USER MOD reduce.3.24.130724 H: found=0, std=0, add=1133, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1134 hydrogens (14 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 126 ASNHD21 : A 126 ASN ND2 : A 161 NAG C1 :(H bumps) USER MOD Set 1.1: A 88 TYR OH : rot 180:sc= 0.159 USER MOD Set 1.2: A 92 GLN : amide:sc= -3.75! K(o=-3.6!,f=-2.9) USER MOD Set 2.1: A 86 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 87 ASN : amide:sc= -2.13 K(o=-5.9,f=-2.1) USER MOD Set 2.3: A 90 GLN : amide:sc= -3.75! C(o=-5.9!,f=-14!) USER MOD Set 3.1: A 50 ASN : amide:sc= -1.72 X(o=-1.7,f=-1.9) USER MOD Set 3.2: A 94 TYR OH : rot -71:sc= 0.0468 USER MOD Set 4.1: A 47 TYR OH : rot -160:sc= -4.86! USER MOD Set 4.2: A 79 HIS : no HD1:sc= -2.99! C(o=-7.9!,f=-8.3!) USER MOD Set 5.1: A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 5.2: A 45 GLN : amide:sc= 0 X(o=0,f=-0.004) USER MOD Set 6.1: A 17 GLN : amide:sc= 0 X(o=-7.3,f=-7.3) USER MOD Set 6.2: A 30 THR OG1 : rot 120:sc= -7.33! USER MOD Set 7.1: A 16 MET CE :methyl -110:sc= -9.68! (180deg=-8.59!) USER MOD Set 7.2: A 144 THR OG1 : rot 22:sc= -1.82 USER MOD Single : A 1 TYR N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 TYR OH : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -8.66! C(o=-8.7!,f=-13!) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.784 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 50:sc= -1.4! USER MOD Single : A 13 SER OG : rot 152:sc= 0.0359 USER MOD Single : A 20 LYS NZ :NH3+ -114:sc= 0.615 (180deg=-1.16!) USER MOD Single : A 21 THR OG1 : rot 19:sc= 0.915 USER MOD Single : A 22 GLN : amide:sc= -4.14! C(o=-4.1!,f=-3.4!) USER MOD Single : A 24 ASN : amide:sc= -0.735 K(o=-0.73,f=-3.8!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 GLN : amide:sc= -0.569 K(o=-0.57,f=-0.0081) USER MOD Single : A 27 MET CE :methyl 147:sc= -6.45! (180deg=-12.3!) USER MOD Single : A 34 ASN : amide:sc= -0.76 K(o=-0.76,f=-0.19) USER MOD Single : A 37 SER OG : rot 92:sc= -2.19! USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.125 USER MOD Single : A 46 THR OG1 : rot 116:sc= 1.62 USER MOD Single : A 51 SER OG : rot 79:sc= -3.13! USER MOD Single : A 52 ASN : amide:sc= -1.95! C(o=-2!,f=-3.6!) USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.0617 USER MOD Single : A 62 TYR OH : rot 165:sc= -0.884 USER MOD Single : A 63 ASN : amide:sc= -6.52! C(o=-6.5!,f=-8.3!) USER MOD Single : A 66 THR OG1 : rot 180:sc= -3! USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 41:sc= 0.0426 USER MOD Single : A 76 GLN : amide:sc= 0.921 K(o=0.92,f=-0.83) USER MOD Single : A 83 SER OG : rot -108:sc= -1.3! USER MOD Single : A 84 THR OG1 : rot 170:sc= -4.41! USER MOD Single : A 85 THR OG1 : rot 70:sc= -0.717 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot -43:sc= -2.17! USER MOD Single : A 98 THR OG1 : rot -25:sc= 0.598! USER MOD Single : A 100 HIS : no HD1:sc= -1.9! K(o=-1.9!,f=-0.31) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.308 USER MOD Single : A 105 GLN : amide:sc= -0.0464 X(o=-0.046,f=0) USER MOD Single : A 106 THR OG1 : rot 60:sc= -2.57! USER MOD Single : A 110 ASN : amide:sc= -9.71! C(o=-9.7!,f=-22!) USER MOD Single : A 111 SER OG : rot -170:sc= -5.46! USER MOD Single : A 112 ASN : amide:sc= -1.86 K(o=-1.9,f=-1.1) USER MOD Single : A 117 HIS : no HD1:sc= -1.23 X(o=-1.2,f=-0.95) USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0.02) USER MOD Single : A 124 ASN : amide:sc= -4.43! C(o=-4.4!,f=-4.8!) USER MOD Single : A 125 HIS : no HD1:sc= -0.245 X(o=-0.24,f=-0.0019) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.234 USER MOD Single : A 131 THR OG1 : rot 180:sc= 0.0511 USER MOD Single : A 132 SER OG : rot 180:sc= 0.432 USER MOD Single : A 138 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 140 LYS NZ :NH3+ 169:sc= 0.21 (180deg=0.18) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0.0848 USER MOD Single : A 146 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 ASN : amide:sc= -2.41! C(o=-2.4!,f=-5.8!) USER MOD Single : A 148 TYR OH : rot 37:sc= 0.0517 USER MOD Single : A 152 GLN : amide:sc= -0.0387 X(o=-0.039,f=-0.34) USER MOD Single : A 153 LYS NZ :NH3+ 155:sc= 0.171 (180deg=-0.0373) USER MOD Single : A 159 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 NAG O3 : rot 158:sc= -0.138 USER MOD Single : A 161 NAG O4 : rot 180:sc= 0.0279 USER MOD Single : A 161 NAG O6 : rot -16:sc= 0.509 USER MOD ----------------------------------------------------------------- ATOM 1 N TYR A 1 13.764 -5.360 20.297 1.00 0.00 N ATOM 2 CA TYR A 1 12.378 -5.851 20.080 1.00 0.00 C ATOM 3 C TYR A 1 11.488 -4.754 19.509 1.00 0.00 C ATOM 4 O TYR A 1 10.832 -4.022 20.252 1.00 0.00 O ATOM 5 CB TYR A 1 11.820 -6.340 21.418 1.00 0.00 C ATOM 6 CG TYR A 1 11.292 -7.757 21.374 1.00 0.00 C ATOM 7 CD1 TYR A 1 12.018 -8.770 20.763 1.00 0.00 C ATOM 8 CD2 TYR A 1 10.066 -8.078 21.944 1.00 0.00 C ATOM 9 CE1 TYR A 1 11.538 -10.065 20.720 1.00 0.00 C ATOM 10 CE2 TYR A 1 9.580 -9.371 21.904 1.00 0.00 C ATOM 11 CZ TYR A 1 10.319 -10.361 21.292 1.00 0.00 C ATOM 12 OH TYR A 1 9.838 -11.649 21.251 1.00 0.00 O ATOM 0 H1 TYR A 1 14.347 -6.128 20.686 1.00 0.00 H new ATOM 0 H2 TYR A 1 14.166 -5.045 19.391 1.00 0.00 H new ATOM 0 H3 TYR A 1 13.749 -4.563 20.966 1.00 0.00 H new ATOM 0 HA TYR A 1 12.396 -6.668 19.358 1.00 0.00 H new ATOM 0 HB2 TYR A 1 12.603 -6.277 22.173 1.00 0.00 H new ATOM 0 HB3 TYR A 1 11.018 -5.672 21.733 1.00 0.00 H new ATOM 0 HD1 TYR A 1 12.973 -8.542 20.314 1.00 0.00 H new ATOM 0 HD2 TYR A 1 9.484 -7.306 22.425 1.00 0.00 H new ATOM 0 HE1 TYR A 1 12.115 -10.842 20.240 1.00 0.00 H new ATOM 0 HE2 TYR A 1 8.625 -9.605 22.350 1.00 0.00 H new ATOM 0 HH TYR A 1 8.968 -11.688 21.700 1.00 0.00 H new ATOM 24 N GLY A 2 11.469 -4.644 18.185 1.00 0.00 N ATOM 25 CA GLY A 2 10.655 -3.632 17.536 1.00 0.00 C ATOM 26 C GLY A 2 9.503 -4.230 16.752 1.00 0.00 C ATOM 27 O GLY A 2 9.702 -5.115 15.920 1.00 0.00 O ATOM 0 H GLY A 2 12.002 -5.237 17.549 1.00 0.00 H new ATOM 0 HA2 GLY A 2 10.262 -2.948 18.289 1.00 0.00 H new ATOM 0 HA3 GLY A 2 11.280 -3.043 16.865 1.00 0.00 H new ATOM 31 N HIS A 3 8.295 -3.743 17.017 1.00 0.00 N ATOM 32 CA HIS A 3 7.105 -4.234 16.331 1.00 0.00 C ATOM 33 C HIS A 3 5.847 -3.934 17.137 1.00 0.00 C ATOM 34 O HIS A 3 5.917 -3.630 18.328 1.00 0.00 O ATOM 35 CB HIS A 3 7.213 -5.740 16.087 1.00 0.00 C ATOM 36 CG HIS A 3 7.859 -6.485 17.212 1.00 0.00 C ATOM 37 ND1 HIS A 3 8.474 -7.709 17.053 1.00 0.00 N ATOM 38 CD2 HIS A 3 7.986 -6.169 18.523 1.00 0.00 C ATOM 39 CE1 HIS A 3 8.950 -8.115 18.217 1.00 0.00 C ATOM 40 NE2 HIS A 3 8.668 -7.199 19.125 1.00 0.00 N ATOM 0 H HIS A 3 8.114 -3.009 17.702 1.00 0.00 H new ATOM 0 HA HIS A 3 7.036 -3.719 15.373 1.00 0.00 H new ATOM 0 HB2 HIS A 3 6.215 -6.145 15.920 1.00 0.00 H new ATOM 0 HB3 HIS A 3 7.783 -5.912 15.174 1.00 0.00 H new ATOM 0 HD2 HIS A 3 7.620 -5.275 19.005 1.00 0.00 H new ATOM 0 HE1 HIS A 3 9.480 -9.039 18.395 1.00 0.00 H new ATOM 0 HE2 HIS A 3 8.916 -7.248 20.113 1.00 0.00 H new ATOM 49 N CYS A 4 4.697 -4.028 16.480 1.00 0.00 N ATOM 50 CA CYS A 4 3.420 -3.773 17.133 1.00 0.00 C ATOM 51 C CYS A 4 2.685 -5.081 17.402 1.00 0.00 C ATOM 52 O CYS A 4 2.358 -5.823 16.476 1.00 0.00 O ATOM 53 CB CYS A 4 2.554 -2.855 16.268 1.00 0.00 C ATOM 54 SG CYS A 4 2.836 -1.079 16.561 1.00 0.00 S ATOM 0 H CYS A 4 4.623 -4.279 15.494 1.00 0.00 H new ATOM 0 HA CYS A 4 3.615 -3.280 18.085 1.00 0.00 H new ATOM 0 HB2 CYS A 4 2.746 -3.075 15.218 1.00 0.00 H new ATOM 0 HB3 CYS A 4 1.504 -3.081 16.454 1.00 0.00 H new ATOM 59 N VAL A 5 2.431 -5.361 18.675 1.00 0.00 N ATOM 60 CA VAL A 5 1.737 -6.583 19.062 1.00 0.00 C ATOM 61 C VAL A 5 0.263 -6.315 19.341 1.00 0.00 C ATOM 62 O VAL A 5 -0.104 -5.864 20.427 1.00 0.00 O ATOM 63 CB VAL A 5 2.374 -7.235 20.305 1.00 0.00 C ATOM 64 CG1 VAL A 5 3.182 -8.461 19.905 1.00 0.00 C ATOM 65 CG2 VAL A 5 3.242 -6.238 21.058 1.00 0.00 C ATOM 0 H VAL A 5 2.695 -4.759 19.455 1.00 0.00 H new ATOM 0 HA VAL A 5 1.827 -7.270 18.221 1.00 0.00 H new ATOM 0 HB VAL A 5 1.573 -7.552 20.973 1.00 0.00 H new ATOM 0 HG11 VAL A 5 3.626 -8.910 20.794 1.00 0.00 H new ATOM 0 HG12 VAL A 5 2.528 -9.186 19.420 1.00 0.00 H new ATOM 0 HG13 VAL A 5 3.972 -8.167 19.214 1.00 0.00 H new ATOM 0 HG21 VAL A 5 3.680 -6.723 21.931 1.00 0.00 H new ATOM 0 HG22 VAL A 5 4.038 -5.881 20.404 1.00 0.00 H new ATOM 0 HG23 VAL A 5 2.631 -5.394 21.380 1.00 0.00 H new ATOM 75 N THR A 6 -0.578 -6.598 18.353 1.00 0.00 N ATOM 76 CA THR A 6 -2.015 -6.391 18.489 1.00 0.00 C ATOM 77 C THR A 6 -2.660 -7.532 19.265 1.00 0.00 C ATOM 78 O THR A 6 -2.513 -8.701 18.907 1.00 0.00 O ATOM 79 CB THR A 6 -2.698 -6.270 17.114 1.00 0.00 C ATOM 80 OG1 THR A 6 -3.225 -7.541 16.715 1.00 0.00 O ATOM 81 CG2 THR A 6 -1.717 -5.771 16.064 1.00 0.00 C ATOM 0 H THR A 6 -0.290 -6.972 17.449 1.00 0.00 H new ATOM 0 HA THR A 6 -2.151 -5.458 19.036 1.00 0.00 H new ATOM 0 HB THR A 6 -3.512 -5.550 17.200 1.00 0.00 H new ATOM 0 HG1 THR A 6 -3.659 -7.455 15.840 1.00 0.00 H new ATOM 0 HG21 THR A 6 -2.222 -5.694 15.101 1.00 0.00 H new ATOM 0 HG22 THR A 6 -1.340 -4.791 16.355 1.00 0.00 H new ATOM 0 HG23 THR A 6 -0.885 -6.470 15.982 1.00 0.00 H new ATOM 89 N ASP A 7 -3.373 -7.188 20.332 1.00 0.00 N ATOM 90 CA ASP A 7 -4.039 -8.185 21.162 1.00 0.00 C ATOM 91 C ASP A 7 -3.042 -9.226 21.660 1.00 0.00 C ATOM 92 O ASP A 7 -3.427 -10.316 22.083 1.00 0.00 O ATOM 93 CB ASP A 7 -5.159 -8.868 20.375 1.00 0.00 C ATOM 94 CG ASP A 7 -6.383 -7.987 20.229 1.00 0.00 C ATOM 95 OD1 ASP A 7 -6.332 -7.026 19.432 1.00 0.00 O ATOM 96 OD2 ASP A 7 -7.394 -8.257 20.911 1.00 0.00 O ATOM 0 H ASP A 7 -3.505 -6.225 20.643 1.00 0.00 H new ATOM 0 HA ASP A 7 -4.470 -7.677 22.025 1.00 0.00 H new ATOM 0 HB2 ASP A 7 -4.791 -9.140 19.386 1.00 0.00 H new ATOM 0 HB3 ASP A 7 -5.439 -9.794 20.877 1.00 0.00 H new ATOM 101 N SER A 8 -1.759 -8.882 21.605 1.00 0.00 N ATOM 102 CA SER A 8 -0.706 -9.788 22.049 1.00 0.00 C ATOM 103 C SER A 8 -0.697 -11.064 21.213 1.00 0.00 C ATOM 104 O SER A 8 -0.640 -12.169 21.752 1.00 0.00 O ATOM 105 CB SER A 8 -0.892 -10.133 23.528 1.00 0.00 C ATOM 106 OG SER A 8 -0.296 -9.154 24.360 1.00 0.00 O ATOM 0 H SER A 8 -1.424 -7.983 21.258 1.00 0.00 H new ATOM 0 HA SER A 8 0.252 -9.284 21.918 1.00 0.00 H new ATOM 0 HB2 SER A 8 -1.955 -10.209 23.756 1.00 0.00 H new ATOM 0 HB3 SER A 8 -0.451 -11.108 23.735 1.00 0.00 H new ATOM 0 HG SER A 8 -0.431 -9.397 25.300 1.00 0.00 H new ATOM 112 N GLY A 9 -0.756 -10.902 19.896 1.00 0.00 N ATOM 113 CA GLY A 9 -0.754 -12.051 19.009 1.00 0.00 C ATOM 114 C GLY A 9 -0.160 -11.737 17.650 1.00 0.00 C ATOM 115 O GLY A 9 0.572 -12.550 17.084 1.00 0.00 O ATOM 0 H GLY A 9 -0.805 -9.998 19.427 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -0.188 -12.861 19.470 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -1.776 -12.408 18.881 1.00 0.00 H new ATOM 119 N VAL A 10 -0.476 -10.558 17.122 1.00 0.00 N ATOM 120 CA VAL A 10 0.033 -10.146 15.819 1.00 0.00 C ATOM 121 C VAL A 10 1.157 -9.127 15.962 1.00 0.00 C ATOM 122 O VAL A 10 0.952 -8.028 16.476 1.00 0.00 O ATOM 123 CB VAL A 10 -1.084 -9.541 14.946 1.00 0.00 C ATOM 124 CG1 VAL A 10 -0.842 -9.853 13.477 1.00 0.00 C ATOM 125 CG2 VAL A 10 -2.446 -10.053 15.391 1.00 0.00 C ATOM 0 H VAL A 10 -1.081 -9.873 17.576 1.00 0.00 H new ATOM 0 HA VAL A 10 0.420 -11.042 15.334 1.00 0.00 H new ATOM 0 HB VAL A 10 -1.071 -8.458 15.070 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.641 -9.418 12.876 1.00 0.00 H new ATOM 0 HG12 VAL A 10 0.115 -9.432 13.168 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -0.826 -10.933 13.332 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.222 -9.615 14.763 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -2.474 -11.139 15.299 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -2.618 -9.772 16.430 1.00 0.00 H new ATOM 135 N VAL A 11 2.347 -9.501 15.503 1.00 0.00 N ATOM 136 CA VAL A 11 3.507 -8.623 15.576 1.00 0.00 C ATOM 137 C VAL A 11 3.731 -7.896 14.254 1.00 0.00 C ATOM 138 O VAL A 11 3.595 -8.485 13.181 1.00 0.00 O ATOM 139 CB VAL A 11 4.781 -9.406 15.940 1.00 0.00 C ATOM 140 CG1 VAL A 11 5.951 -8.458 16.157 1.00 0.00 C ATOM 141 CG2 VAL A 11 4.546 -10.263 17.173 1.00 0.00 C ATOM 0 H VAL A 11 2.532 -10.408 15.076 1.00 0.00 H new ATOM 0 HA VAL A 11 3.302 -7.893 16.359 1.00 0.00 H new ATOM 0 HB VAL A 11 5.029 -10.065 15.108 1.00 0.00 H new ATOM 0 HG11 VAL A 11 6.842 -9.032 16.413 1.00 0.00 H new ATOM 0 HG12 VAL A 11 6.135 -7.892 15.244 1.00 0.00 H new ATOM 0 HG13 VAL A 11 5.716 -7.770 16.969 1.00 0.00 H new ATOM 0 HG21 VAL A 11 5.457 -10.809 17.415 1.00 0.00 H new ATOM 0 HG22 VAL A 11 4.271 -9.625 18.013 1.00 0.00 H new ATOM 0 HG23 VAL A 11 3.740 -10.970 16.976 1.00 0.00 H new ATOM 151 N TYR A 12 4.073 -6.615 14.338 1.00 0.00 N ATOM 152 CA TYR A 12 4.312 -5.811 13.147 1.00 0.00 C ATOM 153 C TYR A 12 5.484 -4.857 13.357 1.00 0.00 C ATOM 154 O TYR A 12 5.322 -3.770 13.912 1.00 0.00 O ATOM 155 CB TYR A 12 3.056 -5.020 12.780 1.00 0.00 C ATOM 156 CG TYR A 12 1.897 -5.892 12.352 1.00 0.00 C ATOM 157 CD1 TYR A 12 1.885 -6.500 11.103 1.00 0.00 C ATOM 158 CD2 TYR A 12 0.816 -6.109 13.198 1.00 0.00 C ATOM 159 CE1 TYR A 12 0.829 -7.298 10.707 1.00 0.00 C ATOM 160 CE2 TYR A 12 -0.244 -6.907 12.810 1.00 0.00 C ATOM 161 CZ TYR A 12 -0.233 -7.499 11.565 1.00 0.00 C ATOM 162 OH TYR A 12 -1.287 -8.293 11.175 1.00 0.00 O ATOM 0 H TYR A 12 4.191 -6.112 15.218 1.00 0.00 H new ATOM 0 HA TYR A 12 4.561 -6.487 12.329 1.00 0.00 H new ATOM 0 HB2 TYR A 12 2.751 -4.419 13.637 1.00 0.00 H new ATOM 0 HB3 TYR A 12 3.296 -4.327 11.974 1.00 0.00 H new ATOM 0 HD1 TYR A 12 2.715 -6.346 10.430 1.00 0.00 H new ATOM 0 HD2 TYR A 12 0.804 -5.647 14.174 1.00 0.00 H new ATOM 0 HE1 TYR A 12 0.835 -7.762 9.732 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -1.077 -7.066 13.479 1.00 0.00 H new ATOM 0 HH TYR A 12 -0.946 -9.147 10.836 1.00 0.00 H new ATOM 172 N SER A 13 6.665 -5.272 12.909 1.00 0.00 N ATOM 173 CA SER A 13 7.865 -4.453 13.046 1.00 0.00 C ATOM 174 C SER A 13 7.594 -3.017 12.612 1.00 0.00 C ATOM 175 O SER A 13 6.769 -2.769 11.733 1.00 0.00 O ATOM 176 CB SER A 13 9.007 -5.042 12.213 1.00 0.00 C ATOM 177 OG SER A 13 9.281 -4.237 11.080 1.00 0.00 O ATOM 0 H SER A 13 6.817 -6.169 12.449 1.00 0.00 H new ATOM 0 HA SER A 13 8.155 -4.449 14.097 1.00 0.00 H new ATOM 0 HB2 SER A 13 9.903 -5.127 12.828 1.00 0.00 H new ATOM 0 HB3 SER A 13 8.744 -6.050 11.892 1.00 0.00 H new ATOM 0 HG SER A 13 10.222 -4.340 10.825 1.00 0.00 H new ATOM 183 N VAL A 14 8.293 -2.074 13.234 1.00 0.00 N ATOM 184 CA VAL A 14 8.130 -0.666 12.915 1.00 0.00 C ATOM 185 C VAL A 14 8.231 -0.425 11.414 1.00 0.00 C ATOM 186 O VAL A 14 8.437 -1.360 10.639 1.00 0.00 O ATOM 187 CB VAL A 14 9.185 0.185 13.638 1.00 0.00 C ATOM 188 CG1 VAL A 14 9.145 -0.081 15.134 1.00 0.00 C ATOM 189 CG2 VAL A 14 10.571 -0.086 13.076 1.00 0.00 C ATOM 0 H VAL A 14 8.980 -2.263 13.964 1.00 0.00 H new ATOM 0 HA VAL A 14 7.137 -0.371 13.254 1.00 0.00 H new ATOM 0 HB VAL A 14 8.954 1.237 13.471 1.00 0.00 H new ATOM 0 HG11 VAL A 14 9.898 0.529 15.632 1.00 0.00 H new ATOM 0 HG12 VAL A 14 8.158 0.172 15.522 1.00 0.00 H new ATOM 0 HG13 VAL A 14 9.350 -1.135 15.322 1.00 0.00 H new ATOM 0 HG21 VAL A 14 11.303 0.527 13.602 1.00 0.00 H new ATOM 0 HG22 VAL A 14 10.818 -1.139 13.208 1.00 0.00 H new ATOM 0 HG23 VAL A 14 10.588 0.160 12.014 1.00 0.00 H new ATOM 199 N GLY A 15 8.079 0.831 11.008 1.00 0.00 N ATOM 200 CA GLY A 15 8.151 1.165 9.599 1.00 0.00 C ATOM 201 C GLY A 15 7.527 0.095 8.726 1.00 0.00 C ATOM 202 O GLY A 15 7.944 -0.108 7.587 1.00 0.00 O ATOM 0 H GLY A 15 7.908 1.622 11.629 1.00 0.00 H new ATOM 0 HA2 GLY A 15 7.644 2.114 9.426 1.00 0.00 H new ATOM 0 HA3 GLY A 15 9.194 1.303 9.313 1.00 0.00 H new ATOM 206 N MET A 16 6.525 -0.593 9.266 1.00 0.00 N ATOM 207 CA MET A 16 5.844 -1.654 8.531 1.00 0.00 C ATOM 208 C MET A 16 4.348 -1.376 8.429 1.00 0.00 C ATOM 209 O MET A 16 3.665 -1.215 9.440 1.00 0.00 O ATOM 210 CB MET A 16 6.078 -3.004 9.210 1.00 0.00 C ATOM 211 CG MET A 16 5.735 -4.195 8.331 1.00 0.00 C ATOM 212 SD MET A 16 5.270 -5.652 9.284 1.00 0.00 S ATOM 213 CE MET A 16 6.607 -6.769 8.871 1.00 0.00 C ATOM 0 H MET A 16 6.167 -0.435 10.208 1.00 0.00 H new ATOM 0 HA MET A 16 6.257 -1.684 7.523 1.00 0.00 H new ATOM 0 HB2 MET A 16 7.124 -3.074 9.510 1.00 0.00 H new ATOM 0 HB3 MET A 16 5.481 -3.051 10.121 1.00 0.00 H new ATOM 0 HG2 MET A 16 4.916 -3.925 7.664 1.00 0.00 H new ATOM 0 HG3 MET A 16 6.592 -4.436 7.702 1.00 0.00 H new ATOM 0 HE1 MET A 16 6.228 -7.573 8.240 1.00 0.00 H new ATOM 0 HE2 MET A 16 7.385 -6.224 8.336 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.024 -7.191 9.785 1.00 0.00 H new ATOM 223 N GLN A 17 3.845 -1.323 7.199 1.00 0.00 N ATOM 224 CA GLN A 17 2.429 -1.066 6.963 1.00 0.00 C ATOM 225 C GLN A 17 1.639 -2.370 6.914 1.00 0.00 C ATOM 226 O GLN A 17 2.208 -3.446 6.731 1.00 0.00 O ATOM 227 CB GLN A 17 2.241 -0.294 5.656 1.00 0.00 C ATOM 228 CG GLN A 17 3.468 0.500 5.236 1.00 0.00 C ATOM 229 CD GLN A 17 3.239 1.301 3.969 1.00 0.00 C ATOM 230 OE1 GLN A 17 3.658 0.900 2.884 1.00 0.00 O ATOM 231 NE2 GLN A 17 2.570 2.440 4.103 1.00 0.00 N ATOM 0 H GLN A 17 4.397 -1.455 6.351 1.00 0.00 H new ATOM 0 HA GLN A 17 2.052 -0.465 7.791 1.00 0.00 H new ATOM 0 HB2 GLN A 17 1.984 -0.996 4.863 1.00 0.00 H new ATOM 0 HB3 GLN A 17 1.397 0.387 5.764 1.00 0.00 H new ATOM 0 HG2 GLN A 17 3.752 1.176 6.042 1.00 0.00 H new ATOM 0 HG3 GLN A 17 4.304 -0.183 5.083 1.00 0.00 H new ATOM 0 HE21 GLN A 17 2.241 2.733 5.023 1.00 0.00 H new ATOM 0 HE22 GLN A 17 2.385 3.022 3.286 1.00 0.00 H new ATOM 240 N TRP A 18 0.324 -2.266 7.078 1.00 0.00 N ATOM 241 CA TRP A 18 -0.545 -3.436 7.051 1.00 0.00 C ATOM 242 C TRP A 18 -2.013 -3.023 7.019 1.00 0.00 C ATOM 243 O TRP A 18 -2.521 -2.425 7.966 1.00 0.00 O ATOM 244 CB TRP A 18 -0.278 -4.325 8.267 1.00 0.00 C ATOM 245 CG TRP A 18 -1.021 -3.899 9.495 1.00 0.00 C ATOM 246 CD1 TRP A 18 -2.313 -4.201 9.819 1.00 0.00 C ATOM 247 CD2 TRP A 18 -0.518 -3.091 10.565 1.00 0.00 C ATOM 248 NE1 TRP A 18 -2.642 -3.632 11.024 1.00 0.00 N ATOM 249 CE2 TRP A 18 -1.557 -2.945 11.504 1.00 0.00 C ATOM 250 CE3 TRP A 18 0.712 -2.477 10.823 1.00 0.00 C ATOM 251 CZ2 TRP A 18 -1.404 -2.212 12.677 1.00 0.00 C ATOM 252 CZ3 TRP A 18 0.863 -1.751 11.988 1.00 0.00 C ATOM 253 CH2 TRP A 18 -0.190 -1.624 12.903 1.00 0.00 C ATOM 0 H TRP A 18 -0.163 -1.383 7.231 1.00 0.00 H new ATOM 0 HA TRP A 18 -0.326 -3.999 6.144 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -0.553 -5.351 8.024 1.00 0.00 H new ATOM 0 HB3 TRP A 18 0.791 -4.323 8.480 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -2.979 -4.800 9.215 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -3.547 -3.708 11.487 1.00 0.00 H new ATOM 0 HE3 TRP A 18 1.529 -2.569 10.123 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -2.215 -2.111 13.383 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 1.809 -1.273 12.197 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -0.040 -1.050 13.805 1.00 0.00 H new ATOM 264 N LEU A 19 -2.688 -3.347 5.920 1.00 0.00 N ATOM 265 CA LEU A 19 -4.098 -3.009 5.763 1.00 0.00 C ATOM 266 C LEU A 19 -4.954 -3.748 6.787 1.00 0.00 C ATOM 267 O LEU A 19 -4.618 -4.855 7.207 1.00 0.00 O ATOM 268 CB LEU A 19 -4.570 -3.348 4.348 1.00 0.00 C ATOM 269 CG LEU A 19 -5.750 -2.516 3.843 1.00 0.00 C ATOM 270 CD1 LEU A 19 -5.372 -1.044 3.769 1.00 0.00 C ATOM 271 CD2 LEU A 19 -6.214 -3.019 2.484 1.00 0.00 C ATOM 0 H LEU A 19 -2.282 -3.842 5.126 1.00 0.00 H new ATOM 0 HA LEU A 19 -4.209 -1.938 5.930 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -3.733 -3.218 3.661 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.848 -4.402 4.317 1.00 0.00 H new ATOM 0 HG LEU A 19 -6.574 -2.623 4.548 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -6.224 -0.467 3.408 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -5.089 -0.691 4.761 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -4.532 -0.918 3.086 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -7.054 -2.416 2.140 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -5.395 -2.942 1.769 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -6.526 -4.060 2.568 1.00 0.00 H new ATOM 283 N LYS A 20 -6.059 -3.127 7.184 1.00 0.00 N ATOM 284 CA LYS A 20 -6.964 -3.725 8.159 1.00 0.00 C ATOM 285 C LYS A 20 -8.309 -3.006 8.166 1.00 0.00 C ATOM 286 O LYS A 20 -8.366 -1.777 8.186 1.00 0.00 O ATOM 287 CB LYS A 20 -6.342 -3.682 9.556 1.00 0.00 C ATOM 288 CG LYS A 20 -5.594 -2.392 9.850 1.00 0.00 C ATOM 289 CD LYS A 20 -6.542 -1.283 10.278 1.00 0.00 C ATOM 290 CE LYS A 20 -6.357 -0.927 11.744 1.00 0.00 C ATOM 291 NZ LYS A 20 -7.098 0.310 12.114 1.00 0.00 N ATOM 0 H LYS A 20 -6.350 -2.210 6.846 1.00 0.00 H new ATOM 0 HA LYS A 20 -7.130 -4.764 7.874 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.129 -3.813 10.299 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -5.657 -4.523 9.665 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.859 -2.567 10.636 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.043 -2.079 8.963 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.371 -0.399 9.663 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.572 -1.596 10.106 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.700 -1.755 12.364 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -5.296 -0.791 11.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -6.421 1.058 12.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -7.677 0.622 11.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.715 0.115 12.928 1.00 0.00 H new ATOM 305 N THR A 21 -9.388 -3.780 8.148 1.00 0.00 N ATOM 306 CA THR A 21 -10.732 -3.216 8.150 1.00 0.00 C ATOM 307 C THR A 21 -11.116 -2.717 9.539 1.00 0.00 C ATOM 308 O THR A 21 -11.241 -3.501 10.479 1.00 0.00 O ATOM 309 CB THR A 21 -11.776 -4.248 7.684 1.00 0.00 C ATOM 310 OG1 THR A 21 -12.983 -3.583 7.294 1.00 0.00 O ATOM 311 CG2 THR A 21 -12.077 -5.250 8.788 1.00 0.00 C ATOM 0 H THR A 21 -9.358 -4.799 8.132 1.00 0.00 H new ATOM 0 HA THR A 21 -10.723 -2.378 7.453 1.00 0.00 H new ATOM 0 HB THR A 21 -11.366 -4.786 6.829 1.00 0.00 H new ATOM 0 HG1 THR A 21 -12.793 -2.638 7.116 1.00 0.00 H new ATOM 0 HG21 THR A 21 -12.817 -5.969 8.435 1.00 0.00 H new ATOM 0 HG22 THR A 21 -11.162 -5.776 9.062 1.00 0.00 H new ATOM 0 HG23 THR A 21 -12.468 -4.725 9.659 1.00 0.00 H new ATOM 319 N GLN A 22 -11.301 -1.406 9.660 1.00 0.00 N ATOM 320 CA GLN A 22 -11.671 -0.801 10.935 1.00 0.00 C ATOM 321 C GLN A 22 -13.183 -0.640 11.041 1.00 0.00 C ATOM 322 O GLN A 22 -13.680 0.428 11.399 1.00 0.00 O ATOM 323 CB GLN A 22 -10.989 0.559 11.094 1.00 0.00 C ATOM 324 CG GLN A 22 -10.827 0.993 12.542 1.00 0.00 C ATOM 325 CD GLN A 22 -12.118 1.516 13.140 1.00 0.00 C ATOM 326 OE1 GLN A 22 -12.402 2.713 13.085 1.00 0.00 O ATOM 327 NE2 GLN A 22 -12.908 0.619 13.719 1.00 0.00 N ATOM 0 H GLN A 22 -11.201 -0.743 8.892 1.00 0.00 H new ATOM 0 HA GLN A 22 -11.337 -1.463 11.734 1.00 0.00 H new ATOM 0 HB2 GLN A 22 -10.007 0.521 10.623 1.00 0.00 H new ATOM 0 HB3 GLN A 22 -11.569 1.312 10.561 1.00 0.00 H new ATOM 0 HG2 GLN A 22 -10.472 0.149 13.133 1.00 0.00 H new ATOM 0 HG3 GLN A 22 -10.063 1.768 12.602 1.00 0.00 H new ATOM 0 HE21 GLN A 22 -12.634 -0.363 13.742 1.00 0.00 H new ATOM 0 HE22 GLN A 22 -13.789 0.912 14.141 1.00 0.00 H new ATOM 336 N GLY A 23 -13.910 -1.708 10.729 1.00 0.00 N ATOM 337 CA GLY A 23 -15.359 -1.665 10.797 1.00 0.00 C ATOM 338 C GLY A 23 -16.015 -2.271 9.572 1.00 0.00 C ATOM 339 O GLY A 23 -16.357 -3.453 9.564 1.00 0.00 O ATOM 0 H GLY A 23 -13.521 -2.603 10.430 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -15.694 -2.199 11.686 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -15.684 -0.630 10.905 1.00 0.00 H new ATOM 343 N ASN A 24 -16.190 -1.459 8.534 1.00 0.00 N ATOM 344 CA ASN A 24 -16.810 -1.921 7.298 1.00 0.00 C ATOM 345 C ASN A 24 -16.087 -1.351 6.082 1.00 0.00 C ATOM 346 O ASN A 24 -16.637 -1.318 4.981 1.00 0.00 O ATOM 347 CB ASN A 24 -18.286 -1.522 7.263 1.00 0.00 C ATOM 348 CG ASN A 24 -18.491 -0.041 7.509 1.00 0.00 C ATOM 349 OD1 ASN A 24 -17.909 0.534 8.428 1.00 0.00 O ATOM 350 ND2 ASN A 24 -19.323 0.586 6.687 1.00 0.00 N ATOM 0 H ASN A 24 -15.911 -0.478 8.525 1.00 0.00 H new ATOM 0 HA ASN A 24 -16.735 -3.008 7.266 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -18.708 -1.788 6.294 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -18.831 -2.091 8.016 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -19.501 1.584 6.804 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -19.785 0.070 5.938 1.00 0.00 H new ATOM 357 N LYS A 25 -14.852 -0.905 6.288 1.00 0.00 N ATOM 358 CA LYS A 25 -14.055 -0.336 5.208 1.00 0.00 C ATOM 359 C LYS A 25 -12.605 -0.798 5.301 1.00 0.00 C ATOM 360 O LYS A 25 -12.271 -1.671 6.102 1.00 0.00 O ATOM 361 CB LYS A 25 -14.119 1.192 5.247 1.00 0.00 C ATOM 362 CG LYS A 25 -15.250 1.731 6.109 1.00 0.00 C ATOM 363 CD LYS A 25 -15.001 3.174 6.517 1.00 0.00 C ATOM 364 CE LYS A 25 -16.206 4.052 6.224 1.00 0.00 C ATOM 365 NZ LYS A 25 -17.019 4.307 7.447 1.00 0.00 N ATOM 0 H LYS A 25 -14.382 -0.927 7.193 1.00 0.00 H new ATOM 0 HA LYS A 25 -14.469 -0.685 4.262 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -13.171 1.578 5.623 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -14.236 1.569 4.231 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -16.190 1.664 5.561 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -15.356 1.113 7.001 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -14.768 3.217 7.581 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.131 3.559 5.985 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -15.870 5.001 5.807 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -16.828 3.574 5.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -17.831 4.910 7.205 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -17.361 3.403 7.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -16.433 4.787 8.160 1.00 0.00 H new ATOM 379 N GLN A 26 -11.746 -0.207 4.477 1.00 0.00 N ATOM 380 CA GLN A 26 -10.331 -0.557 4.467 1.00 0.00 C ATOM 381 C GLN A 26 -9.479 0.602 4.974 1.00 0.00 C ATOM 382 O GLN A 26 -9.645 1.742 4.540 1.00 0.00 O ATOM 383 CB GLN A 26 -9.891 -0.949 3.055 1.00 0.00 C ATOM 384 CG GLN A 26 -10.631 -2.156 2.501 1.00 0.00 C ATOM 385 CD GLN A 26 -10.337 -2.396 1.033 1.00 0.00 C ATOM 386 OE1 GLN A 26 -10.062 -3.523 0.619 1.00 0.00 O ATOM 387 NE2 GLN A 26 -10.393 -1.334 0.236 1.00 0.00 N ATOM 0 H GLN A 26 -12.006 0.517 3.807 1.00 0.00 H new ATOM 0 HA GLN A 26 -10.189 -1.407 5.134 1.00 0.00 H new ATOM 0 HB2 GLN A 26 -10.044 -0.101 2.387 1.00 0.00 H new ATOM 0 HB3 GLN A 26 -8.822 -1.160 3.062 1.00 0.00 H new ATOM 0 HG2 GLN A 26 -10.354 -3.042 3.073 1.00 0.00 H new ATOM 0 HG3 GLN A 26 -11.703 -2.013 2.634 1.00 0.00 H new ATOM 0 HE21 GLN A 26 -10.625 -0.419 0.622 1.00 0.00 H new ATOM 0 HE22 GLN A 26 -10.204 -1.434 -0.761 1.00 0.00 H new ATOM 396 N MET A 27 -8.568 0.303 5.893 1.00 0.00 N ATOM 397 CA MET A 27 -7.689 1.320 6.458 1.00 0.00 C ATOM 398 C MET A 27 -6.259 0.803 6.573 1.00 0.00 C ATOM 399 O MET A 27 -6.008 -0.215 7.217 1.00 0.00 O ATOM 400 CB MET A 27 -8.199 1.756 7.834 1.00 0.00 C ATOM 401 CG MET A 27 -9.203 2.895 7.778 1.00 0.00 C ATOM 402 SD MET A 27 -8.768 4.259 8.874 1.00 0.00 S ATOM 403 CE MET A 27 -7.008 4.388 8.572 1.00 0.00 C ATOM 0 H MET A 27 -8.419 -0.636 6.263 1.00 0.00 H new ATOM 0 HA MET A 27 -7.691 2.179 5.787 1.00 0.00 H new ATOM 0 HB2 MET A 27 -8.659 0.901 8.329 1.00 0.00 H new ATOM 0 HB3 MET A 27 -7.351 2.060 8.447 1.00 0.00 H new ATOM 0 HG2 MET A 27 -9.271 3.264 6.755 1.00 0.00 H new ATOM 0 HG3 MET A 27 -10.190 2.518 8.047 1.00 0.00 H new ATOM 0 HE1 MET A 27 -6.699 5.430 8.658 1.00 0.00 H new ATOM 0 HE2 MET A 27 -6.468 3.788 9.305 1.00 0.00 H new ATOM 0 HE3 MET A 27 -6.783 4.025 7.569 1.00 0.00 H new ATOM 413 N LEU A 28 -5.327 1.511 5.944 1.00 0.00 N ATOM 414 CA LEU A 28 -3.922 1.123 5.976 1.00 0.00 C ATOM 415 C LEU A 28 -3.237 1.665 7.226 1.00 0.00 C ATOM 416 O LEU A 28 -3.334 2.855 7.532 1.00 0.00 O ATOM 417 CB LEU A 28 -3.202 1.629 4.725 1.00 0.00 C ATOM 418 CG LEU A 28 -1.805 1.045 4.503 1.00 0.00 C ATOM 419 CD1 LEU A 28 -1.901 -0.372 3.960 1.00 0.00 C ATOM 420 CD2 LEU A 28 -1.004 1.928 3.557 1.00 0.00 C ATOM 0 H LEU A 28 -5.519 2.356 5.406 1.00 0.00 H new ATOM 0 HA LEU A 28 -3.872 0.034 5.999 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.817 1.403 3.854 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.121 2.714 4.785 1.00 0.00 H new ATOM 0 HG LEU A 28 -1.288 1.011 5.462 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.899 -0.772 3.808 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -2.438 -0.999 4.672 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.436 -0.362 3.010 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.013 1.499 3.410 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.517 1.993 2.598 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.907 2.926 3.985 1.00 0.00 H new ATOM 432 N CYS A 29 -2.546 0.788 7.946 1.00 0.00 N ATOM 433 CA CYS A 29 -1.846 1.182 9.163 1.00 0.00 C ATOM 434 C CYS A 29 -0.408 0.674 9.156 1.00 0.00 C ATOM 435 O CYS A 29 -0.127 -0.421 8.667 1.00 0.00 O ATOM 436 CB CYS A 29 -2.582 0.648 10.394 1.00 0.00 C ATOM 437 SG CYS A 29 -4.374 0.976 10.391 1.00 0.00 S ATOM 0 H CYS A 29 -2.456 -0.200 7.708 1.00 0.00 H new ATOM 0 HA CYS A 29 -1.825 2.271 9.203 1.00 0.00 H new ATOM 0 HB2 CYS A 29 -2.421 -0.428 10.462 1.00 0.00 H new ATOM 0 HB3 CYS A 29 -2.144 1.093 11.287 1.00 0.00 H new ATOM 442 N THR A 30 0.498 1.476 9.703 1.00 0.00 N ATOM 443 CA THR A 30 1.909 1.111 9.763 1.00 0.00 C ATOM 444 C THR A 30 2.496 1.417 11.135 1.00 0.00 C ATOM 445 O THR A 30 2.374 2.534 11.637 1.00 0.00 O ATOM 446 CB THR A 30 2.728 1.854 8.691 1.00 0.00 C ATOM 447 OG1 THR A 30 2.178 1.606 7.391 1.00 0.00 O ATOM 448 CG2 THR A 30 4.185 1.414 8.722 1.00 0.00 C ATOM 0 H THR A 30 0.281 2.385 10.112 1.00 0.00 H new ATOM 0 HA THR A 30 1.967 0.039 9.575 1.00 0.00 H new ATOM 0 HB THR A 30 2.681 2.921 8.906 1.00 0.00 H new ATOM 0 HG1 THR A 30 1.902 2.454 6.985 1.00 0.00 H new ATOM 0 HG21 THR A 30 4.744 1.952 7.956 1.00 0.00 H new ATOM 0 HG22 THR A 30 4.610 1.632 9.702 1.00 0.00 H new ATOM 0 HG23 THR A 30 4.246 0.343 8.530 1.00 0.00 H new ATOM 456 N CYS A 31 3.136 0.420 11.736 1.00 0.00 N ATOM 457 CA CYS A 31 3.744 0.586 13.050 1.00 0.00 C ATOM 458 C CYS A 31 5.101 1.270 12.933 1.00 0.00 C ATOM 459 O CYS A 31 5.890 0.955 12.043 1.00 0.00 O ATOM 460 CB CYS A 31 3.901 -0.770 13.738 1.00 0.00 C ATOM 461 SG CYS A 31 4.490 -0.666 15.458 1.00 0.00 S ATOM 0 H CYS A 31 3.247 -0.511 11.334 1.00 0.00 H new ATOM 0 HA CYS A 31 3.088 1.215 13.652 1.00 0.00 H new ATOM 0 HB2 CYS A 31 2.941 -1.286 13.724 1.00 0.00 H new ATOM 0 HB3 CYS A 31 4.598 -1.379 13.163 1.00 0.00 H new ATOM 466 N LEU A 32 5.365 2.208 13.836 1.00 0.00 N ATOM 467 CA LEU A 32 6.628 2.938 13.834 1.00 0.00 C ATOM 468 C LEU A 32 7.039 3.320 15.252 1.00 0.00 C ATOM 469 O LEU A 32 6.378 2.949 16.222 1.00 0.00 O ATOM 470 CB LEU A 32 6.511 4.195 12.968 1.00 0.00 C ATOM 471 CG LEU A 32 6.346 3.936 11.470 1.00 0.00 C ATOM 472 CD1 LEU A 32 5.335 4.901 10.871 1.00 0.00 C ATOM 473 CD2 LEU A 32 7.685 4.051 10.758 1.00 0.00 C ATOM 0 H LEU A 32 4.721 2.481 14.579 1.00 0.00 H new ATOM 0 HA LEU A 32 7.396 2.286 13.417 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.659 4.780 13.316 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.401 4.806 13.120 1.00 0.00 H new ATOM 0 HG LEU A 32 5.973 2.921 11.334 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.230 4.702 9.804 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.371 4.768 11.361 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.679 5.925 11.017 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.548 3.864 9.693 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.088 5.054 10.901 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.380 3.318 11.169 1.00 0.00 H new ATOM 485 N GLY A 33 8.135 4.061 15.364 1.00 0.00 N ATOM 486 CA GLY A 33 8.616 4.481 16.667 1.00 0.00 C ATOM 487 C GLY A 33 7.505 5.006 17.555 1.00 0.00 C ATOM 488 O GLY A 33 7.490 4.751 18.759 1.00 0.00 O ATOM 0 H GLY A 33 8.699 4.379 14.576 1.00 0.00 H new ATOM 0 HA2 GLY A 33 9.103 3.639 17.159 1.00 0.00 H new ATOM 0 HA3 GLY A 33 9.371 5.256 16.539 1.00 0.00 H new ATOM 492 N ASN A 34 6.571 5.739 16.958 1.00 0.00 N ATOM 493 CA ASN A 34 5.450 6.301 17.701 1.00 0.00 C ATOM 494 C ASN A 34 4.403 5.233 17.995 1.00 0.00 C ATOM 495 O ASN A 34 3.730 5.275 19.026 1.00 0.00 O ATOM 496 CB ASN A 34 4.815 7.451 16.916 1.00 0.00 C ATOM 497 CG ASN A 34 4.958 8.783 17.626 1.00 0.00 C ATOM 498 OD1 ASN A 34 5.195 9.813 16.995 1.00 0.00 O ATOM 499 ND2 ASN A 34 4.813 8.769 18.946 1.00 0.00 N ATOM 0 H ASN A 34 6.569 5.957 15.962 1.00 0.00 H new ATOM 0 HA ASN A 34 5.830 6.683 18.648 1.00 0.00 H new ATOM 0 HB2 ASN A 34 5.279 7.515 15.932 1.00 0.00 H new ATOM 0 HB3 ASN A 34 3.758 7.239 16.757 1.00 0.00 H new ATOM 0 HD21 ASN A 34 4.897 9.635 19.478 1.00 0.00 H new ATOM 0 HD22 ASN A 34 4.617 7.892 19.428 1.00 0.00 H new ATOM 506 N GLY A 35 4.270 4.275 17.084 1.00 0.00 N ATOM 507 CA GLY A 35 3.302 3.208 17.264 1.00 0.00 C ATOM 508 C GLY A 35 2.396 3.035 16.060 1.00 0.00 C ATOM 509 O GLY A 35 2.511 3.770 15.078 1.00 0.00 O ATOM 0 H GLY A 35 4.815 4.218 16.224 1.00 0.00 H new ATOM 0 HA2 GLY A 35 3.828 2.273 17.456 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.695 3.418 18.144 1.00 0.00 H new ATOM 513 N VAL A 36 1.495 2.063 16.136 1.00 0.00 N ATOM 514 CA VAL A 36 0.565 1.795 15.045 1.00 0.00 C ATOM 515 C VAL A 36 0.136 3.087 14.358 1.00 0.00 C ATOM 516 O VAL A 36 -0.602 3.889 14.929 1.00 0.00 O ATOM 517 CB VAL A 36 -0.689 1.054 15.545 1.00 0.00 C ATOM 518 CG1 VAL A 36 -1.753 1.010 14.460 1.00 0.00 C ATOM 519 CG2 VAL A 36 -0.332 -0.351 16.009 1.00 0.00 C ATOM 0 H VAL A 36 1.388 1.447 16.942 1.00 0.00 H new ATOM 0 HA VAL A 36 1.091 1.163 14.330 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.094 1.601 16.397 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -2.631 0.482 14.833 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.031 2.027 14.182 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.361 0.489 13.586 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -1.231 -0.858 16.359 1.00 0.00 H new ATOM 0 HG22 VAL A 36 0.100 -0.910 15.179 1.00 0.00 H new ATOM 0 HG23 VAL A 36 0.391 -0.293 16.823 1.00 0.00 H new ATOM 529 N SER A 37 0.603 3.280 13.128 1.00 0.00 N ATOM 530 CA SER A 37 0.265 4.475 12.363 1.00 0.00 C ATOM 531 C SER A 37 -0.852 4.181 11.366 1.00 0.00 C ATOM 532 O SER A 37 -0.597 3.933 10.188 1.00 0.00 O ATOM 533 CB SER A 37 1.499 4.998 11.624 1.00 0.00 C ATOM 534 OG SER A 37 2.681 4.744 12.363 1.00 0.00 O ATOM 0 H SER A 37 1.215 2.626 12.641 1.00 0.00 H new ATOM 0 HA SER A 37 -0.083 5.238 13.059 1.00 0.00 H new ATOM 0 HB2 SER A 37 1.569 4.523 10.645 1.00 0.00 H new ATOM 0 HB3 SER A 37 1.397 6.069 11.452 1.00 0.00 H new ATOM 0 HG SER A 37 3.061 3.884 12.087 1.00 0.00 H new ATOM 540 N CYS A 38 -2.091 4.212 11.848 1.00 0.00 N ATOM 541 CA CYS A 38 -3.247 3.948 11.000 1.00 0.00 C ATOM 542 C CYS A 38 -3.541 5.138 10.092 1.00 0.00 C ATOM 543 O CYS A 38 -3.470 6.291 10.520 1.00 0.00 O ATOM 544 CB CYS A 38 -4.473 3.631 11.858 1.00 0.00 C ATOM 545 SG CYS A 38 -4.709 1.855 12.190 1.00 0.00 S ATOM 0 H CYS A 38 -2.319 4.417 12.821 1.00 0.00 H new ATOM 0 HA CYS A 38 -3.017 3.086 10.374 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -4.385 4.159 12.808 1.00 0.00 H new ATOM 0 HB3 CYS A 38 -5.362 4.018 11.360 1.00 0.00 H new ATOM 550 N GLN A 39 -3.871 4.850 8.838 1.00 0.00 N ATOM 551 CA GLN A 39 -4.177 5.895 7.868 1.00 0.00 C ATOM 552 C GLN A 39 -4.997 5.339 6.708 1.00 0.00 C ATOM 553 O GLN A 39 -4.659 4.303 6.137 1.00 0.00 O ATOM 554 CB GLN A 39 -2.886 6.525 7.340 1.00 0.00 C ATOM 555 CG GLN A 39 -2.498 7.807 8.057 1.00 0.00 C ATOM 556 CD GLN A 39 -1.006 8.075 8.005 1.00 0.00 C ATOM 557 OE1 GLN A 39 -0.477 8.507 6.981 1.00 0.00 O ATOM 558 NE2 GLN A 39 -0.319 7.821 9.112 1.00 0.00 N ATOM 0 H GLN A 39 -3.933 3.901 8.469 1.00 0.00 H new ATOM 0 HA GLN A 39 -4.767 6.661 8.372 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -2.074 5.804 7.437 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -3.002 6.734 6.277 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -3.030 8.646 7.608 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -2.817 7.748 9.098 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -0.798 7.464 9.939 1.00 0.00 H new ATOM 0 HE22 GLN A 39 0.688 7.983 9.136 1.00 0.00 H new ATOM 567 N GLU A 40 -6.076 6.035 6.365 1.00 0.00 N ATOM 568 CA GLU A 40 -6.944 5.611 5.274 1.00 0.00 C ATOM 569 C GLU A 40 -6.170 5.537 3.960 1.00 0.00 C ATOM 570 O GLU A 40 -4.946 5.657 3.943 1.00 0.00 O ATOM 571 CB GLU A 40 -8.124 6.573 5.131 1.00 0.00 C ATOM 572 CG GLU A 40 -8.572 7.188 6.446 1.00 0.00 C ATOM 573 CD GLU A 40 -7.926 8.535 6.710 1.00 0.00 C ATOM 574 OE1 GLU A 40 -8.174 9.476 5.928 1.00 0.00 O ATOM 575 OE2 GLU A 40 -7.171 8.647 7.700 1.00 0.00 O ATOM 0 H GLU A 40 -6.370 6.895 6.827 1.00 0.00 H new ATOM 0 HA GLU A 40 -7.322 4.616 5.509 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -7.849 7.371 4.441 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -8.964 6.041 4.684 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -9.656 7.304 6.438 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -8.331 6.507 7.262 1.00 0.00 H new ATOM 582 N THR A 41 -6.894 5.338 2.864 1.00 0.00 N ATOM 583 CA THR A 41 -6.276 5.249 1.547 1.00 0.00 C ATOM 584 C THR A 41 -6.708 6.409 0.656 1.00 0.00 C ATOM 585 O THR A 41 -6.548 6.362 -0.563 1.00 0.00 O ATOM 586 CB THR A 41 -6.631 3.922 0.849 1.00 0.00 C ATOM 587 OG1 THR A 41 -7.133 2.984 1.806 1.00 0.00 O ATOM 588 CG2 THR A 41 -5.413 3.337 0.150 1.00 0.00 C ATOM 0 H THR A 41 -7.909 5.235 2.862 1.00 0.00 H new ATOM 0 HA THR A 41 -5.198 5.295 1.701 1.00 0.00 H new ATOM 0 HB THR A 41 -7.398 4.124 0.102 1.00 0.00 H new ATOM 0 HG1 THR A 41 -7.358 2.144 1.354 1.00 0.00 H new ATOM 0 HG21 THR A 41 -5.687 2.401 -0.336 1.00 0.00 H new ATOM 0 HG22 THR A 41 -5.050 4.041 -0.598 1.00 0.00 H new ATOM 0 HG23 THR A 41 -4.628 3.149 0.883 1.00 0.00 H new ATOM 596 N ALA A 42 -7.257 7.450 1.274 1.00 0.00 N ATOM 597 CA ALA A 42 -7.712 8.623 0.538 1.00 0.00 C ATOM 598 C ALA A 42 -7.026 9.888 1.042 1.00 0.00 C ATOM 599 O ALA A 42 -6.154 9.828 1.909 1.00 0.00 O ATOM 600 CB ALA A 42 -9.223 8.761 0.648 1.00 0.00 C ATOM 0 H ALA A 42 -7.397 7.505 2.283 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.445 8.489 -0.510 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -9.549 9.641 0.094 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -9.701 7.873 0.233 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -9.503 8.868 1.696 1.00 0.00 H new ATOM 606 N VAL A 43 -7.427 11.030 0.493 1.00 0.00 N ATOM 607 CA VAL A 43 -6.854 12.313 0.885 1.00 0.00 C ATOM 608 C VAL A 43 -5.374 12.174 1.224 1.00 0.00 C ATOM 609 O VAL A 43 -4.991 12.189 2.394 1.00 0.00 O ATOM 610 CB VAL A 43 -7.599 12.912 2.095 1.00 0.00 C ATOM 611 CG1 VAL A 43 -7.864 11.838 3.139 1.00 0.00 C ATOM 612 CG2 VAL A 43 -6.815 14.069 2.693 1.00 0.00 C ATOM 0 H VAL A 43 -8.148 11.093 -0.226 1.00 0.00 H new ATOM 0 HA VAL A 43 -6.963 12.985 0.033 1.00 0.00 H new ATOM 0 HB VAL A 43 -8.558 13.300 1.752 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -8.390 12.277 3.987 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -8.475 11.048 2.702 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -6.917 11.418 3.478 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.360 14.476 3.545 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.838 13.715 3.022 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.684 14.847 1.941 1.00 0.00 H new ATOM 622 N THR A 44 -4.545 12.040 0.194 1.00 0.00 N ATOM 623 CA THR A 44 -3.107 11.899 0.383 1.00 0.00 C ATOM 624 C THR A 44 -2.586 12.900 1.408 1.00 0.00 C ATOM 625 O THR A 44 -3.077 14.025 1.496 1.00 0.00 O ATOM 626 CB THR A 44 -2.344 12.093 -0.941 1.00 0.00 C ATOM 627 OG1 THR A 44 -3.243 11.965 -2.049 1.00 0.00 O ATOM 628 CG2 THR A 44 -1.222 11.074 -1.073 1.00 0.00 C ATOM 0 H THR A 44 -4.845 12.026 -0.781 1.00 0.00 H new ATOM 0 HA THR A 44 -2.935 10.886 0.748 1.00 0.00 H new ATOM 0 HB THR A 44 -1.909 13.092 -0.940 1.00 0.00 H new ATOM 0 HG1 THR A 44 -2.750 12.091 -2.887 1.00 0.00 H new ATOM 0 HG21 THR A 44 -0.697 11.230 -2.016 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.523 11.193 -0.245 1.00 0.00 H new ATOM 0 HG23 THR A 44 -1.640 10.068 -1.053 1.00 0.00 H new ATOM 636 N GLN A 45 -1.588 12.484 2.180 1.00 0.00 N ATOM 637 CA GLN A 45 -1.000 13.345 3.200 1.00 0.00 C ATOM 638 C GLN A 45 -0.223 14.492 2.562 1.00 0.00 C ATOM 639 O GLN A 45 0.976 14.646 2.792 1.00 0.00 O ATOM 640 CB GLN A 45 -0.078 12.535 4.112 1.00 0.00 C ATOM 641 CG GLN A 45 0.032 13.097 5.520 1.00 0.00 C ATOM 642 CD GLN A 45 0.223 12.016 6.566 1.00 0.00 C ATOM 643 OE1 GLN A 45 1.050 11.118 6.404 1.00 0.00 O ATOM 644 NE2 GLN A 45 -0.545 12.097 7.647 1.00 0.00 N ATOM 0 H GLN A 45 -1.169 11.556 2.119 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.810 13.765 3.795 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -0.444 11.510 4.167 1.00 0.00 H new ATOM 0 HB3 GLN A 45 0.916 12.495 3.667 1.00 0.00 H new ATOM 0 HG2 GLN A 45 0.870 13.793 5.565 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -0.868 13.666 5.751 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -1.217 12.859 7.739 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -0.463 11.397 8.385 1.00 0.00 H new ATOM 653 N THR A 46 -0.915 15.296 1.760 1.00 0.00 N ATOM 654 CA THR A 46 -0.290 16.428 1.089 1.00 0.00 C ATOM 655 C THR A 46 0.658 17.168 2.027 1.00 0.00 C ATOM 656 O THR A 46 0.229 17.763 3.017 1.00 0.00 O ATOM 657 CB THR A 46 -1.344 17.419 0.558 1.00 0.00 C ATOM 658 OG1 THR A 46 -2.405 17.562 1.509 1.00 0.00 O ATOM 659 CG2 THR A 46 -1.909 16.944 -0.772 1.00 0.00 C ATOM 0 H THR A 46 -1.909 15.183 1.560 1.00 0.00 H new ATOM 0 HA THR A 46 0.275 16.024 0.249 1.00 0.00 H new ATOM 0 HB THR A 46 -0.861 18.384 0.406 1.00 0.00 H new ATOM 0 HG1 THR A 46 -2.421 18.482 1.846 1.00 0.00 H new ATOM 0 HG21 THR A 46 -2.651 17.659 -1.128 1.00 0.00 H new ATOM 0 HG22 THR A 46 -1.103 16.863 -1.502 1.00 0.00 H new ATOM 0 HG23 THR A 46 -2.378 15.969 -0.641 1.00 0.00 H new ATOM 667 N TYR A 47 1.947 17.128 1.710 1.00 0.00 N ATOM 668 CA TYR A 47 2.956 17.795 2.524 1.00 0.00 C ATOM 669 C TYR A 47 3.819 18.719 1.672 1.00 0.00 C ATOM 670 O TYR A 47 3.923 18.543 0.458 1.00 0.00 O ATOM 671 CB TYR A 47 3.836 16.763 3.231 1.00 0.00 C ATOM 672 CG TYR A 47 4.448 15.743 2.296 1.00 0.00 C ATOM 673 CD1 TYR A 47 5.566 16.055 1.533 1.00 0.00 C ATOM 674 CD2 TYR A 47 3.905 14.470 2.176 1.00 0.00 C ATOM 675 CE1 TYR A 47 6.127 15.126 0.677 1.00 0.00 C ATOM 676 CE2 TYR A 47 4.461 13.535 1.324 1.00 0.00 C ATOM 677 CZ TYR A 47 5.572 13.868 0.577 1.00 0.00 C ATOM 678 OH TYR A 47 6.128 12.940 -0.274 1.00 0.00 O ATOM 0 H TYR A 47 2.318 16.640 0.895 1.00 0.00 H new ATOM 0 HA TYR A 47 2.442 18.397 3.273 1.00 0.00 H new ATOM 0 HB2 TYR A 47 4.635 17.282 3.761 1.00 0.00 H new ATOM 0 HB3 TYR A 47 3.240 16.243 3.981 1.00 0.00 H new ATOM 0 HD1 TYR A 47 6.004 17.039 1.610 1.00 0.00 H new ATOM 0 HD2 TYR A 47 3.034 14.207 2.758 1.00 0.00 H new ATOM 0 HE1 TYR A 47 6.996 15.384 0.090 1.00 0.00 H new ATOM 0 HE2 TYR A 47 4.028 12.549 1.243 1.00 0.00 H new ATOM 0 HH TYR A 47 5.468 12.244 -0.475 1.00 0.00 H new ATOM 688 N GLY A 48 4.436 19.705 2.314 1.00 0.00 N ATOM 689 CA GLY A 48 5.282 20.643 1.600 1.00 0.00 C ATOM 690 C GLY A 48 4.608 21.202 0.362 1.00 0.00 C ATOM 691 O GLY A 48 3.381 21.228 0.272 1.00 0.00 O ATOM 0 H GLY A 48 4.365 19.871 3.318 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.552 21.463 2.265 1.00 0.00 H new ATOM 0 HA3 GLY A 48 6.209 20.147 1.313 1.00 0.00 H new ATOM 695 N GLY A 49 5.414 21.650 -0.596 1.00 0.00 N ATOM 696 CA GLY A 49 4.870 22.204 -1.822 1.00 0.00 C ATOM 697 C GLY A 49 4.430 23.646 -1.661 1.00 0.00 C ATOM 698 O GLY A 49 4.796 24.310 -0.691 1.00 0.00 O ATOM 0 H GLY A 49 6.433 21.639 -0.545 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.621 22.142 -2.610 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.020 21.602 -2.144 1.00 0.00 H new ATOM 702 N ASN A 50 3.642 24.132 -2.615 1.00 0.00 N ATOM 703 CA ASN A 50 3.150 25.504 -2.576 1.00 0.00 C ATOM 704 C ASN A 50 1.883 25.603 -1.734 1.00 0.00 C ATOM 705 O ASN A 50 1.184 26.616 -1.764 1.00 0.00 O ATOM 706 CB ASN A 50 2.877 26.011 -3.993 1.00 0.00 C ATOM 707 CG ASN A 50 4.079 25.855 -4.905 1.00 0.00 C ATOM 708 OD1 ASN A 50 5.216 25.765 -4.442 1.00 0.00 O ATOM 709 ND2 ASN A 50 3.832 25.824 -6.209 1.00 0.00 N ATOM 0 H ASN A 50 3.331 23.595 -3.425 1.00 0.00 H new ATOM 0 HA ASN A 50 3.918 26.127 -2.118 1.00 0.00 H new ATOM 0 HB2 ASN A 50 2.032 25.467 -4.414 1.00 0.00 H new ATOM 0 HB3 ASN A 50 2.590 27.062 -3.951 1.00 0.00 H new ATOM 0 HD21 ASN A 50 4.601 25.722 -6.871 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.873 25.902 -6.548 1.00 0.00 H new ATOM 716 N SER A 51 1.591 24.545 -0.985 1.00 0.00 N ATOM 717 CA SER A 51 0.407 24.513 -0.136 1.00 0.00 C ATOM 718 C SER A 51 0.794 24.332 1.329 1.00 0.00 C ATOM 719 O SER A 51 -0.029 24.513 2.226 1.00 0.00 O ATOM 720 CB SER A 51 -0.528 23.384 -0.570 1.00 0.00 C ATOM 721 OG SER A 51 -1.887 23.753 -0.404 1.00 0.00 O ATOM 0 H SER A 51 2.159 23.698 -0.949 1.00 0.00 H new ATOM 0 HA SER A 51 -0.112 25.466 -0.243 1.00 0.00 H new ATOM 0 HB2 SER A 51 -0.341 23.134 -1.614 1.00 0.00 H new ATOM 0 HB3 SER A 51 -0.317 22.488 0.015 1.00 0.00 H new ATOM 0 HG SER A 51 -2.162 24.331 -1.146 1.00 0.00 H new ATOM 727 N ASN A 52 2.053 23.975 1.563 1.00 0.00 N ATOM 728 CA ASN A 52 2.550 23.771 2.919 1.00 0.00 C ATOM 729 C ASN A 52 1.881 22.564 3.569 1.00 0.00 C ATOM 730 O ASN A 52 2.031 22.329 4.768 1.00 0.00 O ATOM 731 CB ASN A 52 2.307 25.022 3.766 1.00 0.00 C ATOM 732 CG ASN A 52 2.603 24.793 5.235 1.00 0.00 C ATOM 733 OD1 ASN A 52 3.464 23.988 5.590 1.00 0.00 O ATOM 734 ND2 ASN A 52 1.886 25.502 6.100 1.00 0.00 N ATOM 0 H ASN A 52 2.747 23.821 0.832 1.00 0.00 H new ATOM 0 HA ASN A 52 3.622 23.581 2.862 1.00 0.00 H new ATOM 0 HB2 ASN A 52 2.931 25.835 3.395 1.00 0.00 H new ATOM 0 HB3 ASN A 52 1.270 25.338 3.652 1.00 0.00 H new ATOM 0 HD21 ASN A 52 2.039 25.390 7.102 1.00 0.00 H new ATOM 0 HD22 ASN A 52 1.182 26.158 5.762 1.00 0.00 H new ATOM 741 N GLY A 53 1.143 21.799 2.771 1.00 0.00 N ATOM 742 CA GLY A 53 0.464 20.625 3.287 1.00 0.00 C ATOM 743 C GLY A 53 -1.012 20.611 2.944 1.00 0.00 C ATOM 744 O GLY A 53 -1.622 19.546 2.843 1.00 0.00 O ATOM 0 H GLY A 53 1.003 21.971 1.775 1.00 0.00 H new ATOM 0 HA2 GLY A 53 0.936 19.729 2.883 1.00 0.00 H new ATOM 0 HA3 GLY A 53 0.583 20.587 4.370 1.00 0.00 H new ATOM 748 N GLU A 54 -1.588 21.794 2.764 1.00 0.00 N ATOM 749 CA GLU A 54 -3.003 21.914 2.431 1.00 0.00 C ATOM 750 C GLU A 54 -3.412 20.859 1.409 1.00 0.00 C ATOM 751 O GLU A 54 -2.564 20.199 0.807 1.00 0.00 O ATOM 752 CB GLU A 54 -3.304 23.311 1.887 1.00 0.00 C ATOM 753 CG GLU A 54 -4.064 24.194 2.863 1.00 0.00 C ATOM 754 CD GLU A 54 -3.270 25.412 3.290 1.00 0.00 C ATOM 755 OE1 GLU A 54 -2.266 25.243 4.014 1.00 0.00 O ATOM 756 OE2 GLU A 54 -3.650 26.535 2.897 1.00 0.00 O ATOM 0 H GLU A 54 -1.097 22.684 2.843 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.580 21.755 3.342 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.366 23.799 1.624 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -3.883 23.217 0.968 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -4.998 24.517 2.403 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -4.328 23.610 3.745 1.00 0.00 H new ATOM 763 N PRO A 55 -4.725 20.688 1.201 1.00 0.00 N ATOM 764 CA PRO A 55 -5.256 19.709 0.247 1.00 0.00 C ATOM 765 C PRO A 55 -4.987 20.106 -1.200 1.00 0.00 C ATOM 766 O PRO A 55 -4.342 21.120 -1.466 1.00 0.00 O ATOM 767 CB PRO A 55 -6.759 19.716 0.533 1.00 0.00 C ATOM 768 CG PRO A 55 -7.029 21.063 1.109 1.00 0.00 C ATOM 769 CD PRO A 55 -5.795 21.438 1.881 1.00 0.00 C ATOM 0 HA PRO A 55 -4.790 18.730 0.364 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.336 19.552 -0.377 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.033 18.925 1.231 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -7.233 21.790 0.323 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -7.904 21.041 1.758 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.614 22.512 1.851 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.877 21.157 2.931 1.00 0.00 H new ATOM 777 N CYS A 56 -5.487 19.301 -2.132 1.00 0.00 N ATOM 778 CA CYS A 56 -5.299 19.569 -3.554 1.00 0.00 C ATOM 779 C CYS A 56 -6.583 20.101 -4.180 1.00 0.00 C ATOM 780 O CYS A 56 -7.528 20.456 -3.477 1.00 0.00 O ATOM 781 CB CYS A 56 -4.851 18.299 -4.280 1.00 0.00 C ATOM 782 SG CYS A 56 -3.828 17.184 -3.266 1.00 0.00 S ATOM 0 H CYS A 56 -6.025 18.459 -1.929 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.524 20.329 -3.656 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -5.734 17.757 -4.619 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -4.289 18.581 -5.170 1.00 0.00 H new ATOM 787 N VAL A 57 -6.607 20.156 -5.508 1.00 0.00 N ATOM 788 CA VAL A 57 -7.772 20.649 -6.231 1.00 0.00 C ATOM 789 C VAL A 57 -7.833 20.064 -7.637 1.00 0.00 C ATOM 790 O VAL A 57 -7.578 20.760 -8.621 1.00 0.00 O ATOM 791 CB VAL A 57 -7.763 22.186 -6.324 1.00 0.00 C ATOM 792 CG1 VAL A 57 -9.180 22.721 -6.464 1.00 0.00 C ATOM 793 CG2 VAL A 57 -7.073 22.789 -5.110 1.00 0.00 C ATOM 0 H VAL A 57 -5.832 19.865 -6.104 1.00 0.00 H new ATOM 0 HA VAL A 57 -8.652 20.332 -5.671 1.00 0.00 H new ATOM 0 HB VAL A 57 -7.202 22.476 -7.213 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.154 23.809 -6.528 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -9.635 22.315 -7.368 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -9.769 22.423 -5.596 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.076 23.876 -5.192 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -7.604 22.492 -4.205 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.044 22.431 -5.061 1.00 0.00 H new ATOM 803 N LEU A 58 -8.173 18.783 -7.726 1.00 0.00 N ATOM 804 CA LEU A 58 -8.268 18.105 -9.015 1.00 0.00 C ATOM 805 C LEU A 58 -9.695 17.631 -9.274 1.00 0.00 C ATOM 806 O LEU A 58 -10.591 17.861 -8.461 1.00 0.00 O ATOM 807 CB LEU A 58 -7.304 16.917 -9.057 1.00 0.00 C ATOM 808 CG LEU A 58 -6.403 16.771 -7.830 1.00 0.00 C ATOM 809 CD1 LEU A 58 -7.198 16.244 -6.644 1.00 0.00 C ATOM 810 CD2 LEU A 58 -5.229 15.854 -8.137 1.00 0.00 C ATOM 0 H LEU A 58 -8.387 18.193 -6.922 1.00 0.00 H new ATOM 0 HA LEU A 58 -7.994 18.814 -9.796 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.884 16.002 -9.174 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.675 17.010 -9.942 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.012 17.755 -7.571 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -6.541 16.146 -5.780 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -8.005 16.938 -6.410 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -7.618 15.269 -6.892 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.598 15.762 -7.253 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -5.601 14.870 -8.422 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -4.645 16.272 -8.957 1.00 0.00 H new ATOM 822 N PRO A 59 -9.931 16.961 -10.416 1.00 0.00 N ATOM 823 CA PRO A 59 -8.888 16.670 -11.409 1.00 0.00 C ATOM 824 C PRO A 59 -8.195 17.930 -11.914 1.00 0.00 C ATOM 825 O PRO A 59 -8.846 18.937 -12.196 1.00 0.00 O ATOM 826 CB PRO A 59 -9.653 15.994 -12.551 1.00 0.00 C ATOM 827 CG PRO A 59 -10.894 15.464 -11.918 1.00 0.00 C ATOM 828 CD PRO A 59 -11.243 16.435 -10.827 1.00 0.00 C ATOM 0 HA PRO A 59 -8.093 16.055 -10.987 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -9.886 16.703 -13.345 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -9.066 15.194 -13.001 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -11.702 15.386 -12.646 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -10.731 14.465 -11.515 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -11.900 17.227 -11.187 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -11.758 15.945 -10.001 1.00 0.00 H new ATOM 836 N PHE A 60 -6.872 17.869 -12.025 1.00 0.00 N ATOM 837 CA PHE A 60 -6.091 19.007 -12.495 1.00 0.00 C ATOM 838 C PHE A 60 -5.200 18.609 -13.667 1.00 0.00 C ATOM 839 O PHE A 60 -4.353 17.724 -13.544 1.00 0.00 O ATOM 840 CB PHE A 60 -5.237 19.570 -11.358 1.00 0.00 C ATOM 841 CG PHE A 60 -3.946 18.829 -11.153 1.00 0.00 C ATOM 842 CD1 PHE A 60 -3.907 17.680 -10.379 1.00 0.00 C ATOM 843 CD2 PHE A 60 -2.772 19.281 -11.735 1.00 0.00 C ATOM 844 CE1 PHE A 60 -2.721 16.997 -10.189 1.00 0.00 C ATOM 845 CE2 PHE A 60 -1.584 18.602 -11.548 1.00 0.00 C ATOM 846 CZ PHE A 60 -1.558 17.457 -10.774 1.00 0.00 C ATOM 0 H PHE A 60 -6.318 17.043 -11.796 1.00 0.00 H new ATOM 0 HA PHE A 60 -6.784 19.776 -12.835 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -5.016 20.617 -11.564 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -5.813 19.542 -10.433 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -4.813 17.315 -9.919 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -2.786 20.174 -12.342 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -2.704 16.103 -9.583 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.676 18.965 -12.006 1.00 0.00 H new ATOM 0 HZ PHE A 60 -0.630 16.924 -10.627 1.00 0.00 H new ATOM 856 N THR A 61 -5.397 19.269 -14.803 1.00 0.00 N ATOM 857 CA THR A 61 -4.614 18.988 -15.997 1.00 0.00 C ATOM 858 C THR A 61 -3.210 19.573 -15.882 1.00 0.00 C ATOM 859 O THR A 61 -3.007 20.599 -15.234 1.00 0.00 O ATOM 860 CB THR A 61 -5.294 19.559 -17.254 1.00 0.00 C ATOM 861 OG1 THR A 61 -5.854 20.845 -16.966 1.00 0.00 O ATOM 862 CG2 THR A 61 -6.387 18.625 -17.751 1.00 0.00 C ATOM 0 H THR A 61 -6.095 20.004 -14.920 1.00 0.00 H new ATOM 0 HA THR A 61 -4.546 17.904 -16.088 1.00 0.00 H new ATOM 0 HB THR A 61 -4.540 19.657 -18.035 1.00 0.00 H new ATOM 0 HG1 THR A 61 -6.283 21.203 -17.771 1.00 0.00 H new ATOM 0 HG21 THR A 61 -6.853 19.050 -18.640 1.00 0.00 H new ATOM 0 HG22 THR A 61 -5.953 17.656 -17.997 1.00 0.00 H new ATOM 0 HG23 THR A 61 -7.139 18.499 -16.973 1.00 0.00 H new ATOM 870 N TYR A 62 -2.246 18.916 -16.517 1.00 0.00 N ATOM 871 CA TYR A 62 -0.861 19.375 -16.486 1.00 0.00 C ATOM 872 C TYR A 62 -0.087 18.851 -17.694 1.00 0.00 C ATOM 873 O TYR A 62 -0.139 17.665 -18.008 1.00 0.00 O ATOM 874 CB TYR A 62 -0.186 18.940 -15.177 1.00 0.00 C ATOM 875 CG TYR A 62 1.302 18.690 -15.299 1.00 0.00 C ATOM 876 CD1 TYR A 62 1.789 17.602 -16.012 1.00 0.00 C ATOM 877 CD2 TYR A 62 2.220 19.544 -14.701 1.00 0.00 C ATOM 878 CE1 TYR A 62 3.146 17.373 -16.127 1.00 0.00 C ATOM 879 CE2 TYR A 62 3.578 19.324 -14.812 1.00 0.00 C ATOM 880 CZ TYR A 62 4.037 18.236 -15.526 1.00 0.00 C ATOM 881 OH TYR A 62 5.390 18.012 -15.637 1.00 0.00 O ATOM 0 H TYR A 62 -2.397 18.065 -17.059 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.858 20.464 -16.533 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.353 19.709 -14.422 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -0.668 18.030 -14.818 1.00 0.00 H new ATOM 0 HD1 TYR A 62 1.094 16.923 -16.485 1.00 0.00 H new ATOM 0 HD2 TYR A 62 1.865 20.395 -14.139 1.00 0.00 H new ATOM 0 HE1 TYR A 62 3.507 16.522 -16.685 1.00 0.00 H new ATOM 0 HE2 TYR A 62 4.278 20.000 -14.343 1.00 0.00 H new ATOM 0 HH TYR A 62 5.878 18.819 -15.372 1.00 0.00 H new ATOM 891 N ASN A 63 0.625 19.752 -18.365 1.00 0.00 N ATOM 892 CA ASN A 63 1.423 19.407 -19.542 1.00 0.00 C ATOM 893 C ASN A 63 0.556 19.078 -20.760 1.00 0.00 C ATOM 894 O ASN A 63 1.076 18.890 -21.860 1.00 0.00 O ATOM 895 CB ASN A 63 2.372 18.242 -19.231 1.00 0.00 C ATOM 896 CG ASN A 63 1.758 16.880 -19.495 1.00 0.00 C ATOM 897 OD1 ASN A 63 1.492 16.116 -18.566 1.00 0.00 O ATOM 898 ND2 ASN A 63 1.541 16.565 -20.763 1.00 0.00 N ATOM 0 H ASN A 63 0.666 20.739 -18.111 1.00 0.00 H new ATOM 0 HA ASN A 63 2.012 20.289 -19.794 1.00 0.00 H new ATOM 0 HB2 ASN A 63 3.275 18.348 -19.832 1.00 0.00 H new ATOM 0 HB3 ASN A 63 2.676 18.299 -18.186 1.00 0.00 H new ATOM 0 HD21 ASN A 63 1.138 15.659 -21.002 1.00 0.00 H new ATOM 0 HD22 ASN A 63 1.777 17.229 -21.501 1.00 0.00 H new ATOM 905 N GLY A 64 -0.760 19.017 -20.573 1.00 0.00 N ATOM 906 CA GLY A 64 -1.645 18.720 -21.686 1.00 0.00 C ATOM 907 C GLY A 64 -2.601 17.588 -21.378 1.00 0.00 C ATOM 908 O GLY A 64 -3.518 17.311 -22.152 1.00 0.00 O ATOM 0 H GLY A 64 -1.226 19.167 -19.678 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -2.215 19.613 -21.942 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -1.049 18.461 -22.561 1.00 0.00 H new ATOM 912 N ARG A 65 -2.385 16.931 -20.246 1.00 0.00 N ATOM 913 CA ARG A 65 -3.234 15.821 -19.837 1.00 0.00 C ATOM 914 C ARG A 65 -4.119 16.228 -18.658 1.00 0.00 C ATOM 915 O ARG A 65 -3.969 17.316 -18.103 1.00 0.00 O ATOM 916 CB ARG A 65 -2.363 14.604 -19.485 1.00 0.00 C ATOM 917 CG ARG A 65 -2.591 14.044 -18.090 1.00 0.00 C ATOM 918 CD ARG A 65 -1.626 12.912 -17.777 1.00 0.00 C ATOM 919 NE ARG A 65 -2.119 12.054 -16.704 1.00 0.00 N ATOM 920 CZ ARG A 65 -3.226 11.323 -16.796 1.00 0.00 C ATOM 921 NH1 ARG A 65 -3.948 11.347 -17.906 1.00 0.00 N ATOM 922 NH2 ARG A 65 -3.609 10.567 -15.775 1.00 0.00 N ATOM 0 H ARG A 65 -1.630 17.148 -19.596 1.00 0.00 H new ATOM 0 HA ARG A 65 -3.890 15.549 -20.664 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -2.552 13.816 -20.214 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -1.314 14.884 -19.583 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -2.471 14.839 -17.354 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -3.616 13.683 -18.005 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -1.465 12.314 -18.674 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -0.659 13.328 -17.493 1.00 0.00 H new ATOM 0 HE ARG A 65 -1.585 12.013 -15.836 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -3.655 11.927 -18.692 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -4.797 10.786 -17.975 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -3.054 10.546 -14.919 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -4.458 10.006 -15.846 1.00 0.00 H new ATOM 936 N THR A 66 -5.038 15.345 -18.284 1.00 0.00 N ATOM 937 CA THR A 66 -5.944 15.611 -17.173 1.00 0.00 C ATOM 938 C THR A 66 -5.750 14.595 -16.052 1.00 0.00 C ATOM 939 O THR A 66 -6.179 13.447 -16.160 1.00 0.00 O ATOM 940 CB THR A 66 -7.415 15.582 -17.626 1.00 0.00 C ATOM 941 OG1 THR A 66 -7.616 16.509 -18.700 1.00 0.00 O ATOM 942 CG2 THR A 66 -8.344 15.928 -16.472 1.00 0.00 C ATOM 0 H THR A 66 -5.175 14.440 -18.733 1.00 0.00 H new ATOM 0 HA THR A 66 -5.706 16.608 -16.804 1.00 0.00 H new ATOM 0 HB THR A 66 -7.646 14.573 -17.968 1.00 0.00 H new ATOM 0 HG1 THR A 66 -8.554 16.483 -18.983 1.00 0.00 H new ATOM 0 HG21 THR A 66 -9.378 15.901 -16.816 1.00 0.00 H new ATOM 0 HG22 THR A 66 -8.210 15.204 -15.668 1.00 0.00 H new ATOM 0 HG23 THR A 66 -8.110 16.927 -16.104 1.00 0.00 H new ATOM 950 N PHE A 67 -5.101 15.027 -14.975 1.00 0.00 N ATOM 951 CA PHE A 67 -4.850 14.156 -13.833 1.00 0.00 C ATOM 952 C PHE A 67 -5.988 14.242 -12.822 1.00 0.00 C ATOM 953 O PHE A 67 -6.715 15.235 -12.775 1.00 0.00 O ATOM 954 CB PHE A 67 -3.527 14.529 -13.161 1.00 0.00 C ATOM 955 CG PHE A 67 -2.390 14.704 -14.127 1.00 0.00 C ATOM 956 CD1 PHE A 67 -2.289 15.849 -14.900 1.00 0.00 C ATOM 957 CD2 PHE A 67 -1.421 13.722 -14.262 1.00 0.00 C ATOM 958 CE1 PHE A 67 -1.245 16.012 -15.789 1.00 0.00 C ATOM 959 CE2 PHE A 67 -0.374 13.880 -15.150 1.00 0.00 C ATOM 960 CZ PHE A 67 -0.286 15.027 -15.914 1.00 0.00 C ATOM 0 H PHE A 67 -4.740 15.975 -14.870 1.00 0.00 H new ATOM 0 HA PHE A 67 -4.788 13.131 -14.197 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.662 15.454 -12.600 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.264 13.755 -12.440 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -3.036 16.624 -14.806 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.485 12.823 -13.666 1.00 0.00 H new ATOM 0 HE1 PHE A 67 -1.179 16.910 -16.386 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.374 13.107 -15.246 1.00 0.00 H new ATOM 0 HZ PHE A 67 0.532 15.153 -16.608 1.00 0.00 H new ATOM 970 N TYR A 68 -6.137 13.198 -12.015 1.00 0.00 N ATOM 971 CA TYR A 68 -7.188 13.156 -11.004 1.00 0.00 C ATOM 972 C TYR A 68 -6.595 13.209 -9.600 1.00 0.00 C ATOM 973 O TYR A 68 -7.121 13.886 -8.718 1.00 0.00 O ATOM 974 CB TYR A 68 -8.031 11.889 -11.166 1.00 0.00 C ATOM 975 CG TYR A 68 -9.050 11.978 -12.281 1.00 0.00 C ATOM 976 CD1 TYR A 68 -8.659 12.261 -13.584 1.00 0.00 C ATOM 977 CD2 TYR A 68 -10.401 11.779 -12.030 1.00 0.00 C ATOM 978 CE1 TYR A 68 -9.586 12.343 -14.605 1.00 0.00 C ATOM 979 CE2 TYR A 68 -11.335 11.859 -13.046 1.00 0.00 C ATOM 980 CZ TYR A 68 -10.922 12.141 -14.331 1.00 0.00 C ATOM 981 OH TYR A 68 -11.849 12.221 -15.345 1.00 0.00 O ATOM 0 H TYR A 68 -5.543 12.369 -12.041 1.00 0.00 H new ATOM 0 HA TYR A 68 -7.826 14.029 -11.143 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -7.369 11.044 -11.357 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -8.548 11.684 -10.228 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -7.613 12.419 -13.802 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -10.728 11.558 -11.025 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -9.266 12.564 -15.612 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -12.382 11.702 -12.834 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.744 12.052 -14.984 1.00 0.00 H new ATOM 991 N SER A 69 -5.494 12.490 -9.400 1.00 0.00 N ATOM 992 CA SER A 69 -4.829 12.455 -8.104 1.00 0.00 C ATOM 993 C SER A 69 -3.344 12.770 -8.245 1.00 0.00 C ATOM 994 O SER A 69 -2.831 12.902 -9.357 1.00 0.00 O ATOM 995 CB SER A 69 -5.012 11.084 -7.450 1.00 0.00 C ATOM 996 OG SER A 69 -6.362 10.661 -7.520 1.00 0.00 O ATOM 0 H SER A 69 -5.045 11.924 -10.120 1.00 0.00 H new ATOM 0 HA SER A 69 -5.284 13.216 -7.470 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.373 10.353 -7.945 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.696 11.130 -6.408 1.00 0.00 H new ATOM 0 HG SER A 69 -6.452 9.782 -7.097 1.00 0.00 H new ATOM 1002 N CYS A 70 -2.658 12.888 -7.113 1.00 0.00 N ATOM 1003 CA CYS A 70 -1.231 13.187 -7.111 1.00 0.00 C ATOM 1004 C CYS A 70 -0.529 12.496 -8.277 1.00 0.00 C ATOM 1005 O CYS A 70 -0.971 11.448 -8.747 1.00 0.00 O ATOM 1006 CB CYS A 70 -0.598 12.751 -5.788 1.00 0.00 C ATOM 1007 SG CYS A 70 0.778 13.809 -5.237 1.00 0.00 S ATOM 0 H CYS A 70 -3.068 12.781 -6.185 1.00 0.00 H new ATOM 0 HA CYS A 70 -1.111 14.264 -7.225 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -1.367 12.742 -5.015 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -0.237 11.728 -5.890 1.00 0.00 H new ATOM 1012 N THR A 71 0.568 13.090 -8.736 1.00 0.00 N ATOM 1013 CA THR A 71 1.331 12.531 -9.845 1.00 0.00 C ATOM 1014 C THR A 71 2.797 12.946 -9.767 1.00 0.00 C ATOM 1015 O THR A 71 3.118 14.045 -9.315 1.00 0.00 O ATOM 1016 CB THR A 71 0.756 12.977 -11.203 1.00 0.00 C ATOM 1017 OG1 THR A 71 1.455 12.323 -12.269 1.00 0.00 O ATOM 1018 CG2 THR A 71 0.864 14.485 -11.369 1.00 0.00 C ATOM 0 H THR A 71 0.948 13.958 -8.357 1.00 0.00 H new ATOM 0 HA THR A 71 1.257 11.446 -9.765 1.00 0.00 H new ATOM 0 HB THR A 71 -0.298 12.699 -11.235 1.00 0.00 H new ATOM 0 HG1 THR A 71 1.083 12.610 -13.129 1.00 0.00 H new ATOM 0 HG21 THR A 71 0.452 14.775 -12.335 1.00 0.00 H new ATOM 0 HG22 THR A 71 0.307 14.979 -10.573 1.00 0.00 H new ATOM 0 HG23 THR A 71 1.911 14.783 -11.317 1.00 0.00 H new ATOM 1026 N THR A 72 3.681 12.059 -10.212 1.00 0.00 N ATOM 1027 CA THR A 72 5.112 12.334 -10.193 1.00 0.00 C ATOM 1028 C THR A 72 5.551 13.054 -11.462 1.00 0.00 C ATOM 1029 O THR A 72 6.600 13.697 -11.493 1.00 0.00 O ATOM 1030 CB THR A 72 5.931 11.038 -10.043 1.00 0.00 C ATOM 1031 OG1 THR A 72 5.277 9.963 -10.728 1.00 0.00 O ATOM 1032 CG2 THR A 72 6.109 10.677 -8.576 1.00 0.00 C ATOM 0 H THR A 72 3.431 11.145 -10.590 1.00 0.00 H new ATOM 0 HA THR A 72 5.299 12.975 -9.332 1.00 0.00 H new ATOM 0 HB THR A 72 6.915 11.203 -10.482 1.00 0.00 H new ATOM 0 HG1 THR A 72 4.922 10.287 -11.582 1.00 0.00 H new ATOM 0 HG21 THR A 72 6.690 9.758 -8.495 1.00 0.00 H new ATOM 0 HG22 THR A 72 6.633 11.484 -8.064 1.00 0.00 H new ATOM 0 HG23 THR A 72 5.132 10.529 -8.116 1.00 0.00 H new ATOM 1040 N GLU A 73 4.741 12.942 -12.510 1.00 0.00 N ATOM 1041 CA GLU A 73 5.046 13.583 -13.784 1.00 0.00 C ATOM 1042 C GLU A 73 5.712 14.937 -13.566 1.00 0.00 C ATOM 1043 O GLU A 73 5.260 15.738 -12.749 1.00 0.00 O ATOM 1044 CB GLU A 73 3.769 13.756 -14.609 1.00 0.00 C ATOM 1045 CG GLU A 73 3.711 12.860 -15.836 1.00 0.00 C ATOM 1046 CD GLU A 73 2.432 13.040 -16.630 1.00 0.00 C ATOM 1047 OE1 GLU A 73 2.261 14.113 -17.244 1.00 0.00 O ATOM 1048 OE2 GLU A 73 1.602 12.107 -16.637 1.00 0.00 O ATOM 0 H GLU A 73 3.869 12.413 -12.502 1.00 0.00 H new ATOM 0 HA GLU A 73 5.739 12.942 -14.329 1.00 0.00 H new ATOM 0 HB2 GLU A 73 2.906 13.547 -13.976 1.00 0.00 H new ATOM 0 HB3 GLU A 73 3.689 14.796 -14.925 1.00 0.00 H new ATOM 0 HG2 GLU A 73 4.566 13.074 -16.478 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.798 11.819 -15.525 1.00 0.00 H new ATOM 1055 N GLY A 74 6.789 15.186 -14.304 1.00 0.00 N ATOM 1056 CA GLY A 74 7.501 16.445 -14.177 1.00 0.00 C ATOM 1057 C GLY A 74 8.487 16.439 -13.026 1.00 0.00 C ATOM 1058 O GLY A 74 9.625 16.885 -13.173 1.00 0.00 O ATOM 0 H GLY A 74 7.182 14.539 -14.988 1.00 0.00 H new ATOM 0 HA2 GLY A 74 8.032 16.654 -15.106 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.783 17.252 -14.032 1.00 0.00 H new ATOM 1062 N ARG A 75 8.050 15.935 -11.877 1.00 0.00 N ATOM 1063 CA ARG A 75 8.902 15.874 -10.695 1.00 0.00 C ATOM 1064 C ARG A 75 9.877 14.703 -10.788 1.00 0.00 C ATOM 1065 O ARG A 75 9.538 13.639 -11.304 1.00 0.00 O ATOM 1066 CB ARG A 75 8.050 15.743 -9.431 1.00 0.00 C ATOM 1067 CG ARG A 75 7.401 17.048 -8.999 1.00 0.00 C ATOM 1068 CD ARG A 75 6.985 17.006 -7.537 1.00 0.00 C ATOM 1069 NE ARG A 75 8.127 17.146 -6.639 1.00 0.00 N ATOM 1070 CZ ARG A 75 8.824 18.269 -6.505 1.00 0.00 C ATOM 1071 NH1 ARG A 75 8.495 19.344 -7.208 1.00 0.00 N ATOM 1072 NH2 ARG A 75 9.850 18.319 -5.667 1.00 0.00 N ATOM 0 H ARG A 75 7.110 15.563 -11.739 1.00 0.00 H new ATOM 0 HA ARG A 75 9.475 16.800 -10.643 1.00 0.00 H new ATOM 0 HB2 ARG A 75 7.272 14.999 -9.602 1.00 0.00 H new ATOM 0 HB3 ARG A 75 8.674 15.371 -8.619 1.00 0.00 H new ATOM 0 HG2 ARG A 75 8.097 17.872 -9.157 1.00 0.00 H new ATOM 0 HG3 ARG A 75 6.528 17.245 -9.621 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.269 17.805 -7.341 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.476 16.064 -7.332 1.00 0.00 H new ATOM 0 HE ARG A 75 8.405 16.337 -6.084 1.00 0.00 H new ATOM 0 HH11 ARG A 75 7.706 19.310 -7.853 1.00 0.00 H new ATOM 0 HH12 ARG A 75 9.031 20.205 -7.104 1.00 0.00 H new ATOM 0 HH21 ARG A 75 10.105 17.494 -5.124 1.00 0.00 H new ATOM 0 HH22 ARG A 75 10.384 19.182 -5.565 1.00 0.00 H new ATOM 1086 N GLN A 76 11.089 14.909 -10.284 1.00 0.00 N ATOM 1087 CA GLN A 76 12.114 13.871 -10.309 1.00 0.00 C ATOM 1088 C GLN A 76 12.845 13.796 -8.973 1.00 0.00 C ATOM 1089 O GLN A 76 14.074 13.721 -8.929 1.00 0.00 O ATOM 1090 CB GLN A 76 13.113 14.139 -11.436 1.00 0.00 C ATOM 1091 CG GLN A 76 12.460 14.582 -12.735 1.00 0.00 C ATOM 1092 CD GLN A 76 13.006 15.902 -13.242 1.00 0.00 C ATOM 1093 OE1 GLN A 76 14.219 16.092 -13.332 1.00 0.00 O ATOM 1094 NE2 GLN A 76 12.111 16.824 -13.574 1.00 0.00 N ATOM 0 H GLN A 76 11.386 15.785 -9.853 1.00 0.00 H new ATOM 0 HA GLN A 76 11.623 12.914 -10.488 1.00 0.00 H new ATOM 0 HB2 GLN A 76 13.816 14.907 -11.112 1.00 0.00 H new ATOM 0 HB3 GLN A 76 13.692 13.234 -11.620 1.00 0.00 H new ATOM 0 HG2 GLN A 76 12.612 13.815 -13.494 1.00 0.00 H new ATOM 0 HG3 GLN A 76 11.384 14.672 -12.584 1.00 0.00 H new ATOM 0 HE21 GLN A 76 11.115 16.624 -13.484 1.00 0.00 H new ATOM 0 HE22 GLN A 76 12.419 17.733 -13.920 1.00 0.00 H new ATOM 1103 N ASP A 77 12.082 13.815 -7.884 1.00 0.00 N ATOM 1104 CA ASP A 77 12.659 13.748 -6.546 1.00 0.00 C ATOM 1105 C ASP A 77 12.234 12.468 -5.834 1.00 0.00 C ATOM 1106 O ASP A 77 12.953 11.956 -4.976 1.00 0.00 O ATOM 1107 CB ASP A 77 12.235 14.968 -5.725 1.00 0.00 C ATOM 1108 CG ASP A 77 10.728 15.091 -5.609 1.00 0.00 C ATOM 1109 OD1 ASP A 77 10.032 14.838 -6.614 1.00 0.00 O ATOM 1110 OD2 ASP A 77 10.244 15.441 -4.511 1.00 0.00 O ATOM 0 H ASP A 77 11.064 13.876 -7.902 1.00 0.00 H new ATOM 0 HA ASP A 77 13.745 13.744 -6.644 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.669 14.900 -4.728 1.00 0.00 H new ATOM 0 HB3 ASP A 77 12.636 15.870 -6.186 1.00 0.00 H new ATOM 1115 N GLY A 78 11.062 11.957 -6.196 1.00 0.00 N ATOM 1116 CA GLY A 78 10.562 10.741 -5.582 1.00 0.00 C ATOM 1117 C GLY A 78 9.065 10.780 -5.351 1.00 0.00 C ATOM 1118 O GLY A 78 8.298 10.177 -6.101 1.00 0.00 O ATOM 0 H GLY A 78 10.450 12.363 -6.903 1.00 0.00 H new ATOM 0 HA2 GLY A 78 10.806 9.890 -6.218 1.00 0.00 H new ATOM 0 HA3 GLY A 78 11.069 10.583 -4.630 1.00 0.00 H new ATOM 1122 N HIS A 79 8.647 11.494 -4.310 1.00 0.00 N ATOM 1123 CA HIS A 79 7.231 11.609 -3.982 1.00 0.00 C ATOM 1124 C HIS A 79 6.447 12.197 -5.152 1.00 0.00 C ATOM 1125 O HIS A 79 7.015 12.504 -6.200 1.00 0.00 O ATOM 1126 CB HIS A 79 7.044 12.482 -2.738 1.00 0.00 C ATOM 1127 CG HIS A 79 8.157 12.355 -1.746 1.00 0.00 C ATOM 1128 ND1 HIS A 79 8.742 13.440 -1.129 1.00 0.00 N ATOM 1129 CD2 HIS A 79 8.793 11.261 -1.262 1.00 0.00 C ATOM 1130 CE1 HIS A 79 9.690 13.021 -0.309 1.00 0.00 C ATOM 1131 NE2 HIS A 79 9.740 11.703 -0.371 1.00 0.00 N ATOM 0 H HIS A 79 9.269 12.001 -3.680 1.00 0.00 H new ATOM 0 HA HIS A 79 6.848 10.609 -3.778 1.00 0.00 H new ATOM 0 HB2 HIS A 79 6.959 13.524 -3.045 1.00 0.00 H new ATOM 0 HB3 HIS A 79 6.105 12.215 -2.254 1.00 0.00 H new ATOM 0 HD2 HIS A 79 8.593 10.233 -1.527 1.00 0.00 H new ATOM 0 HE1 HIS A 79 10.317 13.649 0.307 1.00 0.00 H new ATOM 0 HE2 HIS A 79 10.379 11.109 0.158 1.00 0.00 H new ATOM 1140 N LEU A 80 5.141 12.350 -4.965 1.00 0.00 N ATOM 1141 CA LEU A 80 4.280 12.902 -6.005 1.00 0.00 C ATOM 1142 C LEU A 80 3.907 14.347 -5.693 1.00 0.00 C ATOM 1143 O LEU A 80 4.339 14.907 -4.685 1.00 0.00 O ATOM 1144 CB LEU A 80 3.013 12.055 -6.148 1.00 0.00 C ATOM 1145 CG LEU A 80 3.232 10.655 -6.722 1.00 0.00 C ATOM 1146 CD1 LEU A 80 3.344 9.632 -5.602 1.00 0.00 C ATOM 1147 CD2 LEU A 80 2.105 10.287 -7.674 1.00 0.00 C ATOM 0 H LEU A 80 4.655 12.100 -4.104 1.00 0.00 H new ATOM 0 HA LEU A 80 4.830 12.884 -6.946 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.545 11.960 -5.168 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.309 12.587 -6.787 1.00 0.00 H new ATOM 0 HG LEU A 80 4.167 10.654 -7.282 1.00 0.00 H new ATOM 0 HD11 LEU A 80 3.500 8.641 -6.029 1.00 0.00 H new ATOM 0 HD12 LEU A 80 4.187 9.887 -4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.426 9.634 -5.014 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.278 9.287 -8.073 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.156 10.305 -7.138 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.073 11.004 -8.494 1.00 0.00 H new ATOM 1159 N TRP A 81 3.101 14.945 -6.564 1.00 0.00 N ATOM 1160 CA TRP A 81 2.669 16.326 -6.383 1.00 0.00 C ATOM 1161 C TRP A 81 1.264 16.534 -6.938 1.00 0.00 C ATOM 1162 O TRP A 81 0.955 16.101 -8.048 1.00 0.00 O ATOM 1163 CB TRP A 81 3.648 17.283 -7.066 1.00 0.00 C ATOM 1164 CG TRP A 81 3.637 17.176 -8.561 1.00 0.00 C ATOM 1165 CD1 TRP A 81 4.355 16.303 -9.325 1.00 0.00 C ATOM 1166 CD2 TRP A 81 2.871 17.972 -9.472 1.00 0.00 C ATOM 1167 NE1 TRP A 81 4.083 16.506 -10.656 1.00 0.00 N ATOM 1168 CE2 TRP A 81 3.175 17.525 -10.772 1.00 0.00 C ATOM 1169 CE3 TRP A 81 1.958 19.018 -9.315 1.00 0.00 C ATOM 1170 CZ2 TRP A 81 2.597 18.090 -11.907 1.00 0.00 C ATOM 1171 CZ3 TRP A 81 1.385 19.578 -10.442 1.00 0.00 C ATOM 1172 CH2 TRP A 81 1.707 19.112 -11.723 1.00 0.00 C ATOM 0 H TRP A 81 2.734 14.495 -7.402 1.00 0.00 H new ATOM 0 HA TRP A 81 2.652 16.538 -5.314 1.00 0.00 H new ATOM 0 HB2 TRP A 81 3.404 18.306 -6.780 1.00 0.00 H new ATOM 0 HB3 TRP A 81 4.655 17.082 -6.702 1.00 0.00 H new ATOM 0 HD1 TRP A 81 5.038 15.560 -8.939 1.00 0.00 H new ATOM 0 HE1 TRP A 81 4.491 15.983 -11.431 1.00 0.00 H new ATOM 0 HE3 TRP A 81 1.704 19.383 -8.331 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 2.843 17.734 -12.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 0.678 20.387 -10.333 1.00 0.00 H new ATOM 0 HH2 TRP A 81 1.242 19.570 -12.584 1.00 0.00 H new ATOM 1183 N CYS A 82 0.417 17.199 -6.160 1.00 0.00 N ATOM 1184 CA CYS A 82 -0.955 17.464 -6.574 1.00 0.00 C ATOM 1185 C CYS A 82 -1.225 18.964 -6.638 1.00 0.00 C ATOM 1186 O CYS A 82 -0.882 19.706 -5.718 1.00 0.00 O ATOM 1187 CB CYS A 82 -1.939 16.799 -5.609 1.00 0.00 C ATOM 1188 SG CYS A 82 -1.940 17.517 -3.936 1.00 0.00 S ATOM 0 H CYS A 82 0.657 17.564 -5.239 1.00 0.00 H new ATOM 0 HA CYS A 82 -1.094 17.045 -7.571 1.00 0.00 H new ATOM 0 HB2 CYS A 82 -2.944 16.872 -6.025 1.00 0.00 H new ATOM 0 HB3 CYS A 82 -1.700 15.738 -5.537 1.00 0.00 H new ATOM 1193 N SER A 83 -1.842 19.403 -7.730 1.00 0.00 N ATOM 1194 CA SER A 83 -2.158 20.815 -7.914 1.00 0.00 C ATOM 1195 C SER A 83 -3.171 21.284 -6.875 1.00 0.00 C ATOM 1196 O SER A 83 -4.270 20.739 -6.775 1.00 0.00 O ATOM 1197 CB SER A 83 -2.705 21.058 -9.323 1.00 0.00 C ATOM 1198 OG SER A 83 -3.086 22.411 -9.495 1.00 0.00 O ATOM 0 H SER A 83 -2.133 18.802 -8.501 1.00 0.00 H new ATOM 0 HA SER A 83 -1.240 21.388 -7.785 1.00 0.00 H new ATOM 0 HB2 SER A 83 -1.948 20.793 -10.061 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.563 20.410 -9.500 1.00 0.00 H new ATOM 0 HG SER A 83 -4.064 22.475 -9.519 1.00 0.00 H new ATOM 1204 N THR A 84 -2.792 22.297 -6.103 1.00 0.00 N ATOM 1205 CA THR A 84 -3.668 22.839 -5.071 1.00 0.00 C ATOM 1206 C THR A 84 -4.561 23.941 -5.631 1.00 0.00 C ATOM 1207 O THR A 84 -4.786 24.962 -4.980 1.00 0.00 O ATOM 1208 CB THR A 84 -2.860 23.401 -3.888 1.00 0.00 C ATOM 1209 OG1 THR A 84 -1.913 24.371 -4.356 1.00 0.00 O ATOM 1210 CG2 THR A 84 -2.129 22.288 -3.153 1.00 0.00 C ATOM 0 H THR A 84 -1.885 22.759 -6.172 1.00 0.00 H new ATOM 0 HA THR A 84 -4.289 22.015 -4.719 1.00 0.00 H new ATOM 0 HB THR A 84 -3.556 23.876 -3.197 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.518 24.838 -3.591 1.00 0.00 H new ATOM 0 HG21 THR A 84 -1.565 22.710 -2.321 1.00 0.00 H new ATOM 0 HG22 THR A 84 -2.852 21.567 -2.772 1.00 0.00 H new ATOM 0 HG23 THR A 84 -1.445 21.788 -3.838 1.00 0.00 H new ATOM 1218 N THR A 85 -5.069 23.727 -6.840 1.00 0.00 N ATOM 1219 CA THR A 85 -5.939 24.702 -7.488 1.00 0.00 C ATOM 1220 C THR A 85 -6.469 24.172 -8.815 1.00 0.00 C ATOM 1221 O THR A 85 -5.705 23.693 -9.653 1.00 0.00 O ATOM 1222 CB THR A 85 -5.205 26.032 -7.736 1.00 0.00 C ATOM 1223 OG1 THR A 85 -3.823 25.785 -8.021 1.00 0.00 O ATOM 1224 CG2 THR A 85 -5.322 26.949 -6.527 1.00 0.00 C ATOM 0 H THR A 85 -4.893 22.887 -7.391 1.00 0.00 H new ATOM 0 HA THR A 85 -6.775 24.877 -6.811 1.00 0.00 H new ATOM 0 HB THR A 85 -5.670 26.523 -8.591 1.00 0.00 H new ATOM 0 HG1 THR A 85 -3.741 25.361 -8.901 1.00 0.00 H new ATOM 0 HG21 THR A 85 -4.796 27.882 -6.726 1.00 0.00 H new ATOM 0 HG22 THR A 85 -6.373 27.160 -6.331 1.00 0.00 H new ATOM 0 HG23 THR A 85 -4.881 26.462 -5.657 1.00 0.00 H new ATOM 1232 N SER A 86 -7.782 24.258 -8.999 1.00 0.00 N ATOM 1233 CA SER A 86 -8.416 23.787 -10.225 1.00 0.00 C ATOM 1234 C SER A 86 -7.527 24.057 -11.434 1.00 0.00 C ATOM 1235 O SER A 86 -6.927 23.139 -11.994 1.00 0.00 O ATOM 1236 CB SER A 86 -9.775 24.464 -10.414 1.00 0.00 C ATOM 1237 OG SER A 86 -10.183 24.418 -11.770 1.00 0.00 O ATOM 0 H SER A 86 -8.428 24.650 -8.314 1.00 0.00 H new ATOM 0 HA SER A 86 -8.564 22.711 -10.138 1.00 0.00 H new ATOM 0 HB2 SER A 86 -10.520 23.971 -9.790 1.00 0.00 H new ATOM 0 HB3 SER A 86 -9.717 25.501 -10.083 1.00 0.00 H new ATOM 0 HG SER A 86 -11.055 24.856 -11.864 1.00 0.00 H new ATOM 1243 N ASN A 87 -7.447 25.322 -11.833 1.00 0.00 N ATOM 1244 CA ASN A 87 -6.631 25.713 -12.977 1.00 0.00 C ATOM 1245 C ASN A 87 -5.153 25.753 -12.602 1.00 0.00 C ATOM 1246 O ASN A 87 -4.587 26.823 -12.378 1.00 0.00 O ATOM 1247 CB ASN A 87 -7.073 27.080 -13.501 1.00 0.00 C ATOM 1248 CG ASN A 87 -8.560 27.135 -13.793 1.00 0.00 C ATOM 1249 OD1 ASN A 87 -9.200 28.173 -13.621 1.00 0.00 O ATOM 1250 ND2 ASN A 87 -9.118 26.014 -14.234 1.00 0.00 N ATOM 0 H ASN A 87 -7.937 26.094 -11.381 1.00 0.00 H new ATOM 0 HA ASN A 87 -6.768 24.969 -13.762 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -6.821 27.846 -12.767 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -6.518 27.314 -14.410 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -10.116 25.990 -14.445 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -8.549 25.177 -14.362 1.00 0.00 H new ATOM 1257 N TYR A 88 -4.533 24.579 -12.536 1.00 0.00 N ATOM 1258 CA TYR A 88 -3.120 24.479 -12.188 1.00 0.00 C ATOM 1259 C TYR A 88 -2.285 25.447 -13.019 1.00 0.00 C ATOM 1260 O TYR A 88 -1.690 26.384 -12.488 1.00 0.00 O ATOM 1261 CB TYR A 88 -2.622 23.049 -12.397 1.00 0.00 C ATOM 1262 CG TYR A 88 -1.115 22.929 -12.417 1.00 0.00 C ATOM 1263 CD1 TYR A 88 -0.365 23.171 -11.273 1.00 0.00 C ATOM 1264 CD2 TYR A 88 -0.442 22.573 -13.579 1.00 0.00 C ATOM 1265 CE1 TYR A 88 1.012 23.062 -11.287 1.00 0.00 C ATOM 1266 CE2 TYR A 88 0.936 22.461 -13.601 1.00 0.00 C ATOM 1267 CZ TYR A 88 1.658 22.708 -12.452 1.00 0.00 C ATOM 1268 OH TYR A 88 3.029 22.598 -12.470 1.00 0.00 O ATOM 0 H TYR A 88 -4.987 23.684 -12.719 1.00 0.00 H new ATOM 0 HA TYR A 88 -3.011 24.744 -11.136 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -3.018 22.416 -11.603 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -3.021 22.668 -13.337 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -0.867 23.449 -10.358 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -1.005 22.380 -14.481 1.00 0.00 H new ATOM 0 HE1 TYR A 88 1.580 23.253 -10.389 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.444 22.182 -14.512 1.00 0.00 H new ATOM 0 HH TYR A 88 3.325 22.340 -13.368 1.00 0.00 H new ATOM 1278 N GLU A 89 -2.244 25.212 -14.327 1.00 0.00 N ATOM 1279 CA GLU A 89 -1.480 26.062 -15.232 1.00 0.00 C ATOM 1280 C GLU A 89 -1.715 27.536 -14.920 1.00 0.00 C ATOM 1281 O GLU A 89 -0.820 28.367 -15.088 1.00 0.00 O ATOM 1282 CB GLU A 89 -1.861 25.768 -16.684 1.00 0.00 C ATOM 1283 CG GLU A 89 -0.907 24.813 -17.382 1.00 0.00 C ATOM 1284 CD GLU A 89 -0.757 25.115 -18.860 1.00 0.00 C ATOM 1285 OE1 GLU A 89 -1.023 26.268 -19.260 1.00 0.00 O ATOM 1286 OE2 GLU A 89 -0.374 24.199 -19.617 1.00 0.00 O ATOM 0 H GLU A 89 -2.731 24.440 -14.783 1.00 0.00 H new ATOM 0 HA GLU A 89 -0.422 25.844 -15.091 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -2.866 25.347 -16.709 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -1.894 26.705 -17.239 1.00 0.00 H new ATOM 0 HG2 GLU A 89 0.071 24.867 -16.903 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -1.266 23.791 -17.258 1.00 0.00 H new ATOM 1293 N GLN A 90 -2.922 27.854 -14.466 1.00 0.00 N ATOM 1294 CA GLN A 90 -3.275 29.229 -14.131 1.00 0.00 C ATOM 1295 C GLN A 90 -2.729 29.612 -12.759 1.00 0.00 C ATOM 1296 O GLN A 90 -1.926 30.536 -12.635 1.00 0.00 O ATOM 1297 CB GLN A 90 -4.794 29.408 -14.156 1.00 0.00 C ATOM 1298 CG GLN A 90 -5.264 30.707 -13.521 1.00 0.00 C ATOM 1299 CD GLN A 90 -6.775 30.803 -13.441 1.00 0.00 C ATOM 1300 OE1 GLN A 90 -7.460 29.810 -13.199 1.00 0.00 O ATOM 1301 NE2 GLN A 90 -7.303 32.005 -13.646 1.00 0.00 N ATOM 0 H GLN A 90 -3.673 27.179 -14.321 1.00 0.00 H new ATOM 0 HA GLN A 90 -2.826 29.885 -14.877 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -5.139 29.373 -15.189 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -5.259 28.570 -13.636 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.845 30.790 -12.518 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -4.880 31.549 -14.097 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -6.697 32.801 -13.844 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -8.314 32.131 -13.606 1.00 0.00 H new ATOM 1310 N ASP A 91 -3.170 28.894 -11.731 1.00 0.00 N ATOM 1311 CA ASP A 91 -2.724 29.159 -10.368 1.00 0.00 C ATOM 1312 C ASP A 91 -1.244 28.832 -10.205 1.00 0.00 C ATOM 1313 O ASP A 91 -0.454 29.677 -9.783 1.00 0.00 O ATOM 1314 CB ASP A 91 -3.551 28.342 -9.372 1.00 0.00 C ATOM 1315 CG ASP A 91 -4.799 29.074 -8.918 1.00 0.00 C ATOM 1316 OD1 ASP A 91 -4.663 30.129 -8.263 1.00 0.00 O ATOM 1317 OD2 ASP A 91 -5.912 28.593 -9.217 1.00 0.00 O ATOM 0 H ASP A 91 -3.835 28.125 -11.816 1.00 0.00 H new ATOM 0 HA ASP A 91 -2.866 30.221 -10.166 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -3.835 27.395 -9.831 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -2.937 28.104 -8.504 1.00 0.00 H new ATOM 1322 N GLN A 92 -0.875 27.602 -10.545 1.00 0.00 N ATOM 1323 CA GLN A 92 0.512 27.162 -10.438 1.00 0.00 C ATOM 1324 C GLN A 92 0.821 26.676 -9.026 1.00 0.00 C ATOM 1325 O GLN A 92 1.949 26.801 -8.548 1.00 0.00 O ATOM 1326 CB GLN A 92 1.460 28.302 -10.816 1.00 0.00 C ATOM 1327 CG GLN A 92 2.714 27.836 -11.540 1.00 0.00 C ATOM 1328 CD GLN A 92 3.140 26.440 -11.129 1.00 0.00 C ATOM 1329 OE1 GLN A 92 3.968 26.268 -10.235 1.00 0.00 O ATOM 1330 NE2 GLN A 92 2.574 25.433 -11.784 1.00 0.00 N ATOM 0 H GLN A 92 -1.517 26.892 -10.897 1.00 0.00 H new ATOM 0 HA GLN A 92 0.658 26.332 -11.129 1.00 0.00 H new ATOM 0 HB2 GLN A 92 0.927 29.012 -11.449 1.00 0.00 H new ATOM 0 HB3 GLN A 92 1.750 28.837 -9.912 1.00 0.00 H new ATOM 0 HG2 GLN A 92 2.537 27.856 -12.615 1.00 0.00 H new ATOM 0 HG3 GLN A 92 3.526 28.534 -11.338 1.00 0.00 H new ATOM 0 HE21 GLN A 92 1.892 25.622 -12.519 1.00 0.00 H new ATOM 0 HE22 GLN A 92 2.821 24.471 -11.552 1.00 0.00 H new ATOM 1339 N LYS A 93 -0.187 26.119 -8.364 1.00 0.00 N ATOM 1340 CA LYS A 93 -0.023 25.612 -7.006 1.00 0.00 C ATOM 1341 C LYS A 93 0.035 24.088 -6.998 1.00 0.00 C ATOM 1342 O LYS A 93 -0.498 23.431 -7.893 1.00 0.00 O ATOM 1343 CB LYS A 93 -1.170 26.095 -6.117 1.00 0.00 C ATOM 1344 CG LYS A 93 -1.611 27.519 -6.413 1.00 0.00 C ATOM 1345 CD LYS A 93 -1.523 28.399 -5.176 1.00 0.00 C ATOM 1346 CE LYS A 93 -2.180 29.750 -5.406 1.00 0.00 C ATOM 1347 NZ LYS A 93 -2.723 30.326 -4.145 1.00 0.00 N ATOM 0 H LYS A 93 -1.126 26.007 -8.745 1.00 0.00 H new ATOM 0 HA LYS A 93 0.918 25.996 -6.613 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -2.022 25.426 -6.242 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -0.863 26.028 -5.073 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -0.987 27.937 -7.203 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -2.636 27.514 -6.785 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.004 27.897 -4.336 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -0.477 28.543 -4.904 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -1.453 30.439 -5.836 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -2.986 29.643 -6.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -3.163 31.247 -4.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -3.436 29.681 -3.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -1.951 30.453 -3.460 1.00 0.00 H new ATOM 1361 N TYR A 94 0.684 23.530 -5.981 1.00 0.00 N ATOM 1362 CA TYR A 94 0.812 22.082 -5.858 1.00 0.00 C ATOM 1363 C TYR A 94 1.187 21.687 -4.433 1.00 0.00 C ATOM 1364 O TYR A 94 1.291 22.538 -3.550 1.00 0.00 O ATOM 1365 CB TYR A 94 1.862 21.557 -6.838 1.00 0.00 C ATOM 1366 CG TYR A 94 3.219 22.205 -6.678 1.00 0.00 C ATOM 1367 CD1 TYR A 94 3.934 22.081 -5.495 1.00 0.00 C ATOM 1368 CD2 TYR A 94 3.783 22.942 -7.712 1.00 0.00 C ATOM 1369 CE1 TYR A 94 5.174 22.673 -5.344 1.00 0.00 C ATOM 1370 CE2 TYR A 94 5.023 23.537 -7.570 1.00 0.00 C ATOM 1371 CZ TYR A 94 5.714 23.399 -6.385 1.00 0.00 C ATOM 1372 OH TYR A 94 6.948 23.990 -6.240 1.00 0.00 O ATOM 0 H TYR A 94 1.129 24.058 -5.230 1.00 0.00 H new ATOM 0 HA TYR A 94 -0.153 21.636 -6.097 1.00 0.00 H new ATOM 0 HB2 TYR A 94 1.965 20.480 -6.704 1.00 0.00 H new ATOM 0 HB3 TYR A 94 1.509 21.719 -7.856 1.00 0.00 H new ATOM 0 HD1 TYR A 94 3.514 21.512 -4.678 1.00 0.00 H new ATOM 0 HD2 TYR A 94 3.244 23.052 -8.642 1.00 0.00 H new ATOM 0 HE1 TYR A 94 5.717 22.568 -4.416 1.00 0.00 H new ATOM 0 HE2 TYR A 94 5.448 24.107 -8.383 1.00 0.00 H new ATOM 0 HH TYR A 94 6.878 24.747 -5.621 1.00 0.00 H new ATOM 1382 N SER A 95 1.388 20.391 -4.219 1.00 0.00 N ATOM 1383 CA SER A 95 1.752 19.881 -2.902 1.00 0.00 C ATOM 1384 C SER A 95 2.278 18.452 -2.999 1.00 0.00 C ATOM 1385 O SER A 95 1.684 17.606 -3.668 1.00 0.00 O ATOM 1386 CB SER A 95 0.547 19.930 -1.962 1.00 0.00 C ATOM 1387 OG SER A 95 0.687 20.968 -1.006 1.00 0.00 O ATOM 0 H SER A 95 1.305 19.675 -4.940 1.00 0.00 H new ATOM 0 HA SER A 95 2.543 20.514 -2.500 1.00 0.00 H new ATOM 0 HB2 SER A 95 -0.364 20.085 -2.541 1.00 0.00 H new ATOM 0 HB3 SER A 95 0.441 18.973 -1.451 1.00 0.00 H new ATOM 0 HG SER A 95 1.605 20.974 -0.662 1.00 0.00 H new ATOM 1393 N PHE A 96 3.396 18.191 -2.329 1.00 0.00 N ATOM 1394 CA PHE A 96 4.002 16.865 -2.342 1.00 0.00 C ATOM 1395 C PHE A 96 3.215 15.898 -1.463 1.00 0.00 C ATOM 1396 O PHE A 96 3.147 16.065 -0.244 1.00 0.00 O ATOM 1397 CB PHE A 96 5.454 16.942 -1.864 1.00 0.00 C ATOM 1398 CG PHE A 96 6.131 18.235 -2.215 1.00 0.00 C ATOM 1399 CD1 PHE A 96 5.862 18.868 -3.418 1.00 0.00 C ATOM 1400 CD2 PHE A 96 7.035 18.819 -1.343 1.00 0.00 C ATOM 1401 CE1 PHE A 96 6.482 20.058 -3.744 1.00 0.00 C ATOM 1402 CE2 PHE A 96 7.659 20.009 -1.663 1.00 0.00 C ATOM 1403 CZ PHE A 96 7.382 20.630 -2.866 1.00 0.00 C ATOM 0 H PHE A 96 3.900 18.880 -1.771 1.00 0.00 H new ATOM 0 HA PHE A 96 3.982 16.493 -3.366 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.480 16.809 -0.782 1.00 0.00 H new ATOM 0 HB3 PHE A 96 6.016 16.116 -2.300 1.00 0.00 H new ATOM 0 HD1 PHE A 96 5.159 18.426 -4.109 1.00 0.00 H new ATOM 0 HD2 PHE A 96 7.255 18.338 -0.401 1.00 0.00 H new ATOM 0 HE1 PHE A 96 6.263 20.541 -4.685 1.00 0.00 H new ATOM 0 HE2 PHE A 96 8.362 20.453 -0.974 1.00 0.00 H new ATOM 0 HZ PHE A 96 7.868 21.561 -3.119 1.00 0.00 H new ATOM 1413 N CYS A 97 2.622 14.887 -2.089 1.00 0.00 N ATOM 1414 CA CYS A 97 1.840 13.893 -1.364 1.00 0.00 C ATOM 1415 C CYS A 97 2.714 12.719 -0.935 1.00 0.00 C ATOM 1416 O CYS A 97 3.936 12.759 -1.073 1.00 0.00 O ATOM 1417 CB CYS A 97 0.686 13.390 -2.233 1.00 0.00 C ATOM 1418 SG CYS A 97 0.117 14.588 -3.483 1.00 0.00 S ATOM 0 H CYS A 97 2.668 14.735 -3.096 1.00 0.00 H new ATOM 0 HA CYS A 97 1.435 14.368 -0.470 1.00 0.00 H new ATOM 0 HB2 CYS A 97 0.997 12.475 -2.738 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -0.153 13.128 -1.588 1.00 0.00 H new ATOM 1423 N THR A 98 2.077 11.675 -0.415 1.00 0.00 N ATOM 1424 CA THR A 98 2.796 10.489 0.033 1.00 0.00 C ATOM 1425 C THR A 98 2.861 9.439 -1.071 1.00 0.00 C ATOM 1426 O THR A 98 1.833 9.015 -1.599 1.00 0.00 O ATOM 1427 CB THR A 98 2.135 9.866 1.278 1.00 0.00 C ATOM 1428 OG1 THR A 98 1.332 8.743 0.897 1.00 0.00 O ATOM 1429 CG2 THR A 98 1.273 10.889 2.003 1.00 0.00 C ATOM 0 H THR A 98 1.065 11.627 -0.294 1.00 0.00 H new ATOM 0 HA THR A 98 3.806 10.809 0.290 1.00 0.00 H new ATOM 0 HB THR A 98 2.924 9.535 1.953 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.046 8.846 -0.035 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.817 10.426 2.878 1.00 0.00 H new ATOM 0 HG22 THR A 98 1.892 11.729 2.318 1.00 0.00 H new ATOM 0 HG23 THR A 98 0.491 11.246 1.333 1.00 0.00 H new ATOM 1437 N ASP A 99 4.075 9.025 -1.415 1.00 0.00 N ATOM 1438 CA ASP A 99 4.276 8.025 -2.457 1.00 0.00 C ATOM 1439 C ASP A 99 3.559 6.724 -2.110 1.00 0.00 C ATOM 1440 O ASP A 99 4.186 5.747 -1.701 1.00 0.00 O ATOM 1441 CB ASP A 99 5.769 7.758 -2.658 1.00 0.00 C ATOM 1442 CG ASP A 99 6.548 7.831 -1.359 1.00 0.00 C ATOM 1443 OD1 ASP A 99 5.912 7.828 -0.284 1.00 0.00 O ATOM 1444 OD2 ASP A 99 7.794 7.889 -1.417 1.00 0.00 O ATOM 0 H ASP A 99 4.936 9.367 -0.987 1.00 0.00 H new ATOM 0 HA ASP A 99 3.855 8.415 -3.384 1.00 0.00 H new ATOM 0 HB2 ASP A 99 5.902 6.772 -3.104 1.00 0.00 H new ATOM 0 HB3 ASP A 99 6.174 8.484 -3.363 1.00 0.00 H new ATOM 1449 N HIS A 100 2.240 6.719 -2.277 1.00 0.00 N ATOM 1450 CA HIS A 100 1.434 5.545 -1.984 1.00 0.00 C ATOM 1451 C HIS A 100 1.631 4.467 -3.043 1.00 0.00 C ATOM 1452 O HIS A 100 0.671 4.001 -3.656 1.00 0.00 O ATOM 1453 CB HIS A 100 -0.046 5.926 -1.896 1.00 0.00 C ATOM 1454 CG HIS A 100 -0.535 6.704 -3.078 1.00 0.00 C ATOM 1455 ND1 HIS A 100 -1.837 7.135 -3.209 1.00 0.00 N ATOM 1456 CD2 HIS A 100 0.113 7.129 -4.189 1.00 0.00 C ATOM 1457 CE1 HIS A 100 -1.971 7.792 -4.348 1.00 0.00 C ATOM 1458 NE2 HIS A 100 -0.801 7.802 -4.960 1.00 0.00 N ATOM 0 H HIS A 100 1.707 7.520 -2.615 1.00 0.00 H new ATOM 0 HA HIS A 100 1.758 5.145 -1.023 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -0.641 5.018 -1.797 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -0.208 6.513 -0.992 1.00 0.00 H new ATOM 0 HD2 HIS A 100 1.155 6.968 -4.424 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -2.881 8.243 -4.715 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -0.608 8.240 -5.861 1.00 0.00 H new ATOM 1467 N THR A 101 2.884 4.074 -3.255 1.00 0.00 N ATOM 1468 CA THR A 101 3.209 3.052 -4.239 1.00 0.00 C ATOM 1469 C THR A 101 2.359 1.804 -4.037 1.00 0.00 C ATOM 1470 O THR A 101 1.394 1.814 -3.274 1.00 0.00 O ATOM 1471 CB THR A 101 4.696 2.660 -4.170 1.00 0.00 C ATOM 1472 OG1 THR A 101 5.083 1.986 -5.373 1.00 0.00 O ATOM 1473 CG2 THR A 101 4.963 1.761 -2.973 1.00 0.00 C ATOM 0 H THR A 101 3.690 4.450 -2.756 1.00 0.00 H new ATOM 0 HA THR A 101 2.997 3.479 -5.219 1.00 0.00 H new ATOM 0 HB THR A 101 5.283 3.572 -4.060 1.00 0.00 H new ATOM 0 HG1 THR A 101 6.031 1.742 -5.321 1.00 0.00 H new ATOM 0 HG21 THR A 101 6.020 1.497 -2.945 1.00 0.00 H new ATOM 0 HG22 THR A 101 4.696 2.287 -2.056 1.00 0.00 H new ATOM 0 HG23 THR A 101 4.365 0.854 -3.059 1.00 0.00 H new ATOM 1481 N VAL A 102 2.726 0.733 -4.729 1.00 0.00 N ATOM 1482 CA VAL A 102 2.005 -0.527 -4.633 1.00 0.00 C ATOM 1483 C VAL A 102 1.868 -0.978 -3.182 1.00 0.00 C ATOM 1484 O VAL A 102 2.615 -0.534 -2.310 1.00 0.00 O ATOM 1485 CB VAL A 102 2.716 -1.627 -5.438 1.00 0.00 C ATOM 1486 CG1 VAL A 102 3.103 -1.112 -6.816 1.00 0.00 C ATOM 1487 CG2 VAL A 102 3.938 -2.133 -4.687 1.00 0.00 C ATOM 0 H VAL A 102 3.523 0.713 -5.365 1.00 0.00 H new ATOM 0 HA VAL A 102 1.010 -0.361 -5.047 1.00 0.00 H new ATOM 0 HB VAL A 102 2.027 -2.462 -5.567 1.00 0.00 H new ATOM 0 HG11 VAL A 102 3.605 -1.903 -7.372 1.00 0.00 H new ATOM 0 HG12 VAL A 102 2.207 -0.803 -7.354 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.775 -0.260 -6.711 1.00 0.00 H new ATOM 0 HG21 VAL A 102 4.428 -2.911 -5.272 1.00 0.00 H new ATOM 0 HG22 VAL A 102 4.633 -1.309 -4.525 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.630 -2.542 -3.725 1.00 0.00 H new ATOM 1497 N LEU A 103 0.909 -1.865 -2.933 1.00 0.00 N ATOM 1498 CA LEU A 103 0.674 -2.381 -1.589 1.00 0.00 C ATOM 1499 C LEU A 103 0.287 -3.855 -1.634 1.00 0.00 C ATOM 1500 O LEU A 103 -0.738 -4.220 -2.211 1.00 0.00 O ATOM 1501 CB LEU A 103 -0.425 -1.573 -0.895 1.00 0.00 C ATOM 1502 CG LEU A 103 0.061 -0.341 -0.129 1.00 0.00 C ATOM 1503 CD1 LEU A 103 0.580 0.714 -1.094 1.00 0.00 C ATOM 1504 CD2 LEU A 103 -1.055 0.224 0.734 1.00 0.00 C ATOM 0 H LEU A 103 0.282 -2.241 -3.644 1.00 0.00 H new ATOM 0 HA LEU A 103 1.599 -2.284 -1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -1.148 -1.253 -1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -0.953 -2.228 -0.202 1.00 0.00 H new ATOM 0 HG LEU A 103 0.880 -0.641 0.525 1.00 0.00 H new ATOM 0 HD11 LEU A 103 0.922 1.584 -0.533 1.00 0.00 H new ATOM 0 HD12 LEU A 103 1.410 0.304 -1.669 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.220 1.011 -1.773 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -0.691 1.100 1.272 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.895 0.510 0.101 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -1.380 -0.532 1.449 1.00 0.00 H new ATOM 1516 N VAL A 104 1.111 -4.699 -1.023 1.00 0.00 N ATOM 1517 CA VAL A 104 0.854 -6.134 -0.996 1.00 0.00 C ATOM 1518 C VAL A 104 0.340 -6.568 0.372 1.00 0.00 C ATOM 1519 O VAL A 104 0.832 -6.113 1.402 1.00 0.00 O ATOM 1520 CB VAL A 104 2.129 -6.933 -1.344 1.00 0.00 C ATOM 1521 CG1 VAL A 104 2.020 -8.382 -0.884 1.00 0.00 C ATOM 1522 CG2 VAL A 104 2.404 -6.867 -2.836 1.00 0.00 C ATOM 0 H VAL A 104 1.963 -4.414 -0.540 1.00 0.00 H new ATOM 0 HA VAL A 104 0.091 -6.343 -1.746 1.00 0.00 H new ATOM 0 HB VAL A 104 2.965 -6.478 -0.812 1.00 0.00 H new ATOM 0 HG11 VAL A 104 2.934 -8.916 -1.144 1.00 0.00 H new ATOM 0 HG12 VAL A 104 1.878 -8.411 0.196 1.00 0.00 H new ATOM 0 HG13 VAL A 104 1.170 -8.857 -1.375 1.00 0.00 H new ATOM 0 HG21 VAL A 104 3.306 -7.435 -3.065 1.00 0.00 H new ATOM 0 HG22 VAL A 104 1.560 -7.291 -3.381 1.00 0.00 H new ATOM 0 HG23 VAL A 104 2.544 -5.828 -3.135 1.00 0.00 H new ATOM 1532 N GLN A 105 -0.649 -7.458 0.372 1.00 0.00 N ATOM 1533 CA GLN A 105 -1.226 -7.961 1.612 1.00 0.00 C ATOM 1534 C GLN A 105 -0.664 -9.340 1.946 1.00 0.00 C ATOM 1535 O GLN A 105 -1.266 -10.362 1.620 1.00 0.00 O ATOM 1536 CB GLN A 105 -2.750 -8.030 1.501 1.00 0.00 C ATOM 1537 CG GLN A 105 -3.456 -6.791 2.028 1.00 0.00 C ATOM 1538 CD GLN A 105 -4.650 -7.127 2.899 1.00 0.00 C ATOM 1539 OE1 GLN A 105 -5.719 -7.477 2.398 1.00 0.00 O ATOM 1540 NE2 GLN A 105 -4.474 -7.021 4.210 1.00 0.00 N ATOM 0 H GLN A 105 -1.067 -7.845 -0.474 1.00 0.00 H new ATOM 0 HA GLN A 105 -0.961 -7.273 2.415 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -3.023 -8.177 0.456 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -3.107 -8.902 2.049 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -2.750 -6.191 2.602 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -3.784 -6.179 1.188 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -3.570 -6.727 4.581 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -5.242 -7.233 4.847 1.00 0.00 H new ATOM 1549 N THR A 106 0.496 -9.358 2.594 1.00 0.00 N ATOM 1550 CA THR A 106 1.145 -10.609 2.968 1.00 0.00 C ATOM 1551 C THR A 106 0.680 -11.088 4.338 1.00 0.00 C ATOM 1552 O THR A 106 0.135 -10.315 5.125 1.00 0.00 O ATOM 1553 CB THR A 106 2.677 -10.464 2.989 1.00 0.00 C ATOM 1554 OG1 THR A 106 3.039 -9.091 3.176 1.00 0.00 O ATOM 1555 CG2 THR A 106 3.290 -10.984 1.699 1.00 0.00 C ATOM 0 H THR A 106 1.006 -8.519 2.871 1.00 0.00 H new ATOM 0 HA THR A 106 0.863 -11.343 2.213 1.00 0.00 H new ATOM 0 HB THR A 106 3.062 -11.056 3.819 1.00 0.00 H new ATOM 0 HG1 THR A 106 2.672 -8.769 4.026 1.00 0.00 H new ATOM 0 HG21 THR A 106 4.373 -10.870 1.739 1.00 0.00 H new ATOM 0 HG22 THR A 106 3.040 -12.038 1.576 1.00 0.00 H new ATOM 0 HG23 THR A 106 2.897 -10.417 0.855 1.00 0.00 H new ATOM 1563 N ARG A 107 0.906 -12.367 4.616 1.00 0.00 N ATOM 1564 CA ARG A 107 0.516 -12.953 5.893 1.00 0.00 C ATOM 1565 C ARG A 107 1.201 -14.300 6.104 1.00 0.00 C ATOM 1566 O ARG A 107 1.347 -15.085 5.168 1.00 0.00 O ATOM 1567 CB ARG A 107 -1.002 -13.125 5.957 1.00 0.00 C ATOM 1568 CG ARG A 107 -1.541 -14.148 4.970 1.00 0.00 C ATOM 1569 CD ARG A 107 -3.010 -13.906 4.663 1.00 0.00 C ATOM 1570 NE ARG A 107 -3.589 -14.988 3.871 1.00 0.00 N ATOM 1571 CZ ARG A 107 -4.885 -15.283 3.864 1.00 0.00 C ATOM 1572 NH1 ARG A 107 -5.731 -14.578 4.602 1.00 0.00 N ATOM 1573 NH2 ARG A 107 -5.335 -16.282 3.118 1.00 0.00 N ATOM 0 H ARG A 107 1.358 -13.018 3.974 1.00 0.00 H new ATOM 0 HA ARG A 107 0.831 -12.276 6.687 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -1.283 -13.424 6.967 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -1.477 -12.163 5.766 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -0.963 -14.104 4.047 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -1.414 -15.151 5.378 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -3.563 -13.804 5.597 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -3.117 -12.965 4.124 1.00 0.00 H new ATOM 0 HE ARG A 107 -2.964 -15.548 3.291 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.388 -13.808 5.176 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -6.725 -14.805 4.596 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -4.686 -16.825 2.548 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -6.330 -16.507 3.114 1.00 0.00 H new ATOM 1587 N GLY A 108 1.619 -14.561 7.339 1.00 0.00 N ATOM 1588 CA GLY A 108 2.281 -15.815 7.647 1.00 0.00 C ATOM 1589 C GLY A 108 3.785 -15.665 7.765 1.00 0.00 C ATOM 1590 O GLY A 108 4.353 -14.663 7.331 1.00 0.00 O ATOM 0 H GLY A 108 1.511 -13.927 8.131 1.00 0.00 H new ATOM 0 HA2 GLY A 108 1.884 -16.211 8.582 1.00 0.00 H new ATOM 0 HA3 GLY A 108 2.052 -16.543 6.869 1.00 0.00 H new ATOM 1594 N GLY A 109 4.432 -16.667 8.352 1.00 0.00 N ATOM 1595 CA GLY A 109 5.872 -16.627 8.515 1.00 0.00 C ATOM 1596 C GLY A 109 6.296 -15.867 9.757 1.00 0.00 C ATOM 1597 O GLY A 109 6.398 -16.442 10.840 1.00 0.00 O ATOM 0 H GLY A 109 3.983 -17.507 8.718 1.00 0.00 H new ATOM 0 HA2 GLY A 109 6.257 -17.646 8.567 1.00 0.00 H new ATOM 0 HA3 GLY A 109 6.321 -16.162 7.637 1.00 0.00 H new ATOM 1601 N ASN A 110 6.541 -14.570 9.599 1.00 0.00 N ATOM 1602 CA ASN A 110 6.955 -13.729 10.716 1.00 0.00 C ATOM 1603 C ASN A 110 6.481 -12.293 10.519 1.00 0.00 C ATOM 1604 O ASN A 110 6.983 -11.370 11.161 1.00 0.00 O ATOM 1605 CB ASN A 110 8.477 -13.760 10.867 1.00 0.00 C ATOM 1606 CG ASN A 110 9.194 -13.555 9.546 1.00 0.00 C ATOM 1607 OD1 ASN A 110 8.563 -13.387 8.503 1.00 0.00 O ATOM 1608 ND2 ASN A 110 10.522 -13.569 9.585 1.00 0.00 N ATOM 0 H ASN A 110 6.460 -14.079 8.709 1.00 0.00 H new ATOM 0 HA ASN A 110 6.499 -14.122 11.624 1.00 0.00 H new ATOM 0 HB2 ASN A 110 8.786 -12.985 11.569 1.00 0.00 H new ATOM 0 HB3 ASN A 110 8.777 -14.716 11.296 1.00 0.00 H new ATOM 0 HD21 ASN A 110 11.059 -13.437 8.728 1.00 0.00 H new ATOM 0 HD22 ASN A 110 11.005 -13.712 10.472 1.00 0.00 H new ATOM 1615 N SER A 111 5.512 -12.113 9.630 1.00 0.00 N ATOM 1616 CA SER A 111 4.969 -10.790 9.347 1.00 0.00 C ATOM 1617 C SER A 111 3.555 -10.654 9.903 1.00 0.00 C ATOM 1618 O SER A 111 3.017 -9.551 9.997 1.00 0.00 O ATOM 1619 CB SER A 111 4.964 -10.530 7.840 1.00 0.00 C ATOM 1620 OG SER A 111 3.765 -9.894 7.435 1.00 0.00 O ATOM 0 H SER A 111 5.086 -12.867 9.092 1.00 0.00 H new ATOM 0 HA SER A 111 5.605 -10.051 9.834 1.00 0.00 H new ATOM 0 HB2 SER A 111 5.818 -9.907 7.573 1.00 0.00 H new ATOM 0 HB3 SER A 111 5.078 -11.473 7.305 1.00 0.00 H new ATOM 0 HG SER A 111 3.716 -9.881 6.456 1.00 0.00 H new ATOM 1626 N ASN A 112 2.959 -11.783 10.268 1.00 0.00 N ATOM 1627 CA ASN A 112 1.606 -11.791 10.814 1.00 0.00 C ATOM 1628 C ASN A 112 0.684 -10.899 9.991 1.00 0.00 C ATOM 1629 O ASN A 112 0.326 -9.801 10.414 1.00 0.00 O ATOM 1630 CB ASN A 112 1.619 -11.327 12.271 1.00 0.00 C ATOM 1631 CG ASN A 112 2.902 -11.701 12.987 1.00 0.00 C ATOM 1632 OD1 ASN A 112 3.826 -10.895 13.092 1.00 0.00 O ATOM 1633 ND2 ASN A 112 2.966 -12.931 13.484 1.00 0.00 N ATOM 0 H ASN A 112 3.390 -12.704 10.196 1.00 0.00 H new ATOM 0 HA ASN A 112 1.228 -12.812 10.770 1.00 0.00 H new ATOM 0 HB2 ASN A 112 1.489 -10.245 12.306 1.00 0.00 H new ATOM 0 HB3 ASN A 112 0.772 -11.767 12.797 1.00 0.00 H new ATOM 0 HD21 ASN A 112 3.805 -13.239 13.976 1.00 0.00 H new ATOM 0 HD22 ASN A 112 2.176 -13.567 13.374 1.00 0.00 H new ATOM 1640 N GLY A 113 0.305 -11.379 8.812 1.00 0.00 N ATOM 1641 CA GLY A 113 -0.573 -10.613 7.947 1.00 0.00 C ATOM 1642 C GLY A 113 -0.151 -9.161 7.837 1.00 0.00 C ATOM 1643 O GLY A 113 -0.853 -8.267 8.310 1.00 0.00 O ATOM 0 H GLY A 113 0.590 -12.285 8.440 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -0.583 -11.062 6.954 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -1.592 -10.665 8.330 1.00 0.00 H new ATOM 1647 N ALA A 114 1.000 -8.924 7.215 1.00 0.00 N ATOM 1648 CA ALA A 114 1.513 -7.570 7.048 1.00 0.00 C ATOM 1649 C ALA A 114 1.480 -7.143 5.587 1.00 0.00 C ATOM 1650 O ALA A 114 1.664 -7.961 4.686 1.00 0.00 O ATOM 1651 CB ALA A 114 2.927 -7.467 7.599 1.00 0.00 C ATOM 0 H ALA A 114 1.594 -9.652 6.819 1.00 0.00 H new ATOM 0 HA ALA A 114 0.867 -6.895 7.609 1.00 0.00 H new ATOM 0 HB1 ALA A 114 3.296 -6.450 7.467 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.923 -7.716 8.660 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.577 -8.161 7.066 1.00 0.00 H new ATOM 1657 N LEU A 115 1.243 -5.855 5.361 1.00 0.00 N ATOM 1658 CA LEU A 115 1.187 -5.318 4.009 1.00 0.00 C ATOM 1659 C LEU A 115 2.565 -5.351 3.356 1.00 0.00 C ATOM 1660 O LEU A 115 3.300 -4.364 3.387 1.00 0.00 O ATOM 1661 CB LEU A 115 0.652 -3.885 4.027 1.00 0.00 C ATOM 1662 CG LEU A 115 0.801 -3.124 2.707 1.00 0.00 C ATOM 1663 CD1 LEU A 115 -0.272 -3.557 1.720 1.00 0.00 C ATOM 1664 CD2 LEU A 115 0.735 -1.624 2.948 1.00 0.00 C ATOM 0 H LEU A 115 1.087 -5.166 6.096 1.00 0.00 H new ATOM 0 HA LEU A 115 0.511 -5.942 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -0.404 -3.910 4.298 1.00 0.00 H new ATOM 0 HB3 LEU A 115 1.169 -3.330 4.810 1.00 0.00 H new ATOM 0 HG LEU A 115 1.775 -3.360 2.279 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -0.152 -3.006 0.787 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -0.178 -4.625 1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -1.257 -3.350 2.139 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.843 -1.098 1.999 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -0.225 -1.370 3.397 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.540 -1.328 3.620 1.00 0.00 H new ATOM 1676 N CYS A 116 2.914 -6.492 2.771 1.00 0.00 N ATOM 1677 CA CYS A 116 4.209 -6.648 2.118 1.00 0.00 C ATOM 1678 C CYS A 116 4.617 -5.363 1.409 1.00 0.00 C ATOM 1679 O CYS A 116 3.802 -4.714 0.750 1.00 0.00 O ATOM 1680 CB CYS A 116 4.173 -7.807 1.119 1.00 0.00 C ATOM 1681 SG CYS A 116 5.526 -9.011 1.324 1.00 0.00 S ATOM 0 H CYS A 116 2.320 -7.320 2.736 1.00 0.00 H new ATOM 0 HA CYS A 116 4.948 -6.870 2.888 1.00 0.00 H new ATOM 0 HB2 CYS A 116 3.220 -8.327 1.217 1.00 0.00 H new ATOM 0 HB3 CYS A 116 4.212 -7.402 0.108 1.00 0.00 H new ATOM 1686 N HIS A 117 5.887 -5.003 1.553 1.00 0.00 N ATOM 1687 CA HIS A 117 6.420 -3.795 0.934 1.00 0.00 C ATOM 1688 C HIS A 117 7.212 -4.137 -0.323 1.00 0.00 C ATOM 1689 O HIS A 117 8.151 -4.932 -0.279 1.00 0.00 O ATOM 1690 CB HIS A 117 7.310 -3.042 1.928 1.00 0.00 C ATOM 1691 CG HIS A 117 8.288 -2.110 1.282 1.00 0.00 C ATOM 1692 ND1 HIS A 117 8.131 -0.741 1.274 1.00 0.00 N ATOM 1693 CD2 HIS A 117 9.444 -2.358 0.622 1.00 0.00 C ATOM 1694 CE1 HIS A 117 9.147 -0.186 0.638 1.00 0.00 C ATOM 1695 NE2 HIS A 117 9.959 -1.146 0.233 1.00 0.00 N ATOM 0 H HIS A 117 6.569 -5.533 2.095 1.00 0.00 H new ATOM 0 HA HIS A 117 5.583 -3.156 0.651 1.00 0.00 H new ATOM 0 HB2 HIS A 117 6.677 -2.473 2.609 1.00 0.00 H new ATOM 0 HB3 HIS A 117 7.857 -3.766 2.531 1.00 0.00 H new ATOM 0 HD2 HIS A 117 9.880 -3.328 0.436 1.00 0.00 H new ATOM 0 HE1 HIS A 117 9.290 0.872 0.477 1.00 0.00 H new ATOM 0 HE2 HIS A 117 10.827 -1.009 -0.284 1.00 0.00 H new ATOM 1704 N PHE A 118 6.826 -3.535 -1.441 1.00 0.00 N ATOM 1705 CA PHE A 118 7.501 -3.779 -2.709 1.00 0.00 C ATOM 1706 C PHE A 118 8.033 -2.478 -3.304 1.00 0.00 C ATOM 1707 O PHE A 118 7.323 -1.474 -3.360 1.00 0.00 O ATOM 1708 CB PHE A 118 6.545 -4.447 -3.698 1.00 0.00 C ATOM 1709 CG PHE A 118 6.407 -5.929 -3.499 1.00 0.00 C ATOM 1710 CD1 PHE A 118 7.312 -6.806 -4.075 1.00 0.00 C ATOM 1711 CD2 PHE A 118 5.367 -6.445 -2.742 1.00 0.00 C ATOM 1712 CE1 PHE A 118 7.183 -8.170 -3.899 1.00 0.00 C ATOM 1713 CE2 PHE A 118 5.233 -7.809 -2.564 1.00 0.00 C ATOM 1714 CZ PHE A 118 6.141 -8.672 -3.144 1.00 0.00 C ATOM 0 H PHE A 118 6.050 -2.875 -1.495 1.00 0.00 H new ATOM 0 HA PHE A 118 8.344 -4.443 -2.519 1.00 0.00 H new ATOM 0 HB2 PHE A 118 5.562 -3.984 -3.608 1.00 0.00 H new ATOM 0 HB3 PHE A 118 6.895 -4.257 -4.713 1.00 0.00 H new ATOM 0 HD1 PHE A 118 8.127 -6.419 -4.668 1.00 0.00 H new ATOM 0 HD2 PHE A 118 4.654 -5.774 -2.286 1.00 0.00 H new ATOM 0 HE1 PHE A 118 7.896 -8.843 -4.351 1.00 0.00 H new ATOM 0 HE2 PHE A 118 4.419 -8.199 -1.972 1.00 0.00 H new ATOM 0 HZ PHE A 118 6.037 -9.738 -3.008 1.00 0.00 H new ATOM 1724 N PRO A 119 9.296 -2.479 -3.760 1.00 0.00 N ATOM 1725 CA PRO A 119 10.168 -3.639 -3.713 1.00 0.00 C ATOM 1726 C PRO A 119 10.987 -3.692 -2.428 1.00 0.00 C ATOM 1727 O PRO A 119 11.278 -2.660 -1.824 1.00 0.00 O ATOM 1728 CB PRO A 119 11.091 -3.451 -4.928 1.00 0.00 C ATOM 1729 CG PRO A 119 10.966 -1.994 -5.298 1.00 0.00 C ATOM 1730 CD PRO A 119 9.982 -1.343 -4.359 1.00 0.00 C ATOM 0 HA PRO A 119 9.603 -4.571 -3.734 1.00 0.00 H new ATOM 0 HB2 PRO A 119 12.122 -3.708 -4.683 1.00 0.00 H new ATOM 0 HB3 PRO A 119 10.790 -4.094 -5.755 1.00 0.00 H new ATOM 0 HG2 PRO A 119 11.936 -1.502 -5.230 1.00 0.00 H new ATOM 0 HG3 PRO A 119 10.629 -1.893 -6.330 1.00 0.00 H new ATOM 0 HD2 PRO A 119 10.484 -0.734 -3.608 1.00 0.00 H new ATOM 0 HD3 PRO A 119 9.291 -0.689 -4.890 1.00 0.00 H new ATOM 1738 N PHE A 120 11.363 -4.899 -2.021 1.00 0.00 N ATOM 1739 CA PHE A 120 12.155 -5.083 -0.810 1.00 0.00 C ATOM 1740 C PHE A 120 13.598 -5.425 -1.160 1.00 0.00 C ATOM 1741 O PHE A 120 13.971 -5.446 -2.333 1.00 0.00 O ATOM 1742 CB PHE A 120 11.550 -6.182 0.068 1.00 0.00 C ATOM 1743 CG PHE A 120 11.449 -7.518 -0.613 1.00 0.00 C ATOM 1744 CD1 PHE A 120 10.506 -7.736 -1.605 1.00 0.00 C ATOM 1745 CD2 PHE A 120 12.293 -8.558 -0.257 1.00 0.00 C ATOM 1746 CE1 PHE A 120 10.408 -8.965 -2.230 1.00 0.00 C ATOM 1747 CE2 PHE A 120 12.200 -9.790 -0.877 1.00 0.00 C ATOM 1748 CZ PHE A 120 11.257 -9.992 -1.866 1.00 0.00 C ATOM 0 H PHE A 120 11.133 -5.764 -2.511 1.00 0.00 H new ATOM 0 HA PHE A 120 12.145 -4.147 -0.252 1.00 0.00 H new ATOM 0 HB2 PHE A 120 12.155 -6.289 0.968 1.00 0.00 H new ATOM 0 HB3 PHE A 120 10.555 -5.872 0.388 1.00 0.00 H new ATOM 0 HD1 PHE A 120 9.840 -6.936 -1.893 1.00 0.00 H new ATOM 0 HD2 PHE A 120 13.033 -8.404 0.515 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.669 -9.122 -3.002 1.00 0.00 H new ATOM 0 HE2 PHE A 120 12.863 -10.593 -0.589 1.00 0.00 H new ATOM 0 HZ PHE A 120 11.184 -10.952 -2.354 1.00 0.00 H new ATOM 1758 N LEU A 121 14.410 -5.687 -0.141 1.00 0.00 N ATOM 1759 CA LEU A 121 15.811 -6.022 -0.357 1.00 0.00 C ATOM 1760 C LEU A 121 16.181 -7.322 0.350 1.00 0.00 C ATOM 1761 O LEU A 121 16.182 -7.396 1.580 1.00 0.00 O ATOM 1762 CB LEU A 121 16.712 -4.875 0.120 1.00 0.00 C ATOM 1763 CG LEU A 121 18.218 -5.112 -0.038 1.00 0.00 C ATOM 1764 CD1 LEU A 121 18.688 -6.220 0.887 1.00 0.00 C ATOM 1765 CD2 LEU A 121 18.544 -5.438 -1.481 1.00 0.00 C ATOM 0 H LEU A 121 14.123 -5.674 0.838 1.00 0.00 H new ATOM 0 HA LEU A 121 15.964 -6.167 -1.426 1.00 0.00 H new ATOM 0 HB2 LEU A 121 16.444 -3.973 -0.429 1.00 0.00 H new ATOM 0 HB3 LEU A 121 16.500 -4.683 1.172 1.00 0.00 H new ATOM 0 HG LEU A 121 18.746 -4.200 0.239 1.00 0.00 H new ATOM 0 HD11 LEU A 121 19.760 -6.371 0.758 1.00 0.00 H new ATOM 0 HD12 LEU A 121 18.482 -5.943 1.921 1.00 0.00 H new ATOM 0 HD13 LEU A 121 18.160 -7.143 0.647 1.00 0.00 H new ATOM 0 HD21 LEU A 121 19.616 -5.605 -1.583 1.00 0.00 H new ATOM 0 HD22 LEU A 121 18.007 -6.338 -1.781 1.00 0.00 H new ATOM 0 HD23 LEU A 121 18.244 -4.606 -2.119 1.00 0.00 H new ATOM 1777 N TYR A 122 16.505 -8.341 -0.441 1.00 0.00 N ATOM 1778 CA TYR A 122 16.893 -9.642 0.096 1.00 0.00 C ATOM 1779 C TYR A 122 18.389 -9.857 -0.099 1.00 0.00 C ATOM 1780 O TYR A 122 18.895 -9.740 -1.215 1.00 0.00 O ATOM 1781 CB TYR A 122 16.109 -10.759 -0.595 1.00 0.00 C ATOM 1782 CG TYR A 122 16.505 -12.149 -0.147 1.00 0.00 C ATOM 1783 CD1 TYR A 122 17.773 -12.651 -0.412 1.00 0.00 C ATOM 1784 CD2 TYR A 122 15.609 -12.958 0.539 1.00 0.00 C ATOM 1785 CE1 TYR A 122 18.135 -13.921 -0.004 1.00 0.00 C ATOM 1786 CE2 TYR A 122 15.964 -14.228 0.949 1.00 0.00 C ATOM 1787 CZ TYR A 122 17.228 -14.706 0.675 1.00 0.00 C ATOM 1788 OH TYR A 122 17.586 -15.970 1.083 1.00 0.00 O ATOM 0 H TYR A 122 16.506 -8.290 -1.460 1.00 0.00 H new ATOM 0 HA TYR A 122 16.664 -9.664 1.161 1.00 0.00 H new ATOM 0 HB2 TYR A 122 15.045 -10.615 -0.405 1.00 0.00 H new ATOM 0 HB3 TYR A 122 16.254 -10.679 -1.672 1.00 0.00 H new ATOM 0 HD1 TYR A 122 18.486 -12.040 -0.945 1.00 0.00 H new ATOM 0 HD2 TYR A 122 14.618 -12.588 0.756 1.00 0.00 H new ATOM 0 HE1 TYR A 122 19.125 -14.297 -0.216 1.00 0.00 H new ATOM 0 HE2 TYR A 122 15.255 -14.844 1.482 1.00 0.00 H new ATOM 0 HH TYR A 122 16.832 -16.389 1.548 1.00 0.00 H new ATOM 1798 N ASN A 123 19.100 -10.153 0.985 1.00 0.00 N ATOM 1799 CA ASN A 123 20.541 -10.355 0.900 1.00 0.00 C ATOM 1800 C ASN A 123 21.138 -9.313 -0.035 1.00 0.00 C ATOM 1801 O ASN A 123 21.792 -9.645 -1.023 1.00 0.00 O ATOM 1802 CB ASN A 123 20.859 -11.764 0.397 1.00 0.00 C ATOM 1803 CG ASN A 123 22.146 -12.311 0.982 1.00 0.00 C ATOM 1804 OD1 ASN A 123 23.240 -11.890 0.607 1.00 0.00 O ATOM 1805 ND2 ASN A 123 22.020 -13.257 1.906 1.00 0.00 N ATOM 0 H ASN A 123 18.708 -10.257 1.921 1.00 0.00 H new ATOM 0 HA ASN A 123 20.977 -10.245 1.893 1.00 0.00 H new ATOM 0 HB2 ASN A 123 20.036 -12.432 0.651 1.00 0.00 H new ATOM 0 HB3 ASN A 123 20.935 -11.750 -0.690 1.00 0.00 H new ATOM 0 HD21 ASN A 123 22.851 -13.665 2.335 1.00 0.00 H new ATOM 0 HD22 ASN A 123 21.093 -13.576 2.186 1.00 0.00 H new ATOM 1812 N ASN A 124 20.871 -8.048 0.275 1.00 0.00 N ATOM 1813 CA ASN A 124 21.341 -6.938 -0.541 1.00 0.00 C ATOM 1814 C ASN A 124 21.016 -7.189 -2.009 1.00 0.00 C ATOM 1815 O ASN A 124 21.803 -6.872 -2.902 1.00 0.00 O ATOM 1816 CB ASN A 124 22.841 -6.712 -0.355 1.00 0.00 C ATOM 1817 CG ASN A 124 23.624 -8.008 -0.289 1.00 0.00 C ATOM 1818 OD1 ASN A 124 23.970 -8.590 -1.316 1.00 0.00 O ATOM 1819 ND2 ASN A 124 23.907 -8.467 0.924 1.00 0.00 N ATOM 0 H ASN A 124 20.328 -7.767 1.091 1.00 0.00 H new ATOM 0 HA ASN A 124 20.825 -6.035 -0.216 1.00 0.00 H new ATOM 0 HB2 ASN A 124 23.218 -6.106 -1.179 1.00 0.00 H new ATOM 0 HB3 ASN A 124 23.008 -6.144 0.560 1.00 0.00 H new ATOM 0 HD21 ASN A 124 24.431 -9.335 1.031 1.00 0.00 H new ATOM 0 HD22 ASN A 124 23.600 -7.951 1.749 1.00 0.00 H new ATOM 1826 N HIS A 125 19.834 -7.746 -2.242 1.00 0.00 N ATOM 1827 CA HIS A 125 19.359 -8.032 -3.589 1.00 0.00 C ATOM 1828 C HIS A 125 17.946 -7.486 -3.762 1.00 0.00 C ATOM 1829 O HIS A 125 16.969 -8.234 -3.720 1.00 0.00 O ATOM 1830 CB HIS A 125 19.379 -9.540 -3.854 1.00 0.00 C ATOM 1831 CG HIS A 125 19.313 -9.892 -5.308 1.00 0.00 C ATOM 1832 ND1 HIS A 125 20.110 -10.858 -5.886 1.00 0.00 N ATOM 1833 CD2 HIS A 125 18.538 -9.402 -6.304 1.00 0.00 C ATOM 1834 CE1 HIS A 125 19.830 -10.946 -7.174 1.00 0.00 C ATOM 1835 NE2 HIS A 125 18.878 -10.074 -7.452 1.00 0.00 N ATOM 0 H HIS A 125 19.180 -8.011 -1.505 1.00 0.00 H new ATOM 0 HA HIS A 125 20.020 -7.548 -4.307 1.00 0.00 H new ATOM 0 HB2 HIS A 125 20.288 -9.964 -3.427 1.00 0.00 H new ATOM 0 HB3 HIS A 125 18.538 -10.003 -3.338 1.00 0.00 H new ATOM 0 HD2 HIS A 125 17.791 -8.627 -6.213 1.00 0.00 H new ATOM 0 HE1 HIS A 125 20.299 -11.616 -7.879 1.00 0.00 H new ATOM 0 HE2 HIS A 125 18.462 -9.924 -8.371 1.00 0.00 H new ATOM 1844 N ASN A 126 17.847 -6.169 -3.927 1.00 0.00 N ATOM 1845 CA ASN A 126 16.550 -5.514 -4.079 1.00 0.00 C ATOM 1846 C ASN A 126 15.591 -6.384 -4.886 1.00 0.00 C ATOM 1847 O ASN A 126 15.804 -6.621 -6.076 1.00 0.00 O ATOM 1848 CB ASN A 126 16.692 -4.140 -4.749 1.00 0.00 C ATOM 1849 CG ASN A 126 18.097 -3.846 -5.241 1.00 0.00 C ATOM 1850 OD1 ASN A 126 18.582 -4.479 -6.179 1.00 0.00 O ATOM 1851 ND2 ASN A 126 18.753 -2.880 -4.602 1.00 0.00 N ATOM 0 H ASN A 126 18.646 -5.536 -3.959 1.00 0.00 H new ATOM 0 HA ASN A 126 16.142 -5.370 -3.079 1.00 0.00 H new ATOM 0 HB2 ASN A 126 16.002 -4.083 -5.591 1.00 0.00 H new ATOM 0 HB3 ASN A 126 16.395 -3.367 -4.040 1.00 0.00 H new ATOM 0 HD22 ASN A 126 18.307 -2.385 -3.830 1.00 0.00 H new ATOM 1857 N TYR A 127 14.532 -6.852 -4.233 1.00 0.00 N ATOM 1858 CA TYR A 127 13.537 -7.693 -4.890 1.00 0.00 C ATOM 1859 C TYR A 127 12.272 -6.896 -5.194 1.00 0.00 C ATOM 1860 O TYR A 127 12.058 -5.818 -4.639 1.00 0.00 O ATOM 1861 CB TYR A 127 13.194 -8.898 -4.011 1.00 0.00 C ATOM 1862 CG TYR A 127 13.949 -10.154 -4.380 1.00 0.00 C ATOM 1863 CD1 TYR A 127 15.192 -10.427 -3.826 1.00 0.00 C ATOM 1864 CD2 TYR A 127 13.418 -11.067 -5.283 1.00 0.00 C ATOM 1865 CE1 TYR A 127 15.887 -11.575 -4.161 1.00 0.00 C ATOM 1866 CE2 TYR A 127 14.105 -12.216 -5.623 1.00 0.00 C ATOM 1867 CZ TYR A 127 15.339 -12.465 -5.059 1.00 0.00 C ATOM 1868 OH TYR A 127 16.026 -13.608 -5.396 1.00 0.00 O ATOM 0 H TYR A 127 14.341 -6.663 -3.249 1.00 0.00 H new ATOM 0 HA TYR A 127 13.960 -8.048 -5.830 1.00 0.00 H new ATOM 0 HB2 TYR A 127 13.406 -8.650 -2.971 1.00 0.00 H new ATOM 0 HB3 TYR A 127 12.124 -9.094 -4.080 1.00 0.00 H new ATOM 0 HD1 TYR A 127 15.624 -9.731 -3.122 1.00 0.00 H new ATOM 0 HD2 TYR A 127 12.452 -10.875 -5.726 1.00 0.00 H new ATOM 0 HE1 TYR A 127 16.853 -11.773 -3.721 1.00 0.00 H new ATOM 0 HE2 TYR A 127 13.678 -12.916 -6.327 1.00 0.00 H new ATOM 0 HH TYR A 127 15.501 -14.128 -6.040 1.00 0.00 H new ATOM 1878 N THR A 128 11.436 -7.431 -6.079 1.00 0.00 N ATOM 1879 CA THR A 128 10.194 -6.764 -6.453 1.00 0.00 C ATOM 1880 C THR A 128 9.110 -7.773 -6.810 1.00 0.00 C ATOM 1881 O THR A 128 8.267 -7.515 -7.670 1.00 0.00 O ATOM 1882 CB THR A 128 10.405 -5.810 -7.643 1.00 0.00 C ATOM 1883 OG1 THR A 128 11.751 -5.321 -7.648 1.00 0.00 O ATOM 1884 CG2 THR A 128 9.436 -4.638 -7.576 1.00 0.00 C ATOM 0 H THR A 128 11.596 -8.322 -6.549 1.00 0.00 H new ATOM 0 HA THR A 128 9.874 -6.186 -5.586 1.00 0.00 H new ATOM 0 HB THR A 128 10.217 -6.366 -8.562 1.00 0.00 H new ATOM 0 HG1 THR A 128 11.877 -4.716 -8.409 1.00 0.00 H new ATOM 0 HG21 THR A 128 9.604 -3.978 -8.427 1.00 0.00 H new ATOM 0 HG22 THR A 128 8.412 -5.011 -7.602 1.00 0.00 H new ATOM 0 HG23 THR A 128 9.597 -4.085 -6.651 1.00 0.00 H new ATOM 1892 N ASP A 129 9.133 -8.921 -6.143 1.00 0.00 N ATOM 1893 CA ASP A 129 8.146 -9.966 -6.388 1.00 0.00 C ATOM 1894 C ASP A 129 8.216 -11.044 -5.316 1.00 0.00 C ATOM 1895 O ASP A 129 9.299 -11.434 -4.881 1.00 0.00 O ATOM 1896 CB ASP A 129 8.358 -10.586 -7.770 1.00 0.00 C ATOM 1897 CG ASP A 129 7.224 -11.510 -8.170 1.00 0.00 C ATOM 1898 OD1 ASP A 129 6.061 -11.054 -8.177 1.00 0.00 O ATOM 1899 OD2 ASP A 129 7.498 -12.688 -8.477 1.00 0.00 O ATOM 0 H ASP A 129 9.824 -9.152 -5.429 1.00 0.00 H new ATOM 0 HA ASP A 129 7.157 -9.510 -6.352 1.00 0.00 H new ATOM 0 HB2 ASP A 129 8.454 -9.792 -8.510 1.00 0.00 H new ATOM 0 HB3 ASP A 129 9.295 -11.142 -7.776 1.00 0.00 H new ATOM 1904 N CYS A 130 7.049 -11.521 -4.892 1.00 0.00 N ATOM 1905 CA CYS A 130 6.972 -12.553 -3.868 1.00 0.00 C ATOM 1906 C CYS A 130 7.936 -13.694 -4.176 1.00 0.00 C ATOM 1907 O CYS A 130 7.568 -14.676 -4.821 1.00 0.00 O ATOM 1908 CB CYS A 130 5.544 -13.091 -3.761 1.00 0.00 C ATOM 1909 SG CYS A 130 4.259 -11.800 -3.812 1.00 0.00 S ATOM 0 H CYS A 130 6.144 -11.208 -5.243 1.00 0.00 H new ATOM 0 HA CYS A 130 7.256 -12.107 -2.915 1.00 0.00 H new ATOM 0 HB2 CYS A 130 5.370 -13.795 -4.575 1.00 0.00 H new ATOM 0 HB3 CYS A 130 5.446 -13.650 -2.830 1.00 0.00 H new ATOM 1914 N THR A 131 9.172 -13.554 -3.711 1.00 0.00 N ATOM 1915 CA THR A 131 10.193 -14.569 -3.937 1.00 0.00 C ATOM 1916 C THR A 131 9.967 -15.786 -3.045 1.00 0.00 C ATOM 1917 O THR A 131 9.392 -15.677 -1.962 1.00 0.00 O ATOM 1918 CB THR A 131 11.606 -14.014 -3.679 1.00 0.00 C ATOM 1919 OG1 THR A 131 12.589 -15.014 -3.975 1.00 0.00 O ATOM 1920 CG2 THR A 131 11.755 -13.564 -2.232 1.00 0.00 C ATOM 0 H THR A 131 9.491 -12.747 -3.175 1.00 0.00 H new ATOM 0 HA THR A 131 10.114 -14.868 -4.982 1.00 0.00 H new ATOM 0 HB THR A 131 11.757 -13.153 -4.330 1.00 0.00 H new ATOM 0 HG1 THR A 131 13.484 -14.652 -3.810 1.00 0.00 H new ATOM 0 HG21 THR A 131 12.761 -13.176 -2.073 1.00 0.00 H new ATOM 0 HG22 THR A 131 11.026 -12.782 -2.017 1.00 0.00 H new ATOM 0 HG23 THR A 131 11.584 -14.411 -1.568 1.00 0.00 H new ATOM 1928 N SER A 132 10.424 -16.945 -3.509 1.00 0.00 N ATOM 1929 CA SER A 132 10.270 -18.184 -2.756 1.00 0.00 C ATOM 1930 C SER A 132 11.605 -18.638 -2.169 1.00 0.00 C ATOM 1931 O SER A 132 11.662 -19.609 -1.414 1.00 0.00 O ATOM 1932 CB SER A 132 9.695 -19.281 -3.652 1.00 0.00 C ATOM 1933 OG SER A 132 8.281 -19.212 -3.702 1.00 0.00 O ATOM 0 H SER A 132 10.904 -17.052 -4.403 1.00 0.00 H new ATOM 0 HA SER A 132 9.579 -17.995 -1.934 1.00 0.00 H new ATOM 0 HB2 SER A 132 10.102 -19.183 -4.658 1.00 0.00 H new ATOM 0 HB3 SER A 132 10.001 -20.258 -3.278 1.00 0.00 H new ATOM 0 HG SER A 132 7.939 -19.923 -4.283 1.00 0.00 H new ATOM 1939 N GLU A 133 12.674 -17.932 -2.521 1.00 0.00 N ATOM 1940 CA GLU A 133 14.006 -18.267 -2.028 1.00 0.00 C ATOM 1941 C GLU A 133 13.975 -18.556 -0.531 1.00 0.00 C ATOM 1942 O GLU A 133 13.959 -17.636 0.288 1.00 0.00 O ATOM 1943 CB GLU A 133 14.983 -17.126 -2.320 1.00 0.00 C ATOM 1944 CG GLU A 133 16.181 -17.550 -3.153 1.00 0.00 C ATOM 1945 CD GLU A 133 17.424 -16.739 -2.843 1.00 0.00 C ATOM 1946 OE1 GLU A 133 17.310 -15.501 -2.724 1.00 0.00 O ATOM 1947 OE2 GLU A 133 18.510 -17.340 -2.718 1.00 0.00 O ATOM 0 H GLU A 133 12.645 -17.125 -3.145 1.00 0.00 H new ATOM 0 HA GLU A 133 14.343 -19.165 -2.546 1.00 0.00 H new ATOM 0 HB2 GLU A 133 14.453 -16.329 -2.841 1.00 0.00 H new ATOM 0 HB3 GLU A 133 15.336 -16.710 -1.376 1.00 0.00 H new ATOM 0 HG2 GLU A 133 16.387 -18.606 -2.975 1.00 0.00 H new ATOM 0 HG3 GLU A 133 15.938 -17.446 -4.211 1.00 0.00 H new ATOM 1954 N GLY A 134 13.969 -19.837 -0.179 1.00 0.00 N ATOM 1955 CA GLY A 134 13.942 -20.222 1.219 1.00 0.00 C ATOM 1956 C GLY A 134 12.863 -21.245 1.520 1.00 0.00 C ATOM 1957 O GLY A 134 12.670 -21.631 2.673 1.00 0.00 O ATOM 0 H GLY A 134 13.982 -20.616 -0.838 1.00 0.00 H new ATOM 0 HA2 GLY A 134 14.913 -20.630 1.499 1.00 0.00 H new ATOM 0 HA3 GLY A 134 13.780 -19.336 1.833 1.00 0.00 H new ATOM 1961 N ARG A 135 12.160 -21.686 0.483 1.00 0.00 N ATOM 1962 CA ARG A 135 11.097 -22.670 0.643 1.00 0.00 C ATOM 1963 C ARG A 135 10.957 -23.531 -0.606 1.00 0.00 C ATOM 1964 O ARG A 135 11.251 -24.727 -0.586 1.00 0.00 O ATOM 1965 CB ARG A 135 9.769 -21.972 0.948 1.00 0.00 C ATOM 1966 CG ARG A 135 9.934 -20.640 1.661 1.00 0.00 C ATOM 1967 CD ARG A 135 8.590 -20.038 2.039 1.00 0.00 C ATOM 1968 NE ARG A 135 7.514 -20.511 1.173 1.00 0.00 N ATOM 1969 CZ ARG A 135 7.469 -20.284 -0.136 1.00 0.00 C ATOM 1970 NH1 ARG A 135 8.435 -19.591 -0.725 1.00 0.00 N ATOM 1971 NH2 ARG A 135 6.460 -20.751 -0.857 1.00 0.00 N ATOM 0 H ARG A 135 12.307 -21.377 -0.478 1.00 0.00 H new ATOM 0 HA ARG A 135 11.360 -23.318 1.479 1.00 0.00 H new ATOM 0 HB2 ARG A 135 9.229 -21.811 0.015 1.00 0.00 H new ATOM 0 HB3 ARG A 135 9.154 -22.630 1.562 1.00 0.00 H new ATOM 0 HG2 ARG A 135 10.536 -20.779 2.559 1.00 0.00 H new ATOM 0 HG3 ARG A 135 10.476 -19.947 1.018 1.00 0.00 H new ATOM 0 HD2 ARG A 135 8.359 -20.289 3.074 1.00 0.00 H new ATOM 0 HD3 ARG A 135 8.651 -18.951 1.981 1.00 0.00 H new ATOM 0 HE ARG A 135 6.755 -21.045 1.596 1.00 0.00 H new ATOM 0 HH11 ARG A 135 9.214 -19.231 -0.173 1.00 0.00 H new ATOM 0 HH12 ARG A 135 8.399 -19.418 -1.730 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.716 -21.285 -0.408 1.00 0.00 H new ATOM 0 HH22 ARG A 135 6.427 -20.576 -1.861 1.00 0.00 H new ATOM 1985 N ARG A 136 10.505 -22.913 -1.689 1.00 0.00 N ATOM 1986 CA ARG A 136 10.323 -23.616 -2.954 1.00 0.00 C ATOM 1987 C ARG A 136 8.960 -24.299 -3.007 1.00 0.00 C ATOM 1988 O ARG A 136 8.736 -25.197 -3.818 1.00 0.00 O ATOM 1989 CB ARG A 136 11.433 -24.652 -3.151 1.00 0.00 C ATOM 1990 CG ARG A 136 11.999 -24.676 -4.562 1.00 0.00 C ATOM 1991 CD ARG A 136 10.897 -24.795 -5.603 1.00 0.00 C ATOM 1992 NE ARG A 136 11.315 -24.280 -6.903 1.00 0.00 N ATOM 1993 CZ ARG A 136 12.166 -24.910 -7.706 1.00 0.00 C ATOM 1994 NH1 ARG A 136 12.688 -26.073 -7.341 1.00 0.00 N ATOM 1995 NH2 ARG A 136 12.497 -24.377 -8.874 1.00 0.00 N ATOM 0 H ARG A 136 10.257 -21.924 -1.718 1.00 0.00 H new ATOM 0 HA ARG A 136 10.373 -22.882 -3.758 1.00 0.00 H new ATOM 0 HB2 ARG A 136 12.240 -24.446 -2.448 1.00 0.00 H new ATOM 0 HB3 ARG A 136 11.043 -25.641 -2.908 1.00 0.00 H new ATOM 0 HG2 ARG A 136 12.573 -23.767 -4.740 1.00 0.00 H new ATOM 0 HG3 ARG A 136 12.689 -25.513 -4.664 1.00 0.00 H new ATOM 0 HD2 ARG A 136 10.605 -25.840 -5.704 1.00 0.00 H new ATOM 0 HD3 ARG A 136 10.017 -24.250 -5.263 1.00 0.00 H new ATOM 0 HE ARG A 136 10.933 -23.387 -7.213 1.00 0.00 H new ATOM 0 HH11 ARG A 136 12.436 -26.485 -6.443 1.00 0.00 H new ATOM 0 HH12 ARG A 136 13.341 -26.555 -7.959 1.00 0.00 H new ATOM 0 HH21 ARG A 136 12.098 -23.482 -9.157 1.00 0.00 H new ATOM 0 HH22 ARG A 136 13.150 -24.862 -9.489 1.00 0.00 H new ATOM 2009 N ASP A 137 8.054 -23.865 -2.136 1.00 0.00 N ATOM 2010 CA ASP A 137 6.712 -24.434 -2.085 1.00 0.00 C ATOM 2011 C ASP A 137 5.695 -23.482 -2.704 1.00 0.00 C ATOM 2012 O ASP A 137 6.021 -22.345 -3.043 1.00 0.00 O ATOM 2013 CB ASP A 137 6.322 -24.743 -0.638 1.00 0.00 C ATOM 2014 CG ASP A 137 6.174 -23.490 0.201 1.00 0.00 C ATOM 2015 OD1 ASP A 137 7.192 -22.800 0.423 1.00 0.00 O ATOM 2016 OD2 ASP A 137 5.040 -23.197 0.637 1.00 0.00 O ATOM 0 H ASP A 137 8.224 -23.123 -1.457 1.00 0.00 H new ATOM 0 HA ASP A 137 6.714 -25.360 -2.660 1.00 0.00 H new ATOM 0 HB2 ASP A 137 5.383 -25.297 -0.628 1.00 0.00 H new ATOM 0 HB3 ASP A 137 7.078 -25.389 -0.191 1.00 0.00 H new ATOM 2021 N ASN A 138 4.462 -23.956 -2.852 1.00 0.00 N ATOM 2022 CA ASN A 138 3.398 -23.153 -3.432 1.00 0.00 C ATOM 2023 C ASN A 138 2.925 -22.074 -2.460 1.00 0.00 C ATOM 2024 O ASN A 138 1.735 -21.974 -2.164 1.00 0.00 O ATOM 2025 CB ASN A 138 2.222 -24.042 -3.835 1.00 0.00 C ATOM 2026 CG ASN A 138 1.654 -23.673 -5.192 1.00 0.00 C ATOM 2027 OD1 ASN A 138 0.548 -23.142 -5.291 1.00 0.00 O ATOM 2028 ND2 ASN A 138 2.412 -23.952 -6.246 1.00 0.00 N ATOM 0 H ASN A 138 4.177 -24.896 -2.576 1.00 0.00 H new ATOM 0 HA ASN A 138 3.797 -22.661 -4.319 1.00 0.00 H new ATOM 0 HB2 ASN A 138 2.546 -25.083 -3.851 1.00 0.00 H new ATOM 0 HB3 ASN A 138 1.437 -23.964 -3.083 1.00 0.00 H new ATOM 0 HD21 ASN A 138 2.084 -23.725 -7.185 1.00 0.00 H new ATOM 0 HD22 ASN A 138 3.323 -24.393 -6.117 1.00 0.00 H new ATOM 2035 N MET A 139 3.862 -21.268 -1.970 1.00 0.00 N ATOM 2036 CA MET A 139 3.532 -20.197 -1.034 1.00 0.00 C ATOM 2037 C MET A 139 4.468 -19.007 -1.218 1.00 0.00 C ATOM 2038 O MET A 139 5.269 -18.693 -0.338 1.00 0.00 O ATOM 2039 CB MET A 139 3.613 -20.707 0.406 1.00 0.00 C ATOM 2040 CG MET A 139 2.546 -20.122 1.318 1.00 0.00 C ATOM 2041 SD MET A 139 2.644 -20.760 3.001 1.00 0.00 S ATOM 2042 CE MET A 139 1.087 -21.636 3.122 1.00 0.00 C ATOM 0 H MET A 139 4.853 -21.335 -2.204 1.00 0.00 H new ATOM 0 HA MET A 139 2.513 -19.870 -1.239 1.00 0.00 H new ATOM 0 HB2 MET A 139 3.522 -21.793 0.404 1.00 0.00 H new ATOM 0 HB3 MET A 139 4.596 -20.470 0.812 1.00 0.00 H new ATOM 0 HG2 MET A 139 2.647 -19.037 1.339 1.00 0.00 H new ATOM 0 HG3 MET A 139 1.561 -20.343 0.907 1.00 0.00 H new ATOM 0 HE1 MET A 139 0.999 -22.088 4.110 1.00 0.00 H new ATOM 0 HE2 MET A 139 0.264 -20.938 2.968 1.00 0.00 H new ATOM 0 HE3 MET A 139 1.048 -22.416 2.362 1.00 0.00 H new ATOM 2052 N LYS A 140 4.360 -18.347 -2.367 1.00 0.00 N ATOM 2053 CA LYS A 140 5.196 -17.191 -2.666 1.00 0.00 C ATOM 2054 C LYS A 140 5.149 -16.176 -1.528 1.00 0.00 C ATOM 2055 O LYS A 140 4.088 -15.905 -0.968 1.00 0.00 O ATOM 2056 CB LYS A 140 4.743 -16.532 -3.971 1.00 0.00 C ATOM 2057 CG LYS A 140 5.696 -16.767 -5.133 1.00 0.00 C ATOM 2058 CD LYS A 140 5.404 -15.825 -6.290 1.00 0.00 C ATOM 2059 CE LYS A 140 6.015 -16.331 -7.587 1.00 0.00 C ATOM 2060 NZ LYS A 140 7.388 -15.796 -7.802 1.00 0.00 N ATOM 0 H LYS A 140 3.701 -18.594 -3.106 1.00 0.00 H new ATOM 0 HA LYS A 140 6.224 -17.537 -2.778 1.00 0.00 H new ATOM 0 HB2 LYS A 140 3.757 -16.913 -4.238 1.00 0.00 H new ATOM 0 HB3 LYS A 140 4.638 -15.459 -3.809 1.00 0.00 H new ATOM 0 HG2 LYS A 140 6.723 -16.625 -4.797 1.00 0.00 H new ATOM 0 HG3 LYS A 140 5.611 -17.799 -5.472 1.00 0.00 H new ATOM 0 HD2 LYS A 140 4.326 -15.719 -6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 140 5.798 -14.835 -6.063 1.00 0.00 H new ATOM 0 HE2 LYS A 140 6.049 -17.420 -7.571 1.00 0.00 H new ATOM 0 HE3 LYS A 140 5.379 -16.044 -8.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 7.839 -16.303 -8.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 7.334 -14.782 -8.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 7.951 -15.929 -6.938 1.00 0.00 H new ATOM 2074 N TRP A 141 6.308 -15.619 -1.191 1.00 0.00 N ATOM 2075 CA TRP A 141 6.398 -14.635 -0.119 1.00 0.00 C ATOM 2076 C TRP A 141 7.280 -13.459 -0.529 1.00 0.00 C ATOM 2077 O TRP A 141 7.976 -13.515 -1.544 1.00 0.00 O ATOM 2078 CB TRP A 141 6.953 -15.284 1.151 1.00 0.00 C ATOM 2079 CG TRP A 141 8.379 -15.720 1.018 1.00 0.00 C ATOM 2080 CD1 TRP A 141 8.829 -16.977 0.734 1.00 0.00 C ATOM 2081 CD2 TRP A 141 9.544 -14.900 1.165 1.00 0.00 C ATOM 2082 NE1 TRP A 141 10.203 -16.989 0.696 1.00 0.00 N ATOM 2083 CE2 TRP A 141 10.665 -15.725 0.956 1.00 0.00 C ATOM 2084 CE3 TRP A 141 9.747 -13.547 1.453 1.00 0.00 C ATOM 2085 CZ2 TRP A 141 11.968 -15.241 1.025 1.00 0.00 C ATOM 2086 CZ3 TRP A 141 11.042 -13.068 1.521 1.00 0.00 C ATOM 2087 CH2 TRP A 141 12.137 -13.913 1.307 1.00 0.00 C ATOM 0 H TRP A 141 7.197 -15.832 -1.644 1.00 0.00 H new ATOM 0 HA TRP A 141 5.394 -14.260 0.080 1.00 0.00 H new ATOM 0 HB2 TRP A 141 6.872 -14.578 1.977 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.339 -16.147 1.408 1.00 0.00 H new ATOM 0 HD1 TRP A 141 8.198 -17.837 0.564 1.00 0.00 H new ATOM 0 HE1 TRP A 141 10.784 -17.805 0.505 1.00 0.00 H new ATOM 0 HE3 TRP A 141 8.908 -12.888 1.619 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 12.815 -15.890 0.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 11.212 -12.025 1.743 1.00 0.00 H new ATOM 0 HH2 TRP A 141 13.137 -13.508 1.366 1.00 0.00 H new ATOM 2098 N CYS A 142 7.245 -12.397 0.269 1.00 0.00 N ATOM 2099 CA CYS A 142 8.039 -11.206 -0.008 1.00 0.00 C ATOM 2100 C CYS A 142 8.470 -10.526 1.286 1.00 0.00 C ATOM 2101 O CYS A 142 8.048 -10.916 2.375 1.00 0.00 O ATOM 2102 CB CYS A 142 7.242 -10.225 -0.868 1.00 0.00 C ATOM 2103 SG CYS A 142 5.487 -10.083 -0.401 1.00 0.00 S ATOM 0 H CYS A 142 6.675 -12.337 1.113 1.00 0.00 H new ATOM 0 HA CYS A 142 8.932 -11.515 -0.551 1.00 0.00 H new ATOM 0 HB2 CYS A 142 7.705 -9.241 -0.802 1.00 0.00 H new ATOM 0 HB3 CYS A 142 7.305 -10.538 -1.910 1.00 0.00 H new ATOM 2108 N GLY A 143 9.308 -9.503 1.159 1.00 0.00 N ATOM 2109 CA GLY A 143 9.777 -8.781 2.325 1.00 0.00 C ATOM 2110 C GLY A 143 8.797 -7.716 2.774 1.00 0.00 C ATOM 2111 O GLY A 143 8.311 -6.930 1.962 1.00 0.00 O ATOM 0 H GLY A 143 9.670 -9.161 0.269 1.00 0.00 H new ATOM 0 HA2 GLY A 143 9.946 -9.484 3.141 1.00 0.00 H new ATOM 0 HA3 GLY A 143 10.737 -8.317 2.100 1.00 0.00 H new ATOM 2115 N THR A 144 8.506 -7.693 4.070 1.00 0.00 N ATOM 2116 CA THR A 144 7.577 -6.716 4.624 1.00 0.00 C ATOM 2117 C THR A 144 8.215 -5.333 4.715 1.00 0.00 C ATOM 2118 O THR A 144 7.585 -4.377 5.165 1.00 0.00 O ATOM 2119 CB THR A 144 7.088 -7.138 6.021 1.00 0.00 C ATOM 2120 OG1 THR A 144 8.200 -7.553 6.824 1.00 0.00 O ATOM 2121 CG2 THR A 144 6.079 -8.271 5.920 1.00 0.00 C ATOM 0 H THR A 144 8.899 -8.338 4.755 1.00 0.00 H new ATOM 0 HA THR A 144 6.725 -6.672 3.946 1.00 0.00 H new ATOM 0 HB THR A 144 6.603 -6.280 6.487 1.00 0.00 H new ATOM 0 HG1 THR A 144 9.025 -7.164 6.466 1.00 0.00 H new ATOM 0 HG21 THR A 144 5.747 -8.553 6.919 1.00 0.00 H new ATOM 0 HG22 THR A 144 5.222 -7.943 5.332 1.00 0.00 H new ATOM 0 HG23 THR A 144 6.544 -9.130 5.436 1.00 0.00 H new ATOM 2129 N THR A 145 9.469 -5.234 4.285 1.00 0.00 N ATOM 2130 CA THR A 145 10.192 -3.970 4.316 1.00 0.00 C ATOM 2131 C THR A 145 11.193 -3.886 3.168 1.00 0.00 C ATOM 2132 O THR A 145 11.459 -4.878 2.491 1.00 0.00 O ATOM 2133 CB THR A 145 10.938 -3.784 5.651 1.00 0.00 C ATOM 2134 OG1 THR A 145 12.113 -4.604 5.675 1.00 0.00 O ATOM 2135 CG2 THR A 145 10.040 -4.140 6.827 1.00 0.00 C ATOM 0 H THR A 145 10.005 -6.017 3.910 1.00 0.00 H new ATOM 0 HA THR A 145 9.453 -3.176 4.210 1.00 0.00 H new ATOM 0 HB THR A 145 11.226 -2.736 5.738 1.00 0.00 H new ATOM 0 HG1 THR A 145 12.582 -4.478 6.526 1.00 0.00 H new ATOM 0 HG21 THR A 145 10.588 -4.001 7.759 1.00 0.00 H new ATOM 0 HG22 THR A 145 9.162 -3.494 6.823 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.726 -5.180 6.743 1.00 0.00 H new ATOM 2143 N GLN A 146 11.745 -2.696 2.955 1.00 0.00 N ATOM 2144 CA GLN A 146 12.716 -2.485 1.886 1.00 0.00 C ATOM 2145 C GLN A 146 13.910 -3.422 2.042 1.00 0.00 C ATOM 2146 O GLN A 146 14.685 -3.618 1.105 1.00 0.00 O ATOM 2147 CB GLN A 146 13.189 -1.031 1.879 1.00 0.00 C ATOM 2148 CG GLN A 146 14.460 -0.809 1.075 1.00 0.00 C ATOM 2149 CD GLN A 146 14.426 0.476 0.271 1.00 0.00 C ATOM 2150 OE1 GLN A 146 14.450 0.453 -0.959 1.00 0.00 O ATOM 2151 NE2 GLN A 146 14.369 1.606 0.966 1.00 0.00 N ATOM 0 H GLN A 146 11.537 -1.864 3.507 1.00 0.00 H new ATOM 0 HA GLN A 146 12.228 -2.705 0.936 1.00 0.00 H new ATOM 0 HB2 GLN A 146 12.397 -0.402 1.472 1.00 0.00 H new ATOM 0 HB3 GLN A 146 13.357 -0.707 2.906 1.00 0.00 H new ATOM 0 HG2 GLN A 146 15.314 -0.787 1.752 1.00 0.00 H new ATOM 0 HG3 GLN A 146 14.610 -1.651 0.400 1.00 0.00 H new ATOM 0 HE21 GLN A 146 14.351 1.577 1.985 1.00 0.00 H new ATOM 0 HE22 GLN A 146 14.343 2.503 0.480 1.00 0.00 H new ATOM 2160 N ASN A 147 14.051 -4.000 3.231 1.00 0.00 N ATOM 2161 CA ASN A 147 15.149 -4.918 3.512 1.00 0.00 C ATOM 2162 C ASN A 147 14.665 -6.089 4.362 1.00 0.00 C ATOM 2163 O ASN A 147 14.715 -6.041 5.591 1.00 0.00 O ATOM 2164 CB ASN A 147 16.283 -4.183 4.229 1.00 0.00 C ATOM 2165 CG ASN A 147 16.322 -2.707 3.885 1.00 0.00 C ATOM 2166 OD1 ASN A 147 15.316 -2.006 3.988 1.00 0.00 O ATOM 2167 ND2 ASN A 147 17.490 -2.227 3.474 1.00 0.00 N ATOM 0 H ASN A 147 13.418 -3.848 4.016 1.00 0.00 H new ATOM 0 HA ASN A 147 15.523 -5.307 2.565 1.00 0.00 H new ATOM 0 HB2 ASN A 147 16.164 -4.299 5.306 1.00 0.00 H new ATOM 0 HB3 ASN A 147 17.235 -4.641 3.962 1.00 0.00 H new ATOM 0 HD21 ASN A 147 17.578 -1.241 3.229 1.00 0.00 H new ATOM 0 HD22 ASN A 147 18.299 -2.845 3.403 1.00 0.00 H new ATOM 2174 N TYR A 148 14.195 -7.137 3.695 1.00 0.00 N ATOM 2175 CA TYR A 148 13.695 -8.321 4.383 1.00 0.00 C ATOM 2176 C TYR A 148 14.794 -8.977 5.215 1.00 0.00 C ATOM 2177 O TYR A 148 14.613 -9.232 6.407 1.00 0.00 O ATOM 2178 CB TYR A 148 13.136 -9.322 3.370 1.00 0.00 C ATOM 2179 CG TYR A 148 13.065 -10.741 3.885 1.00 0.00 C ATOM 2180 CD1 TYR A 148 12.432 -11.035 5.087 1.00 0.00 C ATOM 2181 CD2 TYR A 148 13.630 -11.787 3.168 1.00 0.00 C ATOM 2182 CE1 TYR A 148 12.365 -12.332 5.559 1.00 0.00 C ATOM 2183 CE2 TYR A 148 13.567 -13.086 3.633 1.00 0.00 C ATOM 2184 CZ TYR A 148 12.934 -13.354 4.828 1.00 0.00 C ATOM 2185 OH TYR A 148 12.870 -14.646 5.295 1.00 0.00 O ATOM 0 H TYR A 148 14.150 -7.191 2.677 1.00 0.00 H new ATOM 0 HA TYR A 148 12.897 -8.010 5.057 1.00 0.00 H new ATOM 0 HB2 TYR A 148 12.137 -9.003 3.073 1.00 0.00 H new ATOM 0 HB3 TYR A 148 13.756 -9.302 2.474 1.00 0.00 H new ATOM 0 HD1 TYR A 148 11.985 -10.237 5.661 1.00 0.00 H new ATOM 0 HD2 TYR A 148 14.127 -11.582 2.231 1.00 0.00 H new ATOM 0 HE1 TYR A 148 11.870 -12.544 6.495 1.00 0.00 H new ATOM 0 HE2 TYR A 148 14.012 -13.888 3.063 1.00 0.00 H new ATOM 0 HH TYR A 148 12.006 -14.793 5.733 1.00 0.00 H new ATOM 2195 N ASP A 149 15.930 -9.245 4.583 1.00 0.00 N ATOM 2196 CA ASP A 149 17.055 -9.871 5.270 1.00 0.00 C ATOM 2197 C ASP A 149 17.621 -8.945 6.341 1.00 0.00 C ATOM 2198 O ASP A 149 18.415 -9.365 7.182 1.00 0.00 O ATOM 2199 CB ASP A 149 18.150 -10.240 4.269 1.00 0.00 C ATOM 2200 CG ASP A 149 17.898 -11.580 3.604 1.00 0.00 C ATOM 2201 OD1 ASP A 149 16.973 -11.662 2.769 1.00 0.00 O ATOM 2202 OD2 ASP A 149 18.626 -12.545 3.918 1.00 0.00 O ATOM 0 H ASP A 149 16.097 -9.040 3.598 1.00 0.00 H new ATOM 0 HA ASP A 149 16.694 -10.779 5.753 1.00 0.00 H new ATOM 0 HB2 ASP A 149 18.216 -9.465 3.505 1.00 0.00 H new ATOM 0 HB3 ASP A 149 19.112 -10.267 4.781 1.00 0.00 H new ATOM 2207 N ALA A 150 17.206 -7.683 6.304 1.00 0.00 N ATOM 2208 CA ALA A 150 17.671 -6.698 7.272 1.00 0.00 C ATOM 2209 C ALA A 150 16.747 -6.644 8.484 1.00 0.00 C ATOM 2210 O ALA A 150 17.156 -6.239 9.572 1.00 0.00 O ATOM 2211 CB ALA A 150 17.771 -5.328 6.620 1.00 0.00 C ATOM 0 H ALA A 150 16.549 -7.319 5.614 1.00 0.00 H new ATOM 0 HA ALA A 150 18.661 -6.998 7.616 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.119 -4.601 7.353 1.00 0.00 H new ATOM 0 HB2 ALA A 150 18.475 -5.371 5.789 1.00 0.00 H new ATOM 0 HB3 ALA A 150 16.790 -5.029 6.250 1.00 0.00 H new ATOM 2217 N ASP A 151 15.499 -7.057 8.288 1.00 0.00 N ATOM 2218 CA ASP A 151 14.515 -7.058 9.365 1.00 0.00 C ATOM 2219 C ASP A 151 14.101 -8.482 9.720 1.00 0.00 C ATOM 2220 O ASP A 151 13.473 -8.717 10.751 1.00 0.00 O ATOM 2221 CB ASP A 151 13.286 -6.242 8.961 1.00 0.00 C ATOM 2222 CG ASP A 151 12.732 -5.424 10.111 1.00 0.00 C ATOM 2223 OD1 ASP A 151 12.717 -5.936 11.250 1.00 0.00 O ATOM 2224 OD2 ASP A 151 12.313 -4.272 9.873 1.00 0.00 O ATOM 0 H ASP A 151 15.145 -7.395 7.393 1.00 0.00 H new ATOM 0 HA ASP A 151 14.972 -6.602 10.243 1.00 0.00 H new ATOM 0 HB2 ASP A 151 13.549 -5.576 8.139 1.00 0.00 H new ATOM 0 HB3 ASP A 151 12.512 -6.915 8.591 1.00 0.00 H new ATOM 2229 N GLN A 152 14.459 -9.429 8.858 1.00 0.00 N ATOM 2230 CA GLN A 152 14.125 -10.831 9.080 1.00 0.00 C ATOM 2231 C GLN A 152 12.620 -11.013 9.248 1.00 0.00 C ATOM 2232 O GLN A 152 12.160 -11.572 10.242 1.00 0.00 O ATOM 2233 CB GLN A 152 14.855 -11.360 10.316 1.00 0.00 C ATOM 2234 CG GLN A 152 15.583 -12.674 10.077 1.00 0.00 C ATOM 2235 CD GLN A 152 17.014 -12.472 9.618 1.00 0.00 C ATOM 2236 OE1 GLN A 152 17.767 -11.705 10.218 1.00 0.00 O ATOM 2237 NE2 GLN A 152 17.395 -13.161 8.549 1.00 0.00 N ATOM 0 H GLN A 152 14.980 -9.251 8.000 1.00 0.00 H new ATOM 0 HA GLN A 152 14.445 -11.398 8.206 1.00 0.00 H new ATOM 0 HB2 GLN A 152 15.573 -10.612 10.651 1.00 0.00 H new ATOM 0 HB3 GLN A 152 14.135 -11.495 11.123 1.00 0.00 H new ATOM 0 HG2 GLN A 152 15.579 -13.260 10.996 1.00 0.00 H new ATOM 0 HG3 GLN A 152 15.043 -13.253 9.328 1.00 0.00 H new ATOM 0 HE21 GLN A 152 16.736 -13.785 8.083 1.00 0.00 H new ATOM 0 HE22 GLN A 152 18.346 -13.066 8.193 1.00 0.00 H new ATOM 2246 N LYS A 153 11.860 -10.535 8.268 1.00 0.00 N ATOM 2247 CA LYS A 153 10.405 -10.645 8.307 1.00 0.00 C ATOM 2248 C LYS A 153 9.836 -10.845 6.907 1.00 0.00 C ATOM 2249 O LYS A 153 9.813 -9.919 6.097 1.00 0.00 O ATOM 2250 CB LYS A 153 9.796 -9.394 8.944 1.00 0.00 C ATOM 2251 CG LYS A 153 10.118 -9.244 10.422 1.00 0.00 C ATOM 2252 CD LYS A 153 10.614 -7.844 10.746 1.00 0.00 C ATOM 2253 CE LYS A 153 10.559 -7.566 12.239 1.00 0.00 C ATOM 2254 NZ LYS A 153 11.329 -8.572 13.021 1.00 0.00 N ATOM 0 H LYS A 153 12.226 -10.068 7.438 1.00 0.00 H new ATOM 0 HA LYS A 153 10.147 -11.515 8.911 1.00 0.00 H new ATOM 0 HB2 LYS A 153 10.156 -8.514 8.411 1.00 0.00 H new ATOM 0 HB3 LYS A 153 8.714 -9.423 8.818 1.00 0.00 H new ATOM 0 HG2 LYS A 153 9.228 -9.462 11.013 1.00 0.00 H new ATOM 0 HG3 LYS A 153 10.876 -9.974 10.706 1.00 0.00 H new ATOM 0 HD2 LYS A 153 11.638 -7.728 10.391 1.00 0.00 H new ATOM 0 HD3 LYS A 153 10.008 -7.110 10.215 1.00 0.00 H new ATOM 0 HE2 LYS A 153 10.956 -6.571 12.438 1.00 0.00 H new ATOM 0 HE3 LYS A 153 9.521 -7.567 12.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 11.628 -8.154 13.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 10.730 -9.402 13.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 12.168 -8.864 12.480 1.00 0.00 H new ATOM 2268 N PHE A 154 9.373 -12.060 6.630 1.00 0.00 N ATOM 2269 CA PHE A 154 8.800 -12.381 5.328 1.00 0.00 C ATOM 2270 C PHE A 154 7.281 -12.476 5.415 1.00 0.00 C ATOM 2271 O PHE A 154 6.711 -12.479 6.506 1.00 0.00 O ATOM 2272 CB PHE A 154 9.378 -13.696 4.802 1.00 0.00 C ATOM 2273 CG PHE A 154 9.038 -14.887 5.652 1.00 0.00 C ATOM 2274 CD1 PHE A 154 9.654 -15.077 6.879 1.00 0.00 C ATOM 2275 CD2 PHE A 154 8.104 -15.816 5.225 1.00 0.00 C ATOM 2276 CE1 PHE A 154 9.345 -16.172 7.663 1.00 0.00 C ATOM 2277 CE2 PHE A 154 7.790 -16.913 6.005 1.00 0.00 C ATOM 2278 CZ PHE A 154 8.411 -17.091 7.225 1.00 0.00 C ATOM 0 H PHE A 154 9.384 -12.838 7.290 1.00 0.00 H new ATOM 0 HA PHE A 154 9.058 -11.579 4.636 1.00 0.00 H new ATOM 0 HB2 PHE A 154 9.010 -13.866 3.790 1.00 0.00 H new ATOM 0 HB3 PHE A 154 10.462 -13.605 4.736 1.00 0.00 H new ATOM 0 HD1 PHE A 154 10.384 -14.361 7.226 1.00 0.00 H new ATOM 0 HD2 PHE A 154 7.615 -15.682 4.271 1.00 0.00 H new ATOM 0 HE1 PHE A 154 9.833 -16.309 8.617 1.00 0.00 H new ATOM 0 HE2 PHE A 154 7.060 -17.630 5.660 1.00 0.00 H new ATOM 0 HZ PHE A 154 8.167 -17.947 7.836 1.00 0.00 H new ATOM 2288 N GLY A 155 6.628 -12.552 4.259 1.00 0.00 N ATOM 2289 CA GLY A 155 5.181 -12.643 4.232 1.00 0.00 C ATOM 2290 C GLY A 155 4.663 -13.372 3.008 1.00 0.00 C ATOM 2291 O GLY A 155 5.242 -13.272 1.926 1.00 0.00 O ATOM 0 H GLY A 155 7.075 -12.552 3.342 1.00 0.00 H new ATOM 0 HA2 GLY A 155 4.837 -13.158 5.129 1.00 0.00 H new ATOM 0 HA3 GLY A 155 4.757 -11.639 4.258 1.00 0.00 H new ATOM 2295 N PHE A 156 3.568 -14.106 3.179 1.00 0.00 N ATOM 2296 CA PHE A 156 2.970 -14.853 2.079 1.00 0.00 C ATOM 2297 C PHE A 156 1.933 -14.006 1.350 1.00 0.00 C ATOM 2298 O PHE A 156 0.884 -13.677 1.905 1.00 0.00 O ATOM 2299 CB PHE A 156 2.323 -16.139 2.597 1.00 0.00 C ATOM 2300 CG PHE A 156 3.257 -17.000 3.399 1.00 0.00 C ATOM 2301 CD1 PHE A 156 4.479 -17.392 2.878 1.00 0.00 C ATOM 2302 CD2 PHE A 156 2.910 -17.418 4.675 1.00 0.00 C ATOM 2303 CE1 PHE A 156 5.339 -18.185 3.613 1.00 0.00 C ATOM 2304 CE2 PHE A 156 3.767 -18.211 5.414 1.00 0.00 C ATOM 2305 CZ PHE A 156 4.983 -18.595 4.884 1.00 0.00 C ATOM 0 H PHE A 156 3.077 -14.199 4.068 1.00 0.00 H new ATOM 0 HA PHE A 156 3.762 -15.113 1.376 1.00 0.00 H new ATOM 0 HB2 PHE A 156 1.462 -15.880 3.213 1.00 0.00 H new ATOM 0 HB3 PHE A 156 1.948 -16.714 1.750 1.00 0.00 H new ATOM 0 HD1 PHE A 156 4.763 -17.074 1.886 1.00 0.00 H new ATOM 0 HD2 PHE A 156 1.961 -17.121 5.095 1.00 0.00 H new ATOM 0 HE1 PHE A 156 6.289 -18.484 3.195 1.00 0.00 H new ATOM 0 HE2 PHE A 156 3.486 -18.531 6.407 1.00 0.00 H new ATOM 0 HZ PHE A 156 5.654 -19.214 5.461 1.00 0.00 H new ATOM 2315 N CYS A 157 2.233 -13.655 0.105 1.00 0.00 N ATOM 2316 CA CYS A 157 1.329 -12.842 -0.701 1.00 0.00 C ATOM 2317 C CYS A 157 0.358 -13.722 -1.484 1.00 0.00 C ATOM 2318 O CYS A 157 0.599 -14.915 -1.673 1.00 0.00 O ATOM 2319 CB CYS A 157 2.125 -11.956 -1.661 1.00 0.00 C ATOM 2320 SG CYS A 157 2.575 -12.770 -3.229 1.00 0.00 S ATOM 0 H CYS A 157 3.096 -13.921 -0.369 1.00 0.00 H new ATOM 0 HA CYS A 157 0.752 -12.207 -0.028 1.00 0.00 H new ATOM 0 HB2 CYS A 157 1.541 -11.063 -1.883 1.00 0.00 H new ATOM 0 HB3 CYS A 157 3.036 -11.625 -1.162 1.00 0.00 H new ATOM 2325 N PRO A 158 -0.755 -13.138 -1.952 1.00 0.00 N ATOM 2326 CA PRO A 158 -1.769 -13.865 -2.718 1.00 0.00 C ATOM 2327 C PRO A 158 -1.314 -14.167 -4.141 1.00 0.00 C ATOM 2328 O PRO A 158 -0.132 -14.050 -4.464 1.00 0.00 O ATOM 2329 CB PRO A 158 -2.956 -12.902 -2.728 1.00 0.00 C ATOM 2330 CG PRO A 158 -2.344 -11.549 -2.611 1.00 0.00 C ATOM 2331 CD PRO A 158 -1.110 -11.718 -1.765 1.00 0.00 C ATOM 0 HA PRO A 158 -1.994 -14.838 -2.281 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -3.535 -12.997 -3.646 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -3.636 -13.102 -1.900 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -2.091 -11.150 -3.593 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -3.038 -10.846 -2.151 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -0.307 -11.057 -2.091 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -1.307 -11.488 -0.718 1.00 0.00 H new ATOM 2339 N MET A 159 -2.261 -14.554 -4.990 1.00 0.00 N ATOM 2340 CA MET A 159 -1.956 -14.874 -6.380 1.00 0.00 C ATOM 2341 C MET A 159 -2.997 -14.268 -7.318 1.00 0.00 C ATOM 2342 O MET A 159 -4.200 -14.379 -7.080 1.00 0.00 O ATOM 2343 CB MET A 159 -1.898 -16.390 -6.577 1.00 0.00 C ATOM 2344 CG MET A 159 -1.263 -16.808 -7.893 1.00 0.00 C ATOM 2345 SD MET A 159 -0.528 -18.452 -7.818 1.00 0.00 S ATOM 2346 CE MET A 159 0.420 -18.468 -9.338 1.00 0.00 C ATOM 0 H MET A 159 -3.245 -14.653 -4.740 1.00 0.00 H new ATOM 0 HA MET A 159 -0.982 -14.446 -6.619 1.00 0.00 H new ATOM 0 HB2 MET A 159 -1.336 -16.834 -5.755 1.00 0.00 H new ATOM 0 HB3 MET A 159 -2.909 -16.794 -6.527 1.00 0.00 H new ATOM 0 HG2 MET A 159 -2.018 -16.787 -8.679 1.00 0.00 H new ATOM 0 HG3 MET A 159 -0.496 -16.084 -8.168 1.00 0.00 H new ATOM 0 HE1 MET A 159 0.935 -19.424 -9.436 1.00 0.00 H new ATOM 0 HE2 MET A 159 -0.250 -18.328 -10.186 1.00 0.00 H new ATOM 0 HE3 MET A 159 1.153 -17.662 -9.318 1.00 0.00 H new ATOM 2356 N ALA A 160 -2.526 -13.627 -8.382 1.00 0.00 N ATOM 2357 CA ALA A 160 -3.414 -13.004 -9.355 1.00 0.00 C ATOM 2358 C ALA A 160 -3.432 -13.787 -10.662 1.00 0.00 C ATOM 2359 O ALA A 160 -2.708 -13.389 -11.599 1.00 0.00 O ATOM 2360 CB ALA A 160 -2.996 -11.564 -9.605 1.00 0.00 C ATOM 2361 OXT ALA A 160 -4.169 -14.792 -10.740 1.00 0.00 O ATOM 0 H ALA A 160 -1.533 -13.525 -8.592 1.00 0.00 H new ATOM 0 HA ALA A 160 -4.424 -13.011 -8.945 1.00 0.00 H new ATOM 0 HB1 ALA A 160 -3.668 -11.111 -10.334 1.00 0.00 H new ATOM 0 HB2 ALA A 160 -3.043 -11.004 -8.671 1.00 0.00 H new ATOM 0 HB3 ALA A 160 -1.976 -11.543 -9.990 1.00 0.00 H new TER 2367 ALA A 160 HETATM 2368 C1 NAG A 161 20.102 -2.510 -5.004 1.00 0.00 C HETATM 2369 C2 NAG A 161 21.117 -3.216 -4.117 1.00 0.00 C HETATM 2370 C3 NAG A 161 22.515 -2.861 -4.589 1.00 0.00 C HETATM 2371 C4 NAG A 161 22.713 -3.308 -6.059 1.00 0.00 C HETATM 2372 C5 NAG A 161 21.625 -2.572 -6.923 1.00 0.00 C HETATM 2373 C6 NAG A 161 21.682 -2.986 -8.402 1.00 0.00 C HETATM 2374 C7 NAG A 161 21.330 -3.640 -1.731 1.00 0.00 C HETATM 2375 C8 NAG A 161 21.123 -3.101 -0.319 1.00 0.00 C HETATM 2376 N2 NAG A 161 20.971 -2.832 -2.725 1.00 0.00 N HETATM 2377 O3 NAG A 161 23.471 -3.512 -3.769 1.00 0.00 O HETATM 2378 O4 NAG A 161 24.038 -2.952 -6.438 1.00 0.00 O HETATM 2379 O5 NAG A 161 20.311 -2.889 -6.380 1.00 0.00 O HETATM 2380 O6 NAG A 161 20.351 -3.034 -8.916 1.00 0.00 O HETATM 2381 O7 NAG A 161 21.796 -4.759 -1.924 1.00 0.00 O HETATM 0 HO6 NAG A 161 19.713 -3.050 -8.172 1.00 0.00 H new HETATM 0 HO4 NAG A 161 24.197 -3.224 -7.366 1.00 0.00 H new HETATM 0 HO3 NAG A 161 24.321 -3.584 -4.252 1.00 0.00 H new HETATM 0 HN2 NAG A 161 20.582 -1.916 -2.502 1.00 0.00 H new HETATM 0 H83 NAG A 161 21.704 -2.188 -0.189 1.00 0.00 H new HETATM 0 H82 NAG A 161 20.066 -2.884 -0.164 1.00 0.00 H new HETATM 0 H81 NAG A 161 21.451 -3.846 0.406 1.00 0.00 H new HETATM 0 H62 NAG A 161 22.281 -2.275 -8.971 1.00 0.00 H new HETATM 0 H61 NAG A 161 22.162 -3.960 -8.504 1.00 0.00 H new HETATM 0 H5 NAG A 161 21.819 -1.500 -6.878 1.00 0.00 H new HETATM 0 H4 NAG A 161 22.594 -4.382 -6.201 1.00 0.00 H new HETATM 0 H3 NAG A 161 22.646 -1.781 -4.524 1.00 0.00 H new HETATM 0 H2 NAG A 161 20.946 -4.290 -4.190 1.00 0.00 H new