USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=64 USER MOD reduce.3.24.130724 removed 2000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 54 TYR OH : rot -119:sc= -0.463 USER MOD Set 1.2: B 119 HIS :FLIP no HE2:sc= -0.575 F(o=-2.6,f=-1) USER MOD Set 2.1: A 126 ASN : amide:sc= 0.303 K(o=0.23,f=-11!) USER MOD Set 2.2: A 130 ASN : amide:sc= -0.0725 X(o=0.23,f=0.62) USER MOD Set 3.1: A 54 TYR OH : rot 180:sc= -0.0126 USER MOD Set 3.2: A 119 HIS : no HE2:sc= 0.654 K(o=0.64,f=-2.9!) USER MOD Set 4.1: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 10 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 78 THR OG1 : rot 180:sc= -0.693 USER MOD Set 5.2: B 12 THR OG1 : rot 180:sc= 0 USER MOD Set 6.1: A 55 SER OG : rot -80:sc= 1 USER MOD Set 6.2: B 11 SER OG : rot -62:sc= 0.83 USER MOD Set 7.1: A 48 GLN : amide:sc= -0.418 K(o=0.037,f=-1.6) USER MOD Set 7.2: B 21 SER OG : rot 133:sc= 0.455 USER MOD Set 8.1: A 45 ASN : amide:sc= -2.2! C(o=-2.1!,f=-2!) USER MOD Set 8.2: B 5 TYR OH : rot -34:sc= 0.112 USER MOD Set 9.1: A 7 THR OG1 : rot 56:sc= 0.284! USER MOD Set 9.2: A 21 SER OG : rot 40:sc= 0.221 USER MOD Set 9.3: A 25 LYS NZ :NH3+ -124:sc= 1.94 (180deg=0.325) USER MOD Set 9.4: B 48 GLN : amide:sc= -3.78! C(o=-1.3!,f=-3.9!) USER MOD Set10.1: A 5 TYR OH : rot 180:sc= 0 USER MOD Set10.2: B 45 ASN : amide:sc= -2.69! X(o=-2.7!,f=-3) USER MOD Single : A 1 MET CE :methyl -152:sc= -1.07 (180deg=-2.68!) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.061 (180deg=-0.107) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 6 LYS NZ :NH3+ 172:sc= 2.02 (180deg=1.98) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 18:sc= 1.09 USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -120:sc= 0.106 USER MOD Single : A 22 HIS : no HD1:sc= -0.242 X(o=-0.24,f=0) USER MOD Single : A 24 GLN : amide:sc= 0.0569 X(o=0.057,f=-0.16) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -160:sc= -0.278 USER MOD Single : A 44 THR OG1 : rot -100:sc= -1.97! USER MOD Single : A 57 CYS SG : rot -157:sc= 0.271 USER MOD Single : A 60 SER OG : rot -95:sc= 0.7 USER MOD Single : A 62 MET CE :methyl 170:sc= -1.11 (180deg=-1.45) USER MOD Single : A 63 LYS NZ :NH3+ 170:sc= -0.0133 (180deg=-0.128) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0.064) USER MOD Single : A 69 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.21) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 THR OG1 : rot 44:sc= 0.0376 USER MOD Single : A 77 THR OG1 : rot 57:sc= 0.829 USER MOD Single : A 88 ASN : amide:sc= -1.14 K(o=-1.1,f=-13!) USER MOD Single : A 112 LYS NZ :NH3+ -169:sc= -0.0115 (180deg=-0.157) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 CYS SG : rot 49:sc= -1.61 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= -2.33! USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : B 1 MET CE :methyl 167:sc= -4.1! (180deg=-4.9!) USER MOD Single : B 1 MET N :NH3+ 131:sc= 0.0635 (180deg=-0.0147) USER MOD Single : B 2 ASN : amide:sc=-0.00274 K(o=-0.0027,f=-0.86) USER MOD Single : B 6 LYS NZ :NH3+ 163:sc= 2.25 (180deg=1.93) USER MOD Single : B 7 THR OG1 : rot 60:sc= 0.444 USER MOD Single : B 20 THR OG1 : rot -112:sc= 0.561 USER MOD Single : B 22 HIS : no HD1:sc= -0.0605 X(o=-0.061,f=-0.061) USER MOD Single : B 24 GLN : amide:sc= -0.289 X(o=-0.29,f=-0.16) USER MOD Single : B 25 LYS NZ :NH3+ 171:sc=-0.00219 (180deg=-0.101) USER MOD Single : B 29 LYS NZ :NH3+ -110:sc= 0.742 (180deg=-3.73!) USER MOD Single : B 31 SER OG : rot 130:sc= -1.53 USER MOD Single : B 44 THR OG1 : rot 180:sc= -0.215 USER MOD Single : B 55 SER OG : rot 69:sc= -1.15! USER MOD Single : B 57 CYS SG : rot -21:sc= 0.00128 USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 62 MET CE :methyl -159:sc= -0.132 (180deg=-0.981) USER MOD Single : B 63 LYS NZ :NH3+ -161:sc= -0.438 (180deg=-1.38) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0.0053) USER MOD Single : B 69 ASN :FLIP amide:sc= -0.544 F(o=-1.3,f=-0.54) USER MOD Single : B 70 LYS NZ :NH3+ -171:sc= 1.26 (180deg=1.07) USER MOD Single : B 71 GLN :FLIP amide:sc= -0.0754 F(o=-1.1,f=-0.075) USER MOD Single : B 72 THR OG1 : rot 27:sc= 0.029 USER MOD Single : B 77 THR OG1 : rot 40:sc= 1.18 USER MOD Single : B 78 THR OG1 : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot -130:sc= 0.28 USER MOD Single : B 88 ASN : amide:sc= -0.123 K(o=-0.12,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ 169:sc= -0.0189 (180deg=-0.169) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= -1.64 K(o=-1.6,f=-2.5!) USER MOD Single : B 122 CYS SG : rot -2:sc= -0.035 USER MOD Single : B 124 TYR OH : rot 34:sc= -0.105 USER MOD Single : B 128 THR OG1 : rot 150:sc= -1.82! USER MOD Single : B 130 ASN :FLIP amide:sc= -0.123 F(o=-0.66,f=-0.12) USER MOD Single : B 131 ASN : amide:sc= -0.284! C(o=-0.28!,f=-9.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.980 0.323 1.358 1.00 60.05 N ATOM 2 CA MET A 1 2.708 0.752 0.136 1.00 3.23 C ATOM 3 C MET A 1 3.362 -0.442 -0.547 1.00 42.13 C ATOM 4 O MET A 1 3.233 -1.580 -0.095 1.00 30.31 O ATOM 5 CB MET A 1 3.785 1.789 0.479 1.00 13.52 C ATOM 6 CG MET A 1 4.804 1.277 1.481 1.00 60.32 C ATOM 7 SD MET A 1 6.149 2.437 1.787 1.00 71.43 S ATOM 8 CE MET A 1 7.143 2.192 0.319 1.00 20.11 C ATOM 0 H1 MET A 1 2.167 0.997 2.128 1.00 60.05 H new ATOM 0 H2 MET A 1 0.959 0.295 1.162 1.00 60.05 H new ATOM 0 H3 MET A 1 2.304 -0.624 1.641 1.00 60.05 H new ATOM 0 HA MET A 1 1.981 1.201 -0.541 1.00 3.23 H new ATOM 0 HB2 MET A 1 4.300 2.086 -0.435 1.00 13.52 H new ATOM 0 HB3 MET A 1 3.307 2.683 0.880 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.300 1.060 2.423 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.220 0.337 1.118 1.00 60.32 H new ATOM 0 HE1 MET A 1 8.186 2.413 0.545 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.055 1.157 -0.012 1.00 20.11 H new ATOM 0 HE3 MET A 1 6.794 2.856 -0.472 1.00 20.11 H new ATOM 20 N ASN A 2 4.097 -0.161 -1.615 1.00 22.52 N ATOM 21 CA ASN A 2 4.766 -1.193 -2.400 1.00 14.33 C ATOM 22 C ASN A 2 6.154 -1.444 -1.834 1.00 22.14 C ATOM 23 O ASN A 2 7.131 -0.842 -2.265 1.00 72.55 O ATOM 24 CB ASN A 2 4.869 -0.781 -3.879 1.00 31.34 C ATOM 25 CG ASN A 2 5.576 -1.827 -4.735 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.493 -3.026 -4.467 1.00 52.13 O ATOM 27 ND2 ASN A 2 6.282 -1.381 -5.766 1.00 35.23 N ATOM 0 H ASN A 2 4.247 0.786 -1.962 1.00 22.52 H new ATOM 0 HA ASN A 2 4.177 -2.108 -2.343 1.00 14.33 H new ATOM 0 HB2 ASN A 2 3.868 -0.610 -4.275 1.00 31.34 H new ATOM 0 HB3 ASN A 2 5.406 0.165 -3.952 1.00 31.34 H new ATOM 0 HD21 ASN A 2 6.779 -2.039 -6.367 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.328 -0.380 -5.958 1.00 35.23 H new ATOM 34 N ILE A 3 6.221 -2.289 -0.824 1.00 0.23 N ATOM 35 CA ILE A 3 7.479 -2.616 -0.173 1.00 51.02 C ATOM 36 C ILE A 3 8.335 -3.559 -1.016 1.00 3.13 C ATOM 37 O ILE A 3 7.846 -4.551 -1.562 1.00 22.24 O ATOM 38 CB ILE A 3 7.218 -3.258 1.207 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.417 -2.291 2.090 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.527 -3.655 1.889 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.207 -1.072 2.519 1.00 23.10 C ATOM 0 H ILE A 3 5.410 -2.767 -0.431 1.00 0.23 H new ATOM 0 HA ILE A 3 8.027 -1.682 -0.050 1.00 51.02 H new ATOM 0 HB ILE A 3 6.635 -4.167 1.059 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.529 -1.967 1.548 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.072 -2.822 2.977 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.311 -4.104 2.858 1.00 24.42 H new ATOM 0 HG22 ILE A 3 9.058 -4.375 1.266 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.147 -2.770 2.030 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.580 -0.432 3.140 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.081 -1.387 3.089 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.529 -0.518 1.637 1.00 23.10 H new ATOM 53 N LEU A 4 9.612 -3.213 -1.121 1.00 41.13 N ATOM 54 CA LEU A 4 10.618 -4.067 -1.735 1.00 42.04 C ATOM 55 C LEU A 4 11.268 -4.935 -0.673 1.00 41.22 C ATOM 56 O LEU A 4 11.461 -6.138 -0.866 1.00 74.21 O ATOM 57 CB LEU A 4 11.702 -3.229 -2.423 1.00 22.30 C ATOM 58 CG LEU A 4 11.206 -2.274 -3.512 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.368 -1.460 -4.082 1.00 73.22 C ATOM 60 CD2 LEU A 4 10.482 -3.040 -4.623 1.00 52.13 C ATOM 0 H LEU A 4 9.980 -2.325 -0.780 1.00 41.13 H new ATOM 0 HA LEU A 4 10.125 -4.690 -2.481 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.223 -2.646 -1.663 1.00 22.30 H new ATOM 0 HB3 LEU A 4 12.434 -3.905 -2.864 1.00 22.30 H new ATOM 0 HG LEU A 4 10.493 -1.584 -3.061 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.996 -0.787 -4.855 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.830 -0.878 -3.285 1.00 73.22 H new ATOM 0 HD13 LEU A 4 13.108 -2.134 -4.514 1.00 73.22 H new ATOM 0 HD21 LEU A 4 10.139 -2.339 -5.384 1.00 52.13 H new ATOM 0 HD22 LEU A 4 11.165 -3.760 -5.074 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.625 -3.567 -4.203 1.00 52.13 H new ATOM 72 N TYR A 5 11.599 -4.314 0.454 1.00 24.01 N ATOM 73 CA TYR A 5 12.307 -5.005 1.528 1.00 4.44 C ATOM 74 C TYR A 5 11.732 -4.598 2.882 1.00 12.52 C ATOM 75 O TYR A 5 11.623 -3.413 3.177 1.00 21.34 O ATOM 76 CB TYR A 5 13.806 -4.663 1.453 1.00 54.43 C ATOM 77 CG TYR A 5 14.698 -5.521 2.336 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.772 -5.308 3.711 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.476 -6.541 1.789 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.592 -6.081 4.509 1.00 2.54 C ATOM 81 CE2 TYR A 5 16.295 -7.317 2.585 1.00 4.33 C ATOM 82 CZ TYR A 5 16.350 -7.085 3.943 1.00 33.20 C ATOM 83 OH TYR A 5 17.173 -7.853 4.735 1.00 31.30 O ATOM 0 H TYR A 5 11.389 -3.335 0.648 1.00 24.01 H new ATOM 0 HA TYR A 5 12.181 -6.082 1.413 1.00 4.44 H new ATOM 0 HB2 TYR A 5 14.136 -4.764 0.419 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.941 -3.618 1.730 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.178 -4.525 4.160 1.00 4.50 H new ATOM 0 HD2 TYR A 5 15.437 -6.727 0.726 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.640 -5.900 5.573 1.00 2.54 H new ATOM 0 HE2 TYR A 5 16.891 -8.103 2.145 1.00 4.33 H new ATOM 0 HH TYR A 5 17.636 -8.515 4.180 1.00 31.30 H new ATOM 93 N LYS A 6 11.343 -5.578 3.690 1.00 51.40 N ATOM 94 CA LYS A 6 10.847 -5.319 5.038 1.00 43.32 C ATOM 95 C LYS A 6 11.372 -6.371 6.009 1.00 62.42 C ATOM 96 O LYS A 6 11.357 -7.567 5.715 1.00 13.53 O ATOM 97 CB LYS A 6 9.305 -5.273 5.068 1.00 1.54 C ATOM 98 CG LYS A 6 8.712 -5.213 6.480 1.00 51.03 C ATOM 99 CD LYS A 6 7.235 -4.806 6.490 1.00 30.33 C ATOM 100 CE LYS A 6 7.044 -3.310 6.240 1.00 61.32 C ATOM 101 NZ LYS A 6 5.631 -2.884 6.444 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.362 -6.565 3.433 1.00 51.40 H new ATOM 0 HA LYS A 6 11.215 -4.342 5.350 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.966 -4.403 4.505 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.915 -6.154 4.558 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.818 -6.188 6.955 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.283 -4.503 7.079 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.700 -5.371 5.727 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.794 -5.071 7.451 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.693 -2.745 6.909 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.351 -3.071 5.222 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.571 -1.847 6.398 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 5.033 -3.299 5.701 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.302 -3.209 7.376 1.00 4.41 H new ATOM 115 N THR A 7 11.853 -5.906 7.155 1.00 30.21 N ATOM 116 CA THR A 7 12.339 -6.778 8.219 1.00 33.22 C ATOM 117 C THR A 7 11.715 -6.355 9.554 1.00 54.23 C ATOM 118 O THR A 7 11.123 -5.275 9.648 1.00 73.02 O ATOM 119 CB THR A 7 13.889 -6.752 8.302 1.00 43.13 C ATOM 120 OG1 THR A 7 14.355 -7.693 9.280 1.00 11.53 O ATOM 121 CG2 THR A 7 14.414 -5.358 8.645 1.00 62.33 C ATOM 0 H THR A 7 11.918 -4.912 7.374 1.00 30.21 H new ATOM 0 HA THR A 7 12.042 -7.802 7.995 1.00 33.22 H new ATOM 0 HB THR A 7 14.270 -7.028 7.319 1.00 43.13 H new ATOM 0 HG1 THR A 7 14.014 -8.586 9.064 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.503 -5.381 8.694 1.00 62.33 H new ATOM 0 HG22 THR A 7 14.100 -4.652 7.876 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.014 -5.046 9.610 1.00 62.33 H new ATOM 129 N ALA A 8 11.843 -7.199 10.577 1.00 51.42 N ATOM 130 CA ALA A 8 11.184 -6.954 11.859 1.00 62.45 C ATOM 131 C ALA A 8 12.122 -7.221 13.034 1.00 64.34 C ATOM 132 O ALA A 8 13.023 -8.066 12.958 1.00 4.53 O ATOM 133 CB ALA A 8 9.930 -7.819 11.980 1.00 11.23 C ATOM 0 H ALA A 8 12.395 -8.056 10.543 1.00 51.42 H new ATOM 0 HA ALA A 8 10.901 -5.902 11.892 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.447 -7.628 12.939 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.240 -7.575 11.172 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.206 -8.871 11.916 1.00 11.23 H new ATOM 139 N ALA A 9 11.909 -6.490 14.121 1.00 62.04 N ATOM 140 CA ALA A 9 12.672 -6.674 15.351 1.00 13.24 C ATOM 141 C ALA A 9 11.763 -6.541 16.566 1.00 53.42 C ATOM 142 O ALA A 9 10.883 -5.683 16.594 1.00 45.34 O ATOM 143 CB ALA A 9 13.805 -5.659 15.430 1.00 65.14 C ATOM 0 H ALA A 9 11.204 -5.754 14.176 1.00 62.04 H new ATOM 0 HA ALA A 9 13.100 -7.676 15.344 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.365 -5.809 16.353 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.471 -5.790 14.577 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.392 -4.651 15.417 1.00 65.14 H new ATOM 149 N THR A 10 11.973 -7.394 17.559 1.00 61.23 N ATOM 150 CA THR A 10 11.224 -7.327 18.804 1.00 51.35 C ATOM 151 C THR A 10 12.093 -6.697 19.892 1.00 43.21 C ATOM 152 O THR A 10 13.257 -7.067 20.065 1.00 73.43 O ATOM 153 CB THR A 10 10.726 -8.729 19.252 1.00 34.35 C ATOM 154 OG1 THR A 10 9.942 -8.619 20.447 1.00 3.15 O ATOM 155 CG2 THR A 10 11.889 -9.695 19.480 1.00 70.40 C ATOM 0 H THR A 10 12.662 -8.146 17.525 1.00 61.23 H new ATOM 0 HA THR A 10 10.343 -6.708 18.637 1.00 51.35 H new ATOM 0 HB THR A 10 10.108 -9.131 18.449 1.00 34.35 H new ATOM 0 HG1 THR A 10 9.633 -9.508 20.718 1.00 3.15 H new ATOM 0 HG21 THR A 10 11.501 -10.665 19.792 1.00 70.40 H new ATOM 0 HG22 THR A 10 12.453 -9.811 18.554 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.544 -9.299 20.256 1.00 70.40 H new ATOM 163 N SER A 11 11.542 -5.721 20.598 1.00 71.32 N ATOM 164 CA SER A 11 12.282 -5.017 21.641 1.00 2.43 C ATOM 165 C SER A 11 11.557 -5.120 22.981 1.00 11.12 C ATOM 166 O SER A 11 10.465 -4.587 23.154 1.00 53.54 O ATOM 167 CB SER A 11 12.478 -3.545 21.246 1.00 22.21 C ATOM 168 OG SER A 11 13.291 -2.852 22.178 1.00 52.01 O ATOM 0 H SER A 11 10.584 -5.396 20.469 1.00 71.32 H new ATOM 0 HA SER A 11 13.261 -5.485 21.749 1.00 2.43 H new ATOM 0 HB2 SER A 11 12.933 -3.492 20.257 1.00 22.21 H new ATOM 0 HB3 SER A 11 11.507 -3.055 21.177 1.00 22.21 H new ATOM 0 HG SER A 11 13.789 -3.498 22.721 1.00 52.01 H new ATOM 174 N THR A 12 12.174 -5.818 23.921 1.00 54.12 N ATOM 175 CA THR A 12 11.642 -5.954 25.269 1.00 52.53 C ATOM 176 C THR A 12 12.211 -4.845 26.161 1.00 72.12 C ATOM 177 O THR A 12 13.162 -4.163 25.777 1.00 13.04 O ATOM 178 CB THR A 12 12.013 -7.339 25.854 1.00 35.03 C ATOM 179 OG1 THR A 12 11.799 -8.355 24.864 1.00 61.53 O ATOM 180 CG2 THR A 12 11.186 -7.660 27.096 1.00 33.34 C ATOM 0 H THR A 12 13.057 -6.306 23.772 1.00 54.12 H new ATOM 0 HA THR A 12 10.556 -5.868 25.232 1.00 52.53 H new ATOM 0 HB THR A 12 13.064 -7.312 26.141 1.00 35.03 H new ATOM 0 HG1 THR A 12 12.036 -9.230 25.237 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.472 -8.639 27.481 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.367 -6.903 27.859 1.00 33.34 H new ATOM 0 HG23 THR A 12 10.127 -7.667 26.836 1.00 33.34 H new ATOM 188 N GLY A 13 11.633 -4.658 27.341 1.00 62.44 N ATOM 189 CA GLY A 13 12.168 -3.691 28.290 1.00 34.44 C ATOM 190 C GLY A 13 13.322 -4.255 29.109 1.00 13.14 C ATOM 191 O GLY A 13 13.726 -3.647 30.098 1.00 50.55 O ATOM 0 H GLY A 13 10.803 -5.157 27.661 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.508 -2.807 27.750 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.373 -3.368 28.962 1.00 34.44 H new ATOM 195 N GLY A 14 13.864 -5.400 28.661 1.00 62.02 N ATOM 196 CA GLY A 14 14.901 -6.130 29.393 1.00 43.32 C ATOM 197 C GLY A 14 14.795 -5.958 30.890 1.00 33.13 C ATOM 198 O GLY A 14 13.730 -6.163 31.472 1.00 44.52 O ATOM 0 H GLY A 14 13.593 -5.841 27.782 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.833 -7.190 29.148 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.882 -5.788 29.062 1.00 43.32 H new ATOM 202 N ARG A 15 15.906 -5.606 31.519 1.00 24.13 N ATOM 203 CA ARG A 15 15.865 -5.082 32.870 1.00 34.21 C ATOM 204 C ARG A 15 15.693 -3.569 32.770 1.00 4.22 C ATOM 205 O ARG A 15 15.005 -2.953 33.590 1.00 73.04 O ATOM 206 CB ARG A 15 17.130 -5.470 33.660 1.00 34.44 C ATOM 207 CG ARG A 15 16.981 -5.323 35.181 1.00 1.44 C ATOM 208 CD ARG A 15 17.270 -3.905 35.668 1.00 44.04 C ATOM 209 NE ARG A 15 18.705 -3.624 35.690 1.00 64.51 N ATOM 210 CZ ARG A 15 19.241 -2.406 35.641 1.00 22.54 C ATOM 211 NH1 ARG A 15 18.469 -1.332 35.491 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 20.556 -2.273 35.735 1.00 44.23 N ATOM 0 H ARG A 15 16.841 -5.674 31.116 1.00 24.13 H new ATOM 0 HA ARG A 15 15.028 -5.512 33.421 1.00 34.21 H new ATOM 0 HB2 ARG A 15 17.389 -6.503 33.428 1.00 34.44 H new ATOM 0 HB3 ARG A 15 17.961 -4.850 33.324 1.00 34.44 H new ATOM 0 HG2 ARG A 15 15.968 -5.603 35.471 1.00 1.44 H new ATOM 0 HG3 ARG A 15 17.658 -6.018 35.677 1.00 1.44 H new ATOM 0 HD2 ARG A 15 16.768 -3.188 35.019 1.00 44.04 H new ATOM 0 HD3 ARG A 15 16.858 -3.772 36.668 1.00 44.04 H new ATOM 0 HE ARG A 15 19.342 -4.419 35.747 1.00 64.51 H new ATOM 0 HH11 ARG A 15 17.458 -1.438 35.412 1.00 12.40 H new ATOM 0 HH12 ARG A 15 18.889 -0.403 35.455 1.00 12.40 H new ATOM 0 HH21 ARG A 15 21.146 -3.098 35.844 1.00 44.23 H new ATOM 0 HH22 ARG A 15 20.979 -1.345 35.699 1.00 44.23 H new ATOM 226 N ASP A 16 16.329 -2.972 31.751 1.00 4.14 N ATOM 227 CA ASP A 16 16.086 -1.570 31.413 1.00 22.02 C ATOM 228 C ASP A 16 15.700 -1.423 29.933 1.00 52.02 C ATOM 229 O ASP A 16 14.780 -0.672 29.610 1.00 74.22 O ATOM 230 CB ASP A 16 17.308 -0.707 31.741 1.00 50.13 C ATOM 231 CG ASP A 16 16.951 0.766 31.878 1.00 53.42 C ATOM 232 OD1 ASP A 16 17.357 1.573 31.017 1.00 45.04 O ATOM 233 OD2 ASP A 16 16.255 1.116 32.857 1.00 61.02 O1- ATOM 0 H ASP A 16 17.011 -3.438 31.153 1.00 4.14 H new ATOM 0 HA ASP A 16 15.251 -1.219 32.020 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.760 -1.057 32.669 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.056 -0.827 30.957 1.00 50.13 H new ATOM 238 N GLY A 17 16.394 -2.149 29.032 1.00 73.12 N ATOM 239 CA GLY A 17 15.944 -2.250 27.653 1.00 31.14 C ATOM 240 C GLY A 17 16.539 -3.463 26.959 1.00 63.12 C ATOM 241 O GLY A 17 17.607 -3.937 27.344 1.00 34.35 O ATOM 0 H GLY A 17 17.251 -2.661 29.241 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.856 -2.313 27.628 1.00 31.14 H new ATOM 0 HA3 GLY A 17 16.223 -1.346 27.111 1.00 31.14 H new ATOM 245 N ARG A 18 15.846 -3.978 25.950 1.00 71.41 N ATOM 246 CA ARG A 18 16.268 -5.192 25.249 1.00 64.41 C ATOM 247 C ARG A 18 15.795 -5.135 23.791 1.00 2.04 C ATOM 248 O ARG A 18 14.621 -4.894 23.540 1.00 73.24 O ATOM 249 CB ARG A 18 15.662 -6.401 25.984 1.00 30.54 C ATOM 250 CG ARG A 18 16.398 -7.726 25.812 1.00 21.30 C ATOM 251 CD ARG A 18 16.137 -8.382 24.464 1.00 2.42 C ATOM 252 NE ARG A 18 16.512 -9.797 24.488 1.00 61.43 N ATOM 253 CZ ARG A 18 17.592 -10.301 23.895 1.00 42.21 C ATOM 254 NH1 ARG A 18 18.428 -9.506 23.237 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 17.846 -11.600 23.966 1.00 11.32 N ATOM 0 H ARG A 18 14.981 -3.571 25.594 1.00 71.41 H new ATOM 0 HA ARG A 18 17.354 -5.281 25.243 1.00 64.41 H new ATOM 0 HB2 ARG A 18 15.617 -6.169 27.048 1.00 30.54 H new ATOM 0 HB3 ARG A 18 14.635 -6.531 25.642 1.00 30.54 H new ATOM 0 HG2 ARG A 18 17.469 -7.558 25.926 1.00 21.30 H new ATOM 0 HG3 ARG A 18 16.096 -8.409 26.606 1.00 21.30 H new ATOM 0 HD2 ARG A 18 15.082 -8.286 24.207 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.702 -7.865 23.688 1.00 2.42 H new ATOM 0 HE ARG A 18 15.904 -10.441 24.994 1.00 61.43 H new ATOM 0 HH11 ARG A 18 18.244 -8.504 23.184 1.00 65.11 H new ATOM 0 HH12 ARG A 18 19.254 -9.897 22.784 1.00 65.11 H new ATOM 0 HH21 ARG A 18 17.213 -12.216 24.476 1.00 11.32 H new ATOM 0 HH22 ARG A 18 18.674 -11.983 23.511 1.00 11.32 H new ATOM 269 N ALA A 19 16.695 -5.355 22.837 1.00 71.12 N ATOM 270 CA ALA A 19 16.340 -5.287 21.414 1.00 34.25 C ATOM 271 C ALA A 19 16.890 -6.490 20.646 1.00 41.03 C ATOM 272 O ALA A 19 18.060 -6.846 20.794 1.00 12.34 O ATOM 273 CB ALA A 19 16.857 -3.987 20.806 1.00 5.35 C ATOM 0 H ALA A 19 17.673 -5.581 23.017 1.00 71.12 H new ATOM 0 HA ALA A 19 15.253 -5.309 21.335 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.588 -3.947 19.750 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.411 -3.139 21.326 1.00 5.35 H new ATOM 0 HB3 ALA A 19 17.942 -3.945 20.906 1.00 5.35 H new ATOM 279 N THR A 20 16.043 -7.103 19.821 1.00 63.53 N ATOM 280 CA THR A 20 16.417 -8.281 19.041 1.00 0.02 C ATOM 281 C THR A 20 15.769 -8.240 17.657 1.00 61.21 C ATOM 282 O THR A 20 14.543 -8.229 17.539 1.00 50.32 O ATOM 283 CB THR A 20 15.977 -9.577 19.770 1.00 22.13 C ATOM 284 OG1 THR A 20 16.529 -9.604 21.094 1.00 4.20 O ATOM 285 CG2 THR A 20 16.424 -10.827 19.012 1.00 30.30 C ATOM 0 H THR A 20 15.081 -6.798 19.675 1.00 63.53 H new ATOM 0 HA THR A 20 17.501 -8.278 18.930 1.00 0.02 H new ATOM 0 HB THR A 20 14.888 -9.576 19.819 1.00 22.13 H new ATOM 0 HG1 THR A 20 17.101 -10.393 21.194 1.00 4.20 H new ATOM 0 HG21 THR A 20 16.098 -11.716 19.552 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.982 -10.826 18.016 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.511 -10.832 18.927 1.00 30.30 H new ATOM 293 N SER A 21 16.588 -8.214 16.607 1.00 52.22 N ATOM 294 CA SER A 21 16.072 -8.264 15.248 1.00 61.23 C ATOM 295 C SER A 21 15.776 -9.707 14.889 1.00 4.01 C ATOM 296 O SER A 21 16.704 -10.541 14.835 1.00 53.51 O ATOM 297 CB SER A 21 17.036 -7.634 14.240 1.00 62.30 C ATOM 298 OG SER A 21 16.458 -7.587 12.941 1.00 0.33 O ATOM 0 H SER A 21 17.604 -8.159 16.674 1.00 52.22 H new ATOM 0 HA SER A 21 15.155 -7.677 15.203 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.297 -6.626 14.562 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.962 -8.208 14.209 1.00 62.30 H new ATOM 0 HG SER A 21 15.511 -7.345 13.013 1.00 0.33 H new ATOM 304 N HIS A 22 14.481 -9.943 14.603 1.00 22.03 N ATOM 305 CA HIS A 22 13.856 -11.270 14.522 1.00 2.11 C ATOM 306 C HIS A 22 14.616 -12.237 13.628 1.00 71.44 C ATOM 307 O HIS A 22 14.592 -13.445 13.860 1.00 63.31 O ATOM 308 CB HIS A 22 12.414 -11.120 14.010 1.00 42.33 C ATOM 309 CG HIS A 22 11.605 -12.388 14.038 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.605 -12.615 14.959 1.00 70.44 N ATOM 311 CD2 HIS A 22 11.634 -13.489 13.245 1.00 33.23 C ATOM 312 CE1 HIS A 22 10.058 -13.794 14.735 1.00 21.33 C ATOM 313 NE2 HIS A 22 10.664 -14.344 13.701 1.00 41.54 N ATOM 0 H HIS A 22 13.822 -9.187 14.416 1.00 22.03 H new ATOM 0 HA HIS A 22 13.871 -11.693 15.526 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.905 -10.367 14.611 1.00 42.33 H new ATOM 0 HB3 HIS A 22 12.443 -10.745 12.987 1.00 42.33 H new ATOM 0 HD2 HIS A 22 12.298 -13.660 12.410 1.00 33.23 H new ATOM 0 HE1 HIS A 22 9.251 -14.234 15.302 1.00 21.33 H new ATOM 0 HE2 HIS A 22 10.446 -15.258 13.304 1.00 41.54 H new ATOM 322 N ASP A 23 15.328 -11.711 12.644 1.00 65.30 N ATOM 323 CA ASP A 23 16.038 -12.552 11.675 1.00 52.23 C ATOM 324 C ASP A 23 17.348 -13.046 12.277 1.00 2.53 C ATOM 325 O ASP A 23 18.282 -13.405 11.556 1.00 21.54 O ATOM 326 CB ASP A 23 16.331 -11.759 10.393 1.00 41.44 C ATOM 327 CG ASP A 23 15.084 -11.162 9.764 1.00 73.43 C ATOM 328 OD1 ASP A 23 14.577 -10.151 10.301 1.00 71.33 O ATOM 329 OD2 ASP A 23 14.627 -11.674 8.723 1.00 13.13 O1- ATOM 0 H ASP A 23 15.434 -10.708 12.490 1.00 65.30 H new ATOM 0 HA ASP A 23 15.407 -13.406 11.429 1.00 52.23 H new ATOM 0 HB2 ASP A 23 17.035 -10.958 10.621 1.00 41.44 H new ATOM 0 HB3 ASP A 23 16.817 -12.415 9.670 1.00 41.44 H new ATOM 334 N GLN A 24 17.401 -13.049 13.613 1.00 30.45 N ATOM 335 CA GLN A 24 18.569 -13.490 14.358 1.00 23.53 C ATOM 336 C GLN A 24 19.762 -12.620 14.002 1.00 71.34 C ATOM 337 O GLN A 24 20.912 -13.001 14.221 1.00 22.01 O ATOM 338 CB GLN A 24 18.869 -14.976 14.085 1.00 42.54 C ATOM 339 CG GLN A 24 17.716 -15.914 14.439 1.00 72.53 C ATOM 340 CD GLN A 24 17.247 -15.757 15.877 1.00 14.50 C ATOM 341 OE1 GLN A 24 17.766 -16.403 16.789 1.00 45.33 O ATOM 342 NE2 GLN A 24 16.249 -14.907 16.089 1.00 4.22 N ATOM 0 H GLN A 24 16.628 -12.743 14.204 1.00 30.45 H new ATOM 0 HA GLN A 24 18.365 -13.388 15.424 1.00 23.53 H new ATOM 0 HB2 GLN A 24 19.114 -15.099 13.030 1.00 42.54 H new ATOM 0 HB3 GLN A 24 19.751 -15.269 14.654 1.00 42.54 H new ATOM 0 HG2 GLN A 24 16.880 -15.724 13.766 1.00 72.53 H new ATOM 0 HG3 GLN A 24 18.029 -16.945 14.275 1.00 72.53 H new ATOM 0 HE21 GLN A 24 15.845 -14.390 15.308 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.887 -14.771 17.033 1.00 4.22 H new ATOM 351 N LYS A 25 19.480 -11.428 13.474 1.00 22.35 N ATOM 352 CA LYS A 25 20.540 -10.542 13.026 1.00 24.04 C ATOM 353 C LYS A 25 20.917 -9.578 14.145 1.00 45.31 C ATOM 354 O LYS A 25 22.015 -9.021 14.138 1.00 73.44 O ATOM 355 CB LYS A 25 20.145 -9.786 11.740 1.00 30.31 C ATOM 356 CG LYS A 25 19.276 -8.553 11.957 1.00 12.14 C ATOM 357 CD LYS A 25 18.978 -7.823 10.643 1.00 61.23 C ATOM 358 CE LYS A 25 17.904 -8.529 9.820 1.00 52.51 C ATOM 359 NZ LYS A 25 16.541 -8.299 10.377 1.00 22.01 N1+ ATOM 0 H LYS A 25 18.536 -11.062 13.350 1.00 22.35 H new ATOM 0 HA LYS A 25 21.412 -11.147 12.779 1.00 24.04 H new ATOM 0 HB2 LYS A 25 21.054 -9.484 11.221 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.615 -10.474 11.081 1.00 30.31 H new ATOM 0 HG2 LYS A 25 18.339 -8.848 12.428 1.00 12.14 H new ATOM 0 HG3 LYS A 25 19.778 -7.872 12.644 1.00 12.14 H new ATOM 0 HD2 LYS A 25 18.655 -6.805 10.860 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.893 -7.749 10.055 1.00 61.23 H new ATOM 0 HE2 LYS A 25 17.941 -8.172 8.791 1.00 52.51 H new ATOM 0 HE3 LYS A 25 18.110 -9.599 9.794 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 16.087 -9.214 10.572 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 16.614 -7.754 11.260 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 15.970 -7.769 9.689 1.00 22.01 H new ATOM 373 N LEU A 26 20.019 -9.386 15.124 1.00 32.33 N ATOM 374 CA LEU A 26 20.360 -8.566 16.288 1.00 24.31 C ATOM 375 C LEU A 26 19.773 -9.174 17.551 1.00 21.31 C ATOM 376 O LEU A 26 18.658 -9.678 17.523 1.00 11.34 O ATOM 377 CB LEU A 26 19.849 -7.133 16.101 1.00 35.55 C ATOM 378 CG LEU A 26 20.036 -6.192 17.301 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.515 -6.018 17.638 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.372 -4.849 17.024 1.00 74.42 C ATOM 0 H LEU A 26 19.077 -9.777 15.132 1.00 32.33 H new ATOM 0 HA LEU A 26 21.445 -8.537 16.386 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.355 -6.697 15.240 1.00 35.55 H new ATOM 0 HB3 LEU A 26 18.787 -7.175 15.859 1.00 35.55 H new ATOM 0 HG LEU A 26 19.555 -6.640 18.170 1.00 2.25 H new ATOM 0 HD11 LEU A 26 21.617 -5.347 18.491 1.00 31.22 H new ATOM 0 HD12 LEU A 26 21.948 -6.987 17.885 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.037 -5.595 16.779 1.00 31.22 H new ATOM 0 HD21 LEU A 26 19.511 -4.191 17.881 1.00 74.42 H new ATOM 0 HD22 LEU A 26 19.823 -4.395 16.141 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.306 -4.999 16.851 1.00 74.42 H new ATOM 392 N ASP A 27 20.532 -9.129 18.643 1.00 3.11 N ATOM 393 CA ASP A 27 20.060 -9.605 19.943 1.00 12.11 C ATOM 394 C ASP A 27 20.933 -9.029 21.058 1.00 11.44 C ATOM 395 O ASP A 27 22.011 -9.547 21.347 1.00 42.31 O ATOM 396 CB ASP A 27 20.063 -11.143 20.001 1.00 5.04 C ATOM 397 CG ASP A 27 19.490 -11.683 21.304 1.00 74.13 C ATOM 398 OD1 ASP A 27 20.180 -11.619 22.348 1.00 54.23 O ATOM 399 OD2 ASP A 27 18.341 -12.163 21.299 1.00 11.42 O1- ATOM 0 H ASP A 27 21.485 -8.765 18.654 1.00 3.11 H new ATOM 0 HA ASP A 27 19.034 -9.265 20.082 1.00 12.11 H new ATOM 0 HB2 ASP A 27 19.485 -11.535 19.164 1.00 5.04 H new ATOM 0 HB3 ASP A 27 21.084 -11.505 19.880 1.00 5.04 H new ATOM 404 N VAL A 28 20.471 -7.935 21.658 1.00 5.03 N ATOM 405 CA VAL A 28 21.196 -7.264 22.743 1.00 42.02 C ATOM 406 C VAL A 28 20.244 -6.647 23.765 1.00 62.12 C ATOM 407 O VAL A 28 19.020 -6.727 23.631 1.00 32.30 O ATOM 408 CB VAL A 28 22.152 -6.159 22.223 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.434 -6.770 21.666 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.457 -5.287 21.178 1.00 1.00 C ATOM 0 H VAL A 28 19.589 -7.487 21.410 1.00 5.03 H new ATOM 0 HA VAL A 28 21.788 -8.043 23.222 1.00 42.02 H new ATOM 0 HB VAL A 28 22.424 -5.520 23.063 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.089 -5.976 21.307 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.940 -7.331 22.451 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.190 -7.439 20.841 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.147 -4.519 20.828 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.146 -5.906 20.337 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.582 -4.813 21.623 1.00 1.00 H new ATOM 420 N LYS A 29 20.838 -6.054 24.794 1.00 24.10 N ATOM 421 CA LYS A 29 20.115 -5.398 25.875 1.00 44.35 C ATOM 422 C LYS A 29 20.870 -4.143 26.307 1.00 43.02 C ATOM 423 O LYS A 29 22.102 -4.143 26.348 1.00 12.55 O ATOM 424 CB LYS A 29 19.961 -6.371 27.053 1.00 13.02 C ATOM 425 CG LYS A 29 19.891 -5.705 28.427 1.00 22.53 C ATOM 426 CD LYS A 29 19.844 -6.743 29.547 1.00 24.23 C ATOM 427 CE LYS A 29 19.938 -6.102 30.925 1.00 1.41 C ATOM 428 NZ LYS A 29 19.976 -7.120 32.007 1.00 62.42 N1+ ATOM 0 H LYS A 29 21.852 -6.015 24.902 1.00 24.10 H new ATOM 0 HA LYS A 29 19.123 -5.106 25.532 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.056 -6.961 26.904 1.00 13.02 H new ATOM 0 HB3 LYS A 29 20.800 -7.067 27.044 1.00 13.02 H new ATOM 0 HG2 LYS A 29 20.758 -5.058 28.564 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.007 -5.069 28.480 1.00 22.53 H new ATOM 0 HD2 LYS A 29 18.917 -7.312 29.475 1.00 24.23 H new ATOM 0 HD3 LYS A 29 20.663 -7.450 29.420 1.00 24.23 H new ATOM 0 HE2 LYS A 29 20.833 -5.483 30.977 1.00 1.41 H new ATOM 0 HE3 LYS A 29 19.084 -5.442 31.077 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 20.040 -6.644 32.929 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 19.110 -7.695 31.973 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 20.805 -7.735 31.876 1.00 62.42 H new ATOM 442 N LEU A 30 20.135 -3.077 26.614 1.00 2.53 N ATOM 443 CA LEU A 30 20.738 -1.812 27.002 1.00 41.03 C ATOM 444 C LEU A 30 20.079 -1.219 28.255 1.00 64.12 C ATOM 445 O LEU A 30 19.074 -1.761 28.783 1.00 54.30 O ATOM 446 CB LEU A 30 20.699 -0.812 25.823 1.00 11.12 C ATOM 447 CG LEU A 30 19.386 -0.717 25.011 1.00 54.41 C ATOM 448 CD1 LEU A 30 19.176 -1.946 24.124 1.00 21.32 C ATOM 449 CD2 LEU A 30 18.190 -0.506 25.928 1.00 54.12 C ATOM 0 H LEU A 30 19.115 -3.068 26.600 1.00 2.53 H new ATOM 0 HA LEU A 30 21.780 -2.007 27.257 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.924 0.180 26.215 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.503 -1.073 25.134 1.00 11.12 H new ATOM 0 HG LEU A 30 19.475 0.150 24.357 1.00 54.41 H new ATOM 0 HD11 LEU A 30 18.243 -1.840 23.570 1.00 21.32 H new ATOM 0 HD12 LEU A 30 20.006 -2.035 23.423 1.00 21.32 H new ATOM 0 HD13 LEU A 30 19.129 -2.840 24.746 1.00 21.32 H new ATOM 0 HD21 LEU A 30 17.280 -0.443 25.331 1.00 54.12 H new ATOM 0 HD22 LEU A 30 18.111 -1.343 26.622 1.00 54.12 H new ATOM 0 HD23 LEU A 30 18.321 0.419 26.489 1.00 54.12 H new ATOM 461 N SER A 31 20.662 -0.106 28.720 1.00 75.34 N ATOM 462 CA SER A 31 20.195 0.601 29.914 1.00 34.22 C ATOM 463 C SER A 31 20.603 2.084 29.880 1.00 62.41 C ATOM 464 O SER A 31 21.595 2.455 29.248 1.00 64.13 O ATOM 465 CB SER A 31 20.761 -0.063 31.176 1.00 52.23 C ATOM 466 OG SER A 31 20.379 -1.427 31.257 1.00 11.31 O ATOM 0 H SER A 31 21.472 0.328 28.276 1.00 75.34 H new ATOM 0 HA SER A 31 19.107 0.546 29.931 1.00 34.22 H new ATOM 0 HB2 SER A 31 21.848 0.013 31.173 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.407 0.469 32.059 1.00 52.23 H new ATOM 0 HG SER A 31 20.468 -1.737 32.182 1.00 11.31 H new ATOM 472 N ALA A 32 19.830 2.920 30.573 1.00 52.21 N ATOM 473 CA ALA A 32 20.087 4.361 30.641 1.00 43.51 C ATOM 474 C ALA A 32 21.275 4.682 31.567 1.00 25.12 C ATOM 475 O ALA A 32 21.506 3.981 32.563 1.00 4.30 O ATOM 476 CB ALA A 32 18.830 5.090 31.111 1.00 22.44 C ATOM 0 H ALA A 32 19.011 2.620 31.102 1.00 52.21 H new ATOM 0 HA ALA A 32 20.350 4.706 29.641 1.00 43.51 H new ATOM 0 HB1 ALA A 32 19.027 6.161 31.160 1.00 22.44 H new ATOM 0 HB2 ALA A 32 18.017 4.902 30.410 1.00 22.44 H new ATOM 0 HB3 ALA A 32 18.548 4.728 32.100 1.00 22.44 H new ATOM 482 N PRO A 33 22.040 5.757 31.256 1.00 32.33 N ATOM 483 CA PRO A 33 23.217 6.157 32.044 1.00 35.40 C ATOM 484 C PRO A 33 22.854 6.523 33.485 1.00 50.42 C ATOM 485 O PRO A 33 21.825 7.147 33.737 1.00 70.53 O ATOM 486 CB PRO A 33 23.766 7.388 31.301 1.00 73.33 C ATOM 487 CG PRO A 33 23.147 7.344 29.946 1.00 10.15 C ATOM 488 CD PRO A 33 21.811 6.671 30.118 1.00 32.53 C ATOM 0 HA PRO A 33 23.938 5.344 32.125 1.00 35.40 H new ATOM 0 HB2 PRO A 33 23.505 8.309 31.822 1.00 73.33 H new ATOM 0 HB3 PRO A 33 24.854 7.355 31.237 1.00 73.33 H new ATOM 0 HG2 PRO A 33 23.028 8.348 29.539 1.00 10.15 H new ATOM 0 HG3 PRO A 33 23.775 6.790 29.248 1.00 10.15 H new ATOM 0 HD2 PRO A 33 21.021 7.391 30.332 1.00 32.53 H new ATOM 0 HD3 PRO A 33 21.514 6.130 29.220 1.00 32.53 H new ATOM 496 N ARG A 34 23.715 6.144 34.421 1.00 10.53 N ATOM 497 CA ARG A 34 23.460 6.358 35.845 1.00 33.33 C ATOM 498 C ARG A 34 23.563 7.835 36.219 1.00 40.12 C ATOM 499 O ARG A 34 22.803 8.319 37.051 1.00 0.24 O ATOM 500 CB ARG A 34 24.452 5.540 36.681 1.00 35.21 C ATOM 501 CG ARG A 34 24.310 5.719 38.185 1.00 34.41 C ATOM 502 CD ARG A 34 22.977 5.207 38.720 1.00 50.12 C ATOM 503 NE ARG A 34 22.843 5.445 40.161 1.00 3.50 N ATOM 504 CZ ARG A 34 22.544 4.506 41.061 1.00 2.33 C ATOM 505 NH1 ARG A 34 22.356 3.246 40.683 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 22.440 4.828 42.341 1.00 21.42 N ATOM 0 H ARG A 34 24.603 5.684 34.220 1.00 10.53 H new ATOM 0 HA ARG A 34 22.442 6.029 36.055 1.00 33.33 H new ATOM 0 HB2 ARG A 34 24.326 4.484 36.440 1.00 35.21 H new ATOM 0 HB3 ARG A 34 25.466 5.815 36.390 1.00 35.21 H new ATOM 0 HG2 ARG A 34 25.123 5.194 38.687 1.00 34.41 H new ATOM 0 HG3 ARG A 34 24.413 6.776 38.431 1.00 34.41 H new ATOM 0 HD2 ARG A 34 22.160 5.699 38.192 1.00 50.12 H new ATOM 0 HD3 ARG A 34 22.890 4.139 38.518 1.00 50.12 H new ATOM 0 HE ARG A 34 22.989 6.396 40.499 1.00 3.50 H new ATOM 0 HH11 ARG A 34 22.440 2.991 39.699 1.00 23.02 H new ATOM 0 HH12 ARG A 34 22.128 2.534 41.377 1.00 23.02 H new ATOM 0 HH21 ARG A 34 22.588 5.792 42.638 1.00 21.42 H new ATOM 0 HH22 ARG A 34 22.212 4.112 43.030 1.00 21.42 H new ATOM 520 N GLU A 35 24.486 8.541 35.575 1.00 72.31 N ATOM 521 CA GLU A 35 24.843 9.908 35.966 1.00 75.14 C ATOM 522 C GLU A 35 23.647 10.863 35.956 1.00 65.21 C ATOM 523 O GLU A 35 23.653 11.875 36.659 1.00 33.12 O ATOM 524 CB GLU A 35 25.951 10.443 35.053 1.00 20.34 C ATOM 525 CG GLU A 35 27.169 9.530 34.978 1.00 71.30 C ATOM 526 CD GLU A 35 27.656 9.092 36.349 1.00 31.03 C ATOM 527 OE1 GLU A 35 28.277 9.913 37.059 1.00 31.45 O ATOM 528 OE2 GLU A 35 27.415 7.927 36.726 1.00 43.03 O1- ATOM 0 H GLU A 35 25.007 8.189 34.772 1.00 72.31 H new ATOM 0 HA GLU A 35 25.200 9.860 36.995 1.00 75.14 H new ATOM 0 HB2 GLU A 35 25.549 10.582 34.050 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.263 11.424 35.410 1.00 20.34 H new ATOM 0 HG2 GLU A 35 26.922 8.649 34.386 1.00 71.30 H new ATOM 0 HG3 GLU A 35 27.975 10.048 34.458 1.00 71.30 H new ATOM 535 N LEU A 36 22.629 10.547 35.163 1.00 33.22 N ATOM 536 CA LEU A 36 21.443 11.401 35.062 1.00 32.24 C ATOM 537 C LEU A 36 20.310 10.842 35.927 1.00 55.25 C ATOM 538 O LEU A 36 19.140 11.185 35.740 1.00 40.24 O ATOM 539 CB LEU A 36 20.978 11.528 33.597 1.00 11.21 C ATOM 540 CG LEU A 36 22.049 11.970 32.574 1.00 24.22 C ATOM 541 CD1 LEU A 36 22.880 13.144 33.100 1.00 52.21 C ATOM 542 CD2 LEU A 36 22.944 10.797 32.182 1.00 63.44 C ATOM 0 H LEU A 36 22.597 9.710 34.581 1.00 33.22 H new ATOM 0 HA LEU A 36 21.709 12.394 35.424 1.00 32.24 H new ATOM 0 HB2 LEU A 36 20.579 10.564 33.280 1.00 11.21 H new ATOM 0 HB3 LEU A 36 20.155 12.241 33.560 1.00 11.21 H new ATOM 0 HG LEU A 36 21.528 12.314 31.680 1.00 24.22 H new ATOM 0 HD11 LEU A 36 23.623 13.427 32.354 1.00 52.21 H new ATOM 0 HD12 LEU A 36 22.225 13.992 33.301 1.00 52.21 H new ATOM 0 HD13 LEU A 36 23.384 12.849 34.020 1.00 52.21 H new ATOM 0 HD21 LEU A 36 23.690 11.133 31.461 1.00 63.44 H new ATOM 0 HD22 LEU A 36 23.445 10.410 33.069 1.00 63.44 H new ATOM 0 HD23 LEU A 36 22.337 10.010 31.735 1.00 63.44 H new ATOM 554 N GLY A 37 20.673 9.999 36.889 1.00 72.22 N ATOM 555 CA GLY A 37 19.688 9.348 37.734 1.00 12.23 C ATOM 556 C GLY A 37 19.165 8.069 37.111 1.00 31.23 C ATOM 557 O GLY A 37 18.017 7.679 37.336 1.00 41.24 O ATOM 0 H GLY A 37 21.640 9.754 37.099 1.00 72.22 H new ATOM 0 HA2 GLY A 37 20.133 9.124 38.704 1.00 12.23 H new ATOM 0 HA3 GLY A 37 18.857 10.030 37.914 1.00 12.23 H new ATOM 561 N GLY A 38 20.015 7.415 36.325 1.00 73.44 N ATOM 562 CA GLY A 38 19.624 6.195 35.640 1.00 31.42 C ATOM 563 C GLY A 38 20.095 4.950 36.364 1.00 22.15 C ATOM 564 O GLY A 38 19.952 4.844 37.585 1.00 21.21 O ATOM 0 H GLY A 38 20.975 7.711 36.149 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.539 6.167 35.544 1.00 31.42 H new ATOM 0 HA3 GLY A 38 20.033 6.201 34.630 1.00 31.42 H new ATOM 568 N ALA A 39 20.681 4.013 35.618 1.00 14.21 N ATOM 569 CA ALA A 39 21.099 2.727 36.182 1.00 43.43 C ATOM 570 C ALA A 39 22.606 2.497 36.044 1.00 63.22 C ATOM 571 O ALA A 39 23.206 1.803 36.864 1.00 3.43 O ATOM 572 CB ALA A 39 20.327 1.594 35.513 1.00 5.43 C ATOM 0 H ALA A 39 20.877 4.119 34.623 1.00 14.21 H new ATOM 0 HA ALA A 39 20.874 2.745 37.248 1.00 43.43 H new ATOM 0 HB1 ALA A 39 20.642 0.640 35.936 1.00 5.43 H new ATOM 0 HB2 ALA A 39 19.259 1.732 35.683 1.00 5.43 H new ATOM 0 HB3 ALA A 39 20.528 1.600 34.442 1.00 5.43 H new ATOM 578 N GLY A 40 23.211 3.113 35.032 1.00 15.31 N ATOM 579 CA GLY A 40 24.613 2.858 34.708 1.00 42.15 C ATOM 580 C GLY A 40 24.947 1.380 34.592 1.00 45.53 C ATOM 581 O GLY A 40 26.003 0.938 35.048 1.00 15.12 O ATOM 0 H GLY A 40 22.754 3.791 34.423 1.00 15.31 H new ATOM 0 HA2 GLY A 40 24.857 3.353 33.768 1.00 42.15 H new ATOM 0 HA3 GLY A 40 25.243 3.306 35.476 1.00 42.15 H new ATOM 585 N ALA A 41 24.048 0.613 33.983 1.00 5.32 N ATOM 586 CA ALA A 41 24.267 -0.819 33.803 1.00 5.21 C ATOM 587 C ALA A 41 25.330 -1.071 32.740 1.00 44.21 C ATOM 588 O ALA A 41 25.700 -0.163 31.994 1.00 13.22 O ATOM 589 CB ALA A 41 22.964 -1.516 33.437 1.00 40.21 C ATOM 0 H ALA A 41 23.164 0.957 33.607 1.00 5.32 H new ATOM 0 HA ALA A 41 24.624 -1.233 34.746 1.00 5.21 H new ATOM 0 HB1 ALA A 41 23.146 -2.583 33.307 1.00 40.21 H new ATOM 0 HB2 ALA A 41 22.235 -1.367 34.234 1.00 40.21 H new ATOM 0 HB3 ALA A 41 22.576 -1.098 32.508 1.00 40.21 H new ATOM 595 N GLU A 42 25.797 -2.313 32.658 1.00 32.32 N ATOM 596 CA GLU A 42 26.865 -2.687 31.729 1.00 71.23 C ATOM 597 C GLU A 42 26.311 -2.975 30.328 1.00 1.12 C ATOM 598 O GLU A 42 26.780 -3.875 29.627 1.00 55.43 O ATOM 599 CB GLU A 42 27.632 -3.902 32.278 1.00 42.31 C ATOM 600 CG GLU A 42 26.759 -5.120 32.563 1.00 52.14 C ATOM 601 CD GLU A 42 27.560 -6.292 33.109 1.00 31.41 C ATOM 602 OE1 GLU A 42 28.112 -7.072 32.301 1.00 24.22 O ATOM 603 OE2 GLU A 42 27.647 -6.434 34.349 1.00 54.53 O1- ATOM 0 H GLU A 42 25.451 -3.085 33.228 1.00 32.32 H new ATOM 0 HA GLU A 42 27.554 -1.847 31.638 1.00 71.23 H new ATOM 0 HB2 GLU A 42 28.404 -4.183 31.562 1.00 42.31 H new ATOM 0 HB3 GLU A 42 28.140 -3.611 33.197 1.00 42.31 H new ATOM 0 HG2 GLU A 42 25.984 -4.848 33.279 1.00 52.14 H new ATOM 0 HG3 GLU A 42 26.254 -5.424 31.646 1.00 52.14 H new ATOM 610 N GLY A 43 25.320 -2.187 29.922 1.00 3.30 N ATOM 611 CA GLY A 43 24.746 -2.310 28.594 1.00 20.41 C ATOM 612 C GLY A 43 25.181 -1.163 27.704 1.00 55.55 C ATOM 613 O GLY A 43 26.352 -0.783 27.708 1.00 25.21 O ATOM 0 H GLY A 43 24.900 -1.457 30.497 1.00 3.30 H new ATOM 0 HA2 GLY A 43 25.052 -3.257 28.148 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.658 -2.328 28.665 1.00 20.41 H new ATOM 617 N THR A 44 24.243 -0.607 26.946 1.00 1.14 N ATOM 618 CA THR A 44 24.520 0.544 26.096 1.00 0.00 C ATOM 619 C THR A 44 23.481 1.630 26.344 1.00 54.32 C ATOM 620 O THR A 44 22.467 1.384 26.997 1.00 53.24 O ATOM 621 CB THR A 44 24.520 0.147 24.599 1.00 74.01 C ATOM 622 OG1 THR A 44 23.237 -0.371 24.224 1.00 60.01 O ATOM 623 CG2 THR A 44 25.583 -0.906 24.317 1.00 54.14 C ATOM 0 H THR A 44 23.279 -0.937 26.903 1.00 1.14 H new ATOM 0 HA THR A 44 25.511 0.923 26.347 1.00 0.00 H new ATOM 0 HB THR A 44 24.741 1.041 24.016 1.00 74.01 H new ATOM 0 HG1 THR A 44 23.271 -1.350 24.209 1.00 60.01 H new ATOM 0 HG21 THR A 44 25.563 -1.169 23.259 1.00 54.14 H new ATOM 0 HG22 THR A 44 26.565 -0.510 24.574 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.382 -1.795 24.915 1.00 54.14 H new ATOM 631 N ASN A 45 23.738 2.832 25.841 1.00 72.33 N ATOM 632 CA ASN A 45 22.809 3.947 26.008 1.00 33.43 C ATOM 633 C ASN A 45 21.998 4.142 24.731 1.00 24.30 C ATOM 634 O ASN A 45 22.547 4.055 23.631 1.00 63.01 O ATOM 635 CB ASN A 45 23.568 5.236 26.360 1.00 4.20 C ATOM 636 CG ASN A 45 24.410 5.109 27.622 1.00 5.33 C ATOM 637 OD1 ASN A 45 25.441 5.768 27.757 1.00 50.31 O ATOM 638 ND2 ASN A 45 23.981 4.270 28.558 1.00 41.45 N ATOM 0 H ASN A 45 24.581 3.061 25.314 1.00 72.33 H new ATOM 0 HA ASN A 45 22.130 3.716 26.829 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.214 5.509 25.526 1.00 4.20 H new ATOM 0 HB3 ASN A 45 22.852 6.048 26.488 1.00 4.20 H new ATOM 0 HD21 ASN A 45 24.511 4.156 29.422 1.00 41.45 H new ATOM 0 HD22 ASN A 45 23.122 3.740 28.413 1.00 41.45 H new ATOM 645 N PRO A 46 20.683 4.408 24.856 1.00 63.04 N ATOM 646 CA PRO A 46 19.789 4.581 23.698 1.00 61.02 C ATOM 647 C PRO A 46 20.280 5.668 22.738 1.00 4.44 C ATOM 648 O PRO A 46 20.353 5.455 21.524 1.00 23.02 O ATOM 649 CB PRO A 46 18.448 4.979 24.336 1.00 23.35 C ATOM 650 CG PRO A 46 18.515 4.443 25.725 1.00 42.23 C ATOM 651 CD PRO A 46 19.957 4.562 26.135 1.00 1.14 C ATOM 0 HA PRO A 46 19.730 3.679 23.090 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.315 6.061 24.335 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.607 4.554 23.788 1.00 23.35 H new ATOM 0 HG2 PRO A 46 17.869 5.010 26.395 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.181 3.406 25.762 1.00 42.23 H new ATOM 0 HD2 PRO A 46 20.165 5.524 26.603 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.237 3.791 26.853 1.00 1.14 H new ATOM 659 N GLU A 47 20.637 6.818 23.298 1.00 25.31 N ATOM 660 CA GLU A 47 21.116 7.956 22.514 1.00 53.11 C ATOM 661 C GLU A 47 22.421 7.600 21.810 1.00 42.42 C ATOM 662 O GLU A 47 22.651 7.981 20.662 1.00 0.52 O ATOM 663 CB GLU A 47 21.322 9.183 23.421 1.00 52.55 C ATOM 664 CG GLU A 47 20.031 9.752 24.017 1.00 35.10 C ATOM 665 CD GLU A 47 19.208 8.711 24.763 1.00 32.04 C ATOM 666 OE1 GLU A 47 18.045 8.472 24.369 1.00 53.13 O ATOM 667 OE2 GLU A 47 19.739 8.099 25.717 1.00 62.13 O1- ATOM 0 H GLU A 47 20.604 6.990 24.303 1.00 25.31 H new ATOM 0 HA GLU A 47 20.365 8.199 21.762 1.00 53.11 H new ATOM 0 HB2 GLU A 47 21.994 8.910 24.235 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.818 9.965 22.847 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.280 10.566 24.698 1.00 35.10 H new ATOM 0 HG3 GLU A 47 19.426 10.180 23.217 1.00 35.10 H new ATOM 674 N GLN A 48 23.267 6.854 22.513 1.00 41.14 N ATOM 675 CA GLN A 48 24.539 6.397 21.966 1.00 71.11 C ATOM 676 C GLN A 48 24.284 5.407 20.831 1.00 34.04 C ATOM 677 O GLN A 48 24.981 5.413 19.814 1.00 32.22 O ATOM 678 CB GLN A 48 25.382 5.765 23.091 1.00 12.45 C ATOM 679 CG GLN A 48 26.810 5.373 22.704 1.00 72.35 C ATOM 680 CD GLN A 48 26.916 3.985 22.089 1.00 3.55 C ATOM 681 OE1 GLN A 48 27.053 2.990 22.799 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.881 3.908 20.767 1.00 72.04 N ATOM 0 H GLN A 48 23.092 6.551 23.471 1.00 41.14 H new ATOM 0 HA GLN A 48 25.096 7.240 21.556 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.430 6.467 23.924 1.00 12.45 H new ATOM 0 HB3 GLN A 48 24.865 4.876 23.453 1.00 12.45 H new ATOM 0 HG2 GLN A 48 27.200 6.105 21.997 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.443 5.418 23.590 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.766 4.755 20.210 1.00 72.04 H new ATOM 0 HE22 GLN A 48 26.969 3.002 20.306 1.00 72.04 H new ATOM 691 N LEU A 49 23.261 4.573 21.008 1.00 51.33 N ATOM 692 CA LEU A 49 22.895 3.569 20.016 1.00 61.13 C ATOM 693 C LEU A 49 22.434 4.261 18.732 1.00 21.55 C ATOM 694 O LEU A 49 22.901 3.932 17.639 1.00 71.11 O ATOM 695 CB LEU A 49 21.798 2.643 20.588 1.00 4.20 C ATOM 696 CG LEU A 49 21.569 1.302 19.855 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.927 1.507 18.484 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.882 0.531 19.729 1.00 52.41 C ATOM 0 H LEU A 49 22.667 4.575 21.838 1.00 51.33 H new ATOM 0 HA LEU A 49 23.761 2.952 19.776 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.045 2.425 21.627 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.857 3.193 20.593 1.00 4.20 H new ATOM 0 HG LEU A 49 20.874 0.713 20.453 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.783 0.540 18.002 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.962 2.000 18.604 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.577 2.127 17.867 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.703 -0.411 19.210 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.600 1.125 19.164 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.281 0.328 20.723 1.00 52.41 H new ATOM 710 N PHE A 50 21.525 5.225 18.876 1.00 3.42 N ATOM 711 CA PHE A 50 21.041 6.012 17.741 1.00 25.51 C ATOM 712 C PHE A 50 22.194 6.762 17.085 1.00 64.45 C ATOM 713 O PHE A 50 22.310 6.785 15.866 1.00 15.22 O ATOM 714 CB PHE A 50 19.952 6.996 18.194 1.00 52.14 C ATOM 715 CG PHE A 50 19.607 8.069 17.180 1.00 40.34 C ATOM 716 CD1 PHE A 50 19.007 7.754 15.964 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.864 9.405 17.459 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.673 8.740 15.060 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.535 10.393 16.553 1.00 34.34 C ATOM 720 CZ PHE A 50 18.937 10.060 15.353 1.00 61.21 C ATOM 0 H PHE A 50 21.107 5.481 19.771 1.00 3.42 H new ATOM 0 HA PHE A 50 20.608 5.331 17.008 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.048 6.434 18.430 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.277 7.478 19.116 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.800 6.721 15.725 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.327 9.674 18.397 1.00 31.01 H new ATOM 0 HE1 PHE A 50 18.205 8.478 14.123 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.745 11.427 16.782 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.677 10.833 14.646 1.00 61.21 H new ATOM 730 N ALA A 51 23.036 7.378 17.906 1.00 33.43 N ATOM 731 CA ALA A 51 24.220 8.080 17.421 1.00 33.33 C ATOM 732 C ALA A 51 25.057 7.187 16.508 1.00 4.13 C ATOM 733 O ALA A 51 25.372 7.556 15.372 1.00 52.03 O ATOM 734 CB ALA A 51 25.062 8.562 18.596 1.00 51.41 C ATOM 0 H ALA A 51 22.920 7.406 18.919 1.00 33.43 H new ATOM 0 HA ALA A 51 23.888 8.941 16.841 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.943 9.084 18.222 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.472 9.240 19.212 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.374 7.707 19.195 1.00 51.41 H new ATOM 740 N ALA A 52 25.395 6.003 17.009 1.00 32.43 N ATOM 741 CA ALA A 52 26.229 5.053 16.272 1.00 41.10 C ATOM 742 C ALA A 52 25.514 4.545 15.022 1.00 30.53 C ATOM 743 O ALA A 52 26.092 4.500 13.934 1.00 13.40 O ATOM 744 CB ALA A 52 26.620 3.885 17.172 1.00 51.43 C ATOM 0 H ALA A 52 25.103 5.675 17.929 1.00 32.43 H new ATOM 0 HA ALA A 52 27.133 5.572 15.954 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.240 3.186 16.612 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.179 4.258 18.030 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.721 3.375 17.518 1.00 51.43 H new ATOM 750 N GLY A 53 24.251 4.170 15.190 1.00 32.23 N ATOM 751 CA GLY A 53 23.470 3.640 14.087 1.00 45.35 C ATOM 752 C GLY A 53 23.250 4.664 12.992 1.00 24.44 C ATOM 753 O GLY A 53 23.316 4.340 11.812 1.00 23.31 O ATOM 0 H GLY A 53 23.751 4.224 16.077 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.978 2.770 13.671 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.505 3.298 14.460 1.00 45.35 H new ATOM 757 N TYR A 54 23.001 5.906 13.397 1.00 20.42 N ATOM 758 CA TYR A 54 22.752 7.003 12.468 1.00 1.52 C ATOM 759 C TYR A 54 24.025 7.359 11.707 1.00 10.14 C ATOM 760 O TYR A 54 24.001 7.495 10.485 1.00 3.35 O ATOM 761 CB TYR A 54 22.213 8.226 13.232 1.00 4.31 C ATOM 762 CG TYR A 54 22.066 9.493 12.402 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.779 9.441 11.041 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.213 10.747 12.988 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.650 10.595 10.293 1.00 65.13 C ATOM 766 CE2 TYR A 54 22.081 11.904 12.246 1.00 14.31 C ATOM 767 CZ TYR A 54 21.802 11.822 10.898 1.00 61.32 C ATOM 768 OH TYR A 54 21.675 12.973 10.152 1.00 14.13 O ATOM 0 H TYR A 54 22.966 6.180 14.379 1.00 20.42 H new ATOM 0 HA TYR A 54 22.002 6.687 11.742 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.241 7.972 13.654 1.00 4.31 H new ATOM 0 HB3 TYR A 54 22.879 8.434 14.069 1.00 4.31 H new ATOM 0 HD1 TYR A 54 21.655 8.481 10.561 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.434 10.816 14.043 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.431 10.535 9.237 1.00 65.13 H new ATOM 0 HE2 TYR A 54 22.196 12.868 12.719 1.00 14.31 H new ATOM 0 HH TYR A 54 21.810 13.753 10.729 1.00 14.13 H new ATOM 778 N SER A 55 25.130 7.501 12.428 1.00 11.10 N ATOM 779 CA SER A 55 26.404 7.843 11.804 1.00 22.53 C ATOM 780 C SER A 55 26.802 6.768 10.790 1.00 50.31 C ATOM 781 O SER A 55 27.126 7.074 9.638 1.00 23.31 O ATOM 782 CB SER A 55 27.487 8.027 12.873 1.00 0.44 C ATOM 783 OG SER A 55 27.543 6.915 13.748 1.00 35.10 O ATOM 0 H SER A 55 25.171 7.386 13.441 1.00 11.10 H new ATOM 0 HA SER A 55 26.296 8.787 11.270 1.00 22.53 H new ATOM 0 HB2 SER A 55 28.456 8.163 12.392 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.285 8.933 13.445 1.00 0.44 H new ATOM 0 HG SER A 55 26.833 6.991 14.419 1.00 35.10 H new ATOM 789 N ALA A 56 26.735 5.509 11.217 1.00 25.24 N ATOM 790 CA ALA A 56 27.014 4.379 10.337 1.00 63.14 C ATOM 791 C ALA A 56 26.024 4.345 9.171 1.00 34.41 C ATOM 792 O ALA A 56 26.403 4.103 8.024 1.00 72.41 O ATOM 793 CB ALA A 56 26.962 3.075 11.123 1.00 2.41 C ATOM 0 H ALA A 56 26.489 5.246 12.171 1.00 25.24 H new ATOM 0 HA ALA A 56 28.017 4.498 9.927 1.00 63.14 H new ATOM 0 HB1 ALA A 56 27.172 2.239 10.455 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.707 3.100 11.919 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.970 2.952 11.558 1.00 2.41 H new ATOM 799 N CYS A 57 24.755 4.613 9.475 1.00 43.11 N ATOM 800 CA CYS A 57 23.705 4.631 8.462 1.00 65.50 C ATOM 801 C CYS A 57 23.975 5.727 7.438 1.00 1.30 C ATOM 802 O CYS A 57 23.702 5.559 6.248 1.00 31.43 O ATOM 803 CB CYS A 57 22.326 4.842 9.102 1.00 74.40 C ATOM 804 SG CYS A 57 20.954 4.845 7.923 1.00 3.24 S ATOM 0 H CYS A 57 24.430 4.821 10.419 1.00 43.11 H new ATOM 0 HA CYS A 57 23.707 3.664 7.959 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.156 4.057 9.838 1.00 74.40 H new ATOM 0 HB3 CYS A 57 22.329 5.789 9.641 1.00 74.40 H new ATOM 0 HG CYS A 57 19.947 5.491 8.431 1.00 3.24 H new ATOM 810 N PHE A 58 24.512 6.851 7.910 1.00 12.51 N ATOM 811 CA PHE A 58 24.782 7.991 7.048 1.00 55.51 C ATOM 812 C PHE A 58 25.898 7.640 6.065 1.00 60.31 C ATOM 813 O PHE A 58 25.923 8.131 4.937 1.00 54.45 O ATOM 814 CB PHE A 58 25.158 9.223 7.888 1.00 64.12 C ATOM 815 CG PHE A 58 25.037 10.523 7.133 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.141 11.100 6.518 1.00 53.31 C ATOM 817 CD2 PHE A 58 23.809 11.164 7.031 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.020 12.286 5.819 1.00 60.42 C ATOM 819 CE2 PHE A 58 23.685 12.350 6.335 1.00 51.42 C ATOM 820 CZ PHE A 58 24.791 12.911 5.728 1.00 5.31 C ATOM 0 H PHE A 58 24.768 6.993 8.887 1.00 12.51 H new ATOM 0 HA PHE A 58 23.882 8.233 6.483 1.00 55.51 H new ATOM 0 HB2 PHE A 58 24.517 9.262 8.769 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.182 9.112 8.244 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.104 10.616 6.587 1.00 53.31 H new ATOM 0 HD2 PHE A 58 22.940 10.729 7.502 1.00 40.52 H new ATOM 0 HE1 PHE A 58 26.885 12.724 5.344 1.00 60.42 H new ATOM 0 HE2 PHE A 58 22.724 12.838 6.265 1.00 51.42 H new ATOM 0 HZ PHE A 58 24.696 13.838 5.182 1.00 5.31 H new ATOM 830 N LEU A 59 26.804 6.767 6.501 1.00 64.51 N ATOM 831 CA LEU A 59 27.867 6.260 5.638 1.00 63.33 C ATOM 832 C LEU A 59 27.264 5.423 4.514 1.00 14.15 C ATOM 833 O LEU A 59 27.549 5.653 3.338 1.00 3.51 O ATOM 834 CB LEU A 59 28.871 5.421 6.446 1.00 74.12 C ATOM 835 CG LEU A 59 29.643 6.185 7.535 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.507 5.229 8.354 1.00 61.22 C ATOM 837 CD2 LEU A 59 30.497 7.290 6.911 1.00 2.33 C ATOM 0 H LEU A 59 26.822 6.395 7.451 1.00 64.51 H new ATOM 0 HA LEU A 59 28.401 7.107 5.207 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.335 4.596 6.915 1.00 74.12 H new ATOM 0 HB3 LEU A 59 29.590 4.981 5.755 1.00 74.12 H new ATOM 0 HG LEU A 59 28.921 6.649 8.207 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.045 5.789 9.119 1.00 61.22 H new ATOM 0 HD12 LEU A 59 29.872 4.482 8.830 1.00 61.22 H new ATOM 0 HD13 LEU A 59 31.222 4.732 7.698 1.00 61.22 H new ATOM 0 HD21 LEU A 59 31.036 7.820 7.696 1.00 2.33 H new ATOM 0 HD22 LEU A 59 31.210 6.849 6.215 1.00 2.33 H new ATOM 0 HD23 LEU A 59 29.854 7.989 6.377 1.00 2.33 H new ATOM 849 N SER A 60 26.417 4.464 4.887 1.00 34.05 N ATOM 850 CA SER A 60 25.708 3.629 3.921 1.00 74.40 C ATOM 851 C SER A 60 24.875 4.498 2.974 1.00 42.34 C ATOM 852 O SER A 60 24.825 4.261 1.761 1.00 41.15 O ATOM 853 CB SER A 60 24.810 2.631 4.662 1.00 52.34 C ATOM 854 OG SER A 60 25.544 1.922 5.646 1.00 74.20 O ATOM 0 H SER A 60 26.205 4.246 5.861 1.00 34.05 H new ATOM 0 HA SER A 60 26.436 3.077 3.326 1.00 74.40 H new ATOM 0 HB2 SER A 60 23.982 3.161 5.132 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.376 1.929 3.950 1.00 52.34 H new ATOM 0 HG SER A 60 25.852 1.070 5.273 1.00 74.20 H new ATOM 860 N ALA A 61 24.236 5.520 3.540 1.00 5.22 N ATOM 861 CA ALA A 61 23.446 6.465 2.764 1.00 61.10 C ATOM 862 C ALA A 61 24.333 7.185 1.759 1.00 23.52 C ATOM 863 O ALA A 61 23.995 7.280 0.588 1.00 64.15 O ATOM 864 CB ALA A 61 22.747 7.462 3.684 1.00 23.00 C ATOM 0 H ALA A 61 24.253 5.713 4.541 1.00 5.22 H new ATOM 0 HA ALA A 61 22.679 5.916 2.218 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.161 8.160 3.086 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.087 6.926 4.366 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.493 8.012 4.258 1.00 23.00 H new ATOM 870 N MET A 62 25.484 7.665 2.221 1.00 1.42 N ATOM 871 CA MET A 62 26.451 8.334 1.351 1.00 22.23 C ATOM 872 C MET A 62 26.936 7.386 0.256 1.00 52.25 C ATOM 873 O MET A 62 27.118 7.791 -0.894 1.00 52.11 O ATOM 874 CB MET A 62 27.642 8.860 2.173 1.00 12.31 C ATOM 875 CG MET A 62 27.357 10.149 2.946 1.00 13.45 C ATOM 876 SD MET A 62 27.837 11.647 2.047 1.00 13.34 S ATOM 877 CE MET A 62 26.846 11.535 0.556 1.00 61.32 C ATOM 0 H MET A 62 25.772 7.603 3.197 1.00 1.42 H new ATOM 0 HA MET A 62 25.956 9.182 0.877 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.950 8.088 2.879 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.483 9.032 1.502 1.00 12.31 H new ATOM 0 HG2 MET A 62 26.293 10.198 3.177 1.00 13.45 H new ATOM 0 HG3 MET A 62 27.889 10.119 3.897 1.00 13.45 H new ATOM 0 HE1 MET A 62 26.911 12.473 0.005 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.217 10.721 -0.067 1.00 61.32 H new ATOM 0 HE3 MET A 62 25.807 11.343 0.823 1.00 61.32 H new ATOM 887 N LYS A 63 27.127 6.121 0.623 1.00 50.31 N ATOM 888 CA LYS A 63 27.553 5.090 -0.317 1.00 32.21 C ATOM 889 C LYS A 63 26.548 4.968 -1.462 1.00 55.33 C ATOM 890 O LYS A 63 26.919 5.014 -2.640 1.00 31.21 O ATOM 891 CB LYS A 63 27.692 3.743 0.416 1.00 32.54 C ATOM 892 CG LYS A 63 28.051 2.560 -0.484 1.00 62.32 C ATOM 893 CD LYS A 63 29.438 2.704 -1.103 1.00 52.53 C ATOM 894 CE LYS A 63 29.791 1.508 -1.983 1.00 52.13 C ATOM 895 NZ LYS A 63 28.871 1.370 -3.146 1.00 51.23 N1+ ATOM 0 H LYS A 63 26.991 5.784 1.576 1.00 50.31 H new ATOM 0 HA LYS A 63 28.520 5.369 -0.735 1.00 32.21 H new ATOM 0 HB2 LYS A 63 28.457 3.841 1.186 1.00 32.54 H new ATOM 0 HB3 LYS A 63 26.753 3.523 0.925 1.00 32.54 H new ATOM 0 HG2 LYS A 63 28.008 1.638 0.097 1.00 62.32 H new ATOM 0 HG3 LYS A 63 27.309 2.471 -1.277 1.00 62.32 H new ATOM 0 HD2 LYS A 63 29.478 3.617 -1.697 1.00 52.53 H new ATOM 0 HD3 LYS A 63 30.181 2.805 -0.312 1.00 52.53 H new ATOM 0 HE2 LYS A 63 30.814 1.614 -2.343 1.00 52.13 H new ATOM 0 HE3 LYS A 63 29.756 0.597 -1.385 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 29.246 0.655 -3.802 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 27.931 1.075 -2.812 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 28.793 2.283 -3.637 1.00 51.23 H new ATOM 909 N PHE A 64 25.275 4.831 -1.105 1.00 54.13 N ATOM 910 CA PHE A 64 24.210 4.669 -2.090 1.00 15.41 C ATOM 911 C PHE A 64 23.983 5.964 -2.875 1.00 43.31 C ATOM 912 O PHE A 64 23.885 5.948 -4.105 1.00 31.42 O ATOM 913 CB PHE A 64 22.914 4.225 -1.400 1.00 54.23 C ATOM 914 CG PHE A 64 21.780 3.961 -2.362 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.891 2.970 -3.331 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.608 4.703 -2.305 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.859 2.730 -4.218 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.576 4.464 -3.190 1.00 31.33 C ATOM 919 CZ PHE A 64 19.704 3.478 -4.148 1.00 62.32 C ATOM 0 H PHE A 64 24.954 4.829 -0.137 1.00 54.13 H new ATOM 0 HA PHE A 64 24.515 3.898 -2.797 1.00 15.41 H new ATOM 0 HB2 PHE A 64 23.110 3.320 -0.824 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.607 4.994 -0.691 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.794 2.381 -3.391 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.502 5.477 -1.559 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.958 1.957 -4.966 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.669 5.048 -3.133 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.898 3.293 -4.843 1.00 62.32 H new ATOM 929 N VAL A 65 23.911 7.083 -2.158 1.00 22.12 N ATOM 930 CA VAL A 65 23.709 8.395 -2.773 1.00 1.13 C ATOM 931 C VAL A 65 24.776 8.667 -3.830 1.00 2.04 C ATOM 932 O VAL A 65 24.471 9.131 -4.936 1.00 1.42 O ATOM 933 CB VAL A 65 23.726 9.529 -1.712 1.00 51.41 C ATOM 934 CG1 VAL A 65 23.834 10.903 -2.373 1.00 35.23 C ATOM 935 CG2 VAL A 65 22.479 9.456 -0.830 1.00 41.32 C ATOM 0 H VAL A 65 23.990 7.108 -1.141 1.00 22.12 H new ATOM 0 HA VAL A 65 22.728 8.382 -3.248 1.00 1.13 H new ATOM 0 HB VAL A 65 24.606 9.388 -1.085 1.00 51.41 H new ATOM 0 HG11 VAL A 65 23.844 11.676 -1.605 1.00 35.23 H new ATOM 0 HG12 VAL A 65 24.755 10.956 -2.953 1.00 35.23 H new ATOM 0 HG13 VAL A 65 22.980 11.057 -3.033 1.00 35.23 H new ATOM 0 HG21 VAL A 65 22.508 10.258 -0.092 1.00 41.32 H new ATOM 0 HG22 VAL A 65 21.589 9.564 -1.449 1.00 41.32 H new ATOM 0 HG23 VAL A 65 22.451 8.494 -0.319 1.00 41.32 H new ATOM 945 N ALA A 66 26.023 8.362 -3.494 1.00 10.53 N ATOM 946 CA ALA A 66 27.130 8.526 -4.426 1.00 34.24 C ATOM 947 C ALA A 66 26.872 7.721 -5.700 1.00 52.01 C ATOM 948 O ALA A 66 27.246 8.133 -6.797 1.00 55.45 O ATOM 949 CB ALA A 66 28.441 8.103 -3.772 1.00 2.15 C ATOM 0 H ALA A 66 26.293 7.999 -2.580 1.00 10.53 H new ATOM 0 HA ALA A 66 27.209 9.579 -4.697 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.259 8.231 -4.481 1.00 2.15 H new ATOM 0 HB2 ALA A 66 28.624 8.719 -2.892 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.378 7.056 -3.476 1.00 2.15 H new ATOM 955 N GLY A 67 26.178 6.599 -5.537 1.00 41.30 N ATOM 956 CA GLY A 67 25.892 5.714 -6.652 1.00 41.44 C ATOM 957 C GLY A 67 24.846 6.283 -7.592 1.00 65.01 C ATOM 958 O GLY A 67 24.864 6.010 -8.792 1.00 24.21 O ATOM 0 H GLY A 67 25.805 6.284 -4.641 1.00 41.30 H new ATOM 0 HA2 GLY A 67 26.811 5.526 -7.207 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.548 4.753 -6.270 1.00 41.44 H new ATOM 962 N GLN A 68 23.936 7.093 -7.054 1.00 2.22 N ATOM 963 CA GLN A 68 22.880 7.700 -7.859 1.00 3.22 C ATOM 964 C GLN A 68 23.292 9.109 -8.261 1.00 13.50 C ATOM 965 O GLN A 68 22.664 9.741 -9.112 1.00 73.33 O ATOM 966 CB GLN A 68 21.549 7.718 -7.091 1.00 70.02 C ATOM 967 CG GLN A 68 21.639 8.355 -5.713 1.00 23.14 C ATOM 968 CD GLN A 68 20.283 8.506 -5.050 1.00 11.52 C ATOM 969 OE1 GLN A 68 19.818 7.618 -4.339 1.00 54.51 O ATOM 970 NE2 GLN A 68 19.644 9.640 -5.276 1.00 55.13 N ATOM 0 H GLN A 68 23.909 7.343 -6.066 1.00 2.22 H new ATOM 0 HA GLN A 68 22.734 7.103 -8.759 1.00 3.22 H new ATOM 0 HB2 GLN A 68 20.808 8.257 -7.681 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.189 6.695 -6.984 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.284 7.748 -5.078 1.00 23.14 H new ATOM 0 HG3 GLN A 68 22.108 9.335 -5.800 1.00 23.14 H new ATOM 0 HE21 GLN A 68 20.065 10.352 -5.873 1.00 55.13 H new ATOM 0 HE22 GLN A 68 18.730 9.803 -4.854 1.00 55.13 H new ATOM 979 N ASN A 69 24.357 9.589 -7.632 1.00 45.10 N ATOM 980 CA ASN A 69 24.942 10.887 -7.959 1.00 61.12 C ATOM 981 C ASN A 69 26.178 10.711 -8.830 1.00 41.24 C ATOM 982 O ASN A 69 26.863 11.679 -9.163 1.00 42.44 O ATOM 983 CB ASN A 69 25.275 11.659 -6.674 1.00 43.31 C ATOM 984 CG ASN A 69 24.075 12.415 -6.125 1.00 21.20 C ATOM 985 OD1 ASN A 69 23.874 13.593 -6.432 1.00 73.01 O ATOM 986 ND2 ASN A 69 23.260 11.741 -5.333 1.00 73.35 N ATOM 0 H ASN A 69 24.840 9.093 -6.883 1.00 45.10 H new ATOM 0 HA ASN A 69 24.214 11.468 -8.525 1.00 61.12 H new ATOM 0 HB2 ASN A 69 25.639 10.962 -5.919 1.00 43.31 H new ATOM 0 HB3 ASN A 69 26.083 12.362 -6.875 1.00 43.31 H new ATOM 0 HD21 ASN A 69 22.429 12.194 -4.952 1.00 73.35 H new ATOM 0 HD22 ASN A 69 23.461 10.768 -5.103 1.00 73.35 H new ATOM 993 N LYS A 70 26.444 9.455 -9.191 1.00 63.25 N ATOM 994 CA LYS A 70 27.487 9.100 -10.156 1.00 32.31 C ATOM 995 C LYS A 70 28.867 9.550 -9.665 1.00 12.34 C ATOM 996 O LYS A 70 29.799 9.729 -10.455 1.00 70.50 O ATOM 997 CB LYS A 70 27.188 9.711 -11.542 1.00 4.35 C ATOM 998 CG LYS A 70 25.704 9.758 -11.932 1.00 13.20 C ATOM 999 CD LYS A 70 24.954 8.463 -11.617 1.00 32.43 C ATOM 1000 CE LYS A 70 23.596 8.419 -12.316 1.00 4.32 C ATOM 1001 NZ LYS A 70 22.858 7.157 -12.040 1.00 52.12 N1+ ATOM 0 H LYS A 70 25.939 8.650 -8.820 1.00 63.25 H new ATOM 0 HA LYS A 70 27.493 8.014 -10.251 1.00 32.31 H new ATOM 0 HB2 LYS A 70 27.586 10.726 -11.567 1.00 4.35 H new ATOM 0 HB3 LYS A 70 27.727 9.139 -12.297 1.00 4.35 H new ATOM 0 HG2 LYS A 70 25.224 10.584 -11.408 1.00 13.20 H new ATOM 0 HG3 LYS A 70 25.622 9.967 -12.999 1.00 13.20 H new ATOM 0 HD2 LYS A 70 25.554 7.608 -11.930 1.00 32.43 H new ATOM 0 HD3 LYS A 70 24.813 8.376 -10.540 1.00 32.43 H new ATOM 0 HE2 LYS A 70 22.995 9.267 -11.990 1.00 4.32 H new ATOM 0 HE3 LYS A 70 23.740 8.525 -13.391 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 21.944 7.174 -12.535 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 23.418 6.347 -12.375 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 22.696 7.066 -11.017 1.00 52.12 H new ATOM 1015 N GLN A 71 28.994 9.699 -8.354 1.00 41.25 N ATOM 1016 CA GLN A 71 30.237 10.151 -7.733 1.00 41.44 C ATOM 1017 C GLN A 71 30.805 9.062 -6.830 1.00 11.15 C ATOM 1018 O GLN A 71 30.120 8.086 -6.522 1.00 3.32 O ATOM 1019 CB GLN A 71 30.001 11.432 -6.929 1.00 65.11 C ATOM 1020 CG GLN A 71 28.807 11.340 -5.994 1.00 11.32 C ATOM 1021 CD GLN A 71 28.876 12.306 -4.833 1.00 14.24 C ATOM 1022 OE1 GLN A 71 28.445 13.455 -4.929 1.00 4.02 O ATOM 1023 NE2 GLN A 71 29.396 11.829 -3.725 1.00 60.02 N ATOM 0 H GLN A 71 28.243 9.511 -7.690 1.00 41.25 H new ATOM 0 HA GLN A 71 30.958 10.364 -8.522 1.00 41.44 H new ATOM 0 HB2 GLN A 71 30.894 11.657 -6.346 1.00 65.11 H new ATOM 0 HB3 GLN A 71 29.852 12.263 -7.618 1.00 65.11 H new ATOM 0 HG2 GLN A 71 27.896 11.530 -6.561 1.00 11.32 H new ATOM 0 HG3 GLN A 71 28.736 10.323 -5.607 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.740 10.869 -3.695 1.00 60.02 H new ATOM 0 HE22 GLN A 71 29.456 12.418 -2.895 1.00 60.02 H new ATOM 1032 N THR A 72 32.053 9.230 -6.407 1.00 0.13 N ATOM 1033 CA THR A 72 32.716 8.254 -5.549 1.00 33.54 C ATOM 1034 C THR A 72 33.380 8.932 -4.359 1.00 64.51 C ATOM 1035 O THR A 72 34.193 9.843 -4.524 1.00 2.32 O ATOM 1036 CB THR A 72 33.776 7.443 -6.324 1.00 55.21 C ATOM 1037 OG1 THR A 72 34.589 8.325 -7.115 1.00 1.42 O ATOM 1038 CG2 THR A 72 33.120 6.398 -7.214 1.00 71.13 C ATOM 0 H THR A 72 32.629 10.037 -6.646 1.00 0.13 H new ATOM 0 HA THR A 72 31.943 7.573 -5.192 1.00 33.54 H new ATOM 0 HB THR A 72 34.407 6.926 -5.601 1.00 55.21 H new ATOM 0 HG1 THR A 72 34.829 9.113 -6.584 1.00 1.42 H new ATOM 0 HG21 THR A 72 33.889 5.841 -7.749 1.00 71.13 H new ATOM 0 HG22 THR A 72 32.536 5.712 -6.600 1.00 71.13 H new ATOM 0 HG23 THR A 72 32.464 6.891 -7.932 1.00 71.13 H new ATOM 1046 N LEU A 73 33.021 8.479 -3.168 1.00 24.22 N ATOM 1047 CA LEU A 73 33.599 8.992 -1.930 1.00 2.33 C ATOM 1048 C LEU A 73 34.506 7.934 -1.293 1.00 44.11 C ATOM 1049 O LEU A 73 34.183 6.745 -1.319 1.00 52.40 O ATOM 1050 CB LEU A 73 32.497 9.460 -0.960 1.00 54.54 C ATOM 1051 CG LEU A 73 31.114 8.859 -1.214 1.00 53.14 C ATOM 1052 CD1 LEU A 73 31.053 7.396 -0.778 1.00 63.13 C ATOM 1053 CD2 LEU A 73 30.024 9.683 -0.530 1.00 44.41 C ATOM 0 H LEU A 73 32.323 7.748 -3.030 1.00 24.22 H new ATOM 0 HA LEU A 73 34.212 9.863 -2.162 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.802 9.215 0.057 1.00 54.54 H new ATOM 0 HB3 LEU A 73 32.421 10.546 -1.017 1.00 54.54 H new ATOM 0 HG LEU A 73 30.933 8.889 -2.289 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.056 7.000 -0.972 1.00 63.13 H new ATOM 0 HD12 LEU A 73 31.789 6.819 -1.338 1.00 63.13 H new ATOM 0 HD13 LEU A 73 31.270 7.325 0.288 1.00 63.13 H new ATOM 0 HD21 LEU A 73 29.051 9.234 -0.727 1.00 44.41 H new ATOM 0 HD22 LEU A 73 30.204 9.703 0.545 1.00 44.41 H new ATOM 0 HD23 LEU A 73 30.039 10.701 -0.920 1.00 44.41 H new ATOM 1065 N PRO A 74 35.658 8.352 -0.731 1.00 14.33 N ATOM 1066 CA PRO A 74 36.640 7.426 -0.139 1.00 71.54 C ATOM 1067 C PRO A 74 36.035 6.564 0.969 1.00 22.35 C ATOM 1068 O PRO A 74 35.456 7.084 1.925 1.00 71.04 O ATOM 1069 CB PRO A 74 37.712 8.360 0.438 1.00 0.31 C ATOM 1070 CG PRO A 74 37.569 9.627 -0.337 1.00 75.32 C ATOM 1071 CD PRO A 74 36.100 9.756 -0.630 1.00 21.31 C ATOM 0 HA PRO A 74 37.022 6.718 -0.874 1.00 71.54 H new ATOM 0 HB2 PRO A 74 37.558 8.528 1.504 1.00 0.31 H new ATOM 0 HB3 PRO A 74 38.710 7.936 0.323 1.00 0.31 H new ATOM 0 HG2 PRO A 74 37.931 10.480 0.236 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.151 9.591 -1.258 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.575 10.288 0.163 1.00 21.31 H new ATOM 0 HD3 PRO A 74 35.919 10.304 -1.555 1.00 21.31 H new ATOM 1079 N ALA A 75 36.194 5.249 0.851 1.00 74.43 N ATOM 1080 CA ALA A 75 35.652 4.311 1.834 1.00 72.21 C ATOM 1081 C ALA A 75 36.509 4.272 3.095 1.00 34.41 C ATOM 1082 O ALA A 75 36.189 3.582 4.063 1.00 42.34 O ATOM 1083 CB ALA A 75 35.521 2.918 1.227 1.00 2.05 C ATOM 0 H ALA A 75 36.696 4.806 0.082 1.00 74.43 H new ATOM 0 HA ALA A 75 34.660 4.660 2.119 1.00 72.21 H new ATOM 0 HB1 ALA A 75 35.116 2.233 1.972 1.00 2.05 H new ATOM 0 HB2 ALA A 75 34.851 2.957 0.368 1.00 2.05 H new ATOM 0 HB3 ALA A 75 36.502 2.567 0.906 1.00 2.05 H new ATOM 1089 N ASP A 76 37.584 5.036 3.080 1.00 35.21 N ATOM 1090 CA ASP A 76 38.527 5.096 4.194 1.00 24.42 C ATOM 1091 C ASP A 76 38.065 6.118 5.239 1.00 33.35 C ATOM 1092 O ASP A 76 38.814 6.506 6.139 1.00 61.01 O ATOM 1093 CB ASP A 76 39.905 5.462 3.627 1.00 72.44 C ATOM 1094 CG ASP A 76 41.027 5.425 4.658 1.00 23.12 C ATOM 1095 OD1 ASP A 76 41.204 4.385 5.324 1.00 55.31 O ATOM 1096 OD2 ASP A 76 41.759 6.432 4.783 1.00 42.23 O1- ATOM 0 H ASP A 76 37.834 5.637 2.295 1.00 35.21 H new ATOM 0 HA ASP A 76 38.582 4.131 4.697 1.00 24.42 H new ATOM 0 HB2 ASP A 76 40.147 4.775 2.816 1.00 72.44 H new ATOM 0 HB3 ASP A 76 39.855 6.461 3.194 1.00 72.44 H new ATOM 1101 N THR A 77 36.806 6.526 5.128 1.00 11.55 N ATOM 1102 CA THR A 77 36.246 7.578 5.965 1.00 12.43 C ATOM 1103 C THR A 77 35.656 7.027 7.265 1.00 50.31 C ATOM 1104 O THR A 77 35.500 5.811 7.434 1.00 30.02 O ATOM 1105 CB THR A 77 35.160 8.356 5.190 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.576 9.364 6.021 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.065 7.423 4.677 1.00 73.22 C ATOM 0 H THR A 77 36.146 6.136 4.455 1.00 11.55 H new ATOM 0 HA THR A 77 37.063 8.250 6.228 1.00 12.43 H new ATOM 0 HB THR A 77 35.644 8.826 4.334 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.279 9.959 6.357 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.317 8.003 4.136 1.00 73.22 H new ATOM 0 HG22 THR A 77 34.502 6.682 4.008 1.00 73.22 H new ATOM 0 HG23 THR A 77 33.593 6.918 5.520 1.00 73.22 H new ATOM 1115 N THR A 78 35.348 7.939 8.184 1.00 13.54 N ATOM 1116 CA THR A 78 34.771 7.602 9.481 1.00 2.03 C ATOM 1117 C THR A 78 33.943 8.782 9.998 1.00 41.21 C ATOM 1118 O THR A 78 34.245 9.935 9.697 1.00 33.42 O ATOM 1119 CB THR A 78 35.871 7.274 10.522 1.00 65.01 C ATOM 1120 OG1 THR A 78 36.758 6.262 10.015 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.274 6.800 11.842 1.00 52.04 C ATOM 0 H THR A 78 35.493 8.939 8.048 1.00 13.54 H new ATOM 0 HA THR A 78 34.142 6.722 9.347 1.00 2.03 H new ATOM 0 HB THR A 78 36.426 8.194 10.703 1.00 65.01 H new ATOM 0 HG1 THR A 78 37.448 6.067 10.683 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.076 6.580 12.546 1.00 52.04 H new ATOM 0 HG22 THR A 78 34.634 7.581 12.253 1.00 52.04 H new ATOM 0 HG23 THR A 78 34.684 5.900 11.672 1.00 52.04 H new ATOM 1129 N VAL A 79 32.906 8.490 10.770 1.00 13.33 N ATOM 1130 CA VAL A 79 32.082 9.519 11.400 1.00 51.35 C ATOM 1131 C VAL A 79 31.952 9.240 12.887 1.00 40.33 C ATOM 1132 O VAL A 79 31.441 8.200 13.296 1.00 15.54 O ATOM 1133 CB VAL A 79 30.665 9.609 10.775 1.00 73.54 C ATOM 1134 CG1 VAL A 79 29.778 10.578 11.560 1.00 32.33 C ATOM 1135 CG2 VAL A 79 30.756 10.038 9.320 1.00 4.51 C ATOM 0 H VAL A 79 32.610 7.536 10.979 1.00 13.33 H new ATOM 0 HA VAL A 79 32.582 10.473 11.233 1.00 51.35 H new ATOM 0 HB VAL A 79 30.211 8.619 10.823 1.00 73.54 H new ATOM 0 HG11 VAL A 79 28.791 10.622 11.100 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.684 10.232 12.589 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.227 11.571 11.551 1.00 32.33 H new ATOM 0 HG21 VAL A 79 29.754 10.097 8.895 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.234 11.015 9.258 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.345 9.310 8.762 1.00 4.51 H new ATOM 1145 N THR A 80 32.422 10.165 13.697 1.00 3.21 N ATOM 1146 CA THR A 80 32.347 10.009 15.137 1.00 52.54 C ATOM 1147 C THR A 80 31.157 10.784 15.692 1.00 43.34 C ATOM 1148 O THR A 80 31.155 12.017 15.700 1.00 4.30 O ATOM 1149 CB THR A 80 33.646 10.475 15.824 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.777 9.934 15.125 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.683 10.016 17.279 1.00 20.33 C ATOM 0 H THR A 80 32.860 11.032 13.385 1.00 3.21 H new ATOM 0 HA THR A 80 32.215 8.948 15.349 1.00 52.54 H new ATOM 0 HB THR A 80 33.680 11.564 15.801 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.603 10.231 15.560 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.608 10.356 17.744 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.832 10.436 17.815 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.635 8.928 17.319 1.00 20.33 H new ATOM 1159 N ALA A 81 30.139 10.053 16.122 1.00 63.21 N ATOM 1160 CA ALA A 81 28.953 10.650 16.716 1.00 75.00 C ATOM 1161 C ALA A 81 29.102 10.697 18.233 1.00 14.40 C ATOM 1162 O ALA A 81 29.038 9.667 18.905 1.00 73.21 O ATOM 1163 CB ALA A 81 27.712 9.860 16.317 1.00 42.42 C ATOM 0 H ALA A 81 30.112 9.035 16.069 1.00 63.21 H new ATOM 0 HA ALA A 81 28.841 11.670 16.347 1.00 75.00 H new ATOM 0 HB1 ALA A 81 26.830 10.316 16.767 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.610 9.867 15.232 1.00 42.42 H new ATOM 0 HB3 ALA A 81 27.807 8.832 16.666 1.00 42.42 H new ATOM 1169 N GLU A 82 29.330 11.892 18.759 1.00 71.31 N ATOM 1170 CA GLU A 82 29.518 12.083 20.193 1.00 72.51 C ATOM 1171 C GLU A 82 28.311 12.817 20.769 1.00 53.13 C ATOM 1172 O GLU A 82 28.108 14.003 20.502 1.00 25.01 O ATOM 1173 CB GLU A 82 30.819 12.858 20.459 1.00 74.00 C ATOM 1174 CG GLU A 82 31.212 12.928 21.933 1.00 3.23 C ATOM 1175 CD GLU A 82 32.591 13.535 22.152 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.599 12.827 21.949 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.680 14.723 22.522 1.00 51.44 O1- ATOM 0 H GLU A 82 29.390 12.750 18.211 1.00 71.31 H new ATOM 0 HA GLU A 82 29.602 11.113 20.684 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.629 12.390 19.900 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.711 13.872 20.074 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.471 13.518 22.473 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.191 11.924 22.357 1.00 3.23 H new ATOM 1184 N VAL A 83 27.499 12.099 21.536 1.00 31.40 N ATOM 1185 CA VAL A 83 26.245 12.637 22.045 1.00 74.25 C ATOM 1186 C VAL A 83 26.355 12.988 23.522 1.00 12.15 C ATOM 1187 O VAL A 83 27.031 12.303 24.290 1.00 3.30 O ATOM 1188 CB VAL A 83 25.070 11.647 21.841 1.00 22.15 C ATOM 1189 CG1 VAL A 83 24.765 11.475 20.357 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.375 10.297 22.493 1.00 42.03 C ATOM 0 H VAL A 83 27.689 11.138 21.820 1.00 31.40 H new ATOM 0 HA VAL A 83 26.041 13.543 21.475 1.00 74.25 H new ATOM 0 HB VAL A 83 24.187 12.063 22.326 1.00 22.15 H new ATOM 0 HG11 VAL A 83 23.937 10.776 20.234 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.493 12.439 19.927 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.646 11.086 19.847 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.536 9.619 22.336 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.273 9.872 22.046 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.534 10.437 23.562 1.00 42.03 H new ATOM 1200 N GLY A 84 25.678 14.056 23.905 1.00 33.12 N ATOM 1201 CA GLY A 84 25.679 14.504 25.275 1.00 23.12 C ATOM 1202 C GLY A 84 24.312 14.971 25.712 1.00 64.22 C ATOM 1203 O GLY A 84 23.439 15.226 24.883 1.00 21.33 O ATOM 0 H GLY A 84 25.117 14.630 23.275 1.00 33.12 H new ATOM 0 HA2 GLY A 84 26.010 13.692 25.923 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.395 15.317 25.391 1.00 23.12 H new ATOM 1207 N ILE A 85 24.132 15.087 27.015 1.00 23.52 N ATOM 1208 CA ILE A 85 22.877 15.517 27.599 1.00 1.40 C ATOM 1209 C ILE A 85 23.160 16.461 28.759 1.00 61.15 C ATOM 1210 O ILE A 85 24.000 16.168 29.620 1.00 10.52 O ATOM 1211 CB ILE A 85 22.024 14.299 28.067 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.708 14.741 28.752 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.840 13.387 28.985 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.821 14.990 30.246 1.00 71.32 C ATOM 0 H ILE A 85 24.858 14.884 27.702 1.00 23.52 H new ATOM 0 HA ILE A 85 22.297 16.043 26.841 1.00 1.40 H new ATOM 0 HB ILE A 85 21.748 13.734 27.177 1.00 52.02 H new ATOM 0 HG12 ILE A 85 20.353 15.653 28.272 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.951 13.975 28.582 1.00 53.33 H new ATOM 0 HG21 ILE A 85 22.225 12.544 29.300 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.714 13.019 28.448 1.00 35.55 H new ATOM 0 HG23 ILE A 85 23.163 13.948 29.862 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.851 15.295 30.638 1.00 71.32 H new ATOM 0 HD12 ILE A 85 21.143 14.075 30.744 1.00 71.32 H new ATOM 0 HD13 ILE A 85 21.551 15.779 30.429 1.00 71.32 H new ATOM 1226 N GLY A 86 22.478 17.599 28.746 1.00 43.44 N ATOM 1227 CA GLY A 86 22.617 18.600 29.792 1.00 64.20 C ATOM 1228 C GLY A 86 21.292 19.280 30.077 1.00 43.21 C ATOM 1229 O GLY A 86 20.332 19.078 29.334 1.00 31.32 O ATOM 0 H GLY A 86 21.816 17.852 28.013 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.991 18.130 30.702 1.00 64.20 H new ATOM 0 HA3 GLY A 86 23.354 19.345 29.491 1.00 64.20 H new ATOM 1233 N PRO A 87 21.195 20.081 31.151 1.00 20.43 N ATOM 1234 CA PRO A 87 19.953 20.757 31.508 1.00 73.43 C ATOM 1235 C PRO A 87 19.753 22.037 30.700 1.00 33.24 C ATOM 1236 O PRO A 87 20.709 22.769 30.427 1.00 11.41 O ATOM 1237 CB PRO A 87 20.146 21.070 32.992 1.00 75.13 C ATOM 1238 CG PRO A 87 21.622 21.251 33.157 1.00 24.22 C ATOM 1239 CD PRO A 87 22.290 20.417 32.082 1.00 44.21 C ATOM 0 HA PRO A 87 19.070 20.152 31.303 1.00 73.43 H new ATOM 0 HB2 PRO A 87 19.603 21.970 33.280 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.775 20.259 33.619 1.00 75.13 H new ATOM 0 HG2 PRO A 87 21.896 22.301 33.057 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.942 20.931 34.149 1.00 24.22 H new ATOM 0 HD2 PRO A 87 23.082 20.974 31.581 1.00 44.21 H new ATOM 0 HD3 PRO A 87 22.746 19.520 32.500 1.00 44.21 H new ATOM 1247 N ASN A 88 18.512 22.302 30.316 1.00 50.13 N ATOM 1248 CA ASN A 88 18.187 23.496 29.540 1.00 62.23 C ATOM 1249 C ASN A 88 17.586 24.569 30.448 1.00 31.22 C ATOM 1250 O ASN A 88 17.179 24.280 31.577 1.00 11.01 O ATOM 1251 CB ASN A 88 17.233 23.153 28.377 1.00 63.43 C ATOM 1252 CG ASN A 88 15.870 22.644 28.822 1.00 21.32 C ATOM 1253 OD1 ASN A 88 15.345 23.044 29.855 1.00 63.22 O ATOM 1254 ND2 ASN A 88 15.288 21.746 28.043 1.00 22.41 N ATOM 0 H ASN A 88 17.711 21.707 30.528 1.00 50.13 H new ATOM 0 HA ASN A 88 19.107 23.890 29.107 1.00 62.23 H new ATOM 0 HB2 ASN A 88 17.094 24.041 27.761 1.00 63.43 H new ATOM 0 HB3 ASN A 88 17.703 22.398 27.746 1.00 63.43 H new ATOM 0 HD21 ASN A 88 14.376 21.366 28.296 1.00 22.41 H new ATOM 0 HD22 ASN A 88 15.752 21.434 27.190 1.00 22.41 H new ATOM 1261 N GLU A 89 17.516 25.799 29.947 1.00 43.32 N ATOM 1262 CA GLU A 89 17.027 26.931 30.739 1.00 2.23 C ATOM 1263 C GLU A 89 15.529 26.803 31.032 1.00 10.40 C ATOM 1264 O GLU A 89 14.989 27.518 31.876 1.00 74.31 O ATOM 1265 CB GLU A 89 17.332 28.253 30.022 1.00 13.04 C ATOM 1266 CG GLU A 89 16.760 28.348 28.613 1.00 64.14 C ATOM 1267 CD GLU A 89 17.220 29.599 27.882 1.00 35.31 C ATOM 1268 OE1 GLU A 89 18.419 29.687 27.540 1.00 70.11 O ATOM 1269 OE2 GLU A 89 16.388 30.497 27.635 1.00 74.23 O1- ATOM 0 H GLU A 89 17.791 26.041 28.995 1.00 43.32 H new ATOM 0 HA GLU A 89 17.549 26.925 31.696 1.00 2.23 H new ATOM 0 HB2 GLU A 89 16.937 29.076 30.618 1.00 13.04 H new ATOM 0 HB3 GLU A 89 18.413 28.385 29.973 1.00 13.04 H new ATOM 0 HG2 GLU A 89 17.058 27.468 28.043 1.00 64.14 H new ATOM 0 HG3 GLU A 89 15.671 28.341 28.665 1.00 64.14 H new ATOM 1276 N GLU A 90 14.865 25.889 30.333 1.00 62.24 N ATOM 1277 CA GLU A 90 13.451 25.604 30.577 1.00 33.11 C ATOM 1278 C GLU A 90 13.286 24.816 31.880 1.00 41.22 C ATOM 1279 O GLU A 90 12.237 24.872 32.530 1.00 23.51 O ATOM 1280 CB GLU A 90 12.856 24.823 29.393 1.00 62.35 C ATOM 1281 CG GLU A 90 11.439 24.313 29.633 1.00 2.12 C ATOM 1282 CD GLU A 90 10.835 23.653 28.404 1.00 32.41 C ATOM 1283 OE1 GLU A 90 11.233 22.520 28.073 1.00 34.55 O ATOM 1284 OE2 GLU A 90 9.954 24.267 27.765 1.00 15.02 O1- ATOM 0 H GLU A 90 15.283 25.330 29.590 1.00 62.24 H new ATOM 0 HA GLU A 90 12.913 26.547 30.675 1.00 33.11 H new ATOM 0 HB2 GLU A 90 12.855 25.465 28.512 1.00 62.35 H new ATOM 0 HB3 GLU A 90 13.503 23.975 29.169 1.00 62.35 H new ATOM 0 HG2 GLU A 90 11.449 23.598 30.456 1.00 2.12 H new ATOM 0 HG3 GLU A 90 10.806 25.145 29.942 1.00 2.12 H new ATOM 1291 N GLY A 91 14.342 24.106 32.266 1.00 4.53 N ATOM 1292 CA GLY A 91 14.321 23.304 33.478 1.00 50.31 C ATOM 1293 C GLY A 91 14.180 21.825 33.183 1.00 52.42 C ATOM 1294 O GLY A 91 13.837 21.035 34.065 1.00 50.31 O ATOM 0 H GLY A 91 15.223 24.072 31.754 1.00 4.53 H new ATOM 0 HA2 GLY A 91 15.239 23.475 34.040 1.00 50.31 H new ATOM 0 HA3 GLY A 91 13.495 23.627 34.111 1.00 50.31 H new ATOM 1298 N GLY A 92 14.453 21.452 31.938 1.00 31.10 N ATOM 1299 CA GLY A 92 14.409 20.060 31.536 1.00 44.24 C ATOM 1300 C GLY A 92 15.746 19.604 30.993 1.00 74.12 C ATOM 1301 O GLY A 92 16.787 20.151 31.370 1.00 42.22 O ATOM 0 H GLY A 92 14.707 22.099 31.192 1.00 31.10 H new ATOM 0 HA2 GLY A 92 14.130 19.441 32.389 1.00 44.24 H new ATOM 0 HA3 GLY A 92 13.639 19.922 30.777 1.00 44.24 H new ATOM 1305 N PHE A 93 15.729 18.619 30.104 1.00 65.13 N ATOM 1306 CA PHE A 93 16.954 18.106 29.499 1.00 72.25 C ATOM 1307 C PHE A 93 17.096 18.606 28.068 1.00 30.35 C ATOM 1308 O PHE A 93 16.112 18.984 27.428 1.00 35.35 O ATOM 1309 CB PHE A 93 16.971 16.573 29.520 1.00 70.53 C ATOM 1310 CG PHE A 93 16.966 15.986 30.910 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.991 15.078 31.296 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.939 16.349 31.831 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.987 14.543 32.569 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.938 15.815 33.107 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.961 14.911 33.476 1.00 12.34 C ATOM 0 H PHE A 93 14.878 18.157 29.784 1.00 65.13 H new ATOM 0 HA PHE A 93 17.796 18.473 30.085 1.00 72.25 H new ATOM 0 HB2 PHE A 93 16.103 16.201 28.975 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.856 16.221 28.989 1.00 70.53 H new ATOM 0 HD1 PHE A 93 15.226 14.786 30.592 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.705 17.056 31.548 1.00 64.21 H new ATOM 0 HE1 PHE A 93 15.222 13.837 32.855 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.701 16.105 33.814 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.959 14.493 34.472 1.00 12.34 H new ATOM 1325 N ALA A 94 18.327 18.614 27.580 1.00 73.43 N ATOM 1326 CA ALA A 94 18.624 19.018 26.215 1.00 60.33 C ATOM 1327 C ALA A 94 19.749 18.148 25.663 1.00 65.32 C ATOM 1328 O ALA A 94 20.736 17.890 26.357 1.00 32.10 O ATOM 1329 CB ALA A 94 18.997 20.496 26.172 1.00 64.21 C ATOM 0 H ALA A 94 19.148 18.340 28.120 1.00 73.43 H new ATOM 0 HA ALA A 94 17.740 18.880 25.592 1.00 60.33 H new ATOM 0 HB1 ALA A 94 19.217 20.786 25.145 1.00 64.21 H new ATOM 0 HB2 ALA A 94 18.165 21.092 26.547 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.876 20.668 26.794 1.00 64.21 H new ATOM 1335 N LEU A 95 19.582 17.678 24.433 1.00 31.23 N ATOM 1336 CA LEU A 95 20.540 16.761 23.816 1.00 75.45 C ATOM 1337 C LEU A 95 21.464 17.494 22.853 1.00 41.42 C ATOM 1338 O LEU A 95 21.029 18.349 22.080 1.00 2.34 O ATOM 1339 CB LEU A 95 19.804 15.618 23.089 1.00 51.22 C ATOM 1340 CG LEU A 95 19.350 14.445 23.980 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.556 13.677 24.517 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.477 14.934 25.132 1.00 71.23 C ATOM 0 H LEU A 95 18.789 17.917 23.838 1.00 31.23 H new ATOM 0 HA LEU A 95 21.152 16.334 24.610 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.928 16.033 22.591 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.458 15.227 22.310 1.00 51.22 H new ATOM 0 HG LEU A 95 18.754 13.771 23.365 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.213 12.853 25.143 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.136 13.282 23.683 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.180 14.347 25.108 1.00 64.34 H new ATOM 0 HD21 LEU A 95 18.172 14.085 25.743 1.00 71.23 H new ATOM 0 HD22 LEU A 95 19.042 15.637 25.744 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.592 15.430 24.733 1.00 71.23 H new ATOM 1354 N ASP A 96 22.741 17.141 22.920 1.00 51.32 N ATOM 1355 CA ASP A 96 23.777 17.706 22.057 1.00 15.24 C ATOM 1356 C ASP A 96 24.443 16.586 21.274 1.00 33.43 C ATOM 1357 O ASP A 96 25.077 15.706 21.856 1.00 1.11 O ATOM 1358 CB ASP A 96 24.829 18.426 22.901 1.00 62.10 C ATOM 1359 CG ASP A 96 25.974 19.002 22.070 1.00 42.14 C ATOM 1360 OD1 ASP A 96 27.058 18.375 22.018 1.00 0.44 O ATOM 1361 OD2 ASP A 96 25.809 20.089 21.483 1.00 11.32 O1- ATOM 0 H ASP A 96 23.093 16.448 23.580 1.00 51.32 H new ATOM 0 HA ASP A 96 23.320 18.419 21.371 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.350 19.232 23.457 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.235 17.730 23.635 1.00 62.10 H new ATOM 1366 N VAL A 97 24.288 16.606 19.964 1.00 3.45 N ATOM 1367 CA VAL A 97 24.853 15.560 19.112 1.00 33.41 C ATOM 1368 C VAL A 97 25.919 16.136 18.189 1.00 35.23 C ATOM 1369 O VAL A 97 25.617 16.888 17.274 1.00 5.33 O ATOM 1370 CB VAL A 97 23.759 14.867 18.257 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.363 13.737 17.420 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.630 14.342 19.144 1.00 41.42 C ATOM 0 H VAL A 97 23.777 17.331 19.461 1.00 3.45 H new ATOM 0 HA VAL A 97 25.302 14.818 19.771 1.00 33.41 H new ATOM 0 HB VAL A 97 23.338 15.607 17.576 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.580 13.264 16.828 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.125 14.144 16.755 1.00 31.40 H new ATOM 0 HG13 VAL A 97 24.816 12.997 18.080 1.00 31.40 H new ATOM 0 HG21 VAL A 97 21.874 13.860 18.524 1.00 41.42 H new ATOM 0 HG22 VAL A 97 23.031 13.619 19.854 1.00 41.42 H new ATOM 0 HG23 VAL A 97 22.178 15.172 19.687 1.00 41.42 H new ATOM 1382 N GLU A 98 27.169 15.772 18.434 1.00 23.12 N ATOM 1383 CA GLU A 98 28.275 16.195 17.585 1.00 44.32 C ATOM 1384 C GLU A 98 28.542 15.139 16.521 1.00 21.31 C ATOM 1385 O GLU A 98 28.988 14.032 16.835 1.00 34.12 O ATOM 1386 CB GLU A 98 29.549 16.426 18.413 1.00 13.10 C ATOM 1387 CG GLU A 98 29.477 17.626 19.348 1.00 35.31 C ATOM 1388 CD GLU A 98 30.780 17.870 20.095 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.782 18.260 19.451 1.00 51.52 O ATOM 1390 OE2 GLU A 98 30.813 17.682 21.327 1.00 21.24 O1- ATOM 0 H GLU A 98 27.445 15.181 19.218 1.00 23.12 H new ATOM 0 HA GLU A 98 27.998 17.135 17.108 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.753 15.532 19.002 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.391 16.559 17.734 1.00 13.10 H new ATOM 0 HG2 GLU A 98 29.222 18.515 18.772 1.00 35.31 H new ATOM 0 HG3 GLU A 98 28.674 17.472 20.068 1.00 35.31 H new ATOM 1397 N LEU A 99 28.251 15.470 15.267 1.00 4.53 N ATOM 1398 CA LEU A 99 28.550 14.567 14.160 1.00 32.31 C ATOM 1399 C LEU A 99 29.863 14.982 13.514 1.00 52.01 C ATOM 1400 O LEU A 99 29.922 15.989 12.805 1.00 21.43 O ATOM 1401 CB LEU A 99 27.419 14.571 13.117 1.00 42.25 C ATOM 1402 CG LEU A 99 26.080 13.978 13.587 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.055 14.008 12.455 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.269 12.555 14.113 1.00 23.33 C ATOM 0 H LEU A 99 27.812 16.349 14.993 1.00 4.53 H new ATOM 0 HA LEU A 99 28.637 13.553 14.550 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.248 15.599 12.796 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.755 14.015 12.241 1.00 42.25 H new ATOM 0 HG LEU A 99 25.703 14.591 14.406 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.114 13.585 12.805 1.00 73.33 H new ATOM 0 HD12 LEU A 99 24.894 15.038 12.137 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.425 13.423 11.613 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.308 12.157 14.439 1.00 23.33 H new ATOM 0 HD22 LEU A 99 26.672 11.925 13.320 1.00 23.33 H new ATOM 0 HD23 LEU A 99 26.961 12.567 14.955 1.00 23.33 H new ATOM 1416 N ARG A 100 30.907 14.200 13.761 1.00 15.15 N ATOM 1417 CA ARG A 100 32.242 14.502 13.259 1.00 11.05 C ATOM 1418 C ARG A 100 32.547 13.644 12.046 1.00 44.33 C ATOM 1419 O ARG A 100 32.727 12.433 12.164 1.00 60.34 O ATOM 1420 CB ARG A 100 33.277 14.274 14.362 1.00 62.13 C ATOM 1421 CG ARG A 100 33.022 15.138 15.587 1.00 11.51 C ATOM 1422 CD ARG A 100 33.970 14.822 16.727 1.00 61.51 C ATOM 1423 NE ARG A 100 33.682 15.647 17.903 1.00 42.53 N ATOM 1424 CZ ARG A 100 33.688 15.195 19.156 1.00 32.53 C ATOM 1425 NH1 ARG A 100 34.074 13.951 19.417 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 33.313 15.991 20.148 1.00 1.52 N ATOM 0 H ARG A 100 30.853 13.343 14.312 1.00 15.15 H new ATOM 0 HA ARG A 100 32.285 15.549 12.957 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.267 13.224 14.654 1.00 62.13 H new ATOM 0 HB3 ARG A 100 34.272 14.487 13.972 1.00 62.13 H new ATOM 0 HG2 ARG A 100 33.124 16.188 15.314 1.00 11.51 H new ATOM 0 HG3 ARG A 100 31.995 14.994 15.922 1.00 11.51 H new ATOM 0 HD2 ARG A 100 33.887 13.768 16.991 1.00 61.51 H new ATOM 0 HD3 ARG A 100 34.998 14.990 16.405 1.00 61.51 H new ATOM 0 HE ARG A 100 33.463 16.632 17.752 1.00 42.53 H new ATOM 0 HH11 ARG A 100 34.367 13.338 18.656 1.00 73.43 H new ATOM 0 HH12 ARG A 100 34.077 13.609 20.378 1.00 73.43 H new ATOM 0 HH21 ARG A 100 33.020 16.948 19.951 1.00 1.52 H new ATOM 0 HH22 ARG A 100 33.317 15.646 21.108 1.00 1.52 H new ATOM 1440 N VAL A 101 32.598 14.273 10.884 1.00 42.14 N ATOM 1441 CA VAL A 101 32.758 13.555 9.630 1.00 72.23 C ATOM 1442 C VAL A 101 34.209 13.602 9.176 1.00 42.25 C ATOM 1443 O VAL A 101 34.653 14.601 8.613 1.00 41.22 O ATOM 1444 CB VAL A 101 31.857 14.151 8.523 1.00 14.41 C ATOM 1445 CG1 VAL A 101 31.934 13.314 7.247 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.413 14.279 9.013 1.00 42.30 C ATOM 0 H VAL A 101 32.530 15.286 10.783 1.00 42.14 H new ATOM 0 HA VAL A 101 32.461 12.521 9.802 1.00 72.23 H new ATOM 0 HB VAL A 101 32.223 15.150 8.287 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.292 13.754 6.484 1.00 25.41 H new ATOM 0 HG12 VAL A 101 32.963 13.293 6.887 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.603 12.297 7.458 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.796 14.700 8.220 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.032 13.294 9.285 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.381 14.934 9.884 1.00 42.30 H new ATOM 1456 N ALA A 102 34.944 12.527 9.421 1.00 43.12 N ATOM 1457 CA ALA A 102 36.340 12.460 9.020 1.00 40.03 C ATOM 1458 C ALA A 102 36.442 11.846 7.636 1.00 12.52 C ATOM 1459 O ALA A 102 36.365 10.627 7.472 1.00 73.10 O ATOM 1460 CB ALA A 102 37.148 11.652 10.030 1.00 44.05 C ATOM 0 H ALA A 102 34.598 11.692 9.894 1.00 43.12 H new ATOM 0 HA ALA A 102 36.752 13.469 8.990 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.190 11.612 9.714 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.084 12.126 11.010 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.748 10.640 10.089 1.00 44.05 H new ATOM 1466 N LEU A 103 36.628 12.708 6.645 1.00 73.31 N ATOM 1467 CA LEU A 103 36.674 12.298 5.249 1.00 63.24 C ATOM 1468 C LEU A 103 38.066 12.530 4.675 1.00 11.33 C ATOM 1469 O LEU A 103 38.559 13.662 4.652 1.00 24.41 O ATOM 1470 CB LEU A 103 35.610 13.054 4.433 1.00 41.13 C ATOM 1471 CG LEU A 103 34.262 12.323 4.272 1.00 32.24 C ATOM 1472 CD1 LEU A 103 33.166 13.279 3.804 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.404 11.166 3.286 1.00 41.41 C ATOM 0 H LEU A 103 36.751 13.711 6.787 1.00 73.31 H new ATOM 0 HA LEU A 103 36.454 11.232 5.189 1.00 63.24 H new ATOM 0 HB2 LEU A 103 35.428 14.018 4.909 1.00 41.13 H new ATOM 0 HB3 LEU A 103 36.014 13.259 3.442 1.00 41.13 H new ATOM 0 HG LEU A 103 33.975 11.930 5.247 1.00 32.24 H new ATOM 0 HD11 LEU A 103 32.228 12.734 3.700 1.00 55.32 H new ATOM 0 HD12 LEU A 103 33.043 14.077 4.536 1.00 55.32 H new ATOM 0 HD13 LEU A 103 33.445 13.709 2.842 1.00 55.32 H new ATOM 0 HD21 LEU A 103 33.445 10.658 3.181 1.00 41.41 H new ATOM 0 HD22 LEU A 103 34.719 11.551 2.316 1.00 41.41 H new ATOM 0 HD23 LEU A 103 35.149 10.462 3.656 1.00 41.41 H new ATOM 1485 N PRO A 104 38.728 11.453 4.227 1.00 73.52 N ATOM 1486 CA PRO A 104 40.064 11.533 3.649 1.00 62.42 C ATOM 1487 C PRO A 104 40.030 11.983 2.196 1.00 45.15 C ATOM 1488 O PRO A 104 39.027 11.805 1.504 1.00 0.45 O ATOM 1489 CB PRO A 104 40.563 10.096 3.758 1.00 24.31 C ATOM 1490 CG PRO A 104 39.335 9.264 3.621 1.00 63.40 C ATOM 1491 CD PRO A 104 38.220 10.065 4.247 1.00 45.41 C ATOM 0 HA PRO A 104 40.699 12.261 4.154 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.287 9.867 2.976 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.058 9.919 4.713 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.122 9.051 2.573 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.456 8.304 4.123 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.293 9.970 3.681 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.009 9.731 5.263 1.00 45.41 H new ATOM 1499 N GLY A 105 41.134 12.561 1.745 1.00 54.45 N ATOM 1500 CA GLY A 105 41.229 13.047 0.379 1.00 13.33 C ATOM 1501 C GLY A 105 40.264 14.189 0.090 1.00 43.42 C ATOM 1502 O GLY A 105 40.024 14.531 -1.072 1.00 1.41 O ATOM 0 H GLY A 105 41.974 12.704 2.305 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.248 13.382 0.187 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.029 12.225 -0.309 1.00 13.33 H new ATOM 1506 N LEU A 106 39.722 14.779 1.152 1.00 4.51 N ATOM 1507 CA LEU A 106 38.724 15.844 1.044 1.00 40.14 C ATOM 1508 C LEU A 106 39.129 17.039 1.906 1.00 43.11 C ATOM 1509 O LEU A 106 39.652 16.867 3.009 1.00 42.33 O ATOM 1510 CB LEU A 106 37.350 15.301 1.473 1.00 65.03 C ATOM 1511 CG LEU A 106 36.241 16.342 1.702 1.00 43.51 C ATOM 1512 CD1 LEU A 106 35.957 17.147 0.446 1.00 44.14 C ATOM 1513 CD2 LEU A 106 34.966 15.665 2.190 1.00 41.21 C ATOM 0 H LEU A 106 39.961 14.534 2.113 1.00 4.51 H new ATOM 0 HA LEU A 106 38.663 16.181 0.009 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.008 14.600 0.712 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.480 14.733 2.394 1.00 65.03 H new ATOM 0 HG LEU A 106 36.595 17.032 2.468 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.168 17.871 0.649 1.00 44.14 H new ATOM 0 HD12 LEU A 106 36.861 17.672 0.138 1.00 44.14 H new ATOM 0 HD13 LEU A 106 35.638 16.476 -0.352 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.192 16.416 2.347 1.00 41.21 H new ATOM 0 HD22 LEU A 106 34.628 14.946 1.444 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.165 15.148 3.129 1.00 41.21 H new ATOM 1525 N ASP A 107 38.901 18.245 1.389 1.00 72.42 N ATOM 1526 CA ASP A 107 39.247 19.474 2.109 1.00 14.02 C ATOM 1527 C ASP A 107 38.282 19.729 3.242 1.00 1.12 C ATOM 1528 O ASP A 107 37.178 19.199 3.256 1.00 10.24 O ATOM 1529 CB ASP A 107 39.198 20.701 1.194 1.00 13.35 C ATOM 1530 CG ASP A 107 40.233 21.747 1.574 1.00 12.43 C ATOM 1531 OD1 ASP A 107 41.444 21.483 1.407 1.00 14.01 O ATOM 1532 OD2 ASP A 107 39.842 22.832 2.053 1.00 2.52 O1- ATOM 0 H ASP A 107 38.478 18.400 0.474 1.00 72.42 H new ATOM 0 HA ASP A 107 40.259 19.327 2.486 1.00 14.02 H new ATOM 0 HB2 ASP A 107 39.362 20.389 0.163 1.00 13.35 H new ATOM 0 HB3 ASP A 107 38.203 21.145 1.238 1.00 13.35 H new ATOM 1537 N ALA A 108 38.694 20.583 4.158 1.00 41.30 N ATOM 1538 CA ALA A 108 37.818 21.083 5.199 1.00 54.32 C ATOM 1539 C ALA A 108 36.708 21.929 4.586 1.00 74.35 C ATOM 1540 O ALA A 108 35.534 21.765 4.913 1.00 33.14 O ATOM 1541 CB ALA A 108 38.629 21.908 6.178 1.00 73.33 C ATOM 0 H ALA A 108 39.645 20.950 4.202 1.00 41.30 H new ATOM 0 HA ALA A 108 37.361 20.245 5.726 1.00 54.32 H new ATOM 0 HB1 ALA A 108 37.975 22.287 6.964 1.00 73.33 H new ATOM 0 HB2 ALA A 108 39.406 21.286 6.622 1.00 73.33 H new ATOM 0 HB3 ALA A 108 39.090 22.745 5.654 1.00 73.33 H new ATOM 1547 N ALA A 109 37.096 22.810 3.663 1.00 23.13 N ATOM 1548 CA ALA A 109 36.163 23.747 3.047 1.00 64.13 C ATOM 1549 C ALA A 109 35.095 23.006 2.255 1.00 31.24 C ATOM 1550 O ALA A 109 33.898 23.258 2.405 1.00 41.21 O ATOM 1551 CB ALA A 109 36.910 24.723 2.148 1.00 33.23 C ATOM 0 H ALA A 109 38.055 22.892 3.326 1.00 23.13 H new ATOM 0 HA ALA A 109 35.670 24.309 3.840 1.00 64.13 H new ATOM 0 HB1 ALA A 109 36.201 25.416 1.695 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.635 25.281 2.740 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.429 24.171 1.364 1.00 33.23 H new ATOM 1557 N ALA A 110 35.541 22.075 1.421 1.00 73.25 N ATOM 1558 CA ALA A 110 34.634 21.285 0.608 1.00 12.34 C ATOM 1559 C ALA A 110 33.802 20.374 1.501 1.00 44.05 C ATOM 1560 O ALA A 110 32.590 20.259 1.330 1.00 34.04 O ATOM 1561 CB ALA A 110 35.410 20.479 -0.425 1.00 53.00 C ATOM 0 H ALA A 110 36.528 21.851 1.292 1.00 73.25 H new ATOM 0 HA ALA A 110 33.960 21.953 0.072 1.00 12.34 H new ATOM 0 HB1 ALA A 110 34.715 19.893 -1.026 1.00 53.00 H new ATOM 0 HB2 ALA A 110 35.967 21.157 -1.072 1.00 53.00 H new ATOM 0 HB3 ALA A 110 36.105 19.810 0.083 1.00 53.00 H new ATOM 1567 N ALA A 111 34.462 19.748 2.472 1.00 5.14 N ATOM 1568 CA ALA A 111 33.782 18.861 3.418 1.00 43.54 C ATOM 1569 C ALA A 111 32.619 19.569 4.107 1.00 4.44 C ATOM 1570 O ALA A 111 31.538 18.997 4.257 1.00 54.13 O ATOM 1571 CB ALA A 111 34.765 18.327 4.447 1.00 13.31 C ATOM 0 H ALA A 111 35.466 19.837 2.626 1.00 5.14 H new ATOM 0 HA ALA A 111 33.374 18.022 2.854 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.243 17.670 5.142 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.553 17.769 3.942 1.00 13.31 H new ATOM 0 HB3 ALA A 111 35.205 19.159 4.996 1.00 13.31 H new ATOM 1577 N LYS A 112 32.843 20.820 4.510 1.00 1.14 N ATOM 1578 CA LYS A 112 31.796 21.632 5.133 1.00 13.13 C ATOM 1579 C LYS A 112 30.546 21.677 4.257 1.00 74.23 C ATOM 1580 O LYS A 112 29.433 21.429 4.731 1.00 4.50 O ATOM 1581 CB LYS A 112 32.301 23.063 5.394 1.00 13.05 C ATOM 1582 CG LYS A 112 33.295 23.176 6.549 1.00 32.13 C ATOM 1583 CD LYS A 112 32.640 22.879 7.900 1.00 10.41 C ATOM 1584 CE LYS A 112 31.569 23.908 8.255 1.00 22.11 C ATOM 1585 NZ LYS A 112 32.133 25.277 8.400 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.741 21.294 4.416 1.00 1.14 H new ATOM 0 HA LYS A 112 31.538 21.168 6.085 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.771 23.441 4.486 1.00 13.05 H new ATOM 0 HB3 LYS A 112 31.446 23.706 5.601 1.00 13.05 H new ATOM 0 HG2 LYS A 112 34.120 22.483 6.386 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.720 24.180 6.565 1.00 32.13 H new ATOM 0 HD2 LYS A 112 32.194 21.885 7.876 1.00 10.41 H new ATOM 0 HD3 LYS A 112 33.403 22.867 8.678 1.00 10.41 H new ATOM 0 HE2 LYS A 112 30.801 23.913 7.481 1.00 22.11 H new ATOM 0 HE3 LYS A 112 31.082 23.617 9.186 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 31.417 25.905 8.819 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 32.969 25.244 9.017 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 32.407 25.640 7.465 1.00 2.23 H new ATOM 1599 N THR A 113 30.739 21.969 2.977 1.00 31.43 N ATOM 1600 CA THR A 113 29.623 22.128 2.052 1.00 60.21 C ATOM 1601 C THR A 113 28.982 20.774 1.732 1.00 74.22 C ATOM 1602 O THR A 113 27.768 20.681 1.533 1.00 73.22 O ATOM 1603 CB THR A 113 30.074 22.846 0.747 1.00 31.33 C ATOM 1604 OG1 THR A 113 28.982 23.578 0.176 1.00 10.35 O ATOM 1605 CG2 THR A 113 30.609 21.868 -0.294 1.00 32.43 C ATOM 0 H THR A 113 31.658 22.101 2.555 1.00 31.43 H new ATOM 0 HA THR A 113 28.874 22.753 2.538 1.00 60.21 H new ATOM 0 HB THR A 113 30.879 23.526 1.025 1.00 31.33 H new ATOM 0 HG1 THR A 113 29.281 24.026 -0.643 1.00 10.35 H new ATOM 0 HG21 THR A 113 30.911 22.416 -1.187 1.00 32.43 H new ATOM 0 HG22 THR A 113 31.469 21.337 0.114 1.00 32.43 H new ATOM 0 HG23 THR A 113 29.830 21.152 -0.554 1.00 32.43 H new ATOM 1613 N LEU A 114 29.802 19.722 1.697 1.00 23.12 N ATOM 1614 CA LEU A 114 29.313 18.380 1.386 1.00 20.51 C ATOM 1615 C LEU A 114 28.413 17.864 2.504 1.00 41.04 C ATOM 1616 O LEU A 114 27.307 17.386 2.249 1.00 13.34 O ATOM 1617 CB LEU A 114 30.477 17.406 1.143 1.00 61.01 C ATOM 1618 CG LEU A 114 31.411 17.774 -0.024 1.00 11.45 C ATOM 1619 CD1 LEU A 114 32.405 16.650 -0.306 1.00 1.51 C ATOM 1620 CD2 LEU A 114 30.608 18.122 -1.278 1.00 50.51 C ATOM 0 H LEU A 114 30.804 19.774 1.880 1.00 23.12 H new ATOM 0 HA LEU A 114 28.728 18.443 0.468 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.071 17.341 2.055 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.066 16.414 0.958 1.00 61.01 H new ATOM 0 HG LEU A 114 31.979 18.657 0.267 1.00 11.45 H new ATOM 0 HD11 LEU A 114 33.052 16.936 -1.135 1.00 1.51 H new ATOM 0 HD12 LEU A 114 33.011 16.469 0.582 1.00 1.51 H new ATOM 0 HD13 LEU A 114 31.862 15.741 -0.567 1.00 1.51 H new ATOM 0 HD21 LEU A 114 31.291 18.378 -2.088 1.00 50.51 H new ATOM 0 HD22 LEU A 114 30.002 17.265 -1.572 1.00 50.51 H new ATOM 0 HD23 LEU A 114 29.958 18.971 -1.069 1.00 50.51 H new ATOM 1632 N VAL A 115 28.883 17.980 3.742 1.00 72.22 N ATOM 1633 CA VAL A 115 28.099 17.569 4.903 1.00 32.34 C ATOM 1634 C VAL A 115 26.822 18.405 4.998 1.00 1.13 C ATOM 1635 O VAL A 115 25.751 17.895 5.366 1.00 25.22 O ATOM 1636 CB VAL A 115 28.915 17.706 6.215 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.064 17.364 7.438 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.160 16.823 6.168 1.00 35.24 C ATOM 0 H VAL A 115 29.804 18.356 3.968 1.00 72.22 H new ATOM 0 HA VAL A 115 27.838 16.519 4.774 1.00 32.34 H new ATOM 0 HB VAL A 115 29.228 18.746 6.305 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.665 17.470 8.341 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.211 18.041 7.489 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.708 16.337 7.358 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.719 16.933 7.097 1.00 35.24 H new ATOM 0 HG22 VAL A 115 29.863 15.782 6.044 1.00 35.24 H new ATOM 0 HG23 VAL A 115 30.788 17.123 5.329 1.00 35.24 H new ATOM 1648 N ASP A 116 26.950 19.685 4.650 1.00 34.11 N ATOM 1649 CA ASP A 116 25.828 20.621 4.667 1.00 22.44 C ATOM 1650 C ASP A 116 24.711 20.141 3.746 1.00 4.20 C ATOM 1651 O ASP A 116 23.598 19.855 4.196 1.00 63.50 O ATOM 1652 CB ASP A 116 26.289 22.018 4.228 1.00 1.42 C ATOM 1653 CG ASP A 116 25.175 23.052 4.321 1.00 43.12 C ATOM 1654 OD1 ASP A 116 24.853 23.492 5.446 1.00 62.34 O ATOM 1655 OD2 ASP A 116 24.611 23.434 3.272 1.00 50.12 O1- ATOM 0 H ASP A 116 27.832 20.101 4.349 1.00 34.11 H new ATOM 0 HA ASP A 116 25.448 20.672 5.687 1.00 22.44 H new ATOM 0 HB2 ASP A 116 27.127 22.333 4.850 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.653 21.972 3.202 1.00 1.42 H new ATOM 1660 N ARG A 117 25.028 20.019 2.456 1.00 43.12 N ATOM 1661 CA ARG A 117 24.037 19.644 1.457 1.00 25.23 C ATOM 1662 C ARG A 117 23.524 18.233 1.716 1.00 51.42 C ATOM 1663 O ARG A 117 22.346 17.946 1.513 1.00 42.42 O ATOM 1664 CB ARG A 117 24.645 19.755 0.059 1.00 4.30 C ATOM 1665 CG ARG A 117 25.873 18.887 -0.138 1.00 3.24 C ATOM 1666 CD ARG A 117 26.630 19.247 -1.405 1.00 12.41 C ATOM 1667 NE ARG A 117 25.847 18.981 -2.619 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.253 18.211 -3.632 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.437 17.612 -3.590 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.469 18.052 -4.691 1.00 65.24 N ATOM 0 H ARG A 117 25.964 20.175 2.083 1.00 43.12 H new ATOM 0 HA ARG A 117 23.189 20.326 1.524 1.00 25.23 H new ATOM 0 HB2 ARG A 117 23.892 19.478 -0.679 1.00 4.30 H new ATOM 0 HB3 ARG A 117 24.911 20.795 -0.131 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.534 18.995 0.722 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.573 17.840 -0.180 1.00 3.24 H new ATOM 0 HD2 ARG A 117 26.902 20.302 -1.375 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.560 18.679 -1.444 1.00 12.41 H new ATOM 0 HE ARG A 117 24.927 19.416 -2.694 1.00 15.40 H new ATOM 0 HH11 ARG A 117 28.044 17.738 -2.780 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.740 17.026 -4.368 1.00 44.31 H new ATOM 0 HH21 ARG A 117 24.562 18.517 -4.728 1.00 65.24 H new ATOM 0 HH22 ARG A 117 25.774 17.465 -5.468 1.00 65.24 H new ATOM 1684 N ALA A 118 24.413 17.367 2.190 1.00 40.10 N ATOM 1685 CA ALA A 118 24.049 15.992 2.525 1.00 45.33 C ATOM 1686 C ALA A 118 22.938 15.973 3.576 1.00 63.41 C ATOM 1687 O ALA A 118 21.922 15.292 3.413 1.00 0.11 O ATOM 1688 CB ALA A 118 25.268 15.221 3.019 1.00 44.02 C ATOM 0 H ALA A 118 25.395 17.592 2.352 1.00 40.10 H new ATOM 0 HA ALA A 118 23.678 15.505 1.624 1.00 45.33 H new ATOM 0 HB1 ALA A 118 24.978 14.199 3.264 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.029 15.205 2.239 1.00 44.02 H new ATOM 0 HB3 ALA A 118 25.670 15.707 3.908 1.00 44.02 H new ATOM 1694 N HIS A 119 23.124 16.747 4.646 1.00 52.13 N ATOM 1695 CA HIS A 119 22.125 16.838 5.713 1.00 15.33 C ATOM 1696 C HIS A 119 20.943 17.707 5.291 1.00 0.40 C ATOM 1697 O HIS A 119 19.913 17.735 5.965 1.00 63.33 O ATOM 1698 CB HIS A 119 22.755 17.380 7.003 1.00 54.45 C ATOM 1699 CG HIS A 119 23.586 16.368 7.729 1.00 21.21 C ATOM 1700 ND1 HIS A 119 24.902 16.101 7.417 1.00 2.34 N ATOM 1701 CD2 HIS A 119 23.272 15.540 8.754 1.00 20.34 C ATOM 1702 CE1 HIS A 119 25.358 15.152 8.214 1.00 52.23 C ATOM 1703 NE2 HIS A 119 24.388 14.795 9.036 1.00 74.13 N ATOM 0 H HIS A 119 23.955 17.319 4.797 1.00 52.13 H new ATOM 0 HA HIS A 119 21.753 15.832 5.905 1.00 15.33 H new ATOM 0 HB2 HIS A 119 23.376 18.243 6.761 1.00 54.45 H new ATOM 0 HB3 HIS A 119 21.964 17.732 7.665 1.00 54.45 H new ATOM 0 HD1 HIS A 119 25.440 16.564 6.685 1.00 2.34 H new ATOM 0 HD2 HIS A 119 22.318 15.478 9.257 1.00 20.34 H new ATOM 0 HE1 HIS A 119 26.355 14.738 8.197 1.00 52.23 H new ATOM 1712 N HIS A 120 21.102 18.412 4.177 1.00 43.52 N ATOM 1713 CA HIS A 120 20.050 19.276 3.647 1.00 31.45 C ATOM 1714 C HIS A 120 19.106 18.489 2.736 1.00 61.14 C ATOM 1715 O HIS A 120 17.910 18.779 2.671 1.00 43.11 O ATOM 1716 CB HIS A 120 20.676 20.454 2.882 1.00 2.24 C ATOM 1717 CG HIS A 120 19.682 21.387 2.256 1.00 45.12 C ATOM 1718 ND1 HIS A 120 19.679 21.690 0.909 1.00 44.32 N ATOM 1719 CD2 HIS A 120 18.671 22.106 2.801 1.00 50.50 C ATOM 1720 CE1 HIS A 120 18.713 22.551 0.657 1.00 65.24 C ATOM 1721 NE2 HIS A 120 18.087 22.817 1.785 1.00 75.14 N ATOM 0 H HIS A 120 21.956 18.403 3.619 1.00 43.52 H new ATOM 0 HA HIS A 120 19.467 19.665 4.482 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.307 21.021 3.566 1.00 2.24 H new ATOM 0 HB3 HIS A 120 21.327 20.059 2.102 1.00 2.24 H new ATOM 0 HD2 HIS A 120 18.380 22.117 3.841 1.00 50.50 H new ATOM 0 HE1 HIS A 120 18.475 22.968 -0.311 1.00 65.24 H new ATOM 0 HE2 HIS A 120 17.294 23.451 1.886 1.00 75.14 H new ATOM 1730 N VAL A 121 19.647 17.494 2.032 1.00 33.11 N ATOM 1731 CA VAL A 121 18.850 16.690 1.105 1.00 23.21 C ATOM 1732 C VAL A 121 18.241 15.473 1.805 1.00 3.02 C ATOM 1733 O VAL A 121 17.028 15.257 1.736 1.00 30.52 O ATOM 1734 CB VAL A 121 19.671 16.240 -0.140 1.00 61.42 C ATOM 1735 CG1 VAL A 121 20.117 17.453 -0.959 1.00 74.54 C ATOM 1736 CG2 VAL A 121 20.878 15.390 0.257 1.00 44.31 C ATOM 0 H VAL A 121 20.630 17.226 2.086 1.00 33.11 H new ATOM 0 HA VAL A 121 18.041 17.332 0.755 1.00 23.21 H new ATOM 0 HB VAL A 121 19.019 15.621 -0.756 1.00 61.42 H new ATOM 0 HG11 VAL A 121 20.689 17.118 -1.824 1.00 74.54 H new ATOM 0 HG12 VAL A 121 19.241 18.007 -1.296 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.740 18.100 -0.341 1.00 74.54 H new ATOM 0 HG21 VAL A 121 21.426 15.095 -0.638 1.00 44.31 H new ATOM 0 HG22 VAL A 121 21.532 15.969 0.909 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.538 14.499 0.784 1.00 44.31 H new ATOM 1746 N CYS A 122 19.068 14.679 2.483 1.00 31.44 N ATOM 1747 CA CYS A 122 18.583 13.481 3.161 1.00 53.14 C ATOM 1748 C CYS A 122 19.517 13.060 4.302 1.00 23.34 C ATOM 1749 O CYS A 122 20.461 12.297 4.089 1.00 24.32 O ATOM 1750 CB CYS A 122 18.411 12.340 2.147 1.00 50.43 C ATOM 1751 SG CYS A 122 19.879 12.024 1.136 1.00 72.12 S ATOM 0 H CYS A 122 20.070 14.843 2.577 1.00 31.44 H new ATOM 0 HA CYS A 122 17.615 13.710 3.605 1.00 53.14 H new ATOM 0 HB2 CYS A 122 18.149 11.428 2.683 1.00 50.43 H new ATOM 0 HB3 CYS A 122 17.574 12.575 1.490 1.00 50.43 H new ATOM 0 HG CYS A 122 20.924 11.935 1.904 1.00 72.12 H new ATOM 1757 N PRO A 123 19.296 13.588 5.522 1.00 50.40 N ATOM 1758 CA PRO A 123 20.040 13.158 6.708 1.00 60.03 C ATOM 1759 C PRO A 123 19.477 11.857 7.301 1.00 74.45 C ATOM 1760 O PRO A 123 20.204 10.886 7.499 1.00 30.15 O ATOM 1761 CB PRO A 123 19.859 14.338 7.673 1.00 24.23 C ATOM 1762 CG PRO A 123 18.541 14.941 7.303 1.00 34.14 C ATOM 1763 CD PRO A 123 18.337 14.673 5.827 1.00 45.03 C ATOM 0 HA PRO A 123 21.084 12.931 6.493 1.00 60.03 H new ATOM 0 HB2 PRO A 123 19.863 14.004 8.710 1.00 24.23 H new ATOM 0 HB3 PRO A 123 20.668 15.061 7.568 1.00 24.23 H new ATOM 0 HG2 PRO A 123 17.736 14.501 7.891 1.00 34.14 H new ATOM 0 HG3 PRO A 123 18.535 16.012 7.506 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.312 14.370 5.615 1.00 45.03 H new ATOM 0 HD3 PRO A 123 18.537 15.562 5.229 1.00 45.03 H new ATOM 1771 N TYR A 124 18.175 11.870 7.575 1.00 53.44 N ATOM 1772 CA TYR A 124 17.440 10.723 8.112 1.00 1.24 C ATOM 1773 C TYR A 124 16.009 11.191 8.344 1.00 42.34 C ATOM 1774 O TYR A 124 15.037 10.496 8.043 1.00 23.13 O ATOM 1775 CB TYR A 124 18.071 10.192 9.426 1.00 65.44 C ATOM 1776 CG TYR A 124 17.899 8.688 9.631 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.815 8.116 10.908 1.00 42.12 C ATOM 1778 CD2 TYR A 124 17.828 7.833 8.533 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.668 6.749 11.065 1.00 14.31 C ATOM 1780 CE2 TYR A 124 17.679 6.470 8.691 1.00 12.12 C ATOM 1781 CZ TYR A 124 17.601 5.933 9.956 1.00 5.42 C ATOM 1782 OH TYR A 124 17.457 4.574 10.112 1.00 60.35 O ATOM 0 H TYR A 124 17.589 12.692 7.428 1.00 53.44 H new ATOM 0 HA TYR A 124 17.474 9.891 7.409 1.00 1.24 H new ATOM 0 HB2 TYR A 124 19.135 10.430 9.429 1.00 65.44 H new ATOM 0 HB3 TYR A 124 17.625 10.717 10.270 1.00 65.44 H new ATOM 0 HD1 TYR A 124 17.866 8.750 11.781 1.00 42.12 H new ATOM 0 HD2 TYR A 124 17.891 8.246 7.537 1.00 13.25 H new ATOM 0 HE1 TYR A 124 17.606 6.322 12.055 1.00 14.31 H new ATOM 0 HE2 TYR A 124 17.624 5.827 7.825 1.00 12.12 H new ATOM 0 HH TYR A 124 17.426 4.145 9.231 1.00 60.35 H new ATOM 1792 N SER A 125 15.916 12.406 8.871 1.00 23.21 N ATOM 1793 CA SER A 125 14.674 13.156 8.957 1.00 62.44 C ATOM 1794 C SER A 125 15.026 14.634 9.123 1.00 2.13 C ATOM 1795 O SER A 125 16.035 14.959 9.746 1.00 5.11 O ATOM 1796 CB SER A 125 13.817 12.659 10.131 1.00 61.32 C ATOM 1797 OG SER A 125 14.537 12.711 11.351 1.00 44.54 O ATOM 0 H SER A 125 16.718 12.905 9.257 1.00 23.21 H new ATOM 0 HA SER A 125 14.087 13.014 8.050 1.00 62.44 H new ATOM 0 HB2 SER A 125 12.917 13.269 10.211 1.00 61.32 H new ATOM 0 HB3 SER A 125 13.493 11.636 9.940 1.00 61.32 H new ATOM 0 HG SER A 125 13.967 12.391 12.081 1.00 44.54 H new ATOM 1803 N ASN A 126 14.235 15.527 8.547 1.00 23.44 N ATOM 1804 CA ASN A 126 14.517 16.962 8.650 1.00 73.42 C ATOM 1805 C ASN A 126 14.500 17.391 10.121 1.00 24.25 C ATOM 1806 O ASN A 126 15.247 18.278 10.545 1.00 64.13 O ATOM 1807 CB ASN A 126 13.497 17.779 7.844 1.00 54.23 C ATOM 1808 CG ASN A 126 13.908 19.236 7.697 1.00 23.41 C ATOM 1809 OD1 ASN A 126 15.098 19.551 7.621 1.00 4.50 O ATOM 1810 ND2 ASN A 126 12.939 20.133 7.657 1.00 5.31 N ATOM 0 H ASN A 126 13.401 15.293 8.008 1.00 23.44 H new ATOM 0 HA ASN A 126 15.506 17.152 8.234 1.00 73.42 H new ATOM 0 HB2 ASN A 126 13.380 17.336 6.855 1.00 54.23 H new ATOM 0 HB3 ASN A 126 12.525 17.726 8.334 1.00 54.23 H new ATOM 0 HD21 ASN A 126 13.164 21.123 7.560 1.00 5.31 H new ATOM 0 HD22 ASN A 126 11.966 19.835 7.723 1.00 5.31 H new ATOM 1817 N ALA A 127 13.661 16.713 10.894 1.00 54.04 N ATOM 1818 CA ALA A 127 13.485 16.990 12.315 1.00 54.10 C ATOM 1819 C ALA A 127 14.582 16.343 13.168 1.00 52.15 C ATOM 1820 O ALA A 127 14.519 16.382 14.392 1.00 1.24 O ATOM 1821 CB ALA A 127 12.103 16.519 12.758 1.00 41.33 C ATOM 0 H ALA A 127 13.079 15.949 10.550 1.00 54.04 H new ATOM 0 HA ALA A 127 13.566 18.067 12.464 1.00 54.10 H new ATOM 0 HB1 ALA A 127 11.971 16.726 13.820 1.00 41.33 H new ATOM 0 HB2 ALA A 127 11.339 17.047 12.188 1.00 41.33 H new ATOM 0 HB3 ALA A 127 12.011 15.447 12.583 1.00 41.33 H new ATOM 1827 N THR A 128 15.592 15.756 12.532 1.00 1.20 N ATOM 1828 CA THR A 128 16.681 15.117 13.274 1.00 2.03 C ATOM 1829 C THR A 128 17.833 16.099 13.397 1.00 41.31 C ATOM 1830 O THR A 128 18.780 15.878 14.145 1.00 64.41 O ATOM 1831 CB THR A 128 17.179 13.804 12.598 1.00 53.22 C ATOM 1832 OG1 THR A 128 17.804 12.956 13.573 1.00 44.43 O ATOM 1833 CG2 THR A 128 18.184 14.081 11.478 1.00 73.21 C ATOM 0 H THR A 128 15.682 15.708 11.517 1.00 1.20 H new ATOM 0 HA THR A 128 16.298 14.842 14.257 1.00 2.03 H new ATOM 0 HB THR A 128 16.305 13.315 12.167 1.00 53.22 H new ATOM 0 HG1 THR A 128 18.113 12.133 13.141 1.00 44.43 H new ATOM 0 HG21 THR A 128 18.504 13.138 11.035 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.715 14.700 10.713 1.00 73.21 H new ATOM 0 HG23 THR A 128 19.050 14.602 11.887 1.00 73.21 H new ATOM 1841 N ARG A 129 17.732 17.191 12.643 1.00 15.30 N ATOM 1842 CA ARG A 129 18.776 18.197 12.585 1.00 1.24 C ATOM 1843 C ARG A 129 18.249 19.557 13.048 1.00 21.22 C ATOM 1844 O ARG A 129 18.942 20.293 13.747 1.00 60.25 O ATOM 1845 CB ARG A 129 19.301 18.290 11.152 1.00 61.34 C ATOM 1846 CG ARG A 129 18.226 18.640 10.130 1.00 45.30 C ATOM 1847 CD ARG A 129 18.818 18.907 8.762 1.00 1.10 C ATOM 1848 NE ARG A 129 17.826 19.456 7.837 1.00 10.14 N ATOM 1849 CZ ARG A 129 17.976 20.599 7.168 1.00 72.04 C ATOM 1850 NH1 ARG A 129 19.083 21.319 7.307 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 17.007 21.024 6.372 1.00 55.55 N ATOM 0 H ARG A 129 16.923 17.398 12.058 1.00 15.30 H new ATOM 0 HA ARG A 129 19.587 17.909 13.254 1.00 1.24 H new ATOM 0 HB2 ARG A 129 20.089 19.042 11.111 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.755 17.338 10.878 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.508 17.822 10.062 1.00 45.30 H new ATOM 0 HG3 ARG A 129 17.677 19.519 10.467 1.00 45.30 H new ATOM 0 HD2 ARG A 129 19.651 19.603 8.856 1.00 1.10 H new ATOM 0 HD3 ARG A 129 19.222 17.980 8.354 1.00 1.10 H new ATOM 0 HE ARG A 129 16.964 18.930 7.695 1.00 10.14 H new ATOM 0 HH11 ARG A 129 19.825 20.998 7.929 1.00 12.15 H new ATOM 0 HH12 ARG A 129 19.191 22.193 6.792 1.00 12.15 H new ATOM 0 HH21 ARG A 129 16.151 20.477 6.273 1.00 55.55 H new ATOM 0 HH22 ARG A 129 17.116 21.898 5.858 1.00 55.55 H new ATOM 1865 N ASN A 130 17.027 19.896 12.637 1.00 53.23 N ATOM 1866 CA ASN A 130 16.397 21.151 13.058 1.00 71.44 C ATOM 1867 C ASN A 130 15.850 21.029 14.478 1.00 71.52 C ATOM 1868 O ASN A 130 16.143 21.852 15.347 1.00 41.25 O ATOM 1869 CB ASN A 130 15.263 21.554 12.102 1.00 51.21 C ATOM 1870 CG ASN A 130 15.762 22.038 10.750 1.00 65.44 C ATOM 1871 OD1 ASN A 130 16.079 23.217 10.578 1.00 64.05 O ATOM 1872 ND2 ASN A 130 15.804 21.142 9.775 1.00 32.23 N ATOM 0 H ASN A 130 16.455 19.324 12.016 1.00 53.23 H new ATOM 0 HA ASN A 130 17.163 21.926 13.034 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.601 20.701 11.953 1.00 51.21 H new ATOM 0 HB3 ASN A 130 14.668 22.341 12.566 1.00 51.21 H new ATOM 0 HD21 ASN A 130 16.107 21.418 8.841 1.00 32.23 H new ATOM 0 HD22 ASN A 130 15.533 20.176 9.958 1.00 32.23 H new ATOM 1879 N ASN A 131 15.049 19.989 14.700 1.00 23.53 N ATOM 1880 CA ASN A 131 14.411 19.768 15.999 1.00 43.51 C ATOM 1881 C ASN A 131 15.449 19.399 17.056 1.00 71.03 C ATOM 1882 O ASN A 131 15.432 19.919 18.174 1.00 72.12 O ATOM 1883 CB ASN A 131 13.371 18.640 15.882 1.00 43.33 C ATOM 1884 CG ASN A 131 12.552 18.442 17.152 1.00 4.41 C ATOM 1885 OD1 ASN A 131 12.262 19.393 17.882 1.00 52.34 O ATOM 1886 ND2 ASN A 131 12.175 17.201 17.430 1.00 53.22 N ATOM 0 H ASN A 131 14.825 19.284 13.997 1.00 23.53 H new ATOM 0 HA ASN A 131 13.918 20.691 16.303 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.697 18.861 15.054 1.00 43.33 H new ATOM 0 HB3 ASN A 131 13.881 17.708 15.638 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.628 17.010 18.269 1.00 53.22 H new ATOM 0 HD22 ASN A 131 12.432 16.438 16.804 1.00 53.22 H new ATOM 1893 N VAL A 132 16.369 18.518 16.680 1.00 22.24 N ATOM 1894 CA VAL A 132 17.404 18.035 17.589 1.00 51.15 C ATOM 1895 C VAL A 132 18.692 18.821 17.381 1.00 30.12 C ATOM 1896 O VAL A 132 19.121 19.029 16.246 1.00 33.10 O ATOM 1897 CB VAL A 132 17.680 16.526 17.370 1.00 54.43 C ATOM 1898 CG1 VAL A 132 18.650 15.984 18.421 1.00 31.31 C ATOM 1899 CG2 VAL A 132 16.370 15.735 17.366 1.00 70.22 C ATOM 0 H VAL A 132 16.419 18.120 15.742 1.00 22.24 H new ATOM 0 HA VAL A 132 17.048 18.179 18.609 1.00 51.15 H new ATOM 0 HB VAL A 132 18.152 16.405 16.395 1.00 54.43 H new ATOM 0 HG11 VAL A 132 18.825 14.923 18.242 1.00 31.31 H new ATOM 0 HG12 VAL A 132 19.595 16.523 18.356 1.00 31.31 H new ATOM 0 HG13 VAL A 132 18.222 16.119 19.415 1.00 31.31 H new ATOM 0 HG21 VAL A 132 16.584 14.678 17.211 1.00 70.22 H new ATOM 0 HG22 VAL A 132 15.863 15.866 18.322 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.729 16.097 16.562 1.00 70.22 H new ATOM 1909 N ALA A 133 19.297 19.259 18.476 1.00 44.32 N ATOM 1910 CA ALA A 133 20.521 20.041 18.413 1.00 45.42 C ATOM 1911 C ALA A 133 21.697 19.173 17.991 1.00 30.31 C ATOM 1912 O ALA A 133 22.362 18.541 18.819 1.00 14.22 O ATOM 1913 CB ALA A 133 20.786 20.723 19.749 1.00 22.23 C ATOM 0 H ALA A 133 18.957 19.085 19.422 1.00 44.32 H new ATOM 0 HA ALA A 133 20.398 20.817 17.658 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.706 21.304 19.685 1.00 22.23 H new ATOM 0 HB2 ALA A 133 19.955 21.385 19.991 1.00 22.23 H new ATOM 0 HB3 ALA A 133 20.887 19.968 20.529 1.00 22.23 H new ATOM 1919 N VAL A 134 21.918 19.119 16.686 1.00 55.21 N ATOM 1920 CA VAL A 134 23.017 18.362 16.126 1.00 14.23 C ATOM 1921 C VAL A 134 24.072 19.297 15.539 1.00 75.02 C ATOM 1922 O VAL A 134 23.836 19.989 14.546 1.00 44.45 O ATOM 1923 CB VAL A 134 22.542 17.374 15.042 1.00 13.33 C ATOM 1924 CG1 VAL A 134 23.722 16.560 14.538 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.437 16.465 15.580 1.00 40.12 C ATOM 0 H VAL A 134 21.342 19.597 15.993 1.00 55.21 H new ATOM 0 HA VAL A 134 23.455 17.786 16.941 1.00 14.23 H new ATOM 0 HB VAL A 134 22.125 17.938 14.208 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.382 15.863 13.772 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.471 17.229 14.114 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.160 16.004 15.366 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.118 15.777 14.797 1.00 40.12 H new ATOM 0 HG22 VAL A 134 21.815 15.897 16.430 1.00 40.12 H new ATOM 0 HG23 VAL A 134 20.589 17.072 15.897 1.00 40.12 H new ATOM 1935 N ARG A 135 25.225 19.310 16.179 1.00 5.32 N ATOM 1936 CA ARG A 135 26.359 20.113 15.762 1.00 35.41 C ATOM 1937 C ARG A 135 27.172 19.369 14.702 1.00 62.34 C ATOM 1938 O ARG A 135 27.816 18.353 14.990 1.00 24.24 O ATOM 1939 CB ARG A 135 27.207 20.440 16.999 1.00 72.41 C ATOM 1940 CG ARG A 135 28.593 21.015 16.713 1.00 24.53 C ATOM 1941 CD ARG A 135 29.222 21.597 17.980 1.00 72.30 C ATOM 1942 NE ARG A 135 28.888 20.815 19.176 1.00 54.11 N ATOM 1943 CZ ARG A 135 29.250 21.144 20.416 1.00 2.05 C ATOM 1944 NH1 ARG A 135 30.042 22.188 20.631 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 28.817 20.422 21.439 1.00 32.21 N ATOM 0 H ARG A 135 25.403 18.755 17.016 1.00 5.32 H new ATOM 0 HA ARG A 135 26.018 21.045 15.311 1.00 35.41 H new ATOM 0 HB2 ARG A 135 26.658 21.151 17.617 1.00 72.41 H new ATOM 0 HB3 ARG A 135 27.325 19.530 17.588 1.00 72.41 H new ATOM 0 HG2 ARG A 135 29.238 20.234 16.309 1.00 24.53 H new ATOM 0 HG3 ARG A 135 28.518 21.791 15.951 1.00 24.53 H new ATOM 0 HD2 ARG A 135 30.305 21.632 17.862 1.00 72.30 H new ATOM 0 HD3 ARG A 135 28.882 22.624 18.113 1.00 72.30 H new ATOM 0 HE ARG A 135 28.342 19.963 19.050 1.00 54.11 H new ATOM 0 HH11 ARG A 135 30.377 22.744 19.845 1.00 12.22 H new ATOM 0 HH12 ARG A 135 30.315 22.434 21.583 1.00 12.22 H new ATOM 0 HH21 ARG A 135 28.210 19.619 21.276 1.00 32.21 H new ATOM 0 HH22 ARG A 135 29.091 20.669 22.390 1.00 32.21 H new ATOM 1959 N LEU A 136 27.097 19.859 13.468 1.00 14.32 N ATOM 1960 CA LEU A 136 27.841 19.284 12.356 1.00 2.32 C ATOM 1961 C LEU A 136 29.284 19.783 12.357 1.00 50.04 C ATOM 1962 O LEU A 136 29.541 20.984 12.281 1.00 1.31 O ATOM 1963 CB LEU A 136 27.152 19.619 11.025 1.00 33.50 C ATOM 1964 CG LEU A 136 25.825 18.881 10.777 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.180 19.335 9.468 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.051 17.370 10.774 1.00 32.41 C ATOM 0 H LEU A 136 26.521 20.662 13.213 1.00 14.32 H new ATOM 0 HA LEU A 136 27.858 18.201 12.474 1.00 2.32 H new ATOM 0 HB2 LEU A 136 26.966 20.692 10.989 1.00 33.50 H new ATOM 0 HB3 LEU A 136 27.837 19.387 10.210 1.00 33.50 H new ATOM 0 HG LEU A 136 25.140 19.128 11.588 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.244 18.797 9.318 1.00 3.54 H new ATOM 0 HD12 LEU A 136 24.980 20.406 9.513 1.00 3.54 H new ATOM 0 HD13 LEU A 136 25.855 19.126 8.638 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.104 16.861 10.597 1.00 32.41 H new ATOM 0 HD22 LEU A 136 26.756 17.109 9.985 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.455 17.061 11.738 1.00 32.41 H new ATOM 1978 N VAL A 137 30.212 18.841 12.448 1.00 24.14 N ATOM 1979 CA VAL A 137 31.636 19.138 12.505 1.00 11.21 C ATOM 1980 C VAL A 137 32.398 18.239 11.529 1.00 22.22 C ATOM 1981 O VAL A 137 32.265 17.018 11.558 1.00 60.11 O ATOM 1982 CB VAL A 137 32.179 18.985 13.962 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.330 17.994 14.757 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.651 18.559 13.981 1.00 51.44 C ATOM 0 H VAL A 137 29.997 17.845 12.485 1.00 24.14 H new ATOM 0 HA VAL A 137 31.791 20.175 12.207 1.00 11.21 H new ATOM 0 HB VAL A 137 32.111 19.965 14.435 1.00 74.42 H new ATOM 0 HG11 VAL A 137 31.727 17.904 15.768 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.301 18.351 14.802 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.356 17.020 14.269 1.00 2.12 H new ATOM 0 HG21 VAL A 137 33.989 18.464 15.013 1.00 51.44 H new ATOM 0 HG22 VAL A 137 33.759 17.600 13.474 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.254 19.309 13.469 1.00 51.44 H new ATOM 1994 N VAL A 138 33.173 18.857 10.644 1.00 43.23 N ATOM 1995 CA VAL A 138 33.929 18.128 9.629 1.00 53.11 C ATOM 1996 C VAL A 138 35.372 17.921 10.072 1.00 13.33 C ATOM 1997 O VAL A 138 35.994 18.802 10.676 1.00 44.02 O ATOM 1998 CB VAL A 138 33.901 18.815 8.245 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.471 19.170 7.851 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.815 20.030 8.224 1.00 13.44 C ATOM 0 H VAL A 138 33.295 19.869 10.609 1.00 43.23 H new ATOM 0 HA VAL A 138 33.437 17.161 9.521 1.00 53.11 H new ATOM 0 HB VAL A 138 34.281 18.114 7.501 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.472 19.653 6.874 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.870 18.262 7.806 1.00 20.25 H new ATOM 0 HG13 VAL A 138 32.048 19.849 8.591 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.778 20.496 7.239 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.486 20.746 8.977 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.837 19.720 8.440 1.00 13.44 H new ATOM 2010 N ALA A 139 35.876 16.738 9.800 1.00 53.03 N ATOM 2011 CA ALA A 139 37.204 16.328 10.248 1.00 12.31 C ATOM 2012 C ALA A 139 38.038 15.817 9.075 1.00 73.13 C ATOM 2013 O ALA A 139 37.494 15.358 8.066 1.00 43.50 O ATOM 2014 CB ALA A 139 37.087 15.259 11.332 1.00 22.50 C ATOM 0 H ALA A 139 35.382 16.026 9.262 1.00 53.03 H new ATOM 0 HA ALA A 139 37.711 17.197 10.668 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.083 14.961 11.658 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.532 15.660 12.180 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.562 14.392 10.932 1.00 22.50 H new ATOM 2021 N MET B 1 26.945 23.804 25.577 1.00 72.34 N ATOM 2022 CA MET B 1 26.286 24.110 26.844 1.00 63.32 C ATOM 2023 C MET B 1 26.874 23.275 27.981 1.00 71.35 C ATOM 2024 O MET B 1 27.863 22.561 27.794 1.00 2.40 O ATOM 2025 CB MET B 1 24.782 23.855 26.746 1.00 41.04 C ATOM 2026 CG MET B 1 24.441 22.407 26.477 1.00 5.33 C ATOM 2027 SD MET B 1 22.672 22.088 26.581 1.00 24.33 S ATOM 2028 CE MET B 1 22.672 20.307 26.724 1.00 72.42 C ATOM 0 H1 MET B 1 26.227 23.629 24.846 1.00 72.34 H new ATOM 0 H2 MET B 1 27.540 24.608 25.292 1.00 72.34 H new ATOM 0 H3 MET B 1 27.538 22.957 25.690 1.00 72.34 H new ATOM 0 HA MET B 1 26.455 25.165 27.059 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.306 24.167 27.675 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.366 24.474 25.951 1.00 41.04 H new ATOM 0 HG2 MET B 1 24.800 22.130 25.486 1.00 5.33 H new ATOM 0 HG3 MET B 1 24.964 21.774 27.194 1.00 5.33 H new ATOM 0 HE1 MET B 1 21.682 19.966 27.027 1.00 72.42 H new ATOM 0 HE2 MET B 1 22.929 19.865 25.761 1.00 72.42 H new ATOM 0 HE3 MET B 1 23.405 20.002 27.471 1.00 72.42 H new ATOM 2038 N ASN B 2 26.249 23.357 29.157 1.00 33.33 N ATOM 2039 CA ASN B 2 26.709 22.618 30.331 1.00 51.30 C ATOM 2040 C ASN B 2 26.223 21.165 30.279 1.00 60.31 C ATOM 2041 O ASN B 2 25.285 20.780 30.980 1.00 61.35 O ATOM 2042 CB ASN B 2 26.227 23.298 31.623 1.00 21.53 C ATOM 2043 CG ASN B 2 26.884 22.717 32.867 1.00 32.42 C ATOM 2044 OD1 ASN B 2 28.042 22.295 32.831 1.00 51.33 O ATOM 2045 ND2 ASN B 2 26.155 22.694 33.973 1.00 42.33 N ATOM 0 H ASN B 2 25.421 23.930 29.320 1.00 33.33 H new ATOM 0 HA ASN B 2 27.799 22.618 30.327 1.00 51.30 H new ATOM 0 HB2 ASN B 2 26.439 24.366 31.569 1.00 21.53 H new ATOM 0 HB3 ASN B 2 25.145 23.192 31.704 1.00 21.53 H new ATOM 0 HD21 ASN B 2 26.549 22.318 34.835 1.00 42.33 H new ATOM 0 HD22 ASN B 2 25.200 23.053 33.962 1.00 42.33 H new ATOM 2052 N ILE B 3 26.836 20.389 29.396 1.00 21.23 N ATOM 2053 CA ILE B 3 26.556 18.963 29.265 1.00 72.42 C ATOM 2054 C ILE B 3 26.872 18.204 30.556 1.00 64.03 C ATOM 2055 O ILE B 3 27.981 18.288 31.086 1.00 40.30 O ATOM 2056 CB ILE B 3 27.378 18.353 28.099 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.995 19.024 26.773 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.179 16.840 28.017 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.592 18.700 26.320 1.00 13.01 C ATOM 0 H ILE B 3 27.545 20.731 28.747 1.00 21.23 H new ATOM 0 HA ILE B 3 25.491 18.862 29.056 1.00 72.42 H new ATOM 0 HB ILE B 3 28.435 18.538 28.292 1.00 60.30 H new ATOM 0 HG12 ILE B 3 27.094 20.104 26.879 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.699 18.714 26.001 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.767 16.440 27.191 1.00 62.10 H new ATOM 0 HG22 ILE B 3 27.504 16.379 28.950 1.00 62.10 H new ATOM 0 HG23 ILE B 3 26.124 16.620 27.852 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.388 19.207 25.377 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.494 17.623 26.182 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.880 19.035 27.074 1.00 13.01 H new ATOM 2071 N LEU B 4 25.884 17.463 31.043 1.00 23.11 N ATOM 2072 CA LEU B 4 26.043 16.629 32.229 1.00 23.43 C ATOM 2073 C LEU B 4 26.759 15.334 31.874 1.00 41.14 C ATOM 2074 O LEU B 4 27.723 14.944 32.536 1.00 62.34 O ATOM 2075 CB LEU B 4 24.674 16.312 32.847 1.00 50.44 C ATOM 2076 CG LEU B 4 23.865 17.532 33.305 1.00 31.23 C ATOM 2077 CD1 LEU B 4 22.493 17.109 33.828 1.00 75.25 C ATOM 2078 CD2 LEU B 4 24.631 18.324 34.367 1.00 11.04 C ATOM 0 H LEU B 4 24.953 17.423 30.629 1.00 23.11 H new ATOM 0 HA LEU B 4 26.642 17.177 32.956 1.00 23.43 H new ATOM 0 HB2 LEU B 4 24.084 15.758 32.117 1.00 50.44 H new ATOM 0 HB3 LEU B 4 24.823 15.653 33.703 1.00 50.44 H new ATOM 0 HG LEU B 4 23.713 18.181 32.442 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.937 17.991 34.147 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.943 16.600 33.036 1.00 75.25 H new ATOM 0 HD13 LEU B 4 22.619 16.434 34.674 1.00 75.25 H new ATOM 0 HD21 LEU B 4 24.038 19.185 34.677 1.00 11.04 H new ATOM 0 HD22 LEU B 4 24.822 17.686 35.229 1.00 11.04 H new ATOM 0 HD23 LEU B 4 25.579 18.667 33.952 1.00 11.04 H new ATOM 2090 N TYR B 5 26.293 14.675 30.820 1.00 23.42 N ATOM 2091 CA TYR B 5 26.835 13.377 30.424 1.00 44.15 C ATOM 2092 C TYR B 5 27.030 13.331 28.918 1.00 24.15 C ATOM 2093 O TYR B 5 26.136 13.701 28.168 1.00 75.34 O ATOM 2094 CB TYR B 5 25.881 12.259 30.865 1.00 21.21 C ATOM 2095 CG TYR B 5 26.362 10.850 30.550 1.00 10.12 C ATOM 2096 CD1 TYR B 5 26.148 10.274 29.300 1.00 52.12 C ATOM 2097 CD2 TYR B 5 27.013 10.090 31.512 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.573 8.988 29.021 1.00 75.45 C ATOM 2099 CE2 TYR B 5 27.445 8.805 31.240 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.220 8.257 29.996 1.00 52.51 C ATOM 2101 OH TYR B 5 27.644 6.971 29.728 1.00 25.44 O ATOM 0 H TYR B 5 25.540 15.017 30.222 1.00 23.42 H new ATOM 0 HA TYR B 5 27.801 13.232 30.908 1.00 44.15 H new ATOM 0 HB2 TYR B 5 25.719 12.341 31.940 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.915 12.414 30.385 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.641 10.842 28.534 1.00 52.12 H new ATOM 0 HD2 TYR B 5 27.185 10.510 32.492 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.399 8.558 28.045 1.00 75.45 H new ATOM 0 HE2 TYR B 5 27.957 8.233 32.000 1.00 10.31 H new ATOM 0 HH TYR B 5 27.011 6.538 29.118 1.00 25.44 H new ATOM 2111 N LYS B 6 28.195 12.885 28.481 1.00 30.03 N ATOM 2112 CA LYS B 6 28.479 12.743 27.060 1.00 63.12 C ATOM 2113 C LYS B 6 29.271 11.466 26.786 1.00 12.41 C ATOM 2114 O LYS B 6 30.225 11.145 27.498 1.00 54.02 O ATOM 2115 CB LYS B 6 29.229 13.977 26.532 1.00 22.40 C ATOM 2116 CG LYS B 6 29.701 13.836 25.086 1.00 43.31 C ATOM 2117 CD LYS B 6 30.070 15.178 24.461 1.00 65.01 C ATOM 2118 CE LYS B 6 28.834 16.013 24.144 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.162 17.201 23.314 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.965 12.613 29.092 1.00 30.03 H new ATOM 0 HA LYS B 6 27.530 12.668 26.530 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.578 14.848 26.609 1.00 22.40 H new ATOM 0 HB3 LYS B 6 30.092 14.167 27.170 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.565 13.173 25.052 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.915 13.367 24.494 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.717 15.731 25.142 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.639 15.009 23.547 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.104 15.396 23.621 1.00 23.11 H new ATOM 0 HE3 LYS B 6 28.368 16.338 25.074 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 28.292 17.575 22.884 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.595 17.933 23.912 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.829 16.927 22.564 1.00 52.41 H new ATOM 2133 N THR B 7 28.848 10.742 25.757 1.00 10.14 N ATOM 2134 CA THR B 7 29.514 9.524 25.315 1.00 42.05 C ATOM 2135 C THR B 7 29.717 9.582 23.804 1.00 63.52 C ATOM 2136 O THR B 7 28.979 10.283 23.100 1.00 72.52 O ATOM 2137 CB THR B 7 28.702 8.259 25.700 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.331 7.078 25.179 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.266 8.342 25.186 1.00 24.11 C ATOM 0 H THR B 7 28.027 10.986 25.202 1.00 10.14 H new ATOM 0 HA THR B 7 30.480 9.457 25.815 1.00 42.05 H new ATOM 0 HB THR B 7 28.678 8.205 26.788 1.00 0.35 H new ATOM 0 HG1 THR B 7 30.236 7.000 25.547 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.724 7.441 25.472 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.775 9.214 25.618 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.273 8.431 24.100 1.00 24.11 H new ATOM 2147 N ALA B 8 30.709 8.857 23.306 1.00 4.15 N ATOM 2148 CA ALA B 8 31.085 8.936 21.901 1.00 51.31 C ATOM 2149 C ALA B 8 30.992 7.575 21.230 1.00 33.43 C ATOM 2150 O ALA B 8 31.232 6.540 21.856 1.00 64.22 O ATOM 2151 CB ALA B 8 32.494 9.497 21.765 1.00 24.44 C ATOM 0 H ALA B 8 31.269 8.206 23.856 1.00 4.15 H new ATOM 0 HA ALA B 8 30.386 9.606 21.401 1.00 51.31 H new ATOM 0 HB1 ALA B 8 32.764 9.551 20.710 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.532 10.495 22.201 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.196 8.847 22.286 1.00 24.44 H new ATOM 2157 N ALA B 9 30.650 7.585 19.951 1.00 21.22 N ATOM 2158 CA ALA B 9 30.592 6.373 19.153 1.00 20.22 C ATOM 2159 C ALA B 9 31.108 6.664 17.749 1.00 31.45 C ATOM 2160 O ALA B 9 30.558 7.502 17.035 1.00 1.21 O ATOM 2161 CB ALA B 9 29.169 5.829 19.115 1.00 3.15 C ATOM 0 H ALA B 9 30.405 8.433 19.439 1.00 21.22 H new ATOM 0 HA ALA B 9 31.225 5.610 19.606 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.143 4.921 18.513 1.00 3.15 H new ATOM 0 HB2 ALA B 9 28.839 5.602 20.129 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.506 6.575 18.676 1.00 3.15 H new ATOM 2167 N THR B 10 32.177 5.980 17.370 1.00 33.23 N ATOM 2168 CA THR B 10 32.807 6.187 16.077 1.00 64.31 C ATOM 2169 C THR B 10 32.297 5.147 15.083 1.00 63.33 C ATOM 2170 O THR B 10 32.131 3.977 15.428 1.00 30.04 O ATOM 2171 CB THR B 10 34.352 6.117 16.193 1.00 62.43 C ATOM 2172 OG1 THR B 10 34.962 6.408 14.931 1.00 21.44 O ATOM 2173 CG2 THR B 10 34.821 4.748 16.684 1.00 23.24 C ATOM 0 H THR B 10 32.629 5.270 17.947 1.00 33.23 H new ATOM 0 HA THR B 10 32.545 7.182 15.718 1.00 64.31 H new ATOM 0 HB THR B 10 34.656 6.864 16.926 1.00 62.43 H new ATOM 0 HG1 THR B 10 35.937 6.362 15.020 1.00 21.44 H new ATOM 0 HG21 THR B 10 35.909 4.739 16.752 1.00 23.24 H new ATOM 0 HG22 THR B 10 34.394 4.548 17.667 1.00 23.24 H new ATOM 0 HG23 THR B 10 34.495 3.979 15.984 1.00 23.24 H new ATOM 2181 N SER B 11 32.020 5.580 13.864 1.00 64.42 N ATOM 2182 CA SER B 11 31.501 4.690 12.834 1.00 20.54 C ATOM 2183 C SER B 11 32.389 4.737 11.594 1.00 44.42 C ATOM 2184 O SER B 11 32.487 5.763 10.924 1.00 74.01 O ATOM 2185 CB SER B 11 30.060 5.083 12.483 1.00 74.14 C ATOM 2186 OG SER B 11 29.988 6.423 12.035 1.00 11.25 O ATOM 0 H SER B 11 32.146 6.546 13.561 1.00 64.42 H new ATOM 0 HA SER B 11 31.502 3.669 13.214 1.00 20.54 H new ATOM 0 HB2 SER B 11 29.677 4.417 11.709 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.422 4.955 13.358 1.00 74.14 H new ATOM 0 HG SER B 11 30.282 7.024 12.751 1.00 11.25 H new ATOM 2192 N THR B 12 33.052 3.630 11.302 1.00 44.31 N ATOM 2193 CA THR B 12 33.944 3.558 10.159 1.00 14.13 C ATOM 2194 C THR B 12 33.245 2.894 8.977 1.00 53.42 C ATOM 2195 O THR B 12 32.278 2.149 9.148 1.00 32.44 O ATOM 2196 CB THR B 12 35.208 2.751 10.513 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.679 3.129 11.818 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.312 2.981 9.492 1.00 31.31 C ATOM 0 H THR B 12 32.988 2.768 11.843 1.00 44.31 H new ATOM 0 HA THR B 12 34.226 4.575 9.888 1.00 14.13 H new ATOM 0 HB THR B 12 34.945 1.693 10.506 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.482 2.612 12.039 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.191 2.398 9.769 1.00 31.31 H new ATOM 0 HG22 THR B 12 35.966 2.670 8.506 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.571 4.039 9.469 1.00 31.31 H new ATOM 2206 N GLY B 13 33.738 3.164 7.779 1.00 25.11 N ATOM 2207 CA GLY B 13 33.222 2.503 6.600 1.00 71.12 C ATOM 2208 C GLY B 13 33.840 1.132 6.431 1.00 70.11 C ATOM 2209 O GLY B 13 34.731 0.954 5.605 1.00 42.34 O ATOM 0 H GLY B 13 34.489 3.831 7.602 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.139 2.410 6.676 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.429 3.110 5.719 1.00 71.12 H new ATOM 2213 N GLY B 14 33.400 0.175 7.256 1.00 21.54 N ATOM 2214 CA GLY B 14 33.909 -1.190 7.179 1.00 31.21 C ATOM 2215 C GLY B 14 33.750 -1.792 5.791 1.00 73.40 C ATOM 2216 O GLY B 14 34.526 -1.488 4.885 1.00 13.01 O ATOM 0 H GLY B 14 32.696 0.324 7.979 1.00 21.54 H new ATOM 0 HA2 GLY B 14 34.963 -1.198 7.457 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.384 -1.812 7.904 1.00 31.21 H new ATOM 2220 N ARG B 15 32.783 -2.688 5.628 1.00 12.42 N ATOM 2221 CA ARG B 15 32.418 -3.166 4.299 1.00 62.32 C ATOM 2222 C ARG B 15 31.349 -2.269 3.697 1.00 53.41 C ATOM 2223 O ARG B 15 31.463 -1.833 2.550 1.00 34.04 O ATOM 2224 CB ARG B 15 31.943 -4.626 4.327 1.00 22.32 C ATOM 2225 CG ARG B 15 33.068 -5.642 4.507 1.00 23.03 C ATOM 2226 CD ARG B 15 34.247 -5.358 3.575 1.00 52.22 C ATOM 2227 NE ARG B 15 33.823 -5.080 2.198 1.00 65.14 N ATOM 2228 CZ ARG B 15 34.647 -4.685 1.225 1.00 55.23 C ATOM 2229 NH1 ARG B 15 35.955 -4.601 1.444 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 34.157 -4.388 0.030 1.00 51.30 N ATOM 0 H ARG B 15 32.242 -3.095 6.391 1.00 12.42 H new ATOM 0 HA ARG B 15 33.311 -3.127 3.675 1.00 62.32 H new ATOM 0 HB2 ARG B 15 31.224 -4.748 5.137 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.416 -4.844 3.398 1.00 22.32 H new ATOM 0 HG2 ARG B 15 33.411 -5.625 5.542 1.00 23.03 H new ATOM 0 HG3 ARG B 15 32.686 -6.645 4.314 1.00 23.03 H new ATOM 0 HD2 ARG B 15 34.810 -4.507 3.957 1.00 52.22 H new ATOM 0 HD3 ARG B 15 34.922 -6.214 3.578 1.00 52.22 H new ATOM 0 HE ARG B 15 32.836 -5.196 1.970 1.00 65.14 H new ATOM 0 HH11 ARG B 15 36.335 -4.839 2.360 1.00 21.14 H new ATOM 0 HH12 ARG B 15 36.579 -4.298 0.696 1.00 21.14 H new ATOM 0 HH21 ARG B 15 33.154 -4.462 -0.143 1.00 51.30 H new ATOM 0 HH22 ARG B 15 34.782 -4.086 -0.717 1.00 51.30 H new ATOM 2244 N ASP B 16 30.299 -2.025 4.470 1.00 43.23 N ATOM 2245 CA ASP B 16 29.232 -1.115 4.063 1.00 64.45 C ATOM 2246 C ASP B 16 29.033 -0.053 5.144 1.00 45.23 C ATOM 2247 O ASP B 16 28.892 1.132 4.846 1.00 44.01 O ATOM 2248 CB ASP B 16 27.945 -1.915 3.830 1.00 65.33 C ATOM 2249 CG ASP B 16 26.807 -1.089 3.238 1.00 54.31 C ATOM 2250 OD1 ASP B 16 26.138 -0.363 4.000 1.00 24.34 O ATOM 2251 OD2 ASP B 16 26.551 -1.208 2.019 1.00 12.23 O1- ATOM 0 H ASP B 16 30.162 -2.447 5.388 1.00 43.23 H new ATOM 0 HA ASP B 16 29.498 -0.613 3.133 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.162 -2.749 3.162 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.617 -2.342 4.778 1.00 65.33 H new ATOM 2256 N GLY B 17 29.053 -0.489 6.410 1.00 22.41 N ATOM 2257 CA GLY B 17 29.150 0.446 7.518 1.00 74.22 C ATOM 2258 C GLY B 17 29.588 -0.240 8.800 1.00 32.04 C ATOM 2259 O GLY B 17 29.388 -1.442 8.959 1.00 11.23 O ATOM 0 H GLY B 17 29.004 -1.471 6.682 1.00 22.41 H new ATOM 0 HA2 GLY B 17 29.860 1.234 7.267 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.184 0.925 7.674 1.00 74.22 H new ATOM 2263 N ARG B 18 30.210 0.509 9.703 1.00 41.41 N ATOM 2264 CA ARG B 18 30.592 -0.009 11.018 1.00 45.30 C ATOM 2265 C ARG B 18 30.175 0.985 12.098 1.00 1.35 C ATOM 2266 O ARG B 18 30.185 2.187 11.861 1.00 0.54 O ATOM 2267 CB ARG B 18 32.111 -0.255 11.087 1.00 74.40 C ATOM 2268 CG ARG B 18 32.602 -0.673 12.472 1.00 53.04 C ATOM 2269 CD ARG B 18 34.118 -0.787 12.544 1.00 43.11 C ATOM 2270 NE ARG B 18 34.639 -1.871 11.706 1.00 64.22 N ATOM 2271 CZ ARG B 18 35.889 -1.922 11.235 1.00 63.34 C ATOM 2272 NH1 ARG B 18 36.758 -0.958 11.527 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 36.276 -2.952 10.493 1.00 54.01 N ATOM 0 H ARG B 18 30.464 1.485 9.550 1.00 41.41 H new ATOM 0 HA ARG B 18 30.084 -0.959 11.182 1.00 45.30 H new ATOM 0 HB2 ARG B 18 32.378 -1.029 10.367 1.00 74.40 H new ATOM 0 HB3 ARG B 18 32.632 0.654 10.785 1.00 74.40 H new ATOM 0 HG2 ARG B 18 32.260 0.053 13.209 1.00 53.04 H new ATOM 0 HG3 ARG B 18 32.156 -1.631 12.738 1.00 53.04 H new ATOM 0 HD2 ARG B 18 34.565 0.157 12.232 1.00 43.11 H new ATOM 0 HD3 ARG B 18 34.418 -0.955 13.578 1.00 43.11 H new ATOM 0 HE ARG B 18 34.007 -2.635 11.467 1.00 64.22 H new ATOM 0 HH11 ARG B 18 36.472 -0.174 12.113 1.00 23.22 H new ATOM 0 HH12 ARG B 18 37.710 -1.003 11.164 1.00 23.22 H new ATOM 0 HH21 ARG B 18 35.620 -3.704 10.282 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.230 -2.992 10.133 1.00 54.01 H new ATOM 2287 N ALA B 19 29.808 0.478 13.271 1.00 25.44 N ATOM 2288 CA ALA B 19 29.447 1.321 14.408 1.00 25.14 C ATOM 2289 C ALA B 19 30.150 0.818 15.667 1.00 64.21 C ATOM 2290 O ALA B 19 29.990 -0.341 16.055 1.00 14.23 O ATOM 2291 CB ALA B 19 27.933 1.331 14.607 1.00 63.23 C ATOM 0 H ALA B 19 29.752 -0.523 13.461 1.00 25.44 H new ATOM 0 HA ALA B 19 29.769 2.343 14.208 1.00 25.14 H new ATOM 0 HB1 ALA B 19 27.682 1.964 15.458 1.00 63.23 H new ATOM 0 HB2 ALA B 19 27.451 1.721 13.710 1.00 63.23 H new ATOM 0 HB3 ALA B 19 27.584 0.316 14.795 1.00 63.23 H new ATOM 2297 N THR B 20 30.907 1.697 16.310 1.00 63.15 N ATOM 2298 CA THR B 20 31.730 1.327 17.454 1.00 31.24 C ATOM 2299 C THR B 20 31.572 2.343 18.585 1.00 2.34 C ATOM 2300 O THR B 20 31.946 3.510 18.444 1.00 75.11 O ATOM 2301 CB THR B 20 33.221 1.239 17.034 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.356 0.387 15.884 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.099 0.706 18.165 1.00 14.05 C ATOM 0 H THR B 20 30.968 2.683 16.055 1.00 63.15 H new ATOM 0 HA THR B 20 31.399 0.352 17.811 1.00 31.24 H new ATOM 0 HB THR B 20 33.555 2.248 16.793 1.00 15.15 H new ATOM 0 HG1 THR B 20 33.830 -0.432 16.138 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.135 0.660 17.830 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.025 1.370 19.027 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.764 -0.292 18.446 1.00 14.05 H new ATOM 2311 N SER B 21 31.014 1.896 19.709 1.00 21.31 N ATOM 2312 CA SER B 21 30.886 2.746 20.881 1.00 32.44 C ATOM 2313 C SER B 21 32.270 2.950 21.464 1.00 11.23 C ATOM 2314 O SER B 21 32.869 1.985 21.981 1.00 42.34 O ATOM 2315 CB SER B 21 29.948 2.137 21.928 1.00 31.41 C ATOM 2316 OG SER B 21 29.909 2.922 23.107 1.00 74.21 O ATOM 0 H SER B 21 30.646 0.952 19.828 1.00 21.31 H new ATOM 0 HA SER B 21 30.448 3.700 20.587 1.00 32.44 H new ATOM 0 HB2 SER B 21 28.944 2.051 21.513 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.279 1.128 22.172 1.00 31.41 H new ATOM 0 HG SER B 21 28.977 3.057 23.379 1.00 74.21 H new ATOM 2322 N HIS B 22 32.727 4.215 21.376 1.00 5.04 N ATOM 2323 CA HIS B 22 34.115 4.637 21.617 1.00 32.51 C ATOM 2324 C HIS B 22 34.585 4.313 23.030 1.00 35.24 C ATOM 2325 O HIS B 22 35.787 4.312 23.309 1.00 73.12 O ATOM 2326 CB HIS B 22 34.231 6.150 21.353 1.00 3.43 C ATOM 2327 CG HIS B 22 35.600 6.735 21.568 1.00 12.52 C ATOM 2328 ND1 HIS B 22 35.942 7.460 22.690 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.702 6.727 20.780 1.00 34.34 C ATOM 2330 CE1 HIS B 22 37.192 7.874 22.581 1.00 23.12 C ATOM 2331 NE2 HIS B 22 37.677 7.441 21.431 1.00 12.42 N ATOM 0 H HIS B 22 32.118 4.994 21.127 1.00 5.04 H new ATOM 0 HA HIS B 22 34.760 4.081 20.936 1.00 32.51 H new ATOM 0 HB2 HIS B 22 33.926 6.348 20.325 1.00 3.43 H new ATOM 0 HB3 HIS B 22 33.525 6.671 22.000 1.00 3.43 H new ATOM 0 HD2 HIS B 22 36.796 6.247 19.817 1.00 34.34 H new ATOM 0 HE1 HIS B 22 37.727 8.466 23.309 1.00 23.12 H new ATOM 0 HE2 HIS B 22 38.621 7.610 21.084 1.00 12.42 H new ATOM 2340 N ASP B 23 33.646 4.024 23.912 1.00 44.12 N ATOM 2341 CA ASP B 23 33.978 3.599 25.270 1.00 0.24 C ATOM 2342 C ASP B 23 34.342 2.116 25.281 1.00 62.21 C ATOM 2343 O ASP B 23 34.462 1.503 26.344 1.00 40.03 O ATOM 2344 CB ASP B 23 32.800 3.868 26.217 1.00 12.04 C ATOM 2345 CG ASP B 23 32.627 5.344 26.533 1.00 5.31 C ATOM 2346 OD1 ASP B 23 32.044 6.076 25.705 1.00 63.54 O ATOM 2347 OD2 ASP B 23 33.085 5.778 27.612 1.00 33.23 O1- ATOM 0 H ASP B 23 32.646 4.074 23.718 1.00 44.12 H new ATOM 0 HA ASP B 23 34.837 4.173 25.617 1.00 0.24 H new ATOM 0 HB2 ASP B 23 31.883 3.487 25.767 1.00 12.04 H new ATOM 0 HB3 ASP B 23 32.952 3.317 27.145 1.00 12.04 H new ATOM 2352 N GLN B 24 34.529 1.560 24.074 1.00 3.35 N ATOM 2353 CA GLN B 24 34.854 0.147 23.885 1.00 64.10 C ATOM 2354 C GLN B 24 33.665 -0.713 24.282 1.00 11.02 C ATOM 2355 O GLN B 24 33.791 -1.919 24.501 1.00 0.33 O ATOM 2356 CB GLN B 24 36.108 -0.246 24.678 1.00 41.34 C ATOM 2357 CG GLN B 24 37.373 0.470 24.217 1.00 71.43 C ATOM 2358 CD GLN B 24 37.746 0.137 22.782 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.465 -0.825 22.525 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.266 0.933 21.837 1.00 4.32 N ATOM 0 H GLN B 24 34.458 2.084 23.202 1.00 3.35 H new ATOM 0 HA GLN B 24 35.072 -0.021 22.830 1.00 64.10 H new ATOM 0 HB2 GLN B 24 35.943 -0.030 25.733 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.259 -1.322 24.593 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.231 1.547 24.310 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.199 0.199 24.875 1.00 71.43 H new ATOM 0 HE21 GLN B 24 36.672 1.723 22.089 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.491 0.756 20.858 1.00 4.32 H new ATOM 2369 N LYS B 25 32.502 -0.076 24.345 1.00 34.11 N ATOM 2370 CA LYS B 25 31.280 -0.745 24.748 1.00 33.22 C ATOM 2371 C LYS B 25 30.589 -1.380 23.552 1.00 40.01 C ATOM 2372 O LYS B 25 29.761 -2.278 23.724 1.00 34.42 O ATOM 2373 CB LYS B 25 30.333 0.240 25.451 1.00 20.21 C ATOM 2374 CG LYS B 25 30.951 0.920 26.667 1.00 22.43 C ATOM 2375 CD LYS B 25 31.459 -0.091 27.692 1.00 41.25 C ATOM 2376 CE LYS B 25 32.111 0.595 28.889 1.00 25.52 C ATOM 2377 NZ LYS B 25 31.150 1.449 29.640 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.384 0.912 24.119 1.00 34.11 H new ATOM 0 HA LYS B 25 31.544 -1.536 25.450 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.022 1.003 24.738 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.434 -0.292 25.761 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.776 1.556 26.346 1.00 22.43 H new ATOM 0 HG3 LYS B 25 30.211 1.569 27.134 1.00 22.43 H new ATOM 0 HD2 LYS B 25 30.629 -0.709 28.035 1.00 41.25 H new ATOM 0 HD3 LYS B 25 32.179 -0.758 27.219 1.00 41.25 H new ATOM 0 HE2 LYS B 25 32.523 -0.160 29.558 1.00 25.52 H new ATOM 0 HE3 LYS B 25 32.946 1.206 28.545 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 31.591 1.772 30.525 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.892 2.273 29.061 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 30.295 0.899 29.860 1.00 5.33 H new ATOM 2391 N LEU B 26 30.906 -0.927 22.331 1.00 71.52 N ATOM 2392 CA LEU B 26 30.316 -1.554 21.153 1.00 40.15 C ATOM 2393 C LEU B 26 31.282 -1.532 19.986 1.00 62.33 C ATOM 2394 O LEU B 26 32.036 -0.582 19.828 1.00 50.50 O ATOM 2395 CB LEU B 26 29.010 -0.845 20.777 1.00 64.14 C ATOM 2396 CG LEU B 26 28.334 -1.346 19.497 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.823 -2.776 19.669 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.207 -0.403 19.088 1.00 31.22 C ATOM 0 H LEU B 26 31.546 -0.155 22.141 1.00 71.52 H new ATOM 0 HA LEU B 26 30.098 -2.595 21.392 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.308 -0.952 21.604 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.214 0.220 20.667 1.00 64.14 H new ATOM 0 HG LEU B 26 29.076 -1.357 18.699 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.348 -3.106 18.745 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.659 -3.435 19.903 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.097 -2.808 20.482 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.736 -0.772 18.177 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.466 -0.355 19.886 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.613 0.593 18.909 1.00 31.22 H new ATOM 2410 N ASP B 27 31.256 -2.590 19.185 1.00 22.45 N ATOM 2411 CA ASP B 27 32.050 -2.668 17.964 1.00 53.33 C ATOM 2412 C ASP B 27 31.413 -3.668 17.004 1.00 42.15 C ATOM 2413 O ASP B 27 31.675 -4.868 17.074 1.00 22.10 O ATOM 2414 CB ASP B 27 33.500 -3.064 18.277 1.00 24.13 C ATOM 2415 CG ASP B 27 34.362 -3.194 17.028 1.00 15.20 C ATOM 2416 OD1 ASP B 27 34.660 -4.337 16.608 1.00 3.40 O ATOM 2417 OD2 ASP B 27 34.771 -2.152 16.475 1.00 21.30 O1- ATOM 0 H ASP B 27 30.685 -3.417 19.362 1.00 22.45 H new ATOM 0 HA ASP B 27 32.070 -1.685 17.493 1.00 53.33 H new ATOM 0 HB2 ASP B 27 33.940 -2.319 18.940 1.00 24.13 H new ATOM 0 HB3 ASP B 27 33.504 -4.012 18.815 1.00 24.13 H new ATOM 2422 N VAL B 28 30.533 -3.167 16.145 1.00 42.42 N ATOM 2423 CA VAL B 28 29.823 -3.993 15.173 1.00 61.03 C ATOM 2424 C VAL B 28 29.799 -3.320 13.813 1.00 62.05 C ATOM 2425 O VAL B 28 30.292 -2.208 13.650 1.00 71.42 O ATOM 2426 CB VAL B 28 28.367 -4.300 15.610 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.351 -5.337 16.727 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.648 -3.021 16.034 1.00 74.12 C ATOM 0 H VAL B 28 30.291 -2.177 16.102 1.00 42.42 H new ATOM 0 HA VAL B 28 30.367 -4.936 15.113 1.00 61.03 H new ATOM 0 HB VAL B 28 27.831 -4.716 14.757 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.321 -5.540 17.021 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.816 -6.258 16.375 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.905 -4.956 17.585 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.628 -3.260 16.336 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.178 -2.566 16.871 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.624 -2.323 15.197 1.00 74.12 H new ATOM 2438 N LYS B 29 29.214 -4.001 12.846 1.00 64.31 N ATOM 2439 CA LYS B 29 29.200 -3.539 11.470 1.00 24.45 C ATOM 2440 C LYS B 29 27.859 -3.857 10.818 1.00 31.35 C ATOM 2441 O LYS B 29 27.283 -4.918 11.057 1.00 25.23 O ATOM 2442 CB LYS B 29 30.367 -4.198 10.720 1.00 11.40 C ATOM 2443 CG LYS B 29 30.136 -4.430 9.228 1.00 53.23 C ATOM 2444 CD LYS B 29 31.405 -4.910 8.520 1.00 3.25 C ATOM 2445 CE LYS B 29 32.119 -6.019 9.294 1.00 32.51 C ATOM 2446 NZ LYS B 29 31.228 -7.174 9.584 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.735 -4.890 12.992 1.00 64.31 H new ATOM 0 HA LYS B 29 29.325 -2.457 11.434 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.253 -3.575 10.841 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.585 -5.157 11.191 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.345 -5.168 9.094 1.00 53.23 H new ATOM 0 HG3 LYS B 29 29.791 -3.505 8.766 1.00 53.23 H new ATOM 0 HD2 LYS B 29 31.148 -5.273 7.525 1.00 3.25 H new ATOM 0 HD3 LYS B 29 32.084 -4.068 8.387 1.00 3.25 H new ATOM 0 HE2 LYS B 29 32.979 -6.363 8.720 1.00 32.51 H new ATOM 0 HE3 LYS B 29 32.502 -5.615 10.231 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 31.022 -7.206 10.603 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 30.339 -7.069 9.054 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 31.699 -8.056 9.298 1.00 50.55 H new ATOM 2460 N LEU B 30 27.358 -2.921 10.015 1.00 60.42 N ATOM 2461 CA LEU B 30 26.096 -3.098 9.312 1.00 43.12 C ATOM 2462 C LEU B 30 26.276 -2.917 7.806 1.00 50.11 C ATOM 2463 O LEU B 30 27.355 -2.508 7.330 1.00 72.32 O ATOM 2464 CB LEU B 30 24.984 -2.171 9.872 1.00 4.40 C ATOM 2465 CG LEU B 30 25.363 -0.719 10.247 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.249 -0.677 11.491 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.021 0.009 9.079 1.00 52.40 C ATOM 0 H LEU B 30 27.814 -2.026 9.836 1.00 60.42 H new ATOM 0 HA LEU B 30 25.767 -4.123 9.486 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.184 -2.126 9.133 1.00 4.40 H new ATOM 0 HB3 LEU B 30 24.570 -2.647 10.761 1.00 4.40 H new ATOM 0 HG LEU B 30 24.437 -0.194 10.481 1.00 61.23 H new ATOM 0 HD11 LEU B 30 26.497 0.358 11.727 1.00 42.23 H new ATOM 0 HD12 LEU B 30 25.717 -1.123 12.331 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.166 -1.236 11.304 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.273 1.026 9.380 1.00 52.40 H new ATOM 0 HD22 LEU B 30 26.929 -0.519 8.786 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.332 0.041 8.235 1.00 52.40 H new ATOM 2479 N SER B 31 25.226 -3.253 7.061 1.00 24.22 N ATOM 2480 CA SER B 31 25.260 -3.218 5.611 1.00 21.40 C ATOM 2481 C SER B 31 23.865 -2.980 5.042 1.00 43.34 C ATOM 2482 O SER B 31 22.895 -3.606 5.476 1.00 1.33 O ATOM 2483 CB SER B 31 25.834 -4.534 5.067 1.00 62.35 C ATOM 2484 OG SER B 31 27.153 -4.752 5.547 1.00 3.34 O ATOM 0 H SER B 31 24.333 -3.556 7.449 1.00 24.22 H new ATOM 0 HA SER B 31 25.902 -2.393 5.302 1.00 21.40 H new ATOM 0 HB2 SER B 31 25.193 -5.364 5.364 1.00 62.35 H new ATOM 0 HB3 SER B 31 25.839 -4.509 3.977 1.00 62.35 H new ATOM 0 HG SER B 31 27.221 -5.657 5.916 1.00 3.34 H new ATOM 2490 N ALA B 32 23.774 -2.063 4.085 1.00 40.52 N ATOM 2491 CA ALA B 32 22.521 -1.782 3.401 1.00 75.13 C ATOM 2492 C ALA B 32 22.110 -2.979 2.541 1.00 31.44 C ATOM 2493 O ALA B 32 22.970 -3.641 1.934 1.00 42.31 O ATOM 2494 CB ALA B 32 22.659 -0.525 2.547 1.00 44.15 C ATOM 0 H ALA B 32 24.561 -1.499 3.765 1.00 40.52 H new ATOM 0 HA ALA B 32 21.742 -1.609 4.144 1.00 75.13 H new ATOM 0 HB1 ALA B 32 21.715 -0.324 2.040 1.00 44.15 H new ATOM 0 HB2 ALA B 32 22.916 0.321 3.184 1.00 44.15 H new ATOM 0 HB3 ALA B 32 23.445 -0.673 1.806 1.00 44.15 H new ATOM 2500 N PRO B 33 20.798 -3.284 2.483 1.00 64.54 N ATOM 2501 CA PRO B 33 20.281 -4.416 1.708 1.00 71.30 C ATOM 2502 C PRO B 33 20.774 -4.404 0.261 1.00 44.54 C ATOM 2503 O PRO B 33 20.440 -3.502 -0.519 1.00 60.20 O ATOM 2504 CB PRO B 33 18.758 -4.231 1.767 1.00 5.21 C ATOM 2505 CG PRO B 33 18.524 -3.466 3.024 1.00 53.32 C ATOM 2506 CD PRO B 33 19.716 -2.557 3.183 1.00 34.02 C ATOM 0 HA PRO B 33 20.617 -5.371 2.111 1.00 71.30 H new ATOM 0 HB2 PRO B 33 18.390 -3.687 0.897 1.00 5.21 H new ATOM 0 HB3 PRO B 33 18.242 -5.191 1.785 1.00 5.21 H new ATOM 0 HG2 PRO B 33 17.600 -2.891 2.965 1.00 53.32 H new ATOM 0 HG3 PRO B 33 18.428 -4.137 3.877 1.00 53.32 H new ATOM 0 HD2 PRO B 33 19.537 -1.578 2.738 1.00 34.02 H new ATOM 0 HD3 PRO B 33 19.957 -2.391 4.233 1.00 34.02 H new ATOM 2514 N ARG B 34 21.589 -5.398 -0.086 1.00 0.10 N ATOM 2515 CA ARG B 34 22.100 -5.569 -1.427 1.00 23.43 C ATOM 2516 C ARG B 34 20.958 -5.546 -2.445 1.00 64.55 C ATOM 2517 O ARG B 34 21.124 -5.070 -3.568 1.00 62.12 O ATOM 2518 CB ARG B 34 22.871 -6.900 -1.494 1.00 33.02 C ATOM 2519 CG ARG B 34 24.170 -6.817 -2.267 1.00 11.34 C ATOM 2520 CD ARG B 34 24.004 -6.102 -3.584 1.00 70.25 C ATOM 2521 NE ARG B 34 23.165 -6.843 -4.533 1.00 41.11 N ATOM 2522 CZ ARG B 34 23.491 -7.068 -5.809 1.00 71.43 C ATOM 2523 NH1 ARG B 34 24.683 -6.709 -6.272 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 22.629 -7.671 -6.618 1.00 21.32 N ATOM 0 H ARG B 34 21.911 -6.110 0.569 1.00 0.10 H new ATOM 0 HA ARG B 34 22.773 -4.748 -1.673 1.00 23.43 H new ATOM 0 HB2 ARG B 34 23.084 -7.237 -0.479 1.00 33.02 H new ATOM 0 HB3 ARG B 34 22.234 -7.655 -1.954 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.916 -6.298 -1.665 1.00 11.34 H new ATOM 0 HG3 ARG B 34 24.549 -7.823 -2.447 1.00 11.34 H new ATOM 0 HD2 ARG B 34 23.564 -5.121 -3.406 1.00 70.25 H new ATOM 0 HD3 ARG B 34 24.986 -5.935 -4.028 1.00 70.25 H new ATOM 0 HE ARG B 34 22.275 -7.210 -4.197 1.00 41.11 H new ATOM 0 HH11 ARG B 34 25.356 -6.258 -5.652 1.00 70.13 H new ATOM 0 HH12 ARG B 34 24.925 -6.884 -7.247 1.00 70.13 H new ATOM 0 HH21 ARG B 34 21.717 -7.963 -6.266 1.00 21.32 H new ATOM 0 HH22 ARG B 34 22.878 -7.843 -7.592 1.00 21.32 H new ATOM 2538 N GLU B 35 19.803 -6.043 -2.021 1.00 42.24 N ATOM 2539 CA GLU B 35 18.603 -6.103 -2.857 1.00 63.02 C ATOM 2540 C GLU B 35 18.288 -4.742 -3.469 1.00 12.03 C ATOM 2541 O GLU B 35 17.964 -4.631 -4.652 1.00 54.43 O ATOM 2542 CB GLU B 35 17.406 -6.577 -2.014 1.00 72.41 C ATOM 2543 CG GLU B 35 17.463 -8.050 -1.610 1.00 31.33 C ATOM 2544 CD GLU B 35 18.732 -8.407 -0.850 1.00 34.33 C ATOM 2545 OE1 GLU B 35 19.483 -9.296 -1.308 1.00 72.42 O ATOM 2546 OE2 GLU B 35 19.000 -7.773 0.192 1.00 24.25 O1- ATOM 0 H GLU B 35 19.668 -6.419 -1.082 1.00 42.24 H new ATOM 0 HA GLU B 35 18.789 -6.809 -3.667 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.348 -5.967 -1.112 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.489 -6.402 -2.577 1.00 72.41 H new ATOM 0 HG2 GLU B 35 16.597 -8.286 -0.992 1.00 31.33 H new ATOM 0 HG3 GLU B 35 17.395 -8.670 -2.504 1.00 31.33 H new ATOM 2553 N LEU B 36 18.406 -3.714 -2.649 1.00 53.04 N ATOM 2554 CA LEU B 36 18.005 -2.367 -3.026 1.00 1.52 C ATOM 2555 C LEU B 36 19.160 -1.621 -3.685 1.00 52.10 C ATOM 2556 O LEU B 36 18.955 -0.830 -4.607 1.00 30.14 O ATOM 2557 CB LEU B 36 17.527 -1.634 -1.775 1.00 63.52 C ATOM 2558 CG LEU B 36 16.481 -2.410 -0.958 1.00 20.23 C ATOM 2559 CD1 LEU B 36 16.307 -1.796 0.421 1.00 52.43 C ATOM 2560 CD2 LEU B 36 15.144 -2.476 -1.700 1.00 15.21 C ATOM 0 H LEU B 36 18.782 -3.787 -1.704 1.00 53.04 H new ATOM 0 HA LEU B 36 17.195 -2.416 -3.753 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.387 -1.423 -1.139 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.104 -0.673 -2.068 1.00 63.52 H new ATOM 0 HG LEU B 36 16.844 -3.430 -0.830 1.00 20.23 H new ATOM 0 HD11 LEU B 36 15.562 -2.362 0.980 1.00 52.43 H new ATOM 0 HD12 LEU B 36 17.258 -1.822 0.954 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.976 -0.762 0.320 1.00 52.43 H new ATOM 0 HD21 LEU B 36 14.422 -3.030 -1.100 1.00 15.21 H new ATOM 0 HD22 LEU B 36 14.773 -1.466 -1.872 1.00 15.21 H new ATOM 0 HD23 LEU B 36 15.283 -2.979 -2.657 1.00 15.21 H new ATOM 2572 N GLY B 37 20.372 -1.881 -3.204 1.00 22.45 N ATOM 2573 CA GLY B 37 21.554 -1.255 -3.773 1.00 25.41 C ATOM 2574 C GLY B 37 22.671 -1.100 -2.761 1.00 51.22 C ATOM 2575 O GLY B 37 23.381 -0.092 -2.760 1.00 30.40 O ATOM 0 H GLY B 37 20.558 -2.516 -2.428 1.00 22.45 H new ATOM 0 HA2 GLY B 37 21.909 -1.852 -4.613 1.00 25.41 H new ATOM 0 HA3 GLY B 37 21.288 -0.275 -4.169 1.00 25.41 H new ATOM 2579 N GLY B 38 22.839 -2.104 -1.902 1.00 53.33 N ATOM 2580 CA GLY B 38 23.846 -2.033 -0.867 1.00 54.12 C ATOM 2581 C GLY B 38 24.942 -3.047 -1.091 1.00 61.21 C ATOM 2582 O GLY B 38 25.375 -3.264 -2.226 1.00 64.12 O ATOM 0 H GLY B 38 22.292 -2.965 -1.908 1.00 53.33 H new ATOM 0 HA2 GLY B 38 24.275 -1.031 -0.843 1.00 54.12 H new ATOM 0 HA3 GLY B 38 23.383 -2.205 0.105 1.00 54.12 H new ATOM 2586 N ALA B 39 25.367 -3.691 -0.018 1.00 3.10 N ATOM 2587 CA ALA B 39 26.457 -4.662 -0.080 1.00 71.25 C ATOM 2588 C ALA B 39 25.996 -6.050 0.356 1.00 4.43 C ATOM 2589 O ALA B 39 26.652 -7.048 0.048 1.00 31.41 O ATOM 2590 CB ALA B 39 27.624 -4.198 0.783 1.00 12.41 C ATOM 0 H ALA B 39 24.974 -3.561 0.914 1.00 3.10 H new ATOM 0 HA ALA B 39 26.784 -4.731 -1.117 1.00 71.25 H new ATOM 0 HB1 ALA B 39 28.430 -4.930 0.729 1.00 12.41 H new ATOM 0 HB2 ALA B 39 27.983 -3.235 0.421 1.00 12.41 H new ATOM 0 HB3 ALA B 39 27.294 -4.097 1.817 1.00 12.41 H new ATOM 2596 N GLY B 40 24.849 -6.113 1.046 1.00 23.34 N ATOM 2597 CA GLY B 40 24.373 -7.377 1.616 1.00 31.44 C ATOM 2598 C GLY B 40 25.483 -8.114 2.338 1.00 1.42 C ATOM 2599 O GLY B 40 25.543 -9.345 2.351 1.00 53.13 O ATOM 0 H GLY B 40 24.241 -5.313 1.221 1.00 23.34 H new ATOM 0 HA2 GLY B 40 23.555 -7.180 2.309 1.00 31.44 H new ATOM 0 HA3 GLY B 40 23.973 -8.007 0.822 1.00 31.44 H new ATOM 2603 N ALA B 41 26.367 -7.327 2.922 1.00 13.10 N ATOM 2604 CA ALA B 41 27.602 -7.823 3.517 1.00 45.11 C ATOM 2605 C ALA B 41 27.397 -8.332 4.942 1.00 24.05 C ATOM 2606 O ALA B 41 26.269 -8.535 5.395 1.00 14.44 O ATOM 2607 CB ALA B 41 28.645 -6.712 3.508 1.00 11.53 C ATOM 0 H ALA B 41 26.251 -6.317 2.999 1.00 13.10 H new ATOM 0 HA ALA B 41 27.943 -8.669 2.920 1.00 45.11 H new ATOM 0 HB1 ALA B 41 29.571 -7.078 3.952 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.834 -6.399 2.481 1.00 11.53 H new ATOM 0 HB3 ALA B 41 28.277 -5.863 4.084 1.00 11.53 H new ATOM 2613 N GLU B 42 28.517 -8.539 5.631 1.00 15.20 N ATOM 2614 CA GLU B 42 28.524 -8.999 7.013 1.00 53.20 C ATOM 2615 C GLU B 42 28.068 -7.886 7.933 1.00 74.14 C ATOM 2616 O GLU B 42 28.874 -7.232 8.600 1.00 53.42 O ATOM 2617 CB GLU B 42 29.926 -9.452 7.397 1.00 21.14 C ATOM 2618 CG GLU B 42 30.528 -10.373 6.364 1.00 73.23 C ATOM 2619 CD GLU B 42 31.986 -10.702 6.649 1.00 72.34 C ATOM 2620 OE1 GLU B 42 32.276 -11.839 7.072 1.00 61.42 O ATOM 2621 OE2 GLU B 42 32.850 -9.813 6.474 1.00 61.14 O1- ATOM 0 H GLU B 42 29.448 -8.391 5.242 1.00 15.20 H new ATOM 0 HA GLU B 42 27.838 -9.840 7.112 1.00 53.20 H new ATOM 0 HB2 GLU B 42 30.567 -8.579 7.521 1.00 21.14 H new ATOM 0 HB3 GLU B 42 29.891 -9.962 8.360 1.00 21.14 H new ATOM 0 HG2 GLU B 42 29.952 -11.297 6.328 1.00 73.23 H new ATOM 0 HG3 GLU B 42 30.450 -9.910 5.380 1.00 73.23 H new ATOM 2628 N GLY B 43 26.782 -7.646 7.907 1.00 33.24 N ATOM 2629 CA GLY B 43 26.192 -6.628 8.753 1.00 35.43 C ATOM 2630 C GLY B 43 24.692 -6.775 8.919 1.00 2.13 C ATOM 2631 O GLY B 43 24.103 -7.773 8.496 1.00 72.12 O ATOM 0 H GLY B 43 26.119 -8.140 7.310 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.664 -6.665 9.735 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.409 -5.646 8.332 1.00 35.43 H new ATOM 2635 N THR B 44 24.087 -5.772 9.546 1.00 33.20 N ATOM 2636 CA THR B 44 22.650 -5.740 9.795 1.00 33.40 C ATOM 2637 C THR B 44 22.015 -4.583 9.023 1.00 35.03 C ATOM 2638 O THR B 44 22.726 -3.756 8.449 1.00 4.14 O ATOM 2639 CB THR B 44 22.349 -5.581 11.310 1.00 13.15 C ATOM 2640 OG1 THR B 44 20.934 -5.597 11.547 1.00 1.03 O ATOM 2641 CG2 THR B 44 22.937 -4.286 11.864 1.00 34.45 C ATOM 0 H THR B 44 24.583 -4.953 9.898 1.00 33.20 H new ATOM 0 HA THR B 44 22.226 -6.685 9.456 1.00 33.40 H new ATOM 0 HB THR B 44 22.815 -6.423 11.822 1.00 13.15 H new ATOM 0 HG1 THR B 44 20.762 -5.497 12.507 1.00 1.03 H new ATOM 0 HG21 THR B 44 22.707 -4.207 12.927 1.00 34.45 H new ATOM 0 HG22 THR B 44 24.018 -4.289 11.726 1.00 34.45 H new ATOM 0 HG23 THR B 44 22.506 -3.436 11.336 1.00 34.45 H new ATOM 2649 N ASN B 45 20.686 -4.527 9.018 1.00 4.01 N ATOM 2650 CA ASN B 45 19.960 -3.451 8.351 1.00 51.43 C ATOM 2651 C ASN B 45 20.049 -2.168 9.172 1.00 21.43 C ATOM 2652 O ASN B 45 19.588 -2.136 10.315 1.00 31.35 O ATOM 2653 CB ASN B 45 18.482 -3.830 8.169 1.00 71.14 C ATOM 2654 CG ASN B 45 18.275 -5.004 7.230 1.00 11.33 C ATOM 2655 OD1 ASN B 45 18.292 -6.164 7.650 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.048 -4.711 5.960 1.00 55.34 N ATOM 0 H ASN B 45 20.088 -5.218 9.471 1.00 4.01 H new ATOM 0 HA ASN B 45 20.413 -3.291 7.373 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.054 -4.072 9.142 1.00 71.14 H new ATOM 0 HB3 ASN B 45 17.937 -2.967 7.786 1.00 71.14 H new ATOM 0 HD21 ASN B 45 17.878 -5.458 5.287 1.00 55.34 H new ATOM 0 HD22 ASN B 45 18.043 -3.738 5.654 1.00 55.34 H new ATOM 2663 N PRO B 46 20.660 -1.101 8.622 1.00 54.41 N ATOM 2664 CA PRO B 46 20.685 0.217 9.270 1.00 2.04 C ATOM 2665 C PRO B 46 19.276 0.672 9.665 1.00 14.41 C ATOM 2666 O PRO B 46 19.062 1.211 10.758 1.00 12.32 O ATOM 2667 CB PRO B 46 21.280 1.135 8.192 1.00 21.50 C ATOM 2668 CG PRO B 46 22.112 0.228 7.348 1.00 13.22 C ATOM 2669 CD PRO B 46 21.390 -1.096 7.336 1.00 31.44 C ATOM 0 HA PRO B 46 21.260 0.220 10.196 1.00 2.04 H new ATOM 0 HB2 PRO B 46 20.498 1.617 7.605 1.00 21.50 H new ATOM 0 HB3 PRO B 46 21.882 1.929 8.634 1.00 21.50 H new ATOM 0 HG2 PRO B 46 22.221 0.624 6.338 1.00 13.22 H new ATOM 0 HG3 PRO B 46 23.116 0.123 7.759 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.710 -1.175 6.488 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.086 -1.932 7.266 1.00 31.44 H new ATOM 2677 N GLU B 47 18.319 0.421 8.769 1.00 51.12 N ATOM 2678 CA GLU B 47 16.908 0.731 9.014 1.00 42.23 C ATOM 2679 C GLU B 47 16.456 0.040 10.298 1.00 51.31 C ATOM 2680 O GLU B 47 15.892 0.660 11.206 1.00 51.34 O ATOM 2681 CB GLU B 47 16.006 0.246 7.855 1.00 43.35 C ATOM 2682 CG GLU B 47 16.537 0.510 6.444 1.00 13.13 C ATOM 2683 CD GLU B 47 17.617 -0.478 6.019 1.00 41.12 C ATOM 2684 OE1 GLU B 47 18.791 -0.071 5.916 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.298 -1.673 5.821 1.00 73.03 O1- ATOM 0 H GLU B 47 18.498 -0.001 7.858 1.00 51.12 H new ATOM 0 HA GLU B 47 16.815 1.814 9.098 1.00 42.23 H new ATOM 0 HB2 GLU B 47 15.846 -0.826 7.968 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.032 0.726 7.952 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.710 0.462 5.736 1.00 13.13 H new ATOM 0 HG3 GLU B 47 16.939 1.522 6.397 1.00 13.13 H new ATOM 2692 N GLN B 48 16.738 -1.256 10.361 1.00 65.22 N ATOM 2693 CA GLN B 48 16.333 -2.095 11.475 1.00 23.21 C ATOM 2694 C GLN B 48 17.104 -1.725 12.735 1.00 44.13 C ATOM 2695 O GLN B 48 16.601 -1.878 13.849 1.00 15.51 O ATOM 2696 CB GLN B 48 16.555 -3.571 11.131 1.00 21.32 C ATOM 2697 CG GLN B 48 15.907 -4.534 12.110 1.00 64.34 C ATOM 2698 CD GLN B 48 14.419 -4.286 12.288 1.00 23.41 C ATOM 2699 OE1 GLN B 48 13.599 -4.860 11.585 1.00 3.40 O ATOM 2700 NE2 GLN B 48 14.060 -3.427 13.230 1.00 12.54 N ATOM 0 H GLN B 48 17.256 -1.753 9.637 1.00 65.22 H new ATOM 0 HA GLN B 48 15.272 -1.932 11.662 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.163 -3.764 10.133 1.00 21.32 H new ATOM 0 HB3 GLN B 48 17.626 -3.769 11.097 1.00 21.32 H new ATOM 0 HG2 GLN B 48 16.061 -5.556 11.762 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.402 -4.449 13.077 1.00 64.34 H new ATOM 0 HE21 GLN B 48 14.771 -2.966 13.798 1.00 12.54 H new ATOM 0 HE22 GLN B 48 13.072 -3.226 13.388 1.00 12.54 H new ATOM 2709 N LEU B 49 18.336 -1.260 12.548 1.00 25.52 N ATOM 2710 CA LEU B 49 19.190 -0.858 13.658 1.00 12.42 C ATOM 2711 C LEU B 49 18.554 0.327 14.381 1.00 73.15 C ATOM 2712 O LEU B 49 18.338 0.279 15.594 1.00 22.33 O ATOM 2713 CB LEU B 49 20.604 -0.516 13.140 1.00 25.41 C ATOM 2714 CG LEU B 49 21.735 -0.481 14.193 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.605 0.723 15.124 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.764 -1.783 14.996 1.00 31.54 C ATOM 0 H LEU B 49 18.767 -1.152 11.630 1.00 25.52 H new ATOM 0 HA LEU B 49 19.289 -1.679 14.368 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.873 -1.245 12.375 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.562 0.458 12.652 1.00 25.41 H new ATOM 0 HG LEU B 49 22.679 -0.380 13.657 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.418 0.711 15.849 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.653 1.642 14.539 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.651 0.676 15.648 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.567 -1.739 15.732 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.810 -1.917 15.507 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.935 -2.622 14.322 1.00 31.54 H new ATOM 2728 N PHE B 50 18.237 1.385 13.627 1.00 74.53 N ATOM 2729 CA PHE B 50 17.551 2.544 14.196 1.00 13.24 C ATOM 2730 C PHE B 50 16.218 2.122 14.801 1.00 54.12 C ATOM 2731 O PHE B 50 15.890 2.512 15.916 1.00 20.22 O ATOM 2732 CB PHE B 50 17.329 3.636 13.136 1.00 14.34 C ATOM 2733 CG PHE B 50 16.349 4.723 13.551 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.661 5.631 14.558 1.00 53.13 C ATOM 2735 CD2 PHE B 50 15.118 4.841 12.919 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.765 6.621 14.927 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.220 5.827 13.283 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.543 6.717 14.288 1.00 62.30 C ATOM 0 H PHE B 50 18.443 1.461 12.631 1.00 74.53 H new ATOM 0 HA PHE B 50 18.184 2.958 14.980 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.288 4.098 12.901 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.968 3.168 12.220 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.615 5.563 15.059 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.858 4.151 12.130 1.00 53.22 H new ATOM 0 HE1 PHE B 50 16.021 7.317 15.713 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.266 5.901 12.782 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.842 7.487 14.574 1.00 62.30 H new ATOM 2748 N ALA B 51 15.465 1.317 14.057 1.00 24.13 N ATOM 2749 CA ALA B 51 14.161 0.837 14.511 1.00 31.22 C ATOM 2750 C ALA B 51 14.254 0.163 15.880 1.00 63.22 C ATOM 2751 O ALA B 51 13.528 0.519 16.810 1.00 61.14 O ATOM 2752 CB ALA B 51 13.574 -0.128 13.492 1.00 4.33 C ATOM 0 H ALA B 51 15.736 0.981 13.133 1.00 24.13 H new ATOM 0 HA ALA B 51 13.505 1.702 14.609 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.603 -0.479 13.841 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.454 0.381 12.536 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.244 -0.979 13.368 1.00 4.33 H new ATOM 2758 N ALA B 52 15.163 -0.800 15.995 1.00 2.41 N ATOM 2759 CA ALA B 52 15.315 -1.576 17.220 1.00 55.02 C ATOM 2760 C ALA B 52 15.810 -0.694 18.359 1.00 53.11 C ATOM 2761 O ALA B 52 15.268 -0.726 19.465 1.00 74.31 O ATOM 2762 CB ALA B 52 16.267 -2.743 16.989 1.00 43.35 C ATOM 0 H ALA B 52 15.809 -1.062 15.250 1.00 2.41 H new ATOM 0 HA ALA B 52 14.340 -1.974 17.501 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.372 -3.315 17.911 1.00 43.35 H new ATOM 0 HB2 ALA B 52 15.869 -3.388 16.206 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.242 -2.362 16.685 1.00 43.35 H new ATOM 2768 N GLY B 53 16.836 0.107 18.072 1.00 41.34 N ATOM 2769 CA GLY B 53 17.386 1.006 19.071 1.00 4.13 C ATOM 2770 C GLY B 53 16.371 2.035 19.525 1.00 15.42 C ATOM 2771 O GLY B 53 16.345 2.424 20.691 1.00 73.22 O ATOM 0 H GLY B 53 17.296 0.148 17.162 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.727 0.429 19.930 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.259 1.514 18.661 1.00 4.13 H new ATOM 2775 N TYR B 54 15.527 2.464 18.592 1.00 15.35 N ATOM 2776 CA TYR B 54 14.459 3.416 18.874 1.00 21.24 C ATOM 2777 C TYR B 54 13.380 2.758 19.733 1.00 2.44 C ATOM 2778 O TYR B 54 12.869 3.367 20.669 1.00 55.40 O ATOM 2779 CB TYR B 54 13.867 3.949 17.556 1.00 22.10 C ATOM 2780 CG TYR B 54 12.638 4.838 17.704 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.400 5.566 18.867 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.710 4.938 16.673 1.00 20.22 C ATOM 2783 CE1 TYR B 54 11.279 6.357 18.998 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.591 5.734 16.796 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.381 6.438 17.961 1.00 15.31 C ATOM 2786 OH TYR B 54 9.263 7.224 18.098 1.00 73.14 O ATOM 0 H TYR B 54 15.564 2.161 17.619 1.00 15.35 H new ATOM 0 HA TYR B 54 14.868 4.259 19.431 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.640 4.511 17.031 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.606 3.100 16.925 1.00 22.10 H new ATOM 0 HD1 TYR B 54 13.107 5.510 19.681 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.869 4.383 15.760 1.00 20.22 H new ATOM 0 HE1 TYR B 54 11.107 6.910 19.910 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.883 5.805 15.983 1.00 11.21 H new ATOM 0 HH TYR B 54 8.460 6.668 18.018 1.00 73.14 H new ATOM 2796 N SER B 55 13.048 1.514 19.421 1.00 62.44 N ATOM 2797 CA SER B 55 12.066 0.772 20.204 1.00 11.44 C ATOM 2798 C SER B 55 12.563 0.607 21.641 1.00 45.34 C ATOM 2799 O SER B 55 11.847 0.908 22.595 1.00 23.33 O ATOM 2800 CB SER B 55 11.799 -0.590 19.561 1.00 71.55 C ATOM 2801 OG SER B 55 11.311 -0.438 18.240 1.00 22.42 O ATOM 0 H SER B 55 13.441 0.997 18.635 1.00 62.44 H new ATOM 0 HA SER B 55 11.129 1.329 20.224 1.00 11.44 H new ATOM 0 HB2 SER B 55 12.717 -1.177 19.548 1.00 71.55 H new ATOM 0 HB3 SER B 55 11.075 -1.143 20.159 1.00 71.55 H new ATOM 0 HG SER B 55 12.024 -0.086 17.667 1.00 22.42 H new ATOM 2807 N ALA B 56 13.806 0.161 21.780 1.00 72.32 N ATOM 2808 CA ALA B 56 14.430 0.005 23.089 1.00 72.14 C ATOM 2809 C ALA B 56 14.542 1.359 23.796 1.00 34.31 C ATOM 2810 O ALA B 56 14.329 1.465 25.006 1.00 51.54 O ATOM 2811 CB ALA B 56 15.797 -0.650 22.938 1.00 11.32 C ATOM 0 H ALA B 56 14.405 -0.101 20.997 1.00 72.32 H new ATOM 0 HA ALA B 56 13.805 -0.641 23.705 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.257 -0.763 23.920 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.682 -1.631 22.476 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.432 -0.026 22.310 1.00 11.32 H new ATOM 2817 N CYS B 57 14.866 2.394 23.022 1.00 24.02 N ATOM 2818 CA CYS B 57 14.916 3.763 23.531 1.00 54.22 C ATOM 2819 C CYS B 57 13.538 4.185 24.024 1.00 22.14 C ATOM 2820 O CYS B 57 13.410 4.886 25.025 1.00 1.03 O ATOM 2821 CB CYS B 57 15.400 4.730 22.439 1.00 72.40 C ATOM 2822 SG CYS B 57 15.391 6.475 22.918 1.00 42.35 S ATOM 0 H CYS B 57 15.099 2.308 22.033 1.00 24.02 H new ATOM 0 HA CYS B 57 15.621 3.797 24.362 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.413 4.452 22.149 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.771 4.606 21.558 1.00 72.40 H new ATOM 0 HG CYS B 57 14.583 6.645 23.922 1.00 42.35 H new ATOM 2828 N PHE B 58 12.508 3.729 23.318 1.00 34.03 N ATOM 2829 CA PHE B 58 11.131 4.080 23.630 1.00 42.11 C ATOM 2830 C PHE B 58 10.758 3.564 25.019 1.00 1.15 C ATOM 2831 O PHE B 58 10.076 4.247 25.786 1.00 52.32 O ATOM 2832 CB PHE B 58 10.191 3.500 22.564 1.00 13.13 C ATOM 2833 CG PHE B 58 8.841 4.164 22.508 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.729 3.579 23.099 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.688 5.382 21.859 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.494 4.194 23.039 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.458 6.000 21.799 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.358 5.406 22.389 1.00 52.03 C ATOM 0 H PHE B 58 12.606 3.107 22.515 1.00 34.03 H new ATOM 0 HA PHE B 58 11.029 5.165 23.630 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.668 3.588 21.588 1.00 13.13 H new ATOM 0 HB3 PHE B 58 10.053 2.436 22.757 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.831 2.633 23.611 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.544 5.851 21.396 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.635 3.728 23.500 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.353 6.948 21.292 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.393 5.889 22.342 1.00 52.03 H new ATOM 2848 N LEU B 59 11.222 2.356 25.339 1.00 60.43 N ATOM 2849 CA LEU B 59 11.012 1.775 26.663 1.00 11.12 C ATOM 2850 C LEU B 59 11.732 2.600 27.728 1.00 60.54 C ATOM 2851 O LEU B 59 11.186 2.841 28.802 1.00 64.41 O ATOM 2852 CB LEU B 59 11.490 0.308 26.713 1.00 33.41 C ATOM 2853 CG LEU B 59 10.505 -0.740 26.156 1.00 23.42 C ATOM 2854 CD1 LEU B 59 9.174 -0.678 26.900 1.00 12.45 C ATOM 2855 CD2 LEU B 59 10.293 -0.562 24.655 1.00 24.24 C ATOM 0 H LEU B 59 11.746 1.761 24.698 1.00 60.43 H new ATOM 0 HA LEU B 59 9.941 1.790 26.867 1.00 11.12 H new ATOM 0 HB2 LEU B 59 12.425 0.231 26.157 1.00 33.41 H new ATOM 0 HB3 LEU B 59 11.713 0.054 27.749 1.00 33.41 H new ATOM 0 HG LEU B 59 10.944 -1.725 26.315 1.00 23.42 H new ATOM 0 HD11 LEU B 59 8.494 -1.425 26.492 1.00 12.45 H new ATOM 0 HD12 LEU B 59 9.339 -0.878 27.959 1.00 12.45 H new ATOM 0 HD13 LEU B 59 8.737 0.314 26.782 1.00 12.45 H new ATOM 0 HD21 LEU B 59 9.594 -1.316 24.294 1.00 24.24 H new ATOM 0 HD22 LEU B 59 9.888 0.431 24.460 1.00 24.24 H new ATOM 0 HD23 LEU B 59 11.246 -0.673 24.137 1.00 24.24 H new ATOM 2867 N SER B 60 12.950 3.040 27.416 1.00 44.21 N ATOM 2868 CA SER B 60 13.751 3.830 28.350 1.00 2.40 C ATOM 2869 C SER B 60 13.107 5.206 28.576 1.00 73.23 C ATOM 2870 O SER B 60 13.025 5.699 29.710 1.00 65.55 O ATOM 2871 CB SER B 60 15.185 3.978 27.819 1.00 63.24 C ATOM 2872 OG SER B 60 16.041 4.546 28.794 1.00 24.13 O ATOM 0 H SER B 60 13.405 2.862 26.521 1.00 44.21 H new ATOM 0 HA SER B 60 13.790 3.313 29.309 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.567 3.001 27.522 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.181 4.604 26.927 1.00 63.24 H new ATOM 0 HG SER B 60 16.946 4.626 28.428 1.00 24.13 H new ATOM 2878 N ALA B 61 12.630 5.814 27.492 1.00 21.42 N ATOM 2879 CA ALA B 61 11.942 7.096 27.566 1.00 31.00 C ATOM 2880 C ALA B 61 10.695 6.969 28.430 1.00 42.41 C ATOM 2881 O ALA B 61 10.486 7.760 29.345 1.00 44.10 O ATOM 2882 CB ALA B 61 11.585 7.593 26.169 1.00 4.34 C ATOM 0 H ALA B 61 12.709 5.435 26.548 1.00 21.42 H new ATOM 0 HA ALA B 61 12.608 7.827 28.024 1.00 31.00 H new ATOM 0 HB1 ALA B 61 11.072 8.552 26.244 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.496 7.714 25.582 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.932 6.869 25.681 1.00 4.34 H new ATOM 2888 N MET B 62 9.887 5.947 28.151 1.00 64.12 N ATOM 2889 CA MET B 62 8.681 5.682 28.934 1.00 62.41 C ATOM 2890 C MET B 62 9.045 5.260 30.354 1.00 51.11 C ATOM 2891 O MET B 62 8.271 5.463 31.289 1.00 53.32 O ATOM 2892 CB MET B 62 7.821 4.602 28.262 1.00 4.11 C ATOM 2893 CG MET B 62 7.080 5.091 27.022 1.00 71.00 C ATOM 2894 SD MET B 62 5.946 6.451 27.382 1.00 51.43 S ATOM 2895 CE MET B 62 4.860 5.694 28.594 1.00 33.40 C ATOM 0 H MET B 62 10.046 5.289 27.388 1.00 64.12 H new ATOM 0 HA MET B 62 8.100 6.603 28.983 1.00 62.41 H new ATOM 0 HB2 MET B 62 8.459 3.762 27.986 1.00 4.11 H new ATOM 0 HB3 MET B 62 7.095 4.227 28.984 1.00 4.11 H new ATOM 0 HG2 MET B 62 7.804 5.415 26.275 1.00 71.00 H new ATOM 0 HG3 MET B 62 6.521 4.262 26.587 1.00 71.00 H new ATOM 0 HE1 MET B 62 3.920 6.244 28.634 1.00 33.40 H new ATOM 0 HE2 MET B 62 4.663 4.660 28.311 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.336 5.718 29.574 1.00 33.40 H new ATOM 2905 N LYS B 63 10.229 4.674 30.500 1.00 72.03 N ATOM 2906 CA LYS B 63 10.757 4.296 31.807 1.00 43.00 C ATOM 2907 C LYS B 63 10.893 5.549 32.670 1.00 70.35 C ATOM 2908 O LYS B 63 10.440 5.589 33.815 1.00 23.43 O ATOM 2909 CB LYS B 63 12.126 3.620 31.633 1.00 31.31 C ATOM 2910 CG LYS B 63 12.638 2.855 32.849 1.00 20.13 C ATOM 2911 CD LYS B 63 11.844 1.572 33.087 1.00 10.22 C ATOM 2912 CE LYS B 63 12.586 0.619 34.015 1.00 1.23 C ATOM 2913 NZ LYS B 63 13.890 0.193 33.437 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.847 4.449 29.720 1.00 72.03 H new ATOM 0 HA LYS B 63 10.079 3.595 32.294 1.00 43.00 H new ATOM 0 HB2 LYS B 63 12.068 2.931 30.790 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.858 4.383 31.371 1.00 31.31 H new ATOM 0 HG2 LYS B 63 13.691 2.610 32.708 1.00 20.13 H new ATOM 0 HG3 LYS B 63 12.574 3.491 33.732 1.00 20.13 H new ATOM 0 HD2 LYS B 63 10.873 1.818 33.518 1.00 10.22 H new ATOM 0 HD3 LYS B 63 11.654 1.079 32.134 1.00 10.22 H new ATOM 0 HE2 LYS B 63 12.755 1.105 34.976 1.00 1.23 H new ATOM 0 HE3 LYS B 63 11.968 -0.259 34.206 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 14.214 -0.673 33.912 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 13.775 0.008 32.420 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 14.593 0.947 33.574 1.00 55.13 H new ATOM 2927 N PHE B 64 11.510 6.576 32.090 1.00 21.33 N ATOM 2928 CA PHE B 64 11.667 7.867 32.756 1.00 32.24 C ATOM 2929 C PHE B 64 10.318 8.582 32.882 1.00 14.21 C ATOM 2930 O PHE B 64 9.993 9.135 33.935 1.00 73.11 O ATOM 2931 CB PHE B 64 12.664 8.743 31.981 1.00 30.41 C ATOM 2932 CG PHE B 64 12.867 10.115 32.581 1.00 63.34 C ATOM 2933 CD1 PHE B 64 13.339 10.259 33.880 1.00 43.42 C ATOM 2934 CD2 PHE B 64 12.577 11.258 31.849 1.00 31.33 C ATOM 2935 CE1 PHE B 64 13.516 11.514 34.433 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.755 12.514 32.397 1.00 33.41 C ATOM 2937 CZ PHE B 64 13.223 12.641 33.690 1.00 14.04 C ATOM 0 H PHE B 64 11.912 6.538 31.153 1.00 21.33 H new ATOM 0 HA PHE B 64 12.055 7.692 33.759 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.625 8.231 31.937 1.00 30.41 H new ATOM 0 HB3 PHE B 64 12.314 8.854 30.955 1.00 30.41 H new ATOM 0 HD1 PHE B 64 13.570 9.381 34.464 1.00 43.42 H new ATOM 0 HD2 PHE B 64 12.208 11.165 30.838 1.00 31.33 H new ATOM 0 HE1 PHE B 64 13.883 11.613 35.444 1.00 55.11 H new ATOM 0 HE2 PHE B 64 12.528 13.395 31.815 1.00 33.41 H new ATOM 0 HZ PHE B 64 13.360 13.622 34.121 1.00 14.04 H new ATOM 2947 N VAL B 65 9.538 8.554 31.803 1.00 75.05 N ATOM 2948 CA VAL B 65 8.234 9.216 31.762 1.00 40.30 C ATOM 2949 C VAL B 65 7.331 8.717 32.886 1.00 43.44 C ATOM 2950 O VAL B 65 6.692 9.509 33.583 1.00 35.52 O ATOM 2951 CB VAL B 65 7.530 9.009 30.393 1.00 54.45 C ATOM 2952 CG1 VAL B 65 6.056 9.405 30.464 1.00 70.43 C ATOM 2953 CG2 VAL B 65 8.242 9.803 29.295 1.00 51.21 C ATOM 0 H VAL B 65 9.789 8.076 30.938 1.00 75.05 H new ATOM 0 HA VAL B 65 8.414 10.282 31.898 1.00 40.30 H new ATOM 0 HB VAL B 65 7.584 7.948 30.148 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.590 9.249 29.491 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.550 8.793 31.211 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.975 10.456 30.741 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.734 9.645 28.344 1.00 51.21 H new ATOM 0 HG22 VAL B 65 8.224 10.864 29.544 1.00 51.21 H new ATOM 0 HG23 VAL B 65 9.276 9.466 29.215 1.00 51.21 H new ATOM 2963 N ALA B 66 7.295 7.406 33.073 1.00 30.22 N ATOM 2964 CA ALA B 66 6.486 6.808 34.127 1.00 74.13 C ATOM 2965 C ALA B 66 6.914 7.345 35.490 1.00 44.35 C ATOM 2966 O ALA B 66 6.091 7.538 36.389 1.00 34.23 O ATOM 2967 CB ALA B 66 6.598 5.288 34.083 1.00 23.44 C ATOM 0 H ALA B 66 7.816 6.735 32.509 1.00 30.22 H new ATOM 0 HA ALA B 66 5.442 7.077 33.965 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.988 4.855 34.876 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.247 4.925 33.117 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.638 4.996 34.225 1.00 23.44 H new ATOM 2973 N GLY B 67 8.206 7.641 35.606 1.00 23.35 N ATOM 2974 CA GLY B 67 8.773 8.093 36.863 1.00 73.24 C ATOM 2975 C GLY B 67 8.364 9.511 37.211 1.00 45.13 C ATOM 2976 O GLY B 67 8.342 9.886 38.384 1.00 75.04 O ATOM 0 H GLY B 67 8.877 7.574 34.841 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.458 7.422 37.662 1.00 73.24 H new ATOM 0 HA3 GLY B 67 9.860 8.035 36.809 1.00 73.24 H new ATOM 2980 N GLN B 68 8.031 10.302 36.192 1.00 2.12 N ATOM 2981 CA GLN B 68 7.622 11.690 36.399 1.00 44.13 C ATOM 2982 C GLN B 68 6.101 11.790 36.370 1.00 40.32 C ATOM 2983 O GLN B 68 5.516 12.725 36.915 1.00 64.50 O ATOM 2984 CB GLN B 68 8.238 12.605 35.330 1.00 33.05 C ATOM 2985 CG GLN B 68 7.906 12.189 33.902 1.00 52.44 C ATOM 2986 CD GLN B 68 8.260 13.246 32.870 1.00 54.32 C ATOM 2987 OE1 GLN B 68 9.357 13.252 32.314 1.00 53.51 O ATOM 2988 NE2 GLN B 68 7.328 14.146 32.612 1.00 53.21 N ATOM 0 H GLN B 68 8.036 10.006 35.216 1.00 2.12 H new ATOM 0 HA GLN B 68 7.983 12.018 37.374 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.889 13.625 35.492 1.00 33.05 H new ATOM 0 HB3 GLN B 68 9.321 12.615 35.454 1.00 33.05 H new ATOM 0 HG2 GLN B 68 8.439 11.268 33.666 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.841 11.967 33.834 1.00 52.44 H new ATOM 0 HE21 GLN B 68 6.431 14.105 33.096 1.00 53.21 H new ATOM 0 HE22 GLN B 68 7.505 14.882 31.929 1.00 53.21 H new ATOM 2997 N ASN B 69 5.469 10.797 35.750 1.00 21.43 N ATOM 2998 CA ASN B 69 4.014 10.764 35.606 1.00 41.54 C ATOM 2999 C ASN B 69 3.369 9.972 36.733 1.00 23.00 C ATOM 3000 O ASN B 69 2.147 9.821 36.776 1.00 34.41 O ATOM 3001 CB ASN B 69 3.619 10.194 34.236 1.00 65.13 C ATOM 3002 CG ASN B 69 3.660 11.244 33.134 1.00 21.52 C ATOM 3003 OD1 ASN B 69 4.824 11.440 32.537 1.00 65.21 O flip ATOM 3004 ND2 ASN B 69 2.652 11.884 32.831 1.00 45.52 N flip ATOM 0 H ASN B 69 5.946 9.997 35.335 1.00 21.43 H new ATOM 0 HA ASN B 69 3.645 11.788 35.668 1.00 41.54 H new ATOM 0 HB2 ASN B 69 4.292 9.376 33.979 1.00 65.13 H new ATOM 0 HB3 ASN B 69 2.615 9.774 34.296 1.00 65.13 H new ATOM 0 HD21 ASN B 69 1.771 11.706 33.313 1.00 45.52 H new ATOM 0 HD22 ASN B 69 2.699 12.592 32.098 1.00 45.52 H new ATOM 3011 N LYS B 70 4.207 9.477 37.642 1.00 4.22 N ATOM 3012 CA LYS B 70 3.754 8.834 38.876 1.00 71.04 C ATOM 3013 C LYS B 70 3.000 7.535 38.577 1.00 55.13 C ATOM 3014 O LYS B 70 2.198 7.060 39.388 1.00 71.33 O ATOM 3015 CB LYS B 70 2.866 9.787 39.707 1.00 43.15 C ATOM 3016 CG LYS B 70 3.382 11.229 39.819 1.00 61.50 C ATOM 3017 CD LYS B 70 4.908 11.311 39.867 1.00 21.25 C ATOM 3018 CE LYS B 70 5.390 12.700 40.273 1.00 20.34 C ATOM 3019 NZ LYS B 70 4.863 13.761 39.373 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.222 9.510 37.544 1.00 4.22 H new ATOM 0 HA LYS B 70 4.640 8.591 39.462 1.00 71.04 H new ATOM 0 HB2 LYS B 70 1.870 9.808 39.265 1.00 43.15 H new ATOM 0 HB3 LYS B 70 2.761 9.377 40.711 1.00 43.15 H new ATOM 0 HG2 LYS B 70 3.018 11.807 38.969 1.00 61.50 H new ATOM 0 HG3 LYS B 70 2.970 11.689 40.717 1.00 61.50 H new ATOM 0 HD2 LYS B 70 5.289 10.574 40.573 1.00 21.25 H new ATOM 0 HD3 LYS B 70 5.316 11.056 38.889 1.00 21.25 H new ATOM 0 HE2 LYS B 70 5.079 12.906 41.297 1.00 20.34 H new ATOM 0 HE3 LYS B 70 6.480 12.723 40.261 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 5.332 14.664 39.588 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 5.050 13.501 38.383 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 3.838 13.861 39.517 1.00 73.12 H new ATOM 3033 N GLN B 71 3.292 6.956 37.421 1.00 41.03 N ATOM 3034 CA GLN B 71 2.654 5.719 36.983 1.00 14.44 C ATOM 3035 C GLN B 71 3.679 4.587 36.914 1.00 73.31 C ATOM 3036 O GLN B 71 4.886 4.827 36.971 1.00 34.15 O ATOM 3037 CB GLN B 71 1.980 5.915 35.617 1.00 1.40 C ATOM 3038 CG GLN B 71 2.873 6.609 34.596 1.00 33.32 C ATOM 3039 CD GLN B 71 2.551 6.233 33.165 1.00 34.04 C ATOM 3040 OE1 GLN B 71 3.258 5.239 32.672 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 1.706 6.844 32.511 1.00 0.43 N flip ATOM 0 H GLN B 71 3.975 7.328 36.761 1.00 41.03 H new ATOM 0 HA GLN B 71 1.888 5.450 37.710 1.00 14.44 H new ATOM 0 HB2 GLN B 71 1.680 4.943 35.225 1.00 1.40 H new ATOM 0 HB3 GLN B 71 1.070 6.500 35.750 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.775 7.688 34.712 1.00 33.32 H new ATOM 0 HG3 GLN B 71 3.913 6.360 34.805 1.00 33.32 H new ATOM 0 HE21 GLN B 71 1.184 7.608 32.940 1.00 0.43 H new ATOM 0 HE22 GLN B 71 1.528 6.586 31.540 1.00 0.43 H new ATOM 3050 N THR B 72 3.190 3.360 36.775 1.00 1.35 N ATOM 3051 CA THR B 72 4.043 2.174 36.765 1.00 51.41 C ATOM 3052 C THR B 72 3.755 1.305 35.543 1.00 74.12 C ATOM 3053 O THR B 72 2.595 1.017 35.235 1.00 25.05 O ATOM 3054 CB THR B 72 3.844 1.334 38.048 1.00 13.02 C ATOM 3055 OG1 THR B 72 2.441 1.126 38.289 1.00 4.22 O ATOM 3056 CG2 THR B 72 4.479 2.014 39.256 1.00 71.50 C ATOM 0 H THR B 72 2.196 3.158 36.666 1.00 1.35 H new ATOM 0 HA THR B 72 5.076 2.519 36.723 1.00 51.41 H new ATOM 0 HB THR B 72 4.334 0.372 37.900 1.00 13.02 H new ATOM 0 HG1 THR B 72 1.954 1.161 37.439 1.00 4.22 H new ATOM 0 HG21 THR B 72 4.323 1.400 40.143 1.00 71.50 H new ATOM 0 HG22 THR B 72 5.548 2.137 39.084 1.00 71.50 H new ATOM 0 HG23 THR B 72 4.021 2.991 39.406 1.00 71.50 H new ATOM 3064 N LEU B 73 4.813 0.892 34.854 1.00 74.12 N ATOM 3065 CA LEU B 73 4.690 0.097 33.633 1.00 52.35 C ATOM 3066 C LEU B 73 5.158 -1.343 33.870 1.00 64.24 C ATOM 3067 O LEU B 73 6.149 -1.574 34.569 1.00 14.14 O ATOM 3068 CB LEU B 73 5.505 0.748 32.505 1.00 75.15 C ATOM 3069 CG LEU B 73 5.063 2.170 32.122 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.037 2.792 31.122 1.00 33.12 C ATOM 3071 CD2 LEU B 73 3.642 2.160 31.560 1.00 51.14 C ATOM 0 H LEU B 73 5.776 1.096 35.122 1.00 74.12 H new ATOM 0 HA LEU B 73 3.640 0.065 33.341 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.553 0.778 32.804 1.00 75.15 H new ATOM 0 HB3 LEU B 73 5.444 0.114 31.620 1.00 75.15 H new ATOM 0 HG LEU B 73 5.069 2.782 33.024 1.00 62.34 H new ATOM 0 HD11 LEU B 73 5.703 3.798 30.866 1.00 33.12 H new ATOM 0 HD12 LEU B 73 7.031 2.842 31.565 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.072 2.181 30.220 1.00 33.12 H new ATOM 0 HD21 LEU B 73 3.348 3.176 31.295 1.00 51.14 H new ATOM 0 HD22 LEU B 73 3.606 1.529 30.672 1.00 51.14 H new ATOM 0 HD23 LEU B 73 2.956 1.768 32.311 1.00 51.14 H new ATOM 3083 N PRO B 74 4.440 -2.334 33.302 1.00 22.31 N ATOM 3084 CA PRO B 74 4.823 -3.751 33.388 1.00 33.15 C ATOM 3085 C PRO B 74 6.109 -4.038 32.614 1.00 51.21 C ATOM 3086 O PRO B 74 6.241 -3.643 31.459 1.00 62.01 O ATOM 3087 CB PRO B 74 3.639 -4.495 32.744 1.00 23.12 C ATOM 3088 CG PRO B 74 2.530 -3.498 32.682 1.00 12.13 C ATOM 3089 CD PRO B 74 3.192 -2.157 32.544 1.00 51.43 C ATOM 0 HA PRO B 74 5.019 -4.057 34.416 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.897 -4.858 31.749 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.353 -5.365 33.336 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.872 -3.698 31.837 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.916 -3.540 33.581 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.384 -1.905 31.501 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.577 -1.357 32.957 1.00 51.43 H new ATOM 3097 N ALA B 75 7.040 -4.753 33.242 1.00 24.41 N ATOM 3098 CA ALA B 75 8.341 -5.035 32.630 1.00 71.53 C ATOM 3099 C ALA B 75 8.251 -6.136 31.568 1.00 71.01 C ATOM 3100 O ALA B 75 9.244 -6.471 30.928 1.00 12.42 O ATOM 3101 CB ALA B 75 9.356 -5.411 33.705 1.00 50.55 C ATOM 0 H ALA B 75 6.920 -5.149 34.174 1.00 24.41 H new ATOM 0 HA ALA B 75 8.672 -4.127 32.125 1.00 71.53 H new ATOM 0 HB1 ALA B 75 10.319 -5.619 33.239 1.00 50.55 H new ATOM 0 HB2 ALA B 75 9.464 -4.585 34.409 1.00 50.55 H new ATOM 0 HB3 ALA B 75 9.011 -6.298 34.236 1.00 50.55 H new ATOM 3107 N ASP B 76 7.056 -6.688 31.377 1.00 24.20 N ATOM 3108 CA ASP B 76 6.847 -7.774 30.412 1.00 60.22 C ATOM 3109 C ASP B 76 6.436 -7.220 29.043 1.00 14.12 C ATOM 3110 O ASP B 76 6.157 -7.969 28.106 1.00 34.13 O ATOM 3111 CB ASP B 76 5.781 -8.746 30.947 1.00 21.51 C ATOM 3112 CG ASP B 76 5.536 -9.942 30.032 1.00 33.51 C ATOM 3113 OD1 ASP B 76 6.428 -10.815 29.923 1.00 23.44 O ATOM 3114 OD2 ASP B 76 4.446 -10.023 29.427 1.00 41.11 O1- ATOM 0 H ASP B 76 6.213 -6.404 31.877 1.00 24.20 H new ATOM 0 HA ASP B 76 7.786 -8.313 30.283 1.00 60.22 H new ATOM 0 HB2 ASP B 76 6.089 -9.106 31.929 1.00 21.51 H new ATOM 0 HB3 ASP B 76 4.844 -8.206 31.085 1.00 21.51 H new ATOM 3119 N THR B 77 6.417 -5.899 28.928 1.00 44.41 N ATOM 3120 CA THR B 77 5.990 -5.240 27.699 1.00 1.21 C ATOM 3121 C THR B 77 7.039 -5.385 26.593 1.00 31.44 C ATOM 3122 O THR B 77 8.237 -5.531 26.866 1.00 72.52 O ATOM 3123 CB THR B 77 5.693 -3.741 27.943 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.352 -3.076 26.718 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.884 -3.038 28.584 1.00 30.02 C ATOM 0 H THR B 77 6.693 -5.260 29.673 1.00 44.41 H new ATOM 0 HA THR B 77 5.073 -5.732 27.375 1.00 1.21 H new ATOM 0 HB THR B 77 4.844 -3.690 28.625 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.789 -3.664 26.172 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.644 -1.987 28.742 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.111 -3.507 29.542 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.750 -3.117 27.927 1.00 30.02 H new ATOM 3133 N THR B 78 6.575 -5.352 25.348 1.00 70.31 N ATOM 3134 CA THR B 78 7.444 -5.445 24.182 1.00 64.53 C ATOM 3135 C THR B 78 6.984 -4.493 23.084 1.00 71.23 C ATOM 3136 O THR B 78 5.808 -4.129 23.008 1.00 64.44 O ATOM 3137 CB THR B 78 7.488 -6.886 23.615 1.00 53.44 C ATOM 3138 OG1 THR B 78 6.184 -7.481 23.677 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.492 -7.748 24.368 1.00 23.30 C ATOM 0 H THR B 78 5.585 -5.260 25.120 1.00 70.31 H new ATOM 0 HA THR B 78 8.445 -5.167 24.511 1.00 64.53 H new ATOM 0 HB THR B 78 7.808 -6.828 22.575 1.00 53.44 H new ATOM 0 HG1 THR B 78 6.222 -8.391 23.315 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.498 -8.753 23.945 1.00 23.30 H new ATOM 0 HG22 THR B 78 9.486 -7.311 24.279 1.00 23.30 H new ATOM 0 HG23 THR B 78 8.211 -7.799 25.420 1.00 23.30 H new ATOM 3147 N VAL B 79 7.925 -4.092 22.244 1.00 22.45 N ATOM 3148 CA VAL B 79 7.646 -3.260 21.083 1.00 23.02 C ATOM 3149 C VAL B 79 8.309 -3.867 19.858 1.00 31.21 C ATOM 3150 O VAL B 79 9.527 -4.033 19.814 1.00 14.34 O ATOM 3151 CB VAL B 79 8.139 -1.801 21.273 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.990 -0.995 19.978 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.373 -1.129 22.406 1.00 54.24 C ATOM 0 H VAL B 79 8.910 -4.336 22.349 1.00 22.45 H new ATOM 0 HA VAL B 79 6.564 -3.225 20.953 1.00 23.02 H new ATOM 0 HB VAL B 79 9.198 -1.832 21.531 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.343 0.023 20.141 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.580 -1.462 19.189 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.941 -0.972 19.682 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.729 -0.106 22.529 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.309 -1.117 22.169 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.533 -1.682 23.331 1.00 54.24 H new ATOM 3163 N THR B 80 7.499 -4.220 18.879 1.00 72.42 N ATOM 3164 CA THR B 80 7.993 -4.843 17.665 1.00 23.21 C ATOM 3165 C THR B 80 8.129 -3.803 16.555 1.00 63.22 C ATOM 3166 O THR B 80 7.130 -3.289 16.047 1.00 42.43 O ATOM 3167 CB THR B 80 7.056 -5.981 17.201 1.00 22.40 C ATOM 3168 OG1 THR B 80 6.639 -6.763 18.332 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.764 -6.884 16.196 1.00 64.25 C ATOM 0 H THR B 80 6.488 -4.085 18.901 1.00 72.42 H new ATOM 0 HA THR B 80 8.972 -5.270 17.883 1.00 23.21 H new ATOM 0 HB THR B 80 6.184 -5.534 16.722 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.781 -7.714 18.142 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.088 -7.679 15.882 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.063 -6.297 15.327 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.648 -7.322 16.660 1.00 64.25 H new ATOM 3177 N ALA B 81 9.367 -3.483 16.202 1.00 41.34 N ATOM 3178 CA ALA B 81 9.644 -2.525 15.140 1.00 73.43 C ATOM 3179 C ALA B 81 9.827 -3.252 13.813 1.00 13.31 C ATOM 3180 O ALA B 81 10.861 -3.886 13.580 1.00 32.14 O ATOM 3181 CB ALA B 81 10.886 -1.703 15.476 1.00 31.52 C ATOM 0 H ALA B 81 10.201 -3.876 16.639 1.00 41.34 H new ATOM 0 HA ALA B 81 8.797 -1.845 15.051 1.00 73.43 H new ATOM 0 HB1 ALA B 81 11.080 -0.992 14.673 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.723 -1.162 16.408 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.743 -2.367 15.587 1.00 31.52 H new ATOM 3187 N GLU B 82 8.813 -3.171 12.960 1.00 50.12 N ATOM 3188 CA GLU B 82 8.853 -3.805 11.649 1.00 53.10 C ATOM 3189 C GLU B 82 9.016 -2.731 10.577 1.00 51.21 C ATOM 3190 O GLU B 82 8.088 -1.970 10.299 1.00 13.21 O ATOM 3191 CB GLU B 82 7.565 -4.615 11.421 1.00 51.24 C ATOM 3192 CG GLU B 82 7.583 -5.481 10.166 1.00 31.41 C ATOM 3193 CD GLU B 82 6.344 -6.357 10.041 1.00 63.34 C ATOM 3194 OE1 GLU B 82 6.152 -7.252 10.896 1.00 35.34 O ATOM 3195 OE2 GLU B 82 5.559 -6.166 9.088 1.00 71.23 O1- ATOM 0 H GLU B 82 7.947 -2.668 13.155 1.00 50.12 H new ATOM 0 HA GLU B 82 9.700 -4.489 11.594 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.393 -5.254 12.287 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.722 -3.926 11.361 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.660 -4.840 9.288 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.471 -6.113 10.178 1.00 31.41 H new ATOM 3202 N VAL B 83 10.204 -2.663 9.985 1.00 40.31 N ATOM 3203 CA VAL B 83 10.535 -1.601 9.039 1.00 71.44 C ATOM 3204 C VAL B 83 10.595 -2.128 7.616 1.00 35.11 C ATOM 3205 O VAL B 83 11.070 -3.235 7.370 1.00 1.44 O ATOM 3206 CB VAL B 83 11.881 -0.919 9.388 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.766 -0.162 10.706 1.00 71.22 C ATOM 3208 CG2 VAL B 83 13.019 -1.941 9.444 1.00 51.35 C ATOM 0 H VAL B 83 10.957 -3.333 10.144 1.00 40.31 H new ATOM 0 HA VAL B 83 9.739 -0.861 9.114 1.00 71.44 H new ATOM 0 HB VAL B 83 12.116 -0.205 8.599 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.720 0.312 10.938 1.00 71.22 H new ATOM 0 HG12 VAL B 83 10.993 0.601 10.621 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.503 -0.857 11.503 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.952 -1.434 9.691 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.800 -2.689 10.206 1.00 51.35 H new ATOM 0 HG23 VAL B 83 13.117 -2.430 8.475 1.00 51.35 H new ATOM 3218 N GLY B 84 10.112 -1.321 6.684 1.00 51.11 N ATOM 3219 CA GLY B 84 10.116 -1.689 5.291 1.00 52.45 C ATOM 3220 C GLY B 84 10.507 -0.530 4.413 1.00 30.33 C ATOM 3221 O GLY B 84 10.517 0.619 4.854 1.00 4.21 O ATOM 0 H GLY B 84 9.712 -0.403 6.877 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.810 -2.515 5.134 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.126 -2.045 5.005 1.00 52.45 H new ATOM 3225 N ILE B 85 10.828 -0.834 3.172 1.00 72.33 N ATOM 3226 CA ILE B 85 11.230 0.172 2.199 1.00 70.35 C ATOM 3227 C ILE B 85 10.747 -0.241 0.815 1.00 24.30 C ATOM 3228 O ILE B 85 10.856 -1.413 0.444 1.00 65.43 O ATOM 3229 CB ILE B 85 12.772 0.359 2.208 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.245 1.395 1.159 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.456 -0.985 1.995 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.503 0.823 -0.226 1.00 22.31 C ATOM 0 H ILE B 85 10.819 -1.786 2.805 1.00 72.33 H new ATOM 0 HA ILE B 85 10.777 1.127 2.465 1.00 70.35 H new ATOM 0 HB ILE B 85 13.054 0.755 3.184 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.493 2.180 1.079 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.160 1.865 1.519 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.537 -0.848 2.002 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.171 -1.669 2.795 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.149 -1.401 1.035 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.830 1.620 -0.894 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.278 0.059 -0.166 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.586 0.379 -0.613 1.00 22.31 H new ATOM 3244 N GLY B 86 10.205 0.718 0.074 1.00 43.24 N ATOM 3245 CA GLY B 86 9.675 0.450 -1.256 1.00 50.02 C ATOM 3246 C GLY B 86 9.822 1.645 -2.176 1.00 52.30 C ATOM 3247 O GLY B 86 10.174 2.731 -1.713 1.00 42.02 O ATOM 0 H GLY B 86 10.121 1.690 0.373 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.194 -0.406 -1.688 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.622 0.179 -1.179 1.00 50.02 H new ATOM 3251 N PRO B 87 9.566 1.485 -3.489 1.00 42.21 N ATOM 3252 CA PRO B 87 9.713 2.568 -4.456 1.00 30.25 C ATOM 3253 C PRO B 87 8.639 3.624 -4.250 1.00 61.30 C ATOM 3254 O PRO B 87 7.440 3.342 -4.365 1.00 52.32 O ATOM 3255 CB PRO B 87 9.554 1.885 -5.830 1.00 44.10 C ATOM 3256 CG PRO B 87 9.543 0.417 -5.548 1.00 14.42 C ATOM 3257 CD PRO B 87 9.057 0.270 -4.133 1.00 45.13 C ATOM 0 HA PRO B 87 10.669 3.083 -4.359 1.00 30.25 H new ATOM 0 HB2 PRO B 87 8.631 2.197 -6.319 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.374 2.150 -6.497 1.00 44.10 H new ATOM 0 HG2 PRO B 87 8.887 -0.109 -6.242 1.00 14.42 H new ATOM 0 HG3 PRO B 87 10.539 -0.010 -5.665 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.970 0.210 -4.083 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.448 -0.632 -3.662 1.00 45.13 H new ATOM 3265 N ASN B 88 9.070 4.825 -3.915 1.00 53.24 N ATOM 3266 CA ASN B 88 8.156 5.933 -3.713 1.00 21.43 C ATOM 3267 C ASN B 88 7.607 6.376 -5.060 1.00 21.10 C ATOM 3268 O ASN B 88 8.352 6.456 -6.043 1.00 51.23 O ATOM 3269 CB ASN B 88 8.875 7.097 -3.010 1.00 72.30 C ATOM 3270 CG ASN B 88 7.926 8.189 -2.531 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.857 8.398 -3.100 1.00 5.32 O ATOM 3272 ND2 ASN B 88 8.325 8.902 -1.492 1.00 3.11 N ATOM 0 H ASN B 88 10.053 5.059 -3.776 1.00 53.24 H new ATOM 0 HA ASN B 88 7.331 5.615 -3.076 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.432 6.709 -2.157 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.603 7.532 -3.695 1.00 72.30 H new ATOM 0 HD21 ASN B 88 7.738 9.656 -1.136 1.00 3.11 H new ATOM 0 HD22 ASN B 88 9.220 8.698 -1.047 1.00 3.11 H new ATOM 3279 N GLU B 89 6.312 6.653 -5.105 1.00 65.22 N ATOM 3280 CA GLU B 89 5.655 7.093 -6.334 1.00 51.32 C ATOM 3281 C GLU B 89 6.189 8.460 -6.773 1.00 22.42 C ATOM 3282 O GLU B 89 5.940 8.914 -7.890 1.00 11.02 O ATOM 3283 CB GLU B 89 4.134 7.114 -6.129 1.00 62.31 C ATOM 3284 CG GLU B 89 3.682 7.932 -4.920 1.00 11.15 C ATOM 3285 CD GLU B 89 2.361 7.442 -4.351 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.294 7.835 -4.871 1.00 4.32 O ATOM 3287 OE2 GLU B 89 2.383 6.645 -3.388 1.00 35.35 O1- ATOM 0 H GLU B 89 5.689 6.581 -4.300 1.00 65.22 H new ATOM 0 HA GLU B 89 5.879 6.389 -7.135 1.00 51.32 H new ATOM 0 HB2 GLU B 89 3.662 7.518 -7.025 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.779 6.090 -6.015 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.448 7.885 -4.146 1.00 11.15 H new ATOM 0 HG3 GLU B 89 3.584 8.979 -5.209 1.00 11.15 H new ATOM 3294 N GLU B 90 6.938 9.097 -5.876 1.00 52.12 N ATOM 3295 CA GLU B 90 7.672 10.325 -6.173 1.00 15.12 C ATOM 3296 C GLU B 90 8.799 10.047 -7.173 1.00 74.05 C ATOM 3297 O GLU B 90 9.265 10.945 -7.880 1.00 53.12 O ATOM 3298 CB GLU B 90 8.252 10.889 -4.869 1.00 14.23 C ATOM 3299 CG GLU B 90 9.230 12.044 -5.050 1.00 30.33 C ATOM 3300 CD GLU B 90 9.844 12.490 -3.733 1.00 5.15 C ATOM 3301 OE1 GLU B 90 9.269 13.383 -3.074 1.00 54.43 O ATOM 3302 OE2 GLU B 90 10.895 11.937 -3.341 1.00 12.50 O1- ATOM 0 H GLU B 90 7.054 8.773 -4.916 1.00 52.12 H new ATOM 0 HA GLU B 90 6.993 11.052 -6.618 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.429 11.224 -4.237 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.757 10.084 -4.335 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.023 11.742 -5.734 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.714 12.886 -5.511 1.00 30.33 H new ATOM 3309 N GLY B 91 9.214 8.786 -7.237 1.00 72.20 N ATOM 3310 CA GLY B 91 10.313 8.390 -8.103 1.00 12.11 C ATOM 3311 C GLY B 91 11.589 8.139 -7.323 1.00 71.02 C ATOM 3312 O GLY B 91 12.689 8.407 -7.813 1.00 5.53 O ATOM 0 H GLY B 91 8.804 8.023 -6.699 1.00 72.20 H new ATOM 0 HA2 GLY B 91 10.038 7.487 -8.648 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.489 9.169 -8.845 1.00 12.11 H new ATOM 3316 N GLY B 92 11.439 7.610 -6.112 1.00 60.34 N ATOM 3317 CA GLY B 92 12.578 7.316 -5.261 1.00 61.32 C ATOM 3318 C GLY B 92 12.282 6.162 -4.326 1.00 12.52 C ATOM 3319 O GLY B 92 11.725 5.148 -4.750 1.00 70.13 O ATOM 0 H GLY B 92 10.535 7.377 -5.701 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.443 7.074 -5.878 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.838 8.200 -4.680 1.00 61.32 H new ATOM 3323 N PHE B 93 12.619 6.315 -3.050 1.00 71.13 N ATOM 3324 CA PHE B 93 12.376 5.275 -2.053 1.00 4.00 C ATOM 3325 C PHE B 93 11.620 5.848 -0.862 1.00 73.12 C ATOM 3326 O PHE B 93 11.791 7.019 -0.508 1.00 63.14 O ATOM 3327 CB PHE B 93 13.692 4.641 -1.582 1.00 42.41 C ATOM 3328 CG PHE B 93 14.401 3.838 -2.646 1.00 52.32 C ATOM 3329 CD1 PHE B 93 15.712 4.126 -2.999 1.00 72.40 C ATOM 3330 CD2 PHE B 93 13.754 2.788 -3.287 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.363 3.385 -3.966 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.402 2.046 -4.257 1.00 20.53 C ATOM 3333 CZ PHE B 93 15.707 2.344 -4.596 1.00 20.53 C ATOM 0 H PHE B 93 13.064 7.154 -2.679 1.00 71.13 H new ATOM 0 HA PHE B 93 11.770 4.499 -2.521 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.358 5.429 -1.232 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.487 3.994 -0.729 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.229 4.939 -2.512 1.00 72.40 H new ATOM 0 HD2 PHE B 93 12.734 2.549 -3.024 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.384 3.619 -4.230 1.00 54.33 H new ATOM 0 HE2 PHE B 93 13.888 1.234 -4.749 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.215 1.764 -5.353 1.00 20.53 H new ATOM 3343 N ALA B 94 10.793 5.016 -0.248 1.00 22.42 N ATOM 3344 CA ALA B 94 9.990 5.419 0.897 1.00 62.21 C ATOM 3345 C ALA B 94 10.103 4.374 2.000 1.00 42.21 C ATOM 3346 O ALA B 94 10.069 3.169 1.727 1.00 61.15 O ATOM 3347 CB ALA B 94 8.535 5.616 0.486 1.00 43.22 C ATOM 0 H ALA B 94 10.659 4.044 -0.528 1.00 22.42 H new ATOM 0 HA ALA B 94 10.365 6.370 1.276 1.00 62.21 H new ATOM 0 HB1 ALA B 94 7.949 5.917 1.354 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.475 6.390 -0.279 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.140 4.681 0.088 1.00 43.22 H new ATOM 3353 N LEU B 95 10.262 4.847 3.234 1.00 51.40 N ATOM 3354 CA LEU B 95 10.413 3.974 4.397 1.00 52.52 C ATOM 3355 C LEU B 95 9.093 3.849 5.146 1.00 31.45 C ATOM 3356 O LEU B 95 8.502 4.849 5.557 1.00 74.21 O ATOM 3357 CB LEU B 95 11.510 4.503 5.342 1.00 5.44 C ATOM 3358 CG LEU B 95 12.957 4.131 4.962 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.193 2.633 5.144 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.271 4.551 3.527 1.00 13.14 C ATOM 0 H LEU B 95 10.290 5.842 3.456 1.00 51.40 H new ATOM 0 HA LEU B 95 10.710 2.987 4.041 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.433 5.589 5.385 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.310 4.129 6.346 1.00 5.44 H new ATOM 0 HG LEU B 95 13.629 4.671 5.629 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.220 2.391 4.871 1.00 3.52 H new ATOM 0 HD12 LEU B 95 13.021 2.361 6.186 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.507 2.076 4.506 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.298 4.277 3.284 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.589 4.046 2.843 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.150 5.630 3.429 1.00 13.14 H new ATOM 3372 N ASP B 96 8.645 2.614 5.308 1.00 51.23 N ATOM 3373 CA ASP B 96 7.412 2.302 6.025 1.00 11.24 C ATOM 3374 C ASP B 96 7.752 1.612 7.336 1.00 14.30 C ATOM 3375 O ASP B 96 8.210 0.471 7.341 1.00 55.22 O ATOM 3376 CB ASP B 96 6.542 1.372 5.182 1.00 22.11 C ATOM 3377 CG ASP B 96 5.218 1.018 5.844 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.399 1.933 6.071 1.00 73.12 O ATOM 3379 OD2 ASP B 96 4.976 -0.184 6.104 1.00 73.53 O1- ATOM 0 H ASP B 96 9.128 1.792 4.944 1.00 51.23 H new ATOM 0 HA ASP B 96 6.869 3.227 6.222 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.344 1.845 4.220 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.095 0.455 4.979 1.00 22.11 H new ATOM 3384 N VAL B 97 7.533 2.295 8.439 1.00 43.21 N ATOM 3385 CA VAL B 97 7.899 1.761 9.752 1.00 65.34 C ATOM 3386 C VAL B 97 6.659 1.471 10.593 1.00 4.12 C ATOM 3387 O VAL B 97 5.970 2.385 11.020 1.00 1.23 O ATOM 3388 CB VAL B 97 8.820 2.743 10.521 1.00 44.15 C ATOM 3389 CG1 VAL B 97 9.212 2.178 11.888 1.00 31.14 C ATOM 3390 CG2 VAL B 97 10.061 3.084 9.693 1.00 13.32 C ATOM 0 H VAL B 97 7.105 3.220 8.463 1.00 43.21 H new ATOM 0 HA VAL B 97 8.439 0.830 9.579 1.00 65.34 H new ATOM 0 HB VAL B 97 8.262 3.664 10.691 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.858 2.889 12.404 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.314 2.006 12.482 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.744 1.236 11.753 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.693 3.774 10.252 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.619 2.172 9.481 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.756 3.549 8.755 1.00 13.32 H new ATOM 3400 N GLU B 98 6.379 0.194 10.831 1.00 55.41 N ATOM 3401 CA GLU B 98 5.253 -0.205 11.670 1.00 61.25 C ATOM 3402 C GLU B 98 5.731 -0.476 13.096 1.00 55.42 C ATOM 3403 O GLU B 98 6.405 -1.477 13.356 1.00 74.01 O ATOM 3404 CB GLU B 98 4.558 -1.447 11.088 1.00 43.20 C ATOM 3405 CG GLU B 98 3.932 -1.211 9.715 1.00 33.43 C ATOM 3406 CD GLU B 98 3.173 -2.419 9.185 1.00 35.25 C ATOM 3407 OE1 GLU B 98 3.694 -3.106 8.280 1.00 70.42 O ATOM 3408 OE2 GLU B 98 2.045 -2.680 9.668 1.00 74.42 O1- ATOM 0 H GLU B 98 6.918 -0.585 10.454 1.00 55.41 H new ATOM 0 HA GLU B 98 4.529 0.610 11.693 1.00 61.25 H new ATOM 0 HB2 GLU B 98 5.283 -2.257 11.013 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.783 -1.777 11.780 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.253 -0.361 9.774 1.00 33.43 H new ATOM 0 HG3 GLU B 98 4.716 -0.944 9.007 1.00 33.43 H new ATOM 3415 N LEU B 99 5.399 0.434 14.012 1.00 61.12 N ATOM 3416 CA LEU B 99 5.778 0.295 15.417 1.00 54.24 C ATOM 3417 C LEU B 99 4.649 -0.361 16.201 1.00 51.12 C ATOM 3418 O LEU B 99 3.607 0.256 16.446 1.00 12.44 O ATOM 3419 CB LEU B 99 6.127 1.661 16.032 1.00 60.12 C ATOM 3420 CG LEU B 99 7.400 2.327 15.481 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.648 3.667 16.168 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.610 1.407 15.643 1.00 1.13 C ATOM 0 H LEU B 99 4.866 1.279 13.804 1.00 61.12 H new ATOM 0 HA LEU B 99 6.664 -0.338 15.470 1.00 54.24 H new ATOM 0 HB2 LEU B 99 5.286 2.337 15.874 1.00 60.12 H new ATOM 0 HB3 LEU B 99 6.239 1.538 17.109 1.00 60.12 H new ATOM 0 HG LEU B 99 7.252 2.509 14.417 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.553 4.121 15.764 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.800 4.329 15.992 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.769 3.510 17.240 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.498 1.900 15.246 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.760 1.185 16.700 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.437 0.479 15.099 1.00 1.13 H new ATOM 3434 N ARG B 100 4.867 -1.612 16.588 1.00 53.41 N ATOM 3435 CA ARG B 100 3.858 -2.409 17.277 1.00 2.45 C ATOM 3436 C ARG B 100 4.124 -2.409 18.779 1.00 14.01 C ATOM 3437 O ARG B 100 5.167 -2.873 19.230 1.00 24.14 O ATOM 3438 CB ARG B 100 3.882 -3.841 16.730 1.00 53.52 C ATOM 3439 CG ARG B 100 2.945 -4.813 17.443 1.00 13.43 C ATOM 3440 CD ARG B 100 3.065 -6.211 16.847 1.00 64.11 C ATOM 3441 NE ARG B 100 2.371 -7.224 17.642 1.00 3.43 N ATOM 3442 CZ ARG B 100 2.974 -8.273 18.212 1.00 52.33 C ATOM 3443 NH1 ARG B 100 4.301 -8.377 18.192 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 2.254 -9.197 18.828 1.00 11.32 N ATOM 0 H ARG B 100 5.748 -2.103 16.433 1.00 53.41 H new ATOM 0 HA ARG B 100 2.873 -1.976 17.103 1.00 2.45 H new ATOM 0 HB2 ARG B 100 3.620 -3.816 15.672 1.00 53.52 H new ATOM 0 HB3 ARG B 100 4.900 -4.224 16.797 1.00 53.52 H new ATOM 0 HG2 ARG B 100 3.185 -4.843 18.506 1.00 13.43 H new ATOM 0 HG3 ARG B 100 1.916 -4.463 17.358 1.00 13.43 H new ATOM 0 HD2 ARG B 100 2.658 -6.207 15.836 1.00 64.11 H new ATOM 0 HD3 ARG B 100 4.119 -6.478 16.765 1.00 64.11 H new ATOM 0 HE ARG B 100 1.364 -7.124 17.770 1.00 3.43 H new ATOM 0 HH11 ARG B 100 4.862 -7.655 17.741 1.00 41.53 H new ATOM 0 HH12 ARG B 100 4.756 -9.179 18.628 1.00 41.53 H new ATOM 0 HH21 ARG B 100 1.239 -9.109 18.868 1.00 11.32 H new ATOM 0 HH22 ARG B 100 2.715 -9.997 19.262 1.00 11.32 H new ATOM 3458 N VAL B 101 3.178 -1.881 19.542 1.00 41.00 N ATOM 3459 CA VAL B 101 3.338 -1.731 20.983 1.00 50.20 C ATOM 3460 C VAL B 101 2.487 -2.744 21.740 1.00 3.30 C ATOM 3461 O VAL B 101 1.264 -2.633 21.759 1.00 1.54 O ATOM 3462 CB VAL B 101 2.923 -0.312 21.434 1.00 60.12 C ATOM 3463 CG1 VAL B 101 3.009 -0.176 22.955 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.771 0.753 20.735 1.00 51.31 C ATOM 0 H VAL B 101 2.283 -1.546 19.184 1.00 41.00 H new ATOM 0 HA VAL B 101 4.391 -1.900 21.208 1.00 50.20 H new ATOM 0 HB VAL B 101 1.884 -0.155 21.143 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.712 0.831 23.248 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.343 -0.901 23.423 1.00 22.35 H new ATOM 0 HG13 VAL B 101 4.033 -0.361 23.280 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.460 1.743 21.069 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.822 0.601 20.981 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.636 0.675 19.656 1.00 51.31 H new ATOM 3474 N ALA B 102 3.131 -3.722 22.366 1.00 24.03 N ATOM 3475 CA ALA B 102 2.420 -4.679 23.206 1.00 53.32 C ATOM 3476 C ALA B 102 2.682 -4.375 24.679 1.00 44.40 C ATOM 3477 O ALA B 102 3.730 -4.726 25.222 1.00 4.42 O ATOM 3478 CB ALA B 102 2.844 -6.106 22.864 1.00 42.24 C ATOM 0 H ALA B 102 4.138 -3.873 22.309 1.00 24.03 H new ATOM 0 HA ALA B 102 1.350 -4.589 23.018 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.304 -6.808 23.500 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.615 -6.313 21.819 1.00 42.24 H new ATOM 0 HB3 ALA B 102 3.916 -6.217 23.029 1.00 42.24 H new ATOM 3484 N LEU B 103 1.716 -3.726 25.318 1.00 61.44 N ATOM 3485 CA LEU B 103 1.793 -3.402 26.734 1.00 72.24 C ATOM 3486 C LEU B 103 0.748 -4.239 27.466 1.00 41.41 C ATOM 3487 O LEU B 103 -0.451 -4.086 27.225 1.00 40.11 O ATOM 3488 CB LEU B 103 1.555 -1.891 26.925 1.00 55.34 C ATOM 3489 CG LEU B 103 1.896 -1.275 28.304 1.00 34.43 C ATOM 3490 CD1 LEU B 103 0.927 -1.720 29.396 1.00 40.33 C ATOM 3491 CD2 LEU B 103 3.323 -1.579 28.716 1.00 1.40 C ATOM 0 H LEU B 103 0.857 -3.410 24.867 1.00 61.44 H new ATOM 0 HA LEU B 103 2.777 -3.632 27.142 1.00 72.24 H new ATOM 0 HB2 LEU B 103 2.136 -1.362 26.169 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.504 -1.689 26.719 1.00 55.34 H new ATOM 0 HG LEU B 103 1.792 -0.196 28.187 1.00 34.43 H new ATOM 0 HD11 LEU B 103 1.210 -1.260 30.343 1.00 40.33 H new ATOM 0 HD12 LEU B 103 -0.085 -1.413 29.132 1.00 40.33 H new ATOM 0 HD13 LEU B 103 0.963 -2.805 29.494 1.00 40.33 H new ATOM 0 HD21 LEU B 103 3.524 -1.130 29.689 1.00 1.40 H new ATOM 0 HD22 LEU B 103 3.461 -2.658 28.779 1.00 1.40 H new ATOM 0 HD23 LEU B 103 4.011 -1.167 27.977 1.00 1.40 H new ATOM 3503 N PRO B 104 1.188 -5.154 28.341 1.00 3.11 N ATOM 3504 CA PRO B 104 0.286 -6.087 29.011 1.00 24.44 C ATOM 3505 C PRO B 104 -0.630 -5.403 30.023 1.00 5.10 C ATOM 3506 O PRO B 104 -0.240 -4.440 30.690 1.00 15.44 O ATOM 3507 CB PRO B 104 1.233 -7.072 29.702 1.00 10.11 C ATOM 3508 CG PRO B 104 2.517 -6.335 29.872 1.00 31.23 C ATOM 3509 CD PRO B 104 2.591 -5.344 28.746 1.00 74.24 C ATOM 0 HA PRO B 104 -0.397 -6.563 28.307 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.833 -7.392 30.664 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.372 -7.970 29.101 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.549 -5.829 30.837 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.364 -7.020 29.843 1.00 31.23 H new ATOM 0 HD2 PRO B 104 3.043 -4.406 29.069 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.196 -5.722 27.922 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.851 -5.915 30.122 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.843 -5.342 31.017 1.00 21.00 C ATOM 3519 C GLY B 105 -3.397 -4.029 30.492 1.00 53.31 C ATOM 3520 O GLY B 105 -4.031 -3.271 31.232 1.00 21.33 O ATOM 0 H GLY B 105 -2.175 -6.725 29.593 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.660 -6.051 31.153 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.395 -5.180 31.997 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.157 -3.763 29.210 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.566 -2.507 28.581 1.00 45.21 C ATOM 3526 C LEU B 106 -4.436 -2.767 27.348 1.00 60.53 C ATOM 3527 O LEU B 106 -4.183 -3.700 26.583 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.318 -1.691 28.207 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.553 -0.439 27.343 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.472 0.552 28.044 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.224 0.226 26.992 1.00 55.01 C ATOM 0 H LEU B 106 -2.677 -4.406 28.581 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.166 -1.937 29.290 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -1.823 -1.383 29.128 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.627 -2.347 27.677 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.041 -0.757 26.422 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.618 1.425 27.408 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.435 0.080 28.239 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.022 0.861 28.987 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.409 1.109 26.381 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -0.711 0.519 27.908 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.602 -0.475 26.436 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.464 -1.935 27.173 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.395 -2.058 26.048 1.00 50.41 C ATOM 3545 C ASP B 107 -5.795 -1.475 24.788 1.00 24.13 C ATOM 3546 O ASP B 107 -4.843 -0.709 24.851 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.692 -1.294 26.323 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.915 -1.981 25.734 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.166 -1.823 24.518 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.631 -2.678 26.488 1.00 14.11 O1- ATOM 0 H ASP B 107 -5.675 -1.161 27.803 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.597 -3.122 25.922 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -7.824 -1.187 27.400 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -7.611 -0.289 25.910 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.400 -1.798 23.658 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.076 -1.143 22.406 1.00 21.33 C ATOM 3557 C ALA B 108 -6.483 0.325 22.481 1.00 4.44 C ATOM 3558 O ALA B 108 -5.706 1.214 22.143 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.791 -1.831 21.255 1.00 34.32 C ATOM 0 H ALA B 108 -7.122 -2.514 23.584 1.00 12.24 H new ATOM 0 HA ALA B 108 -5.002 -1.208 22.232 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.540 -1.331 20.320 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -6.478 -2.874 21.204 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.868 -1.783 21.415 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.700 0.560 22.970 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.270 1.904 23.048 1.00 64.51 C ATOM 3567 C ALA B 109 -7.372 2.840 23.849 1.00 34.40 C ATOM 3568 O ALA B 109 -7.025 3.932 23.390 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.662 1.852 23.669 1.00 34.53 C ATOM 0 H ALA B 109 -8.316 -0.173 23.322 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.346 2.296 22.034 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.075 2.859 23.721 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.310 1.225 23.057 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.597 1.434 24.674 1.00 34.53 H new ATOM 3575 N ALA B 110 -6.994 2.401 25.046 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.145 3.197 25.922 1.00 72.03 C ATOM 3577 C ALA B 110 -4.722 3.253 25.376 1.00 4.25 C ATOM 3578 O ALA B 110 -4.087 4.316 25.362 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.162 2.627 27.336 1.00 4.12 C ATOM 0 H ALA B 110 -7.264 1.496 25.431 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.535 4.214 25.959 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.523 3.232 27.980 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.182 2.640 27.721 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -5.793 1.601 27.319 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.231 2.109 24.905 1.00 64.14 N ATOM 3586 CA ALA B 111 -2.886 2.035 24.331 1.00 51.51 C ATOM 3587 C ALA B 111 -2.709 3.057 23.213 1.00 2.23 C ATOM 3588 O ALA B 111 -1.642 3.652 23.078 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.595 0.636 23.814 1.00 4.22 C ATOM 0 H ALA B 111 -4.739 1.225 24.908 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.175 2.268 25.124 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.590 0.606 23.392 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -2.666 -0.077 24.635 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.320 0.375 23.043 1.00 4.22 H new ATOM 3595 N LYS B 112 -3.762 3.264 22.426 1.00 32.30 N ATOM 3596 CA LYS B 112 -3.738 4.245 21.345 1.00 34.20 C ATOM 3597 C LYS B 112 -3.301 5.614 21.860 1.00 24.41 C ATOM 3598 O LYS B 112 -2.396 6.238 21.302 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.114 4.350 20.684 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.482 3.127 19.855 1.00 74.45 C ATOM 3601 CD LYS B 112 -6.896 3.221 19.305 1.00 63.04 C ATOM 3602 CE LYS B 112 -7.064 4.409 18.366 1.00 72.33 C ATOM 3603 NZ LYS B 112 -6.192 4.290 17.170 1.00 62.21 N1+ ATOM 0 H LYS B 112 -4.646 2.763 22.518 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.015 3.908 20.603 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -5.869 4.497 21.456 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.135 5.233 20.045 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -4.778 3.022 19.030 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.390 2.231 20.469 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.140 2.301 18.774 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -7.602 3.309 20.131 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -8.105 4.480 18.052 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -6.828 5.330 18.899 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -6.463 5.009 16.470 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -5.200 4.434 17.448 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -6.301 3.343 16.754 1.00 62.21 H new ATOM 3617 N THR B 113 -3.923 6.062 22.948 1.00 71.03 N ATOM 3618 CA THR B 113 -3.641 7.386 23.482 1.00 12.30 C ATOM 3619 C THR B 113 -2.284 7.404 24.189 1.00 72.03 C ATOM 3620 O THR B 113 -1.555 8.394 24.116 1.00 34.03 O ATOM 3621 CB THR B 113 -4.753 7.875 24.451 1.00 51.23 C ATOM 3622 OG1 THR B 113 -4.802 9.311 24.462 1.00 15.33 O ATOM 3623 CG2 THR B 113 -4.522 7.380 25.876 1.00 55.23 C ATOM 0 H THR B 113 -4.619 5.531 23.471 1.00 71.03 H new ATOM 0 HA THR B 113 -3.614 8.073 22.636 1.00 12.30 H new ATOM 0 HB THR B 113 -5.697 7.467 24.091 1.00 51.23 H new ATOM 0 HG1 THR B 113 -5.507 9.610 25.074 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.321 7.744 26.522 1.00 55.23 H new ATOM 0 HG22 THR B 113 -4.515 6.290 25.886 1.00 55.23 H new ATOM 0 HG23 THR B 113 -3.564 7.752 26.240 1.00 55.23 H new ATOM 3631 N LEU B 114 -1.943 6.303 24.862 1.00 42.02 N ATOM 3632 CA LEU B 114 -0.676 6.216 25.589 1.00 34.43 C ATOM 3633 C LEU B 114 0.502 6.261 24.622 1.00 70.23 C ATOM 3634 O LEU B 114 1.462 7.002 24.831 1.00 14.10 O ATOM 3635 CB LEU B 114 -0.623 4.943 26.444 1.00 61.41 C ATOM 3636 CG LEU B 114 -1.731 4.820 27.507 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.486 3.617 28.413 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -1.846 6.105 28.328 1.00 20.12 C ATOM 0 H LEU B 114 -2.522 5.465 24.918 1.00 42.02 H new ATOM 0 HA LEU B 114 -0.608 7.076 26.255 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -0.678 4.078 25.783 1.00 61.41 H new ATOM 0 HB3 LEU B 114 0.345 4.901 26.944 1.00 61.41 H new ATOM 0 HG LEU B 114 -2.677 4.665 26.989 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.282 3.552 29.155 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.474 2.707 27.814 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.527 3.732 28.919 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -2.635 5.992 29.071 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -0.899 6.301 28.831 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.086 6.938 27.668 1.00 20.12 H new ATOM 3650 N VAL B 115 0.408 5.481 23.554 1.00 61.11 N ATOM 3651 CA VAL B 115 1.434 5.462 22.519 1.00 23.35 C ATOM 3652 C VAL B 115 1.479 6.808 21.798 1.00 63.55 C ATOM 3653 O VAL B 115 2.546 7.272 21.383 1.00 10.54 O ATOM 3654 CB VAL B 115 1.183 4.321 21.498 1.00 32.23 C ATOM 3655 CG1 VAL B 115 2.225 4.336 20.380 1.00 53.51 C ATOM 3656 CG2 VAL B 115 1.175 2.968 22.205 1.00 32.34 C ATOM 0 H VAL B 115 -0.374 4.849 23.381 1.00 61.11 H new ATOM 0 HA VAL B 115 2.394 5.280 23.001 1.00 23.35 H new ATOM 0 HB VAL B 115 0.206 4.485 21.044 1.00 32.23 H new ATOM 0 HG11 VAL B 115 2.021 3.524 19.682 1.00 53.51 H new ATOM 0 HG12 VAL B 115 2.179 5.289 19.853 1.00 53.51 H new ATOM 0 HG13 VAL B 115 3.219 4.205 20.807 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.998 2.177 21.476 1.00 32.34 H new ATOM 0 HG22 VAL B 115 2.137 2.805 22.690 1.00 32.34 H new ATOM 0 HG23 VAL B 115 0.384 2.954 22.955 1.00 32.34 H new ATOM 3666 N ASP B 116 0.313 7.437 21.666 1.00 33.05 N ATOM 3667 CA ASP B 116 0.214 8.744 21.022 1.00 4.03 C ATOM 3668 C ASP B 116 0.988 9.797 21.801 1.00 43.14 C ATOM 3669 O ASP B 116 1.884 10.449 21.256 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.244 9.190 20.895 1.00 75.43 C ATOM 3671 CG ASP B 116 -1.381 10.516 20.160 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -2.237 11.338 20.552 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -0.626 10.748 19.185 1.00 32.45 O1- ATOM 0 H ASP B 116 -0.576 7.062 21.997 1.00 33.05 H new ATOM 0 HA ASP B 116 0.645 8.642 20.026 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -1.811 8.424 20.366 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -1.682 9.281 21.889 1.00 75.43 H new ATOM 3678 N ARG B 117 0.646 9.954 23.080 1.00 65.05 N ATOM 3679 CA ARG B 117 1.278 10.957 23.926 1.00 30.34 C ATOM 3680 C ARG B 117 2.755 10.637 24.116 1.00 41.22 C ATOM 3681 O ARG B 117 3.598 11.534 24.192 1.00 22.44 O ATOM 3682 CB ARG B 117 0.564 11.031 25.277 1.00 5.33 C ATOM 3683 CG ARG B 117 0.501 9.695 26.003 1.00 52.02 C ATOM 3684 CD ARG B 117 -0.380 9.759 27.239 1.00 70.20 C ATOM 3685 NE ARG B 117 0.222 10.563 28.306 1.00 35.41 N ATOM 3686 CZ ARG B 117 -0.466 11.133 29.302 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -1.784 10.995 29.371 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 0.170 11.839 30.231 1.00 12.43 N ATOM 0 H ARG B 117 -0.067 9.396 23.550 1.00 65.05 H new ATOM 0 HA ARG B 117 1.199 11.929 23.438 1.00 30.34 H new ATOM 0 HB2 ARG B 117 1.075 11.756 25.910 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -0.450 11.401 25.124 1.00 5.33 H new ATOM 0 HG2 ARG B 117 0.119 8.932 25.325 1.00 52.02 H new ATOM 0 HG3 ARG B 117 1.507 9.391 26.291 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -1.349 10.181 26.971 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -0.562 8.749 27.606 1.00 70.20 H new ATOM 0 HE ARG B 117 1.233 10.697 28.288 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -2.278 10.452 28.663 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -2.303 11.432 30.133 1.00 12.31 H new ATOM 0 HH21 ARG B 117 1.183 11.947 30.185 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -0.355 12.273 30.990 1.00 12.43 H new ATOM 3702 N ALA B 118 3.060 9.347 24.182 1.00 61.11 N ATOM 3703 CA ALA B 118 4.441 8.884 24.243 1.00 4.01 C ATOM 3704 C ALA B 118 5.188 9.312 22.978 1.00 4.12 C ATOM 3705 O ALA B 118 6.367 9.665 23.022 1.00 22.32 O ATOM 3706 CB ALA B 118 4.484 7.372 24.419 1.00 4.44 C ATOM 0 H ALA B 118 2.366 8.600 24.195 1.00 61.11 H new ATOM 0 HA ALA B 118 4.934 9.336 25.104 1.00 4.01 H new ATOM 0 HB1 ALA B 118 5.521 7.040 24.463 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.976 7.099 25.344 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.985 6.893 23.576 1.00 4.44 H new ATOM 3712 N HIS B 119 4.483 9.290 21.845 1.00 53.54 N ATOM 3713 CA HIS B 119 5.030 9.787 20.587 1.00 31.05 C ATOM 3714 C HIS B 119 4.919 11.313 20.471 1.00 22.51 C ATOM 3715 O HIS B 119 5.079 11.864 19.383 1.00 73.21 O ATOM 3716 CB HIS B 119 4.370 9.095 19.381 1.00 24.30 C ATOM 3717 CG HIS B 119 5.000 7.777 19.030 1.00 50.32 C ATOM 3718 ND1 HIS B 119 4.857 6.548 19.580 1.00 33.22 N flip ATOM 3719 CD2 HIS B 119 5.923 7.631 18.012 1.00 55.12 C flip ATOM 3720 CE1 HIS B 119 5.687 5.694 18.895 1.00 74.31 C flip ATOM 3721 NE2 HIS B 119 6.316 6.372 17.954 1.00 22.51 N flip ATOM 0 H HIS B 119 3.530 8.932 21.776 1.00 53.54 H new ATOM 0 HA HIS B 119 6.092 9.539 20.583 1.00 31.05 H new ATOM 0 HB2 HIS B 119 3.313 8.938 19.595 1.00 24.30 H new ATOM 0 HB3 HIS B 119 4.425 9.757 18.517 1.00 24.30 H new ATOM 0 HD1 HIS B 119 4.246 6.302 20.359 1.00 33.22 H new ATOM 0 HD2 HIS B 119 6.269 8.423 17.365 1.00 55.12 H new ATOM 0 HE1 HIS B 119 5.805 4.639 19.094 1.00 74.31 H new ATOM 3730 N HIS B 120 4.628 11.988 21.585 1.00 35.12 N ATOM 3731 CA HIS B 120 4.604 13.457 21.624 1.00 61.52 C ATOM 3732 C HIS B 120 5.822 14.001 22.375 1.00 22.12 C ATOM 3733 O HIS B 120 6.547 14.856 21.870 1.00 21.30 O ATOM 3734 CB HIS B 120 3.332 13.986 22.314 1.00 61.10 C ATOM 3735 CG HIS B 120 2.051 13.740 21.576 1.00 45.20 C ATOM 3736 ND1 HIS B 120 0.811 13.942 22.146 1.00 23.40 N ATOM 3737 CD2 HIS B 120 1.812 13.324 20.310 1.00 61.34 C ATOM 3738 CE1 HIS B 120 -0.129 13.659 21.268 1.00 14.23 C ATOM 3739 NE2 HIS B 120 0.449 13.282 20.145 1.00 33.30 N ATOM 0 H HIS B 120 4.405 11.542 22.475 1.00 35.12 H new ATOM 0 HA HIS B 120 4.619 13.798 20.589 1.00 61.52 H new ATOM 0 HB2 HIS B 120 3.257 13.528 23.300 1.00 61.10 H new ATOM 0 HB3 HIS B 120 3.442 15.059 22.468 1.00 61.10 H new ATOM 0 HD2 HIS B 120 2.555 13.072 19.568 1.00 61.34 H new ATOM 0 HE1 HIS B 120 -1.193 13.725 21.439 1.00 14.23 H new ATOM 0 HE2 HIS B 120 -0.037 13.004 19.292 1.00 33.30 H new ATOM 3748 N VAL B 121 6.048 13.474 23.577 1.00 53.34 N ATOM 3749 CA VAL B 121 7.008 14.053 24.526 1.00 2.11 C ATOM 3750 C VAL B 121 8.454 13.587 24.296 1.00 31.12 C ATOM 3751 O VAL B 121 9.264 13.585 25.229 1.00 43.14 O ATOM 3752 CB VAL B 121 6.593 13.724 25.987 1.00 52.03 C ATOM 3753 CG1 VAL B 121 5.241 14.354 26.319 1.00 41.33 C ATOM 3754 CG2 VAL B 121 6.562 12.210 26.220 1.00 63.42 C ATOM 0 H VAL B 121 5.576 12.639 23.923 1.00 53.34 H new ATOM 0 HA VAL B 121 6.984 15.129 24.355 1.00 2.11 H new ATOM 0 HB VAL B 121 7.340 14.151 26.656 1.00 52.03 H new ATOM 0 HG11 VAL B 121 4.969 14.112 27.346 1.00 41.33 H new ATOM 0 HG12 VAL B 121 5.307 15.436 26.207 1.00 41.33 H new ATOM 0 HG13 VAL B 121 4.482 13.964 25.641 1.00 41.33 H new ATOM 0 HG21 VAL B 121 6.269 12.006 27.250 1.00 63.42 H new ATOM 0 HG22 VAL B 121 5.843 11.752 25.541 1.00 63.42 H new ATOM 0 HG23 VAL B 121 7.552 11.793 26.035 1.00 63.42 H new ATOM 3764 N CYS B 122 8.795 13.233 23.060 1.00 64.23 N ATOM 3765 CA CYS B 122 10.152 12.791 22.740 1.00 24.42 C ATOM 3766 C CYS B 122 10.565 13.270 21.342 1.00 23.34 C ATOM 3767 O CYS B 122 9.759 13.247 20.408 1.00 74.53 O ATOM 3768 CB CYS B 122 10.255 11.262 22.833 1.00 15.34 C ATOM 3769 SG CYS B 122 9.851 10.595 24.464 1.00 14.44 S ATOM 0 H CYS B 122 8.155 13.243 22.266 1.00 64.23 H new ATOM 0 HA CYS B 122 10.834 13.231 23.468 1.00 24.42 H new ATOM 0 HB2 CYS B 122 9.587 10.818 22.095 1.00 15.34 H new ATOM 0 HB3 CYS B 122 11.268 10.960 22.569 1.00 15.34 H new ATOM 0 HG CYS B 122 9.584 11.572 25.278 1.00 14.44 H new ATOM 3775 N PRO B 123 11.833 13.712 21.181 1.00 45.45 N ATOM 3776 CA PRO B 123 12.346 14.207 19.894 1.00 1.30 C ATOM 3777 C PRO B 123 12.300 13.129 18.809 1.00 21.43 C ATOM 3778 O PRO B 123 11.896 13.393 17.673 1.00 1.12 O ATOM 3779 CB PRO B 123 13.798 14.616 20.206 1.00 65.25 C ATOM 3780 CG PRO B 123 14.146 13.886 21.461 1.00 12.41 C ATOM 3781 CD PRO B 123 12.862 13.775 22.239 1.00 30.51 C ATOM 0 HA PRO B 123 11.748 15.030 19.503 1.00 1.30 H new ATOM 0 HB2 PRO B 123 14.469 14.342 19.392 1.00 65.25 H new ATOM 0 HB3 PRO B 123 13.884 15.694 20.340 1.00 65.25 H new ATOM 0 HG2 PRO B 123 14.556 12.901 21.240 1.00 12.41 H new ATOM 0 HG3 PRO B 123 14.903 14.425 22.030 1.00 12.41 H new ATOM 0 HD2 PRO B 123 12.848 12.885 22.868 1.00 30.51 H new ATOM 0 HD3 PRO B 123 12.713 14.632 22.895 1.00 30.51 H new ATOM 3789 N TYR B 124 12.702 11.910 19.178 1.00 44.15 N ATOM 3790 CA TYR B 124 12.683 10.772 18.257 1.00 41.53 C ATOM 3791 C TYR B 124 11.272 10.545 17.721 1.00 41.03 C ATOM 3792 O TYR B 124 11.074 10.283 16.537 1.00 24.42 O ATOM 3793 CB TYR B 124 13.153 9.486 18.957 1.00 11.44 C ATOM 3794 CG TYR B 124 14.591 9.504 19.440 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.592 8.831 18.742 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.944 10.178 20.605 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.897 8.832 19.193 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.248 10.184 21.059 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.219 9.510 20.352 1.00 65.35 C ATOM 3800 OH TYR B 124 18.516 9.510 20.807 1.00 21.31 O ATOM 0 H TYR B 124 13.046 11.686 20.112 1.00 44.15 H new ATOM 0 HA TYR B 124 13.361 11.005 17.436 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.502 9.297 19.810 1.00 11.44 H new ATOM 0 HB3 TYR B 124 13.028 8.650 18.269 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.343 8.301 17.835 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.185 10.705 21.164 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.662 8.305 18.642 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.505 10.714 21.964 1.00 2.53 H new ATOM 0 HH TYR B 124 19.130 9.498 20.044 1.00 21.31 H new ATOM 3845 N THR B 128 9.251 11.055 13.984 1.00 13.32 N ATOM 3846 CA THR B 128 8.984 9.740 13.423 1.00 55.14 C ATOM 3847 C THR B 128 7.533 9.672 12.982 1.00 13.14 C ATOM 3848 O THR B 128 7.131 8.774 12.256 1.00 21.45 O ATOM 3849 CB THR B 128 9.292 8.604 14.439 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.591 7.384 13.750 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.119 8.361 15.385 1.00 11.25 C ATOM 0 HA THR B 128 9.641 9.593 12.566 1.00 55.14 H new ATOM 0 HB THR B 128 10.154 8.923 15.025 1.00 41.45 H new ATOM 0 HG1 THR B 128 10.215 6.850 14.285 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.372 7.560 16.080 1.00 11.25 H new ATOM 0 HG22 THR B 128 7.907 9.273 15.943 1.00 11.25 H new ATOM 0 HG23 THR B 128 7.239 8.076 14.808 1.00 11.25 H new ATOM 3859 N ARG B 129 6.758 10.661 13.407 1.00 41.51 N ATOM 3860 CA ARG B 129 5.335 10.684 13.137 1.00 75.21 C ATOM 3861 C ARG B 129 4.989 11.818 12.177 1.00 73.32 C ATOM 3862 O ARG B 129 4.238 11.625 11.219 1.00 44.41 O ATOM 3863 CB ARG B 129 4.555 10.814 14.452 1.00 21.01 C ATOM 3864 CG ARG B 129 4.834 12.089 15.243 1.00 45.10 C ATOM 3865 CD ARG B 129 4.002 12.158 16.520 1.00 21.21 C ATOM 3866 NE ARG B 129 2.562 12.168 16.239 1.00 2.44 N ATOM 3867 CZ ARG B 129 1.626 11.692 17.063 1.00 0.21 C ATOM 3868 NH1 ARG B 129 1.963 11.151 18.229 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 0.349 11.764 16.728 1.00 44.44 N ATOM 0 H ARG B 129 7.098 11.460 13.943 1.00 41.51 H new ATOM 0 HA ARG B 129 5.050 9.747 12.659 1.00 75.21 H new ATOM 0 HB2 ARG B 129 3.489 10.767 14.231 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.788 9.955 15.082 1.00 21.01 H new ATOM 0 HG2 ARG B 129 5.893 12.135 15.497 1.00 45.10 H new ATOM 0 HG3 ARG B 129 4.617 12.957 14.621 1.00 45.10 H new ATOM 0 HD2 ARG B 129 4.241 11.305 17.155 1.00 21.21 H new ATOM 0 HD3 ARG B 129 4.269 13.056 17.078 1.00 21.21 H new ATOM 0 HE ARG B 129 2.255 12.567 15.352 1.00 2.44 H new ATOM 0 HH11 ARG B 129 2.944 11.097 18.501 1.00 5.12 H new ATOM 0 HH12 ARG B 129 1.240 10.790 18.852 1.00 5.12 H new ATOM 0 HH21 ARG B 129 0.078 12.184 15.839 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -0.365 11.400 17.359 1.00 44.44 H new ATOM 3883 N ASN B 130 5.524 13.005 12.445 1.00 21.53 N ATOM 3884 CA ASN B 130 5.281 14.161 11.586 1.00 53.34 C ATOM 3885 C ASN B 130 6.149 14.113 10.333 1.00 22.35 C ATOM 3886 O ASN B 130 5.700 14.443 9.233 1.00 70.41 O ATOM 3887 CB ASN B 130 5.511 15.479 12.341 1.00 70.21 C ATOM 3888 CG ASN B 130 4.616 15.622 13.564 1.00 33.52 C ATOM 3889 OD1 ASN B 130 5.164 15.344 14.738 1.00 60.32 O flip ATOM 3890 ND2 ASN B 130 3.451 16.002 13.459 1.00 74.14 N flip ATOM 0 H ASN B 130 6.126 13.192 13.247 1.00 21.53 H new ATOM 0 HA ASN B 130 4.235 14.120 11.281 1.00 53.34 H new ATOM 0 HB2 ASN B 130 6.554 15.538 12.651 1.00 70.21 H new ATOM 0 HB3 ASN B 130 5.332 16.315 11.665 1.00 70.21 H new ATOM 0 HD21 ASN B 130 3.062 16.207 12.538 1.00 74.14 H new ATOM 0 HD22 ASN B 130 2.873 16.112 14.292 1.00 74.14 H new ATOM 3897 N ASN B 131 7.396 13.691 10.510 1.00 34.23 N ATOM 3898 CA ASN B 131 8.392 13.745 9.441 1.00 31.43 C ATOM 3899 C ASN B 131 8.466 12.414 8.687 1.00 54.44 C ATOM 3900 O ASN B 131 8.609 12.393 7.464 1.00 13.44 O ATOM 3901 CB ASN B 131 9.768 14.091 10.047 1.00 3.33 C ATOM 3902 CG ASN B 131 10.799 14.605 9.039 1.00 61.21 C ATOM 3903 OD1 ASN B 131 11.683 15.378 9.400 1.00 75.43 O ATOM 3904 ND2 ASN B 131 10.708 14.195 7.778 1.00 34.33 N ATOM 0 H ASN B 131 7.745 13.305 11.388 1.00 34.23 H new ATOM 0 HA ASN B 131 8.099 14.515 8.727 1.00 31.43 H new ATOM 0 HB2 ASN B 131 9.630 14.845 10.821 1.00 3.33 H new ATOM 0 HB3 ASN B 131 10.169 13.203 10.535 1.00 3.33 H new ATOM 0 HD21 ASN B 131 11.381 14.523 7.085 1.00 34.33 H new ATOM 0 HD22 ASN B 131 9.965 13.553 7.503 1.00 34.33 H new ATOM 3911 N VAL B 132 8.357 11.308 9.416 1.00 52.13 N ATOM 3912 CA VAL B 132 8.576 9.977 8.838 1.00 11.30 C ATOM 3913 C VAL B 132 7.275 9.170 8.795 1.00 11.32 C ATOM 3914 O VAL B 132 6.358 9.411 9.583 1.00 35.23 O ATOM 3915 CB VAL B 132 9.661 9.203 9.638 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.958 7.840 9.005 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.941 10.039 9.752 1.00 3.12 C ATOM 0 H VAL B 132 8.119 11.302 10.408 1.00 52.13 H new ATOM 0 HA VAL B 132 8.925 10.114 7.815 1.00 11.30 H new ATOM 0 HB VAL B 132 9.273 9.023 10.640 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.721 7.326 9.590 1.00 32.53 H new ATOM 0 HG12 VAL B 132 9.048 7.240 8.989 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.317 7.983 7.986 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.690 9.482 10.315 1.00 3.12 H new ATOM 0 HG22 VAL B 132 11.324 10.256 8.755 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.720 10.974 10.267 1.00 3.12 H new ATOM 3927 N ALA B 133 7.199 8.227 7.856 1.00 53.04 N ATOM 3928 CA ALA B 133 6.020 7.383 7.691 1.00 53.01 C ATOM 3929 C ALA B 133 6.074 6.181 8.630 1.00 72.23 C ATOM 3930 O ALA B 133 6.695 5.152 8.331 1.00 0.23 O ATOM 3931 CB ALA B 133 5.890 6.939 6.239 1.00 11.23 C ATOM 0 H ALA B 133 7.949 8.029 7.193 1.00 53.04 H new ATOM 0 HA ALA B 133 5.137 7.966 7.953 1.00 53.01 H new ATOM 0 HB1 ALA B 133 5.007 6.310 6.129 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.794 7.815 5.598 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.776 6.374 5.951 1.00 11.23 H new ATOM 3937 N VAL B 134 5.429 6.333 9.779 1.00 34.41 N ATOM 3938 CA VAL B 134 5.422 5.302 10.798 1.00 31.34 C ATOM 3939 C VAL B 134 3.996 4.924 11.191 1.00 33.12 C ATOM 3940 O VAL B 134 3.252 5.731 11.752 1.00 12.15 O ATOM 3941 CB VAL B 134 6.216 5.749 12.050 1.00 33.43 C ATOM 3942 CG1 VAL B 134 6.060 4.745 13.184 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.690 5.948 11.703 1.00 5.41 C ATOM 0 H VAL B 134 4.901 7.170 10.026 1.00 34.41 H new ATOM 0 HA VAL B 134 5.908 4.423 10.374 1.00 31.34 H new ATOM 0 HB VAL B 134 5.809 6.701 12.389 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.628 5.084 14.051 1.00 61.10 H new ATOM 0 HG12 VAL B 134 5.007 4.659 13.451 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.434 3.773 12.863 1.00 61.10 H new ATOM 0 HG21 VAL B 134 8.234 6.262 12.594 1.00 5.41 H new ATOM 0 HG22 VAL B 134 8.107 5.011 11.335 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.782 6.714 10.933 1.00 5.41 H new ATOM 3953 N ARG B 135 3.625 3.692 10.869 1.00 11.21 N ATOM 3954 CA ARG B 135 2.342 3.131 11.251 1.00 24.23 C ATOM 3955 C ARG B 135 2.348 2.788 12.740 1.00 24.22 C ATOM 3956 O ARG B 135 3.063 1.882 13.178 1.00 54.44 O ATOM 3957 CB ARG B 135 2.059 1.872 10.415 1.00 74.32 C ATOM 3958 CG ARG B 135 0.775 1.136 10.790 1.00 34.13 C ATOM 3959 CD ARG B 135 -0.472 1.959 10.486 1.00 2.43 C ATOM 3960 NE ARG B 135 -1.700 1.231 10.815 1.00 1.50 N ATOM 3961 CZ ARG B 135 -2.895 1.497 10.283 1.00 23.13 C ATOM 3962 NH1 ARG B 135 -3.027 2.460 9.376 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -3.955 0.789 10.643 1.00 14.33 N ATOM 0 H ARG B 135 4.211 3.053 10.332 1.00 11.21 H new ATOM 0 HA ARG B 135 1.557 3.864 11.064 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.007 2.154 9.363 1.00 74.32 H new ATOM 0 HB3 ARG B 135 2.899 1.186 10.520 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.727 0.193 10.246 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.796 0.891 11.852 1.00 34.13 H new ATOM 0 HD2 ARG B 135 -0.439 2.890 11.052 1.00 2.43 H new ATOM 0 HD3 ARG B 135 -0.481 2.228 9.430 1.00 2.43 H new ATOM 0 HE ARG B 135 -1.638 0.472 11.494 1.00 1.50 H new ATOM 0 HH11 ARG B 135 -2.213 3.000 9.083 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -3.943 2.659 8.973 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -3.859 0.039 11.328 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -4.867 0.994 10.235 1.00 14.33 H new ATOM 3977 N LEU B 136 1.575 3.534 13.519 1.00 62.51 N ATOM 3978 CA LEU B 136 1.422 3.257 14.941 1.00 72.41 C ATOM 3979 C LEU B 136 0.396 2.150 15.154 1.00 41.21 C ATOM 3980 O LEU B 136 -0.803 2.341 14.929 1.00 33.52 O ATOM 3981 CB LEU B 136 1.023 4.530 15.705 1.00 60.04 C ATOM 3982 CG LEU B 136 2.172 5.523 15.946 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.671 6.784 16.645 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.279 4.860 16.766 1.00 0.00 C ATOM 0 H LEU B 136 1.042 4.339 13.188 1.00 62.51 H new ATOM 0 HA LEU B 136 2.381 2.919 15.334 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.233 5.037 15.151 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.602 4.242 16.668 1.00 60.04 H new ATOM 0 HG LEU B 136 2.578 5.816 14.978 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.505 7.468 16.803 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.916 7.268 16.025 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.234 6.517 17.607 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.087 5.573 16.930 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.877 4.539 17.727 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.663 3.994 16.226 1.00 0.00 H new ATOM 3996 N VAL B 137 0.883 0.989 15.565 1.00 22.01 N ATOM 3997 CA VAL B 137 0.044 -0.177 15.796 1.00 61.13 C ATOM 3998 C VAL B 137 0.150 -0.617 17.253 1.00 31.22 C ATOM 3999 O VAL B 137 1.223 -0.986 17.728 1.00 63.04 O ATOM 4000 CB VAL B 137 0.420 -1.340 14.828 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.904 -1.296 14.479 1.00 20.11 C ATOM 4002 CG2 VAL B 137 0.049 -2.707 15.416 1.00 5.14 C ATOM 0 H VAL B 137 1.874 0.829 15.748 1.00 22.01 H new ATOM 0 HA VAL B 137 -0.992 0.095 15.591 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.158 -1.203 13.914 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.143 -2.117 13.803 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.136 -0.347 13.995 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.495 -1.392 15.390 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.326 -3.493 14.713 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.582 -2.856 16.355 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.025 -2.745 15.598 1.00 5.14 H new ATOM 4012 N VAL B 138 -0.965 -0.542 17.965 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.020 -0.941 19.363 1.00 24.22 C ATOM 4014 C VAL B 138 -1.599 -2.346 19.472 1.00 70.52 C ATOM 4015 O VAL B 138 -2.521 -2.713 18.736 1.00 62.24 O ATOM 4016 CB VAL B 138 -1.843 0.034 20.234 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.435 1.478 19.963 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.333 -0.180 20.027 1.00 0.20 C ATOM 0 H VAL B 138 -1.852 -0.205 17.592 1.00 51.04 H new ATOM 0 HA VAL B 138 0.001 -0.921 19.743 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.628 -0.175 21.282 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.028 2.147 20.587 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.378 1.607 20.195 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.608 1.714 18.913 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -3.891 0.518 20.651 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.583 -0.010 18.980 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.595 -1.202 20.302 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.012 -3.140 20.338 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.398 -4.540 20.493 1.00 52.34 C ATOM 4030 C ALA B 139 -2.393 -4.695 21.645 1.00 22.31 C ATOM 4031 O ALA B 139 -1.969 -4.627 22.820 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.168 -5.417 20.710 1.00 71.35 C ATOM 4033 OXT ALA B 139 -3.597 -4.889 21.371 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.256 -2.844 20.956 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.886 -4.869 19.576 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.477 -6.456 20.823 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.498 -5.328 19.852 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.355 -5.094 21.610 1.00 71.35 H new