00 0.00 C ATOM 1811 CD LYS B 24 84.887 -4.238 -14.743 1.00 0.00 C ATOM 1812 CE LYS B 24 86.148 -5.099 -14.925 1.00 0.00 C ATOM 1813 NZ LYS B 24 86.331 -5.967 -13.728 1.00 0.00 N ATOM 0 H LYS B 24 87.811 -1.888 -13.233 1.00 0.00 H new ATOM 0 HA LYS B 24 85.243 -1.230 -11.998 1.00 0.00 H new ATOM 0 HB2 LYS B 24 86.652 -3.844 -12.685 1.00 0.00 H new ATOM 0 HB3 LYS B 24 85.022 -3.747 -12.050 1.00 0.00 H new ATOM 0 HG2 LYS B 24 84.356 -2.283 -13.982 1.00 0.00 H new ATOM 0 HG3 LYS B 24 85.987 -2.379 -14.616 1.00 0.00 H new ATOM 0 HD2 LYS B 24 84.147 -4.784 -14.159 1.00 0.00 H new ATOM 0 HD3 LYS B 24 84.437 -4.030 -15.714 1.00 0.00 H new ATOM 0 HE2 LYS B 24 86.057 -5.712 -15.822 1.00 0.00 H new ATOM 0 HE3 LYS B 24 87.021 -4.461 -15.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 87.238 -5.742 -13.271 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 85.554 -5.801 -13.057 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 86.329 -6.965 -14.019 1.00 0.00 H new ATOM 1827 N HIS B 25 85.562 -2.325 -9.602 1.00 0.00 N ATOM 1828 CA HIS B 25 85.916 -2.596 -8.185 1.00 0.00 C ATOM 1829 C HIS B 25 87.004 -1.637 -7.704 1.00 0.00 C ATOM 1830 O HIS B 25 87.835 -1.995 -6.894 1.00 0.00 O ATOM 1831 CB HIS B 25 86.409 -4.034 -8.088 1.00 0.00 C ATOM 1832 CG HIS B 25 85.248 -4.975 -8.256 1.00 0.00 C ATOM 1833 ND1 HIS B 25 84.425 -5.334 -7.197 1.00 0.00 N ATOM 1834 CD2 HIS B 25 84.755 -5.634 -9.355 1.00 0.00 C ATOM 1835 CE1 HIS B 25 83.490 -6.174 -7.677 1.00 0.00 C ATOM 1836 NE2 HIS B 25 83.648 -6.387 -8.986 1.00 0.00 N ATOM 0 H HIS B 25 84.562 -2.305 -9.803 1.00 0.00 H new ATOM 0 HA HIS B 25 85.040 -2.449 -7.553 1.00 0.00 H new ATOM 0 HB2 HIS B 25 87.159 -4.225 -8.855 1.00 0.00 H new ATOM 0 HB3 HIS B 25 86.889 -4.201 -7.124 1.00 0.00 H new ATOM 0 HD2 HIS B 25 85.165 -5.576 -10.353 1.00 0.00 H new ATOM 0 HE1 HIS B 25 82.709 -6.620 -7.079 1.00 0.00 H new ATOM 0 HE2 HIS B 25 83.076 -6.979 -9.588 1.00 0.00 H new ATOM 1845 N LYS B 26 87.010 -0.420 -8.180 1.00 0.00 N ATOM 1846 CA LYS B 26 88.062 0.529 -7.714 1.00 0.00 C ATOM 1847 C LYS B 26 87.768 1.960 -8.176 1.00 0.00 C ATOM 1848 O LYS B 26 88.083 2.339 -9.288 1.00 0.00 O ATOM 1849 CB LYS B 26 89.419 0.093 -8.267 1.00 0.00 C ATOM 1850 CG LYS B 26 90.509 1.024 -7.732 1.00 0.00 C ATOM 1851 CD LYS B 26 91.892 0.458 -8.072 1.00 0.00 C ATOM 1852 CE LYS B 26 92.078 0.404 -9.591 1.00 0.00 C ATOM 1853 NZ LYS B 26 93.530 0.290 -9.909 1.00 0.00 N ATOM 0 H LYS B 26 86.346 -0.047 -8.858 1.00 0.00 H new ATOM 0 HA LYS B 26 88.073 0.515 -6.624 1.00 0.00 H new ATOM 0 HB2 LYS B 26 89.629 -0.936 -7.976 1.00 0.00 H new ATOM 0 HB3 LYS B 26 89.405 0.119 -9.357 1.00 0.00 H new ATOM 0 HG2 LYS B 26 90.396 2.017 -8.166 1.00 0.00 H new ATOM 0 HG3 LYS B 26 90.407 1.135 -6.652 1.00 0.00 H new ATOM 0 HD2 LYS B 26 92.668 1.079 -7.624 1.00 0.00 H new ATOM 0 HD3 LYS B 26 91.999 -0.541 -7.649 1.00 0.00 H new ATOM 0 HE2 LYS B 26 91.536 -0.447 -10.005 1.00 0.00 H new ATOM 0 HE3 LYS B 26 91.663 1.301 -10.051 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 93.658 0.253 -10.940 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 94.035 1.115 -9.527 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 93.912 -0.578 -9.482 1.00 0.00 H new ATOM 1867 N LEU B 27 87.180 2.762 -7.323 1.00 0.00 N ATOM 1868 CA LEU B 27 86.883 4.179 -7.700 1.00 0.00 C ATOM 1869 C LEU B 27 88.008 5.071 -7.156 1.00 0.00 C ATOM 1870 O LEU B 27 88.368 5.005 -5.997 1.00 0.00 O ATOM 1871 CB LEU B 27 85.535 4.603 -7.094 1.00 0.00 C ATOM 1872 CG LEU B 27 84.386 4.187 -8.023 1.00 0.00 C ATOM 1873 CD1 LEU B 27 84.405 2.668 -8.216 1.00 0.00 C ATOM 1874 CD2 LEU B 27 83.048 4.611 -7.403 1.00 0.00 C ATOM 0 H LEU B 27 86.893 2.496 -6.381 1.00 0.00 H new ATOM 0 HA LEU B 27 86.824 4.277 -8.784 1.00 0.00 H new ATOM 0 HB2 LEU B 27 85.406 4.142 -6.115 1.00 0.00 H new ATOM 0 HB3 LEU B 27 85.519 5.682 -6.943 1.00 0.00 H new ATOM 0 HG LEU B 27 84.508 4.674 -8.991 1.00 0.00 H new ATOM 0 HD11 LEU B 27 83.588 2.375 -8.876 1.00 0.00 H new ATOM 0 HD12 LEU B 27 85.355 2.369 -8.659 1.00 0.00 H new ATOM 0 HD13 LEU B 27 84.285 2.177 -7.250 1.00 0.00 H new ATOM 0 HD21 LEU B 27 82.232 4.316 -8.062 1.00 0.00 H new ATOM 0 HD22 LEU B 27 82.926 4.126 -6.435 1.00 0.00 H new ATOM 0 HD23 LEU B 27 83.035 5.693 -7.271 1.00 0.00 H new ATOM 1886 N LYS B 28 88.574 5.890 -8.000 1.00 0.00 N ATOM 1887 CA LYS B 28 89.691 6.785 -7.567 1.00 0.00 C ATOM 1888 C LYS B 28 89.133 8.088 -6.982 1.00 0.00 C ATOM 1889 O LYS B 28 88.012 8.471 -7.253 1.00 0.00 O ATOM 1890 CB LYS B 28 90.582 7.093 -8.774 1.00 0.00 C ATOM 1891 CG LYS B 28 91.862 7.796 -8.315 1.00 0.00 C ATOM 1892 CD LYS B 28 92.749 8.074 -9.528 1.00 0.00 C ATOM 1893 CE LYS B 28 94.048 8.736 -9.067 1.00 0.00 C ATOM 1894 NZ LYS B 28 94.985 8.852 -10.219 1.00 0.00 N ATOM 0 H LYS B 28 88.309 5.980 -8.981 1.00 0.00 H new ATOM 0 HA LYS B 28 90.277 6.284 -6.796 1.00 0.00 H new ATOM 0 HB2 LYS B 28 90.832 6.170 -9.297 1.00 0.00 H new ATOM 0 HB3 LYS B 28 90.044 7.724 -9.481 1.00 0.00 H new ATOM 0 HG2 LYS B 28 91.616 8.729 -7.808 1.00 0.00 H new ATOM 0 HG3 LYS B 28 92.394 7.174 -7.596 1.00 0.00 H new ATOM 0 HD2 LYS B 28 92.968 7.144 -10.053 1.00 0.00 H new ATOM 0 HD3 LYS B 28 92.228 8.722 -10.232 1.00 0.00 H new ATOM 0 HE2 LYS B 28 93.839 9.723 -8.655 1.00 0.00 H new ATOM 0 HE3 LYS B 28 94.505 8.148 -8.271 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 95.868 9.302 -9.904 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 95.194 7.904 -10.593 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 94.548 9.430 -10.965 1.00 0.00 H new ATOM 1908 N LYS B 29 89.903 8.764 -6.169 1.00 0.00 N ATOM 1909 CA LYS B 29 89.414 10.031 -5.551 1.00 0.00 C ATOM 1910 C LYS B 29 88.962 11.000 -6.648 1.00 0.00 C ATOM 1911 O LYS B 29 87.898 11.582 -6.572 1.00 0.00 O ATOM 1912 CB LYS B 29 90.553 10.658 -4.745 1.00 0.00 C ATOM 1913 CG LYS B 29 90.075 11.961 -4.100 1.00 0.00 C ATOM 1914 CD LYS B 29 91.111 12.441 -3.077 1.00 0.00 C ATOM 1915 CE LYS B 29 92.434 12.754 -3.781 1.00 0.00 C ATOM 1916 NZ LYS B 29 93.279 13.602 -2.892 1.00 0.00 N ATOM 0 H LYS B 29 90.850 8.492 -5.907 1.00 0.00 H new ATOM 0 HA LYS B 29 88.569 9.821 -4.895 1.00 0.00 H new ATOM 0 HB2 LYS B 29 90.892 9.964 -3.976 1.00 0.00 H new ATOM 0 HB3 LYS B 29 91.406 10.855 -5.395 1.00 0.00 H new ATOM 0 HG2 LYS B 29 89.925 12.723 -4.865 1.00 0.00 H new ATOM 0 HG3 LYS B 29 89.113 11.805 -3.612 1.00 0.00 H new ATOM 0 HD2 LYS B 29 90.743 13.330 -2.564 1.00 0.00 H new ATOM 0 HD3 LYS B 29 91.266 11.675 -2.317 1.00 0.00 H new ATOM 0 HE2 LYS B 29 92.957 11.829 -4.024 1.00 0.00 H new ATOM 0 HE3 LYS B 29 92.245 13.270 -4.722 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 94.232 13.689 -3.299 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 92.852 14.546 -2.804 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 93.343 13.163 -1.952 1.00 0.00 H new ATOM 1930 N SER B 30 89.744 11.164 -7.678 1.00 0.00 N ATOM 1931 CA SER B 30 89.334 12.077 -8.784 1.00 0.00 C ATOM 1932 C SER B 30 88.018 11.561 -9.372 1.00 0.00 C ATOM 1933 O SER B 30 87.126 12.315 -9.707 1.00 0.00 O ATOM 1934 CB SER B 30 90.415 12.087 -9.866 1.00 0.00 C ATOM 1935 OG SER B 30 90.443 10.823 -10.514 1.00 0.00 O ATOM 0 H SER B 30 90.647 10.707 -7.803 1.00 0.00 H new ATOM 0 HA SER B 30 89.203 13.091 -8.407 1.00 0.00 H new ATOM 0 HB2 SER B 30 90.213 12.876 -10.591 1.00 0.00 H new ATOM 0 HB3 SER B 30 91.387 12.303 -9.423 1.00 0.00 H new ATOM 0 HG SER B 30 91.134 10.827 -11.209 1.00 0.00 H new ATOM 1941 N GLU B 31 87.890 10.268 -9.455 1.00 0.00 N ATOM 1942 CA GLU B 31 86.629 9.670 -9.972 1.00 0.00 C ATOM 1943 C GLU B 31 85.526 9.903 -8.934 1.00 0.00 C ATOM 1944 O GLU B 31 84.397 10.215 -9.258 1.00 0.00 O ATOM 1945 CB GLU B 31 86.818 8.168 -10.204 1.00 0.00 C ATOM 1946 CG GLU B 31 85.523 7.572 -10.764 1.00 0.00 C ATOM 1947 CD GLU B 31 85.725 6.083 -11.044 1.00 0.00 C ATOM 1948 OE1 GLU B 31 86.853 5.631 -10.957 1.00 0.00 O ATOM 1949 OE2 GLU B 31 84.746 5.421 -11.347 1.00 0.00 O ATOM 0 H GLU B 31 88.608 9.596 -9.186 1.00 0.00 H new ATOM 0 HA GLU B 31 86.357 10.134 -10.920 1.00 0.00 H new ATOM 0 HB2 GLU B 31 87.640 7.997 -10.899 1.00 0.00 H new ATOM 0 HB3 GLU B 31 87.083 7.675 -9.269 1.00 0.00 H new ATOM 0 HG2 GLU B 31 84.709 7.712 -10.053 1.00 0.00 H new ATOM 0 HG3 GLU B 31 85.239 8.090 -11.680 1.00 0.00 H new ATOM 1956 N LEU B 32 85.870 9.764 -7.682 1.00 0.00 N ATOM 1957 CA LEU B 32 84.871 9.988 -6.598 1.00 0.00 C ATOM 1958 C LEU B 32 84.379 11.438 -6.670 1.00 0.00 C ATOM 1959 O LEU B 32 83.197 11.711 -6.598 1.00 0.00 O ATOM 1960 CB LEU B 32 85.519 9.718 -5.233 1.00 0.00 C ATOM 1961 CG LEU B 32 84.510 9.941 -4.093 1.00 0.00 C ATOM 1962 CD1 LEU B 32 83.357 8.933 -4.197 1.00 0.00 C ATOM 1963 CD2 LEU B 32 85.228 9.756 -2.750 1.00 0.00 C ATOM 0 H LEU B 32 86.803 9.504 -7.362 1.00 0.00 H new ATOM 0 HA LEU B 32 84.027 9.310 -6.724 1.00 0.00 H new ATOM 0 HB2 LEU B 32 85.892 8.694 -5.199 1.00 0.00 H new ATOM 0 HB3 LEU B 32 86.378 10.375 -5.097 1.00 0.00 H new ATOM 0 HG LEU B 32 84.103 10.949 -4.166 1.00 0.00 H new ATOM 0 HD11 LEU B 32 82.651 9.103 -3.384 1.00 0.00 H new ATOM 0 HD12 LEU B 32 82.848 9.060 -5.152 1.00 0.00 H new ATOM 0 HD13 LEU B 32 83.752 7.920 -4.129 1.00 0.00 H new ATOM 0 HD21 LEU B 32 84.521 9.912 -1.935 1.00 0.00 H new ATOM 0 HD22 LEU B 32 85.633 8.746 -2.690 1.00 0.00 H new ATOM 0 HD23 LEU B 32 86.040 10.478 -2.669 1.00 0.00 H new ATOM 1975 N LYS B 33 85.284 12.367 -6.812 1.00 0.00 N ATOM 1976 CA LYS B 33 84.886 13.801 -6.891 1.00 0.00 C ATOM 1977 C LYS B 33 83.981 14.018 -8.107 1.00 0.00 C ATOM 1978 O LYS B 33 83.007 14.742 -8.049 1.00 0.00 O ATOM 1979 CB LYS B 33 86.142 14.670 -7.033 1.00 0.00 C ATOM 1980 CG LYS B 33 85.746 16.151 -7.057 1.00 0.00 C ATOM 1981 CD LYS B 33 86.998 17.019 -7.198 1.00 0.00 C ATOM 1982 CE LYS B 33 86.591 18.493 -7.215 1.00 0.00 C ATOM 1983 NZ LYS B 33 87.798 19.345 -7.409 1.00 0.00 N ATOM 0 H LYS B 33 86.287 12.194 -6.877 1.00 0.00 H new ATOM 0 HA LYS B 33 84.348 14.077 -5.984 1.00 0.00 H new ATOM 0 HB2 LYS B 33 86.823 14.479 -6.204 1.00 0.00 H new ATOM 0 HB3 LYS B 33 86.674 14.411 -7.949 1.00 0.00 H new ATOM 0 HG2 LYS B 33 85.065 16.342 -7.886 1.00 0.00 H new ATOM 0 HG3 LYS B 33 85.214 16.410 -6.142 1.00 0.00 H new ATOM 0 HD2 LYS B 33 87.682 16.828 -6.371 1.00 0.00 H new ATOM 0 HD3 LYS B 33 87.529 16.766 -8.116 1.00 0.00 H new ATOM 0 HE2 LYS B 33 85.874 18.673 -8.016 1.00 0.00 H new ATOM 0 HE3 LYS B 33 86.096 18.754 -6.280 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 87.518 20.346 -7.420 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 88.467 19.181 -6.630 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 88.252 19.103 -8.313 1.00 0.00 H new ATOM 1997 N GLU B 34 84.303 13.400 -9.209 1.00 0.00 N ATOM 1998 CA GLU B 34 83.468 13.577 -10.431 1.00 0.00 C ATOM 1999 C GLU B 34 82.044 13.104 -10.140 1.00 0.00 C ATOM 2000 O GLU B 34 81.077 13.745 -10.500 1.00 0.00 O ATOM 2001 CB GLU B 34 84.061 12.758 -11.584 1.00 0.00 C ATOM 2002 CG GLU B 34 83.224 12.961 -12.852 1.00 0.00 C ATOM 2003 CD GLU B 34 83.824 12.142 -13.997 1.00 0.00 C ATOM 2004 OE1 GLU B 34 84.917 11.629 -13.824 1.00 0.00 O ATOM 2005 OE2 GLU B 34 83.179 12.042 -15.029 1.00 0.00 O ATOM 0 H GLU B 34 85.107 12.781 -9.317 1.00 0.00 H new ATOM 0 HA GLU B 34 83.451 14.630 -10.714 1.00 0.00 H new ATOM 0 HB2 GLU B 34 85.092 13.062 -11.765 1.00 0.00 H new ATOM 0 HB3 GLU B 34 84.083 11.701 -11.317 1.00 0.00 H new ATOM 0 HG2 GLU B 34 82.193 12.655 -12.673 1.00 0.00 H new ATOM 0 HG3 GLU B 34 83.201 14.017 -13.120 1.00 0.00 H new ATOM 2012 N LEU B 35 81.914 11.978 -9.501 1.00 0.00 N ATOM 2013 CA LEU B 35 80.561 11.436 -9.188 1.00 0.00 C ATOM 2014 C LEU B 35 79.778 12.429 -8.311 1.00 0.00 C ATOM 2015 O LEU B 35 78.619 12.702 -8.553 1.00 0.00 O ATOM 2016 CB LEU B 35 80.729 10.097 -8.449 1.00 0.00 C ATOM 2017 CG LEU B 35 79.364 9.478 -8.096 1.00 0.00 C ATOM 2018 CD1 LEU B 35 78.656 8.992 -9.369 1.00 0.00 C ATOM 2019 CD2 LEU B 35 79.582 8.286 -7.160 1.00 0.00 C ATOM 0 H LEU B 35 82.693 11.403 -9.178 1.00 0.00 H new ATOM 0 HA LEU B 35 80.003 11.284 -10.112 1.00 0.00 H new ATOM 0 HB2 LEU B 35 81.295 9.404 -9.072 1.00 0.00 H new ATOM 0 HB3 LEU B 35 81.307 10.252 -7.538 1.00 0.00 H new ATOM 0 HG LEU B 35 78.746 10.232 -7.609 1.00 0.00 H new ATOM 0 HD11 LEU B 35 77.692 8.556 -9.106 1.00 0.00 H new ATOM 0 HD12 LEU B 35 78.501 9.834 -10.043 1.00 0.00 H new ATOM 0 HD13 LEU B 35 79.271 8.240 -9.863 1.00 0.00 H new ATOM 0 HD21 LEU B 35 78.619 7.842 -6.906 1.00 0.00 H new ATOM 0 HD22 LEU B 35 80.204 7.542 -7.657 1.00 0.00 H new ATOM 0 HD23 LEU B 35 80.078 8.624 -6.250 1.00 0.00 H new ATOM 2031 N ILE B 36 80.391 12.949 -7.279 1.00 0.00 N ATOM 2032 CA ILE B 36 79.665 13.893 -6.371 1.00 0.00 C ATOM 2033 C ILE B 36 79.176 15.129 -7.135 1.00 0.00 C ATOM 2034 O ILE B 36 78.031 15.518 -7.026 1.00 0.00 O ATOM 2035 CB ILE B 36 80.600 14.335 -5.243 1.00 0.00 C ATOM 2036 CG1 ILE B 36 81.024 13.112 -4.426 1.00 0.00 C ATOM 2037 CG2 ILE B 36 79.866 15.326 -4.335 1.00 0.00 C ATOM 2038 CD1 ILE B 36 82.144 13.502 -3.459 1.00 0.00 C ATOM 0 H ILE B 36 81.361 12.763 -7.024 1.00 0.00 H new ATOM 0 HA ILE B 36 78.798 13.375 -5.961 1.00 0.00 H new ATOM 0 HB ILE B 36 81.483 14.814 -5.666 1.00 0.00 H new ATOM 0 HG12 ILE B 36 80.172 12.720 -3.871 1.00 0.00 H new ATOM 0 HG13 ILE B 36 81.364 12.318 -5.091 1.00 0.00 H new ATOM 0 HG21 ILE B 36 80.530 15.643 -3.530 1.00 0.00 H new ATOM 0 HG22 ILE B 36 79.561 16.196 -4.917 1.00 0.00 H new ATOM 0 HG23 ILE B 36 78.984 14.846 -3.910 1.00 0.00 H new ATOM 0 HD11 ILE B 36 82.444 12.629 -2.879 1.00 0.00 H new ATOM 0 HD12 ILE B 36 82.999 13.874 -4.024 1.00 0.00 H new ATOM 0 HD13 ILE B 36 81.788 14.281 -2.785 1.00 0.00 H new ATOM 2050 N ASN B 37 80.028 15.761 -7.889 1.00 0.00 N ATOM 2051 CA ASN B 37 79.601 16.981 -8.632 1.00 0.00 C ATOM 2052 C ASN B 37 78.456 16.640 -9.593 1.00 0.00 C ATOM 2053 O ASN B 37 77.525 17.402 -9.762 1.00 0.00 O ATOM 2054 CB ASN B 37 80.788 17.523 -9.433 1.00 0.00 C ATOM 2055 CG ASN B 37 80.372 18.793 -10.177 1.00 0.00 C ATOM 2056 OD1 ASN B 37 79.691 19.636 -9.628 1.00 0.00 O ATOM 2057 ND2 ASN B 37 80.760 18.969 -11.411 1.00 0.00 N ATOM 0 H ASN B 37 81.001 15.488 -8.024 1.00 0.00 H new ATOM 0 HA ASN B 37 79.257 17.731 -7.920 1.00 0.00 H new ATOM 0 HB2 ASN B 37 81.622 17.738 -8.765 1.00 0.00 H new ATOM 0 HB3 ASN B 37 81.134 16.771 -10.142 1.00 0.00 H new ATOM 0 HD21 ASN B 37 80.491 19.814 -11.914 1.00 0.00 H new ATOM 0 HD22 ASN B 37 81.332 18.261 -11.872 1.00 0.00 H new ATOM 2064 N ASN B 38 78.532 15.509 -10.233 1.00 0.00 N ATOM 2065 CA ASN B 38 77.463 15.120 -11.198 1.00 0.00 C ATOM 2066 C ASN B 38 76.208 14.633 -10.462 1.00 0.00 C ATOM 2067 O ASN B 38 75.099 15.001 -10.797 1.00 0.00 O ATOM 2068 CB ASN B 38 77.987 13.988 -12.083 1.00 0.00 C ATOM 2069 CG ASN B 38 79.073 14.528 -13.014 1.00 0.00 C ATOM 2070 OD1 ASN B 38 79.068 15.692 -13.362 1.00 0.00 O ATOM 2071 ND2 ASN B 38 80.014 13.726 -13.431 1.00 0.00 N ATOM 0 H ASN B 38 79.290 14.834 -10.131 1.00 0.00 H new ATOM 0 HA ASN B 38 77.199 15.991 -11.797 1.00 0.00 H new ATOM 0 HB2 ASN B 38 78.389 13.186 -11.465 1.00 0.00 H new ATOM 0 HB3 ASN B 38 77.171 13.562 -12.667 1.00 0.00 H new ATOM 0 HD21 ASN B 38 80.746 14.076 -14.049 1.00 0.00 H new ATOM 0 HD22 ASN B 38 80.018 12.749 -13.139 1.00 0.00 H new ATOM 2078 N GLU B 39 76.374 13.769 -9.495 1.00 0.00 N ATOM 2079 CA GLU B 39 75.186 13.208 -8.775 1.00 0.00 C ATOM 2080 C GLU B 39 74.692 14.121 -7.645 1.00 0.00 C ATOM 2081 O GLU B 39 73.623 14.692 -7.731 1.00 0.00 O ATOM 2082 CB GLU B 39 75.553 11.843 -8.186 1.00 0.00 C ATOM 2083 CG GLU B 39 75.723 10.821 -9.313 1.00 0.00 C ATOM 2084 CD GLU B 39 74.359 10.518 -9.938 1.00 0.00 C ATOM 2085 OE1 GLU B 39 73.367 10.660 -9.243 1.00 0.00 O ATOM 2086 OE2 GLU B 39 74.331 10.148 -11.101 1.00 0.00 O ATOM 0 H GLU B 39 77.278 13.426 -9.171 1.00 0.00 H new ATOM 0 HA GLU B 39 74.379 13.119 -9.502 1.00 0.00 H new ATOM 0 HB2 GLU B 39 76.476 11.921 -7.611 1.00 0.00 H new ATOM 0 HB3 GLU B 39 74.775 11.513 -7.497 1.00 0.00 H new ATOM 0 HG2 GLU B 39 76.404 11.209 -10.071 1.00 0.00 H new ATOM 0 HG3 GLU B 39 76.168 9.905 -8.924 1.00 0.00 H new ATOM 2093 N LEU B 40 75.422 14.225 -6.567 1.00 0.00 N ATOM 2094 CA LEU B 40 74.940 15.056 -5.418 1.00 0.00 C ATOM 2095 C LEU B 40 75.453 16.491 -5.511 1.00 0.00 C ATOM 2096 O LEU B 40 76.641 16.746 -5.506 1.00 0.00 O ATOM 2097 CB LEU B 40 75.440 14.441 -4.109 1.00 0.00 C ATOM 2098 CG LEU B 40 74.966 12.987 -3.994 1.00 0.00 C ATOM 2099 CD1 LEU B 40 75.487 12.394 -2.680 1.00 0.00 C ATOM 2100 CD2 LEU B 40 73.427 12.927 -4.014 1.00 0.00 C ATOM 0 H LEU B 40 76.327 13.774 -6.429 1.00 0.00 H new ATOM 0 HA LEU B 40 73.851 15.075 -5.448 1.00 0.00 H new ATOM 0 HB2 LEU B 40 76.529 14.481 -4.072 1.00 0.00 H new ATOM 0 HB3 LEU B 40 75.071 15.020 -3.262 1.00 0.00 H new ATOM 0 HG LEU B 40 75.350 12.414 -4.838 1.00 0.00 H new ATOM 0 HD11 LEU B 40 75.154 11.360 -2.590 1.00 0.00 H new ATOM 0 HD12 LEU B 40 76.576 12.427 -2.673 1.00 0.00 H new ATOM 0 HD13 LEU B 40 75.101 12.973 -1.841 1.00 0.00 H new ATOM 0 HD21 LEU B 40 73.102 11.890 -3.932 1.00 0.00 H new ATOM 0 HD22 LEU B 40 73.030 13.499 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU B 40 73.059 13.350 -4.949 1.00 0.00 H new ATOM 2112 N SER B 41 74.548 17.432 -5.558 1.00 0.00 N ATOM 2113 CA SER B 41 74.935 18.874 -5.611 1.00 0.00 C ATOM 2114 C SER B 41 74.039 19.637 -4.636 1.00 0.00 C ATOM 2115 O SER B 41 74.499 20.417 -3.825 1.00 0.00 O ATOM 2116 CB SER B 41 74.731 19.420 -7.027 1.00 0.00 C ATOM 2117 OG SER B 41 75.538 18.682 -7.936 1.00 0.00 O ATOM 0 H SER B 41 73.542 17.261 -5.562 1.00 0.00 H new ATOM 0 HA SER B 41 75.985 18.991 -5.341 1.00 0.00 H new ATOM 0 HB2 SER B 41 73.681 19.344 -7.311 1.00 0.00 H new ATOM 0 HB3 SER B 41 74.996 20.477 -7.063 1.00 0.00 H new ATOM 0 HG SER B 41 75.409 19.028 -8.844 1.00 0.00 H new ATOM 2123 N HIS B 42 72.756 19.402 -4.708 1.00 0.00 N ATOM 2124 CA HIS B 42 71.807 20.088 -3.790 1.00 0.00 C ATOM 2125 C HIS B 42 71.854 19.417 -2.411 1.00 0.00 C ATOM 2126 O HIS B 42 71.447 19.989 -1.418 1.00 0.00 O ATOM 2127 CB HIS B 42 70.390 19.992 -4.360 1.00 0.00 C ATOM 2128 CG HIS B 42 70.290 20.811 -5.621 1.00 0.00 C ATOM 2129 ND1 HIS B 42 69.533 20.400 -6.710 1.00 0.00 N ATOM 2130 CD2 HIS B 42 70.842 22.018 -5.983 1.00 0.00 C ATOM 2131 CE1 HIS B 42 69.650 21.342 -7.665 1.00 0.00 C ATOM 2132 NE2 HIS B 42 70.435 22.346 -7.271 1.00 0.00 N ATOM 0 H HIS B 42 72.323 18.758 -5.370 1.00 0.00 H new ATOM 0 HA HIS B 42 72.088 21.137 -3.691 1.00 0.00 H new ATOM 0 HB2 HIS B 42 70.143 18.952 -4.571 1.00 0.00 H new ATOM 0 HB3 HIS B 42 69.668 20.349 -3.626 1.00 0.00 H new ATOM 0 HD2 HIS B 42 71.491 22.618 -5.362 1.00 0.00 H new ATOM 0 HE1 HIS B 42 69.168 21.291 -8.630 1.00 0.00 H new ATOM 0 HE2 HIS B 42 70.684 23.180 -7.803 1.00 0.00 H new ATOM 2141 N PHE B 43 72.335 18.199 -2.345 1.00 0.00 N ATOM 2142 CA PHE B 43 72.395 17.476 -1.032 1.00 0.00 C ATOM 2143 C PHE B 43 73.812 17.558 -0.459 1.00 0.00 C ATOM 2144 O PHE B 43 74.023 17.346 0.719 1.00 0.00 O ATOM 2145 CB PHE B 43 72.034 16.001 -1.246 1.00 0.00 C ATOM 2146 CG PHE B 43 70.565 15.872 -1.572 1.00 0.00 C ATOM 2147 CD1 PHE B 43 70.132 15.929 -2.901 1.00 0.00 C ATOM 2148 CD2 PHE B 43 69.637 15.680 -0.541 1.00 0.00 C ATOM 2149 CE1 PHE B 43 68.769 15.798 -3.199 1.00 0.00 C ATOM 2150 CE2 PHE B 43 68.275 15.549 -0.839 1.00 0.00 C ATOM 2151 CZ PHE B 43 67.842 15.609 -2.168 1.00 0.00 C ATOM 0 H PHE B 43 72.689 17.672 -3.143 1.00 0.00 H new ATOM 0 HA PHE B 43 71.691 17.937 -0.339 1.00 0.00 H new ATOM 0 HB2 PHE B 43 72.633 15.585 -2.056 1.00 0.00 H new ATOM 0 HB3 PHE B 43 72.268 15.427 -0.350 1.00 0.00 H new ATOM 0 HD1 PHE B 43 70.848 16.074 -3.697 1.00 0.00 H new ATOM 0 HD2 PHE B 43 69.972 15.633 0.485 1.00 0.00 H new ATOM 0 HE1 PHE B 43 68.434 15.843 -4.225 1.00 0.00 H new ATOM 0 HE2 PHE B 43 67.559 15.402 -0.044 1.00 0.00 H new ATOM 0 HZ PHE B 43 66.792 15.509 -2.398 1.00 0.00 H new ATOM 2161 N LEU B 44 74.783 17.878 -1.270 1.00 0.00 N ATOM 2162 CA LEU B 44 76.178 17.985 -0.752 1.00 0.00 C ATOM 2163 C LEU B 44 76.997 18.866 -1.688 1.00 0.00 C ATOM 2164 O LEU B 44 76.945 18.733 -2.894 1.00 0.00 O ATOM 2165 CB LEU B 44 76.815 16.595 -0.678 1.00 0.00 C ATOM 2166 CG LEU B 44 78.256 16.685 -0.146 1.00 0.00 C ATOM 2167 CD1 LEU B 44 78.261 17.239 1.288 1.00 0.00 C ATOM 2168 CD2 LEU B 44 78.875 15.284 -0.159 1.00 0.00 C ATOM 0 H LEU B 44 74.672 18.070 -2.266 1.00 0.00 H new ATOM 0 HA LEU B 44 76.158 18.424 0.246 1.00 0.00 H new ATOM 0 HB2 LEU B 44 76.222 15.952 -0.028 1.00 0.00 H new ATOM 0 HB3 LEU B 44 76.815 16.136 -1.667 1.00 0.00 H new ATOM 0 HG LEU B 44 78.836 17.356 -0.780 1.00 0.00 H new ATOM 0 HD11 LEU B 44 79.287 17.297 1.652 1.00 0.00 H new ATOM 0 HD12 LEU B 44 77.816 18.234 1.295 1.00 0.00 H new ATOM 0 HD13 LEU B 44 77.683 16.579 1.935 1.00 0.00 H new ATOM 0 HD21 LEU B 44 79.897 15.334 0.216 1.00 0.00 H new ATOM 0 HD22 LEU B 44 78.288 14.621 0.476 1.00 0.00 H new ATOM 0 HD23 LEU B 44 78.881 14.898 -1.179 1.00 0.00 H new ATOM 2180 N GLU B 45 77.764 19.755 -1.136 1.00 0.00 N ATOM 2181 CA GLU B 45 78.605 20.641 -1.983 1.00 0.00 C ATOM 2182 C GLU B 45 79.557 21.427 -1.075 1.00 0.00 C ATOM 2183 O GLU B 45 80.176 20.875 -0.188 1.00 0.00 O ATOM 2184 CB GLU B 45 77.701 21.604 -2.769 1.00 0.00 C ATOM 2185 CG GLU B 45 78.445 22.134 -4.003 1.00 0.00 C ATOM 2186 CD GLU B 45 77.498 23.000 -4.838 1.00 0.00 C ATOM 2187 OE1 GLU B 45 76.372 23.193 -4.411 1.00 0.00 O ATOM 2188 OE2 GLU B 45 77.918 23.459 -5.887 1.00 0.00 O ATOM 0 H GLU B 45 77.847 19.909 -0.131 1.00 0.00 H new ATOM 0 HA GLU B 45 79.185 20.050 -2.692 1.00 0.00 H new ATOM 0 HB2 GLU B 45 76.790 21.091 -3.076 1.00 0.00 H new ATOM 0 HB3 GLU B 45 77.400 22.435 -2.131 1.00 0.00 H new ATOM 0 HG2 GLU B 45 79.312 22.718 -3.695 1.00 0.00 H new ATOM 0 HG3 GLU B 45 78.817 21.302 -4.601 1.00 0.00 H new ATOM 2195 N GLU B 46 79.674 22.710 -1.281 1.00 0.00 N ATOM 2196 CA GLU B 46 80.581 23.530 -0.428 1.00 0.00 C ATOM 2197 C GLU B 46 81.985 22.916 -0.428 1.00 0.00 C ATOM 2198 O GLU B 46 82.728 23.044 0.525 1.00 0.00 O ATOM 2199 CB GLU B 46 80.042 23.587 1.005 1.00 0.00 C ATOM 2200 CG GLU B 46 78.695 24.315 1.015 1.00 0.00 C ATOM 2201 CD GLU B 46 78.912 25.795 0.698 1.00 0.00 C ATOM 2202 OE1 GLU B 46 80.026 26.261 0.872 1.00 0.00 O ATOM 2203 OE2 GLU B 46 77.961 26.438 0.287 1.00 0.00 O ATOM 0 H GLU B 46 79.178 23.228 -2.006 1.00 0.00 H new ATOM 0 HA GLU B 46 80.630 24.542 -0.830 1.00 0.00 H new ATOM 0 HB2 GLU B 46 79.925 22.578 1.401 1.00 0.00 H new ATOM 0 HB3 GLU B 46 80.751 24.103 1.652 1.00 0.00 H new ATOM 0 HG2 GLU B 46 78.024 23.870 0.281 1.00 0.00 H new ATOM 0 HG3 GLU B 46 78.219 24.207 1.989 1.00 0.00 H new ATOM 2210 N ILE B 47 82.362 22.260 -1.496 1.00 0.00 N ATOM 2211 CA ILE B 47 83.728 21.652 -1.565 1.00 0.00 C ATOM 2212 C ILE B 47 84.659 22.631 -2.280 1.00 0.00 C ATOM 2213 O ILE B 47 84.477 22.941 -3.440 1.00 0.00 O ATOM 2214 CB ILE B 47 83.661 20.337 -2.346 1.00 0.00 C ATOM 2215 CG1 ILE B 47 82.851 19.314 -1.545 1.00 0.00 C ATOM 2216 CG2 ILE B 47 85.077 19.802 -2.569 1.00 0.00 C ATOM 2217 CD1 ILE B 47 82.533 18.102 -2.422 1.00 0.00 C ATOM 0 H ILE B 47 81.784 22.118 -2.324 1.00 0.00 H new ATOM 0 HA ILE B 47 84.102 21.450 -0.561 1.00 0.00 H new ATOM 0 HB ILE B 47 83.183 20.510 -3.310 1.00 0.00 H new ATOM 0 HG12 ILE B 47 83.413 19.000 -0.665 1.00 0.00 H new ATOM 0 HG13 ILE B 47 81.927 19.768 -1.188 1.00 0.00 H new ATOM 0 HG21 ILE B 47 85.029 18.866 -3.125 1.00 0.00 H new ATOM 0 HG22 ILE B 47 85.656 20.531 -3.135 1.00 0.00 H new ATOM 0 HG23 ILE B 47 85.556 19.628 -1.606 1.00 0.00 H new ATOM 0 HD11 ILE B 47 81.957 17.378 -1.847 1.00 0.00 H new ATOM 0 HD12 ILE B 47 81.953 18.422 -3.288 1.00 0.00 H new ATOM 0 HD13 ILE B 47 83.462 17.642 -2.758 1.00 0.00 H new ATOM 2229 N LYS B 48 85.647 23.137 -1.589 1.00 0.00 N ATOM 2230 CA LYS B 48 86.583 24.114 -2.220 1.00 0.00 C ATOM 2231 C LYS B 48 87.765 23.389 -2.866 1.00 0.00 C ATOM 2232 O LYS B 48 87.815 23.216 -4.068 1.00 0.00 O ATOM 2233 CB LYS B 48 87.103 25.079 -1.151 1.00 0.00 C ATOM 2234 CG LYS B 48 85.966 26.000 -0.705 1.00 0.00 C ATOM 2235 CD LYS B 48 86.397 26.799 0.531 1.00 0.00 C ATOM 2236 CE LYS B 48 87.509 27.785 0.159 1.00 0.00 C ATOM 2237 NZ LYS B 48 87.598 28.843 1.207 1.00 0.00 N ATOM 0 H LYS B 48 85.846 22.915 -0.614 1.00 0.00 H new ATOM 0 HA LYS B 48 86.046 24.665 -2.992 1.00 0.00 H new ATOM 0 HB2 LYS B 48 87.490 24.521 -0.298 1.00 0.00 H new ATOM 0 HB3 LYS B 48 87.929 25.669 -1.548 1.00 0.00 H new ATOM 0 HG2 LYS B 48 85.699 26.680 -1.514 1.00 0.00 H new ATOM 0 HG3 LYS B 48 85.077 25.411 -0.477 1.00 0.00 H new ATOM 0 HD2 LYS B 48 85.543 27.339 0.940 1.00 0.00 H new ATOM 0 HD3 LYS B 48 86.747 26.120 1.309 1.00 0.00 H new ATOM 0 HE2 LYS B 48 88.461 27.262 0.072 1.00 0.00 H new ATOM 0 HE3 LYS B 48 87.303 28.235 -0.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 88.352 29.515 0.959 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 86.691 29.348 1.269 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 87.813 28.405 2.125 1.00 0.00 H new ATOM 2251 N GLU B 49 88.733 22.992 -2.078 1.00 0.00 N ATOM 2252 CA GLU B 49 89.941 22.308 -2.638 1.00 0.00 C ATOM 2253 C GLU B 49 89.864 20.795 -2.412 1.00 0.00 C ATOM 2254 O GLU B 49 89.055 20.302 -1.651 1.00 0.00 O ATOM 2255 CB GLU B 49 91.187 22.852 -1.938 1.00 0.00 C ATOM 2256 CG GLU B 49 91.282 24.363 -2.157 1.00 0.00 C ATOM 2257 CD GLU B 49 92.530 24.900 -1.455 1.00 0.00 C ATOM 2258 OE1 GLU B 49 93.140 24.146 -0.715 1.00 0.00 O ATOM 2259 OE2 GLU B 49 92.858 26.054 -1.675 1.00 0.00 O ATOM 0 H GLU B 49 88.739 23.113 -1.065 1.00 0.00 H new ATOM 0 HA GLU B 49 89.987 22.500 -3.710 1.00 0.00 H new ATOM 0 HB2 GLU B 49 91.142 22.631 -0.872 1.00 0.00 H new ATOM 0 HB3 GLU B 49 92.079 22.361 -2.328 1.00 0.00 H new ATOM 0 HG2 GLU B 49 91.327 24.585 -3.223 1.00 0.00 H new ATOM 0 HG3 GLU B 49 90.391 24.855 -1.766 1.00 0.00 H new ATOM 2266 N GLN B 50 90.718 20.062 -3.073 1.00 0.00 N ATOM 2267 CA GLN B 50 90.737 18.579 -2.924 1.00 0.00 C ATOM 2268 C GLN B 50 91.014 18.221 -1.459 1.00 0.00 C ATOM 2269 O GLN B 50 90.457 17.288 -0.917 1.00 0.00 O ATOM 2270 CB GLN B 50 91.842 18.010 -3.819 1.00 0.00 C ATOM 2271 CG GLN B 50 91.834 16.482 -3.750 1.00 0.00 C ATOM 2272 CD GLN B 50 92.870 15.926 -4.729 1.00 0.00 C ATOM 2273 OE1 GLN B 50 92.562 15.671 -5.877 1.00 0.00 O ATOM 2274 NE2 GLN B 50 94.097 15.732 -4.327 1.00 0.00 N ATOM 0 H GLN B 50 91.414 20.434 -3.720 1.00 0.00 H new ATOM 0 HA GLN B 50 89.775 18.157 -3.217 1.00 0.00 H new ATOM 0 HB2 GLN B 50 91.693 18.337 -4.848 1.00 0.00 H new ATOM 0 HB3 GLN B 50 92.812 18.392 -3.501 1.00 0.00 H new ATOM 0 HG2 GLN B 50 92.060 16.151 -2.736 1.00 0.00 H new ATOM 0 HG3 GLN B 50 90.843 16.101 -3.996 1.00 0.00 H new ATOM 0 HE21 GLN B 50 94.358 15.945 -3.364 1.00 0.00 H new ATOM 0 HE22 GLN B 50 94.795 15.367 -4.976 1.00 0.00 H new ATOM 2283 N GLU B 51 91.871 18.960 -0.818 1.00 0.00 N ATOM 2284 CA GLU B 51 92.184 18.666 0.613 1.00 0.00 C ATOM 2285 C GLU B 51 90.872 18.472 1.386 1.00 0.00 C ATOM 2286 O GLU B 51 90.799 17.696 2.319 1.00 0.00 O ATOM 2287 CB GLU B 51 92.984 19.820 1.228 1.00 0.00 C ATOM 2288 CG GLU B 51 94.405 19.831 0.656 1.00 0.00 C ATOM 2289 CD GLU B 51 94.375 20.300 -0.798 1.00 0.00 C ATOM 2290 OE1 GLU B 51 93.350 20.809 -1.212 1.00 0.00 O ATOM 2291 OE2 GLU B 51 95.381 20.148 -1.471 1.00 0.00 O ATOM 0 H GLU B 51 92.370 19.755 -1.218 1.00 0.00 H new ATOM 0 HA GLU B 51 92.783 17.757 0.672 1.00 0.00 H new ATOM 0 HB2 GLU B 51 92.491 20.769 1.018 1.00 0.00 H new ATOM 0 HB3 GLU B 51 93.020 19.712 2.312 1.00 0.00 H new ATOM 0 HG2 GLU B 51 95.040 20.491 1.247 1.00 0.00 H new ATOM 0 HG3 GLU B 51 94.839 18.833 0.717 1.00 0.00 H new ATOM 2298 N VAL B 52 89.824 19.140 0.981 1.00 0.00 N ATOM 2299 CA VAL B 52 88.507 18.962 1.665 1.00 0.00 C ATOM 2300 C VAL B 52 87.950 17.577 1.303 1.00 0.00 C ATOM 2301 O VAL B 52 87.330 16.906 2.103 1.00 0.00 O ATOM 2302 CB VAL B 52 87.534 20.048 1.192 1.00 0.00 C ATOM 2303 CG1 VAL B 52 86.148 19.801 1.797 1.00 0.00 C ATOM 2304 CG2 VAL B 52 88.045 21.420 1.636 1.00 0.00 C ATOM 0 H VAL B 52 89.822 19.802 0.205 1.00 0.00 H new ATOM 0 HA VAL B 52 88.632 19.042 2.745 1.00 0.00 H new ATOM 0 HB VAL B 52 87.464 20.018 0.105 1.00 0.00 H new ATOM 0 HG11 VAL B 52 85.460 20.575 1.458 1.00 0.00 H new ATOM 0 HG12 VAL B 52 85.781 18.825 1.479 1.00 0.00 H new ATOM 0 HG13 VAL B 52 86.216 19.827 2.885 1.00 0.00 H new ATOM 0 HG21 VAL B 52 87.353 22.192 1.300 1.00 0.00 H new ATOM 0 HG22 VAL B 52 88.118 21.447 2.723 1.00 0.00 H new ATOM 0 HG23 VAL B 52 89.028 21.600 1.202 1.00 0.00 H new ATOM 2314 N VAL B 53 88.189 17.156 0.089 1.00 0.00 N ATOM 2315 CA VAL B 53 87.705 15.818 -0.366 1.00 0.00 C ATOM 2316 C VAL B 53 88.456 14.729 0.404 1.00 0.00 C ATOM 2317 O VAL B 53 87.890 13.728 0.798 1.00 0.00 O ATOM 2318 CB VAL B 53 87.947 15.665 -1.872 1.00 0.00 C ATOM 2319 CG1 VAL B 53 87.685 14.217 -2.299 1.00 0.00 C ATOM 2320 CG2 VAL B 53 87.004 16.601 -2.634 1.00 0.00 C ATOM 0 H VAL B 53 88.704 17.687 -0.614 1.00 0.00 H new ATOM 0 HA VAL B 53 86.636 15.725 -0.174 1.00 0.00 H new ATOM 0 HB VAL B 53 88.982 15.922 -2.098 1.00 0.00 H new ATOM 0 HG11 VAL B 53 87.859 14.116 -3.370 1.00 0.00 H new ATOM 0 HG12 VAL B 53 88.357 13.551 -1.758 1.00 0.00 H new ATOM 0 HG13 VAL B 53 86.652 13.952 -2.073 1.00 0.00 H new ATOM 0 HG21 VAL B 53 87.173 16.495 -3.705 1.00 0.00 H new ATOM 0 HG22 VAL B 53 85.970 16.343 -2.403 1.00 0.00 H new ATOM 0 HG23 VAL B 53 87.196 17.632 -2.337 1.00 0.00 H new ATOM 2330 N ASP B 54 89.727 14.918 0.616 1.00 0.00 N ATOM 2331 CA ASP B 54 90.528 13.903 1.358 1.00 0.00 C ATOM 2332 C ASP B 54 89.941 13.729 2.757 1.00 0.00 C ATOM 2333 O ASP B 54 89.866 12.634 3.280 1.00 0.00 O ATOM 2334 CB ASP B 54 91.978 14.377 1.476 1.00 0.00 C ATOM 2335 CG ASP B 54 92.649 14.329 0.104 1.00 0.00 C ATOM 2336 OD1 ASP B 54 92.195 13.559 -0.727 1.00 0.00 O ATOM 2337 OD2 ASP B 54 93.607 15.058 -0.091 1.00 0.00 O ATOM 0 H ASP B 54 90.250 15.737 0.306 1.00 0.00 H new ATOM 0 HA ASP B 54 90.500 12.954 0.822 1.00 0.00 H new ATOM 0 HB2 ASP B 54 92.008 15.393 1.871 1.00 0.00 H new ATOM 0 HB3 ASP B 54 92.521 13.746 2.179 1.00 0.00 H new ATOM 2342 N LYS B 55 89.525 14.802 3.365 1.00 0.00 N ATOM 2343 CA LYS B 55 88.943 14.703 4.730 1.00 0.00 C ATOM 2344 C LYS B 55 87.715 13.794 4.679 1.00 0.00 C ATOM 2345 O LYS B 55 87.567 12.887 5.474 1.00 0.00 O ATOM 2346 CB LYS B 55 88.522 16.102 5.193 1.00 0.00 C ATOM 2347 CG LYS B 55 87.952 16.032 6.611 1.00 0.00 C ATOM 2348 CD LYS B 55 87.536 17.434 7.062 1.00 0.00 C ATOM 2349 CE LYS B 55 86.935 17.361 8.468 1.00 0.00 C ATOM 2350 NZ LYS B 55 86.556 18.728 8.921 1.00 0.00 N ATOM 0 H LYS B 55 89.563 15.744 2.976 1.00 0.00 H new ATOM 0 HA LYS B 55 89.677 14.292 5.423 1.00 0.00 H new ATOM 0 HB2 LYS B 55 89.379 16.776 5.169 1.00 0.00 H new ATOM 0 HB3 LYS B 55 87.776 16.511 4.512 1.00 0.00 H new ATOM 0 HG2 LYS B 55 87.094 15.360 6.637 1.00 0.00 H new ATOM 0 HG3 LYS B 55 88.697 15.624 7.294 1.00 0.00 H new ATOM 0 HD2 LYS B 55 88.399 18.100 7.058 1.00 0.00 H new ATOM 0 HD3 LYS B 55 86.809 17.851 6.365 1.00 0.00 H new ATOM 0 HE2 LYS B 55 86.060 16.712 8.467 1.00 0.00 H new ATOM 0 HE3 LYS B 55 87.655 16.924 9.160 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 86.148 18.676 9.876 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 87.400 19.335 8.937 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 85.855 19.129 8.266 1.00 0.00 H new ATOM 2364 N VAL B 56 86.833 14.029 3.750 1.00 0.00 N ATOM 2365 CA VAL B 56 85.613 13.183 3.642 1.00 0.00 C ATOM 2366 C VAL B 56 85.997 11.760 3.216 1.00 0.00 C ATOM 2367 O VAL B 56 85.463 10.788 3.710 1.00 0.00 O ATOM 2368 CB VAL B 56 84.674 13.808 2.600 1.00 0.00 C ATOM 2369 CG1 VAL B 56 83.527 12.851 2.274 1.00 0.00 C ATOM 2370 CG2 VAL B 56 84.098 15.111 3.158 1.00 0.00 C ATOM 0 H VAL B 56 86.905 14.774 3.057 1.00 0.00 H new ATOM 0 HA VAL B 56 85.112 13.131 4.608 1.00 0.00 H new ATOM 0 HB VAL B 56 85.239 14.007 1.689 1.00 0.00 H new ATOM 0 HG11 VAL B 56 82.870 13.309 1.534 1.00 0.00 H new ATOM 0 HG12 VAL B 56 83.931 11.921 1.874 1.00 0.00 H new ATOM 0 HG13 VAL B 56 82.960 12.640 3.181 1.00 0.00 H new ATOM 0 HG21 VAL B 56 83.431 15.559 2.422 1.00 0.00 H new ATOM 0 HG22 VAL B 56 83.542 14.901 4.072 1.00 0.00 H new ATOM 0 HG23 VAL B 56 84.911 15.803 3.379 1.00 0.00 H new ATOM 2380 N MET B 57 86.907 11.636 2.291 1.00 0.00 N ATOM 2381 CA MET B 57 87.316 10.280 1.813 1.00 0.00 C ATOM 2382 C MET B 57 87.989 9.480 2.935 1.00 0.00 C ATOM 2383 O MET B 57 87.759 8.296 3.084 1.00 0.00 O ATOM 2384 CB MET B 57 88.295 10.434 0.647 1.00 0.00 C ATOM 2385 CG MET B 57 88.576 9.062 0.030 1.00 0.00 C ATOM 2386 SD MET B 57 89.612 9.259 -1.439 1.00 0.00 S ATOM 2387 CE MET B 57 89.149 7.709 -2.248 1.00 0.00 C ATOM 0 H MET B 57 87.388 12.416 1.842 1.00 0.00 H new ATOM 0 HA MET B 57 86.424 9.741 1.492 1.00 0.00 H new ATOM 0 HB2 MET B 57 87.878 11.104 -0.105 1.00 0.00 H new ATOM 0 HB3 MET B 57 89.224 10.885 0.996 1.00 0.00 H new ATOM 0 HG2 MET B 57 89.075 8.421 0.756 1.00 0.00 H new ATOM 0 HG3 MET B 57 87.639 8.573 -0.236 1.00 0.00 H new ATOM 0 HE1 MET B 57 89.682 7.619 -3.195 1.00 0.00 H new ATOM 0 HE2 MET B 57 89.411 6.870 -1.603 1.00 0.00 H new ATOM 0 HE3 MET B 57 88.075 7.702 -2.434 1.00 0.00 H new ATOM 2397 N GLU B 58 88.830 10.105 3.709 1.00 0.00 N ATOM 2398 CA GLU B 58 89.528 9.362 4.802 1.00 0.00 C ATOM 2399 C GLU B 58 88.499 8.781 5.775 1.00 0.00 C ATOM 2400 O GLU B 58 88.619 7.659 6.226 1.00 0.00 O ATOM 2401 CB GLU B 58 90.469 10.315 5.545 1.00 0.00 C ATOM 2402 CG GLU B 58 91.254 9.541 6.609 1.00 0.00 C ATOM 2403 CD GLU B 58 92.191 10.500 7.344 1.00 0.00 C ATOM 2404 OE1 GLU B 58 92.295 11.638 6.918 1.00 0.00 O ATOM 2405 OE2 GLU B 58 92.793 10.079 8.318 1.00 0.00 O ATOM 0 H GLU B 58 89.066 11.095 3.635 1.00 0.00 H new ATOM 0 HA GLU B 58 90.108 8.545 4.372 1.00 0.00 H new ATOM 0 HB2 GLU B 58 91.157 10.784 4.841 1.00 0.00 H new ATOM 0 HB3 GLU B 58 89.896 11.116 6.013 1.00 0.00 H new ATOM 0 HG2 GLU B 58 90.568 9.073 7.315 1.00 0.00 H new ATOM 0 HG3 GLU B 58 91.828 8.740 6.143 1.00 0.00 H new ATOM 2412 N THR B 59 87.490 9.534 6.095 1.00 0.00 N ATOM 2413 CA THR B 59 86.446 9.034 7.031 1.00 0.00 C ATOM 2414 C THR B 59 85.639 7.920 6.360 1.00 0.00 C ATOM 2415 O THR B 59 85.269 6.942 6.981 1.00 0.00 O ATOM 2416 CB THR B 59 85.509 10.181 7.418 1.00 0.00 C ATOM 2417 OG1 THR B 59 86.257 11.209 8.052 1.00 0.00 O ATOM 2418 CG2 THR B 59 84.433 9.663 8.374 1.00 0.00 C ATOM 0 H THR B 59 87.340 10.481 5.747 1.00 0.00 H new ATOM 0 HA THR B 59 86.928 8.641 7.926 1.00 0.00 H new ATOM 0 HB THR B 59 85.033 10.580 6.522 1.00 0.00 H new ATOM 0 HG1 THR B 59 86.728 11.737 7.374 1.00 0.00 H new ATOM 0 HG21 THR B 59 83.766 10.480 8.649 1.00 0.00 H new ATOM 0 HG22 THR B 59 83.859 8.876 7.884 1.00 0.00 H new ATOM 0 HG23 THR B 59 84.905 9.263 9.271 1.00 0.00 H new ATOM 2426 N LEU B 60 85.366 8.064 5.093 1.00 0.00 N ATOM 2427 CA LEU B 60 84.581 7.015 4.381 1.00 0.00 C ATOM 2428 C LEU B 60 85.419 5.747 4.226 1.00 0.00 C ATOM 2429 O LEU B 60 84.918 4.648 4.367 1.00 0.00 O ATOM 2430 CB LEU B 60 84.170 7.516 2.993 1.00 0.00 C ATOM 2431 CG LEU B 60 83.144 8.652 3.111 1.00 0.00 C ATOM 2432 CD1 LEU B 60 83.012 9.334 1.749 1.00 0.00 C ATOM 2433 CD2 LEU B 60 81.766 8.102 3.527 1.00 0.00 C ATOM 0 H LEU B 60 85.651 8.859 4.521 1.00 0.00 H new ATOM 0 HA LEU B 60 83.689 6.793 4.967 1.00 0.00 H new ATOM 0 HB2 LEU B 60 85.049 7.867 2.452 1.00 0.00 H new ATOM 0 HB3 LEU B 60 83.747 6.695 2.415 1.00 0.00 H new ATOM 0 HG LEU B 60 83.483 9.359 3.869 1.00 0.00 H new ATOM 0 HD11 LEU B 60 82.286 10.144 1.817 1.00 0.00 H new ATOM 0 HD12 LEU B 60 83.979 9.738 1.449 1.00 0.00 H new ATOM 0 HD13 LEU B 60 82.677 8.607 1.009 1.00 0.00 H new ATOM 0 HD21 LEU B 60 81.054 8.924 3.605 1.00 0.00 H new ATOM 0 HD22 LEU B 60 81.418 7.390 2.779 1.00 0.00 H new ATOM 0 HD23 LEU B 60 81.850 7.602 4.492 1.00 0.00 H new ATOM 2445 N ASP B 61 86.679 5.871 3.912 1.00 0.00 N ATOM 2446 CA ASP B 61 87.521 4.653 3.727 1.00 0.00 C ATOM 2447 C ASP B 61 87.677 3.909 5.050 1.00 0.00 C ATOM 2448 O ASP B 61 88.447 4.292 5.909 1.00 0.00 O ATOM 2449 CB ASP B 61 88.899 5.065 3.209 1.00 0.00 C ATOM 2450 CG ASP B 61 88.785 5.527 1.755 1.00 0.00 C ATOM 2451 OD1 ASP B 61 87.808 5.175 1.115 1.00 0.00 O ATOM 2452 OD2 ASP B 61 89.677 6.227 1.304 1.00 0.00 O ATOM 0 H ASP B 61 87.162 6.759 3.776 1.00 0.00 H new ATOM 0 HA ASP B 61 87.036 3.993 3.007 1.00 0.00 H new ATOM 0 HB2 ASP B 61 89.305 5.867 3.825 1.00 0.00 H new ATOM 0 HB3 ASP B 61 89.591 4.226 3.281 1.00 0.00 H new ATOM 2457 N GLU B 62 86.952 2.841 5.212 1.00 0.00 N ATOM 2458 CA GLU B 62 87.049 2.053 6.467 1.00 0.00 C ATOM 2459 C GLU B 62 88.441 1.427 6.572 1.00 0.00 C ATOM 2460 O GLU B 62 89.026 1.361 7.635 1.00 0.00 O ATOM 2461 CB GLU B 62 85.989 0.951 6.446 1.00 0.00 C ATOM 2462 CG GLU B 62 86.032 0.159 7.754 1.00 0.00 C ATOM 2463 CD GLU B 62 84.967 -0.938 7.717 1.00 0.00 C ATOM 2464 OE1 GLU B 62 84.194 -0.951 6.772 1.00 0.00 O ATOM 2465 OE2 GLU B 62 84.939 -1.743 8.632 1.00 0.00 O ATOM 0 H GLU B 62 86.292 2.478 4.524 1.00 0.00 H new ATOM 0 HA GLU B 62 86.885 2.704 7.326 1.00 0.00 H new ATOM 0 HB2 GLU B 62 85.000 1.389 6.309 1.00 0.00 H new ATOM 0 HB3 GLU B 62 86.163 0.284 5.602 1.00 0.00 H new ATOM 0 HG2 GLU B 62 87.019 -0.281 7.893 1.00 0.00 H new ATOM 0 HG3 GLU B 62 85.857 0.823 8.600 1.00 0.00 H new ATOM 2472 N ASP B 63 88.968 0.947 5.476 1.00 0.00 N ATOM 2473 CA ASP B 63 90.313 0.303 5.506 1.00 0.00 C ATOM 2474 C ASP B 63 91.416 1.340 5.264 1.00 0.00 C ATOM 2475 O ASP B 63 92.584 1.059 5.445 1.00 0.00 O ATOM 2476 CB ASP B 63 90.368 -0.776 4.422 1.00 0.00 C ATOM 2477 CG ASP B 63 90.074 -0.151 3.058 1.00 0.00 C ATOM 2478 OD1 ASP B 63 89.674 1.002 3.030 1.00 0.00 O ATOM 2479 OD2 ASP B 63 90.252 -0.835 2.064 1.00 0.00 O ATOM 0 H ASP B 63 88.523 0.974 4.559 1.00 0.00 H new ATOM 0 HA ASP B 63 90.475 -0.143 6.487 1.00 0.00 H new ATOM 0 HB2 ASP B 63 91.351 -1.246 4.413 1.00 0.00 H new ATOM 0 HB3 ASP B 63 89.642 -1.560 4.638 1.00 0.00 H new ATOM 2484 N GLY B 64 91.068 2.531 4.859 1.00 0.00 N ATOM 2485 CA GLY B 64 92.117 3.564 4.616 1.00 0.00 C ATOM 2486 C GLY B 64 92.965 3.164 3.406 1.00 0.00 C ATOM 2487 O GLY B 64 94.134 3.489 3.323 1.00 0.00 O ATOM 0 H GLY B 64 90.109 2.833 4.687 1.00 0.00 H new ATOM 0 HA2 GLY B 64 91.652 4.534 4.441 1.00 0.00 H new ATOM 0 HA3 GLY B 64 92.750 3.668 5.497 1.00 0.00 H new ATOM 2491 N ASP B 65 92.394 2.444 2.478 1.00 0.00 N ATOM 2492 CA ASP B 65 93.176 2.006 1.285 1.00 0.00 C ATOM 2493 C ASP B 65 93.326 3.165 0.291 1.00 0.00 C ATOM 2494 O ASP B 65 93.968 3.032 -0.731 1.00 0.00 O ATOM 2495 CB ASP B 65 92.457 0.840 0.605 1.00 0.00 C ATOM 2496 CG ASP B 65 91.110 1.316 0.059 1.00 0.00 C ATOM 2497 OD1 ASP B 65 90.643 2.350 0.507 1.00 0.00 O ATOM 2498 OD2 ASP B 65 90.568 0.638 -0.798 1.00 0.00 O ATOM 0 H ASP B 65 91.420 2.140 2.494 1.00 0.00 H new ATOM 0 HA ASP B 65 94.167 1.689 1.609 1.00 0.00 H new ATOM 0 HB2 ASP B 65 93.070 0.444 -0.205 1.00 0.00 H new ATOM 0 HB3 ASP B 65 92.306 0.028 1.316 1.00 0.00 H new ATOM 2503 N GLY B 66 92.774 4.307 0.595 1.00 0.00 N ATOM 2504 CA GLY B 66 92.929 5.477 -0.319 1.00 0.00 C ATOM 2505 C GLY B 66 91.964 5.399 -1.508 1.00 0.00 C ATOM 2506 O GLY B 66 91.913 6.300 -2.321 1.00 0.00 O ATOM 0 H GLY B 66 92.223 4.482 1.435 1.00 0.00 H new ATOM 0 HA2 GLY B 66 92.750 6.398 0.235 1.00 0.00 H new ATOM 0 HA3 GLY B 66 93.955 5.520 -0.685 1.00 0.00 H new ATOM 2510 N GLU B 67 91.197 4.345 -1.622 1.00 0.00 N ATOM 2511 CA GLU B 67 90.232 4.214 -2.761 1.00 0.00 C ATOM 2512 C GLU B 67 88.870 3.816 -2.193 1.00 0.00 C ATOM 2513 O GLU B 67 88.780 3.377 -1.064 1.00 0.00 O ATOM 2514 CB GLU B 67 90.712 3.119 -3.714 1.00 0.00 C ATOM 2515 CG GLU B 67 91.980 3.578 -4.434 1.00 0.00 C ATOM 2516 CD GLU B 67 92.579 2.400 -5.201 1.00 0.00 C ATOM 2517 OE1 GLU B 67 92.079 1.300 -5.040 1.00 0.00 O ATOM 2518 OE2 GLU B 67 93.536 2.615 -5.926 1.00 0.00 O ATOM 0 H GLU B 67 91.196 3.561 -0.970 1.00 0.00 H new ATOM 0 HA GLU B 67 90.161 5.158 -3.301 1.00 0.00 H new ATOM 0 HB2 GLU B 67 90.910 2.202 -3.159 1.00 0.00 H new ATOM 0 HB3 GLU B 67 89.933 2.890 -4.441 1.00 0.00 H new ATOM 0 HG2 GLU B 67 91.748 4.393 -5.120 1.00 0.00 H new ATOM 0 HG3 GLU B 67 92.702 3.963 -3.714 1.00 0.00 H new ATOM 2525 N CYS B 68 87.806 3.959 -2.950 1.00 0.00 N ATOM 2526 CA CYS B 68 86.452 3.578 -2.426 1.00 0.00 C ATOM 2527 C CYS B 68 86.009 2.243 -3.043 1.00 0.00 C ATOM 2528 O CYS B 68 85.624 2.176 -4.196 1.00 0.00 O ATOM 2529 CB CYS B 68 85.448 4.668 -2.806 1.00 0.00 C ATOM 2530 SG CYS B 68 83.847 4.309 -2.043 1.00 0.00 S ATOM 0 H CYS B 68 87.815 4.321 -3.903 1.00 0.00 H new ATOM 0 HA CYS B 68 86.498 3.473 -1.342 1.00 0.00 H new ATOM 0 HB2 CYS B 68 85.810 5.642 -2.475 1.00 0.00 H new ATOM 0 HB3 CYS B 68 85.343 4.718 -3.890 1.00 0.00 H new ATOM 0 HG CYS B 68 82.995 5.237 -2.365 1.00 0.00 H new ATOM 2536 N ASP B 69 86.090 1.176 -2.290 1.00 0.00 N ATOM 2537 CA ASP B 69 85.706 -0.166 -2.826 1.00 0.00 C ATOM 2538 C ASP B 69 84.184 -0.273 -3.009 1.00 0.00 C ATOM 2539 O ASP B 69 83.434 0.625 -2.678 1.00 0.00 O ATOM 2540 CB ASP B 69 86.180 -1.254 -1.852 1.00 0.00 C ATOM 2541 CG ASP B 69 86.237 -2.607 -2.568 1.00 0.00 C ATOM 2542 OD1 ASP B 69 85.758 -2.685 -3.686 1.00 0.00 O ATOM 2543 OD2 ASP B 69 86.768 -3.539 -1.987 1.00 0.00 O ATOM 0 H ASP B 69 86.408 1.176 -1.321 1.00 0.00 H new ATOM 0 HA ASP B 69 86.179 -0.299 -3.799 1.00 0.00 H new ATOM 0 HB2 ASP B 69 87.164 -0.999 -1.459 1.00 0.00 H new ATOM 0 HB3 ASP B 69 85.502 -1.312 -1.000 1.00 0.00 H new ATOM 2548 N PHE B 70 83.738 -1.382 -3.541 1.00 0.00 N ATOM 2549 CA PHE B 70 82.275 -1.592 -3.758 1.00 0.00 C ATOM 2550 C PHE B 70 81.541 -1.519 -2.417 1.00 0.00 C ATOM 2551 O PHE B 70 80.545 -0.841 -2.274 1.00 0.00 O ATOM 2552 CB PHE B 70 82.042 -2.971 -4.382 1.00 0.00 C ATOM 2553 CG PHE B 70 80.575 -3.140 -4.702 1.00 0.00 C ATOM 2554 CD1 PHE B 70 79.700 -3.660 -3.740 1.00 0.00 C ATOM 2555 CD2 PHE B 70 80.089 -2.779 -5.965 1.00 0.00 C ATOM 2556 CE1 PHE B 70 78.341 -3.819 -4.042 1.00 0.00 C ATOM 2557 CE2 PHE B 70 78.731 -2.938 -6.266 1.00 0.00 C ATOM 2558 CZ PHE B 70 77.857 -3.458 -5.304 1.00 0.00 C ATOM 0 H PHE B 70 84.330 -2.158 -3.837 1.00 0.00 H new ATOM 0 HA PHE B 70 81.897 -0.818 -4.426 1.00 0.00 H new ATOM 0 HB2 PHE B 70 82.637 -3.076 -5.289 1.00 0.00 H new ATOM 0 HB3 PHE B 70 82.367 -3.752 -3.695 1.00 0.00 H new ATOM 0 HD1 PHE B 70 80.073 -3.938 -2.765 1.00 0.00 H new ATOM 0 HD2 PHE B 70 80.763 -2.378 -6.708 1.00 0.00 H new ATOM 0 HE1 PHE B 70 77.667 -4.221 -3.300 1.00 0.00 H new ATOM 0 HE2 PHE B 70 78.358 -2.659 -7.240 1.00 0.00 H new ATOM 0 HZ PHE B 70 76.809 -3.580 -5.536 1.00 0.00 H new ATOM 2568 N GLN B 71 82.010 -2.241 -1.439 1.00 0.00 N ATOM 2569 CA GLN B 71 81.308 -2.228 -0.123 1.00 0.00 C ATOM 2570 C GLN B 71 81.286 -0.791 0.405 1.00 0.00 C ATOM 2571 O GLN B 71 80.245 -0.267 0.750 1.00 0.00 O ATOM 2572 CB GLN B 71 82.040 -3.135 0.867 1.00 0.00 C ATOM 2573 CG GLN B 71 82.035 -4.574 0.346 1.00 0.00 C ATOM 2574 CD GLN B 71 82.768 -5.478 1.339 1.00 0.00 C ATOM 2575 OE1 GLN B 71 83.588 -5.015 2.109 1.00 0.00 O ATOM 2576 NE2 GLN B 71 82.506 -6.756 1.356 1.00 0.00 N ATOM 0 H GLN B 71 82.839 -2.833 -1.490 1.00 0.00 H new ATOM 0 HA GLN B 71 80.289 -2.595 -0.243 1.00 0.00 H new ATOM 0 HB2 GLN B 71 83.065 -2.790 1.002 1.00 0.00 H new ATOM 0 HB3 GLN B 71 81.557 -3.089 1.843 1.00 0.00 H new ATOM 0 HG2 GLN B 71 81.010 -4.920 0.211 1.00 0.00 H new ATOM 0 HG3 GLN B 71 82.518 -4.621 -0.630 1.00 0.00 H new ATOM 0 HE21 GLN B 71 81.818 -7.144 0.710 1.00 0.00 H new ATOM 0 HE22 GLN B 71 82.989 -7.367 2.015 1.00 0.00 H new ATOM 2585 N GLU B 72 82.418 -0.144 0.475 1.00 0.00 N ATOM 2586 CA GLU B 72 82.433 1.259 0.983 1.00 0.00 C ATOM 2587 C GLU B 72 81.545 2.104 0.066 1.00 0.00 C ATOM 2588 O GLU B 72 80.755 2.911 0.511 1.00 0.00 O ATOM 2589 CB GLU B 72 83.866 1.789 0.933 1.00 0.00 C ATOM 2590 CG GLU B 72 84.714 1.063 1.979 1.00 0.00 C ATOM 2591 CD GLU B 72 86.153 1.578 1.917 1.00 0.00 C ATOM 2592 OE1 GLU B 72 86.450 2.342 1.014 1.00 0.00 O ATOM 2593 OE2 GLU B 72 86.936 1.193 2.770 1.00 0.00 O ATOM 0 H GLU B 72 83.326 -0.522 0.205 1.00 0.00 H new ATOM 0 HA GLU B 72 82.067 1.303 2.009 1.00 0.00 H new ATOM 0 HB2 GLU B 72 84.287 1.637 -0.061 1.00 0.00 H new ATOM 0 HB3 GLU B 72 83.875 2.862 1.123 1.00 0.00 H new ATOM 0 HG2 GLU B 72 84.301 1.226 2.974 1.00 0.00 H new ATOM 0 HG3 GLU B 72 84.693 -0.012 1.797 1.00 0.00 H new ATOM 2600 N PHE B 73 81.690 1.915 -1.218 1.00 0.00 N ATOM 2601 CA PHE B 73 80.868 2.704 -2.182 1.00 0.00 C ATOM 2602 C PHE B 73 79.409 2.663 -1.713 1.00 0.00 C ATOM 2603 O PHE B 73 78.726 3.667 -1.676 1.00 0.00 O ATOM 2604 CB PHE B 73 80.987 2.121 -3.594 1.00 0.00 C ATOM 2605 CG PHE B 73 79.990 2.805 -4.498 1.00 0.00 C ATOM 2606 CD1 PHE B 73 80.310 4.032 -5.086 1.00 0.00 C ATOM 2607 CD2 PHE B 73 78.746 2.214 -4.743 1.00 0.00 C ATOM 2608 CE1 PHE B 73 79.385 4.671 -5.920 1.00 0.00 C ATOM 2609 CE2 PHE B 73 77.820 2.850 -5.578 1.00 0.00 C ATOM 2610 CZ PHE B 73 78.140 4.080 -6.167 1.00 0.00 C ATOM 0 H PHE B 73 82.339 1.251 -1.640 1.00 0.00 H new ATOM 0 HA PHE B 73 81.224 3.734 -2.215 1.00 0.00 H new ATOM 0 HB2 PHE B 73 81.998 2.262 -3.975 1.00 0.00 H new ATOM 0 HB3 PHE B 73 80.801 1.047 -3.574 1.00 0.00 H new ATOM 0 HD1 PHE B 73 81.271 4.487 -4.897 1.00 0.00 H new ATOM 0 HD2 PHE B 73 78.500 1.266 -4.287 1.00 0.00 H new ATOM 0 HE1 PHE B 73 79.632 5.620 -6.373 1.00 0.00 H new ATOM 0 HE2 PHE B 73 76.860 2.393 -5.768 1.00 0.00 H new ATOM 0 HZ PHE B 73 77.427 4.572 -6.811 1.00 0.00 H new ATOM 2620 N MET B 74 78.948 1.515 -1.306 1.00 0.00 N ATOM 2621 CA MET B 74 77.557 1.406 -0.782 1.00 0.00 C ATOM 2622 C MET B 74 77.495 2.128 0.568 1.00 0.00 C ATOM 2623 O MET B 74 76.533 2.790 0.894 1.00 0.00 O ATOM 2624 CB MET B 74 77.192 -0.074 -0.599 1.00 0.00 C ATOM 2625 CG MET B 74 75.761 -0.207 -0.059 1.00 0.00 C ATOM 2626 SD MET B 74 74.584 0.509 -1.239 1.00 0.00 S ATOM 2627 CE MET B 74 73.286 -0.743 -1.074 1.00 0.00 C ATOM 0 H MET B 74 79.476 0.643 -1.313 1.00 0.00 H new ATOM 0 HA MET B 74 76.852 1.858 -1.480 1.00 0.00 H new ATOM 0 HB2 MET B 74 77.279 -0.597 -1.551 1.00 0.00 H new ATOM 0 HB3 MET B 74 77.893 -0.546 0.089 1.00 0.00 H new ATOM 0 HG2 MET B 74 75.524 -1.257 0.112 1.00 0.00 H new ATOM 0 HG3 MET B 74 75.678 0.299 0.903 1.00 0.00 H new ATOM 0 HE1 MET B 74 72.451 -0.490 -1.728 1.00 0.00 H new ATOM 0 HE2 MET B 74 73.684 -1.718 -1.354 1.00 0.00 H new ATOM 0 HE3 MET B 74 72.941 -0.775 -0.041 1.00 0.00 H new ATOM 2637 N ALA B 75 78.516 1.985 1.364 1.00 0.00 N ATOM 2638 CA ALA B 75 78.537 2.634 2.704 1.00 0.00 C ATOM 2639 C ALA B 75 78.359 4.149 2.588 1.00 0.00 C ATOM 2640 O ALA B 75 78.032 4.813 3.552 1.00 0.00 O ATOM 2641 CB ALA B 75 79.878 2.349 3.368 1.00 0.00 C ATOM 0 H ALA B 75 79.348 1.439 1.140 1.00 0.00 H new ATOM 0 HA ALA B 75 77.715 2.231 3.296 1.00 0.00 H new ATOM 0 HB1 ALA B 75 79.905 2.820 4.351 1.00 0.00 H new ATOM 0 HB2 ALA B 75 80.008 1.272 3.478 1.00 0.00 H new ATOM 0 HB3 ALA B 75 80.682 2.751 2.751 1.00 0.00 H new ATOM 2647 N PHE B 76 78.509 4.707 1.418 1.00 0.00 N ATOM 2648 CA PHE B 76 78.284 6.170 1.240 1.00 0.00 C ATOM 2649 C PHE B 76 76.823 6.354 0.828 1.00 0.00 C ATOM 2650 O PHE B 76 76.201 7.371 1.062 1.00 0.00 O ATOM 2651 CB PHE B 76 79.204 6.675 0.124 1.00 0.00 C ATOM 2652 CG PHE B 76 78.898 8.121 -0.185 1.00 0.00 C ATOM 2653 CD1 PHE B 76 77.903 8.440 -1.112 1.00 0.00 C ATOM 2654 CD2 PHE B 76 79.612 9.140 0.453 1.00 0.00 C ATOM 2655 CE1 PHE B 76 77.623 9.781 -1.403 1.00 0.00 C ATOM 2656 CE2 PHE B 76 79.335 10.479 0.164 1.00 0.00 C ATOM 2657 CZ PHE B 76 78.340 10.800 -0.765 1.00 0.00 C ATOM 0 H PHE B 76 78.780 4.208 0.571 1.00 0.00 H new ATOM 0 HA PHE B 76 78.496 6.723 2.155 1.00 0.00 H new ATOM 0 HB2 PHE B 76 80.246 6.572 0.427 1.00 0.00 H new ATOM 0 HB3 PHE B 76 79.070 6.067 -0.771 1.00 0.00 H new ATOM 0 HD1 PHE B 76 77.350 7.653 -1.604 1.00 0.00 H new ATOM 0 HD2 PHE B 76 80.380 8.892 1.171 1.00 0.00 H new ATOM 0 HE1 PHE B 76 76.854 10.029 -2.120 1.00 0.00 H new ATOM 0 HE2 PHE B 76 79.888 11.265 0.657 1.00 0.00 H new ATOM 0 HZ PHE B 76 78.125 11.834 -0.990 1.00 0.00 H new ATOM 2667 N VAL B 77 76.292 5.334 0.213 1.00 0.00 N ATOM 2668 CA VAL B 77 74.871 5.375 -0.232 1.00 0.00 C ATOM 2669 C VAL B 77 73.978 5.411 1.010 1.00 0.00 C ATOM 2670 O VAL B 77 73.008 6.140 1.067 1.00 0.00 O ATOM 2671 CB VAL B 77 74.538 4.142 -1.085 1.00 0.00 C ATOM 2672 CG1 VAL B 77 73.031 4.103 -1.368 1.00 0.00 C ATOM 2673 CG2 VAL B 77 75.311 4.217 -2.406 1.00 0.00 C ATOM 0 H VAL B 77 76.785 4.467 -0.002 1.00 0.00 H new ATOM 0 HA VAL B 77 74.702 6.262 -0.842 1.00 0.00 H new ATOM 0 HB VAL B 77 74.824 3.238 -0.548 1.00 0.00 H new ATOM 0 HG11 VAL B 77 72.797 3.227 -1.973 1.00 0.00 H new ATOM 0 HG12 VAL B 77 72.485 4.049 -0.426 1.00 0.00 H new ATOM 0 HG13 VAL B 77 72.738 5.005 -1.906 1.00 0.00 H new ATOM 0 HG21 VAL B 77 75.077 3.343 -3.014 1.00 0.00 H new ATOM 0 HG22 VAL B 77 75.025 5.121 -2.944 1.00 0.00 H new ATOM 0 HG23 VAL B 77 76.381 4.240 -2.201 1.00 0.00 H new ATOM 2683 N SER B 78 74.302 4.636 2.015 1.00 0.00 N ATOM 2684 CA SER B 78 73.475 4.636 3.256 1.00 0.00 C ATOM 2685 C SER B 78 73.689 5.942 4.026 1.00 0.00 C ATOM 2686 O SER B 78 72.750 6.588 4.445 1.00 0.00 O ATOM 2687 CB SER B 78 73.878 3.454 4.136 1.00 0.00 C ATOM 2688 OG SER B 78 73.093 3.463 5.320 1.00 0.00 O ATOM 0 H SER B 78 75.103 4.005 2.028 1.00 0.00 H new ATOM 0 HA SER B 78 72.423 4.549 2.985 1.00 0.00 H new ATOM 0 HB2 SER B 78 73.733 2.518 3.597 1.00 0.00 H new ATOM 0 HB3 SER B 78 74.937 3.517 4.387 1.00 0.00 H new ATOM 0 HG SER B 78 73.347 2.705 5.887 1.00 0.00 H new ATOM 2694 N MET B 79 74.919 6.322 4.245 1.00 0.00 N ATOM 2695 CA MET B 79 75.182 7.572 5.019 1.00 0.00 C ATOM 2696 C MET B 79 74.345 8.713 4.446 1.00 0.00 C ATOM 2697 O MET B 79 73.771 9.499 5.172 1.00 0.00 O ATOM 2698 CB MET B 79 76.666 7.937 4.923 1.00 0.00 C ATOM 2699 CG MET B 79 76.979 9.064 5.910 1.00 0.00 C ATOM 2700 SD MET B 79 78.723 9.536 5.766 1.00 0.00 S ATOM 2701 CE MET B 79 79.446 8.065 6.537 1.00 0.00 C ATOM 0 H MET B 79 75.750 5.825 3.924 1.00 0.00 H new ATOM 0 HA MET B 79 74.915 7.410 6.063 1.00 0.00 H new ATOM 0 HB2 MET B 79 77.281 7.065 5.144 1.00 0.00 H new ATOM 0 HB3 MET B 79 76.910 8.250 3.908 1.00 0.00 H new ATOM 0 HG2 MET B 79 76.342 9.925 5.708 1.00 0.00 H new ATOM 0 HG3 MET B 79 76.763 8.739 6.928 1.00 0.00 H new ATOM 0 HE1 MET B 79 80.446 8.300 6.903 1.00 0.00 H new ATOM 0 HE2 MET B 79 78.820 7.746 7.371 1.00 0.00 H new ATOM 0 HE3 MET B 79 79.508 7.262 5.802 1.00 0.00 H new ATOM 2711 N VAL B 80 74.251 8.799 3.153 1.00 0.00 N ATOM 2712 CA VAL B 80 73.427 9.878 2.542 1.00 0.00 C ATOM 2713 C VAL B 80 71.959 9.621 2.898 1.00 0.00 C ATOM 2714 O VAL B 80 71.155 10.528 2.977 1.00 0.00 O ATOM 2715 CB VAL B 80 73.612 9.882 1.022 1.00 0.00 C ATOM 2716 CG1 VAL B 80 72.605 10.843 0.383 1.00 0.00 C ATOM 2717 CG2 VAL B 80 75.033 10.343 0.685 1.00 0.00 C ATOM 0 H VAL B 80 74.707 8.171 2.491 1.00 0.00 H new ATOM 0 HA VAL B 80 73.737 10.850 2.924 1.00 0.00 H new ATOM 0 HB VAL B 80 73.449 8.876 0.636 1.00 0.00 H new ATOM 0 HG11 VAL B 80 72.739 10.844 -0.699 1.00 0.00 H new ATOM 0 HG12 VAL B 80 71.592 10.521 0.623 1.00 0.00 H new ATOM 0 HG13 VAL B 80 72.767 11.849 0.769 1.00 0.00 H new ATOM 0 HG21 VAL B 80 75.167 10.347 -0.397 1.00 0.00 H new ATOM 0 HG22 VAL B 80 75.191 11.349 1.074 1.00 0.00 H new ATOM 0 HG23 VAL B 80 75.753 9.662 1.138 1.00 0.00 H new ATOM 2727 N THR B 81 71.618 8.382 3.147 1.00 0.00 N ATOM 2728 CA THR B 81 70.216 8.056 3.535 1.00 0.00 C ATOM 2729 C THR B 81 70.034 8.405 5.014 1.00 0.00 C ATOM 2730 O THR B 81 69.101 9.080 5.400 1.00 0.00 O ATOM 2731 CB THR B 81 69.955 6.560 3.326 1.00 0.00 C ATOM 2732 OG1 THR B 81 70.363 6.188 2.017 1.00 0.00 O ATOM 2733 CG2 THR B 81 68.463 6.273 3.497 1.00 0.00 C ATOM 0 H THR B 81 72.251 7.584 3.098 1.00 0.00 H new ATOM 0 HA THR B 81 69.516 8.625 2.923 1.00 0.00 H new ATOM 0 HB THR B 81 70.520 5.986 4.060 1.00 0.00 H new ATOM 0 HG1 THR B 81 71.342 6.182 1.969 1.00 0.00 H new ATOM 0 HG21 THR B 81 68.278 5.209 3.348 1.00 0.00 H new ATOM 0 HG22 THR B 81 68.150 6.559 4.501 1.00 0.00 H new ATOM 0 HG23 THR B 81 67.896 6.846 2.763 1.00 0.00 H new ATOM 2741 N THR B 82 70.938 7.947 5.838 1.00 0.00 N ATOM 2742 CA THR B 82 70.866 8.234 7.294 1.00 0.00 C ATOM 2743 C THR B 82 71.191 9.709 7.546 1.00 0.00 C ATOM 2744 O THR B 82 70.937 10.236 8.611 1.00 0.00 O ATOM 2745 CB THR B 82 71.890 7.364 8.025 1.00 0.00 C ATOM 2746 OG1 THR B 82 73.201 7.755 7.640 1.00 0.00 O ATOM 2747 CG2 THR B 82 71.672 5.894 7.668 1.00 0.00 C ATOM 0 H THR B 82 71.735 7.377 5.556 1.00 0.00 H new ATOM 0 HA THR B 82 69.862 8.017 7.658 1.00 0.00 H new ATOM 0 HB THR B 82 71.769 7.493 9.101 1.00 0.00 H new ATOM 0 HG1 THR B 82 73.155 8.290 6.820 1.00 0.00 H new ATOM 0 HG21 THR B 82 72.404 5.280 8.192 1.00 0.00 H new ATOM 0 HG22 THR B 82 70.667 5.593 7.965 1.00 0.00 H new ATOM 0 HG23 THR B 82 71.789 5.760 6.593 1.00 0.00 H new ATOM 2755 N ALA B 83 71.753 10.379 6.577 1.00 0.00 N ATOM 2756 CA ALA B 83 72.094 11.817 6.768 1.00 0.00 C ATOM 2757 C ALA B 83 70.818 12.664 6.761 1.00 0.00 C ATOM 2758 O ALA B 83 70.659 13.567 7.558 1.00 0.00 O ATOM 2759 CB ALA B 83 73.013 12.270 5.633 1.00 0.00 C ATOM 0 H ALA B 83 71.990 9.993 5.663 1.00 0.00 H new ATOM 0 HA ALA B 83 72.599 11.944 7.726 1.00 0.00 H new ATOM 0 HB1 ALA B 83 73.266 13.322 5.767 1.00 0.00 H new ATOM 0 HB2 ALA B 83 73.925 11.673 5.643 1.00 0.00 H new ATOM 0 HB3 ALA B 83 72.504 12.138 4.678 1.00 0.00 H new ATOM 2765 N CYS B 84 69.920 12.402 5.849 1.00 0.00 N ATOM 2766 CA CYS B 84 68.675 13.219 5.776 1.00 0.00 C ATOM 2767 C CYS B 84 67.783 12.932 6.985 1.00 0.00 C ATOM 2768 O CYS B 84 67.913 11.921 7.647 1.00 0.00 O ATOM 2769 CB CYS B 84 67.914 12.874 4.493 1.00 0.00 C ATOM 2770 SG CYS B 84 67.480 11.117 4.504 1.00 0.00 S ATOM 0 H CYS B 84 69.995 11.660 5.154 1.00 0.00 H new ATOM 0 HA CYS B 84 68.944 14.275 5.774 1.00 0.00 H new ATOM 0 HB2 CYS B 84 67.012 13.482 4.417 1.00 0.00 H new ATOM 0 HB3 CYS B 84 68.527 13.103 3.621 1.00 0.00 H new ATOM 0 HG CYS B 84 68.470 10.428 4.989 1.00 0.00 H new