USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=63 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: A 125 SER OG : rot 30:sc= 0.641 USER MOD Set 1.2: B 131 ASN : amide:sc= -2.82! C(o=-2.2!,f=-4.6!) USER MOD Set 2.1: B 54 TYR OH : rot -158:sc= 0.479 USER MOD Set 2.2: B 119 HIS :FLIP no HE2:sc= -2.8 F(o=-4.1,f=-2.3) USER MOD Set 3.1: A 10 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: B 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 78 THR OG1 : rot -103:sc= 0.0662 USER MOD Set 4.2: B 12 THR OG1 : rot 180:sc= 0.286 USER MOD Set 5.1: A 126 ASN : amide:sc= 0.544 K(o=0.31,f=-6.8!) USER MOD Set 5.2: A 130 ASN : amide:sc= -0.236 K(o=0.31,f=-0.2) USER MOD Set 6.1: A 57 CYS SG : rot 68:sc= 0.506 USER MOD Set 6.2: A 124 TYR OH : rot -130:sc= 0.707 USER MOD Set 7.1: A 48 GLN :FLIP amide:sc= -0.117 F(o=-2.9,f=-0.38) USER MOD Set 7.2: B 21 SER OG : rot 126:sc= -0.265 USER MOD Set 8.1: A 45 ASN : amide:sc= 0.64 K(o=4.3,f=-5.5!) USER MOD Set 8.2: B 5 TYR OH : rot 165:sc= -0.0273 USER MOD Set 8.3: B 7 THR OG1 : rot 32:sc= 1.32 USER MOD Set 8.4: B 25 LYS NZ :NH3+ 164:sc= 2.38 (180deg=0) USER MOD Set 9.1: A 11 SER OG : rot -2:sc= 0.687 USER MOD Set 9.2: B 55 SER OG : rot -15:sc= 0.519 USER MOD Set10.1: A 5 TYR OH : rot -52:sc= 0.601 USER MOD Set10.2: A 7 THR OG1 : rot -82:sc= 1.45 USER MOD Set10.3: A 21 SER OG : rot 19:sc= -1.89! USER MOD Set10.4: A 25 LYS NZ :NH3+ 153:sc= 1.68 (180deg=-0.219) USER MOD Set10.5: B 45 ASN : amide:sc= -1.29 X(o=-3.8,f=-4) USER MOD Set10.6: B 48 GLN : amide:sc= -4.33! C(o=-3.8!,f=-7!) USER MOD Single : A 1 MET CE :methyl 165:sc= -3.01! (180deg=-4.12!) USER MOD Single : A 1 MET N :NH3+ -115:sc= 0.093 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 6 LYS NZ :NH3+ 168:sc= 1.69 (180deg=1.55) USER MOD Single : A 12 THR OG1 : rot -164:sc= 0.0423 USER MOD Single : A 20 THR OG1 : rot -139:sc= -0.175 USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 24 GLN : amide:sc= 0.0568 X(o=0.057,f=-0.15) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -5:sc= 0.869 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 77:sc= -0.87! USER MOD Single : A 60 SER OG : rot -102:sc= 0.437 USER MOD Single : A 62 MET CE :methyl -145:sc= -0.896 (180deg=-3.49!) USER MOD Single : A 63 LYS NZ :NH3+ 166:sc= 1.16 (180deg=0.884) USER MOD Single : A 68 GLN : amide:sc= -0.373 X(o=-0.37,f=-0.0091) USER MOD Single : A 69 ASN : amide:sc= -0.254 X(o=-0.25,f=-0.31) USER MOD Single : A 70 LYS NZ :NH3+ -161:sc= 1.05 (180deg=0.797) USER MOD Single : A 71 GLN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 33:sc= 1.09 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= 0.0665 K(o=0.067,f=-5.6!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -3.91! C(o=-3.9!,f=-5!) USER MOD Single : A 120 HIS : no HD1:sc= -0.0369 X(o=-0.037,f=0) USER MOD Single : A 122 CYS SG : rot -56:sc= 0 USER MOD Single : A 128 THR OG1 : rot -42:sc= 0.00554 USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.0085) USER MOD Single : B 1 MET CE :methyl 174:sc= -2.73 (180deg=-3.11) USER MOD Single : B 1 MET N :NH3+ -110:sc= 0.0883 (180deg=-0.0194) USER MOD Single : B 2 ASN : amide:sc= -0.0535 K(o=-0.053,f=-0.63) USER MOD Single : B 6 LYS NZ :NH3+ 164:sc= 2.43 (180deg=2.34) USER MOD Single : B 10 THR OG1 : rot 180:sc= -0.375 USER MOD Single : B 11 SER OG : rot 34:sc= 1.16 USER MOD Single : B 20 THR OG1 : rot -116:sc= 0.75 USER MOD Single : B 22 HIS : no HE2:sc= 0.763 K(o=0.76,f=-3.5!) USER MOD Single : B 24 GLN : amide:sc= 0.15 X(o=0.15,f=-0.16) USER MOD Single : B 29 LYS NZ :NH3+ -137:sc= -2.47! (180deg=-5.31!) USER MOD Single : B 31 SER OG : rot 140:sc= -1.93! USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 57 CYS SG : rot -12:sc= -6.78! USER MOD Single : B 60 SER OG : rot -71:sc= 0.284 USER MOD Single : B 62 MET CE :methyl -108:sc= -0.48 (180deg=-3.79!) USER MOD Single : B 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0.13) USER MOD Single : B 69 ASN : amide:sc= -0.59! C(o=-0.59!,f=-6.9!) USER MOD Single : B 70 LYS NZ :NH3+ -161:sc= -0.0357 (180deg=-0.284) USER MOD Single : B 71 GLN :FLIP amide:sc=-0.00892 F(o=-1.1,f=-0.0089) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 49:sc= 0.523 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.129 USER MOD Single : B 88 ASN : amide:sc= -0.585 K(o=-0.58,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ 171:sc= -0.0103 (180deg=-0.118) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= 0 X(o=0,f=-0.024) USER MOD Single : B 122 CYS SG : rot 90:sc= -2.8! USER MOD Single : B 124 TYR OH : rot -151:sc= 0.672 USER MOD Single : B 128 THR OG1 : rot 180:sc= -0.387 USER MOD Single : B 130 ASN : amide:sc= -0.0628 X(o=-0.063,f=-0.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.159 0.453 2.587 1.00 60.05 N ATOM 2 CA MET A 1 2.367 0.824 1.165 1.00 3.23 C ATOM 3 C MET A 1 3.073 -0.303 0.416 1.00 42.13 C ATOM 4 O MET A 1 3.226 -1.406 0.945 1.00 30.31 O ATOM 5 CB MET A 1 3.204 2.096 1.057 1.00 13.52 C ATOM 6 CG MET A 1 4.614 1.894 1.542 1.00 60.32 C ATOM 7 SD MET A 1 5.720 3.239 1.086 1.00 71.43 S ATOM 8 CE MET A 1 7.295 2.472 1.450 1.00 20.11 C ATOM 0 H1 MET A 1 1.140 0.376 2.780 1.00 60.05 H new ATOM 0 H2 MET A 1 2.617 -0.461 2.778 1.00 60.05 H new ATOM 0 H3 MET A 1 2.574 1.183 3.201 1.00 60.05 H new ATOM 0 HA MET A 1 1.388 0.998 0.719 1.00 3.23 H new ATOM 0 HB2 MET A 1 3.223 2.429 0.019 1.00 13.52 H new ATOM 0 HB3 MET A 1 2.732 2.889 1.637 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.607 1.790 2.627 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.001 0.960 1.135 1.00 60.32 H new ATOM 0 HE1 MET A 1 8.096 3.047 0.986 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.446 2.445 2.529 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.304 1.455 1.057 1.00 20.11 H new ATOM 20 N ASN A 2 3.514 -0.016 -0.809 1.00 22.52 N ATOM 21 CA ASN A 2 4.285 -0.971 -1.602 1.00 14.33 C ATOM 22 C ASN A 2 5.708 -1.098 -1.048 1.00 22.14 C ATOM 23 O ASN A 2 6.641 -0.463 -1.535 1.00 72.55 O ATOM 24 CB ASN A 2 4.327 -0.545 -3.078 1.00 31.34 C ATOM 25 CG ASN A 2 5.149 -1.492 -3.941 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.193 -2.699 -3.700 1.00 52.13 O ATOM 27 ND2 ASN A 2 5.819 -0.947 -4.946 1.00 35.23 N ATOM 0 H ASN A 2 3.349 0.876 -1.275 1.00 22.52 H new ATOM 0 HA ASN A 2 3.794 -1.942 -1.538 1.00 14.33 H new ATOM 0 HB2 ASN A 2 3.310 -0.497 -3.467 1.00 31.34 H new ATOM 0 HB3 ASN A 2 4.744 0.460 -3.150 1.00 31.34 H new ATOM 0 HD21 ASN A 2 6.396 -1.532 -5.551 1.00 35.23 H new ATOM 0 HD22 ASN A 2 5.758 0.057 -5.115 1.00 35.23 H new ATOM 34 N ILE A 3 5.840 -1.869 0.019 1.00 0.23 N ATOM 35 CA ILE A 3 7.130 -2.164 0.623 1.00 51.02 C ATOM 36 C ILE A 3 7.925 -3.163 -0.214 1.00 3.13 C ATOM 37 O ILE A 3 7.376 -4.138 -0.730 1.00 22.24 O ATOM 38 CB ILE A 3 6.937 -2.735 2.047 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.172 -1.729 2.916 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.277 -3.089 2.684 1.00 24.42 C ATOM 41 CD1 ILE A 3 6.961 -0.474 3.214 1.00 23.10 C ATOM 0 H ILE A 3 5.052 -2.310 0.493 1.00 0.23 H new ATOM 0 HA ILE A 3 7.689 -1.229 0.671 1.00 51.02 H new ATOM 0 HB ILE A 3 6.353 -3.653 1.974 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.245 -1.456 2.412 1.00 25.54 H new ATOM 0 HG13 ILE A 3 5.895 -2.208 3.855 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.110 -3.488 3.685 1.00 24.42 H new ATOM 0 HG22 ILE A 3 8.783 -3.838 2.075 1.00 24.42 H new ATOM 0 HG23 ILE A 3 8.897 -2.195 2.749 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.362 0.194 3.832 1.00 23.10 H new ATOM 0 HD12 ILE A 3 7.876 -0.737 3.745 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.215 0.027 2.280 1.00 23.10 H new ATOM 53 N LEU A 4 9.218 -2.899 -0.351 1.00 41.13 N ATOM 54 CA LEU A 4 10.143 -3.817 -1.008 1.00 42.04 C ATOM 55 C LEU A 4 10.799 -4.723 0.027 1.00 41.22 C ATOM 56 O LEU A 4 10.899 -5.937 -0.167 1.00 74.21 O ATOM 57 CB LEU A 4 11.223 -3.045 -1.777 1.00 22.30 C ATOM 58 CG LEU A 4 10.705 -2.086 -2.857 1.00 5.11 C ATOM 59 CD1 LEU A 4 11.864 -1.373 -3.548 1.00 73.22 C ATOM 60 CD2 LEU A 4 9.830 -2.823 -3.873 1.00 52.13 C ATOM 0 H LEU A 4 9.656 -2.043 -0.010 1.00 41.13 H new ATOM 0 HA LEU A 4 9.578 -4.423 -1.716 1.00 42.04 H new ATOM 0 HB2 LEU A 4 11.816 -2.474 -1.062 1.00 22.30 H new ATOM 0 HB3 LEU A 4 11.895 -3.764 -2.246 1.00 22.30 H new ATOM 0 HG LEU A 4 10.086 -1.332 -2.370 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.474 -0.698 -4.310 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.430 -0.801 -2.812 1.00 73.22 H new ATOM 0 HD13 LEU A 4 12.517 -2.110 -4.016 1.00 73.22 H new ATOM 0 HD21 LEU A 4 9.476 -2.119 -4.627 1.00 52.13 H new ATOM 0 HD22 LEU A 4 10.414 -3.608 -4.354 1.00 52.13 H new ATOM 0 HD23 LEU A 4 8.976 -3.268 -3.363 1.00 52.13 H new ATOM 72 N TYR A 5 11.236 -4.124 1.135 1.00 24.01 N ATOM 73 CA TYR A 5 11.914 -4.871 2.195 1.00 4.44 C ATOM 74 C TYR A 5 11.390 -4.427 3.557 1.00 12.52 C ATOM 75 O TYR A 5 11.302 -3.234 3.830 1.00 21.34 O ATOM 76 CB TYR A 5 13.434 -4.646 2.111 1.00 54.43 C ATOM 77 CG TYR A 5 14.251 -5.537 3.035 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.399 -5.232 4.385 1.00 4.50 C ATOM 79 CD2 TYR A 5 14.872 -6.684 2.553 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.137 -6.043 5.225 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.614 -7.499 3.389 1.00 4.33 C ATOM 82 CZ TYR A 5 15.743 -7.176 4.723 1.00 33.20 C ATOM 83 OH TYR A 5 16.476 -7.992 5.562 1.00 31.30 O ATOM 0 H TYR A 5 11.133 -3.127 1.322 1.00 24.01 H new ATOM 0 HA TYR A 5 11.711 -5.934 2.067 1.00 4.44 H new ATOM 0 HB2 TYR A 5 13.758 -4.814 1.084 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.649 -3.604 2.347 1.00 54.43 H new ATOM 0 HD1 TYR A 5 13.928 -4.345 4.783 1.00 4.50 H new ATOM 0 HD2 TYR A 5 14.773 -6.943 1.509 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.239 -5.791 6.270 1.00 2.54 H new ATOM 0 HE2 TYR A 5 16.091 -8.386 2.998 1.00 4.33 H new ATOM 0 HH TYR A 5 17.136 -7.454 6.047 1.00 31.30 H new ATOM 93 N LYS A 6 11.032 -5.386 4.399 1.00 51.40 N ATOM 94 CA LYS A 6 10.565 -5.093 5.753 1.00 43.32 C ATOM 95 C LYS A 6 11.156 -6.090 6.746 1.00 62.42 C ATOM 96 O LYS A 6 11.261 -7.285 6.457 1.00 13.53 O ATOM 97 CB LYS A 6 9.021 -5.086 5.819 1.00 1.54 C ATOM 98 CG LYS A 6 8.454 -4.925 7.234 1.00 51.03 C ATOM 99 CD LYS A 6 6.985 -4.485 7.236 1.00 30.33 C ATOM 100 CE LYS A 6 6.835 -3.002 6.896 1.00 61.32 C ATOM 101 NZ LYS A 6 5.426 -2.534 7.007 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.055 -6.380 4.170 1.00 51.40 H new ATOM 0 HA LYS A 6 10.909 -4.095 6.027 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.645 -4.275 5.195 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.646 -6.017 5.393 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.547 -5.871 7.768 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.049 -4.192 7.778 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.426 -5.081 6.515 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.549 -4.679 8.216 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.464 -2.413 7.564 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.195 -2.826 5.882 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.401 -1.495 6.968 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.868 -2.923 6.220 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.023 -2.856 7.910 1.00 4.41 H new ATOM 115 N THR A 7 11.563 -5.580 7.903 1.00 30.21 N ATOM 116 CA THR A 7 12.158 -6.392 8.956 1.00 33.22 C ATOM 117 C THR A 7 11.678 -5.879 10.317 1.00 54.23 C ATOM 118 O THR A 7 11.436 -4.677 10.484 1.00 73.02 O ATOM 119 CB THR A 7 13.713 -6.366 8.863 1.00 43.13 C ATOM 120 OG1 THR A 7 14.306 -7.248 9.830 1.00 11.53 O ATOM 121 CG2 THR A 7 14.266 -4.956 9.056 1.00 62.33 C ATOM 0 H THR A 7 11.489 -4.590 8.137 1.00 30.21 H new ATOM 0 HA THR A 7 11.843 -7.428 8.835 1.00 33.22 H new ATOM 0 HB THR A 7 13.973 -6.708 7.861 1.00 43.13 H new ATOM 0 HG1 THR A 7 14.348 -6.799 10.700 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.353 -4.979 8.984 1.00 62.33 H new ATOM 0 HG22 THR A 7 13.865 -4.299 8.284 1.00 62.33 H new ATOM 0 HG23 THR A 7 13.975 -4.582 10.038 1.00 62.33 H new ATOM 129 N ALA A 8 11.515 -6.787 11.277 1.00 51.42 N ATOM 130 CA ALA A 8 10.955 -6.440 12.587 1.00 62.45 C ATOM 131 C ALA A 8 11.964 -6.673 13.711 1.00 64.34 C ATOM 132 O ALA A 8 12.873 -7.497 13.588 1.00 4.53 O ATOM 133 CB ALA A 8 9.686 -7.245 12.842 1.00 11.23 C ATOM 0 H ALA A 8 11.762 -7.771 11.175 1.00 51.42 H new ATOM 0 HA ALA A 8 10.712 -5.377 12.576 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.277 -6.981 13.817 1.00 11.23 H new ATOM 0 HB2 ALA A 8 8.952 -7.022 12.068 1.00 11.23 H new ATOM 0 HB3 ALA A 8 9.920 -8.309 12.823 1.00 11.23 H new ATOM 139 N ALA A 9 11.797 -5.937 14.809 1.00 62.04 N ATOM 140 CA ALA A 9 12.644 -6.093 15.988 1.00 13.24 C ATOM 141 C ALA A 9 11.813 -6.022 17.260 1.00 53.42 C ATOM 142 O ALA A 9 11.144 -5.026 17.511 1.00 45.34 O ATOM 143 CB ALA A 9 13.732 -5.029 16.012 1.00 65.14 C ATOM 0 H ALA A 9 11.076 -5.222 14.905 1.00 62.04 H new ATOM 0 HA ALA A 9 13.117 -7.074 15.937 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.352 -5.163 16.898 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.350 -5.121 15.119 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.274 -4.040 16.036 1.00 65.14 H new ATOM 149 N THR A 10 11.860 -7.082 18.053 1.00 61.23 N ATOM 150 CA THR A 10 11.148 -7.139 19.316 1.00 51.35 C ATOM 151 C THR A 10 12.105 -6.820 20.466 1.00 43.21 C ATOM 152 O THR A 10 13.093 -7.525 20.691 1.00 73.43 O ATOM 153 CB THR A 10 10.481 -8.524 19.526 1.00 34.35 C ATOM 154 OG1 THR A 10 9.801 -8.567 20.787 1.00 3.15 O ATOM 155 CG2 THR A 10 11.501 -9.662 19.451 1.00 70.40 C ATOM 0 H THR A 10 12.393 -7.925 17.837 1.00 61.23 H new ATOM 0 HA THR A 10 10.354 -6.393 19.297 1.00 51.35 H new ATOM 0 HB THR A 10 9.760 -8.662 18.720 1.00 34.35 H new ATOM 0 HG1 THR A 10 9.384 -9.446 20.904 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.995 -10.615 19.603 1.00 70.40 H new ATOM 0 HG22 THR A 10 11.980 -9.658 18.472 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.256 -9.525 20.225 1.00 70.40 H new ATOM 163 N SER A 11 11.841 -5.719 21.154 1.00 71.32 N ATOM 164 CA SER A 11 12.655 -5.303 22.283 1.00 2.43 C ATOM 165 C SER A 11 11.916 -5.520 23.606 1.00 11.12 C ATOM 166 O SER A 11 10.856 -4.939 23.844 1.00 53.54 O ATOM 167 CB SER A 11 13.086 -3.841 22.117 1.00 22.21 C ATOM 168 OG SER A 11 11.989 -3.001 21.805 1.00 52.01 O ATOM 0 H SER A 11 11.062 -5.094 20.946 1.00 71.32 H new ATOM 0 HA SER A 11 13.552 -5.922 22.308 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.559 -3.495 23.036 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.834 -3.770 21.327 1.00 22.21 H new ATOM 0 HG SER A 11 11.176 -3.542 21.723 1.00 52.01 H new ATOM 174 N THR A 12 12.477 -6.389 24.440 1.00 54.12 N ATOM 175 CA THR A 12 11.930 -6.702 25.750 1.00 52.53 C ATOM 176 C THR A 12 12.360 -5.652 26.778 1.00 72.12 C ATOM 177 O THR A 12 13.399 -4.999 26.613 1.00 13.04 O ATOM 178 CB THR A 12 12.429 -8.090 26.215 1.00 35.03 C ATOM 179 OG1 THR A 12 12.471 -8.992 25.094 1.00 61.53 O ATOM 180 CG2 THR A 12 11.534 -8.670 27.308 1.00 33.34 C ATOM 0 H THR A 12 13.332 -6.899 24.221 1.00 54.12 H new ATOM 0 HA THR A 12 10.843 -6.706 25.671 1.00 52.53 H new ATOM 0 HB THR A 12 13.430 -7.966 26.629 1.00 35.03 H new ATOM 0 HG1 THR A 12 12.537 -9.914 25.419 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.915 -9.646 27.610 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.529 -8.000 28.168 1.00 33.34 H new ATOM 0 HG23 THR A 12 10.519 -8.779 26.927 1.00 33.34 H new ATOM 188 N GLY A 13 11.569 -5.500 27.836 1.00 62.44 N ATOM 189 CA GLY A 13 11.885 -4.540 28.878 1.00 34.44 C ATOM 190 C GLY A 13 12.749 -5.127 29.984 1.00 13.14 C ATOM 191 O GLY A 13 12.252 -5.428 31.072 1.00 50.55 O ATOM 0 H GLY A 13 10.710 -6.028 27.990 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.401 -3.688 28.435 1.00 34.44 H new ATOM 0 HA3 GLY A 13 10.958 -4.163 29.310 1.00 34.44 H new ATOM 195 N GLY A 14 14.040 -5.322 29.697 1.00 62.02 N ATOM 196 CA GLY A 14 14.986 -5.738 30.726 1.00 43.32 C ATOM 197 C GLY A 14 15.323 -4.605 31.690 1.00 33.13 C ATOM 198 O GLY A 14 14.424 -3.923 32.191 1.00 44.52 O ATOM 0 H GLY A 14 14.447 -5.199 28.770 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.568 -6.576 31.284 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.901 -6.095 30.253 1.00 43.32 H new ATOM 202 N ARG A 15 16.614 -4.398 31.959 1.00 24.13 N ATOM 203 CA ARG A 15 17.048 -3.289 32.816 1.00 34.21 C ATOM 204 C ARG A 15 16.634 -1.950 32.209 1.00 4.22 C ATOM 205 O ARG A 15 15.952 -1.148 32.853 1.00 73.04 O ATOM 206 CB ARG A 15 18.571 -3.319 33.027 1.00 34.44 C ATOM 207 CG ARG A 15 19.027 -4.202 34.184 1.00 1.44 C ATOM 208 CD ARG A 15 18.668 -3.593 35.537 1.00 44.04 C ATOM 209 NE ARG A 15 19.137 -4.421 36.650 1.00 64.51 N ATOM 210 CZ ARG A 15 19.736 -3.949 37.747 1.00 22.54 C ATOM 211 NH1 ARG A 15 19.999 -2.649 37.871 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 20.092 -4.786 38.714 1.00 44.23 N ATOM 0 H ARG A 15 17.373 -4.978 31.600 1.00 24.13 H new ATOM 0 HA ARG A 15 16.562 -3.405 33.785 1.00 34.21 H new ATOM 0 HB2 ARG A 15 19.046 -3.668 32.110 1.00 34.44 H new ATOM 0 HB3 ARG A 15 18.922 -2.302 33.201 1.00 34.44 H new ATOM 0 HG2 ARG A 15 18.566 -5.186 34.094 1.00 1.44 H new ATOM 0 HG3 ARG A 15 20.105 -4.349 34.126 1.00 1.44 H new ATOM 0 HD2 ARG A 15 19.106 -2.598 35.615 1.00 44.04 H new ATOM 0 HD3 ARG A 15 17.587 -3.472 35.605 1.00 44.04 H new ATOM 0 HE ARG A 15 18.996 -5.429 36.583 1.00 64.51 H new ATOM 0 HH11 ARG A 15 19.743 -2.003 37.124 1.00 12.40 H new ATOM 0 HH12 ARG A 15 20.457 -2.299 38.713 1.00 12.40 H new ATOM 0 HH21 ARG A 15 19.908 -5.785 38.618 1.00 44.23 H new ATOM 0 HH22 ARG A 15 20.550 -4.430 39.553 1.00 44.23 H new ATOM 226 N ASP A 16 17.050 -1.714 30.966 1.00 4.14 N ATOM 227 CA ASP A 16 16.655 -0.503 30.246 1.00 22.02 C ATOM 228 C ASP A 16 16.032 -0.875 28.909 1.00 52.02 C ATOM 229 O ASP A 16 15.007 -0.320 28.518 1.00 74.22 O ATOM 230 CB ASP A 16 17.872 0.402 30.028 1.00 50.13 C ATOM 231 CG ASP A 16 17.512 1.813 29.586 1.00 53.42 C ATOM 232 OD1 ASP A 16 16.443 2.317 29.996 1.00 45.04 O ATOM 233 OD2 ASP A 16 18.318 2.436 28.857 1.00 61.02 O1- ATOM 0 H ASP A 16 17.657 -2.341 30.438 1.00 4.14 H new ATOM 0 HA ASP A 16 15.919 0.038 30.841 1.00 22.02 H new ATOM 0 HB2 ASP A 16 18.445 0.456 30.954 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.521 -0.050 29.278 1.00 50.13 H new ATOM 238 N GLY A 17 16.641 -1.846 28.222 1.00 73.12 N ATOM 239 CA GLY A 17 16.031 -2.395 27.032 1.00 31.14 C ATOM 240 C GLY A 17 16.764 -3.622 26.541 1.00 63.12 C ATOM 241 O GLY A 17 17.959 -3.778 26.785 1.00 34.35 O ATOM 0 H GLY A 17 17.541 -2.255 28.473 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.992 -2.651 27.241 1.00 31.14 H new ATOM 0 HA3 GLY A 17 16.021 -1.639 26.247 1.00 31.14 H new ATOM 245 N ARG A 18 16.043 -4.499 25.867 1.00 71.41 N ATOM 246 CA ARG A 18 16.616 -5.710 25.298 1.00 64.41 C ATOM 247 C ARG A 18 16.084 -5.876 23.878 1.00 2.04 C ATOM 248 O ARG A 18 14.958 -6.305 23.685 1.00 73.24 O ATOM 249 CB ARG A 18 16.260 -6.910 26.202 1.00 30.54 C ATOM 250 CG ARG A 18 16.784 -8.270 25.738 1.00 21.30 C ATOM 251 CD ARG A 18 15.864 -8.920 24.712 1.00 2.42 C ATOM 252 NE ARG A 18 16.323 -10.244 24.299 1.00 61.43 N ATOM 253 CZ ARG A 18 15.530 -11.163 23.743 1.00 42.21 C ATOM 254 NH1 ARG A 18 14.228 -10.926 23.608 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 16.037 -12.317 23.329 1.00 11.32 N ATOM 0 H ARG A 18 15.043 -4.394 25.697 1.00 71.41 H new ATOM 0 HA ARG A 18 17.703 -5.650 25.247 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.646 -6.715 27.202 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.175 -6.969 26.285 1.00 30.54 H new ATOM 0 HG2 ARG A 18 17.777 -8.147 25.307 1.00 21.30 H new ATOM 0 HG3 ARG A 18 16.890 -8.930 26.599 1.00 21.30 H new ATOM 0 HD2 ARG A 18 14.861 -9.002 25.131 1.00 2.42 H new ATOM 0 HD3 ARG A 18 15.792 -8.276 23.836 1.00 2.42 H new ATOM 0 HE ARG A 18 17.305 -10.480 24.444 1.00 61.43 H new ATOM 0 HH11 ARG A 18 13.835 -10.041 23.929 1.00 65.11 H new ATOM 0 HH12 ARG A 18 13.623 -11.629 23.183 1.00 65.11 H new ATOM 0 HH21 ARG A 18 17.034 -12.503 23.435 1.00 11.32 H new ATOM 0 HH22 ARG A 18 15.430 -13.018 22.904 1.00 11.32 H new ATOM 269 N ALA A 19 16.895 -5.521 22.889 1.00 71.12 N ATOM 270 CA ALA A 19 16.432 -5.430 21.505 1.00 34.25 C ATOM 271 C ALA A 19 16.872 -6.641 20.689 1.00 41.03 C ATOM 272 O ALA A 19 18.061 -6.942 20.596 1.00 12.34 O ATOM 273 CB ALA A 19 16.950 -4.146 20.865 1.00 5.35 C ATOM 0 H ALA A 19 17.880 -5.290 23.018 1.00 71.12 H new ATOM 0 HA ALA A 19 15.342 -5.413 21.514 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.600 -4.086 19.834 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.580 -3.286 21.424 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.040 -4.147 20.879 1.00 5.35 H new ATOM 279 N THR A 20 15.908 -7.324 20.091 1.00 63.53 N ATOM 280 CA THR A 20 16.184 -8.458 19.222 1.00 0.02 C ATOM 281 C THR A 20 15.467 -8.281 17.892 1.00 61.21 C ATOM 282 O THR A 20 14.241 -8.321 17.830 1.00 50.32 O ATOM 283 CB THR A 20 15.733 -9.785 19.876 1.00 22.13 C ATOM 284 OG1 THR A 20 16.342 -9.916 21.167 1.00 4.20 O ATOM 285 CG2 THR A 20 16.106 -10.991 19.011 1.00 30.30 C ATOM 0 H THR A 20 14.916 -7.109 20.194 1.00 63.53 H new ATOM 0 HA THR A 20 17.261 -8.501 19.057 1.00 0.02 H new ATOM 0 HB THR A 20 14.648 -9.761 19.975 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.630 -10.843 21.300 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.774 -11.907 19.501 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.623 -10.904 18.038 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.187 -11.022 18.877 1.00 30.30 H new ATOM 293 N SER A 21 16.233 -8.076 16.831 1.00 52.22 N ATOM 294 CA SER A 21 15.664 -7.987 15.506 1.00 61.23 C ATOM 295 C SER A 21 15.115 -9.353 15.143 1.00 4.01 C ATOM 296 O SER A 21 15.894 -10.290 14.881 1.00 53.51 O ATOM 297 CB SER A 21 16.696 -7.512 14.487 1.00 62.30 C ATOM 298 OG SER A 21 16.143 -7.468 13.183 1.00 0.33 O ATOM 0 H SER A 21 17.247 -7.969 16.867 1.00 52.22 H new ATOM 0 HA SER A 21 14.862 -7.249 15.495 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.058 -6.522 14.766 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.557 -8.181 14.498 1.00 62.30 H new ATOM 0 HG SER A 21 15.165 -7.460 13.243 1.00 0.33 H new ATOM 304 N HIS A 22 13.768 -9.414 15.145 1.00 22.03 N ATOM 305 CA HIS A 22 12.968 -10.642 15.083 1.00 2.11 C ATOM 306 C HIS A 22 13.414 -11.581 13.980 1.00 71.44 C ATOM 307 O HIS A 22 13.379 -12.799 14.154 1.00 63.31 O ATOM 308 CB HIS A 22 11.489 -10.271 14.874 1.00 42.33 C ATOM 309 CG HIS A 22 10.588 -11.442 14.599 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.178 -11.795 13.332 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.005 -12.331 15.439 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.385 -12.847 13.403 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.262 -13.193 14.671 1.00 41.54 N ATOM 0 H HIS A 22 13.191 -8.574 15.192 1.00 22.03 H new ATOM 0 HA HIS A 22 13.107 -11.169 16.027 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.128 -9.751 15.762 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.417 -9.570 14.043 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.106 -12.357 16.514 1.00 33.23 H new ATOM 0 HE1 HIS A 22 8.916 -13.342 12.565 1.00 21.33 H new ATOM 0 HE2 HIS A 22 8.706 -13.973 15.022 1.00 41.54 H new ATOM 322 N ASP A 23 13.894 -11.019 12.886 1.00 65.30 N ATOM 323 CA ASP A 23 14.275 -11.811 11.718 1.00 52.23 C ATOM 324 C ASP A 23 15.654 -12.426 11.931 1.00 2.53 C ATOM 325 O ASP A 23 16.370 -12.725 10.974 1.00 21.54 O ATOM 326 CB ASP A 23 14.275 -10.926 10.462 1.00 41.44 C ATOM 327 CG ASP A 23 12.889 -10.422 10.096 1.00 73.43 C ATOM 328 OD1 ASP A 23 12.359 -10.837 9.041 1.00 71.33 O ATOM 329 OD2 ASP A 23 12.320 -9.615 10.864 1.00 13.13 O1- ATOM 0 H ASP A 23 14.032 -10.014 12.776 1.00 65.30 H new ATOM 0 HA ASP A 23 13.551 -12.614 11.582 1.00 52.23 H new ATOM 0 HB2 ASP A 23 14.935 -10.074 10.624 1.00 41.44 H new ATOM 0 HB3 ASP A 23 14.684 -11.492 9.625 1.00 41.44 H new ATOM 334 N GLN A 24 16.008 -12.611 13.210 1.00 30.45 N ATOM 335 CA GLN A 24 17.269 -13.219 13.612 1.00 23.53 C ATOM 336 C GLN A 24 18.428 -12.360 13.142 1.00 71.34 C ATOM 337 O GLN A 24 19.566 -12.821 13.033 1.00 22.01 O ATOM 338 CB GLN A 24 17.385 -14.655 13.073 1.00 42.54 C ATOM 339 CG GLN A 24 16.259 -15.576 13.536 1.00 72.53 C ATOM 340 CD GLN A 24 16.131 -15.635 15.050 1.00 14.50 C ATOM 341 OE1 GLN A 24 16.760 -16.468 15.705 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.313 -14.757 15.616 1.00 4.22 N ATOM 0 H GLN A 24 15.418 -12.338 13.996 1.00 30.45 H new ATOM 0 HA GLN A 24 17.300 -13.277 14.700 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.394 -14.625 11.983 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.340 -15.076 13.388 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.316 -15.233 13.109 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.436 -16.580 13.151 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.810 -14.083 15.039 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.187 -14.756 16.628 1.00 4.22 H new ATOM 351 N LYS A 25 18.125 -11.093 12.883 1.00 22.35 N ATOM 352 CA LYS A 25 19.131 -10.140 12.466 1.00 24.04 C ATOM 353 C LYS A 25 19.984 -9.756 13.672 1.00 45.31 C ATOM 354 O LYS A 25 21.210 -9.682 13.571 1.00 73.44 O ATOM 355 CB LYS A 25 18.492 -8.877 11.861 1.00 30.31 C ATOM 356 CG LYS A 25 17.440 -9.133 10.780 1.00 12.14 C ATOM 357 CD LYS A 25 18.052 -9.600 9.461 1.00 61.23 C ATOM 358 CE LYS A 25 16.983 -9.818 8.389 1.00 52.51 C ATOM 359 NZ LYS A 25 16.210 -8.575 8.091 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.184 -10.706 12.957 1.00 22.35 H new ATOM 0 HA LYS A 25 19.749 -10.604 11.697 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.032 -8.302 12.664 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.282 -8.257 11.437 1.00 30.31 H new ATOM 0 HG2 LYS A 25 16.735 -9.885 11.135 1.00 12.14 H new ATOM 0 HG3 LYS A 25 16.871 -8.219 10.609 1.00 12.14 H new ATOM 0 HD2 LYS A 25 18.772 -8.860 9.112 1.00 61.23 H new ATOM 0 HD3 LYS A 25 18.601 -10.528 9.622 1.00 61.23 H new ATOM 0 HE2 LYS A 25 17.457 -10.175 7.475 1.00 52.51 H new ATOM 0 HE3 LYS A 25 16.297 -10.599 8.718 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 15.852 -8.615 7.116 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 15.410 -8.497 8.751 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 16.830 -7.747 8.199 1.00 22.01 H new ATOM 373 N LEU A 26 19.339 -9.538 14.832 1.00 32.33 N ATOM 374 CA LEU A 26 20.069 -9.013 15.989 1.00 24.31 C ATOM 375 C LEU A 26 19.463 -9.480 17.299 1.00 21.31 C ATOM 376 O LEU A 26 18.268 -9.717 17.378 1.00 11.34 O ATOM 377 CB LEU A 26 20.068 -7.479 15.921 1.00 35.55 C ATOM 378 CG LEU A 26 20.568 -6.738 17.172 1.00 2.25 C ATOM 379 CD1 LEU A 26 22.041 -7.036 17.443 1.00 31.22 C ATOM 380 CD2 LEU A 26 20.328 -5.239 17.025 1.00 74.42 C ATOM 0 H LEU A 26 18.346 -9.712 14.987 1.00 32.33 H new ATOM 0 HA LEU A 26 21.091 -9.392 15.955 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.684 -7.174 15.075 1.00 35.55 H new ATOM 0 HB3 LEU A 26 19.051 -7.147 15.711 1.00 35.55 H new ATOM 0 HG LEU A 26 20.002 -7.097 18.032 1.00 2.25 H new ATOM 0 HD11 LEU A 26 22.363 -6.497 18.334 1.00 31.22 H new ATOM 0 HD12 LEU A 26 22.173 -8.107 17.599 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.640 -6.717 16.590 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.686 -4.724 17.917 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.865 -4.868 16.152 1.00 74.42 H new ATOM 0 HD23 LEU A 26 19.261 -5.052 16.901 1.00 74.42 H new ATOM 392 N ASP A 27 20.307 -9.620 18.317 1.00 3.11 N ATOM 393 CA ASP A 27 19.852 -9.901 19.669 1.00 12.11 C ATOM 394 C ASP A 27 20.867 -9.335 20.675 1.00 11.44 C ATOM 395 O ASP A 27 21.987 -9.826 20.801 1.00 42.31 O ATOM 396 CB ASP A 27 19.601 -11.419 19.851 1.00 5.04 C ATOM 397 CG ASP A 27 20.655 -12.162 20.665 1.00 74.13 C ATOM 398 OD1 ASP A 27 20.479 -12.298 21.899 1.00 54.23 O ATOM 399 OD2 ASP A 27 21.656 -12.632 20.075 1.00 11.42 O1- ATOM 0 H ASP A 27 21.320 -9.542 18.226 1.00 3.11 H new ATOM 0 HA ASP A 27 18.897 -9.409 19.855 1.00 12.11 H new ATOM 0 HB2 ASP A 27 18.632 -11.555 20.332 1.00 5.04 H new ATOM 0 HB3 ASP A 27 19.535 -11.880 18.866 1.00 5.04 H new ATOM 404 N VAL A 28 20.489 -8.231 21.314 1.00 5.03 N ATOM 405 CA VAL A 28 21.314 -7.583 22.343 1.00 42.02 C ATOM 406 C VAL A 28 20.452 -6.846 23.365 1.00 62.12 C ATOM 407 O VAL A 28 19.228 -6.804 23.256 1.00 32.30 O ATOM 408 CB VAL A 28 22.333 -6.566 21.756 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.539 -7.279 21.158 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.658 -5.656 20.730 1.00 1.00 C ATOM 0 H VAL A 28 19.604 -7.757 21.137 1.00 5.03 H new ATOM 0 HA VAL A 28 21.863 -8.395 22.820 1.00 42.02 H new ATOM 0 HB VAL A 28 22.696 -5.940 22.571 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.234 -6.542 20.755 1.00 34.22 H new ATOM 0 HG12 VAL A 28 24.037 -7.863 21.932 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.210 -7.942 20.358 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.389 -4.952 20.332 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.255 -6.260 19.917 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.848 -5.106 21.209 1.00 1.00 H new ATOM 420 N LYS A 29 21.120 -6.267 24.353 1.00 24.10 N ATOM 421 CA LYS A 29 20.475 -5.482 25.396 1.00 44.35 C ATOM 422 C LYS A 29 21.231 -4.177 25.603 1.00 43.02 C ATOM 423 O LYS A 29 22.455 -4.128 25.460 1.00 12.55 O ATOM 424 CB LYS A 29 20.425 -6.296 26.704 1.00 13.02 C ATOM 425 CG LYS A 29 20.632 -5.477 27.981 1.00 22.53 C ATOM 426 CD LYS A 29 20.705 -6.368 29.218 1.00 24.23 C ATOM 427 CE LYS A 29 21.009 -5.566 30.481 1.00 1.41 C ATOM 428 NZ LYS A 29 21.138 -6.444 31.674 1.00 62.42 N1+ ATOM 0 H LYS A 29 22.133 -6.329 24.454 1.00 24.10 H new ATOM 0 HA LYS A 29 19.455 -5.246 25.094 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.460 -6.799 26.765 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.188 -7.073 26.661 1.00 13.02 H new ATOM 0 HG2 LYS A 29 21.551 -4.897 27.896 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.814 -4.765 28.093 1.00 22.53 H new ATOM 0 HD2 LYS A 29 19.759 -6.895 29.342 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.476 -7.125 29.075 1.00 24.23 H new ATOM 0 HE2 LYS A 29 21.933 -5.004 30.341 1.00 1.41 H new ATOM 0 HE3 LYS A 29 20.215 -4.838 30.649 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 21.344 -5.863 32.512 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 20.248 -6.961 31.822 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 21.912 -7.122 31.524 1.00 62.42 H new ATOM 442 N LEU A 30 20.499 -3.118 25.922 1.00 2.53 N ATOM 443 CA LEU A 30 21.101 -1.851 26.263 1.00 41.03 C ATOM 444 C LEU A 30 20.597 -1.384 27.628 1.00 64.12 C ATOM 445 O LEU A 30 19.479 -1.732 28.056 1.00 54.30 O ATOM 446 CB LEU A 30 20.881 -0.790 25.156 1.00 11.12 C ATOM 447 CG LEU A 30 19.480 -0.669 24.522 1.00 54.41 C ATOM 448 CD1 LEU A 30 19.136 -1.875 23.646 1.00 21.32 C ATOM 449 CD2 LEU A 30 18.419 -0.432 25.586 1.00 54.12 C ATOM 0 H LEU A 30 19.479 -3.120 25.950 1.00 2.53 H new ATOM 0 HA LEU A 30 22.180 -1.988 26.333 1.00 41.03 H new ATOM 0 HB2 LEU A 30 21.142 0.183 25.573 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.591 -0.994 24.355 1.00 11.12 H new ATOM 0 HG LEU A 30 19.497 0.200 23.865 1.00 54.41 H new ATOM 0 HD11 LEU A 30 18.141 -1.744 23.222 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.866 -1.960 22.841 1.00 21.32 H new ATOM 0 HD13 LEU A 30 19.156 -2.782 24.251 1.00 21.32 H new ATOM 0 HD21 LEU A 30 17.441 -0.350 25.112 1.00 54.12 H new ATOM 0 HD22 LEU A 30 18.414 -1.266 26.287 1.00 54.12 H new ATOM 0 HD23 LEU A 30 18.641 0.491 26.122 1.00 54.12 H new ATOM 461 N SER A 31 21.434 -0.605 28.299 1.00 75.34 N ATOM 462 CA SER A 31 21.205 -0.189 29.674 1.00 34.22 C ATOM 463 C SER A 31 22.177 0.915 30.040 1.00 62.41 C ATOM 464 O SER A 31 23.354 0.654 30.302 1.00 64.13 O ATOM 465 CB SER A 31 21.357 -1.371 30.650 1.00 52.23 C ATOM 466 OG SER A 31 20.344 -2.344 30.452 1.00 11.31 O ATOM 0 H SER A 31 22.299 -0.241 27.900 1.00 75.34 H new ATOM 0 HA SER A 31 20.183 0.181 29.754 1.00 34.22 H new ATOM 0 HB2 SER A 31 22.336 -1.831 30.516 1.00 52.23 H new ATOM 0 HB3 SER A 31 21.315 -1.005 31.676 1.00 52.23 H new ATOM 0 HG SER A 31 19.706 -2.020 29.783 1.00 11.31 H new ATOM 472 N ALA A 32 21.690 2.146 30.031 1.00 52.21 N ATOM 473 CA ALA A 32 22.505 3.283 30.399 1.00 43.51 C ATOM 474 C ALA A 32 22.842 3.212 31.883 1.00 25.12 C ATOM 475 O ALA A 32 21.947 3.032 32.715 1.00 4.30 O ATOM 476 CB ALA A 32 21.780 4.585 30.075 1.00 22.44 C ATOM 0 H ALA A 32 20.731 2.379 29.772 1.00 52.21 H new ATOM 0 HA ALA A 32 23.431 3.259 29.824 1.00 43.51 H new ATOM 0 HB1 ALA A 32 22.407 5.431 30.358 1.00 22.44 H new ATOM 0 HB2 ALA A 32 21.572 4.629 29.006 1.00 22.44 H new ATOM 0 HB3 ALA A 32 20.842 4.627 30.629 1.00 22.44 H new ATOM 482 N PRO A 33 24.135 3.299 32.238 1.00 32.33 N ATOM 483 CA PRO A 33 24.560 3.361 33.634 1.00 35.40 C ATOM 484 C PRO A 33 23.755 4.407 34.402 1.00 50.42 C ATOM 485 O PRO A 33 23.442 5.471 33.861 1.00 70.53 O ATOM 486 CB PRO A 33 26.052 3.742 33.558 1.00 73.33 C ATOM 487 CG PRO A 33 26.317 4.063 32.120 1.00 10.15 C ATOM 488 CD PRO A 33 25.281 3.327 31.322 1.00 32.53 C ATOM 0 HA PRO A 33 24.402 2.422 34.164 1.00 35.40 H new ATOM 0 HB2 PRO A 33 26.270 4.598 34.197 1.00 73.33 H new ATOM 0 HB3 PRO A 33 26.683 2.921 33.898 1.00 73.33 H new ATOM 0 HG2 PRO A 33 26.252 5.137 31.944 1.00 10.15 H new ATOM 0 HG3 PRO A 33 27.321 3.753 31.832 1.00 10.15 H new ATOM 0 HD2 PRO A 33 25.044 3.842 30.391 1.00 32.53 H new ATOM 0 HD3 PRO A 33 25.612 2.323 31.055 1.00 32.53 H new ATOM 496 N ARG A 34 23.407 4.080 35.645 1.00 10.53 N ATOM 497 CA ARG A 34 22.564 4.910 36.484 1.00 33.33 C ATOM 498 C ARG A 34 22.945 6.377 36.398 1.00 40.12 C ATOM 499 O ARG A 34 22.316 7.109 35.642 1.00 0.24 O ATOM 500 CB ARG A 34 22.625 4.375 37.925 1.00 35.21 C ATOM 501 CG ARG A 34 21.270 3.999 38.498 1.00 34.41 C ATOM 502 CD ARG A 34 20.427 5.231 38.755 1.00 50.12 C ATOM 503 NE ARG A 34 21.060 6.112 39.746 1.00 3.50 N ATOM 504 CZ ARG A 34 20.627 7.333 40.080 1.00 2.33 C ATOM 505 NH1 ARG A 34 19.479 7.800 39.603 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 21.334 8.066 40.932 1.00 21.42 N ATOM 0 H ARG A 34 23.710 3.218 36.098 1.00 10.53 H new ATOM 0 HA ARG A 34 21.535 4.855 36.128 1.00 33.33 H new ATOM 0 HB2 ARG A 34 23.275 3.500 37.951 1.00 35.21 H new ATOM 0 HB3 ARG A 34 23.082 5.131 38.564 1.00 35.21 H new ATOM 0 HG2 ARG A 34 20.750 3.336 37.806 1.00 34.41 H new ATOM 0 HG3 ARG A 34 21.405 3.446 39.428 1.00 34.41 H new ATOM 0 HD2 ARG A 34 20.280 5.775 37.822 1.00 50.12 H new ATOM 0 HD3 ARG A 34 19.440 4.932 39.108 1.00 50.12 H new ATOM 0 HE ARG A 34 21.896 5.765 40.217 1.00 3.50 H new ATOM 0 HH11 ARG A 34 18.917 7.226 38.975 1.00 23.02 H new ATOM 0 HH12 ARG A 34 19.160 8.733 39.865 1.00 23.02 H new ATOM 0 HH21 ARG A 34 22.199 7.697 41.326 1.00 21.42 H new ATOM 0 HH22 ARG A 34 21.012 8.998 41.192 1.00 21.42 H new ATOM 520 N GLU A 35 23.959 6.777 37.155 1.00 72.31 N ATOM 521 CA GLU A 35 24.455 8.155 37.180 1.00 75.14 C ATOM 522 C GLU A 35 23.343 9.205 37.291 1.00 65.21 C ATOM 523 O GLU A 35 23.153 9.806 38.350 1.00 33.12 O ATOM 524 CB GLU A 35 25.375 8.435 35.983 1.00 20.34 C ATOM 525 CG GLU A 35 26.723 7.724 36.090 1.00 71.30 C ATOM 526 CD GLU A 35 27.723 8.158 35.030 1.00 31.03 C ATOM 527 OE1 GLU A 35 27.932 9.378 34.863 1.00 31.45 O ATOM 528 OE2 GLU A 35 28.332 7.280 34.381 1.00 43.03 O1- ATOM 0 H GLU A 35 24.469 6.150 37.777 1.00 72.31 H new ATOM 0 HA GLU A 35 25.041 8.248 38.094 1.00 75.14 H new ATOM 0 HB2 GLU A 35 24.876 8.121 35.066 1.00 20.34 H new ATOM 0 HB3 GLU A 35 25.542 9.509 35.903 1.00 20.34 H new ATOM 0 HG2 GLU A 35 27.147 7.912 37.077 1.00 71.30 H new ATOM 0 HG3 GLU A 35 26.565 6.648 36.011 1.00 71.30 H new ATOM 535 N LEU A 36 22.606 9.405 36.211 1.00 33.22 N ATOM 536 CA LEU A 36 21.553 10.417 36.168 1.00 32.24 C ATOM 537 C LEU A 36 20.263 9.801 36.681 1.00 55.25 C ATOM 538 O LEU A 36 19.572 10.357 37.534 1.00 40.24 O ATOM 539 CB LEU A 36 21.345 10.928 34.730 1.00 11.21 C ATOM 540 CG LEU A 36 22.422 11.886 34.183 1.00 24.22 C ATOM 541 CD1 LEU A 36 23.818 11.279 34.281 1.00 52.21 C ATOM 542 CD2 LEU A 36 22.106 12.258 32.737 1.00 63.44 C ATOM 0 H LEU A 36 22.716 8.878 35.345 1.00 33.22 H new ATOM 0 HA LEU A 36 21.844 11.262 36.792 1.00 32.24 H new ATOM 0 HB2 LEU A 36 21.285 10.066 34.066 1.00 11.21 H new ATOM 0 HB3 LEU A 36 20.381 11.434 34.683 1.00 11.21 H new ATOM 0 HG LEU A 36 22.411 12.787 34.797 1.00 24.22 H new ATOM 0 HD11 LEU A 36 24.550 11.984 33.886 1.00 52.21 H new ATOM 0 HD12 LEU A 36 24.049 11.063 35.324 1.00 52.21 H new ATOM 0 HD13 LEU A 36 23.855 10.356 33.703 1.00 52.21 H new ATOM 0 HD21 LEU A 36 22.872 12.935 32.360 1.00 63.44 H new ATOM 0 HD22 LEU A 36 22.086 11.356 32.125 1.00 63.44 H new ATOM 0 HD23 LEU A 36 21.134 12.749 32.692 1.00 63.44 H new ATOM 554 N GLY A 37 19.977 8.628 36.152 1.00 72.22 N ATOM 555 CA GLY A 37 18.782 7.905 36.502 1.00 12.23 C ATOM 556 C GLY A 37 18.544 6.776 35.536 1.00 31.23 C ATOM 557 O GLY A 37 17.406 6.512 35.152 1.00 41.24 O ATOM 0 H GLY A 37 20.568 8.154 35.469 1.00 72.22 H new ATOM 0 HA2 GLY A 37 18.872 7.512 37.515 1.00 12.23 H new ATOM 0 HA3 GLY A 37 17.927 8.581 36.497 1.00 12.23 H new ATOM 561 N GLY A 38 19.630 6.109 35.131 1.00 73.44 N ATOM 562 CA GLY A 38 19.516 5.062 34.143 1.00 31.42 C ATOM 563 C GLY A 38 19.036 3.755 34.739 1.00 22.15 C ATOM 564 O GLY A 38 18.112 3.726 35.551 1.00 21.21 O ATOM 0 H GLY A 38 20.576 6.280 35.472 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.825 5.377 33.362 1.00 31.42 H new ATOM 0 HA3 GLY A 38 20.485 4.907 33.668 1.00 31.42 H new ATOM 568 N ALA A 39 19.693 2.680 34.353 1.00 14.21 N ATOM 569 CA ALA A 39 19.299 1.331 34.761 1.00 43.43 C ATOM 570 C ALA A 39 20.372 0.688 35.629 1.00 63.22 C ATOM 571 O ALA A 39 20.164 -0.387 36.200 1.00 3.43 O ATOM 572 CB ALA A 39 19.025 0.475 33.532 1.00 5.43 C ATOM 0 H ALA A 39 20.514 2.708 33.749 1.00 14.21 H new ATOM 0 HA ALA A 39 18.387 1.403 35.354 1.00 43.43 H new ATOM 0 HB1 ALA A 39 18.732 -0.527 33.845 1.00 5.43 H new ATOM 0 HB2 ALA A 39 18.220 0.923 32.949 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.926 0.416 32.921 1.00 5.43 H new ATOM 578 N GLY A 40 21.521 1.355 35.714 1.00 15.31 N ATOM 579 CA GLY A 40 22.623 0.856 36.517 1.00 42.15 C ATOM 580 C GLY A 40 23.196 -0.437 35.970 1.00 45.53 C ATOM 581 O GLY A 40 23.029 -1.502 36.570 1.00 15.12 O ATOM 0 H GLY A 40 21.708 2.237 35.238 1.00 15.31 H new ATOM 0 HA2 GLY A 40 23.409 1.610 36.559 1.00 42.15 H new ATOM 0 HA3 GLY A 40 22.281 0.695 37.539 1.00 42.15 H new ATOM 585 N ALA A 41 23.864 -0.345 34.826 1.00 5.32 N ATOM 586 CA ALA A 41 24.464 -1.513 34.185 1.00 5.21 C ATOM 587 C ALA A 41 25.492 -1.079 33.149 1.00 44.21 C ATOM 588 O ALA A 41 25.625 0.110 32.856 1.00 13.22 O ATOM 589 CB ALA A 41 23.387 -2.385 33.541 1.00 40.21 C ATOM 0 H ALA A 41 24.005 0.529 34.320 1.00 5.32 H new ATOM 0 HA ALA A 41 24.971 -2.104 34.948 1.00 5.21 H new ATOM 0 HB1 ALA A 41 23.853 -3.250 33.069 1.00 40.21 H new ATOM 0 HB2 ALA A 41 22.687 -2.722 34.305 1.00 40.21 H new ATOM 0 HB3 ALA A 41 22.851 -1.806 32.789 1.00 40.21 H new ATOM 595 N GLU A 42 26.210 -2.050 32.595 1.00 32.32 N ATOM 596 CA GLU A 42 27.249 -1.787 31.601 1.00 71.23 C ATOM 597 C GLU A 42 26.719 -2.052 30.189 1.00 1.12 C ATOM 598 O GLU A 42 27.456 -2.504 29.307 1.00 55.43 O ATOM 599 CB GLU A 42 28.475 -2.667 31.893 1.00 42.31 C ATOM 600 CG GLU A 42 28.180 -4.165 31.872 1.00 52.14 C ATOM 601 CD GLU A 42 29.411 -5.012 32.155 1.00 31.41 C ATOM 602 OE1 GLU A 42 30.343 -5.016 31.323 1.00 24.22 O ATOM 603 OE2 GLU A 42 29.446 -5.695 33.200 1.00 54.53 O1- ATOM 0 H GLU A 42 26.091 -3.038 32.820 1.00 32.32 H new ATOM 0 HA GLU A 42 27.543 -0.739 31.660 1.00 71.23 H new ATOM 0 HB2 GLU A 42 29.250 -2.449 31.158 1.00 42.31 H new ATOM 0 HB3 GLU A 42 28.878 -2.400 32.870 1.00 42.31 H new ATOM 0 HG2 GLU A 42 27.412 -4.390 32.612 1.00 52.14 H new ATOM 0 HG3 GLU A 42 27.773 -4.437 30.898 1.00 52.14 H new ATOM 610 N GLY A 43 25.439 -1.752 29.978 1.00 3.30 N ATOM 611 CA GLY A 43 24.817 -1.978 28.686 1.00 20.41 C ATOM 612 C GLY A 43 25.107 -0.854 27.709 1.00 55.55 C ATOM 613 O GLY A 43 26.019 -0.053 27.926 1.00 25.21 O ATOM 0 H GLY A 43 24.820 -1.354 30.684 1.00 3.30 H new ATOM 0 HA2 GLY A 43 25.176 -2.920 28.271 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.739 -2.077 28.815 1.00 20.41 H new ATOM 617 N THR A 44 24.330 -0.779 26.635 1.00 1.14 N ATOM 618 CA THR A 44 24.517 0.260 25.633 1.00 0.00 C ATOM 619 C THR A 44 23.606 1.445 25.948 1.00 54.32 C ATOM 620 O THR A 44 22.573 1.281 26.597 1.00 53.24 O ATOM 621 CB THR A 44 24.222 -0.285 24.211 1.00 74.01 C ATOM 622 OG1 THR A 44 25.024 -1.448 23.966 1.00 60.01 O ATOM 623 CG2 THR A 44 24.506 0.760 23.133 1.00 54.14 C ATOM 0 H THR A 44 23.566 -1.425 26.437 1.00 1.14 H new ATOM 0 HA THR A 44 25.556 0.589 25.658 1.00 0.00 H new ATOM 0 HB THR A 44 23.163 -0.539 24.165 1.00 74.01 H new ATOM 0 HG1 THR A 44 24.835 -1.792 23.068 1.00 60.01 H new ATOM 0 HG21 THR A 44 24.287 0.339 22.152 1.00 54.14 H new ATOM 0 HG22 THR A 44 23.879 1.635 23.301 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.555 1.052 23.177 1.00 54.14 H new ATOM 631 N ASN A 45 24.010 2.636 25.523 1.00 72.33 N ATOM 632 CA ASN A 45 23.197 3.836 25.700 1.00 33.43 C ATOM 633 C ASN A 45 22.325 4.037 24.461 1.00 24.30 C ATOM 634 O ASN A 45 22.858 4.200 23.363 1.00 63.01 O ATOM 635 CB ASN A 45 24.091 5.071 25.906 1.00 4.20 C ATOM 636 CG ASN A 45 25.057 4.921 27.067 1.00 5.33 C ATOM 637 OD1 ASN A 45 26.180 4.438 26.897 1.00 50.31 O ATOM 638 ND2 ASN A 45 24.637 5.341 28.251 1.00 41.45 N ATOM 0 H ASN A 45 24.900 2.798 25.051 1.00 72.33 H new ATOM 0 HA ASN A 45 22.570 3.712 26.583 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.656 5.259 24.993 1.00 4.20 H new ATOM 0 HB3 ASN A 45 23.461 5.944 26.076 1.00 4.20 H new ATOM 0 HD21 ASN A 45 25.249 5.271 29.064 1.00 41.45 H new ATOM 0 HD22 ASN A 45 23.701 5.734 28.350 1.00 41.45 H new ATOM 645 N PRO A 46 20.985 4.000 24.610 1.00 63.04 N ATOM 646 CA PRO A 46 20.044 4.209 23.496 1.00 61.02 C ATOM 647 C PRO A 46 20.443 5.375 22.579 1.00 4.44 C ATOM 648 O PRO A 46 20.517 5.214 21.359 1.00 23.02 O ATOM 649 CB PRO A 46 18.729 4.508 24.219 1.00 23.35 C ATOM 650 CG PRO A 46 18.816 3.705 25.472 1.00 42.23 C ATOM 651 CD PRO A 46 20.271 3.727 25.878 1.00 1.14 C ATOM 0 HA PRO A 46 20.003 3.349 22.827 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.624 5.572 24.433 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.868 4.217 23.618 1.00 23.35 H new ATOM 0 HG2 PRO A 46 18.186 4.131 26.253 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.472 2.684 25.306 1.00 42.23 H new ATOM 0 HD2 PRO A 46 20.467 4.499 26.622 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.579 2.777 26.315 1.00 1.14 H new ATOM 659 N GLU A 47 20.721 6.531 23.180 1.00 25.31 N ATOM 660 CA GLU A 47 21.110 7.726 22.424 1.00 53.11 C ATOM 661 C GLU A 47 22.374 7.456 21.606 1.00 42.42 C ATOM 662 O GLU A 47 22.482 7.855 20.445 1.00 0.52 O ATOM 663 CB GLU A 47 21.344 8.911 23.375 1.00 52.55 C ATOM 664 CG GLU A 47 20.218 9.129 24.383 1.00 35.10 C ATOM 665 CD GLU A 47 18.841 9.164 23.736 1.00 32.04 C ATOM 666 OE1 GLU A 47 18.108 8.157 23.844 1.00 53.13 O ATOM 667 OE2 GLU A 47 18.499 10.190 23.112 1.00 62.13 O1- ATOM 0 H GLU A 47 20.685 6.668 24.190 1.00 25.31 H new ATOM 0 HA GLU A 47 20.298 7.977 21.742 1.00 53.11 H new ATOM 0 HB2 GLU A 47 22.276 8.751 23.916 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.470 9.818 22.784 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.244 8.333 25.127 1.00 35.10 H new ATOM 0 HG3 GLU A 47 20.388 10.066 24.913 1.00 35.10 H new ATOM 674 N GLN A 48 23.325 6.763 22.227 1.00 41.14 N ATOM 675 CA GLN A 48 24.578 6.399 21.577 1.00 71.11 C ATOM 676 C GLN A 48 24.308 5.436 20.423 1.00 34.04 C ATOM 677 O GLN A 48 24.933 5.526 19.368 1.00 32.22 O ATOM 678 CB GLN A 48 25.523 5.781 22.623 1.00 12.45 C ATOM 679 CG GLN A 48 26.871 5.288 22.094 1.00 72.35 C ATOM 680 CD GLN A 48 26.829 3.854 21.579 1.00 3.55 C ATOM 681 OE1 GLN A 48 27.021 2.898 22.476 1.00 43.42 O flip ATOM 682 NE2 GLN A 48 26.622 3.605 20.396 1.00 72.04 N flip ATOM 0 H GLN A 48 23.248 6.440 23.191 1.00 41.14 H new ATOM 0 HA GLN A 48 25.056 7.285 21.158 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.708 6.522 23.400 1.00 12.45 H new ATOM 0 HB3 GLN A 48 25.012 4.943 23.097 1.00 12.45 H new ATOM 0 HG2 GLN A 48 27.200 5.946 21.290 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.613 5.360 22.889 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.478 4.366 19.732 1.00 72.04 H new ATOM 0 HE22 GLN A 48 26.594 2.637 20.076 1.00 72.04 H new ATOM 691 N LEU A 49 23.352 4.536 20.632 1.00 51.33 N ATOM 692 CA LEU A 49 22.983 3.546 19.625 1.00 61.13 C ATOM 693 C LEU A 49 22.440 4.256 18.381 1.00 21.55 C ATOM 694 O LEU A 49 22.818 3.933 17.252 1.00 71.11 O ATOM 695 CB LEU A 49 21.947 2.568 20.221 1.00 4.20 C ATOM 696 CG LEU A 49 21.706 1.248 19.454 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.906 1.475 18.173 1.00 0.52 C ATOM 698 CD2 LEU A 49 23.033 0.554 19.146 1.00 52.41 C ATOM 0 H LEU A 49 22.815 4.472 21.497 1.00 51.33 H new ATOM 0 HA LEU A 49 23.859 2.970 19.326 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.261 2.318 21.235 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.994 3.092 20.302 1.00 4.20 H new ATOM 0 HG LEU A 49 21.114 0.598 20.098 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.758 0.523 17.663 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.937 1.908 18.421 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.451 2.156 17.519 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.842 -0.373 18.606 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.653 1.209 18.534 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.552 0.330 20.078 1.00 52.41 H new ATOM 710 N PHE A 50 21.563 5.234 18.603 1.00 3.42 N ATOM 711 CA PHE A 50 21.008 6.035 17.514 1.00 25.51 C ATOM 712 C PHE A 50 22.105 6.849 16.830 1.00 64.45 C ATOM 713 O PHE A 50 22.143 6.943 15.610 1.00 15.22 O ATOM 714 CB PHE A 50 19.902 6.969 18.033 1.00 52.14 C ATOM 715 CG PHE A 50 19.449 8.003 17.025 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.649 7.652 15.944 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.819 9.333 17.168 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.232 8.601 15.033 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.405 10.283 16.257 1.00 34.34 C ATOM 720 CZ PHE A 50 18.610 9.918 15.188 1.00 61.21 C ATOM 0 H PHE A 50 21.221 5.491 19.529 1.00 3.42 H new ATOM 0 HA PHE A 50 20.572 5.354 16.783 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.044 6.368 18.333 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.261 7.480 18.926 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.350 6.622 15.815 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.438 9.628 18.002 1.00 31.01 H new ATOM 0 HE1 PHE A 50 17.610 8.312 14.199 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.703 11.314 16.380 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.285 10.662 14.476 1.00 61.21 H new ATOM 730 N ALA A 51 22.983 7.444 17.633 1.00 33.43 N ATOM 731 CA ALA A 51 24.115 8.216 17.119 1.00 33.33 C ATOM 732 C ALA A 51 24.992 7.370 16.199 1.00 4.13 C ATOM 733 O ALA A 51 25.260 7.750 15.057 1.00 52.03 O ATOM 734 CB ALA A 51 24.938 8.754 18.280 1.00 51.41 C ATOM 0 H ALA A 51 22.933 7.407 18.651 1.00 33.43 H new ATOM 0 HA ALA A 51 23.724 9.048 16.534 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.780 9.328 17.894 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.314 9.397 18.901 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.310 7.922 18.878 1.00 51.41 H new ATOM 740 N ALA A 52 25.417 6.212 16.698 1.00 32.43 N ATOM 741 CA ALA A 52 26.283 5.314 15.943 1.00 41.10 C ATOM 742 C ALA A 52 25.568 4.812 14.693 1.00 30.53 C ATOM 743 O ALA A 52 26.149 4.762 13.609 1.00 13.40 O ATOM 744 CB ALA A 52 26.724 4.145 16.818 1.00 51.43 C ATOM 0 H ALA A 52 25.173 5.873 17.629 1.00 32.43 H new ATOM 0 HA ALA A 52 27.171 5.864 15.631 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.370 3.483 16.242 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.270 4.523 17.682 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.847 3.593 17.156 1.00 51.43 H new ATOM 750 N GLY A 53 24.298 4.457 14.861 1.00 32.23 N ATOM 751 CA GLY A 53 23.496 3.985 13.750 1.00 45.35 C ATOM 752 C GLY A 53 23.300 5.047 12.687 1.00 24.44 C ATOM 753 O GLY A 53 23.435 4.774 11.502 1.00 23.31 O ATOM 0 H GLY A 53 23.808 4.489 15.755 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.975 3.113 13.305 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.523 3.661 14.120 1.00 45.35 H new ATOM 757 N TYR A 54 22.998 6.263 13.123 1.00 20.42 N ATOM 758 CA TYR A 54 22.773 7.385 12.212 1.00 1.52 C ATOM 759 C TYR A 54 24.062 7.722 11.463 1.00 10.14 C ATOM 760 O TYR A 54 24.037 7.988 10.261 1.00 3.35 O ATOM 761 CB TYR A 54 22.255 8.604 13.000 1.00 4.31 C ATOM 762 CG TYR A 54 21.947 9.848 12.171 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.762 9.787 10.790 1.00 61.33 C ATOM 764 CD2 TYR A 54 21.840 11.094 12.785 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.490 10.926 10.052 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.563 12.233 12.054 1.00 14.31 C ATOM 767 CZ TYR A 54 21.391 12.145 10.688 1.00 61.32 C ATOM 768 OH TYR A 54 21.119 13.280 9.955 1.00 14.13 O ATOM 0 H TYR A 54 22.902 6.502 14.110 1.00 20.42 H new ATOM 0 HA TYR A 54 22.018 7.106 11.477 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.350 8.311 13.532 1.00 4.31 H new ATOM 0 HB3 TYR A 54 22.997 8.867 13.754 1.00 4.31 H new ATOM 0 HD1 TYR A 54 21.832 8.834 10.287 1.00 61.33 H new ATOM 0 HD2 TYR A 54 21.976 11.171 13.854 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.356 10.860 8.982 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.481 13.189 12.550 1.00 14.31 H new ATOM 0 HH TYR A 54 21.081 14.055 10.554 1.00 14.13 H new ATOM 778 N SER A 55 25.184 7.688 12.172 1.00 11.10 N ATOM 779 CA SER A 55 26.480 7.949 11.562 1.00 22.53 C ATOM 780 C SER A 55 26.783 6.893 10.498 1.00 50.31 C ATOM 781 O SER A 55 27.135 7.223 9.366 1.00 23.31 O ATOM 782 CB SER A 55 27.575 7.977 12.632 1.00 0.44 C ATOM 783 OG SER A 55 27.310 8.977 13.600 1.00 35.10 O ATOM 0 H SER A 55 25.221 7.482 13.170 1.00 11.10 H new ATOM 0 HA SER A 55 26.454 8.925 11.078 1.00 22.53 H new ATOM 0 HB2 SER A 55 27.640 7.003 13.117 1.00 0.44 H new ATOM 0 HB3 SER A 55 28.541 8.165 12.164 1.00 0.44 H new ATOM 0 HG SER A 55 26.614 8.662 14.213 1.00 35.10 H new ATOM 789 N ALA A 56 26.612 5.625 10.860 1.00 25.24 N ATOM 790 CA ALA A 56 26.821 4.524 9.925 1.00 63.14 C ATOM 791 C ALA A 56 25.887 4.660 8.725 1.00 34.41 C ATOM 792 O ALA A 56 26.313 4.559 7.571 1.00 72.41 O ATOM 793 CB ALA A 56 26.613 3.189 10.630 1.00 2.41 C ATOM 0 H ALA A 56 26.329 5.334 11.796 1.00 25.24 H new ATOM 0 HA ALA A 56 27.847 4.561 9.560 1.00 63.14 H new ATOM 0 HB1 ALA A 56 26.772 2.375 9.922 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.322 3.098 11.453 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.596 3.138 11.020 1.00 2.41 H new ATOM 799 N CYS A 57 24.614 4.913 9.017 1.00 43.11 N ATOM 800 CA CYS A 57 23.610 5.161 7.992 1.00 65.50 C ATOM 801 C CYS A 57 24.038 6.313 7.088 1.00 1.30 C ATOM 802 O CYS A 57 23.776 6.297 5.887 1.00 31.43 O ATOM 803 CB CYS A 57 22.246 5.464 8.629 1.00 74.40 C ATOM 804 SG CYS A 57 21.543 4.087 9.569 1.00 3.24 S ATOM 0 H CYS A 57 24.252 4.951 9.970 1.00 43.11 H new ATOM 0 HA CYS A 57 23.516 4.260 7.386 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.349 6.325 9.290 1.00 74.40 H new ATOM 0 HB3 CYS A 57 21.546 5.748 7.843 1.00 74.40 H new ATOM 0 HG CYS A 57 22.259 3.878 10.634 1.00 3.24 H new ATOM 810 N PHE A 58 24.691 7.316 7.680 1.00 12.51 N ATOM 811 CA PHE A 58 25.141 8.485 6.938 1.00 55.51 C ATOM 812 C PHE A 58 26.121 8.057 5.844 1.00 60.31 C ATOM 813 O PHE A 58 26.063 8.549 4.716 1.00 54.45 O ATOM 814 CB PHE A 58 25.795 9.493 7.896 1.00 64.12 C ATOM 815 CG PHE A 58 25.771 10.921 7.412 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.858 11.468 6.745 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.656 11.718 7.636 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.831 12.782 6.314 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.625 13.030 7.207 1.00 51.42 C ATOM 820 CZ PHE A 58 25.714 13.563 6.545 1.00 5.31 C ATOM 0 H PHE A 58 24.918 7.337 8.674 1.00 12.51 H new ATOM 0 HA PHE A 58 24.285 8.967 6.466 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.288 9.441 8.860 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.830 9.197 8.064 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.733 10.862 6.561 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.802 11.306 8.153 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.683 13.198 5.797 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.751 13.638 7.389 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.693 14.589 6.208 1.00 5.31 H new ATOM 830 N LEU A 59 27.002 7.113 6.183 1.00 64.51 N ATOM 831 CA LEU A 59 27.959 6.568 5.219 1.00 63.33 C ATOM 832 C LEU A 59 27.239 5.746 4.151 1.00 14.15 C ATOM 833 O LEU A 59 27.437 5.967 2.956 1.00 3.51 O ATOM 834 CB LEU A 59 29.029 5.702 5.916 1.00 74.12 C ATOM 835 CG LEU A 59 30.170 6.467 6.618 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.865 7.421 5.649 1.00 61.22 C ATOM 837 CD2 LEU A 59 29.663 7.216 7.846 1.00 2.33 C ATOM 0 H LEU A 59 27.072 6.711 7.118 1.00 64.51 H new ATOM 0 HA LEU A 59 28.459 7.411 4.742 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.533 5.072 6.655 1.00 74.12 H new ATOM 0 HB3 LEU A 59 29.469 5.036 5.173 1.00 74.12 H new ATOM 0 HG LEU A 59 30.901 5.732 6.955 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.665 7.948 6.168 1.00 61.22 H new ATOM 0 HD12 LEU A 59 31.284 6.854 4.818 1.00 61.22 H new ATOM 0 HD13 LEU A 59 30.143 8.143 5.268 1.00 61.22 H new ATOM 0 HD21 LEU A 59 30.491 7.744 8.318 1.00 2.33 H new ATOM 0 HD22 LEU A 59 28.899 7.933 7.545 1.00 2.33 H new ATOM 0 HD23 LEU A 59 29.235 6.506 8.554 1.00 2.33 H new ATOM 849 N SER A 60 26.406 4.804 4.587 1.00 34.05 N ATOM 850 CA SER A 60 25.667 3.938 3.667 1.00 74.40 C ATOM 851 C SER A 60 24.829 4.767 2.687 1.00 42.34 C ATOM 852 O SER A 60 24.789 4.479 1.487 1.00 41.15 O ATOM 853 CB SER A 60 24.775 2.973 4.458 1.00 52.34 C ATOM 854 OG SER A 60 25.543 2.210 5.374 1.00 74.20 O ATOM 0 H SER A 60 26.225 4.619 5.574 1.00 34.05 H new ATOM 0 HA SER A 60 26.384 3.359 3.086 1.00 74.40 H new ATOM 0 HB2 SER A 60 24.012 3.535 4.997 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.254 2.307 3.771 1.00 52.34 H new ATOM 0 HG SER A 60 25.679 1.308 5.015 1.00 74.20 H new ATOM 860 N ALA A 61 24.187 5.811 3.202 1.00 5.22 N ATOM 861 CA ALA A 61 23.380 6.705 2.379 1.00 61.10 C ATOM 862 C ALA A 61 24.272 7.484 1.417 1.00 23.52 C ATOM 863 O ALA A 61 23.967 7.613 0.230 1.00 64.15 O ATOM 864 CB ALA A 61 22.576 7.659 3.257 1.00 23.00 C ATOM 0 H ALA A 61 24.211 6.059 4.191 1.00 5.22 H new ATOM 0 HA ALA A 61 22.680 6.106 1.796 1.00 61.10 H new ATOM 0 HB1 ALA A 61 21.980 8.319 2.627 1.00 23.00 H new ATOM 0 HB2 ALA A 61 21.916 7.086 3.908 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.257 8.255 3.865 1.00 23.00 H new ATOM 870 N MET A 62 25.390 7.982 1.944 1.00 1.42 N ATOM 871 CA MET A 62 26.375 8.709 1.146 1.00 22.23 C ATOM 872 C MET A 62 26.911 7.811 0.025 1.00 52.25 C ATOM 873 O MET A 62 27.240 8.289 -1.063 1.00 52.11 O ATOM 874 CB MET A 62 27.524 9.195 2.049 1.00 12.31 C ATOM 875 CG MET A 62 28.547 10.113 1.377 1.00 13.45 C ATOM 876 SD MET A 62 27.955 11.801 1.112 1.00 13.34 S ATOM 877 CE MET A 62 27.023 11.641 -0.409 1.00 61.32 C ATOM 0 H MET A 62 25.637 7.894 2.930 1.00 1.42 H new ATOM 0 HA MET A 62 25.898 9.578 0.692 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.095 9.721 2.902 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.047 8.323 2.442 1.00 12.31 H new ATOM 0 HG2 MET A 62 29.448 10.147 1.990 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.831 9.683 0.416 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.132 12.550 -1.000 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.399 10.791 -0.978 1.00 61.32 H new ATOM 0 HE3 MET A 62 25.970 11.485 -0.176 1.00 61.32 H new ATOM 887 N LYS A 63 26.982 6.504 0.297 1.00 50.31 N ATOM 888 CA LYS A 63 27.420 5.525 -0.698 1.00 32.21 C ATOM 889 C LYS A 63 26.361 5.358 -1.786 1.00 55.33 C ATOM 890 O LYS A 63 26.671 5.415 -2.978 1.00 31.21 O ATOM 891 CB LYS A 63 27.720 4.165 -0.044 1.00 32.54 C ATOM 892 CG LYS A 63 28.939 4.168 0.878 1.00 62.32 C ATOM 893 CD LYS A 63 29.218 2.777 1.448 1.00 52.53 C ATOM 894 CE LYS A 63 30.452 2.761 2.342 1.00 52.13 C ATOM 895 NZ LYS A 63 30.746 1.396 2.856 1.00 51.23 N1+ ATOM 0 H LYS A 63 26.740 6.100 1.202 1.00 50.31 H new ATOM 0 HA LYS A 63 28.339 5.898 -1.150 1.00 32.21 H new ATOM 0 HB2 LYS A 63 26.847 3.849 0.527 1.00 32.54 H new ATOM 0 HB3 LYS A 63 27.873 3.423 -0.828 1.00 32.54 H new ATOM 0 HG2 LYS A 63 29.812 4.518 0.327 1.00 62.32 H new ATOM 0 HG3 LYS A 63 28.776 4.871 1.695 1.00 62.32 H new ATOM 0 HD2 LYS A 63 28.353 2.439 2.019 1.00 52.53 H new ATOM 0 HD3 LYS A 63 29.355 2.071 0.629 1.00 52.53 H new ATOM 0 HE2 LYS A 63 31.311 3.131 1.782 1.00 52.13 H new ATOM 0 HE3 LYS A 63 30.302 3.440 3.181 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 31.706 1.375 3.256 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 30.057 1.147 3.595 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 30.681 0.710 2.077 1.00 51.23 H new ATOM 909 N PHE A 64 25.108 5.162 -1.369 1.00 54.13 N ATOM 910 CA PHE A 64 23.991 5.045 -2.309 1.00 15.41 C ATOM 911 C PHE A 64 23.943 6.273 -3.217 1.00 43.31 C ATOM 912 O PHE A 64 23.719 6.167 -4.425 1.00 31.42 O ATOM 913 CB PHE A 64 22.664 4.886 -1.550 1.00 54.23 C ATOM 914 CG PHE A 64 21.449 4.849 -2.448 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.228 3.773 -3.298 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.531 5.892 -2.443 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.120 3.740 -4.123 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.422 5.861 -3.265 1.00 31.33 C ATOM 919 CZ PHE A 64 19.215 4.785 -4.106 1.00 62.32 C ATOM 0 H PHE A 64 24.842 5.081 -0.388 1.00 54.13 H new ATOM 0 HA PHE A 64 24.141 4.158 -2.925 1.00 15.41 H new ATOM 0 HB2 PHE A 64 22.699 3.968 -0.964 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.558 5.710 -0.845 1.00 54.23 H new ATOM 0 HD1 PHE A 64 21.930 2.953 -3.314 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.687 6.737 -1.788 1.00 44.41 H new ATOM 0 HE1 PHE A 64 19.961 2.898 -4.781 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.716 6.678 -3.250 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.348 4.760 -4.749 1.00 62.32 H new ATOM 929 N VAL A 65 24.166 7.437 -2.619 1.00 22.12 N ATOM 930 CA VAL A 65 24.256 8.686 -3.362 1.00 1.13 C ATOM 931 C VAL A 65 25.440 8.647 -4.327 1.00 2.04 C ATOM 932 O VAL A 65 25.306 8.983 -5.506 1.00 1.42 O ATOM 933 CB VAL A 65 24.408 9.897 -2.410 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.784 11.153 -3.191 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.126 10.114 -1.603 1.00 41.32 C ATOM 0 H VAL A 65 24.289 7.541 -1.612 1.00 22.12 H new ATOM 0 HA VAL A 65 23.330 8.801 -3.925 1.00 1.13 H new ATOM 0 HB VAL A 65 25.215 9.684 -1.709 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.886 11.992 -2.503 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.730 10.991 -3.708 1.00 35.23 H new ATOM 0 HG13 VAL A 65 24.005 11.374 -3.921 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.254 10.970 -0.940 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.295 10.303 -2.283 1.00 41.32 H new ATOM 0 HG23 VAL A 65 22.914 9.224 -1.010 1.00 41.32 H new ATOM 945 N ALA A 66 26.589 8.220 -3.820 1.00 10.53 N ATOM 946 CA ALA A 66 27.808 8.135 -4.618 1.00 34.24 C ATOM 947 C ALA A 66 27.587 7.266 -5.851 1.00 52.01 C ATOM 948 O ALA A 66 28.117 7.546 -6.930 1.00 55.45 O ATOM 949 CB ALA A 66 28.956 7.581 -3.778 1.00 2.15 C ATOM 0 H ALA A 66 26.704 7.924 -2.851 1.00 10.53 H new ATOM 0 HA ALA A 66 28.070 9.140 -4.949 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.858 7.524 -4.387 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.134 8.238 -2.927 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.697 6.585 -3.419 1.00 2.15 H new ATOM 955 N GLY A 67 26.760 6.241 -5.682 1.00 41.30 N ATOM 956 CA GLY A 67 26.513 5.278 -6.742 1.00 41.44 C ATOM 957 C GLY A 67 25.743 5.880 -7.899 1.00 65.01 C ATOM 958 O GLY A 67 25.936 5.499 -9.054 1.00 24.21 O ATOM 0 H GLY A 67 26.249 6.057 -4.818 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.464 4.889 -7.105 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.956 4.432 -6.339 1.00 41.44 H new ATOM 962 N GLN A 68 24.884 6.843 -7.589 1.00 2.22 N ATOM 963 CA GLN A 68 24.053 7.490 -8.600 1.00 3.22 C ATOM 964 C GLN A 68 24.712 8.787 -9.046 1.00 13.50 C ATOM 965 O GLN A 68 24.373 9.349 -10.087 1.00 73.33 O ATOM 966 CB GLN A 68 22.639 7.740 -8.058 1.00 70.02 C ATOM 967 CG GLN A 68 22.619 8.413 -6.699 1.00 23.14 C ATOM 968 CD GLN A 68 21.212 8.660 -6.178 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.624 9.717 -6.411 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.663 7.685 -5.472 1.00 55.13 N ATOM 0 H GLN A 68 24.743 7.195 -6.642 1.00 2.22 H new ATOM 0 HA GLN A 68 23.960 6.833 -9.465 1.00 3.22 H new ATOM 0 HB2 GLN A 68 22.091 8.359 -8.768 1.00 70.02 H new ATOM 0 HB3 GLN A 68 22.111 6.789 -7.991 1.00 70.02 H new ATOM 0 HG2 GLN A 68 23.161 7.793 -5.985 1.00 23.14 H new ATOM 0 HG3 GLN A 68 23.149 9.363 -6.763 1.00 23.14 H new ATOM 0 HE21 GLN A 68 21.183 6.824 -5.301 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.720 7.794 -5.099 1.00 55.13 H new ATOM 979 N ASN A 69 25.676 9.243 -8.251 1.00 45.10 N ATOM 980 CA ASN A 69 26.456 10.436 -8.571 1.00 61.12 C ATOM 981 C ASN A 69 27.743 10.061 -9.288 1.00 41.24 C ATOM 982 O ASN A 69 28.538 10.928 -9.654 1.00 42.44 O ATOM 983 CB ASN A 69 26.761 11.237 -7.297 1.00 43.31 C ATOM 984 CG ASN A 69 25.627 12.177 -6.914 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.638 13.355 -7.265 1.00 73.01 O ATOM 986 ND2 ASN A 69 24.634 11.661 -6.209 1.00 73.35 N ATOM 0 H ASN A 69 25.938 8.799 -7.371 1.00 45.10 H new ATOM 0 HA ASN A 69 25.865 11.063 -9.239 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.950 10.547 -6.475 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.673 11.815 -7.445 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.843 12.245 -5.939 1.00 73.35 H new ATOM 0 HD22 ASN A 69 24.659 10.679 -5.936 1.00 73.35 H new ATOM 993 N LYS A 70 27.937 8.760 -9.470 1.00 63.25 N ATOM 994 CA LYS A 70 29.035 8.225 -10.273 1.00 32.31 C ATOM 995 C LYS A 70 30.386 8.609 -9.670 1.00 12.34 C ATOM 996 O LYS A 70 31.406 8.657 -10.362 1.00 70.50 O ATOM 997 CB LYS A 70 28.934 8.712 -11.732 1.00 4.35 C ATOM 998 CG LYS A 70 27.519 8.674 -12.332 1.00 13.20 C ATOM 999 CD LYS A 70 26.697 7.489 -11.826 1.00 32.43 C ATOM 1000 CE LYS A 70 25.489 7.199 -12.712 1.00 4.32 C ATOM 1001 NZ LYS A 70 24.538 8.342 -12.766 1.00 52.12 N1+ ATOM 0 H LYS A 70 27.336 8.042 -9.064 1.00 63.25 H new ATOM 0 HA LYS A 70 28.957 7.138 -10.270 1.00 32.31 H new ATOM 0 HB2 LYS A 70 29.308 9.735 -11.785 1.00 4.35 H new ATOM 0 HB3 LYS A 70 29.591 8.100 -12.350 1.00 4.35 H new ATOM 0 HG2 LYS A 70 27.000 9.601 -12.089 1.00 13.20 H new ATOM 0 HG3 LYS A 70 27.590 8.624 -13.419 1.00 13.20 H new ATOM 0 HD2 LYS A 70 27.331 6.604 -11.780 1.00 32.43 H new ATOM 0 HD3 LYS A 70 26.359 7.692 -10.810 1.00 32.43 H new ATOM 0 HE2 LYS A 70 25.829 6.965 -13.721 1.00 4.32 H new ATOM 0 HE3 LYS A 70 24.971 6.316 -12.338 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 23.610 8.006 -13.095 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 24.440 8.757 -11.817 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 24.898 9.063 -13.423 1.00 52.12 H new ATOM 1015 N GLN A 71 30.381 8.867 -8.370 1.00 41.25 N ATOM 1016 CA GLN A 71 31.594 9.204 -7.632 1.00 41.44 C ATOM 1017 C GLN A 71 31.963 8.057 -6.701 1.00 11.15 C ATOM 1018 O GLN A 71 31.161 7.148 -6.478 1.00 3.32 O ATOM 1019 CB GLN A 71 31.405 10.498 -6.824 1.00 65.11 C ATOM 1020 CG GLN A 71 30.129 10.516 -5.988 1.00 11.32 C ATOM 1021 CD GLN A 71 30.287 11.233 -4.659 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.516 10.456 -3.616 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 30.153 12.451 -4.563 1.00 60.02 N flip ATOM 0 H GLN A 71 29.538 8.849 -7.796 1.00 41.25 H new ATOM 0 HA GLN A 71 32.400 9.365 -8.347 1.00 41.44 H new ATOM 0 HB2 GLN A 71 32.263 10.633 -6.165 1.00 65.11 H new ATOM 0 HB3 GLN A 71 31.392 11.346 -7.509 1.00 65.11 H new ATOM 0 HG2 GLN A 71 29.336 10.998 -6.560 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.811 9.490 -5.803 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.977 13.012 -5.397 1.00 60.02 H new ATOM 0 HE22 GLN A 71 30.218 12.901 -3.650 1.00 60.02 H new ATOM 1032 N THR A 72 33.163 8.110 -6.146 1.00 0.13 N ATOM 1033 CA THR A 72 33.646 7.051 -5.268 1.00 33.54 C ATOM 1034 C THR A 72 34.044 7.613 -3.909 1.00 64.51 C ATOM 1035 O THR A 72 34.571 8.723 -3.811 1.00 2.32 O ATOM 1036 CB THR A 72 34.843 6.302 -5.896 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.846 7.235 -6.326 1.00 1.42 O ATOM 1038 CG2 THR A 72 34.399 5.448 -7.078 1.00 71.13 C ATOM 0 H THR A 72 33.823 8.875 -6.287 1.00 0.13 H new ATOM 0 HA THR A 72 32.829 6.343 -5.133 1.00 33.54 H new ATOM 0 HB THR A 72 35.262 5.646 -5.133 1.00 55.21 H new ATOM 0 HG1 THR A 72 36.599 6.747 -6.720 1.00 1.42 H new ATOM 0 HG21 THR A 72 35.262 4.933 -7.499 1.00 71.13 H new ATOM 0 HG22 THR A 72 33.667 4.714 -6.742 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.950 6.086 -7.839 1.00 71.13 H new ATOM 1046 N LEU A 73 33.757 6.852 -2.864 1.00 24.22 N ATOM 1047 CA LEU A 73 34.094 7.238 -1.501 1.00 2.33 C ATOM 1048 C LEU A 73 35.223 6.358 -0.964 1.00 44.11 C ATOM 1049 O LEU A 73 35.232 5.147 -1.204 1.00 52.40 O ATOM 1050 CB LEU A 73 32.856 7.114 -0.605 1.00 54.54 C ATOM 1051 CG LEU A 73 31.696 8.063 -0.941 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.475 7.734 -0.090 1.00 63.13 C ATOM 1053 CD2 LEU A 73 32.116 9.520 -0.751 1.00 44.41 C ATOM 0 H LEU A 73 33.285 5.951 -2.936 1.00 24.22 H new ATOM 0 HA LEU A 73 34.432 8.274 -1.501 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.491 6.089 -0.661 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.158 7.289 0.428 1.00 54.54 H new ATOM 0 HG LEU A 73 31.430 7.924 -1.989 1.00 53.14 H new ATOM 0 HD11 LEU A 73 29.662 8.416 -0.341 1.00 63.13 H new ATOM 0 HD12 LEU A 73 30.161 6.708 -0.285 1.00 63.13 H new ATOM 0 HD13 LEU A 73 30.727 7.842 0.965 1.00 63.13 H new ATOM 0 HD21 LEU A 73 31.279 10.175 -0.995 1.00 44.41 H new ATOM 0 HD22 LEU A 73 32.413 9.681 0.285 1.00 44.41 H new ATOM 0 HD23 LEU A 73 32.956 9.745 -1.408 1.00 44.41 H new ATOM 1065 N PRO A 74 36.197 6.952 -0.253 1.00 14.33 N ATOM 1066 CA PRO A 74 37.274 6.196 0.400 1.00 71.54 C ATOM 1067 C PRO A 74 36.730 5.291 1.508 1.00 22.35 C ATOM 1068 O PRO A 74 35.851 5.695 2.270 1.00 71.04 O ATOM 1069 CB PRO A 74 38.183 7.288 0.991 1.00 0.31 C ATOM 1070 CG PRO A 74 37.314 8.496 1.098 1.00 75.32 C ATOM 1071 CD PRO A 74 36.337 8.406 -0.041 1.00 21.31 C ATOM 0 HA PRO A 74 37.794 5.535 -0.293 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.571 6.993 1.966 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.043 7.476 0.349 1.00 0.31 H new ATOM 0 HG2 PRO A 74 36.795 8.520 2.056 1.00 75.32 H new ATOM 0 HG3 PRO A 74 37.906 9.409 1.033 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.383 8.870 0.210 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.711 8.909 -0.933 1.00 21.31 H new ATOM 1079 N ALA A 75 37.257 4.074 1.600 1.00 74.43 N ATOM 1080 CA ALA A 75 36.806 3.111 2.607 1.00 72.21 C ATOM 1081 C ALA A 75 37.376 3.443 3.983 1.00 34.41 C ATOM 1082 O ALA A 75 36.961 2.882 4.998 1.00 42.34 O ATOM 1083 CB ALA A 75 37.190 1.694 2.193 1.00 2.05 C ATOM 0 H ALA A 75 37.998 3.728 0.990 1.00 74.43 H new ATOM 0 HA ALA A 75 35.720 3.174 2.674 1.00 72.21 H new ATOM 0 HB1 ALA A 75 36.849 0.989 2.951 1.00 2.05 H new ATOM 0 HB2 ALA A 75 36.723 1.455 1.238 1.00 2.05 H new ATOM 0 HB3 ALA A 75 38.273 1.625 2.095 1.00 2.05 H new ATOM 1089 N ASP A 76 38.316 4.375 4.003 1.00 35.21 N ATOM 1090 CA ASP A 76 39.027 4.752 5.223 1.00 24.42 C ATOM 1091 C ASP A 76 38.310 5.885 5.961 1.00 33.35 C ATOM 1092 O ASP A 76 38.794 6.396 6.972 1.00 61.01 O ATOM 1093 CB ASP A 76 40.447 5.169 4.835 1.00 72.44 C ATOM 1094 CG ASP A 76 41.356 5.428 6.028 1.00 23.12 C ATOM 1095 OD1 ASP A 76 41.727 4.458 6.722 1.00 55.31 O ATOM 1096 OD2 ASP A 76 41.731 6.602 6.258 1.00 42.23 O1- ATOM 0 H ASP A 76 38.610 4.894 3.176 1.00 35.21 H new ATOM 0 HA ASP A 76 39.057 3.902 5.905 1.00 24.42 H new ATOM 0 HB2 ASP A 76 40.889 4.389 4.215 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.397 6.071 4.225 1.00 72.44 H new ATOM 1101 N THR A 77 37.143 6.261 5.462 1.00 11.55 N ATOM 1102 CA THR A 77 36.384 7.364 6.036 1.00 12.43 C ATOM 1103 C THR A 77 35.644 6.929 7.299 1.00 50.31 C ATOM 1104 O THR A 77 35.212 5.777 7.416 1.00 30.02 O ATOM 1105 CB THR A 77 35.383 7.943 5.015 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.678 9.053 5.583 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.379 6.890 4.554 1.00 73.22 C ATOM 0 H THR A 77 36.699 5.818 4.658 1.00 11.55 H new ATOM 0 HA THR A 77 37.099 8.142 6.303 1.00 12.43 H new ATOM 0 HB THR A 77 35.956 8.275 4.150 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.265 9.529 6.207 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.690 7.334 3.836 1.00 73.22 H new ATOM 0 HG22 THR A 77 34.910 6.062 4.084 1.00 73.22 H new ATOM 0 HG23 THR A 77 33.819 6.520 5.413 1.00 73.22 H new ATOM 1115 N THR A 78 35.513 7.850 8.248 1.00 13.54 N ATOM 1116 CA THR A 78 34.849 7.572 9.514 1.00 2.03 C ATOM 1117 C THR A 78 34.151 8.828 10.042 1.00 41.21 C ATOM 1118 O THR A 78 34.588 9.951 9.799 1.00 33.42 O ATOM 1119 CB THR A 78 35.856 7.057 10.575 1.00 65.01 C ATOM 1120 OG1 THR A 78 36.534 5.885 10.092 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.164 6.726 11.894 1.00 52.04 C ATOM 0 H THR A 78 35.862 8.804 8.161 1.00 13.54 H new ATOM 0 HA THR A 78 34.106 6.795 9.331 1.00 2.03 H new ATOM 0 HB THR A 78 36.576 7.856 10.753 1.00 65.01 H new ATOM 0 HG1 THR A 78 36.157 5.089 10.522 1.00 41.13 H new ATOM 0 HG21 THR A 78 35.902 6.368 12.612 1.00 52.04 H new ATOM 0 HG22 THR A 78 34.680 7.621 12.286 1.00 52.04 H new ATOM 0 HG23 THR A 78 34.415 5.952 11.728 1.00 52.04 H new ATOM 1129 N VAL A 79 33.067 8.610 10.763 1.00 13.33 N ATOM 1130 CA VAL A 79 32.285 9.668 11.384 1.00 51.35 C ATOM 1131 C VAL A 79 32.163 9.381 12.875 1.00 40.33 C ATOM 1132 O VAL A 79 31.687 8.317 13.271 1.00 15.54 O ATOM 1133 CB VAL A 79 30.871 9.777 10.749 1.00 73.54 C ATOM 1134 CG1 VAL A 79 29.978 10.726 11.547 1.00 32.33 C ATOM 1135 CG2 VAL A 79 30.976 10.239 9.300 1.00 4.51 C ATOM 0 H VAL A 79 32.697 7.676 10.938 1.00 13.33 H new ATOM 0 HA VAL A 79 32.794 10.618 11.223 1.00 51.35 H new ATOM 0 HB VAL A 79 30.414 8.788 10.772 1.00 73.54 H new ATOM 0 HG11 VAL A 79 28.996 10.782 11.078 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.873 10.356 12.567 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.428 11.719 11.566 1.00 32.33 H new ATOM 0 HG21 VAL A 79 29.978 10.311 8.868 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.458 11.216 9.264 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.567 9.521 8.731 1.00 4.51 H new ATOM 1145 N THR A 80 32.625 10.310 13.693 1.00 3.21 N ATOM 1146 CA THR A 80 32.582 10.139 15.137 1.00 52.54 C ATOM 1147 C THR A 80 31.373 10.867 15.722 1.00 43.34 C ATOM 1148 O THR A 80 31.274 12.092 15.638 1.00 4.30 O ATOM 1149 CB THR A 80 33.875 10.659 15.809 1.00 61.00 C ATOM 1150 OG1 THR A 80 35.024 10.172 15.098 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.947 10.200 17.265 1.00 20.33 C ATOM 0 H THR A 80 33.035 11.191 13.383 1.00 3.21 H new ATOM 0 HA THR A 80 32.497 9.071 15.338 1.00 52.54 H new ATOM 0 HB THR A 80 33.862 11.749 15.783 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.840 10.506 15.527 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.863 10.576 17.720 1.00 20.33 H new ATOM 0 HG22 THR A 80 33.086 10.586 17.811 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.943 9.111 17.304 1.00 20.33 H new ATOM 1159 N ALA A 81 30.453 10.098 16.289 1.00 63.21 N ATOM 1160 CA ALA A 81 29.251 10.643 16.901 1.00 75.00 C ATOM 1161 C ALA A 81 29.442 10.809 18.406 1.00 14.40 C ATOM 1162 O ALA A 81 29.450 9.828 19.153 1.00 73.21 O ATOM 1163 CB ALA A 81 28.059 9.737 16.611 1.00 42.42 C ATOM 0 H ALA A 81 30.520 9.081 16.337 1.00 63.21 H new ATOM 0 HA ALA A 81 29.057 11.626 16.472 1.00 75.00 H new ATOM 0 HB1 ALA A 81 27.164 10.154 17.073 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.911 9.665 15.534 1.00 42.42 H new ATOM 0 HB3 ALA A 81 28.249 8.744 17.018 1.00 42.42 H new ATOM 1169 N GLU A 82 29.634 12.049 18.838 1.00 71.31 N ATOM 1170 CA GLU A 82 29.748 12.368 20.256 1.00 72.51 C ATOM 1171 C GLU A 82 28.403 12.873 20.770 1.00 53.13 C ATOM 1172 O GLU A 82 27.965 13.963 20.404 1.00 25.01 O ATOM 1173 CB GLU A 82 30.826 13.439 20.475 1.00 74.00 C ATOM 1174 CG GLU A 82 31.063 13.774 21.941 1.00 3.23 C ATOM 1175 CD GLU A 82 31.908 15.022 22.131 1.00 23.22 C ATOM 1176 OE1 GLU A 82 31.332 16.101 22.394 1.00 3.55 O ATOM 1177 OE2 GLU A 82 33.147 14.931 22.038 1.00 51.44 O1- ATOM 0 H GLU A 82 29.715 12.857 18.221 1.00 71.31 H new ATOM 0 HA GLU A 82 30.034 11.470 20.803 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.762 13.096 20.033 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.537 14.347 19.946 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.102 13.912 22.437 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.554 12.931 22.427 1.00 3.23 H new ATOM 1184 N VAL A 83 27.738 12.079 21.602 1.00 31.40 N ATOM 1185 CA VAL A 83 26.425 12.455 22.116 1.00 74.25 C ATOM 1186 C VAL A 83 26.462 12.687 23.620 1.00 12.15 C ATOM 1187 O VAL A 83 27.062 11.919 24.373 1.00 3.30 O ATOM 1188 CB VAL A 83 25.342 11.399 21.781 1.00 22.15 C ATOM 1189 CG1 VAL A 83 25.056 11.388 20.285 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.757 10.008 22.260 1.00 42.03 C ATOM 0 H VAL A 83 28.082 11.178 21.933 1.00 31.40 H new ATOM 0 HA VAL A 83 26.158 13.388 21.619 1.00 74.25 H new ATOM 0 HB VAL A 83 24.429 11.674 22.309 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.293 10.641 20.066 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.701 12.371 19.975 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.969 11.144 19.742 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.976 9.289 22.010 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.687 9.718 21.772 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.904 10.024 23.340 1.00 42.03 H new ATOM 1200 N GLY A 84 25.822 13.766 24.040 1.00 33.12 N ATOM 1201 CA GLY A 84 25.722 14.096 25.440 1.00 23.12 C ATOM 1202 C GLY A 84 24.327 14.542 25.800 1.00 64.22 C ATOM 1203 O GLY A 84 23.540 14.906 24.925 1.00 21.33 O ATOM 0 H GLY A 84 25.361 14.431 23.418 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.995 13.228 26.041 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.432 14.887 25.681 1.00 23.12 H new ATOM 1207 N ILE A 85 24.023 14.528 27.083 1.00 23.52 N ATOM 1208 CA ILE A 85 22.708 14.887 27.574 1.00 1.40 C ATOM 1209 C ILE A 85 22.855 15.734 28.828 1.00 61.15 C ATOM 1210 O ILE A 85 23.636 15.393 29.730 1.00 10.52 O ATOM 1211 CB ILE A 85 21.842 13.617 27.850 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.434 13.982 28.373 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.552 12.675 28.822 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.349 14.170 29.877 1.00 71.32 C ATOM 0 H ILE A 85 24.683 14.267 27.816 1.00 23.52 H new ATOM 0 HA ILE A 85 22.190 15.467 26.811 1.00 1.40 H new ATOM 0 HB ILE A 85 21.713 13.101 26.899 1.00 52.02 H new ATOM 0 HG12 ILE A 85 20.106 14.900 27.886 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.736 13.198 28.078 1.00 53.33 H new ATOM 0 HG21 ILE A 85 21.930 11.798 28.999 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.505 12.363 28.396 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.728 13.191 29.766 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.326 14.424 30.155 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.642 13.246 30.376 1.00 71.32 H new ATOM 0 HD13 ILE A 85 21.018 14.975 30.181 1.00 71.32 H new ATOM 1226 N GLY A 86 22.126 16.845 28.853 1.00 43.44 N ATOM 1227 CA GLY A 86 22.160 17.767 29.978 1.00 64.20 C ATOM 1228 C GLY A 86 20.829 18.473 30.154 1.00 43.21 C ATOM 1229 O GLY A 86 19.961 18.362 29.285 1.00 31.32 O ATOM 0 H GLY A 86 21.500 17.128 28.099 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.408 17.223 30.889 1.00 64.20 H new ATOM 0 HA3 GLY A 86 22.947 18.505 29.822 1.00 64.20 H new ATOM 1233 N PRO A 87 20.626 19.199 31.268 1.00 20.43 N ATOM 1234 CA PRO A 87 19.360 19.874 31.554 1.00 73.43 C ATOM 1235 C PRO A 87 19.157 21.097 30.661 1.00 33.24 C ATOM 1236 O PRO A 87 20.011 21.988 30.605 1.00 11.41 O ATOM 1237 CB PRO A 87 19.481 20.293 33.036 1.00 75.13 C ATOM 1238 CG PRO A 87 20.745 19.668 33.535 1.00 24.22 C ATOM 1239 CD PRO A 87 21.612 19.451 32.326 1.00 44.21 C ATOM 0 HA PRO A 87 18.502 19.229 31.364 1.00 73.43 H new ATOM 0 HB2 PRO A 87 19.516 21.378 33.134 1.00 75.13 H new ATOM 0 HB3 PRO A 87 18.621 19.949 33.611 1.00 75.13 H new ATOM 0 HG2 PRO A 87 21.241 20.316 34.258 1.00 24.22 H new ATOM 0 HG3 PRO A 87 20.539 18.725 34.041 1.00 24.22 H new ATOM 0 HD2 PRO A 87 22.228 20.323 32.107 1.00 44.21 H new ATOM 0 HD3 PRO A 87 22.289 18.607 32.459 1.00 44.21 H new ATOM 1247 N ASN A 88 18.029 21.127 29.960 1.00 50.13 N ATOM 1248 CA ASN A 88 17.673 22.263 29.116 1.00 62.23 C ATOM 1249 C ASN A 88 17.248 23.433 29.997 1.00 31.22 C ATOM 1250 O ASN A 88 16.860 23.230 31.147 1.00 11.01 O ATOM 1251 CB ASN A 88 16.537 21.879 28.155 1.00 63.43 C ATOM 1252 CG ASN A 88 16.199 22.984 27.166 1.00 21.32 C ATOM 1253 OD1 ASN A 88 15.370 23.847 27.446 1.00 63.22 O ATOM 1254 ND2 ASN A 88 16.837 22.966 26.004 1.00 22.41 N ATOM 0 H ASN A 88 17.342 20.373 29.960 1.00 50.13 H new ATOM 0 HA ASN A 88 18.539 22.555 28.522 1.00 62.23 H new ATOM 0 HB2 ASN A 88 16.820 20.981 27.606 1.00 63.43 H new ATOM 0 HB3 ASN A 88 15.647 21.631 28.733 1.00 63.43 H new ATOM 0 HD21 ASN A 88 16.646 23.685 25.306 1.00 22.41 H new ATOM 0 HD22 ASN A 88 17.519 22.233 25.808 1.00 22.41 H new ATOM 1261 N GLU A 89 17.311 24.648 29.462 1.00 43.32 N ATOM 1262 CA GLU A 89 16.970 25.844 30.230 1.00 2.23 C ATOM 1263 C GLU A 89 15.513 25.800 30.699 1.00 10.40 C ATOM 1264 O GLU A 89 15.148 26.443 31.685 1.00 74.31 O ATOM 1265 CB GLU A 89 17.215 27.101 29.391 1.00 13.04 C ATOM 1266 CG GLU A 89 16.328 27.197 28.157 1.00 64.14 C ATOM 1267 CD GLU A 89 16.630 28.422 27.317 1.00 35.31 C ATOM 1268 OE1 GLU A 89 16.482 29.549 27.831 1.00 70.11 O ATOM 1269 OE2 GLU A 89 17.013 28.264 26.140 1.00 74.23 O1- ATOM 0 H GLU A 89 17.595 24.832 28.500 1.00 43.32 H new ATOM 0 HA GLU A 89 17.611 25.874 31.111 1.00 2.23 H new ATOM 0 HB2 GLU A 89 17.052 27.980 30.014 1.00 13.04 H new ATOM 0 HB3 GLU A 89 18.259 27.121 29.079 1.00 13.04 H new ATOM 0 HG2 GLU A 89 16.460 26.302 27.549 1.00 64.14 H new ATOM 0 HG3 GLU A 89 15.283 27.221 28.466 1.00 64.14 H new ATOM 1276 N GLU A 90 14.688 25.037 29.986 1.00 62.24 N ATOM 1277 CA GLU A 90 13.285 24.850 30.356 1.00 33.11 C ATOM 1278 C GLU A 90 13.172 24.014 31.634 1.00 41.22 C ATOM 1279 O GLU A 90 12.174 24.072 32.353 1.00 23.51 O ATOM 1280 CB GLU A 90 12.527 24.169 29.208 1.00 62.35 C ATOM 1281 CG GLU A 90 11.112 23.746 29.574 1.00 2.12 C ATOM 1282 CD GLU A 90 10.378 23.074 28.425 1.00 32.41 C ATOM 1283 OE1 GLU A 90 9.720 23.783 27.635 1.00 34.55 O ATOM 1284 OE2 GLU A 90 10.453 21.834 28.307 1.00 15.02 O1- ATOM 0 H GLU A 90 14.968 24.535 29.143 1.00 62.24 H new ATOM 0 HA GLU A 90 12.841 25.827 30.545 1.00 33.11 H new ATOM 0 HB2 GLU A 90 12.485 24.850 28.358 1.00 62.35 H new ATOM 0 HB3 GLU A 90 13.087 23.291 28.885 1.00 62.35 H new ATOM 0 HG2 GLU A 90 11.151 23.063 30.422 1.00 2.12 H new ATOM 0 HG3 GLU A 90 10.548 24.622 29.895 1.00 2.12 H new ATOM 1291 N GLY A 91 14.220 23.256 31.914 1.00 4.53 N ATOM 1292 CA GLY A 91 14.232 22.361 33.057 1.00 50.31 C ATOM 1293 C GLY A 91 14.045 20.917 32.642 1.00 52.42 C ATOM 1294 O GLY A 91 13.912 20.028 33.485 1.00 50.31 O ATOM 0 H GLY A 91 15.077 23.244 31.361 1.00 4.53 H new ATOM 0 HA2 GLY A 91 15.176 22.466 33.591 1.00 50.31 H new ATOM 0 HA3 GLY A 91 13.440 22.646 33.750 1.00 50.31 H new ATOM 1298 N GLY A 92 14.040 20.682 31.333 1.00 31.10 N ATOM 1299 CA GLY A 92 13.922 19.334 30.812 1.00 44.24 C ATOM 1300 C GLY A 92 15.282 18.767 30.473 1.00 74.12 C ATOM 1301 O GLY A 92 16.280 19.130 31.100 1.00 42.22 O ATOM 0 H GLY A 92 14.116 21.408 30.620 1.00 31.10 H new ATOM 0 HA2 GLY A 92 13.431 18.697 31.548 1.00 44.24 H new ATOM 0 HA3 GLY A 92 13.293 19.337 29.922 1.00 44.24 H new ATOM 1305 N PHE A 93 15.337 17.886 29.486 1.00 65.13 N ATOM 1306 CA PHE A 93 16.604 17.340 29.012 1.00 72.25 C ATOM 1307 C PHE A 93 16.889 17.834 27.603 1.00 30.35 C ATOM 1308 O PHE A 93 15.968 18.114 26.833 1.00 35.35 O ATOM 1309 CB PHE A 93 16.593 15.806 29.048 1.00 70.53 C ATOM 1310 CG PHE A 93 16.552 15.236 30.445 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.584 14.312 30.809 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.487 15.630 31.394 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.549 13.793 32.090 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.455 15.114 32.674 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.486 14.195 33.023 1.00 12.34 C ATOM 0 H PHE A 93 14.517 17.531 28.995 1.00 65.13 H new ATOM 0 HA PHE A 93 17.395 17.685 29.677 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.729 15.444 28.491 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.481 15.432 28.538 1.00 70.53 H new ATOM 0 HD1 PHE A 93 14.849 13.994 30.084 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.248 16.348 31.127 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.790 13.074 32.361 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.188 15.429 33.402 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.460 13.791 34.024 1.00 12.34 H new ATOM 1325 N ALA A 94 18.168 17.946 27.279 1.00 73.43 N ATOM 1326 CA ALA A 94 18.604 18.423 25.978 1.00 60.33 C ATOM 1327 C ALA A 94 19.789 17.599 25.497 1.00 65.32 C ATOM 1328 O ALA A 94 20.697 17.287 26.279 1.00 32.10 O ATOM 1329 CB ALA A 94 18.963 19.904 26.052 1.00 64.21 C ATOM 0 H ALA A 94 18.932 17.708 27.911 1.00 73.43 H new ATOM 0 HA ALA A 94 17.790 18.308 25.262 1.00 60.33 H new ATOM 0 HB1 ALA A 94 19.288 20.249 25.071 1.00 64.21 H new ATOM 0 HB2 ALA A 94 18.089 20.475 26.366 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.768 20.048 26.772 1.00 64.21 H new ATOM 1335 N LEU A 95 19.762 17.231 24.219 1.00 31.23 N ATOM 1336 CA LEU A 95 20.800 16.395 23.628 1.00 75.45 C ATOM 1337 C LEU A 95 21.804 17.239 22.848 1.00 41.42 C ATOM 1338 O LEU A 95 21.432 18.040 21.988 1.00 2.34 O ATOM 1339 CB LEU A 95 20.179 15.316 22.717 1.00 51.22 C ATOM 1340 CG LEU A 95 19.643 14.061 23.439 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.793 13.241 24.022 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.647 14.440 24.536 1.00 71.23 C ATOM 0 H LEU A 95 19.025 17.502 23.568 1.00 31.23 H new ATOM 0 HA LEU A 95 21.332 15.898 24.439 1.00 75.45 H new ATOM 0 HB2 LEU A 95 19.361 15.767 22.155 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.930 15.003 21.991 1.00 51.22 H new ATOM 0 HG LEU A 95 19.120 13.450 22.703 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.393 12.361 24.526 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.460 12.927 23.219 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.347 13.849 24.737 1.00 64.34 H new ATOM 0 HD21 LEU A 95 18.286 13.537 25.028 1.00 71.23 H new ATOM 0 HD22 LEU A 95 19.139 15.080 25.269 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.805 14.974 24.095 1.00 71.23 H new ATOM 1354 N ASP A 96 23.071 17.049 23.175 1.00 51.32 N ATOM 1355 CA ASP A 96 24.180 17.725 22.505 1.00 15.24 C ATOM 1356 C ASP A 96 24.948 16.707 21.683 1.00 33.43 C ATOM 1357 O ASP A 96 25.597 15.815 22.231 1.00 1.11 O ATOM 1358 CB ASP A 96 25.112 18.360 23.538 1.00 62.10 C ATOM 1359 CG ASP A 96 26.328 19.050 22.924 1.00 42.14 C ATOM 1360 OD1 ASP A 96 27.415 18.425 22.880 1.00 0.44 O ATOM 1361 OD2 ASP A 96 26.215 20.224 22.516 1.00 11.32 O1- ATOM 0 H ASP A 96 23.366 16.417 23.919 1.00 51.32 H new ATOM 0 HA ASP A 96 23.790 18.510 21.858 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.550 19.087 24.124 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.453 17.589 24.229 1.00 62.10 H new ATOM 1366 N VAL A 97 24.854 16.831 20.376 1.00 3.45 N ATOM 1367 CA VAL A 97 25.450 15.862 19.461 1.00 33.41 C ATOM 1368 C VAL A 97 26.478 16.531 18.559 1.00 35.23 C ATOM 1369 O VAL A 97 26.129 17.330 17.698 1.00 5.33 O ATOM 1370 CB VAL A 97 24.369 15.180 18.579 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.996 14.124 17.671 1.00 31.40 C ATOM 1372 CG2 VAL A 97 23.262 14.572 19.444 1.00 41.42 C ATOM 0 H VAL A 97 24.367 17.599 19.913 1.00 3.45 H new ATOM 0 HA VAL A 97 25.940 15.103 20.071 1.00 33.41 H new ATOM 0 HB VAL A 97 23.918 15.944 17.946 1.00 12.11 H new ATOM 0 HG11 VAL A 97 24.220 13.660 17.063 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.734 14.595 17.021 1.00 31.40 H new ATOM 0 HG13 VAL A 97 25.483 13.363 18.281 1.00 31.40 H new ATOM 0 HG21 VAL A 97 22.517 14.100 18.803 1.00 41.42 H new ATOM 0 HG22 VAL A 97 23.691 13.825 20.112 1.00 41.42 H new ATOM 0 HG23 VAL A 97 22.789 15.357 20.034 1.00 41.42 H new ATOM 1382 N GLU A 98 27.746 16.209 18.762 1.00 23.12 N ATOM 1383 CA GLU A 98 28.810 16.709 17.905 1.00 44.32 C ATOM 1384 C GLU A 98 29.218 15.615 16.925 1.00 21.31 C ATOM 1385 O GLU A 98 29.738 14.569 17.325 1.00 34.12 O ATOM 1386 CB GLU A 98 30.006 17.186 18.740 1.00 13.10 C ATOM 1387 CG GLU A 98 31.153 17.733 17.899 1.00 35.31 C ATOM 1388 CD GLU A 98 32.125 18.579 18.700 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.946 19.815 18.741 1.00 51.52 O ATOM 1390 OE2 GLU A 98 33.061 18.019 19.306 1.00 21.24 O1- ATOM 0 H GLU A 98 28.064 15.601 19.516 1.00 23.12 H new ATOM 0 HA GLU A 98 28.448 17.570 17.343 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.671 17.960 19.431 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.372 16.356 19.344 1.00 13.10 H new ATOM 0 HG2 GLU A 98 31.692 16.901 17.445 1.00 35.31 H new ATOM 0 HG3 GLU A 98 30.745 18.331 17.084 1.00 35.31 H new ATOM 1397 N LEU A 99 28.950 15.849 15.645 1.00 4.53 N ATOM 1398 CA LEU A 99 29.183 14.850 14.609 1.00 32.31 C ATOM 1399 C LEU A 99 30.423 15.232 13.799 1.00 52.01 C ATOM 1400 O LEU A 99 30.397 16.193 13.026 1.00 21.43 O ATOM 1401 CB LEU A 99 27.946 14.744 13.697 1.00 42.25 C ATOM 1402 CG LEU A 99 27.816 13.430 12.904 1.00 64.41 C ATOM 1403 CD1 LEU A 99 27.591 12.252 13.852 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.682 13.524 11.884 1.00 23.33 C ATOM 0 H LEU A 99 28.568 16.729 15.298 1.00 4.53 H new ATOM 0 HA LEU A 99 29.354 13.877 15.070 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.053 14.868 14.310 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.965 15.574 12.990 1.00 42.25 H new ATOM 0 HG LEU A 99 28.747 13.263 12.363 1.00 64.41 H new ATOM 0 HD11 LEU A 99 27.501 11.332 13.274 1.00 73.33 H new ATOM 0 HD12 LEU A 99 28.435 12.170 14.537 1.00 73.33 H new ATOM 0 HD13 LEU A 99 26.676 12.413 14.422 1.00 73.33 H new ATOM 0 HD21 LEU A 99 26.608 12.585 11.335 1.00 23.33 H new ATOM 0 HD22 LEU A 99 25.742 13.717 12.401 1.00 23.33 H new ATOM 0 HD23 LEU A 99 26.886 14.337 11.187 1.00 23.33 H new ATOM 1416 N ARG A 100 31.504 14.482 13.992 1.00 15.15 N ATOM 1417 CA ARG A 100 32.785 14.774 13.353 1.00 11.05 C ATOM 1418 C ARG A 100 32.966 13.886 12.127 1.00 44.33 C ATOM 1419 O ARG A 100 33.116 12.670 12.252 1.00 60.34 O ATOM 1420 CB ARG A 100 33.922 14.537 14.358 1.00 62.13 C ATOM 1421 CG ARG A 100 35.265 15.142 13.955 1.00 11.51 C ATOM 1422 CD ARG A 100 36.358 14.789 14.961 1.00 61.51 C ATOM 1423 NE ARG A 100 37.560 15.613 14.799 1.00 42.53 N ATOM 1424 CZ ARG A 100 38.803 15.189 15.047 1.00 32.53 C ATOM 1425 NH1 ARG A 100 39.032 13.913 15.351 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 39.818 16.040 14.972 1.00 1.52 N ATOM 0 H ARG A 100 31.518 13.658 14.593 1.00 15.15 H new ATOM 0 HA ARG A 100 32.805 15.816 13.033 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.628 14.950 15.323 1.00 62.13 H new ATOM 0 HB3 ARG A 100 34.049 13.463 14.496 1.00 62.13 H new ATOM 0 HG2 ARG A 100 35.547 14.780 12.966 1.00 11.51 H new ATOM 0 HG3 ARG A 100 35.171 16.226 13.883 1.00 11.51 H new ATOM 0 HD2 ARG A 100 35.970 14.913 15.972 1.00 61.51 H new ATOM 0 HD3 ARG A 100 36.624 13.738 14.849 1.00 61.51 H new ATOM 0 HE ARG A 100 37.440 16.573 14.476 1.00 42.53 H new ATOM 0 HH11 ARG A 100 38.256 13.252 15.396 1.00 73.43 H new ATOM 0 HH12 ARG A 100 39.983 13.596 15.539 1.00 73.43 H new ATOM 0 HH21 ARG A 100 39.649 17.015 14.726 1.00 1.52 H new ATOM 0 HH22 ARG A 100 40.768 15.719 15.161 1.00 1.52 H new ATOM 1440 N VAL A 101 32.956 14.495 10.944 1.00 42.14 N ATOM 1441 CA VAL A 101 32.964 13.743 9.696 1.00 72.23 C ATOM 1442 C VAL A 101 34.365 13.714 9.103 1.00 42.25 C ATOM 1443 O VAL A 101 34.804 14.684 8.487 1.00 41.22 O ATOM 1444 CB VAL A 101 31.977 14.353 8.668 1.00 14.41 C ATOM 1445 CG1 VAL A 101 31.939 13.523 7.383 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.580 14.490 9.274 1.00 42.30 C ATOM 0 H VAL A 101 32.942 15.508 10.825 1.00 42.14 H new ATOM 0 HA VAL A 101 32.646 12.725 9.920 1.00 72.23 H new ATOM 0 HB VAL A 101 32.333 15.350 8.409 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.239 13.973 6.680 1.00 25.41 H new ATOM 0 HG12 VAL A 101 32.934 13.496 6.938 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.618 12.508 7.615 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.904 14.920 8.535 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.215 13.507 9.572 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.624 15.141 10.147 1.00 42.30 H new ATOM 1456 N ALA A 102 35.076 12.611 9.315 1.00 43.12 N ATOM 1457 CA ALA A 102 36.425 12.462 8.791 1.00 40.03 C ATOM 1458 C ALA A 102 36.393 11.766 7.435 1.00 12.52 C ATOM 1459 O ALA A 102 36.248 10.542 7.352 1.00 73.10 O ATOM 1460 CB ALA A 102 37.292 11.681 9.774 1.00 44.05 C ATOM 0 H ALA A 102 34.738 11.808 9.846 1.00 43.12 H new ATOM 0 HA ALA A 102 36.860 13.453 8.659 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.298 11.577 9.369 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.336 12.215 10.723 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.861 10.692 9.933 1.00 44.05 H new ATOM 1466 N LEU A 103 36.528 12.552 6.376 1.00 73.31 N ATOM 1467 CA LEU A 103 36.581 12.019 5.020 1.00 63.24 C ATOM 1468 C LEU A 103 37.969 12.304 4.446 1.00 11.33 C ATOM 1469 O LEU A 103 38.329 13.458 4.219 1.00 24.41 O ATOM 1470 CB LEU A 103 35.468 12.637 4.146 1.00 41.13 C ATOM 1471 CG LEU A 103 35.277 12.005 2.748 1.00 32.24 C ATOM 1472 CD1 LEU A 103 34.958 10.520 2.859 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.169 12.716 1.970 1.00 41.41 C ATOM 0 H LEU A 103 36.603 13.568 6.430 1.00 73.31 H new ATOM 0 HA LEU A 103 36.411 10.942 5.033 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.525 12.564 4.688 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.681 13.698 4.017 1.00 41.13 H new ATOM 0 HG LEU A 103 36.215 12.122 2.206 1.00 32.24 H new ATOM 0 HD11 LEU A 103 34.828 10.100 1.861 1.00 55.32 H new ATOM 0 HD12 LEU A 103 35.777 10.009 3.364 1.00 55.32 H new ATOM 0 HD13 LEU A 103 34.040 10.387 3.431 1.00 55.32 H new ATOM 0 HD21 LEU A 103 34.056 12.251 0.991 1.00 41.41 H new ATOM 0 HD22 LEU A 103 33.231 12.637 2.519 1.00 41.41 H new ATOM 0 HD23 LEU A 103 34.429 13.767 1.845 1.00 41.41 H new ATOM 1485 N PRO A 104 38.776 11.252 4.235 1.00 73.52 N ATOM 1486 CA PRO A 104 40.181 11.397 3.858 1.00 62.42 C ATOM 1487 C PRO A 104 40.363 11.855 2.416 1.00 45.15 C ATOM 1488 O PRO A 104 39.562 11.523 1.538 1.00 0.45 O ATOM 1489 CB PRO A 104 40.745 9.993 4.062 1.00 24.31 C ATOM 1490 CG PRO A 104 39.585 9.077 3.872 1.00 63.40 C ATOM 1491 CD PRO A 104 38.368 9.841 4.322 1.00 45.41 C ATOM 0 HA PRO A 104 40.684 12.162 4.449 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.538 9.779 3.345 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.176 9.882 5.057 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.493 8.777 2.828 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.710 8.165 4.455 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.509 9.634 3.683 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.081 9.571 5.338 1.00 45.41 H new ATOM 1499 N GLY A 105 41.435 12.605 2.184 1.00 54.45 N ATOM 1500 CA GLY A 105 41.704 13.139 0.861 1.00 13.33 C ATOM 1501 C GLY A 105 40.755 14.264 0.484 1.00 43.42 C ATOM 1502 O GLY A 105 40.649 14.632 -0.686 1.00 1.41 O ATOM 0 H GLY A 105 42.126 12.854 2.892 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.730 13.505 0.822 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.623 12.338 0.126 1.00 13.33 H new ATOM 1506 N LEU A 106 40.058 14.803 1.480 1.00 4.51 N ATOM 1507 CA LEU A 106 39.045 15.829 1.264 1.00 40.14 C ATOM 1508 C LEU A 106 39.456 17.147 1.930 1.00 43.11 C ATOM 1509 O LEU A 106 40.070 17.146 2.999 1.00 42.33 O ATOM 1510 CB LEU A 106 37.699 15.331 1.814 1.00 65.03 C ATOM 1511 CG LEU A 106 36.613 16.400 1.999 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.195 16.998 0.663 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.411 15.816 2.728 1.00 41.21 C ATOM 0 H LEU A 106 40.180 14.541 2.458 1.00 4.51 H new ATOM 0 HA LEU A 106 38.946 16.020 0.195 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.315 14.564 1.142 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.877 14.851 2.776 1.00 65.03 H new ATOM 0 HG LEU A 106 37.030 17.203 2.606 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.425 17.752 0.827 1.00 44.14 H new ATOM 0 HD12 LEU A 106 37.059 17.460 0.185 1.00 44.14 H new ATOM 0 HD13 LEU A 106 35.802 16.211 0.019 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.650 16.587 2.851 1.00 41.21 H new ATOM 0 HD22 LEU A 106 35.000 14.990 2.148 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.721 15.453 3.708 1.00 41.21 H new ATOM 1525 N ASP A 107 39.127 18.263 1.277 1.00 72.42 N ATOM 1526 CA ASP A 107 39.432 19.600 1.802 1.00 14.02 C ATOM 1527 C ASP A 107 38.480 19.969 2.919 1.00 1.12 C ATOM 1528 O ASP A 107 37.401 19.402 3.038 1.00 10.24 O ATOM 1529 CB ASP A 107 39.277 20.679 0.726 1.00 13.35 C ATOM 1530 CG ASP A 107 40.252 21.833 0.896 1.00 12.43 C ATOM 1531 OD1 ASP A 107 40.000 22.707 1.755 1.00 14.01 O ATOM 1532 OD2 ASP A 107 41.262 21.883 0.166 1.00 2.52 O1- ATOM 0 H ASP A 107 38.646 18.269 0.378 1.00 72.42 H new ATOM 0 HA ASP A 107 40.462 19.559 2.156 1.00 14.02 H new ATOM 0 HB2 ASP A 107 39.423 20.229 -0.256 1.00 13.35 H new ATOM 0 HB3 ASP A 107 38.258 21.065 0.751 1.00 13.35 H new ATOM 1537 N ALA A 108 38.865 20.975 3.678 1.00 41.30 N ATOM 1538 CA ALA A 108 37.996 21.579 4.670 1.00 54.32 C ATOM 1539 C ALA A 108 36.861 22.321 3.979 1.00 74.35 C ATOM 1540 O ALA A 108 35.693 22.201 4.361 1.00 33.14 O ATOM 1541 CB ALA A 108 38.808 22.540 5.514 1.00 73.33 C ATOM 0 H ALA A 108 39.791 21.398 3.625 1.00 41.30 H new ATOM 0 HA ALA A 108 37.569 20.805 5.307 1.00 54.32 H new ATOM 0 HB1 ALA A 108 38.164 23.000 6.263 1.00 73.33 H new ATOM 0 HB2 ALA A 108 39.613 21.998 6.011 1.00 73.33 H new ATOM 0 HB3 ALA A 108 39.233 23.315 4.876 1.00 73.33 H new ATOM 1547 N ALA A 109 37.221 23.072 2.940 1.00 23.13 N ATOM 1548 CA ALA A 109 36.263 23.893 2.212 1.00 64.13 C ATOM 1549 C ALA A 109 35.197 23.018 1.568 1.00 31.24 C ATOM 1550 O ALA A 109 33.996 23.270 1.708 1.00 41.21 O ATOM 1551 CB ALA A 109 36.973 24.737 1.159 1.00 33.23 C ATOM 0 H ALA A 109 38.175 23.127 2.584 1.00 23.13 H new ATOM 0 HA ALA A 109 35.777 24.566 2.918 1.00 64.13 H new ATOM 0 HB1 ALA A 109 36.242 25.344 0.625 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.700 25.388 1.644 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.486 24.083 0.454 1.00 33.23 H new ATOM 1557 N ALA A 110 35.641 21.977 0.876 1.00 73.25 N ATOM 1558 CA ALA A 110 34.726 21.059 0.218 1.00 12.34 C ATOM 1559 C ALA A 110 33.953 20.259 1.257 1.00 44.05 C ATOM 1560 O ALA A 110 32.746 20.063 1.130 1.00 34.04 O ATOM 1561 CB ALA A 110 35.481 20.136 -0.729 1.00 53.00 C ATOM 0 H ALA A 110 36.628 21.749 0.757 1.00 73.25 H new ATOM 0 HA ALA A 110 34.015 21.635 -0.373 1.00 12.34 H new ATOM 0 HB1 ALA A 110 34.779 19.456 -1.212 1.00 53.00 H new ATOM 0 HB2 ALA A 110 35.990 20.731 -1.487 1.00 53.00 H new ATOM 0 HB3 ALA A 110 36.215 19.559 -0.167 1.00 53.00 H new ATOM 1567 N ALA A 111 34.652 19.826 2.304 1.00 5.14 N ATOM 1568 CA ALA A 111 34.029 19.044 3.373 1.00 43.54 C ATOM 1569 C ALA A 111 32.820 19.762 3.958 1.00 4.44 C ATOM 1570 O ALA A 111 31.769 19.151 4.163 1.00 54.13 O ATOM 1571 CB ALA A 111 35.039 18.736 4.464 1.00 13.31 C ATOM 0 H ALA A 111 35.648 20.002 2.436 1.00 5.14 H new ATOM 0 HA ALA A 111 33.682 18.107 2.938 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.559 18.154 5.251 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.866 18.164 4.043 1.00 13.31 H new ATOM 0 HB3 ALA A 111 35.418 19.668 4.882 1.00 13.31 H new ATOM 1577 N LYS A 112 32.973 21.059 4.215 1.00 1.14 N ATOM 1578 CA LYS A 112 31.874 21.877 4.729 1.00 13.13 C ATOM 1579 C LYS A 112 30.623 21.718 3.865 1.00 74.23 C ATOM 1580 O LYS A 112 29.530 21.482 4.378 1.00 4.50 O ATOM 1581 CB LYS A 112 32.285 23.359 4.790 1.00 13.05 C ATOM 1582 CG LYS A 112 33.093 23.743 6.030 1.00 32.13 C ATOM 1583 CD LYS A 112 32.224 23.762 7.289 1.00 10.41 C ATOM 1584 CE LYS A 112 33.006 24.235 8.512 1.00 22.11 C ATOM 1585 NZ LYS A 112 32.153 24.325 9.729 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.846 21.567 4.076 1.00 1.14 H new ATOM 0 HA LYS A 112 31.644 21.532 5.737 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.871 23.597 3.902 1.00 13.05 H new ATOM 0 HB3 LYS A 112 31.386 23.974 4.753 1.00 13.05 H new ATOM 0 HG2 LYS A 112 33.912 23.036 6.164 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.541 24.726 5.882 1.00 32.13 H new ATOM 0 HD2 LYS A 112 31.368 24.417 7.130 1.00 10.41 H new ATOM 0 HD3 LYS A 112 31.830 22.763 7.474 1.00 10.41 H new ATOM 0 HE2 LYS A 112 33.832 23.549 8.700 1.00 22.11 H new ATOM 0 HE3 LYS A 112 33.444 25.212 8.305 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 32.728 24.650 10.533 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 31.379 24.999 9.562 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 31.755 23.388 9.944 1.00 2.23 H new ATOM 1599 N THR A 113 30.794 21.819 2.550 1.00 31.43 N ATOM 1600 CA THR A 113 29.658 21.811 1.639 1.00 60.21 C ATOM 1601 C THR A 113 29.107 20.399 1.453 1.00 74.22 C ATOM 1602 O THR A 113 27.900 20.216 1.311 1.00 73.22 O ATOM 1603 CB THR A 113 30.017 22.427 0.261 1.00 31.33 C ATOM 1604 OG1 THR A 113 28.844 22.988 -0.347 1.00 10.35 O ATOM 1605 CG2 THR A 113 30.623 21.397 -0.686 1.00 32.43 C ATOM 0 H THR A 113 31.703 21.907 2.095 1.00 31.43 H new ATOM 0 HA THR A 113 28.886 22.431 2.095 1.00 60.21 H new ATOM 0 HB THR A 113 30.760 23.205 0.440 1.00 31.33 H new ATOM 0 HG1 THR A 113 29.079 23.376 -1.216 1.00 10.35 H new ATOM 0 HG21 THR A 113 30.859 21.872 -1.638 1.00 32.43 H new ATOM 0 HG22 THR A 113 31.535 20.991 -0.247 1.00 32.43 H new ATOM 0 HG23 THR A 113 29.909 20.590 -0.850 1.00 32.43 H new ATOM 1613 N LEU A 114 29.990 19.405 1.462 1.00 23.12 N ATOM 1614 CA LEU A 114 29.579 18.016 1.274 1.00 20.51 C ATOM 1615 C LEU A 114 28.691 17.566 2.426 1.00 41.04 C ATOM 1616 O LEU A 114 27.579 17.076 2.212 1.00 13.34 O ATOM 1617 CB LEU A 114 30.797 17.091 1.142 1.00 61.01 C ATOM 1618 CG LEU A 114 31.731 17.393 -0.042 1.00 11.45 C ATOM 1619 CD1 LEU A 114 32.780 16.297 -0.200 1.00 1.51 C ATOM 1620 CD2 LEU A 114 30.935 17.581 -1.335 1.00 50.51 C ATOM 0 H LEU A 114 30.993 19.534 1.597 1.00 23.12 H new ATOM 0 HA LEU A 114 29.009 17.955 0.347 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.377 17.148 2.063 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.443 16.064 1.051 1.00 61.01 H new ATOM 0 HG LEU A 114 32.250 18.328 0.169 1.00 11.45 H new ATOM 0 HD11 LEU A 114 33.429 16.533 -1.044 1.00 1.51 H new ATOM 0 HD12 LEU A 114 33.377 16.231 0.709 1.00 1.51 H new ATOM 0 HD13 LEU A 114 32.285 15.343 -0.379 1.00 1.51 H new ATOM 0 HD21 LEU A 114 31.620 17.793 -2.156 1.00 50.51 H new ATOM 0 HD22 LEU A 114 30.377 16.671 -1.554 1.00 50.51 H new ATOM 0 HD23 LEU A 114 30.241 18.413 -1.217 1.00 50.51 H new ATOM 1632 N VAL A 115 29.170 17.773 3.644 1.00 72.22 N ATOM 1633 CA VAL A 115 28.411 17.411 4.833 1.00 32.34 C ATOM 1634 C VAL A 115 27.129 18.237 4.894 1.00 1.13 C ATOM 1635 O VAL A 115 26.070 17.755 5.324 1.00 25.22 O ATOM 1636 CB VAL A 115 29.241 17.631 6.125 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.442 17.242 7.368 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.553 16.849 6.058 1.00 35.24 C ATOM 0 H VAL A 115 30.081 18.190 3.835 1.00 72.22 H new ATOM 0 HA VAL A 115 28.165 16.351 4.769 1.00 32.34 H new ATOM 0 HB VAL A 115 29.475 18.693 6.199 1.00 63.01 H new ATOM 0 HG11 VAL A 115 29.050 17.407 8.258 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.540 17.852 7.426 1.00 14.41 H new ATOM 0 HG13 VAL A 115 28.165 16.189 7.308 1.00 14.41 H new ATOM 0 HG21 VAL A 115 31.123 17.015 6.972 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.338 15.786 5.952 1.00 35.24 H new ATOM 0 HG23 VAL A 115 31.135 17.188 5.201 1.00 35.24 H new ATOM 1648 N ASP A 116 27.223 19.482 4.430 1.00 34.11 N ATOM 1649 CA ASP A 116 26.084 20.386 4.439 1.00 22.44 C ATOM 1650 C ASP A 116 24.980 19.870 3.525 1.00 4.20 C ATOM 1651 O ASP A 116 23.860 19.612 3.972 1.00 63.50 O ATOM 1652 CB ASP A 116 26.478 21.800 4.011 1.00 1.42 C ATOM 1653 CG ASP A 116 25.348 22.790 4.244 1.00 43.12 C ATOM 1654 OD1 ASP A 116 25.105 23.155 5.415 1.00 62.34 O ATOM 1655 OD2 ASP A 116 24.689 23.197 3.268 1.00 50.12 O1- ATOM 0 H ASP A 116 28.078 19.884 4.044 1.00 34.11 H new ATOM 0 HA ASP A 116 25.718 20.427 5.465 1.00 22.44 H new ATOM 0 HB2 ASP A 116 27.360 22.117 4.567 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.750 21.799 2.955 1.00 1.42 H new ATOM 1660 N ARG A 117 25.309 19.697 2.245 1.00 43.12 N ATOM 1661 CA ARG A 117 24.338 19.236 1.264 1.00 25.23 C ATOM 1662 C ARG A 117 23.812 17.864 1.659 1.00 51.42 C ATOM 1663 O ARG A 117 22.647 17.541 1.423 1.00 42.42 O ATOM 1664 CB ARG A 117 24.965 19.195 -0.136 1.00 4.30 C ATOM 1665 CG ARG A 117 26.160 18.256 -0.249 1.00 3.24 C ATOM 1666 CD ARG A 117 26.955 18.488 -1.527 1.00 12.41 C ATOM 1667 NE ARG A 117 26.302 17.921 -2.716 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.235 18.535 -3.904 1.00 54.12 C ATOM 1669 NH1 ARG A 117 26.695 19.773 -4.047 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.702 17.912 -4.946 1.00 65.24 N ATOM 0 H ARG A 117 26.241 19.870 1.867 1.00 43.12 H new ATOM 0 HA ARG A 117 23.503 19.936 1.240 1.00 25.23 H new ATOM 0 HB2 ARG A 117 24.205 18.889 -0.855 1.00 4.30 H new ATOM 0 HB3 ARG A 117 25.279 20.202 -0.413 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.812 18.396 0.613 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.812 17.223 -0.222 1.00 3.24 H new ATOM 0 HD2 ARG A 117 27.096 19.559 -1.672 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.946 18.048 -1.418 1.00 12.41 H new ATOM 0 HE ARG A 117 25.872 17.000 -2.630 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.102 20.261 -3.249 1.00 44.31 H new ATOM 0 HH12 ARG A 117 26.641 20.235 -4.955 1.00 44.31 H new ATOM 0 HH21 ARG A 117 25.342 16.963 -4.843 1.00 65.24 H new ATOM 0 HH22 ARG A 117 25.652 18.382 -5.850 1.00 65.24 H new ATOM 1684 N ALA A 118 24.680 17.075 2.287 1.00 40.10 N ATOM 1685 CA ALA A 118 24.307 15.755 2.783 1.00 45.33 C ATOM 1686 C ALA A 118 23.159 15.853 3.792 1.00 63.41 C ATOM 1687 O ALA A 118 22.098 15.266 3.586 1.00 0.11 O ATOM 1688 CB ALA A 118 25.520 15.063 3.398 1.00 44.02 C ATOM 0 H ALA A 118 25.652 17.330 2.465 1.00 40.10 H new ATOM 0 HA ALA A 118 23.957 15.155 1.943 1.00 45.33 H new ATOM 0 HB1 ALA A 118 25.230 14.078 3.765 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.298 14.954 2.643 1.00 44.02 H new ATOM 0 HB3 ALA A 118 25.899 15.662 4.226 1.00 44.02 H new ATOM 1694 N HIS A 119 23.346 16.641 4.860 1.00 52.13 N ATOM 1695 CA HIS A 119 22.294 16.800 5.879 1.00 15.33 C ATOM 1696 C HIS A 119 21.143 17.646 5.335 1.00 0.40 C ATOM 1697 O HIS A 119 20.073 17.723 5.943 1.00 63.33 O ATOM 1698 CB HIS A 119 22.831 17.448 7.168 1.00 54.45 C ATOM 1699 CG HIS A 119 23.019 18.941 7.083 1.00 21.21 C ATOM 1700 ND1 HIS A 119 21.982 19.850 7.191 1.00 2.34 N ATOM 1701 CD2 HIS A 119 24.133 19.679 6.899 1.00 20.34 C ATOM 1702 CE1 HIS A 119 22.459 21.074 7.071 1.00 52.23 C ATOM 1703 NE2 HIS A 119 23.760 21.001 6.893 1.00 74.13 N ATOM 0 H HIS A 119 24.199 17.170 5.041 1.00 52.13 H new ATOM 0 HA HIS A 119 21.936 15.799 6.122 1.00 15.33 H new ATOM 0 HB2 HIS A 119 22.144 17.227 7.985 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.786 16.988 7.421 1.00 54.45 H new ATOM 0 HD2 HIS A 119 25.137 19.299 6.778 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.878 21.984 7.112 1.00 52.23 H new ATOM 0 HE2 HIS A 119 24.388 21.795 6.771 1.00 74.13 H new ATOM 1712 N HIS A 120 21.393 18.305 4.210 1.00 43.52 N ATOM 1713 CA HIS A 120 20.412 19.180 3.578 1.00 31.45 C ATOM 1714 C HIS A 120 19.347 18.352 2.858 1.00 61.14 C ATOM 1715 O HIS A 120 18.149 18.539 3.084 1.00 43.11 O ATOM 1716 CB HIS A 120 21.124 20.119 2.589 1.00 2.24 C ATOM 1717 CG HIS A 120 20.263 21.195 1.993 1.00 45.12 C ATOM 1718 ND1 HIS A 120 20.372 22.521 2.348 1.00 44.32 N ATOM 1719 CD2 HIS A 120 19.309 21.146 1.032 1.00 50.50 C ATOM 1720 CE1 HIS A 120 19.526 23.240 1.636 1.00 65.24 C ATOM 1721 NE2 HIS A 120 18.870 22.430 0.828 1.00 75.14 N ATOM 0 H HIS A 120 22.280 18.248 3.710 1.00 43.52 H new ATOM 0 HA HIS A 120 19.918 19.778 4.344 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.963 20.590 3.101 1.00 2.24 H new ATOM 0 HB3 HIS A 120 21.540 19.519 1.779 1.00 2.24 H new ATOM 0 HD2 HIS A 120 18.959 20.261 0.521 1.00 50.50 H new ATOM 0 HE1 HIS A 120 19.393 24.310 1.703 1.00 65.24 H new ATOM 0 HE2 HIS A 120 18.153 22.712 0.160 1.00 75.14 H new ATOM 1730 N VAL A 121 19.795 17.422 2.013 1.00 33.11 N ATOM 1731 CA VAL A 121 18.889 16.637 1.170 1.00 23.21 C ATOM 1732 C VAL A 121 18.626 15.243 1.744 1.00 3.02 C ATOM 1733 O VAL A 121 17.655 14.590 1.363 1.00 30.52 O ATOM 1734 CB VAL A 121 19.435 16.493 -0.277 1.00 61.42 C ATOM 1735 CG1 VAL A 121 19.652 17.867 -0.912 1.00 74.54 C ATOM 1736 CG2 VAL A 121 20.724 15.666 -0.301 1.00 44.31 C ATOM 0 H VAL A 121 20.782 17.193 1.893 1.00 33.11 H new ATOM 0 HA VAL A 121 17.949 17.188 1.148 1.00 23.21 H new ATOM 0 HB VAL A 121 18.689 15.961 -0.868 1.00 61.42 H new ATOM 0 HG11 VAL A 121 20.035 17.743 -1.925 1.00 74.54 H new ATOM 0 HG12 VAL A 121 18.705 18.406 -0.945 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.371 18.432 -0.319 1.00 74.54 H new ATOM 0 HG21 VAL A 121 21.083 15.582 -1.327 1.00 44.31 H new ATOM 0 HG22 VAL A 121 21.482 16.156 0.310 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.525 14.671 0.097 1.00 44.31 H new ATOM 1746 N CYS A 122 19.486 14.785 2.654 1.00 31.44 N ATOM 1747 CA CYS A 122 19.343 13.450 3.241 1.00 53.14 C ATOM 1748 C CYS A 122 19.215 13.534 4.765 1.00 23.34 C ATOM 1749 O CYS A 122 20.203 13.417 5.493 1.00 24.32 O ATOM 1750 CB CYS A 122 20.536 12.564 2.849 1.00 50.43 C ATOM 1751 SG CYS A 122 20.397 10.843 3.391 1.00 72.12 S ATOM 0 H CYS A 122 20.286 15.315 3.000 1.00 31.44 H new ATOM 0 HA CYS A 122 18.431 13.000 2.849 1.00 53.14 H new ATOM 0 HB2 CYS A 122 20.647 12.583 1.765 1.00 50.43 H new ATOM 0 HB3 CYS A 122 21.445 12.993 3.270 1.00 50.43 H new ATOM 0 HG CYS A 122 20.220 10.806 4.678 1.00 72.12 H new ATOM 1757 N PRO A 123 17.995 13.800 5.270 1.00 50.40 N ATOM 1758 CA PRO A 123 17.711 13.821 6.695 1.00 60.03 C ATOM 1759 C PRO A 123 17.054 12.522 7.183 1.00 74.45 C ATOM 1760 O PRO A 123 16.134 12.006 6.548 1.00 30.15 O ATOM 1761 CB PRO A 123 16.728 14.994 6.785 1.00 24.23 C ATOM 1762 CG PRO A 123 15.971 14.970 5.482 1.00 34.14 C ATOM 1763 CD PRO A 123 16.790 14.150 4.499 1.00 45.03 C ATOM 0 HA PRO A 123 18.604 13.919 7.312 1.00 60.03 H new ATOM 0 HB2 PRO A 123 16.055 14.880 7.635 1.00 24.23 H new ATOM 0 HB3 PRO A 123 17.253 15.940 6.919 1.00 24.23 H new ATOM 0 HG2 PRO A 123 14.983 14.531 5.620 1.00 34.14 H new ATOM 0 HG3 PRO A 123 15.820 15.982 5.106 1.00 34.14 H new ATOM 0 HD2 PRO A 123 16.251 13.262 4.170 1.00 45.03 H new ATOM 0 HD3 PRO A 123 17.037 14.723 3.605 1.00 45.03 H new ATOM 1771 N TYR A 124 17.534 11.995 8.311 1.00 53.44 N ATOM 1772 CA TYR A 124 16.863 10.872 8.978 1.00 1.24 C ATOM 1773 C TYR A 124 15.501 11.353 9.485 1.00 42.34 C ATOM 1774 O TYR A 124 14.588 10.570 9.746 1.00 23.13 O ATOM 1775 CB TYR A 124 17.729 10.343 10.143 1.00 65.44 C ATOM 1776 CG TYR A 124 17.880 8.829 10.157 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.358 8.048 11.190 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.544 8.179 9.120 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.496 6.673 11.181 1.00 14.31 C ATOM 1780 CE2 TYR A 124 18.684 6.806 9.109 1.00 12.12 C ATOM 1781 CZ TYR A 124 18.159 6.057 10.138 1.00 5.42 C ATOM 1782 OH TYR A 124 18.301 4.687 10.128 1.00 60.35 O ATOM 0 H TYR A 124 18.378 12.323 8.781 1.00 53.44 H new ATOM 0 HA TYR A 124 16.721 10.051 8.275 1.00 1.24 H new ATOM 0 HB2 TYR A 124 18.718 10.797 10.083 1.00 65.44 H new ATOM 0 HB3 TYR A 124 17.287 10.664 11.087 1.00 65.44 H new ATOM 0 HD1 TYR A 124 16.839 8.525 12.008 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.957 8.760 8.309 1.00 13.25 H new ATOM 0 HE1 TYR A 124 17.087 6.082 11.987 1.00 14.31 H new ATOM 0 HE2 TYR A 124 19.204 6.321 8.296 1.00 12.12 H new ATOM 0 HH TYR A 124 19.240 4.457 9.966 1.00 60.35 H new ATOM 1792 N SER A 125 15.417 12.670 9.616 1.00 23.21 N ATOM 1793 CA SER A 125 14.212 13.394 9.971 1.00 62.44 C ATOM 1794 C SER A 125 14.556 14.877 9.922 1.00 2.13 C ATOM 1795 O SER A 125 15.689 15.254 10.222 1.00 5.11 O ATOM 1796 CB SER A 125 13.717 13.005 11.376 1.00 61.32 C ATOM 1797 OG SER A 125 12.617 13.808 11.780 1.00 44.54 O ATOM 0 H SER A 125 16.219 13.283 9.472 1.00 23.21 H new ATOM 0 HA SER A 125 13.408 13.152 9.276 1.00 62.44 H new ATOM 0 HB2 SER A 125 13.424 11.955 11.382 1.00 61.32 H new ATOM 0 HB3 SER A 125 14.531 13.113 12.093 1.00 61.32 H new ATOM 0 HG SER A 125 12.101 14.077 10.991 1.00 44.54 H new ATOM 1803 N ASN A 126 13.619 15.722 9.524 1.00 23.44 N ATOM 1804 CA ASN A 126 13.877 17.163 9.525 1.00 73.42 C ATOM 1805 C ASN A 126 14.209 17.608 10.947 1.00 24.25 C ATOM 1806 O ASN A 126 15.008 18.522 11.173 1.00 64.13 O ATOM 1807 CB ASN A 126 12.670 17.949 8.993 1.00 54.23 C ATOM 1808 CG ASN A 126 12.932 19.447 8.941 1.00 23.41 C ATOM 1809 OD1 ASN A 126 14.066 19.883 8.728 1.00 4.50 O ATOM 1810 ND2 ASN A 126 11.891 20.243 9.146 1.00 5.31 N ATOM 0 H ASN A 126 12.691 15.449 9.202 1.00 23.44 H new ATOM 0 HA ASN A 126 14.719 17.368 8.864 1.00 73.42 H new ATOM 0 HB2 ASN A 126 12.419 17.592 7.994 1.00 54.23 H new ATOM 0 HB3 ASN A 126 11.805 17.756 9.628 1.00 54.23 H new ATOM 0 HD21 ASN A 126 12.013 21.256 9.131 1.00 5.31 H new ATOM 0 HD22 ASN A 126 10.969 19.842 9.319 1.00 5.31 H new ATOM 1817 N ALA A 127 13.607 16.912 11.900 1.00 54.04 N ATOM 1818 CA ALA A 127 13.744 17.225 13.312 1.00 54.10 C ATOM 1819 C ALA A 127 15.003 16.598 13.929 1.00 52.15 C ATOM 1820 O ALA A 127 15.231 16.721 15.130 1.00 1.24 O ATOM 1821 CB ALA A 127 12.498 16.751 14.041 1.00 41.33 C ATOM 0 H ALA A 127 13.006 16.109 11.713 1.00 54.04 H new ATOM 0 HA ALA A 127 13.853 18.304 13.416 1.00 54.10 H new ATOM 0 HB1 ALA A 127 12.588 16.980 15.103 1.00 41.33 H new ATOM 0 HB2 ALA A 127 11.623 17.258 13.634 1.00 41.33 H new ATOM 0 HB3 ALA A 127 12.387 15.675 13.910 1.00 41.33 H new ATOM 1827 N THR A 128 15.841 15.963 13.112 1.00 1.20 N ATOM 1828 CA THR A 128 17.052 15.314 13.626 1.00 2.03 C ATOM 1829 C THR A 128 18.231 16.272 13.496 1.00 41.31 C ATOM 1830 O THR A 128 19.327 16.007 13.984 1.00 64.41 O ATOM 1831 CB THR A 128 17.371 13.982 12.883 1.00 53.22 C ATOM 1832 OG1 THR A 128 18.199 13.146 13.700 1.00 44.43 O ATOM 1833 CG2 THR A 128 18.087 14.226 11.554 1.00 73.21 C ATOM 0 H THR A 128 15.709 15.883 12.104 1.00 1.20 H new ATOM 0 HA THR A 128 16.877 15.066 14.673 1.00 2.03 H new ATOM 0 HB THR A 128 16.418 13.494 12.681 1.00 53.22 H new ATOM 0 HG1 THR A 128 18.894 13.690 14.126 1.00 44.43 H new ATOM 0 HG21 THR A 128 18.290 13.271 11.070 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.455 14.834 10.907 1.00 73.21 H new ATOM 0 HG23 THR A 128 19.027 14.747 11.737 1.00 73.21 H new ATOM 1841 N ARG A 129 17.974 17.393 12.829 1.00 15.30 N ATOM 1842 CA ARG A 129 18.997 18.383 12.532 1.00 1.24 C ATOM 1843 C ARG A 129 18.617 19.741 13.123 1.00 21.22 C ATOM 1844 O ARG A 129 19.401 20.365 13.839 1.00 60.25 O ATOM 1845 CB ARG A 129 19.162 18.478 11.002 1.00 61.34 C ATOM 1846 CG ARG A 129 17.860 18.766 10.250 1.00 45.30 C ATOM 1847 CD ARG A 129 18.022 18.680 8.735 1.00 1.10 C ATOM 1848 NE ARG A 129 16.810 19.116 8.028 1.00 10.14 N ATOM 1849 CZ ARG A 129 16.620 19.006 6.707 1.00 72.04 C ATOM 1850 NH1 ARG A 129 17.541 18.440 5.932 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 15.499 19.466 6.162 1.00 55.55 N ATOM 0 H ARG A 129 17.048 17.639 12.480 1.00 15.30 H new ATOM 0 HA ARG A 129 19.943 18.082 12.982 1.00 1.24 H new ATOM 0 HB2 ARG A 129 19.883 19.263 10.773 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.582 17.542 10.634 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.096 18.057 10.570 1.00 45.30 H new ATOM 0 HG3 ARG A 129 17.504 19.761 10.517 1.00 45.30 H new ATOM 0 HD2 ARG A 129 18.865 19.297 8.425 1.00 1.10 H new ATOM 0 HD3 ARG A 129 18.257 17.654 8.453 1.00 1.10 H new ATOM 0 HE ARG A 129 16.061 19.531 8.582 1.00 10.14 H new ATOM 0 HH11 ARG A 129 18.404 18.084 6.343 1.00 12.15 H new ATOM 0 HH12 ARG A 129 17.384 18.362 4.927 1.00 12.15 H new ATOM 0 HH21 ARG A 129 14.787 19.901 6.749 1.00 55.55 H new ATOM 0 HH22 ARG A 129 15.350 19.384 5.156 1.00 55.55 H new ATOM 1865 N ASN A 130 17.411 20.193 12.801 1.00 53.23 N ATOM 1866 CA ASN A 130 16.919 21.499 13.231 1.00 71.44 C ATOM 1867 C ASN A 130 16.442 21.473 14.681 1.00 71.52 C ATOM 1868 O ASN A 130 16.588 22.456 15.410 1.00 41.25 O ATOM 1869 CB ASN A 130 15.801 21.953 12.284 1.00 51.21 C ATOM 1870 CG ASN A 130 16.329 22.216 10.880 1.00 65.44 C ATOM 1871 OD1 ASN A 130 17.407 22.781 10.708 1.00 64.05 O ATOM 1872 ND2 ASN A 130 15.606 21.765 9.868 1.00 32.23 N ATOM 0 H ASN A 130 16.746 19.666 12.235 1.00 53.23 H new ATOM 0 HA ASN A 130 17.739 22.216 13.187 1.00 71.44 H new ATOM 0 HB2 ASN A 130 15.024 21.189 12.244 1.00 51.21 H new ATOM 0 HB3 ASN A 130 15.338 22.859 12.675 1.00 51.21 H new ATOM 0 HD21 ASN A 130 15.939 21.882 8.911 1.00 32.23 H new ATOM 0 HD22 ASN A 130 14.715 21.300 10.045 1.00 32.23 H new ATOM 1879 N ASN A 131 15.875 20.343 15.098 1.00 23.53 N ATOM 1880 CA ASN A 131 15.347 20.202 16.456 1.00 43.51 C ATOM 1881 C ASN A 131 16.439 19.718 17.406 1.00 71.03 C ATOM 1882 O ASN A 131 16.567 20.213 18.527 1.00 72.12 O ATOM 1883 CB ASN A 131 14.166 19.223 16.476 1.00 43.33 C ATOM 1884 CG ASN A 131 13.461 19.170 17.826 1.00 4.41 C ATOM 1885 OD1 ASN A 131 13.818 18.379 18.698 1.00 52.34 O ATOM 1886 ND2 ASN A 131 12.451 20.012 18.004 1.00 53.22 N ATOM 0 H ASN A 131 15.769 19.512 14.517 1.00 23.53 H new ATOM 0 HA ASN A 131 14.998 21.180 16.789 1.00 43.51 H new ATOM 0 HB2 ASN A 131 13.448 19.512 15.708 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.523 18.226 16.219 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.942 20.018 18.888 1.00 53.22 H new ATOM 0 HD22 ASN A 131 12.184 20.653 17.257 1.00 53.22 H new ATOM 1893 N VAL A 132 17.227 18.749 16.947 1.00 22.24 N ATOM 1894 CA VAL A 132 18.321 18.201 17.743 1.00 51.15 C ATOM 1895 C VAL A 132 19.591 19.009 17.510 1.00 30.12 C ATOM 1896 O VAL A 132 19.994 19.230 16.366 1.00 33.10 O ATOM 1897 CB VAL A 132 18.583 16.710 17.404 1.00 54.43 C ATOM 1898 CG1 VAL A 132 19.715 16.140 18.260 1.00 31.31 C ATOM 1899 CG2 VAL A 132 17.307 15.887 17.574 1.00 70.22 C ATOM 0 H VAL A 132 17.127 18.326 16.024 1.00 22.24 H new ATOM 0 HA VAL A 132 18.031 18.264 18.792 1.00 51.15 H new ATOM 0 HB VAL A 132 18.893 16.652 16.361 1.00 54.43 H new ATOM 0 HG11 VAL A 132 19.876 15.094 18.000 1.00 31.31 H new ATOM 0 HG12 VAL A 132 20.629 16.704 18.077 1.00 31.31 H new ATOM 0 HG13 VAL A 132 19.447 16.215 19.314 1.00 31.31 H new ATOM 0 HG21 VAL A 132 17.512 14.844 17.332 1.00 70.22 H new ATOM 0 HG22 VAL A 132 16.962 15.959 18.606 1.00 70.22 H new ATOM 0 HG23 VAL A 132 16.535 16.270 16.906 1.00 70.22 H new ATOM 1909 N ALA A 133 20.211 19.458 18.594 1.00 44.32 N ATOM 1910 CA ALA A 133 21.405 20.285 18.507 1.00 45.42 C ATOM 1911 C ALA A 133 22.611 19.462 18.094 1.00 30.31 C ATOM 1912 O ALA A 133 23.360 18.946 18.930 1.00 14.22 O ATOM 1913 CB ALA A 133 21.651 21.002 19.829 1.00 22.23 C ATOM 0 H ALA A 133 19.904 19.262 19.547 1.00 44.32 H new ATOM 0 HA ALA A 133 21.245 21.039 17.736 1.00 45.42 H new ATOM 0 HB1 ALA A 133 22.548 21.617 19.748 1.00 22.23 H new ATOM 0 HB2 ALA A 133 20.796 21.636 20.063 1.00 22.23 H new ATOM 0 HB3 ALA A 133 21.786 20.267 20.622 1.00 22.23 H new ATOM 1919 N VAL A 134 22.764 19.308 16.788 1.00 55.21 N ATOM 1920 CA VAL A 134 23.905 18.617 16.229 1.00 14.23 C ATOM 1921 C VAL A 134 24.926 19.619 15.683 1.00 75.02 C ATOM 1922 O VAL A 134 24.614 20.409 14.785 1.00 44.45 O ATOM 1923 CB VAL A 134 23.474 17.654 15.101 1.00 13.33 C ATOM 1924 CG1 VAL A 134 24.674 16.863 14.603 1.00 2.32 C ATOM 1925 CG2 VAL A 134 22.359 16.720 15.577 1.00 40.12 C ATOM 0 H VAL A 134 22.103 19.657 16.094 1.00 55.21 H new ATOM 0 HA VAL A 134 24.363 18.036 17.029 1.00 14.23 H new ATOM 0 HB VAL A 134 23.080 18.242 14.272 1.00 13.33 H new ATOM 0 HG11 VAL A 134 24.360 16.187 13.808 1.00 2.32 H new ATOM 0 HG12 VAL A 134 25.428 17.550 14.218 1.00 2.32 H new ATOM 0 HG13 VAL A 134 25.095 16.285 15.425 1.00 2.32 H new ATOM 0 HG21 VAL A 134 22.073 16.052 14.765 1.00 40.12 H new ATOM 0 HG22 VAL A 134 22.714 16.132 16.423 1.00 40.12 H new ATOM 0 HG23 VAL A 134 21.495 17.311 15.882 1.00 40.12 H new ATOM 1935 N ARG A 135 26.131 19.605 16.247 1.00 5.32 N ATOM 1936 CA ARG A 135 27.224 20.435 15.755 1.00 35.41 C ATOM 1937 C ARG A 135 28.008 19.664 14.699 1.00 62.34 C ATOM 1938 O ARG A 135 28.699 18.691 15.013 1.00 24.24 O ATOM 1939 CB ARG A 135 28.159 20.865 16.900 1.00 72.41 C ATOM 1940 CG ARG A 135 27.440 21.547 18.062 1.00 24.53 C ATOM 1941 CD ARG A 135 28.399 22.330 18.958 1.00 72.30 C ATOM 1942 NE ARG A 135 29.511 21.515 19.467 1.00 54.11 N ATOM 1943 CZ ARG A 135 30.019 21.626 20.699 1.00 2.05 C ATOM 1944 NH1 ARG A 135 29.446 22.419 21.598 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 31.082 20.916 21.041 1.00 32.21 N ATOM 0 H ARG A 135 26.375 19.024 17.049 1.00 5.32 H new ATOM 0 HA ARG A 135 26.802 21.338 15.314 1.00 35.41 H new ATOM 0 HB2 ARG A 135 28.685 19.987 17.276 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.914 21.544 16.504 1.00 72.41 H new ATOM 0 HG2 ARG A 135 26.680 22.222 17.670 1.00 24.53 H new ATOM 0 HG3 ARG A 135 26.922 20.795 18.657 1.00 24.53 H new ATOM 0 HD2 ARG A 135 28.802 23.174 18.398 1.00 72.30 H new ATOM 0 HD3 ARG A 135 27.844 22.742 19.801 1.00 72.30 H new ATOM 0 HE ARG A 135 29.921 20.821 18.841 1.00 54.11 H new ATOM 0 HH11 ARG A 135 28.611 22.950 21.351 1.00 12.22 H new ATOM 0 HH12 ARG A 135 29.841 22.497 22.535 1.00 12.22 H new ATOM 0 HH21 ARG A 135 31.513 20.285 20.365 1.00 32.21 H new ATOM 0 HH22 ARG A 135 31.471 21.000 21.980 1.00 32.21 H new ATOM 1959 N LEU A 136 27.866 20.079 13.446 1.00 14.32 N ATOM 1960 CA LEU A 136 28.545 19.432 12.333 1.00 2.32 C ATOM 1961 C LEU A 136 29.975 19.932 12.202 1.00 50.04 C ATOM 1962 O LEU A 136 30.222 21.072 11.804 1.00 1.31 O ATOM 1963 CB LEU A 136 27.771 19.659 11.034 1.00 33.50 C ATOM 1964 CG LEU A 136 26.476 18.845 10.926 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.661 19.283 9.718 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.800 17.355 10.849 1.00 32.41 C ATOM 0 H LEU A 136 27.280 20.869 13.175 1.00 14.32 H new ATOM 0 HA LEU A 136 28.582 18.361 12.532 1.00 2.32 H new ATOM 0 HB2 LEU A 136 27.530 20.718 10.948 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.416 19.409 10.191 1.00 33.50 H new ATOM 0 HG LEU A 136 25.876 19.026 11.818 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.747 18.692 9.662 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.405 20.338 9.815 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.246 19.133 8.811 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.874 16.785 10.773 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.419 17.162 9.972 1.00 32.41 H new ATOM 0 HD23 LEU A 136 27.339 17.053 11.747 1.00 32.41 H new ATOM 1978 N VAL A 137 30.905 19.060 12.543 1.00 24.14 N ATOM 1979 CA VAL A 137 32.326 19.357 12.498 1.00 11.21 C ATOM 1980 C VAL A 137 33.007 18.451 11.477 1.00 22.22 C ATOM 1981 O VAL A 137 33.004 17.230 11.610 1.00 60.11 O ATOM 1982 CB VAL A 137 32.969 19.195 13.905 1.00 74.42 C ATOM 1983 CG1 VAL A 137 32.261 18.095 14.690 1.00 2.12 C ATOM 1984 CG2 VAL A 137 34.468 18.901 13.809 1.00 51.44 C ATOM 0 H VAL A 137 30.694 18.115 12.863 1.00 24.14 H new ATOM 0 HA VAL A 137 32.462 20.394 12.192 1.00 11.21 H new ATOM 0 HB VAL A 137 32.850 20.140 14.434 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.723 17.994 15.672 1.00 2.12 H new ATOM 0 HG12 VAL A 137 31.208 18.352 14.809 1.00 2.12 H new ATOM 0 HG13 VAL A 137 32.345 17.151 14.151 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.883 18.794 14.811 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.623 17.977 13.252 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.968 19.722 13.295 1.00 51.44 H new ATOM 1994 N VAL A 138 33.560 19.057 10.443 1.00 43.23 N ATOM 1995 CA VAL A 138 34.198 18.314 9.366 1.00 53.11 C ATOM 1996 C VAL A 138 35.678 18.099 9.675 1.00 13.33 C ATOM 1997 O VAL A 138 36.357 18.984 10.205 1.00 44.02 O ATOM 1998 CB VAL A 138 34.042 19.013 7.998 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.597 19.450 7.773 1.00 20.25 C ATOM 2000 CG2 VAL A 138 35.008 20.178 7.883 1.00 13.44 C ATOM 0 H VAL A 138 33.581 20.070 10.324 1.00 43.23 H new ATOM 0 HA VAL A 138 33.694 17.350 9.300 1.00 53.11 H new ATOM 0 HB VAL A 138 34.290 18.300 7.212 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.512 19.940 6.803 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.945 18.577 7.797 1.00 20.25 H new ATOM 0 HG13 VAL A 138 32.301 20.146 8.558 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.884 20.659 6.913 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.804 20.899 8.674 1.00 13.44 H new ATOM 0 HG23 VAL A 138 36.031 19.814 7.979 1.00 13.44 H new ATOM 2010 N ALA A 139 36.153 16.910 9.376 1.00 53.03 N ATOM 2011 CA ALA A 139 37.524 16.512 9.686 1.00 12.31 C ATOM 2012 C ALA A 139 38.224 15.969 8.443 1.00 73.13 C ATOM 2013 O ALA A 139 37.607 15.293 7.619 1.00 43.50 O ATOM 2014 CB ALA A 139 37.527 15.471 10.800 1.00 22.50 C ATOM 0 H ALA A 139 35.606 16.186 8.911 1.00 53.03 H new ATOM 0 HA ALA A 139 38.072 17.391 10.025 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.553 15.181 11.024 1.00 22.50 H new ATOM 0 HB2 ALA A 139 37.066 15.893 11.693 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.964 14.594 10.480 1.00 22.50 H new ATOM 2021 N MET B 1 27.259 23.055 26.677 1.00 72.34 N ATOM 2022 CA MET B 1 26.344 23.346 27.773 1.00 63.32 C ATOM 2023 C MET B 1 26.650 22.460 28.979 1.00 71.35 C ATOM 2024 O MET B 1 27.654 21.745 28.997 1.00 2.40 O ATOM 2025 CB MET B 1 24.893 23.131 27.335 1.00 41.04 C ATOM 2026 CG MET B 1 24.586 21.688 26.999 1.00 5.33 C ATOM 2027 SD MET B 1 22.832 21.399 26.696 1.00 24.33 S ATOM 2028 CE MET B 1 22.765 19.619 26.861 1.00 72.42 C ATOM 0 H1 MET B 1 27.911 23.855 26.547 1.00 72.34 H new ATOM 0 H2 MET B 1 27.804 22.197 26.898 1.00 72.34 H new ATOM 0 H3 MET B 1 26.717 22.905 25.802 1.00 72.34 H new ATOM 0 HA MET B 1 26.480 24.390 28.055 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.226 23.463 28.130 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.686 23.753 26.464 1.00 41.04 H new ATOM 0 HG2 MET B 1 25.155 21.396 26.117 1.00 5.33 H new ATOM 0 HG3 MET B 1 24.918 21.050 27.818 1.00 5.33 H new ATOM 0 HE1 MET B 1 21.728 19.287 26.808 1.00 72.42 H new ATOM 0 HE2 MET B 1 23.335 19.157 26.055 1.00 72.42 H new ATOM 0 HE3 MET B 1 23.191 19.326 27.821 1.00 72.42 H new ATOM 2038 N ASN B 2 25.769 22.501 29.972 1.00 33.33 N ATOM 2039 CA ASN B 2 25.924 21.694 31.183 1.00 51.30 C ATOM 2040 C ASN B 2 25.506 20.243 30.927 1.00 60.31 C ATOM 2041 O ASN B 2 24.422 19.811 31.321 1.00 61.35 O ATOM 2042 CB ASN B 2 25.118 22.290 32.350 1.00 21.53 C ATOM 2043 CG ASN B 2 25.255 21.485 33.639 1.00 32.42 C ATOM 2044 OD1 ASN B 2 26.271 20.828 33.874 1.00 51.33 O ATOM 2045 ND2 ASN B 2 24.242 21.539 34.489 1.00 42.33 N ATOM 0 H ASN B 2 24.934 23.087 29.964 1.00 33.33 H new ATOM 0 HA ASN B 2 26.978 21.704 31.459 1.00 51.30 H new ATOM 0 HB2 ASN B 2 25.450 23.313 32.529 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.066 22.341 32.070 1.00 21.53 H new ATOM 0 HD21 ASN B 2 24.288 21.027 35.370 1.00 42.33 H new ATOM 0 HD22 ASN B 2 23.416 22.093 34.263 1.00 42.33 H new ATOM 2052 N ILE B 3 26.353 19.519 30.211 1.00 21.23 N ATOM 2053 CA ILE B 3 26.157 18.096 29.975 1.00 72.42 C ATOM 2054 C ILE B 3 26.298 17.297 31.267 1.00 64.03 C ATOM 2055 O ILE B 3 27.295 17.417 31.983 1.00 40.30 O ATOM 2056 CB ILE B 3 27.171 17.563 28.935 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.998 18.307 27.606 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.005 16.057 28.738 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.684 18.004 26.926 1.00 13.01 C ATOM 0 H ILE B 3 27.194 19.900 29.778 1.00 21.23 H new ATOM 0 HA ILE B 3 25.145 17.971 29.589 1.00 72.42 H new ATOM 0 HB ILE B 3 28.180 17.742 29.307 1.00 60.30 H new ATOM 0 HG12 ILE B 3 27.069 19.380 27.785 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.817 18.040 26.938 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.728 15.704 28.003 1.00 62.10 H new ATOM 0 HG22 ILE B 3 27.172 15.545 29.686 1.00 62.10 H new ATOM 0 HG23 ILE B 3 25.996 15.845 28.385 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.621 18.561 25.991 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.620 16.936 26.718 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.861 18.296 27.578 1.00 13.01 H new ATOM 2071 N LEU B 4 25.293 16.484 31.548 1.00 23.11 N ATOM 2072 CA LEU B 4 25.318 15.581 32.691 1.00 23.43 C ATOM 2073 C LEU B 4 26.037 14.290 32.319 1.00 41.14 C ATOM 2074 O LEU B 4 26.884 13.803 33.068 1.00 62.34 O ATOM 2075 CB LEU B 4 23.894 15.262 33.156 1.00 50.44 C ATOM 2076 CG LEU B 4 23.051 16.470 33.583 1.00 31.23 C ATOM 2077 CD1 LEU B 4 21.627 16.034 33.931 1.00 75.25 C ATOM 2078 CD2 LEU B 4 23.701 17.195 34.762 1.00 11.04 C ATOM 0 H LEU B 4 24.439 16.430 30.993 1.00 23.11 H new ATOM 0 HA LEU B 4 25.852 16.070 33.506 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.374 14.746 32.349 1.00 50.44 H new ATOM 0 HB3 LEU B 4 23.951 14.567 33.994 1.00 50.44 H new ATOM 0 HG LEU B 4 23.000 17.166 32.746 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.043 16.904 34.232 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.165 15.571 33.059 1.00 75.25 H new ATOM 0 HD13 LEU B 4 21.656 15.316 34.751 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.086 18.048 35.048 1.00 11.04 H new ATOM 0 HD22 LEU B 4 23.788 16.511 35.606 1.00 11.04 H new ATOM 0 HD23 LEU B 4 24.693 17.543 34.473 1.00 11.04 H new ATOM 2090 N TYR B 5 25.705 13.748 31.147 1.00 23.42 N ATOM 2091 CA TYR B 5 26.295 12.487 30.693 1.00 44.15 C ATOM 2092 C TYR B 5 26.626 12.562 29.203 1.00 24.15 C ATOM 2093 O TYR B 5 25.796 12.984 28.406 1.00 75.34 O ATOM 2094 CB TYR B 5 25.322 11.324 30.961 1.00 21.21 C ATOM 2095 CG TYR B 5 25.921 9.944 30.736 1.00 10.12 C ATOM 2096 CD1 TYR B 5 26.087 9.432 29.451 1.00 52.12 C ATOM 2097 CD2 TYR B 5 26.331 9.158 31.812 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.645 8.187 29.244 1.00 75.45 C ATOM 2099 CE2 TYR B 5 26.886 7.910 31.607 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.043 7.431 30.324 1.00 52.51 C ATOM 2101 OH TYR B 5 27.617 6.197 30.120 1.00 25.44 O ATOM 0 H TYR B 5 25.035 14.159 30.497 1.00 23.42 H new ATOM 0 HA TYR B 5 27.218 12.312 31.247 1.00 44.15 H new ATOM 0 HB2 TYR B 5 24.969 11.391 31.990 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.450 11.439 30.317 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.773 10.020 28.601 1.00 52.12 H new ATOM 0 HD2 TYR B 5 26.213 9.530 32.819 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.769 7.808 28.240 1.00 75.45 H new ATOM 0 HE2 TYR B 5 27.196 7.311 32.450 1.00 10.31 H new ATOM 0 HH TYR B 5 28.055 5.899 30.945 1.00 25.44 H new ATOM 2111 N LYS B 6 27.842 12.168 28.835 1.00 30.03 N ATOM 2112 CA LYS B 6 28.250 12.141 27.429 1.00 63.12 C ATOM 2113 C LYS B 6 29.083 10.895 27.100 1.00 12.41 C ATOM 2114 O LYS B 6 29.917 10.454 27.895 1.00 54.02 O ATOM 2115 CB LYS B 6 29.027 13.418 27.072 1.00 22.40 C ATOM 2116 CG LYS B 6 29.670 13.382 25.686 1.00 43.31 C ATOM 2117 CD LYS B 6 30.120 14.762 25.217 1.00 65.01 C ATOM 2118 CE LYS B 6 28.933 15.653 24.859 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.356 16.884 24.141 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.563 11.863 29.488 1.00 30.03 H new ATOM 0 HA LYS B 6 27.344 12.097 26.825 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.350 14.271 27.126 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.804 13.580 27.819 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.528 12.710 25.704 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.959 12.972 24.969 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.709 15.238 26.001 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.771 14.657 24.349 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.234 15.093 24.238 1.00 23.11 H new ATOM 0 HE3 LYS B 6 28.400 15.929 25.769 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 28.530 17.320 23.683 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.771 17.555 24.818 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 30.063 16.639 23.419 1.00 52.41 H new ATOM 2133 N THR B 7 28.837 10.344 25.911 1.00 10.14 N ATOM 2134 CA THR B 7 29.551 9.180 25.402 1.00 42.05 C ATOM 2135 C THR B 7 29.770 9.350 23.892 1.00 63.52 C ATOM 2136 O THR B 7 28.936 9.941 23.199 1.00 72.52 O ATOM 2137 CB THR B 7 28.765 7.871 25.700 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.455 6.718 25.183 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.355 7.923 25.116 1.00 24.11 C ATOM 0 H THR B 7 28.128 10.700 25.270 1.00 10.14 H new ATOM 0 HA THR B 7 30.516 9.103 25.903 1.00 42.05 H new ATOM 0 HB THR B 7 28.694 7.784 26.784 1.00 0.35 H new ATOM 0 HG1 THR B 7 30.422 6.875 25.211 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.833 6.993 25.342 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.811 8.760 25.553 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.413 8.053 24.035 1.00 24.11 H new ATOM 2147 N ALA B 8 30.903 8.860 23.389 1.00 4.15 N ATOM 2148 CA ALA B 8 31.259 9.032 21.980 1.00 51.31 C ATOM 2149 C ALA B 8 31.383 7.684 21.277 1.00 33.43 C ATOM 2150 O ALA B 8 31.778 6.686 21.889 1.00 64.22 O ATOM 2151 CB ALA B 8 32.561 9.816 21.861 1.00 24.44 C ATOM 0 H ALA B 8 31.590 8.341 23.936 1.00 4.15 H new ATOM 0 HA ALA B 8 30.462 9.593 21.492 1.00 51.31 H new ATOM 0 HB1 ALA B 8 32.817 9.938 20.809 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.439 10.796 22.321 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.360 9.274 22.368 1.00 24.44 H new ATOM 2157 N ALA B 9 31.060 7.662 19.990 1.00 21.22 N ATOM 2158 CA ALA B 9 31.117 6.443 19.194 1.00 20.22 C ATOM 2159 C ALA B 9 31.733 6.730 17.828 1.00 31.45 C ATOM 2160 O ALA B 9 31.410 7.731 17.195 1.00 1.21 O ATOM 2161 CB ALA B 9 29.721 5.847 19.035 1.00 3.15 C ATOM 0 H ALA B 9 30.753 8.484 19.471 1.00 21.22 H new ATOM 0 HA ALA B 9 31.745 5.718 19.712 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.780 4.937 18.438 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.312 5.611 20.017 1.00 3.15 H new ATOM 0 HB3 ALA B 9 29.073 6.567 18.536 1.00 3.15 H new ATOM 2167 N THR B 10 32.627 5.857 17.388 1.00 33.23 N ATOM 2168 CA THR B 10 33.249 5.986 16.080 1.00 64.31 C ATOM 2169 C THR B 10 32.541 5.068 15.081 1.00 63.33 C ATOM 2170 O THR B 10 32.354 3.877 15.338 1.00 30.04 O ATOM 2171 CB THR B 10 34.767 5.659 16.140 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.353 5.774 14.836 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.025 4.261 16.696 1.00 23.24 C ATOM 0 H THR B 10 32.939 5.046 17.923 1.00 33.23 H new ATOM 0 HA THR B 10 33.150 7.021 15.752 1.00 64.31 H new ATOM 0 HB THR B 10 35.228 6.381 16.814 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.310 5.567 14.888 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.098 4.072 16.721 1.00 23.24 H new ATOM 0 HG22 THR B 10 34.620 4.191 17.706 1.00 23.24 H new ATOM 0 HG23 THR B 10 34.541 3.521 16.059 1.00 23.24 H new ATOM 2181 N SER B 11 32.113 5.633 13.962 1.00 64.42 N ATOM 2182 CA SER B 11 31.381 4.879 12.953 1.00 20.54 C ATOM 2183 C SER B 11 32.098 4.957 11.607 1.00 44.42 C ATOM 2184 O SER B 11 32.172 6.016 10.998 1.00 74.01 O ATOM 2185 CB SER B 11 29.959 5.447 12.844 1.00 74.14 C ATOM 2186 OG SER B 11 29.177 4.745 11.898 1.00 11.25 O ATOM 0 H SER B 11 32.260 6.615 13.728 1.00 64.42 H new ATOM 0 HA SER B 11 31.330 3.830 13.243 1.00 20.54 H new ATOM 0 HB2 SER B 11 29.475 5.401 13.820 1.00 74.14 H new ATOM 0 HB3 SER B 11 30.010 6.499 12.563 1.00 74.14 H new ATOM 0 HG SER B 11 29.432 3.799 11.901 1.00 11.25 H new ATOM 2192 N THR B 12 32.620 3.830 11.145 1.00 44.31 N ATOM 2193 CA THR B 12 33.341 3.777 9.884 1.00 14.13 C ATOM 2194 C THR B 12 32.443 3.212 8.788 1.00 53.42 C ATOM 2195 O THR B 12 31.435 2.576 9.073 1.00 32.44 O ATOM 2196 CB THR B 12 34.600 2.894 10.027 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.328 3.280 11.200 1.00 14.42 O ATOM 2198 CG2 THR B 12 35.508 3.014 8.813 1.00 31.31 C ATOM 0 H THR B 12 32.556 2.935 11.629 1.00 44.31 H new ATOM 0 HA THR B 12 33.642 4.789 9.614 1.00 14.13 H new ATOM 0 HB THR B 12 34.273 1.857 10.109 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.126 2.718 11.290 1.00 14.42 H new ATOM 0 HG21 THR B 12 36.383 2.379 8.949 1.00 31.31 H new ATOM 0 HG22 THR B 12 34.966 2.699 7.921 1.00 31.31 H new ATOM 0 HG23 THR B 12 35.826 4.050 8.697 1.00 31.31 H new ATOM 2206 N GLY B 13 32.808 3.447 7.539 1.00 25.11 N ATOM 2207 CA GLY B 13 32.061 2.891 6.427 1.00 71.12 C ATOM 2208 C GLY B 13 32.726 1.646 5.881 1.00 70.11 C ATOM 2209 O GLY B 13 32.891 1.521 4.669 1.00 42.34 O ATOM 0 H GLY B 13 33.612 4.015 7.272 1.00 25.11 H new ATOM 0 HA2 GLY B 13 31.048 2.652 6.751 1.00 71.12 H new ATOM 0 HA3 GLY B 13 31.975 3.636 5.636 1.00 71.12 H new ATOM 2213 N GLY B 14 33.066 0.718 6.792 1.00 21.54 N ATOM 2214 CA GLY B 14 33.857 -0.471 6.463 1.00 31.21 C ATOM 2215 C GLY B 14 33.485 -1.131 5.142 1.00 73.40 C ATOM 2216 O GLY B 14 33.941 -0.703 4.081 1.00 13.01 O ATOM 0 H GLY B 14 32.799 0.775 7.775 1.00 21.54 H new ATOM 0 HA2 GLY B 14 34.911 -0.194 6.432 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.743 -1.201 7.264 1.00 31.21 H new ATOM 2220 N ARG B 15 32.688 -2.198 5.195 1.00 12.42 N ATOM 2221 CA ARG B 15 32.240 -2.855 3.965 1.00 62.32 C ATOM 2222 C ARG B 15 31.002 -2.149 3.424 1.00 53.41 C ATOM 2223 O ARG B 15 30.987 -1.690 2.281 1.00 34.04 O ATOM 2224 CB ARG B 15 31.956 -4.348 4.203 1.00 22.32 C ATOM 2225 CG ARG B 15 33.162 -5.135 4.721 1.00 23.03 C ATOM 2226 CD ARG B 15 34.419 -4.895 3.883 1.00 52.22 C ATOM 2227 NE ARG B 15 34.228 -5.223 2.467 1.00 65.14 N ATOM 2228 CZ ARG B 15 35.184 -5.130 1.537 1.00 55.23 C ATOM 2229 NH1 ARG B 15 36.414 -4.747 1.868 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 34.905 -5.425 0.276 1.00 51.30 N ATOM 0 H ARG B 15 32.344 -2.620 6.058 1.00 12.42 H new ATOM 0 HA ARG B 15 33.038 -2.787 3.226 1.00 62.32 H new ATOM 0 HB2 ARG B 15 31.139 -4.443 4.918 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.616 -4.796 3.269 1.00 22.32 H new ATOM 0 HG2 ARG B 15 33.359 -4.853 5.755 1.00 23.03 H new ATOM 0 HG3 ARG B 15 32.926 -6.199 4.720 1.00 23.03 H new ATOM 0 HD2 ARG B 15 34.716 -3.850 3.972 1.00 52.22 H new ATOM 0 HD3 ARG B 15 35.237 -5.494 4.283 1.00 52.22 H new ATOM 0 HE ARG B 15 33.306 -5.543 2.172 1.00 65.14 H new ATOM 0 HH11 ARG B 15 36.634 -4.521 2.838 1.00 21.14 H new ATOM 0 HH12 ARG B 15 37.137 -4.679 1.152 1.00 21.14 H new ATOM 0 HH21 ARG B 15 33.964 -5.722 0.018 1.00 51.30 H new ATOM 0 HH22 ARG B 15 35.631 -5.355 -0.437 1.00 51.30 H new ATOM 2244 N ASP B 16 29.973 -2.029 4.257 1.00 43.23 N ATOM 2245 CA ASP B 16 28.814 -1.210 3.914 1.00 64.45 C ATOM 2246 C ASP B 16 28.625 -0.157 4.998 1.00 45.23 C ATOM 2247 O ASP B 16 28.457 1.026 4.699 1.00 44.01 O ATOM 2248 CB ASP B 16 27.563 -2.087 3.784 1.00 65.33 C ATOM 2249 CG ASP B 16 26.328 -1.320 3.317 1.00 54.31 C ATOM 2250 OD1 ASP B 16 25.874 -1.554 2.178 1.00 24.34 O ATOM 2251 OD2 ASP B 16 25.793 -0.507 4.100 1.00 12.23 O1- ATOM 0 H ASP B 16 29.917 -2.484 5.168 1.00 43.23 H new ATOM 0 HA ASP B 16 28.977 -0.719 2.955 1.00 64.45 H new ATOM 0 HB2 ASP B 16 27.767 -2.895 3.081 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.351 -2.549 4.748 1.00 65.33 H new ATOM 2256 N GLY B 17 28.757 -0.582 6.258 1.00 22.41 N ATOM 2257 CA GLY B 17 28.882 0.356 7.352 1.00 74.22 C ATOM 2258 C GLY B 17 29.401 -0.323 8.599 1.00 32.04 C ATOM 2259 O GLY B 17 29.411 -1.549 8.681 1.00 11.23 O ATOM 0 H GLY B 17 28.779 -1.564 6.534 1.00 22.41 H new ATOM 0 HA2 GLY B 17 29.557 1.163 7.067 1.00 74.22 H new ATOM 0 HA3 GLY B 17 27.912 0.809 7.558 1.00 74.22 H new ATOM 2263 N ARG B 18 29.843 0.465 9.559 1.00 41.41 N ATOM 2264 CA ARG B 18 30.359 -0.051 10.820 1.00 45.30 C ATOM 2265 C ARG B 18 30.048 0.932 11.944 1.00 1.35 C ATOM 2266 O ARG B 18 30.101 2.141 11.741 1.00 0.54 O ATOM 2267 CB ARG B 18 31.877 -0.285 10.736 1.00 74.40 C ATOM 2268 CG ARG B 18 32.486 -0.758 12.054 1.00 53.04 C ATOM 2269 CD ARG B 18 34.002 -0.861 11.996 1.00 43.11 C ATOM 2270 NE ARG B 18 34.460 -1.876 11.043 1.00 64.22 N ATOM 2271 CZ ARG B 18 35.645 -2.487 11.116 1.00 63.34 C ATOM 2272 NH1 ARG B 18 36.469 -2.231 12.125 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 35.994 -3.368 10.187 1.00 54.01 N ATOM 0 H ARG B 18 29.856 1.483 9.491 1.00 41.41 H new ATOM 0 HA ARG B 18 29.875 -1.006 11.027 1.00 45.30 H new ATOM 0 HB2 ARG B 18 32.082 -1.025 9.962 1.00 74.40 H new ATOM 0 HB3 ARG B 18 32.364 0.640 10.429 1.00 74.40 H new ATOM 0 HG2 ARG B 18 32.203 -0.068 12.849 1.00 53.04 H new ATOM 0 HG3 ARG B 18 32.069 -1.731 12.314 1.00 53.04 H new ATOM 0 HD2 ARG B 18 34.418 0.107 11.718 1.00 43.11 H new ATOM 0 HD3 ARG B 18 34.385 -1.100 12.988 1.00 43.11 H new ATOM 0 HE ARG B 18 33.836 -2.131 10.278 1.00 64.22 H new ATOM 0 HH11 ARG B 18 36.198 -1.565 12.849 1.00 23.22 H new ATOM 0 HH12 ARG B 18 37.373 -2.700 12.177 1.00 23.22 H new ATOM 0 HH21 ARG B 18 35.357 -3.578 9.418 1.00 54.01 H new ATOM 0 HH22 ARG B 18 36.899 -3.835 10.242 1.00 54.01 H new ATOM 2287 N ALA B 19 29.739 0.405 13.120 1.00 25.44 N ATOM 2288 CA ALA B 19 29.417 1.224 14.280 1.00 25.14 C ATOM 2289 C ALA B 19 30.163 0.702 15.498 1.00 64.21 C ATOM 2290 O ALA B 19 30.029 -0.469 15.866 1.00 14.23 O ATOM 2291 CB ALA B 19 27.913 1.220 14.531 1.00 63.23 C ATOM 0 H ALA B 19 29.704 -0.599 13.297 1.00 25.44 H new ATOM 0 HA ALA B 19 29.728 2.251 14.089 1.00 25.14 H new ATOM 0 HB1 ALA B 19 27.688 1.836 15.401 1.00 63.23 H new ATOM 0 HB2 ALA B 19 27.397 1.622 13.659 1.00 63.23 H new ATOM 0 HB3 ALA B 19 27.577 0.199 14.713 1.00 63.23 H new ATOM 2297 N THR B 20 30.939 1.570 16.126 1.00 63.15 N ATOM 2298 CA THR B 20 31.753 1.193 17.267 1.00 31.24 C ATOM 2299 C THR B 20 31.609 2.216 18.387 1.00 2.34 C ATOM 2300 O THR B 20 31.994 3.376 18.234 1.00 75.11 O ATOM 2301 CB THR B 20 33.241 1.077 16.857 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.370 0.192 15.732 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.105 0.571 18.011 1.00 14.05 C ATOM 0 H THR B 20 31.022 2.551 15.860 1.00 63.15 H new ATOM 0 HA THR B 20 31.406 0.223 17.625 1.00 31.24 H new ATOM 0 HB THR B 20 33.591 2.073 16.586 1.00 15.15 H new ATOM 0 HG1 THR B 20 33.887 -0.598 15.995 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.143 0.502 17.686 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.033 1.263 18.850 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.756 -0.414 18.322 1.00 14.05 H new ATOM 2311 N SER B 21 31.052 1.790 19.512 1.00 21.31 N ATOM 2312 CA SER B 21 30.971 2.648 20.674 1.00 32.44 C ATOM 2313 C SER B 21 32.373 2.759 21.241 1.00 11.23 C ATOM 2314 O SER B 21 32.878 1.791 21.838 1.00 42.34 O ATOM 2315 CB SER B 21 29.995 2.093 21.718 1.00 31.41 C ATOM 2316 OG SER B 21 29.844 2.987 22.808 1.00 74.21 O ATOM 0 H SER B 21 30.653 0.860 19.640 1.00 21.31 H new ATOM 0 HA SER B 21 30.588 3.629 20.394 1.00 32.44 H new ATOM 0 HB2 SER B 21 29.025 1.915 21.254 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.356 1.131 22.081 1.00 31.41 H new ATOM 0 HG SER B 21 28.893 3.180 22.943 1.00 74.21 H new ATOM 2322 N HIS B 22 32.969 3.943 21.040 1.00 5.04 N ATOM 2323 CA HIS B 22 34.405 4.188 21.228 1.00 32.51 C ATOM 2324 C HIS B 22 34.877 3.806 22.624 1.00 35.24 C ATOM 2325 O HIS B 22 36.062 3.557 22.838 1.00 73.12 O ATOM 2326 CB HIS B 22 34.726 5.670 20.935 1.00 3.43 C ATOM 2327 CG HIS B 22 35.142 6.471 22.138 1.00 12.52 C ATOM 2328 ND1 HIS B 22 34.267 6.845 23.137 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.351 6.961 22.497 1.00 34.34 C ATOM 2330 CE1 HIS B 22 34.924 7.532 24.054 1.00 23.12 C ATOM 2331 NE2 HIS B 22 36.187 7.614 23.688 1.00 12.42 N ATOM 0 H HIS B 22 32.457 4.771 20.737 1.00 5.04 H new ATOM 0 HA HIS B 22 34.944 3.553 20.525 1.00 32.51 H new ATOM 0 HB2 HIS B 22 35.522 5.715 20.192 1.00 3.43 H new ATOM 0 HB3 HIS B 22 33.847 6.137 20.490 1.00 3.43 H new ATOM 0 HD1 HIS B 22 33.271 6.626 23.163 1.00 31.42 H new ATOM 0 HD2 HIS B 22 37.274 6.856 21.946 1.00 34.34 H new ATOM 0 HE1 HIS B 22 34.498 7.955 24.952 1.00 23.12 H new ATOM 2340 N ASP B 23 33.945 3.727 23.560 1.00 44.12 N ATOM 2341 CA ASP B 23 34.269 3.368 24.937 1.00 0.24 C ATOM 2342 C ASP B 23 34.420 1.851 25.049 1.00 62.21 C ATOM 2343 O ASP B 23 34.346 1.287 26.140 1.00 40.03 O ATOM 2344 CB ASP B 23 33.158 3.855 25.882 1.00 12.04 C ATOM 2345 CG ASP B 23 32.790 5.317 25.666 1.00 5.31 C ATOM 2346 OD1 ASP B 23 32.077 5.615 24.679 1.00 63.54 O ATOM 2347 OD2 ASP B 23 33.200 6.169 26.477 1.00 33.23 O1- ATOM 0 H ASP B 23 32.955 3.907 23.394 1.00 44.12 H new ATOM 0 HA ASP B 23 35.207 3.845 25.221 1.00 0.24 H new ATOM 0 HB2 ASP B 23 32.271 3.238 25.739 1.00 12.04 H new ATOM 0 HB3 ASP B 23 33.480 3.716 26.914 1.00 12.04 H new ATOM 2352 N GLN B 24 34.624 1.206 23.890 1.00 3.35 N ATOM 2353 CA GLN B 24 34.780 -0.242 23.788 1.00 64.10 C ATOM 2354 C GLN B 24 33.495 -0.939 24.215 1.00 11.02 C ATOM 2355 O GLN B 24 33.489 -2.126 24.541 1.00 0.33 O ATOM 2356 CB GLN B 24 35.980 -0.728 24.616 1.00 41.34 C ATOM 2357 CG GLN B 24 37.306 -0.082 24.216 1.00 71.43 C ATOM 2358 CD GLN B 24 37.587 -0.184 22.723 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.171 -1.161 22.253 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.180 0.827 21.967 1.00 4.32 N ATOM 0 H GLN B 24 34.685 1.685 22.992 1.00 3.35 H new ATOM 0 HA GLN B 24 34.979 -0.497 22.747 1.00 64.10 H new ATOM 0 HB2 GLN B 24 35.790 -0.523 25.670 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.067 -1.810 24.512 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.296 0.968 24.508 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.117 -0.558 24.767 1.00 71.43 H new ATOM 0 HE21 GLN B 24 36.699 1.620 22.392 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.348 0.811 20.961 1.00 4.32 H new ATOM 2369 N LYS B 25 32.396 -0.186 24.180 1.00 34.11 N ATOM 2370 CA LYS B 25 31.089 -0.708 24.549 1.00 33.22 C ATOM 2371 C LYS B 25 30.432 -1.411 23.366 1.00 40.01 C ATOM 2372 O LYS B 25 29.574 -2.275 23.554 1.00 34.42 O ATOM 2373 CB LYS B 25 30.178 0.418 25.070 1.00 20.21 C ATOM 2374 CG LYS B 25 30.686 1.077 26.351 1.00 22.43 C ATOM 2375 CD LYS B 25 29.745 2.174 26.860 1.00 41.25 C ATOM 2376 CE LYS B 25 29.550 3.291 25.838 1.00 25.52 C ATOM 2377 NZ LYS B 25 28.839 4.464 26.418 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.390 0.794 23.897 1.00 34.11 H new ATOM 0 HA LYS B 25 31.233 -1.436 25.348 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.077 1.179 24.296 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.182 0.013 25.251 1.00 20.21 H new ATOM 0 HG2 LYS B 25 30.805 0.318 27.124 1.00 22.43 H new ATOM 0 HG3 LYS B 25 31.672 1.504 26.169 1.00 22.43 H new ATOM 0 HD2 LYS B 25 28.778 1.735 27.104 1.00 41.25 H new ATOM 0 HD3 LYS B 25 30.146 2.594 27.782 1.00 41.25 H new ATOM 0 HE2 LYS B 25 30.521 3.608 25.458 1.00 25.52 H new ATOM 0 HE3 LYS B 25 28.985 2.909 24.988 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 28.963 5.288 25.795 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 27.826 4.247 26.507 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 29.231 4.678 27.357 1.00 5.33 H new ATOM 2391 N LEU B 26 30.819 -1.037 22.141 1.00 71.52 N ATOM 2392 CA LEU B 26 30.258 -1.681 20.954 1.00 40.15 C ATOM 2393 C LEU B 26 31.251 -1.656 19.799 1.00 62.33 C ATOM 2394 O LEU B 26 32.011 -0.709 19.664 1.00 50.50 O ATOM 2395 CB LEU B 26 28.961 -0.973 20.550 1.00 64.14 C ATOM 2396 CG LEU B 26 28.320 -1.452 19.244 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.818 -2.891 19.372 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.199 -0.503 18.840 1.00 31.22 C ATOM 0 H LEU B 26 31.505 -0.306 21.950 1.00 71.52 H new ATOM 0 HA LEU B 26 30.044 -2.723 21.192 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.236 -1.096 21.355 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.164 0.094 20.463 1.00 64.14 H new ATOM 0 HG LEU B 26 29.076 -1.446 18.458 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.368 -3.204 18.430 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.654 -3.548 19.611 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.074 -2.947 20.166 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.747 -0.849 17.910 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.443 -0.479 19.624 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.604 0.498 18.696 1.00 31.22 H new ATOM 2410 N ASP B 27 31.237 -2.711 18.989 1.00 22.45 N ATOM 2411 CA ASP B 27 32.039 -2.783 17.768 1.00 53.33 C ATOM 2412 C ASP B 27 31.428 -3.806 16.814 1.00 42.15 C ATOM 2413 O ASP B 27 31.657 -5.012 16.950 1.00 22.10 O ATOM 2414 CB ASP B 27 33.499 -3.160 18.074 1.00 24.13 C ATOM 2415 CG ASP B 27 34.371 -3.198 16.821 1.00 15.20 C ATOM 2416 OD1 ASP B 27 34.508 -4.275 16.201 1.00 3.40 O ATOM 2417 OD2 ASP B 27 34.934 -2.145 16.454 1.00 21.30 O1- ATOM 0 H ASP B 27 30.670 -3.541 19.159 1.00 22.45 H new ATOM 0 HA ASP B 27 32.039 -1.797 17.303 1.00 53.33 H new ATOM 0 HB2 ASP B 27 33.915 -2.442 18.780 1.00 24.13 H new ATOM 0 HB3 ASP B 27 33.524 -4.136 18.559 1.00 24.13 H new ATOM 2422 N VAL B 28 30.607 -3.324 15.887 1.00 42.42 N ATOM 2423 CA VAL B 28 29.968 -4.182 14.886 1.00 61.03 C ATOM 2424 C VAL B 28 29.888 -3.492 13.535 1.00 62.05 C ATOM 2425 O VAL B 28 30.243 -2.323 13.392 1.00 71.42 O ATOM 2426 CB VAL B 28 28.538 -4.621 15.303 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.594 -5.696 16.382 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.709 -3.420 15.761 1.00 74.12 C ATOM 0 H VAL B 28 30.365 -2.337 15.805 1.00 42.42 H new ATOM 0 HA VAL B 28 30.597 -5.069 14.813 1.00 61.03 H new ATOM 0 HB VAL B 28 28.047 -5.050 14.430 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.581 -5.988 16.658 1.00 44.41 H new ATOM 0 HG12 VAL B 28 29.131 -6.565 16.002 1.00 44.41 H new ATOM 0 HG13 VAL B 28 29.111 -5.305 17.259 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.712 -3.754 16.048 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.193 -2.948 16.616 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.630 -2.700 14.946 1.00 74.12 H new ATOM 2438 N LYS B 29 29.403 -4.232 12.554 1.00 64.31 N ATOM 2439 CA LYS B 29 29.273 -3.750 11.192 1.00 24.45 C ATOM 2440 C LYS B 29 27.854 -3.978 10.696 1.00 31.35 C ATOM 2441 O LYS B 29 27.240 -5.004 10.995 1.00 25.23 O ATOM 2442 CB LYS B 29 30.288 -4.482 10.308 1.00 11.40 C ATOM 2443 CG LYS B 29 29.927 -4.555 8.827 1.00 53.23 C ATOM 2444 CD LYS B 29 31.000 -5.277 8.006 1.00 3.25 C ATOM 2445 CE LYS B 29 31.123 -6.766 8.352 1.00 32.51 C ATOM 2446 NZ LYS B 29 31.696 -7.009 9.708 1.00 50.55 N1+ ATOM 0 H LYS B 29 29.086 -5.193 12.682 1.00 64.31 H new ATOM 0 HA LYS B 29 29.475 -2.680 11.152 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.254 -3.987 10.406 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.410 -5.497 10.686 1.00 11.40 H new ATOM 0 HG2 LYS B 29 28.974 -5.072 8.712 1.00 53.23 H new ATOM 0 HG3 LYS B 29 29.791 -3.546 8.437 1.00 53.23 H new ATOM 0 HD2 LYS B 29 30.768 -5.175 6.946 1.00 3.25 H new ATOM 0 HD3 LYS B 29 31.962 -4.792 8.170 1.00 3.25 H new ATOM 0 HE2 LYS B 29 30.138 -7.229 8.293 1.00 32.51 H new ATOM 0 HE3 LYS B 29 31.750 -7.255 7.607 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 32.389 -7.783 9.658 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 32.165 -6.145 10.046 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 30.933 -7.269 10.366 1.00 50.55 H new ATOM 2460 N LEU B 30 27.332 -3.016 9.948 1.00 60.42 N ATOM 2461 CA LEU B 30 26.008 -3.125 9.379 1.00 43.12 C ATOM 2462 C LEU B 30 26.075 -2.957 7.864 1.00 50.11 C ATOM 2463 O LEU B 30 27.112 -2.526 7.310 1.00 72.32 O ATOM 2464 CB LEU B 30 25.016 -2.136 10.042 1.00 4.40 C ATOM 2465 CG LEU B 30 25.454 -0.662 10.215 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.532 -0.500 11.290 1.00 42.23 C ATOM 2467 CD2 LEU B 30 25.899 -0.059 8.890 1.00 52.40 C ATOM 0 H LEU B 30 27.815 -2.146 9.723 1.00 60.42 H new ATOM 0 HA LEU B 30 25.621 -4.122 9.587 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.098 -2.143 9.455 1.00 4.40 H new ATOM 0 HB3 LEU B 30 24.767 -2.527 11.029 1.00 4.40 H new ATOM 0 HG LEU B 30 24.579 -0.110 10.558 1.00 61.23 H new ATOM 0 HD11 LEU B 30 26.806 0.551 11.374 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.147 -0.853 12.247 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.411 -1.083 11.015 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.201 0.977 9.045 1.00 52.40 H new ATOM 0 HD22 LEU B 30 26.742 -0.627 8.496 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.074 -0.094 8.179 1.00 52.40 H new ATOM 2479 N SER B 31 24.987 -3.316 7.195 1.00 24.22 N ATOM 2480 CA SER B 31 24.948 -3.326 5.743 1.00 21.40 C ATOM 2481 C SER B 31 23.523 -3.146 5.232 1.00 43.34 C ATOM 2482 O SER B 31 22.598 -3.816 5.699 1.00 1.33 O ATOM 2483 CB SER B 31 25.529 -4.646 5.217 1.00 62.35 C ATOM 2484 OG SER B 31 26.838 -4.863 5.722 1.00 3.34 O ATOM 0 H SER B 31 24.116 -3.605 7.640 1.00 24.22 H new ATOM 0 HA SER B 31 25.548 -2.493 5.378 1.00 21.40 H new ATOM 0 HB2 SER B 31 24.882 -5.474 5.507 1.00 62.35 H new ATOM 0 HB3 SER B 31 25.554 -4.628 4.127 1.00 62.35 H new ATOM 0 HG SER B 31 26.948 -5.810 5.951 1.00 3.34 H new ATOM 2490 N ALA B 32 23.354 -2.229 4.284 1.00 40.52 N ATOM 2491 CA ALA B 32 22.079 -2.052 3.608 1.00 75.13 C ATOM 2492 C ALA B 32 21.766 -3.295 2.774 1.00 31.44 C ATOM 2493 O ALA B 32 22.640 -3.804 2.064 1.00 42.31 O ATOM 2494 CB ALA B 32 22.113 -0.805 2.729 1.00 44.15 C ATOM 0 H ALA B 32 24.089 -1.596 3.968 1.00 40.52 H new ATOM 0 HA ALA B 32 21.293 -1.919 4.351 1.00 75.13 H new ATOM 0 HB1 ALA B 32 21.152 -0.686 2.229 1.00 44.15 H new ATOM 0 HB2 ALA B 32 22.312 0.071 3.347 1.00 44.15 H new ATOM 0 HB3 ALA B 32 22.900 -0.908 1.982 1.00 44.15 H new ATOM 2500 N PRO B 33 20.524 -3.811 2.849 1.00 64.54 N ATOM 2501 CA PRO B 33 20.141 -5.035 2.146 1.00 71.30 C ATOM 2502 C PRO B 33 20.409 -4.935 0.644 1.00 44.54 C ATOM 2503 O PRO B 33 19.850 -4.074 -0.043 1.00 60.20 O ATOM 2504 CB PRO B 33 18.635 -5.185 2.437 1.00 5.21 C ATOM 2505 CG PRO B 33 18.195 -3.857 2.964 1.00 53.32 C ATOM 2506 CD PRO B 33 19.404 -3.241 3.617 1.00 34.02 C ATOM 0 HA PRO B 33 20.719 -5.896 2.481 1.00 71.30 H new ATOM 0 HB2 PRO B 33 18.085 -5.450 1.534 1.00 5.21 H new ATOM 0 HB3 PRO B 33 18.453 -5.976 3.165 1.00 5.21 H new ATOM 0 HG2 PRO B 33 17.822 -3.223 2.159 1.00 53.32 H new ATOM 0 HG3 PRO B 33 17.382 -3.973 3.681 1.00 53.32 H new ATOM 0 HD2 PRO B 33 19.385 -2.153 3.555 1.00 34.02 H new ATOM 0 HD3 PRO B 33 19.467 -3.499 4.674 1.00 34.02 H new ATOM 2514 N ARG B 34 21.273 -5.822 0.144 1.00 0.10 N ATOM 2515 CA ARG B 34 21.637 -5.855 -1.278 1.00 23.43 C ATOM 2516 C ARG B 34 20.381 -5.923 -2.144 1.00 64.55 C ATOM 2517 O ARG B 34 20.391 -5.508 -3.303 1.00 62.12 O ATOM 2518 CB ARG B 34 22.548 -7.064 -1.572 1.00 33.02 C ATOM 2519 CG ARG B 34 23.878 -6.708 -2.231 1.00 11.34 C ATOM 2520 CD ARG B 34 23.710 -5.885 -3.501 1.00 70.25 C ATOM 2521 NE ARG B 34 24.992 -5.669 -4.173 1.00 41.11 N ATOM 2522 CZ ARG B 34 25.121 -5.149 -5.393 1.00 71.43 C ATOM 2523 NH1 ARG B 34 24.048 -4.801 -6.096 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 26.329 -4.983 -5.915 1.00 21.32 N ATOM 0 H ARG B 34 21.738 -6.534 0.708 1.00 0.10 H new ATOM 0 HA ARG B 34 22.181 -4.941 -1.517 1.00 23.43 H new ATOM 0 HB2 ARG B 34 22.749 -7.588 -0.637 1.00 33.02 H new ATOM 0 HB3 ARG B 34 22.011 -7.759 -2.218 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.491 -6.151 -1.522 1.00 11.34 H new ATOM 0 HG3 ARG B 34 24.417 -7.625 -2.467 1.00 11.34 H new ATOM 0 HD2 ARG B 34 23.024 -6.394 -4.178 1.00 70.25 H new ATOM 0 HD3 ARG B 34 23.260 -4.923 -3.256 1.00 70.25 H new ATOM 0 HE ARG B 34 25.842 -5.934 -3.675 1.00 41.11 H new ATOM 0 HH11 ARG B 34 23.116 -4.931 -5.702 1.00 70.13 H new ATOM 0 HH12 ARG B 34 24.156 -4.404 -7.029 1.00 70.13 H new ATOM 0 HH21 ARG B 34 27.156 -5.253 -5.383 1.00 21.32 H new ATOM 0 HH22 ARG B 34 26.431 -4.585 -6.849 1.00 21.32 H new ATOM 2538 N GLU B 35 19.311 -6.440 -1.545 1.00 42.24 N ATOM 2539 CA GLU B 35 18.007 -6.573 -2.189 1.00 63.02 C ATOM 2540 C GLU B 35 17.613 -5.303 -2.935 1.00 12.03 C ATOM 2541 O GLU B 35 17.060 -5.352 -4.037 1.00 54.43 O ATOM 2542 CB GLU B 35 16.942 -6.867 -1.119 1.00 72.41 C ATOM 2543 CG GLU B 35 17.297 -8.016 -0.177 1.00 31.33 C ATOM 2544 CD GLU B 35 17.519 -9.336 -0.899 1.00 34.33 C ATOM 2545 OE1 GLU B 35 18.668 -9.608 -1.313 1.00 72.42 O ATOM 2546 OE2 GLU B 35 16.552 -10.112 -1.038 1.00 24.25 O1- ATOM 0 H GLU B 35 19.326 -6.783 -0.585 1.00 42.24 H new ATOM 0 HA GLU B 35 18.071 -7.388 -2.909 1.00 63.02 H new ATOM 0 HB2 GLU B 35 16.779 -5.966 -0.528 1.00 72.41 H new ATOM 0 HB3 GLU B 35 15.999 -7.098 -1.615 1.00 72.41 H new ATOM 0 HG2 GLU B 35 18.199 -7.757 0.378 1.00 31.33 H new ATOM 0 HG3 GLU B 35 16.497 -8.139 0.553 1.00 31.33 H new ATOM 2553 N LEU B 36 17.916 -4.170 -2.323 1.00 53.04 N ATOM 2554 CA LEU B 36 17.447 -2.874 -2.793 1.00 1.52 C ATOM 2555 C LEU B 36 18.524 -2.164 -3.605 1.00 52.10 C ATOM 2556 O LEU B 36 18.441 -0.958 -3.844 1.00 30.14 O ATOM 2557 CB LEU B 36 17.038 -2.051 -1.571 1.00 63.52 C ATOM 2558 CG LEU B 36 16.069 -2.788 -0.634 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.928 -2.067 0.696 1.00 52.43 C ATOM 2560 CD2 LEU B 36 14.706 -2.969 -1.298 1.00 15.21 C ATOM 0 H LEU B 36 18.495 -4.121 -1.485 1.00 53.04 H new ATOM 0 HA LEU B 36 16.591 -3.002 -3.456 1.00 1.52 H new ATOM 0 HB2 LEU B 36 17.932 -1.775 -1.012 1.00 63.52 H new ATOM 0 HB3 LEU B 36 16.573 -1.124 -1.906 1.00 63.52 H new ATOM 0 HG LEU B 36 16.488 -3.774 -0.434 1.00 20.23 H new ATOM 0 HD11 LEU B 36 15.236 -2.615 1.335 1.00 52.43 H new ATOM 0 HD12 LEU B 36 16.902 -2.008 1.183 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.546 -1.061 0.526 1.00 52.43 H new ATOM 0 HD21 LEU B 36 14.036 -3.493 -0.616 1.00 15.21 H new ATOM 0 HD22 LEU B 36 14.286 -1.992 -1.540 1.00 15.21 H new ATOM 0 HD23 LEU B 36 14.821 -3.551 -2.212 1.00 15.21 H new ATOM 2572 N GLY B 37 19.516 -2.932 -4.046 1.00 22.45 N ATOM 2573 CA GLY B 37 20.607 -2.378 -4.823 1.00 25.41 C ATOM 2574 C GLY B 37 21.625 -1.673 -3.953 1.00 51.22 C ATOM 2575 O GLY B 37 22.082 -0.578 -4.286 1.00 30.40 O ATOM 0 H GLY B 37 19.582 -3.936 -3.877 1.00 22.45 H new ATOM 0 HA2 GLY B 37 21.097 -3.177 -5.379 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.209 -1.676 -5.556 1.00 25.41 H new ATOM 2579 N GLY B 38 21.981 -2.298 -2.831 1.00 53.33 N ATOM 2580 CA GLY B 38 22.960 -1.716 -1.940 1.00 54.12 C ATOM 2581 C GLY B 38 24.358 -2.185 -2.275 1.00 61.21 C ATOM 2582 O GLY B 38 24.732 -2.264 -3.446 1.00 64.12 O ATOM 0 H GLY B 38 21.606 -3.197 -2.528 1.00 53.33 H new ATOM 0 HA2 GLY B 38 22.914 -0.629 -2.006 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.722 -1.983 -0.910 1.00 54.12 H new ATOM 2586 N ALA B 39 25.114 -2.536 -1.249 1.00 3.10 N ATOM 2587 CA ALA B 39 26.500 -2.974 -1.423 1.00 71.25 C ATOM 2588 C ALA B 39 26.614 -4.482 -1.241 1.00 4.43 C ATOM 2589 O ALA B 39 27.154 -5.182 -2.100 1.00 31.41 O ATOM 2590 CB ALA B 39 27.424 -2.245 -0.454 1.00 12.41 C ATOM 0 H ALA B 39 24.795 -2.528 -0.280 1.00 3.10 H new ATOM 0 HA ALA B 39 26.809 -2.727 -2.439 1.00 71.25 H new ATOM 0 HB1 ALA B 39 28.449 -2.587 -0.602 1.00 12.41 H new ATOM 0 HB2 ALA B 39 27.369 -1.172 -0.637 1.00 12.41 H new ATOM 0 HB3 ALA B 39 27.116 -2.455 0.570 1.00 12.41 H new ATOM 2596 N GLY B 40 26.084 -4.980 -0.126 1.00 23.34 N ATOM 2597 CA GLY B 40 26.132 -6.403 0.162 1.00 31.44 C ATOM 2598 C GLY B 40 27.271 -6.770 1.084 1.00 1.42 C ATOM 2599 O GLY B 40 28.428 -6.826 0.661 1.00 53.13 O ATOM 0 H GLY B 40 25.619 -4.418 0.587 1.00 23.34 H new ATOM 0 HA2 GLY B 40 25.189 -6.711 0.615 1.00 31.44 H new ATOM 0 HA3 GLY B 40 26.233 -6.956 -0.772 1.00 31.44 H new ATOM 2603 N ALA B 41 26.943 -6.997 2.347 1.00 13.10 N ATOM 2604 CA ALA B 41 27.915 -7.448 3.339 1.00 45.11 C ATOM 2605 C ALA B 41 27.199 -8.080 4.530 1.00 24.05 C ATOM 2606 O ALA B 41 25.983 -7.928 4.682 1.00 14.44 O ATOM 2607 CB ALA B 41 28.804 -6.293 3.789 1.00 11.53 C ATOM 0 H ALA B 41 26.000 -6.875 2.715 1.00 13.10 H new ATOM 0 HA ALA B 41 28.554 -8.203 2.881 1.00 45.11 H new ATOM 0 HB1 ALA B 41 29.520 -6.652 4.528 1.00 11.53 H new ATOM 0 HB2 ALA B 41 29.340 -5.890 2.930 1.00 11.53 H new ATOM 0 HB3 ALA B 41 28.188 -5.510 4.231 1.00 11.53 H new ATOM 2613 N GLU B 42 27.952 -8.794 5.365 1.00 15.20 N ATOM 2614 CA GLU B 42 27.391 -9.453 6.543 1.00 53.20 C ATOM 2615 C GLU B 42 27.207 -8.455 7.686 1.00 74.14 C ATOM 2616 O GLU B 42 27.982 -8.417 8.648 1.00 53.42 O ATOM 2617 CB GLU B 42 28.273 -10.633 6.974 1.00 21.14 C ATOM 2618 CG GLU B 42 29.739 -10.267 7.161 1.00 73.23 C ATOM 2619 CD GLU B 42 30.611 -11.474 7.459 1.00 72.34 C ATOM 2620 OE1 GLU B 42 31.245 -11.511 8.532 1.00 61.42 O ATOM 2621 OE2 GLU B 42 30.662 -12.400 6.620 1.00 61.14 O1- ATOM 0 H GLU B 42 28.956 -8.931 5.247 1.00 15.20 H new ATOM 0 HA GLU B 42 26.408 -9.846 6.282 1.00 53.20 H new ATOM 0 HB2 GLU B 42 27.888 -11.040 7.909 1.00 21.14 H new ATOM 0 HB3 GLU B 42 28.198 -11.423 6.227 1.00 21.14 H new ATOM 0 HG2 GLU B 42 30.104 -9.774 6.260 1.00 73.23 H new ATOM 0 HG3 GLU B 42 29.829 -9.549 7.976 1.00 73.23 H new ATOM 2628 N GLY B 43 26.192 -7.624 7.540 1.00 33.24 N ATOM 2629 CA GLY B 43 25.841 -6.663 8.567 1.00 35.43 C ATOM 2630 C GLY B 43 24.350 -6.635 8.828 1.00 2.13 C ATOM 2631 O GLY B 43 23.603 -7.455 8.288 1.00 72.12 O ATOM 0 H GLY B 43 25.593 -7.596 6.715 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.366 -6.909 9.490 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.175 -5.670 8.265 1.00 35.43 H new ATOM 2635 N THR B 44 23.918 -5.693 9.655 1.00 33.20 N ATOM 2636 CA THR B 44 22.511 -5.556 10.012 1.00 33.40 C ATOM 2637 C THR B 44 21.869 -4.423 9.214 1.00 35.03 C ATOM 2638 O THR B 44 22.551 -3.474 8.826 1.00 4.14 O ATOM 2639 CB THR B 44 22.357 -5.272 11.527 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.101 -6.245 12.274 1.00 1.03 O ATOM 2641 CG2 THR B 44 20.891 -5.309 11.962 1.00 34.45 C ATOM 0 H THR B 44 24.529 -5.005 10.096 1.00 33.20 H new ATOM 0 HA THR B 44 22.009 -6.494 9.774 1.00 33.40 H new ATOM 0 HB THR B 44 22.742 -4.271 11.722 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.005 -6.065 13.232 1.00 1.03 H new ATOM 0 HG21 THR B 44 20.823 -5.105 13.031 1.00 34.45 H new ATOM 0 HG22 THR B 44 20.329 -4.554 11.412 1.00 34.45 H new ATOM 0 HG23 THR B 44 20.474 -6.294 11.753 1.00 34.45 H new ATOM 2649 N ASN B 45 20.568 -4.541 8.957 1.00 4.01 N ATOM 2650 CA ASN B 45 19.808 -3.489 8.284 1.00 51.43 C ATOM 2651 C ASN B 45 19.871 -2.189 9.089 1.00 21.43 C ATOM 2652 O ASN B 45 19.404 -2.154 10.226 1.00 31.35 O ATOM 2653 CB ASN B 45 18.337 -3.914 8.137 1.00 71.14 C ATOM 2654 CG ASN B 45 18.141 -5.100 7.214 1.00 11.33 C ATOM 2655 OD1 ASN B 45 18.232 -6.260 7.636 1.00 33.20 O ATOM 2656 ND2 ASN B 45 17.827 -4.823 5.962 1.00 55.34 N ATOM 0 H ASN B 45 20.015 -5.361 9.207 1.00 4.01 H new ATOM 0 HA ASN B 45 20.245 -3.327 7.299 1.00 51.43 H new ATOM 0 HB2 ASN B 45 17.938 -4.159 9.121 1.00 71.14 H new ATOM 0 HB3 ASN B 45 17.759 -3.070 7.760 1.00 71.14 H new ATOM 0 HD21 ASN B 45 17.649 -5.580 5.302 1.00 55.34 H new ATOM 0 HD22 ASN B 45 17.763 -3.852 5.655 1.00 55.34 H new ATOM 2663 N PRO B 46 20.467 -1.111 8.535 1.00 54.41 N ATOM 2664 CA PRO B 46 20.462 0.210 9.177 1.00 2.04 C ATOM 2665 C PRO B 46 19.040 0.645 9.560 1.00 14.41 C ATOM 2666 O PRO B 46 18.819 1.210 10.643 1.00 12.32 O ATOM 2667 CB PRO B 46 21.074 1.151 8.115 1.00 21.50 C ATOM 2668 CG PRO B 46 21.143 0.350 6.852 1.00 13.22 C ATOM 2669 CD PRO B 46 21.214 -1.094 7.267 1.00 31.44 C ATOM 0 HA PRO B 46 21.024 0.218 10.111 1.00 2.04 H new ATOM 0 HB2 PRO B 46 20.459 2.041 7.980 1.00 21.50 H new ATOM 0 HB3 PRO B 46 22.065 1.490 8.418 1.00 21.50 H new ATOM 0 HG2 PRO B 46 20.268 0.532 6.229 1.00 13.22 H new ATOM 0 HG3 PRO B 46 22.017 0.628 6.263 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.762 -1.750 6.523 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.244 -1.425 7.401 1.00 31.44 H new ATOM 2677 N GLU B 47 18.076 0.350 8.680 1.00 51.12 N ATOM 2678 CA GLU B 47 16.665 0.630 8.960 1.00 42.23 C ATOM 2679 C GLU B 47 16.282 -0.056 10.269 1.00 51.31 C ATOM 2680 O GLU B 47 15.706 0.551 11.181 1.00 51.34 O ATOM 2681 CB GLU B 47 15.725 0.119 7.841 1.00 43.35 C ATOM 2682 CG GLU B 47 16.300 0.152 6.423 1.00 13.13 C ATOM 2683 CD GLU B 47 17.109 -1.098 6.092 1.00 41.12 C ATOM 2684 OE1 GLU B 47 18.349 -1.040 6.155 1.00 53.12 O ATOM 2685 OE2 GLU B 47 16.505 -2.148 5.790 1.00 73.03 O1- ATOM 0 H GLU B 47 18.247 -0.081 7.772 1.00 51.12 H new ATOM 0 HA GLU B 47 16.548 1.712 9.023 1.00 42.23 H new ATOM 0 HB2 GLU B 47 15.439 -0.907 8.073 1.00 43.35 H new ATOM 0 HB3 GLU B 47 14.813 0.716 7.857 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.485 0.254 5.706 1.00 13.13 H new ATOM 0 HG3 GLU B 47 16.934 1.031 6.312 1.00 13.13 H new ATOM 2692 N GLN B 48 16.642 -1.334 10.343 1.00 65.22 N ATOM 2693 CA GLN B 48 16.355 -2.165 11.496 1.00 23.21 C ATOM 2694 C GLN B 48 17.148 -1.700 12.711 1.00 44.13 C ATOM 2695 O GLN B 48 16.695 -1.841 13.846 1.00 15.51 O ATOM 2696 CB GLN B 48 16.700 -3.622 11.185 1.00 21.32 C ATOM 2697 CG GLN B 48 16.346 -4.577 12.304 1.00 64.34 C ATOM 2698 CD GLN B 48 14.856 -4.651 12.566 1.00 23.41 C ATOM 2699 OE1 GLN B 48 14.170 -5.513 12.033 1.00 3.40 O ATOM 2700 NE2 GLN B 48 14.344 -3.736 13.373 1.00 12.54 N ATOM 0 H GLN B 48 17.143 -1.820 9.599 1.00 65.22 H new ATOM 0 HA GLN B 48 15.292 -2.081 11.722 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.176 -3.926 10.279 1.00 21.32 H new ATOM 0 HB3 GLN B 48 17.767 -3.698 10.977 1.00 21.32 H new ATOM 0 HG2 GLN B 48 16.716 -5.572 12.057 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.855 -4.265 13.216 1.00 64.34 H new ATOM 0 HE21 GLN B 48 14.950 -3.034 13.798 1.00 12.54 H new ATOM 0 HE22 GLN B 48 13.343 -3.733 13.570 1.00 12.54 H new ATOM 2709 N LEU B 49 18.333 -1.155 12.461 1.00 25.52 N ATOM 2710 CA LEU B 49 19.208 -0.681 13.525 1.00 12.42 C ATOM 2711 C LEU B 49 18.516 0.457 14.273 1.00 73.15 C ATOM 2712 O LEU B 49 18.402 0.428 15.501 1.00 22.33 O ATOM 2713 CB LEU B 49 20.562 -0.236 12.929 1.00 25.41 C ATOM 2714 CG LEU B 49 21.729 -0.038 13.920 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.549 1.223 14.761 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.891 -1.266 14.816 1.00 31.54 C ATOM 0 H LEU B 49 18.712 -1.030 11.522 1.00 25.52 H new ATOM 0 HA LEU B 49 19.409 -1.483 14.235 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.867 -0.976 12.189 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.406 0.702 12.396 1.00 25.41 H new ATOM 0 HG LEU B 49 22.639 0.087 13.333 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.391 1.327 15.446 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.504 2.093 14.107 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.623 1.150 15.332 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.719 -1.106 15.507 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.973 -1.428 15.381 1.00 31.54 H new ATOM 0 HD23 LEU B 49 22.097 -2.141 14.200 1.00 31.54 H new ATOM 2728 N PHE B 50 18.036 1.447 13.522 1.00 74.53 N ATOM 2729 CA PHE B 50 17.267 2.543 14.112 1.00 13.24 C ATOM 2730 C PHE B 50 15.988 2.012 14.760 1.00 54.12 C ATOM 2731 O PHE B 50 15.635 2.413 15.865 1.00 20.22 O ATOM 2732 CB PHE B 50 16.934 3.603 13.052 1.00 14.34 C ATOM 2733 CG PHE B 50 15.903 4.622 13.493 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.206 5.594 14.443 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.631 4.611 12.943 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.259 6.526 14.832 1.00 14.14 C ATOM 2737 CE2 PHE B 50 13.685 5.538 13.329 1.00 22.12 C ATOM 2738 CZ PHE B 50 13.997 6.496 14.274 1.00 62.30 C ATOM 0 H PHE B 50 18.164 1.514 12.512 1.00 74.53 H new ATOM 0 HA PHE B 50 17.876 3.012 14.885 1.00 13.24 H new ATOM 0 HB2 PHE B 50 17.850 4.126 12.777 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.572 3.102 12.155 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.192 5.621 14.882 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.377 3.867 12.203 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.507 7.274 15.570 1.00 14.14 H new ATOM 0 HE2 PHE B 50 12.698 5.515 12.891 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.255 7.220 14.576 1.00 62.30 H new ATOM 2748 N ALA B 51 15.303 1.112 14.058 1.00 24.13 N ATOM 2749 CA ALA B 51 14.076 0.494 14.569 1.00 31.22 C ATOM 2750 C ALA B 51 14.291 -0.123 15.952 1.00 63.22 C ATOM 2751 O ALA B 51 13.550 0.165 16.889 1.00 61.14 O ATOM 2752 CB ALA B 51 13.587 -0.568 13.594 1.00 4.33 C ATOM 0 H ALA B 51 15.576 0.792 13.129 1.00 24.13 H new ATOM 0 HA ALA B 51 13.322 1.275 14.667 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.675 -1.024 13.980 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.382 -0.108 12.627 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.353 -1.334 13.476 1.00 4.33 H new ATOM 2758 N ALA B 52 15.318 -0.959 16.069 1.00 2.41 N ATOM 2759 CA ALA B 52 15.606 -1.668 17.313 1.00 55.02 C ATOM 2760 C ALA B 52 16.021 -0.692 18.410 1.00 53.11 C ATOM 2761 O ALA B 52 15.544 -0.768 19.550 1.00 74.31 O ATOM 2762 CB ALA B 52 16.694 -2.713 17.085 1.00 43.35 C ATOM 0 H ALA B 52 15.970 -1.164 15.312 1.00 2.41 H new ATOM 0 HA ALA B 52 14.698 -2.175 17.638 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.899 -3.234 18.020 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.358 -3.430 16.336 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.603 -2.222 16.736 1.00 43.35 H new ATOM 2768 N GLY B 53 16.914 0.229 18.055 1.00 41.34 N ATOM 2769 CA GLY B 53 17.358 1.238 18.995 1.00 4.13 C ATOM 2770 C GLY B 53 16.214 2.113 19.463 1.00 15.42 C ATOM 2771 O GLY B 53 16.167 2.517 20.624 1.00 73.22 O ATOM 0 H GLY B 53 17.338 0.292 17.129 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.821 0.755 19.855 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.123 1.859 18.528 1.00 4.13 H new ATOM 2775 N TYR B 54 15.278 2.381 18.557 1.00 15.35 N ATOM 2776 CA TYR B 54 14.129 3.226 18.854 1.00 21.24 C ATOM 2777 C TYR B 54 13.113 2.474 19.714 1.00 2.44 C ATOM 2778 O TYR B 54 12.586 3.026 20.677 1.00 55.40 O ATOM 2779 CB TYR B 54 13.480 3.737 17.554 1.00 22.10 C ATOM 2780 CG TYR B 54 12.224 4.578 17.752 1.00 24.43 C ATOM 2781 CD1 TYR B 54 11.991 5.270 18.941 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.266 4.668 16.751 1.00 20.22 C ATOM 2783 CE1 TYR B 54 10.845 6.013 19.123 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.119 5.419 16.923 1.00 11.21 C ATOM 2785 CZ TYR B 54 9.913 6.086 18.114 1.00 15.31 C ATOM 2786 OH TYR B 54 8.767 6.822 18.304 1.00 73.14 O ATOM 0 H TYR B 54 15.295 2.021 17.603 1.00 15.35 H new ATOM 0 HA TYR B 54 14.476 4.090 19.421 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.214 4.329 17.007 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.231 2.880 16.928 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.723 5.222 19.734 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.420 4.141 15.821 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.679 6.536 20.053 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.388 5.484 16.131 1.00 11.21 H new ATOM 0 HH TYR B 54 8.070 6.506 17.692 1.00 73.14 H new ATOM 2796 N SER B 55 12.847 1.217 19.383 1.00 62.44 N ATOM 2797 CA SER B 55 11.891 0.425 20.147 1.00 11.44 C ATOM 2798 C SER B 55 12.389 0.251 21.580 1.00 45.34 C ATOM 2799 O SER B 55 11.612 0.328 22.536 1.00 23.33 O ATOM 2800 CB SER B 55 11.659 -0.934 19.476 1.00 71.55 C ATOM 2801 OG SER B 55 12.875 -1.634 19.292 1.00 22.42 O ATOM 0 H SER B 55 13.275 0.727 18.598 1.00 62.44 H new ATOM 0 HA SER B 55 10.936 0.950 20.174 1.00 11.44 H new ATOM 0 HB2 SER B 55 10.982 -1.532 20.086 1.00 71.55 H new ATOM 0 HB3 SER B 55 11.173 -0.787 18.512 1.00 71.55 H new ATOM 0 HG SER B 55 13.628 -1.016 19.400 1.00 22.42 H new ATOM 2807 N ALA B 56 13.697 0.042 21.718 1.00 72.32 N ATOM 2808 CA ALA B 56 14.321 -0.082 23.029 1.00 72.14 C ATOM 2809 C ALA B 56 14.334 1.263 23.760 1.00 34.31 C ATOM 2810 O ALA B 56 13.920 1.351 24.916 1.00 51.54 O ATOM 2811 CB ALA B 56 15.734 -0.637 22.888 1.00 11.32 C ATOM 0 H ALA B 56 14.344 -0.045 20.935 1.00 72.32 H new ATOM 0 HA ALA B 56 13.732 -0.778 23.626 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.190 -0.725 23.874 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.694 -1.619 22.418 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.330 0.036 22.272 1.00 11.32 H new ATOM 2817 N CYS B 57 14.789 2.315 23.075 1.00 24.02 N ATOM 2818 CA CYS B 57 14.858 3.652 23.670 1.00 54.22 C ATOM 2819 C CYS B 57 13.469 4.114 24.090 1.00 22.14 C ATOM 2820 O CYS B 57 13.310 4.799 25.096 1.00 1.03 O ATOM 2821 CB CYS B 57 15.484 4.673 22.709 1.00 72.40 C ATOM 2822 SG CYS B 57 14.447 5.116 21.297 1.00 42.35 S ATOM 0 H CYS B 57 15.115 2.267 22.110 1.00 24.02 H new ATOM 0 HA CYS B 57 15.499 3.587 24.549 1.00 54.22 H new ATOM 0 HB2 CYS B 57 15.721 5.579 23.267 1.00 72.40 H new ATOM 0 HB3 CYS B 57 16.427 4.272 22.338 1.00 72.40 H new ATOM 0 HG CYS B 57 13.450 4.286 21.213 1.00 42.35 H new ATOM 2828 N PHE B 58 12.466 3.747 23.291 1.00 34.03 N ATOM 2829 CA PHE B 58 11.077 4.127 23.548 1.00 42.11 C ATOM 2830 C PHE B 58 10.662 3.693 24.954 1.00 1.15 C ATOM 2831 O PHE B 58 9.870 4.366 25.616 1.00 52.32 O ATOM 2832 CB PHE B 58 10.155 3.489 22.495 1.00 13.13 C ATOM 2833 CG PHE B 58 8.741 4.020 22.502 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.701 3.286 23.059 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.454 5.258 21.945 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.409 3.778 23.059 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.165 5.754 21.943 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.140 5.012 22.500 1.00 52.03 C ATOM 0 H PHE B 58 12.593 3.181 22.452 1.00 34.03 H new ATOM 0 HA PHE B 58 10.988 5.211 23.481 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.586 3.650 21.507 1.00 13.13 H new ATOM 0 HB3 PHE B 58 10.127 2.412 22.659 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.904 2.320 23.497 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.250 5.842 21.507 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.610 3.197 23.496 1.00 5.05 H new ATOM 0 HE2 PHE B 58 6.958 6.720 21.507 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.131 5.397 22.498 1.00 52.03 H new ATOM 2848 N LEU B 59 11.221 2.574 25.406 1.00 60.43 N ATOM 2849 CA LEU B 59 10.963 2.063 26.747 1.00 11.12 C ATOM 2850 C LEU B 59 11.583 3.011 27.778 1.00 60.54 C ATOM 2851 O LEU B 59 10.953 3.348 28.780 1.00 64.41 O ATOM 2852 CB LEU B 59 11.525 0.632 26.881 1.00 33.41 C ATOM 2853 CG LEU B 59 11.084 -0.181 28.123 1.00 23.42 C ATOM 2854 CD1 LEU B 59 11.784 0.296 29.395 1.00 12.45 C ATOM 2855 CD2 LEU B 59 9.566 -0.128 28.294 1.00 24.24 C ATOM 0 H LEU B 59 11.861 2.000 24.857 1.00 60.43 H new ATOM 0 HA LEU B 59 9.889 2.015 26.928 1.00 11.12 H new ATOM 0 HB2 LEU B 59 11.241 0.071 25.990 1.00 33.41 H new ATOM 0 HB3 LEU B 59 12.613 0.694 26.885 1.00 33.41 H new ATOM 0 HG LEU B 59 11.381 -1.216 27.954 1.00 23.42 H new ATOM 0 HD11 LEU B 59 11.446 -0.301 30.242 1.00 12.45 H new ATOM 0 HD12 LEU B 59 12.862 0.185 29.280 1.00 12.45 H new ATOM 0 HD13 LEU B 59 11.544 1.345 29.571 1.00 12.45 H new ATOM 0 HD21 LEU B 59 9.278 -0.706 29.172 1.00 24.24 H new ATOM 0 HD22 LEU B 59 9.250 0.907 28.421 1.00 24.24 H new ATOM 0 HD23 LEU B 59 9.085 -0.548 27.410 1.00 24.24 H new ATOM 2867 N SER B 60 12.816 3.443 27.517 1.00 44.21 N ATOM 2868 CA SER B 60 13.510 4.395 28.382 1.00 2.40 C ATOM 2869 C SER B 60 12.743 5.722 28.429 1.00 73.23 C ATOM 2870 O SER B 60 12.498 6.297 29.502 1.00 65.55 O ATOM 2871 CB SER B 60 14.932 4.621 27.850 1.00 63.24 C ATOM 2872 OG SER B 60 15.527 3.393 27.469 1.00 24.13 O ATOM 0 H SER B 60 13.358 3.145 26.706 1.00 44.21 H new ATOM 0 HA SER B 60 13.564 3.992 29.393 1.00 2.40 H new ATOM 0 HB2 SER B 60 14.902 5.297 26.995 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.540 5.103 28.616 1.00 63.24 H new ATOM 0 HG SER B 60 15.734 2.867 28.270 1.00 24.13 H new ATOM 2878 N ALA B 61 12.343 6.184 27.250 1.00 21.42 N ATOM 2879 CA ALA B 61 11.580 7.412 27.115 1.00 31.00 C ATOM 2880 C ALA B 61 10.295 7.321 27.921 1.00 42.41 C ATOM 2881 O ALA B 61 9.981 8.218 28.696 1.00 44.10 O ATOM 2882 CB ALA B 61 11.279 7.689 25.645 1.00 4.34 C ATOM 0 H ALA B 61 12.540 5.717 26.365 1.00 21.42 H new ATOM 0 HA ALA B 61 12.172 8.240 27.504 1.00 31.00 H new ATOM 0 HB1 ALA B 61 10.707 8.613 25.559 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.215 7.789 25.095 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.701 6.863 25.230 1.00 4.34 H new ATOM 2888 N MET B 62 9.572 6.213 27.760 1.00 64.12 N ATOM 2889 CA MET B 62 8.333 5.994 28.501 1.00 62.41 C ATOM 2890 C MET B 62 8.615 5.772 29.981 1.00 51.11 C ATOM 2891 O MET B 62 7.763 6.046 30.824 1.00 53.32 O ATOM 2892 CB MET B 62 7.534 4.814 27.939 1.00 4.11 C ATOM 2893 CG MET B 62 6.857 5.104 26.608 1.00 71.00 C ATOM 2894 SD MET B 62 5.345 4.145 26.394 1.00 51.43 S ATOM 2895 CE MET B 62 4.385 4.728 27.796 1.00 33.40 C ATOM 0 H MET B 62 9.823 5.456 27.124 1.00 64.12 H new ATOM 0 HA MET B 62 7.731 6.895 28.386 1.00 62.41 H new ATOM 0 HB2 MET B 62 8.202 3.961 27.817 1.00 4.11 H new ATOM 0 HB3 MET B 62 6.775 4.523 28.665 1.00 4.11 H new ATOM 0 HG2 MET B 62 6.624 6.167 26.544 1.00 71.00 H new ATOM 0 HG3 MET B 62 7.547 4.879 25.794 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.326 3.942 28.549 1.00 33.40 H new ATOM 0 HE2 MET B 62 4.866 5.606 28.226 1.00 33.40 H new ATOM 0 HE3 MET B 62 3.380 4.990 27.465 1.00 33.40 H new ATOM 2905 N LYS B 63 9.805 5.270 30.286 1.00 72.03 N ATOM 2906 CA LYS B 63 10.237 5.096 31.668 1.00 43.00 C ATOM 2907 C LYS B 63 10.249 6.460 32.354 1.00 70.35 C ATOM 2908 O LYS B 63 9.745 6.620 33.465 1.00 23.43 O ATOM 2909 CB LYS B 63 11.640 4.464 31.716 1.00 31.31 C ATOM 2910 CG LYS B 63 12.074 3.976 33.097 1.00 20.13 C ATOM 2911 CD LYS B 63 13.591 3.781 33.188 1.00 10.22 C ATOM 2912 CE LYS B 63 14.142 2.904 32.062 1.00 1.23 C ATOM 2913 NZ LYS B 63 13.614 1.514 32.107 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.491 4.975 29.592 1.00 72.03 H new ATOM 0 HA LYS B 63 9.547 4.429 32.185 1.00 43.00 H new ATOM 0 HB2 LYS B 63 11.669 3.623 31.023 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.365 5.195 31.360 1.00 31.31 H new ATOM 0 HG2 LYS B 63 11.755 4.695 33.852 1.00 20.13 H new ATOM 0 HG3 LYS B 63 11.574 3.034 33.322 1.00 20.13 H new ATOM 0 HD2 LYS B 63 14.081 4.754 33.158 1.00 10.22 H new ATOM 0 HD3 LYS B 63 13.838 3.329 34.149 1.00 10.22 H new ATOM 0 HE2 LYS B 63 13.891 3.353 31.101 1.00 1.23 H new ATOM 0 HE3 LYS B 63 15.230 2.877 32.127 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 14.019 0.963 31.323 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 13.875 1.072 33.012 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 12.578 1.533 32.018 1.00 55.13 H new ATOM 2927 N PHE B 64 10.817 7.444 31.656 1.00 21.33 N ATOM 2928 CA PHE B 64 10.836 8.826 32.136 1.00 32.24 C ATOM 2929 C PHE B 64 9.434 9.450 32.065 1.00 14.21 C ATOM 2930 O PHE B 64 8.967 10.074 33.023 1.00 73.11 O ATOM 2931 CB PHE B 64 11.829 9.655 31.308 1.00 30.41 C ATOM 2932 CG PHE B 64 11.899 11.107 31.714 1.00 63.34 C ATOM 2933 CD1 PHE B 64 12.276 11.466 33.003 1.00 43.42 C ATOM 2934 CD2 PHE B 64 11.587 12.113 30.810 1.00 31.33 C ATOM 2935 CE1 PHE B 64 12.336 12.795 33.377 1.00 55.11 C ATOM 2936 CE2 PHE B 64 11.648 13.443 31.180 1.00 33.41 C ATOM 2937 CZ PHE B 64 12.021 13.784 32.465 1.00 14.04 C ATOM 0 H PHE B 64 11.272 7.309 30.753 1.00 21.33 H new ATOM 0 HA PHE B 64 11.154 8.824 33.178 1.00 32.24 H new ATOM 0 HB2 PHE B 64 12.821 9.214 31.400 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.550 9.595 30.256 1.00 30.41 H new ATOM 0 HD1 PHE B 64 12.525 10.698 33.720 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.293 11.853 29.804 1.00 31.33 H new ATOM 0 HE1 PHE B 64 12.629 13.061 34.382 1.00 55.11 H new ATOM 0 HE2 PHE B 64 11.404 14.215 30.465 1.00 33.41 H new ATOM 0 HZ PHE B 64 12.066 14.823 32.757 1.00 14.04 H new ATOM 2947 N VAL B 65 8.768 9.255 30.926 1.00 75.05 N ATOM 2948 CA VAL B 65 7.450 9.840 30.673 1.00 40.30 C ATOM 2949 C VAL B 65 6.439 9.419 31.738 1.00 43.44 C ATOM 2950 O VAL B 65 5.686 10.249 32.260 1.00 35.52 O ATOM 2951 CB VAL B 65 6.925 9.444 29.266 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.441 9.766 29.114 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.737 10.144 28.174 1.00 51.21 C ATOM 0 H VAL B 65 9.125 8.690 30.156 1.00 75.05 H new ATOM 0 HA VAL B 65 7.566 10.923 30.715 1.00 40.30 H new ATOM 0 HB VAL B 65 7.046 8.366 29.158 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.106 9.476 28.118 1.00 70.43 H new ATOM 0 HG12 VAL B 65 4.871 9.216 29.863 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.285 10.836 29.252 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.355 9.855 27.195 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.651 11.224 28.293 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.784 9.852 28.256 1.00 51.21 H new ATOM 2963 N ALA B 66 6.431 8.135 32.066 1.00 30.22 N ATOM 2964 CA ALA B 66 5.518 7.604 33.071 1.00 74.13 C ATOM 2965 C ALA B 66 5.685 8.350 34.393 1.00 44.35 C ATOM 2966 O ALA B 66 4.716 8.589 35.116 1.00 34.23 O ATOM 2967 CB ALA B 66 5.752 6.109 33.258 1.00 23.44 C ATOM 0 H ALA B 66 7.049 7.438 31.650 1.00 30.22 H new ATOM 0 HA ALA B 66 4.494 7.751 32.727 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.064 5.724 34.011 1.00 23.44 H new ATOM 0 HB2 ALA B 66 5.581 5.593 32.313 1.00 23.44 H new ATOM 0 HB3 ALA B 66 6.778 5.939 33.584 1.00 23.44 H new ATOM 2973 N GLY B 67 6.918 8.765 34.662 1.00 23.35 N ATOM 2974 CA GLY B 67 7.236 9.434 35.911 1.00 73.24 C ATOM 2975 C GLY B 67 6.647 10.829 35.987 1.00 45.13 C ATOM 2976 O GLY B 67 6.266 11.291 37.062 1.00 75.04 O ATOM 0 H GLY B 67 7.711 8.649 34.031 1.00 23.35 H new ATOM 0 HA2 GLY B 67 6.862 8.839 36.744 1.00 73.24 H new ATOM 0 HA3 GLY B 67 8.319 9.493 36.023 1.00 73.24 H new ATOM 2980 N GLN B 68 6.545 11.493 34.838 1.00 2.12 N ATOM 2981 CA GLN B 68 6.032 12.857 34.785 1.00 44.13 C ATOM 2982 C GLN B 68 4.547 12.834 34.457 1.00 40.32 C ATOM 2983 O GLN B 68 3.847 13.836 34.605 1.00 64.50 O ATOM 2984 CB GLN B 68 6.797 13.689 33.745 1.00 33.05 C ATOM 2985 CG GLN B 68 6.820 13.072 32.352 1.00 52.44 C ATOM 2986 CD GLN B 68 7.358 14.022 31.297 1.00 54.32 C ATOM 2987 OE1 GLN B 68 8.554 14.050 31.018 1.00 53.51 O ATOM 2988 NE2 GLN B 68 6.475 14.814 30.714 1.00 53.21 N ATOM 0 H GLN B 68 6.811 11.107 33.932 1.00 2.12 H new ATOM 0 HA GLN B 68 6.176 13.322 35.760 1.00 44.13 H new ATOM 0 HB2 GLN B 68 6.346 14.680 33.685 1.00 33.05 H new ATOM 0 HB3 GLN B 68 7.823 13.826 34.088 1.00 33.05 H new ATOM 0 HG2 GLN B 68 7.432 12.170 32.369 1.00 52.44 H new ATOM 0 HG3 GLN B 68 5.810 12.766 32.078 1.00 52.44 H new ATOM 0 HE21 GLN B 68 5.490 14.759 30.975 1.00 53.21 H new ATOM 0 HE22 GLN B 68 6.778 15.480 30.003 1.00 53.21 H new ATOM 2997 N ASN B 69 4.077 11.674 34.006 1.00 21.43 N ATOM 2998 CA ASN B 69 2.669 11.482 33.671 1.00 41.54 C ATOM 2999 C ASN B 69 1.903 10.813 34.812 1.00 23.00 C ATOM 3000 O ASN B 69 0.722 10.490 34.671 1.00 34.41 O ATOM 3001 CB ASN B 69 2.549 10.670 32.380 1.00 65.13 C ATOM 3002 CG ASN B 69 2.661 11.549 31.141 1.00 21.52 C ATOM 3003 OD1 ASN B 69 1.657 12.026 30.606 1.00 65.21 O ATOM 3004 ND2 ASN B 69 3.879 11.802 30.695 1.00 45.52 N ATOM 0 H ASN B 69 4.656 10.847 33.863 1.00 21.43 H new ATOM 0 HA ASN B 69 2.218 12.462 33.516 1.00 41.54 H new ATOM 0 HB2 ASN B 69 3.329 9.909 32.356 1.00 65.13 H new ATOM 0 HB3 ASN B 69 1.593 10.147 32.368 1.00 65.13 H new ATOM 0 HD21 ASN B 69 4.010 12.408 29.885 1.00 45.52 H new ATOM 0 HD22 ASN B 69 4.688 11.391 31.161 1.00 45.52 H new ATOM 3011 N LYS B 70 2.590 10.618 35.938 1.00 4.22 N ATOM 3012 CA LYS B 70 1.967 10.132 37.177 1.00 71.04 C ATOM 3013 C LYS B 70 1.426 8.710 37.013 1.00 55.13 C ATOM 3014 O LYS B 70 0.508 8.292 37.724 1.00 71.33 O ATOM 3015 CB LYS B 70 0.843 11.085 37.631 1.00 43.15 C ATOM 3016 CG LYS B 70 1.330 12.386 38.276 1.00 61.50 C ATOM 3017 CD LYS B 70 2.431 13.061 37.467 1.00 21.25 C ATOM 3018 CE LYS B 70 2.577 14.538 37.811 1.00 20.34 C ATOM 3019 NZ LYS B 70 1.397 15.333 37.377 1.00 73.12 N1+ ATOM 0 H LYS B 70 3.592 10.791 36.021 1.00 4.22 H new ATOM 0 HA LYS B 70 2.739 10.109 37.946 1.00 71.04 H new ATOM 0 HB2 LYS B 70 0.224 11.332 36.768 1.00 43.15 H new ATOM 0 HB3 LYS B 70 0.204 10.560 38.341 1.00 43.15 H new ATOM 0 HG2 LYS B 70 0.490 13.072 38.383 1.00 61.50 H new ATOM 0 HG3 LYS B 70 1.699 12.175 39.280 1.00 61.50 H new ATOM 0 HD2 LYS B 70 3.377 12.552 37.650 1.00 21.25 H new ATOM 0 HD3 LYS B 70 2.214 12.957 36.404 1.00 21.25 H new ATOM 0 HE2 LYS B 70 2.711 14.648 38.887 1.00 20.34 H new ATOM 0 HE3 LYS B 70 3.475 14.933 37.336 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 1.655 16.339 37.329 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 1.087 15.010 36.438 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 0.623 15.207 38.060 1.00 73.12 H new ATOM 3033 N GLN B 71 2.022 7.964 36.094 1.00 41.03 N ATOM 3034 CA GLN B 71 1.598 6.596 35.806 1.00 14.44 C ATOM 3035 C GLN B 71 2.758 5.624 36.010 1.00 73.31 C ATOM 3036 O GLN B 71 3.914 6.030 36.116 1.00 34.15 O ATOM 3037 CB GLN B 71 1.066 6.494 34.370 1.00 1.40 C ATOM 3038 CG GLN B 71 2.003 7.110 33.339 1.00 33.32 C ATOM 3039 CD GLN B 71 1.911 6.456 31.977 1.00 34.04 C ATOM 3040 OE1 GLN B 71 2.781 5.495 31.755 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 1.101 6.832 31.134 1.00 0.43 N flip ATOM 0 H GLN B 71 2.808 8.285 35.529 1.00 41.03 H new ATOM 0 HA GLN B 71 0.797 6.330 36.495 1.00 14.44 H new ATOM 0 HB2 GLN B 71 0.903 5.445 34.123 1.00 1.40 H new ATOM 0 HB3 GLN B 71 0.097 6.989 34.312 1.00 1.40 H new ATOM 0 HG2 GLN B 71 1.775 8.171 33.240 1.00 33.32 H new ATOM 0 HG3 GLN B 71 3.029 7.036 33.701 1.00 33.32 H new ATOM 0 HE21 GLN B 71 0.446 7.582 31.355 1.00 0.43 H new ATOM 0 HE22 GLN B 71 1.083 6.394 30.213 1.00 0.43 H new ATOM 3050 N THR B 72 2.439 4.338 36.048 1.00 1.35 N ATOM 3051 CA THR B 72 3.434 3.288 36.244 1.00 51.41 C ATOM 3052 C THR B 72 3.337 2.257 35.124 1.00 74.12 C ATOM 3053 O THR B 72 2.237 1.917 34.680 1.00 25.05 O ATOM 3054 CB THR B 72 3.244 2.590 37.612 1.00 13.02 C ATOM 3055 OG1 THR B 72 1.876 2.182 37.769 1.00 4.22 O ATOM 3056 CG2 THR B 72 3.643 3.511 38.760 1.00 71.50 C ATOM 0 H THR B 72 1.485 3.991 35.944 1.00 1.35 H new ATOM 0 HA THR B 72 4.420 3.751 36.226 1.00 51.41 H new ATOM 0 HB THR B 72 3.890 1.713 37.637 1.00 13.02 H new ATOM 0 HG1 THR B 72 1.764 1.740 38.636 1.00 4.22 H new ATOM 0 HG21 THR B 72 3.499 2.994 39.708 1.00 71.50 H new ATOM 0 HG22 THR B 72 4.691 3.790 38.655 1.00 71.50 H new ATOM 0 HG23 THR B 72 3.024 4.408 38.738 1.00 71.50 H new ATOM 3064 N LEU B 73 4.487 1.794 34.646 1.00 74.12 N ATOM 3065 CA LEU B 73 4.537 0.798 33.577 1.00 52.35 C ATOM 3066 C LEU B 73 5.022 -0.552 34.111 1.00 64.24 C ATOM 3067 O LEU B 73 5.950 -0.604 34.923 1.00 14.14 O ATOM 3068 CB LEU B 73 5.465 1.285 32.457 1.00 75.15 C ATOM 3069 CG LEU B 73 5.029 2.581 31.759 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.092 3.039 30.766 1.00 33.12 C ATOM 3071 CD2 LEU B 73 3.681 2.396 31.065 1.00 51.14 C ATOM 0 H LEU B 73 5.402 2.093 34.983 1.00 74.12 H new ATOM 0 HA LEU B 73 3.530 0.666 33.180 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.462 1.434 32.873 1.00 75.15 H new ATOM 0 HB3 LEU B 73 5.546 0.498 31.707 1.00 75.15 H new ATOM 0 HG LEU B 73 4.914 3.356 32.517 1.00 62.34 H new ATOM 0 HD11 LEU B 73 5.765 3.959 30.281 1.00 33.12 H new ATOM 0 HD12 LEU B 73 7.029 3.220 31.293 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.243 2.266 30.013 1.00 33.12 H new ATOM 0 HD21 LEU B 73 3.392 3.327 30.577 1.00 51.14 H new ATOM 0 HD22 LEU B 73 3.761 1.605 30.319 1.00 51.14 H new ATOM 0 HD23 LEU B 73 2.926 2.124 31.803 1.00 51.14 H new ATOM 3083 N PRO B 74 4.389 -1.662 33.677 1.00 22.31 N ATOM 3084 CA PRO B 74 4.859 -3.019 33.989 1.00 33.15 C ATOM 3085 C PRO B 74 6.201 -3.328 33.321 1.00 51.21 C ATOM 3086 O PRO B 74 6.443 -2.927 32.182 1.00 62.01 O ATOM 3087 CB PRO B 74 3.763 -3.936 33.418 1.00 23.12 C ATOM 3088 CG PRO B 74 2.584 -3.046 33.194 1.00 12.13 C ATOM 3089 CD PRO B 74 3.148 -1.688 32.885 1.00 51.43 C ATOM 0 HA PRO B 74 5.022 -3.151 35.059 1.00 33.15 H new ATOM 0 HB2 PRO B 74 4.086 -4.403 32.488 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.522 -4.741 34.112 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.970 -3.411 32.371 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.946 -3.013 34.077 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.345 -1.565 31.820 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.465 -0.890 33.177 1.00 51.43 H new ATOM 3097 N ALA B 75 7.056 -4.060 34.026 1.00 24.41 N ATOM 3098 CA ALA B 75 8.386 -4.409 33.522 1.00 71.53 C ATOM 3099 C ALA B 75 8.317 -5.490 32.453 1.00 71.01 C ATOM 3100 O ALA B 75 9.187 -5.596 31.592 1.00 12.42 O ATOM 3101 CB ALA B 75 9.260 -4.885 34.668 1.00 50.55 C ATOM 0 H ALA B 75 6.853 -4.427 34.956 1.00 24.41 H new ATOM 0 HA ALA B 75 8.816 -3.515 33.070 1.00 71.53 H new ATOM 0 HB1 ALA B 75 10.249 -5.144 34.289 1.00 50.55 H new ATOM 0 HB2 ALA B 75 9.352 -4.091 35.409 1.00 50.55 H new ATOM 0 HB3 ALA B 75 8.808 -5.762 35.130 1.00 50.55 H new ATOM 3107 N ASP B 76 7.252 -6.264 32.502 1.00 24.20 N ATOM 3108 CA ASP B 76 7.104 -7.460 31.677 1.00 60.22 C ATOM 3109 C ASP B 76 6.645 -7.115 30.257 1.00 14.12 C ATOM 3110 O ASP B 76 6.072 -7.953 29.557 1.00 34.13 O ATOM 3111 CB ASP B 76 6.083 -8.374 32.346 1.00 21.51 C ATOM 3112 CG ASP B 76 6.535 -8.870 33.708 1.00 33.51 C ATOM 3113 OD1 ASP B 76 7.274 -9.874 33.768 1.00 23.44 O ATOM 3114 OD2 ASP B 76 6.150 -8.253 34.731 1.00 41.11 O1- ATOM 0 H ASP B 76 6.457 -6.086 33.116 1.00 24.20 H new ATOM 0 HA ASP B 76 8.071 -7.956 31.592 1.00 60.22 H new ATOM 0 HB2 ASP B 76 5.140 -7.838 32.455 1.00 21.51 H new ATOM 0 HB3 ASP B 76 5.890 -9.230 31.699 1.00 21.51 H new ATOM 3119 N THR B 77 6.919 -5.890 29.834 1.00 44.41 N ATOM 3120 CA THR B 77 6.449 -5.380 28.556 1.00 1.21 C ATOM 3121 C THR B 77 7.429 -5.660 27.412 1.00 31.44 C ATOM 3122 O THR B 77 8.546 -6.147 27.625 1.00 72.52 O ATOM 3123 CB THR B 77 6.187 -3.865 28.666 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.709 -3.341 27.421 1.00 73.25 O ATOM 3125 CG2 THR B 77 7.445 -3.111 29.091 1.00 30.02 C ATOM 0 H THR B 77 7.474 -5.221 30.368 1.00 44.41 H new ATOM 0 HA THR B 77 5.524 -5.905 28.318 1.00 1.21 H new ATOM 0 HB THR B 77 5.424 -3.722 29.431 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.982 -3.906 27.086 1.00 73.25 H new ATOM 0 HG21 THR B 77 7.225 -2.046 29.159 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.777 -3.476 30.063 1.00 30.02 H new ATOM 0 HG23 THR B 77 8.232 -3.273 28.355 1.00 30.02 H new ATOM 3133 N THR B 78 6.981 -5.341 26.197 1.00 70.31 N ATOM 3134 CA THR B 78 7.757 -5.526 24.980 1.00 64.53 C ATOM 3135 C THR B 78 7.304 -4.524 23.918 1.00 71.23 C ATOM 3136 O THR B 78 6.134 -4.132 23.884 1.00 64.44 O ATOM 3137 CB THR B 78 7.596 -6.963 24.419 1.00 53.44 C ATOM 3138 OG1 THR B 78 6.277 -7.451 24.696 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.633 -7.911 25.004 1.00 23.30 C ATOM 0 H THR B 78 6.057 -4.942 26.033 1.00 70.31 H new ATOM 0 HA THR B 78 8.806 -5.364 25.227 1.00 64.53 H new ATOM 0 HB THR B 78 7.751 -6.921 23.341 1.00 53.44 H new ATOM 0 HG1 THR B 78 6.182 -8.358 24.337 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.490 -8.908 24.588 1.00 23.30 H new ATOM 0 HG22 THR B 78 9.633 -7.555 24.756 1.00 23.30 H new ATOM 0 HG23 THR B 78 8.520 -7.950 26.087 1.00 23.30 H new ATOM 3147 N VAL B 79 8.227 -4.119 23.057 1.00 22.45 N ATOM 3148 CA VAL B 79 7.923 -3.209 21.953 1.00 23.02 C ATOM 3149 C VAL B 79 8.595 -3.707 20.683 1.00 31.21 C ATOM 3150 O VAL B 79 9.803 -3.920 20.661 1.00 14.34 O ATOM 3151 CB VAL B 79 8.380 -1.754 22.248 1.00 21.11 C ATOM 3152 CG1 VAL B 79 8.177 -0.855 21.025 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.629 -1.193 23.452 1.00 54.24 C ATOM 0 H VAL B 79 9.204 -4.408 23.100 1.00 22.45 H new ATOM 0 HA VAL B 79 6.840 -3.194 21.827 1.00 23.02 H new ATOM 0 HB VAL B 79 9.445 -1.775 22.479 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.505 0.158 21.259 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.760 -1.241 20.189 1.00 1.41 H new ATOM 0 HG13 VAL B 79 7.121 -0.841 20.755 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.961 -0.173 23.645 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.559 -1.193 23.246 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.830 -1.812 24.327 1.00 54.24 H new ATOM 3163 N THR B 80 7.815 -3.906 19.637 1.00 72.42 N ATOM 3164 CA THR B 80 8.333 -4.443 18.389 1.00 23.21 C ATOM 3165 C THR B 80 8.318 -3.389 17.285 1.00 63.22 C ATOM 3166 O THR B 80 7.259 -2.942 16.858 1.00 42.43 O ATOM 3167 CB THR B 80 7.516 -5.672 17.942 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.434 -6.614 19.022 1.00 71.34 O ATOM 3169 CG2 THR B 80 8.148 -6.346 16.725 1.00 64.25 C ATOM 0 H THR B 80 6.815 -3.703 19.626 1.00 72.42 H new ATOM 0 HA THR B 80 9.365 -4.746 18.567 1.00 23.21 H new ATOM 0 HB THR B 80 6.518 -5.334 17.665 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.913 -7.394 18.737 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.548 -7.209 16.435 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.189 -5.638 15.897 1.00 64.25 H new ATOM 0 HG23 THR B 80 9.158 -6.673 16.974 1.00 64.25 H new ATOM 3177 N ALA B 81 9.498 -2.990 16.833 1.00 41.34 N ATOM 3178 CA ALA B 81 9.619 -2.037 15.739 1.00 73.43 C ATOM 3179 C ALA B 81 9.748 -2.774 14.412 1.00 13.31 C ATOM 3180 O ALA B 81 10.773 -3.406 14.136 1.00 32.14 O ATOM 3181 CB ALA B 81 10.812 -1.119 15.960 1.00 31.52 C ATOM 0 H ALA B 81 10.389 -3.313 17.209 1.00 41.34 H new ATOM 0 HA ALA B 81 8.718 -1.424 15.710 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.887 -0.414 15.132 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.682 -0.571 16.893 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.724 -1.714 16.013 1.00 31.52 H new ATOM 3187 N GLU B 82 8.696 -2.710 13.612 1.00 50.12 N ATOM 3188 CA GLU B 82 8.662 -3.354 12.309 1.00 53.10 C ATOM 3189 C GLU B 82 8.770 -2.290 11.221 1.00 51.21 C ATOM 3190 O GLU B 82 7.833 -1.528 10.990 1.00 13.21 O ATOM 3191 CB GLU B 82 7.360 -4.155 12.174 1.00 51.24 C ATOM 3192 CG GLU B 82 7.207 -4.894 10.851 1.00 31.41 C ATOM 3193 CD GLU B 82 5.948 -5.749 10.807 1.00 63.34 C ATOM 3194 OE1 GLU B 82 6.063 -6.991 10.788 1.00 35.34 O ATOM 3195 OE2 GLU B 82 4.835 -5.180 10.804 1.00 71.23 O1- ATOM 0 H GLU B 82 7.840 -2.209 13.848 1.00 50.12 H new ATOM 0 HA GLU B 82 9.501 -4.042 12.203 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.307 -4.878 12.988 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.516 -3.476 12.296 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.181 -4.172 10.035 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.079 -5.527 10.689 1.00 31.41 H new ATOM 3202 N VAL B 83 9.921 -2.226 10.564 1.00 40.31 N ATOM 3203 CA VAL B 83 10.184 -1.179 9.582 1.00 71.44 C ATOM 3204 C VAL B 83 10.242 -1.746 8.174 1.00 35.11 C ATOM 3205 O VAL B 83 10.696 -2.867 7.962 1.00 1.44 O ATOM 3206 CB VAL B 83 11.503 -0.425 9.885 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.376 0.377 11.177 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.684 -1.396 9.956 1.00 51.35 C ATOM 0 H VAL B 83 10.688 -2.886 10.692 1.00 40.31 H new ATOM 0 HA VAL B 83 9.356 -0.474 9.650 1.00 71.44 H new ATOM 0 HB VAL B 83 11.694 0.272 9.069 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.312 0.900 11.374 1.00 71.22 H new ATOM 0 HG12 VAL B 83 10.569 1.103 11.077 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.157 -0.298 12.004 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.598 -0.842 10.170 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.508 -2.125 10.747 1.00 51.35 H new ATOM 0 HG23 VAL B 83 12.788 -1.913 9.002 1.00 51.35 H new ATOM 3218 N GLY B 84 9.771 -0.960 7.219 1.00 51.11 N ATOM 3219 CA GLY B 84 9.790 -1.357 5.832 1.00 52.45 C ATOM 3220 C GLY B 84 10.240 -0.229 4.938 1.00 30.33 C ATOM 3221 O GLY B 84 10.139 0.943 5.301 1.00 4.21 O ATOM 0 H GLY B 84 9.369 -0.038 7.387 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.457 -2.210 5.706 1.00 52.45 H new ATOM 0 HA3 GLY B 84 8.794 -1.684 5.533 1.00 52.45 H new ATOM 3225 N ILE B 85 10.732 -0.586 3.771 1.00 72.33 N ATOM 3226 CA ILE B 85 11.220 0.372 2.799 1.00 70.35 C ATOM 3227 C ILE B 85 10.685 -0.003 1.424 1.00 24.30 C ATOM 3228 O ILE B 85 10.764 -1.170 1.015 1.00 65.43 O ATOM 3229 CB ILE B 85 12.774 0.423 2.803 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.330 1.410 1.752 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.348 -0.976 2.599 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.495 0.827 0.362 1.00 22.31 C ATOM 0 H ILE B 85 10.806 -1.557 3.467 1.00 72.33 H new ATOM 0 HA ILE B 85 10.865 1.369 3.061 1.00 70.35 H new ATOM 0 HB ILE B 85 13.089 0.794 3.778 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.664 2.271 1.694 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.297 1.778 2.094 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.437 -0.927 2.604 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.011 -1.629 3.404 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.007 -1.373 1.643 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.890 1.590 -0.308 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.186 -0.015 0.400 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.528 0.486 -0.007 1.00 22.31 H new ATOM 3244 N GLY B 86 10.127 0.987 0.739 1.00 43.24 N ATOM 3245 CA GLY B 86 9.517 0.790 -0.567 1.00 50.02 C ATOM 3246 C GLY B 86 9.839 1.937 -1.504 1.00 52.30 C ATOM 3247 O GLY B 86 10.394 2.947 -1.065 1.00 42.02 O ATOM 0 H GLY B 86 10.085 1.949 1.075 1.00 43.24 H new ATOM 0 HA2 GLY B 86 9.872 -0.146 -0.999 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.436 0.701 -0.456 1.00 50.02 H new ATOM 3251 N PRO B 87 9.521 1.815 -2.804 1.00 42.21 N ATOM 3252 CA PRO B 87 9.861 2.839 -3.789 1.00 30.25 C ATOM 3253 C PRO B 87 9.000 4.092 -3.628 1.00 61.30 C ATOM 3254 O PRO B 87 7.805 4.011 -3.323 1.00 52.32 O ATOM 3255 CB PRO B 87 9.581 2.150 -5.130 1.00 44.10 C ATOM 3256 CG PRO B 87 8.506 1.164 -4.822 1.00 14.42 C ATOM 3257 CD PRO B 87 8.756 0.704 -3.408 1.00 45.13 C ATOM 0 HA PRO B 87 10.889 3.186 -3.689 1.00 30.25 H new ATOM 0 HB2 PRO B 87 9.259 2.867 -5.885 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.473 1.658 -5.518 1.00 44.10 H new ATOM 0 HG2 PRO B 87 7.520 1.620 -4.915 1.00 14.42 H new ATOM 0 HG3 PRO B 87 8.536 0.324 -5.516 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.822 0.525 -2.875 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.320 -0.229 -3.385 1.00 45.13 H new ATOM 3265 N ASN B 88 9.622 5.245 -3.815 1.00 53.24 N ATOM 3266 CA ASN B 88 8.929 6.524 -3.757 1.00 21.43 C ATOM 3267 C ASN B 88 8.531 6.927 -5.171 1.00 21.10 C ATOM 3268 O ASN B 88 9.277 6.671 -6.115 1.00 51.23 O ATOM 3269 CB ASN B 88 9.848 7.584 -3.126 1.00 72.30 C ATOM 3270 CG ASN B 88 9.158 8.911 -2.848 1.00 63.22 C ATOM 3271 OD1 ASN B 88 8.262 9.332 -3.576 1.00 5.32 O ATOM 3272 ND2 ASN B 88 9.573 9.578 -1.781 1.00 3.11 N ATOM 0 H ASN B 88 10.620 5.322 -4.011 1.00 53.24 H new ATOM 0 HA ASN B 88 8.033 6.441 -3.142 1.00 21.43 H new ATOM 0 HB2 ASN B 88 10.250 7.192 -2.192 1.00 72.30 H new ATOM 0 HB3 ASN B 88 10.695 7.758 -3.790 1.00 72.30 H new ATOM 0 HD21 ASN B 88 9.146 10.473 -1.541 1.00 3.11 H new ATOM 0 HD22 ASN B 88 10.320 9.197 -1.200 1.00 3.11 H new ATOM 3279 N GLU B 89 7.368 7.556 -5.313 1.00 65.22 N ATOM 3280 CA GLU B 89 6.857 7.954 -6.624 1.00 51.32 C ATOM 3281 C GLU B 89 7.791 8.968 -7.289 1.00 22.42 C ATOM 3282 O GLU B 89 7.735 9.182 -8.502 1.00 11.02 O ATOM 3283 CB GLU B 89 5.443 8.531 -6.488 1.00 62.31 C ATOM 3284 CG GLU B 89 5.374 9.806 -5.654 1.00 11.15 C ATOM 3285 CD GLU B 89 3.948 10.237 -5.360 1.00 24.23 C ATOM 3286 OE1 GLU B 89 3.189 10.506 -6.318 1.00 4.32 O ATOM 3287 OE2 GLU B 89 3.574 10.307 -4.171 1.00 35.35 O1- ATOM 0 H GLU B 89 6.758 7.803 -4.533 1.00 65.22 H new ATOM 0 HA GLU B 89 6.814 7.069 -7.259 1.00 51.32 H new ATOM 0 HB2 GLU B 89 5.048 8.737 -7.483 1.00 62.31 H new ATOM 0 HB3 GLU B 89 4.796 7.778 -6.038 1.00 62.31 H new ATOM 0 HG2 GLU B 89 5.903 9.650 -4.714 1.00 11.15 H new ATOM 0 HG3 GLU B 89 5.891 10.608 -6.181 1.00 11.15 H new ATOM 3294 N GLU B 90 8.644 9.589 -6.478 1.00 52.12 N ATOM 3295 CA GLU B 90 9.662 10.515 -6.971 1.00 15.12 C ATOM 3296 C GLU B 90 10.714 9.768 -7.795 1.00 74.05 C ATOM 3297 O GLU B 90 11.357 10.336 -8.681 1.00 53.12 O ATOM 3298 CB GLU B 90 10.329 11.229 -5.781 1.00 14.23 C ATOM 3299 CG GLU B 90 11.550 12.060 -6.160 1.00 30.33 C ATOM 3300 CD GLU B 90 12.185 12.762 -4.972 1.00 5.15 C ATOM 3301 OE1 GLU B 90 11.925 13.967 -4.780 1.00 54.43 O ATOM 3302 OE2 GLU B 90 12.952 12.115 -4.227 1.00 12.50 O1- ATOM 0 H GLU B 90 8.650 9.466 -5.465 1.00 52.12 H new ATOM 0 HA GLU B 90 9.185 11.255 -7.614 1.00 15.12 H new ATOM 0 HB2 GLU B 90 9.595 11.878 -5.302 1.00 14.23 H new ATOM 0 HB3 GLU B 90 10.625 10.483 -5.043 1.00 14.23 H new ATOM 0 HG2 GLU B 90 12.290 11.413 -6.631 1.00 30.33 H new ATOM 0 HG3 GLU B 90 11.260 12.804 -6.902 1.00 30.33 H new ATOM 3309 N GLY B 91 10.850 8.479 -7.516 1.00 72.20 N ATOM 3310 CA GLY B 91 11.900 7.680 -8.118 1.00 12.11 C ATOM 3311 C GLY B 91 13.021 7.416 -7.134 1.00 71.02 C ATOM 3312 O GLY B 91 14.192 7.339 -7.510 1.00 5.53 O ATOM 0 H GLY B 91 10.244 7.967 -6.875 1.00 72.20 H new ATOM 0 HA2 GLY B 91 11.486 6.733 -8.464 1.00 12.11 H new ATOM 0 HA3 GLY B 91 12.295 8.195 -8.994 1.00 12.11 H new ATOM 3316 N GLY B 92 12.655 7.282 -5.862 1.00 60.34 N ATOM 3317 CA GLY B 92 13.627 7.040 -4.812 1.00 61.32 C ATOM 3318 C GLY B 92 13.106 6.047 -3.801 1.00 12.52 C ATOM 3319 O GLY B 92 12.411 5.100 -4.165 1.00 70.13 O ATOM 0 H GLY B 92 11.689 7.338 -5.538 1.00 60.34 H new ATOM 0 HA2 GLY B 92 14.552 6.665 -5.249 1.00 61.32 H new ATOM 0 HA3 GLY B 92 13.867 7.979 -4.313 1.00 61.32 H new ATOM 3323 N PHE B 93 13.413 6.268 -2.531 1.00 71.13 N ATOM 3324 CA PHE B 93 12.948 5.384 -1.467 1.00 4.00 C ATOM 3325 C PHE B 93 11.966 6.098 -0.547 1.00 73.12 C ATOM 3326 O PHE B 93 11.941 7.331 -0.473 1.00 63.14 O ATOM 3327 CB PHE B 93 14.130 4.833 -0.655 1.00 42.41 C ATOM 3328 CG PHE B 93 14.986 3.856 -1.417 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.371 3.923 -1.358 1.00 72.40 C ATOM 3330 CD2 PHE B 93 14.400 2.864 -2.192 1.00 72.15 C ATOM 3331 CE1 PHE B 93 17.153 3.022 -2.057 1.00 54.33 C ATOM 3332 CE2 PHE B 93 15.179 1.962 -2.892 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.556 2.042 -2.824 1.00 20.53 C ATOM 0 H PHE B 93 13.982 7.051 -2.210 1.00 71.13 H new ATOM 0 HA PHE B 93 12.430 4.548 -1.938 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.751 5.665 -0.324 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.747 4.345 0.241 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.843 4.688 -0.759 1.00 72.40 H new ATOM 0 HD2 PHE B 93 13.324 2.796 -2.248 1.00 72.15 H new ATOM 0 HE1 PHE B 93 18.230 3.085 -2.003 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.711 1.195 -3.492 1.00 20.53 H new ATOM 0 HZ PHE B 93 17.166 1.338 -3.371 1.00 20.53 H new ATOM 3343 N ALA B 94 11.152 5.303 0.132 1.00 22.42 N ATOM 3344 CA ALA B 94 10.181 5.795 1.096 1.00 62.21 C ATOM 3345 C ALA B 94 10.104 4.817 2.265 1.00 42.21 C ATOM 3346 O ALA B 94 10.105 3.600 2.058 1.00 61.15 O ATOM 3347 CB ALA B 94 8.819 5.972 0.428 1.00 43.22 C ATOM 0 H ALA B 94 11.148 4.288 0.028 1.00 22.42 H new ATOM 0 HA ALA B 94 10.491 6.770 1.473 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.100 6.341 1.160 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.905 6.688 -0.389 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.479 5.014 0.036 1.00 43.22 H new ATOM 3353 N LEU B 95 10.067 5.341 3.485 1.00 51.40 N ATOM 3354 CA LEU B 95 10.101 4.503 4.685 1.00 52.52 C ATOM 3355 C LEU B 95 8.717 4.368 5.316 1.00 31.45 C ATOM 3356 O LEU B 95 7.926 5.312 5.326 1.00 74.21 O ATOM 3357 CB LEU B 95 11.105 5.062 5.713 1.00 5.44 C ATOM 3358 CG LEU B 95 12.570 4.609 5.534 1.00 70.54 C ATOM 3359 CD1 LEU B 95 12.699 3.105 5.768 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.100 4.983 4.149 1.00 13.14 C ATOM 0 H LEU B 95 10.013 6.342 3.673 1.00 51.40 H new ATOM 0 HA LEU B 95 10.428 3.509 4.379 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.073 6.151 5.669 1.00 5.44 H new ATOM 0 HB3 LEU B 95 10.774 4.773 6.711 1.00 5.44 H new ATOM 0 HG LEU B 95 13.174 5.130 6.277 1.00 70.54 H new ATOM 0 HD11 LEU B 95 13.739 2.804 5.637 1.00 3.52 H new ATOM 0 HD12 LEU B 95 12.376 2.865 6.781 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.074 2.571 5.052 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.134 4.651 4.053 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.492 4.501 3.384 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.053 6.064 4.021 1.00 13.14 H new ATOM 3372 N ASP B 96 8.458 3.176 5.839 1.00 51.23 N ATOM 3373 CA ASP B 96 7.210 2.845 6.521 1.00 11.24 C ATOM 3374 C ASP B 96 7.540 2.154 7.831 1.00 14.30 C ATOM 3375 O ASP B 96 8.039 1.029 7.837 1.00 55.22 O ATOM 3376 CB ASP B 96 6.380 1.900 5.659 1.00 22.11 C ATOM 3377 CG ASP B 96 5.085 1.433 6.318 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.115 2.215 6.360 1.00 73.12 O ATOM 3379 OD2 ASP B 96 5.021 0.257 6.754 1.00 73.53 O1- ATOM 0 H ASP B 96 9.118 2.399 5.801 1.00 51.23 H new ATOM 0 HA ASP B 96 6.642 3.758 6.703 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.138 2.399 4.720 1.00 22.11 H new ATOM 0 HB3 ASP B 96 6.984 1.027 5.410 1.00 22.11 H new ATOM 3384 N VAL B 97 7.288 2.824 8.931 1.00 43.21 N ATOM 3385 CA VAL B 97 7.627 2.276 10.242 1.00 65.34 C ATOM 3386 C VAL B 97 6.372 1.905 11.020 1.00 4.12 C ATOM 3387 O VAL B 97 5.616 2.772 11.438 1.00 1.23 O ATOM 3388 CB VAL B 97 8.468 3.272 11.081 1.00 44.15 C ATOM 3389 CG1 VAL B 97 8.815 2.677 12.448 1.00 31.14 C ATOM 3390 CG2 VAL B 97 9.732 3.686 10.324 1.00 13.32 C ATOM 0 H VAL B 97 6.852 3.746 8.954 1.00 43.21 H new ATOM 0 HA VAL B 97 8.222 1.380 10.063 1.00 65.34 H new ATOM 0 HB VAL B 97 7.868 4.166 11.249 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.405 3.395 13.018 1.00 31.14 H new ATOM 0 HG12 VAL B 97 7.897 2.451 12.990 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.390 1.761 12.311 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.307 4.385 10.931 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.337 2.803 10.116 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.453 4.165 9.385 1.00 13.32 H new ATOM 3400 N GLU B 98 6.155 0.614 11.209 1.00 55.41 N ATOM 3401 CA GLU B 98 5.052 0.132 12.027 1.00 61.25 C ATOM 3402 C GLU B 98 5.564 -0.206 13.423 1.00 55.42 C ATOM 3403 O GLU B 98 6.259 -1.205 13.620 1.00 74.01 O ATOM 3404 CB GLU B 98 4.383 -1.087 11.378 1.00 43.20 C ATOM 3405 CG GLU B 98 3.730 -0.769 10.034 1.00 33.43 C ATOM 3406 CD GLU B 98 2.886 -1.913 9.497 1.00 35.25 C ATOM 3407 OE1 GLU B 98 3.319 -2.585 8.538 1.00 70.42 O ATOM 3408 OE2 GLU B 98 1.780 -2.141 10.031 1.00 74.42 O1- ATOM 0 H GLU B 98 6.732 -0.124 10.805 1.00 55.41 H new ATOM 0 HA GLU B 98 4.299 0.916 12.107 1.00 61.25 H new ATOM 0 HB2 GLU B 98 5.128 -1.870 11.237 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.628 -1.484 12.057 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.104 0.117 10.141 1.00 33.43 H new ATOM 0 HG3 GLU B 98 4.506 -0.526 9.308 1.00 33.43 H new ATOM 3415 N LEU B 99 5.247 0.654 14.380 1.00 61.12 N ATOM 3416 CA LEU B 99 5.708 0.481 15.750 1.00 54.24 C ATOM 3417 C LEU B 99 4.641 -0.263 16.552 1.00 51.12 C ATOM 3418 O LEU B 99 3.555 0.267 16.807 1.00 12.44 O ATOM 3419 CB LEU B 99 6.019 1.849 16.385 1.00 60.12 C ATOM 3420 CG LEU B 99 6.939 1.815 17.620 1.00 42.10 C ATOM 3421 CD1 LEU B 99 8.342 1.333 17.239 1.00 24.34 C ATOM 3422 CD2 LEU B 99 7.001 3.193 18.283 1.00 1.13 C ATOM 0 H LEU B 99 4.670 1.482 14.232 1.00 61.12 H new ATOM 0 HA LEU B 99 6.626 -0.107 15.754 1.00 54.24 H new ATOM 0 HB2 LEU B 99 6.479 2.485 15.629 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.078 2.321 16.668 1.00 60.12 H new ATOM 0 HG LEU B 99 6.521 1.109 18.337 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.975 1.317 18.126 1.00 24.34 H new ATOM 0 HD12 LEU B 99 8.280 0.329 16.819 1.00 24.34 H new ATOM 0 HD13 LEU B 99 8.771 2.010 16.500 1.00 24.34 H new ATOM 0 HD21 LEU B 99 7.656 3.149 19.153 1.00 1.13 H new ATOM 0 HD22 LEU B 99 7.391 3.922 17.572 1.00 1.13 H new ATOM 0 HD23 LEU B 99 6.001 3.491 18.596 1.00 1.13 H new ATOM 3434 N ARG B 100 4.959 -1.493 16.929 1.00 53.41 N ATOM 3435 CA ARG B 100 4.030 -2.375 17.624 1.00 2.45 C ATOM 3436 C ARG B 100 4.313 -2.355 19.122 1.00 14.01 C ATOM 3437 O ARG B 100 5.459 -2.501 19.546 1.00 24.14 O ATOM 3438 CB ARG B 100 4.173 -3.802 17.076 1.00 53.52 C ATOM 3439 CG ARG B 100 3.095 -4.778 17.542 1.00 13.43 C ATOM 3440 CD ARG B 100 3.378 -6.190 17.036 1.00 64.11 C ATOM 3441 NE ARG B 100 2.230 -7.089 17.201 1.00 3.43 N ATOM 3442 CZ ARG B 100 2.315 -8.426 17.181 1.00 52.33 C ATOM 3443 NH1 ARG B 100 3.498 -9.023 17.083 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 1.215 -9.166 17.276 1.00 11.32 N ATOM 0 H ARG B 100 5.874 -1.911 16.761 1.00 53.41 H new ATOM 0 HA ARG B 100 3.010 -2.029 17.458 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.160 -3.761 15.987 1.00 53.52 H new ATOM 0 HB3 ARG B 100 5.148 -4.192 17.368 1.00 53.52 H new ATOM 0 HG2 ARG B 100 3.049 -4.781 18.631 1.00 13.43 H new ATOM 0 HG3 ARG B 100 2.121 -4.448 17.182 1.00 13.43 H new ATOM 0 HD2 ARG B 100 3.652 -6.146 15.982 1.00 64.11 H new ATOM 0 HD3 ARG B 100 4.235 -6.599 17.571 1.00 64.11 H new ATOM 0 HE ARG B 100 1.310 -6.670 17.339 1.00 3.43 H new ATOM 0 HH11 ARG B 100 4.348 -8.463 17.022 1.00 41.53 H new ATOM 0 HH12 ARG B 100 3.556 -10.041 17.068 1.00 41.53 H new ATOM 0 HH21 ARG B 100 0.304 -8.716 17.364 1.00 11.32 H new ATOM 0 HH22 ARG B 100 1.282 -10.184 17.261 1.00 11.32 H new ATOM 3458 N VAL B 101 3.268 -2.173 19.919 1.00 41.00 N ATOM 3459 CA VAL B 101 3.410 -2.038 21.365 1.00 50.20 C ATOM 3460 C VAL B 101 2.702 -3.174 22.087 1.00 3.30 C ATOM 3461 O VAL B 101 1.539 -3.443 21.815 1.00 1.54 O ATOM 3462 CB VAL B 101 2.813 -0.697 21.849 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.859 -0.593 23.372 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.537 0.481 21.196 1.00 51.31 C ATOM 0 H VAL B 101 2.306 -2.115 19.586 1.00 41.00 H new ATOM 0 HA VAL B 101 4.475 -2.070 21.593 1.00 50.20 H new ATOM 0 HB VAL B 101 1.766 -0.663 21.547 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.433 0.360 23.685 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.284 -1.409 23.810 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.893 -0.656 23.710 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.102 1.416 21.549 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.594 0.450 21.460 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.431 0.418 20.113 1.00 51.31 H new ATOM 3474 N ALA B 102 3.403 -3.833 23.005 1.00 24.03 N ATOM 3475 CA ALA B 102 2.796 -4.866 23.837 1.00 53.32 C ATOM 3476 C ALA B 102 3.039 -4.563 25.315 1.00 44.40 C ATOM 3477 O ALA B 102 4.129 -4.805 25.841 1.00 4.42 O ATOM 3478 CB ALA B 102 3.349 -6.241 23.465 1.00 42.24 C ATOM 0 H ALA B 102 4.392 -3.670 23.191 1.00 24.03 H new ATOM 0 HA ALA B 102 1.720 -4.874 23.661 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.887 -7.002 24.094 1.00 42.24 H new ATOM 0 HB2 ALA B 102 3.127 -6.452 22.419 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.428 -6.252 23.616 1.00 42.24 H new ATOM 3484 N LEU B 103 2.017 -4.030 25.977 1.00 61.44 N ATOM 3485 CA LEU B 103 2.100 -3.684 27.394 1.00 72.24 C ATOM 3486 C LEU B 103 1.118 -4.553 28.178 1.00 41.41 C ATOM 3487 O LEU B 103 -0.087 -4.501 27.934 1.00 40.11 O ATOM 3488 CB LEU B 103 1.792 -2.188 27.599 1.00 55.34 C ATOM 3489 CG LEU B 103 2.100 -1.629 29.004 1.00 34.43 C ATOM 3490 CD1 LEU B 103 3.587 -1.731 29.308 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.636 -0.180 29.138 1.00 1.40 C ATOM 0 H LEU B 103 1.113 -3.826 25.551 1.00 61.44 H new ATOM 0 HA LEU B 103 3.111 -3.870 27.758 1.00 72.24 H new ATOM 0 HB2 LEU B 103 2.361 -1.615 26.867 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.737 -2.020 27.384 1.00 55.34 H new ATOM 0 HG LEU B 103 1.550 -2.232 29.727 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.783 -1.332 30.303 1.00 40.33 H new ATOM 0 HD12 LEU B 103 3.896 -2.776 29.269 1.00 40.33 H new ATOM 0 HD13 LEU B 103 4.149 -1.159 28.570 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.867 0.185 30.139 1.00 1.40 H new ATOM 0 HD22 LEU B 103 2.149 0.436 28.400 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.560 -0.126 28.971 1.00 1.40 H new ATOM 3503 N PRO B 104 1.619 -5.378 29.117 1.00 3.11 N ATOM 3504 CA PRO B 104 0.788 -6.345 29.843 1.00 24.44 C ATOM 3505 C PRO B 104 -0.201 -5.685 30.799 1.00 5.10 C ATOM 3506 O PRO B 104 0.090 -4.647 31.403 1.00 15.44 O ATOM 3507 CB PRO B 104 1.810 -7.184 30.614 1.00 10.11 C ATOM 3508 CG PRO B 104 2.979 -6.281 30.791 1.00 31.23 C ATOM 3509 CD PRO B 104 3.026 -5.432 29.551 1.00 74.24 C ATOM 0 HA PRO B 104 0.163 -6.925 29.165 1.00 24.44 H new ATOM 0 HB2 PRO B 104 1.412 -7.510 31.575 1.00 10.11 H new ATOM 0 HB3 PRO B 104 2.083 -8.083 30.061 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.867 -5.665 31.683 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.900 -6.851 30.911 1.00 31.23 H new ATOM 0 HD2 PRO B 104 3.420 -4.437 29.760 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.665 -5.873 28.786 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.357 -6.317 30.940 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.413 -5.798 31.793 1.00 21.00 C ATOM 3519 C GLY B 105 -3.059 -4.543 31.235 1.00 53.31 C ATOM 3520 O GLY B 105 -3.772 -3.836 31.949 1.00 21.33 O ATOM 0 H GLY B 105 -1.587 -7.194 30.472 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.176 -6.565 31.926 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.003 -5.582 32.780 1.00 21.00 H new ATOM 3524 N LEU B 106 -2.818 -4.271 29.956 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.319 -3.062 29.306 1.00 45.21 C ATOM 3526 C LEU B 106 -4.249 -3.411 28.138 1.00 60.53 C ATOM 3527 O LEU B 106 -4.005 -4.367 27.401 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.135 -2.207 28.820 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.494 -1.043 27.881 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.418 -0.043 28.565 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.237 -0.346 27.375 1.00 55.01 C ATOM 0 H LEU B 106 -2.273 -4.878 29.343 1.00 45.40 H new ATOM 0 HA LEU B 106 -3.898 -2.490 30.031 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -1.622 -1.801 29.692 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.427 -2.858 28.307 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.025 -1.462 27.026 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.652 0.767 27.874 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.339 -0.544 28.863 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -2.924 0.364 29.447 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.517 0.473 26.713 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -0.673 0.047 28.221 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.620 -1.060 26.829 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.324 -2.632 27.991 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.282 -2.823 26.898 1.00 50.41 C ATOM 3545 C ASP B 107 -5.730 -2.286 25.597 1.00 24.13 C ATOM 3546 O ASP B 107 -4.795 -1.493 25.593 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.591 -2.078 27.157 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.792 -2.794 26.567 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.091 -2.573 25.375 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.432 -3.591 27.286 1.00 14.11 O1- ATOM 0 H ASP B 107 -5.553 -1.860 28.617 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.461 -3.897 26.838 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -7.733 -1.962 28.231 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -7.525 -1.076 26.734 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.361 -2.678 24.509 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.091 -2.100 23.208 1.00 21.33 C ATOM 3557 C ALA B 108 -6.579 -0.655 23.169 1.00 4.44 C ATOM 3558 O ALA B 108 -5.864 0.245 22.728 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.791 -2.919 22.143 1.00 34.32 C ATOM 0 H ALA B 108 -7.075 -3.406 24.502 1.00 12.24 H new ATOM 0 HA ALA B 108 -5.017 -2.108 23.020 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.591 -2.488 21.162 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -6.422 -3.944 22.171 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.865 -2.915 22.329 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.795 -0.443 23.672 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.433 0.869 23.639 1.00 64.51 C ATOM 3567 C ALA B 109 -7.611 1.888 24.418 1.00 34.40 C ATOM 3568 O ALA B 109 -7.348 2.994 23.938 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.848 0.782 24.200 1.00 34.53 C ATOM 0 H ALA B 109 -8.360 -1.171 24.110 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.489 1.199 22.602 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.313 1.768 24.170 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.435 0.086 23.601 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.810 0.431 25.231 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.196 1.497 25.619 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.380 2.355 26.466 1.00 72.03 C ATOM 3577 C ALA B 110 -4.971 2.473 25.894 1.00 4.25 C ATOM 3578 O ALA B 110 -4.386 3.562 25.865 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.345 1.817 27.892 1.00 4.12 C ATOM 0 H ALA B 110 -7.413 0.588 26.027 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.824 3.350 26.491 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.731 2.470 28.512 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.358 1.783 28.293 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -5.921 0.813 27.892 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.437 1.349 25.417 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.099 1.330 24.817 1.00 51.51 C ATOM 3587 C ALA B 111 -2.978 2.350 23.694 1.00 2.23 C ATOM 3588 O ALA B 111 -1.970 3.041 23.590 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.752 -0.057 24.296 1.00 4.22 C ATOM 0 H ALA B 111 -4.906 0.443 25.433 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.392 1.597 25.602 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.755 -0.042 23.857 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -2.775 -0.771 25.119 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.478 -0.353 23.539 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.014 2.446 22.867 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.020 3.386 21.749 1.00 34.20 C ATOM 3597 C LYS B 112 -3.699 4.810 22.210 1.00 24.41 C ATOM 3598 O LYS B 112 -2.906 5.507 21.575 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.368 3.356 21.021 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.603 2.075 20.227 1.00 74.45 C ATOM 3601 CD LYS B 112 -6.945 2.091 19.504 1.00 63.04 C ATOM 3602 CE LYS B 112 -7.041 3.233 18.498 1.00 72.33 C ATOM 3603 NZ LYS B 112 -5.994 3.145 17.445 1.00 62.21 N1+ ATOM 0 H LYS B 112 -4.861 1.884 22.949 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.239 3.073 21.056 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.169 3.473 21.751 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.426 4.209 20.345 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -4.801 1.946 19.500 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.564 1.219 20.900 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.090 1.141 18.989 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -7.749 2.183 20.234 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -8.026 3.221 18.031 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -6.948 4.185 19.021 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -6.188 3.847 16.703 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -5.062 3.335 17.865 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -5.999 2.192 17.030 1.00 62.21 H new ATOM 3617 N THR B 113 -4.300 5.234 23.323 1.00 71.03 N ATOM 3618 CA THR B 113 -4.097 6.593 23.812 1.00 12.30 C ATOM 3619 C THR B 113 -2.755 6.713 24.536 1.00 72.03 C ATOM 3620 O THR B 113 -2.068 7.729 24.418 1.00 34.03 O ATOM 3621 CB THR B 113 -5.247 7.065 24.743 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.337 8.499 24.730 1.00 15.33 O ATOM 3623 CG2 THR B 113 -5.041 6.603 26.178 1.00 55.23 C ATOM 0 H THR B 113 -4.923 4.663 23.894 1.00 71.03 H new ATOM 0 HA THR B 113 -4.094 7.244 22.938 1.00 12.30 H new ATOM 0 HB THR B 113 -6.168 6.623 24.364 1.00 51.23 H new ATOM 0 HG1 THR B 113 -6.066 8.786 25.319 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.868 6.954 26.796 1.00 55.23 H new ATOM 0 HG22 THR B 113 -5.003 5.514 26.208 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.104 7.009 26.560 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.377 5.671 25.279 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.113 5.684 26.017 1.00 34.43 C ATOM 3633 C LEU B 114 0.059 5.776 25.046 1.00 70.23 C ATOM 3634 O LEU B 114 0.975 6.585 25.230 1.00 14.10 O ATOM 3635 CB LEU B 114 -0.979 4.442 26.912 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.083 4.275 27.971 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.737 3.149 28.941 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.329 5.585 28.723 1.00 20.12 C ATOM 0 H LEU B 114 -2.922 4.815 25.385 1.00 42.02 H new ATOM 0 HA LEU B 114 -1.104 6.561 26.664 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -0.970 3.556 26.277 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.015 4.481 27.419 1.00 61.41 H new ATOM 0 HG LEU B 114 -3.005 4.008 27.454 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.531 3.049 29.681 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.634 2.214 28.391 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.798 3.379 29.445 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -3.114 5.437 29.465 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.411 5.895 29.223 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.637 6.357 28.018 1.00 20.12 H new ATOM 3650 N VAL B 115 0.004 4.965 23.998 1.00 61.11 N ATOM 3651 CA VAL B 115 1.014 4.987 22.952 1.00 23.35 C ATOM 3652 C VAL B 115 0.981 6.324 22.223 1.00 63.55 C ATOM 3653 O VAL B 115 2.021 6.874 21.888 1.00 10.54 O ATOM 3654 CB VAL B 115 0.812 3.831 21.935 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.849 3.899 20.811 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.875 2.478 22.643 1.00 32.34 C ATOM 0 H VAL B 115 -0.736 4.279 23.851 1.00 61.11 H new ATOM 0 HA VAL B 115 1.985 4.851 23.427 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.176 3.943 21.488 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.684 3.078 20.114 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.752 4.848 20.284 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.850 3.820 21.234 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.731 1.679 21.915 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.848 2.363 23.121 1.00 32.34 H new ATOM 0 HG23 VAL B 115 0.091 2.426 23.398 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.222 6.846 21.998 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.396 8.135 21.327 1.00 4.03 C ATOM 3668 C ASP B 116 0.374 9.235 22.051 1.00 43.14 C ATOM 3669 O ASP B 116 1.266 9.870 21.476 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.884 8.507 21.261 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.133 9.895 20.679 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -3.059 10.584 21.160 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -1.406 10.308 19.744 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.095 6.395 22.271 1.00 33.05 H new ATOM 0 HA ASP B 116 -0.003 8.041 20.315 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.410 7.768 20.657 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.308 8.460 22.264 1.00 75.43 H new ATOM 3678 N ARG B 117 0.037 9.436 23.319 1.00 65.05 N ATOM 3679 CA ARG B 117 0.642 10.491 24.123 1.00 30.34 C ATOM 3680 C ARG B 117 2.144 10.258 24.294 1.00 41.22 C ATOM 3681 O ARG B 117 2.945 11.181 24.123 1.00 22.44 O ATOM 3682 CB ARG B 117 -0.061 10.586 25.485 1.00 5.33 C ATOM 3683 CG ARG B 117 -0.080 9.273 26.262 1.00 52.02 C ATOM 3684 CD ARG B 117 -1.060 9.309 27.426 1.00 70.20 C ATOM 3685 NE ARG B 117 -0.651 10.248 28.472 1.00 35.41 N ATOM 3686 CZ ARG B 117 -1.468 10.720 29.414 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -2.770 10.465 29.362 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -0.990 11.482 30.386 1.00 12.43 N ATOM 0 H ARG B 117 -0.657 8.878 23.816 1.00 65.05 H new ATOM 0 HA ARG B 117 0.515 11.440 23.602 1.00 30.34 H new ATOM 0 HB2 ARG B 117 0.436 11.347 26.087 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.087 10.921 25.331 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.347 8.458 25.589 1.00 52.02 H new ATOM 0 HG3 ARG B 117 0.921 9.061 26.638 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -2.047 9.588 27.058 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -1.149 8.310 27.853 1.00 70.20 H new ATOM 0 HE ARG B 117 0.320 10.561 28.481 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -3.150 9.905 28.599 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -3.390 10.829 30.085 1.00 12.31 H new ATOM 0 HH21 ARG B 117 0.004 11.708 30.414 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -1.616 11.843 31.106 1.00 12.43 H new ATOM 3702 N ALA B 118 2.526 9.017 24.592 1.00 61.11 N ATOM 3703 CA ALA B 118 3.935 8.663 24.759 1.00 4.01 C ATOM 3704 C ALA B 118 4.704 8.888 23.459 1.00 4.12 C ATOM 3705 O ALA B 118 5.855 9.329 23.462 1.00 22.32 O ATOM 3706 CB ALA B 118 4.065 7.216 25.213 1.00 4.44 C ATOM 0 H ALA B 118 1.879 8.239 24.723 1.00 61.11 H new ATOM 0 HA ALA B 118 4.365 9.308 25.525 1.00 4.01 H new ATOM 0 HB1 ALA B 118 5.119 6.966 25.333 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.550 7.086 26.165 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.619 6.559 24.466 1.00 4.44 H new ATOM 3712 N HIS B 119 4.039 8.607 22.348 1.00 53.54 N ATOM 3713 CA HIS B 119 4.639 8.743 21.027 1.00 31.05 C ATOM 3714 C HIS B 119 4.527 10.190 20.542 1.00 22.51 C ATOM 3715 O HIS B 119 4.924 10.506 19.425 1.00 73.21 O ATOM 3716 CB HIS B 119 3.954 7.783 20.038 1.00 24.30 C ATOM 3717 CG HIS B 119 4.676 7.581 18.736 1.00 50.32 C ATOM 3718 ND1 HIS B 119 4.540 8.196 17.534 1.00 33.22 N flip ATOM 3719 CD2 HIS B 119 5.639 6.610 18.555 1.00 55.12 C flip ATOM 3720 CE1 HIS B 119 5.410 7.587 16.666 1.00 74.31 C flip ATOM 3721 NE2 HIS B 119 6.061 6.637 17.306 1.00 22.51 N flip ATOM 0 H HIS B 119 3.073 8.280 22.335 1.00 53.54 H new ATOM 0 HA HIS B 119 5.696 8.483 21.087 1.00 31.05 H new ATOM 0 HB2 HIS B 119 3.834 6.814 20.522 1.00 24.30 H new ATOM 0 HB3 HIS B 119 2.953 8.160 19.825 1.00 24.30 H new ATOM 0 HD1 HIS B 119 3.909 8.967 17.317 1.00 33.22 H new ATOM 0 HD2 HIS B 119 5.993 5.933 19.318 1.00 55.12 H new ATOM 0 HE1 HIS B 119 5.540 7.845 15.625 1.00 74.31 H new ATOM 3730 N HIS B 120 3.973 11.063 21.381 1.00 35.12 N ATOM 3731 CA HIS B 120 3.839 12.484 21.045 1.00 61.52 C ATOM 3732 C HIS B 120 4.806 13.336 21.867 1.00 22.12 C ATOM 3733 O HIS B 120 5.357 14.315 21.366 1.00 21.30 O ATOM 3734 CB HIS B 120 2.399 12.957 21.286 1.00 61.10 C ATOM 3735 CG HIS B 120 2.141 14.366 20.830 1.00 45.20 C ATOM 3736 ND1 HIS B 120 2.236 15.463 21.662 1.00 23.40 N ATOM 3737 CD2 HIS B 120 1.789 14.850 19.615 1.00 61.34 C ATOM 3738 CE1 HIS B 120 1.954 16.557 20.977 1.00 14.23 C ATOM 3739 NE2 HIS B 120 1.680 16.212 19.735 1.00 33.30 N ATOM 0 H HIS B 120 3.608 10.813 22.300 1.00 35.12 H new ATOM 0 HA HIS B 120 4.084 12.602 19.989 1.00 61.52 H new ATOM 0 HB2 HIS B 120 1.714 12.286 20.768 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.175 12.882 22.350 1.00 61.10 H new ATOM 0 HD2 HIS B 120 1.625 14.271 18.718 1.00 61.34 H new ATOM 0 HE1 HIS B 120 1.949 17.563 21.369 1.00 14.23 H new ATOM 0 HE2 HIS B 120 1.428 16.854 18.984 1.00 33.30 H new ATOM 3748 N VAL B 121 4.997 12.961 23.130 1.00 53.34 N ATOM 3749 CA VAL B 121 5.817 13.747 24.055 1.00 2.11 C ATOM 3750 C VAL B 121 7.317 13.500 23.855 1.00 31.12 C ATOM 3751 O VAL B 121 8.126 14.423 23.987 1.00 43.14 O ATOM 3752 CB VAL B 121 5.438 13.463 25.533 1.00 52.03 C ATOM 3753 CG1 VAL B 121 3.994 13.887 25.808 1.00 41.33 C ATOM 3754 CG2 VAL B 121 5.642 11.988 25.882 1.00 63.42 C ATOM 0 H VAL B 121 4.595 12.117 23.539 1.00 53.34 H new ATOM 0 HA VAL B 121 5.610 14.793 23.829 1.00 2.11 H new ATOM 0 HB VAL B 121 6.099 14.052 26.169 1.00 52.03 H new ATOM 0 HG11 VAL B 121 3.746 13.680 26.849 1.00 41.33 H new ATOM 0 HG12 VAL B 121 3.885 14.954 25.614 1.00 41.33 H new ATOM 0 HG13 VAL B 121 3.321 13.329 25.157 1.00 41.33 H new ATOM 0 HG21 VAL B 121 5.368 11.819 26.924 1.00 63.42 H new ATOM 0 HG22 VAL B 121 5.015 11.372 25.238 1.00 63.42 H new ATOM 0 HG23 VAL B 121 6.688 11.720 25.734 1.00 63.42 H new ATOM 3764 N CYS B 122 7.682 12.260 23.536 1.00 64.23 N ATOM 3765 CA CYS B 122 9.087 11.889 23.378 1.00 24.42 C ATOM 3766 C CYS B 122 9.672 12.502 22.098 1.00 23.34 C ATOM 3767 O CYS B 122 9.022 12.489 21.051 1.00 74.53 O ATOM 3768 CB CYS B 122 9.227 10.361 23.357 1.00 15.34 C ATOM 3769 SG CYS B 122 8.595 9.543 24.840 1.00 14.44 S ATOM 0 H CYS B 122 7.025 11.495 23.382 1.00 64.23 H new ATOM 0 HA CYS B 122 9.648 12.282 24.226 1.00 24.42 H new ATOM 0 HB2 CYS B 122 8.700 9.970 22.487 1.00 15.34 H new ATOM 0 HB3 CYS B 122 10.279 10.105 23.234 1.00 15.34 H new ATOM 0 HG CYS B 122 7.340 9.250 24.672 1.00 14.44 H new ATOM 3775 N PRO B 123 10.917 13.033 22.168 1.00 45.45 N ATOM 3776 CA PRO B 123 11.568 13.724 21.039 1.00 1.30 C ATOM 3777 C PRO B 123 11.533 12.914 19.739 1.00 21.43 C ATOM 3778 O PRO B 123 10.947 13.348 18.744 1.00 1.12 O ATOM 3779 CB PRO B 123 13.014 13.913 21.525 1.00 65.25 C ATOM 3780 CG PRO B 123 12.905 13.951 23.012 1.00 12.41 C ATOM 3781 CD PRO B 123 11.787 13.005 23.365 1.00 30.51 C ATOM 0 HA PRO B 123 11.060 14.656 20.791 1.00 1.30 H new ATOM 0 HB2 PRO B 123 13.654 13.095 21.195 1.00 65.25 H new ATOM 0 HB3 PRO B 123 13.447 14.834 21.135 1.00 65.25 H new ATOM 0 HG2 PRO B 123 13.840 13.644 23.481 1.00 12.41 H new ATOM 0 HG3 PRO B 123 12.689 14.960 23.363 1.00 12.41 H new ATOM 0 HD2 PRO B 123 12.160 12.001 23.566 1.00 30.51 H new ATOM 0 HD3 PRO B 123 11.252 13.331 24.257 1.00 30.51 H new ATOM 3789 N TYR B 124 12.153 11.731 19.763 1.00 44.15 N ATOM 3790 CA TYR B 124 12.191 10.851 18.590 1.00 41.53 C ATOM 3791 C TYR B 124 10.778 10.564 18.095 1.00 41.03 C ATOM 3792 O TYR B 124 10.515 10.547 16.895 1.00 24.42 O ATOM 3793 CB TYR B 124 12.892 9.520 18.924 1.00 11.44 C ATOM 3794 CG TYR B 124 14.371 9.648 19.261 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.352 9.106 18.427 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.789 10.306 20.414 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.692 9.221 18.735 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.131 10.424 20.726 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.077 9.878 19.886 1.00 65.35 C ATOM 3800 OH TYR B 124 18.412 9.998 20.194 1.00 21.31 O ATOM 0 H TYR B 124 12.636 11.360 20.581 1.00 44.15 H new ATOM 0 HA TYR B 124 12.754 11.362 17.809 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.380 9.057 19.767 1.00 11.44 H new ATOM 0 HB3 TYR B 124 12.784 8.845 18.075 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.057 8.588 17.526 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.051 10.732 21.078 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.437 8.798 18.077 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.436 10.941 21.624 1.00 2.53 H new ATOM 0 HH TYR B 124 18.520 10.045 21.167 1.00 21.31 H new ATOM 3845 N THR B 128 8.860 11.492 14.533 1.00 13.32 N ATOM 3846 CA THR B 128 8.705 10.263 13.767 1.00 55.14 C ATOM 3847 C THR B 128 7.241 10.045 13.390 1.00 13.14 C ATOM 3848 O THR B 128 6.919 9.155 12.614 1.00 21.45 O ATOM 3849 CB THR B 128 9.248 9.040 14.549 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.571 7.976 13.647 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.236 8.541 15.571 1.00 11.25 C ATOM 0 HA THR B 128 9.290 10.366 12.853 1.00 55.14 H new ATOM 0 HB THR B 128 10.147 9.361 15.076 1.00 41.45 H new ATOM 0 HG1 THR B 128 9.914 7.211 14.154 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.648 7.683 16.102 1.00 11.25 H new ATOM 0 HG22 THR B 128 8.015 9.336 16.283 1.00 11.25 H new ATOM 0 HG23 THR B 128 7.319 8.246 15.061 1.00 11.25 H new ATOM 3859 N ARG B 129 6.354 10.872 13.935 1.00 41.51 N ATOM 3860 CA ARG B 129 4.929 10.766 13.634 1.00 75.21 C ATOM 3861 C ARG B 129 4.485 11.955 12.795 1.00 73.32 C ATOM 3862 O ARG B 129 3.793 11.808 11.788 1.00 44.41 O ATOM 3863 CB ARG B 129 4.106 10.682 14.932 1.00 21.01 C ATOM 3864 CG ARG B 129 4.246 11.884 15.861 1.00 45.10 C ATOM 3865 CD ARG B 129 3.437 11.707 17.140 1.00 21.21 C ATOM 3866 NE ARG B 129 1.990 11.707 16.894 1.00 2.44 N ATOM 3867 CZ ARG B 129 1.072 11.255 17.754 1.00 0.21 C ATOM 3868 NH1 ARG B 129 1.435 10.777 18.940 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 -0.211 11.287 17.428 1.00 44.44 N ATOM 0 H ARG B 129 6.595 11.620 14.585 1.00 41.51 H new ATOM 0 HA ARG B 129 4.758 9.852 13.065 1.00 75.21 H new ATOM 0 HB2 ARG B 129 3.054 10.564 14.671 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.402 9.785 15.475 1.00 21.01 H new ATOM 0 HG2 ARG B 129 5.297 12.029 16.112 1.00 45.10 H new ATOM 0 HG3 ARG B 129 3.915 12.784 15.343 1.00 45.10 H new ATOM 0 HD2 ARG B 129 3.721 10.770 17.619 1.00 21.21 H new ATOM 0 HD3 ARG B 129 3.684 12.508 17.836 1.00 21.21 H new ATOM 0 HE ARG B 129 1.661 12.079 16.003 1.00 2.44 H new ATOM 0 HH11 ARG B 129 2.421 10.753 19.200 1.00 5.12 H new ATOM 0 HH12 ARG B 129 0.728 10.434 19.590 1.00 5.12 H new ATOM 0 HH21 ARG B 129 -0.498 11.656 16.521 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -0.912 10.942 18.083 1.00 44.44 H new ATOM 3883 N ASN B 130 4.866 13.140 13.242 1.00 21.53 N ATOM 3884 CA ASN B 130 4.538 14.371 12.546 1.00 53.34 C ATOM 3885 C ASN B 130 5.464 14.588 11.361 1.00 22.35 C ATOM 3886 O ASN B 130 5.056 15.115 10.325 1.00 70.41 O ATOM 3887 CB ASN B 130 4.592 15.540 13.530 1.00 70.21 C ATOM 3888 CG ASN B 130 3.479 15.433 14.557 1.00 33.52 C ATOM 3889 OD1 ASN B 130 2.336 15.124 14.212 1.00 60.32 O ATOM 3890 ND2 ASN B 130 3.808 15.613 15.824 1.00 74.14 N ATOM 0 H ASN B 130 5.409 13.275 14.095 1.00 21.53 H new ATOM 0 HA ASN B 130 3.526 14.302 12.147 1.00 53.34 H new ATOM 0 HB2 ASN B 130 5.558 15.552 14.034 1.00 70.21 H new ATOM 0 HB3 ASN B 130 4.503 16.482 12.988 1.00 70.21 H new ATOM 0 HD21 ASN B 130 3.106 15.497 16.555 1.00 74.14 H new ATOM 0 HD22 ASN B 130 4.764 15.868 16.071 1.00 74.14 H new ATOM 3897 N ASN B 131 6.712 14.168 11.518 1.00 34.23 N ATOM 3898 CA ASN B 131 7.724 14.379 10.490 1.00 31.43 C ATOM 3899 C ASN B 131 7.874 13.141 9.603 1.00 54.44 C ATOM 3900 O ASN B 131 7.985 13.248 8.378 1.00 13.44 O ATOM 3901 CB ASN B 131 9.064 14.736 11.148 1.00 3.33 C ATOM 3902 CG ASN B 131 10.033 15.367 10.165 1.00 61.21 C ATOM 3903 OD1 ASN B 131 10.889 14.697 9.586 1.00 75.43 O ATOM 3904 ND2 ASN B 131 9.894 16.665 9.961 1.00 34.33 N ATOM 0 H ASN B 131 7.049 13.679 12.347 1.00 34.23 H new ATOM 0 HA ASN B 131 7.407 15.206 9.855 1.00 31.43 H new ATOM 0 HB2 ASN B 131 8.889 15.423 11.976 1.00 3.33 H new ATOM 0 HB3 ASN B 131 9.511 13.836 11.570 1.00 3.33 H new ATOM 0 HD21 ASN B 131 10.508 17.147 9.304 1.00 34.33 H new ATOM 0 HD22 ASN B 131 9.173 17.185 10.460 1.00 34.33 H new ATOM 3911 N VAL B 132 7.843 11.965 10.227 1.00 52.13 N ATOM 3912 CA VAL B 132 8.099 10.700 9.532 1.00 11.30 C ATOM 3913 C VAL B 132 6.838 9.820 9.540 1.00 11.32 C ATOM 3914 O VAL B 132 5.874 10.122 10.248 1.00 35.23 O ATOM 3915 CB VAL B 132 9.296 9.955 10.195 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.712 8.722 9.393 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.487 10.905 10.382 1.00 3.12 C ATOM 0 H VAL B 132 7.641 11.860 11.221 1.00 52.13 H new ATOM 0 HA VAL B 132 8.358 10.915 8.495 1.00 11.30 H new ATOM 0 HB VAL B 132 8.965 9.611 11.175 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.549 8.231 9.889 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.872 8.030 9.328 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.011 9.025 8.390 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.313 10.366 10.846 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.803 11.287 9.412 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.192 11.737 11.021 1.00 3.12 H new ATOM 3927 N ALA B 133 6.840 8.753 8.736 1.00 53.04 N ATOM 3928 CA ALA B 133 5.679 7.873 8.595 1.00 53.01 C ATOM 3929 C ALA B 133 5.770 6.652 9.511 1.00 72.23 C ATOM 3930 O ALA B 133 6.427 5.648 9.191 1.00 0.23 O ATOM 3931 CB ALA B 133 5.521 7.443 7.140 1.00 11.23 C ATOM 0 H ALA B 133 7.641 8.477 8.168 1.00 53.04 H new ATOM 0 HA ALA B 133 4.797 8.437 8.899 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.654 6.789 7.046 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.380 8.324 6.514 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.415 6.909 6.819 1.00 11.23 H new ATOM 3937 N VAL B 134 5.107 6.756 10.656 1.00 34.41 N ATOM 3938 CA VAL B 134 5.040 5.666 11.617 1.00 31.34 C ATOM 3939 C VAL B 134 3.591 5.272 11.914 1.00 33.12 C ATOM 3940 O VAL B 134 2.813 6.061 12.454 1.00 12.15 O ATOM 3941 CB VAL B 134 5.755 6.026 12.942 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.527 4.941 13.987 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.249 6.233 12.709 1.00 5.41 C ATOM 0 H VAL B 134 4.603 7.595 10.942 1.00 34.41 H new ATOM 0 HA VAL B 134 5.553 4.819 11.162 1.00 31.34 H new ATOM 0 HB VAL B 134 5.331 6.959 13.314 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.038 5.213 14.911 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.459 4.839 14.179 1.00 61.10 H new ATOM 0 HG13 VAL B 134 5.921 3.994 13.620 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.733 6.485 13.653 1.00 5.41 H new ATOM 0 HG22 VAL B 134 7.685 5.317 12.311 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.397 7.045 11.997 1.00 5.41 H new ATOM 3953 N ARG B 135 3.247 4.046 11.540 1.00 11.21 N ATOM 3954 CA ARG B 135 1.956 3.449 11.864 1.00 24.23 C ATOM 3955 C ARG B 135 2.004 2.880 13.284 1.00 24.22 C ATOM 3956 O ARG B 135 2.861 2.049 13.594 1.00 54.44 O ATOM 3957 CB ARG B 135 1.637 2.335 10.851 1.00 74.32 C ATOM 3958 CG ARG B 135 1.405 2.843 9.428 1.00 34.13 C ATOM 3959 CD ARG B 135 1.542 1.731 8.387 1.00 2.43 C ATOM 3960 NE ARG B 135 0.723 0.552 8.696 1.00 1.50 N ATOM 3961 CZ ARG B 135 0.152 -0.226 7.773 1.00 23.13 C ATOM 3962 NH1 ARG B 135 0.247 0.077 6.485 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -0.518 -1.312 8.141 1.00 14.33 N ATOM 0 H ARG B 135 3.859 3.434 11.000 1.00 11.21 H new ATOM 0 HA ARG B 135 1.174 4.206 11.812 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.459 1.619 10.842 1.00 74.32 H new ATOM 0 HB3 ARG B 135 0.749 1.797 11.184 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.410 3.282 9.359 1.00 34.13 H new ATOM 0 HG3 ARG B 135 2.119 3.636 9.206 1.00 34.13 H new ATOM 0 HD2 ARG B 135 1.256 2.119 7.409 1.00 2.43 H new ATOM 0 HD3 ARG B 135 2.588 1.432 8.318 1.00 2.43 H new ATOM 0 HE ARG B 135 0.581 0.312 9.677 1.00 1.50 H new ATOM 0 HH11 ARG B 135 0.759 0.910 6.193 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -0.192 -0.523 5.786 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -0.597 -1.552 9.129 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -0.954 -1.906 7.435 1.00 14.33 H new ATOM 3977 N LEU B 136 1.107 3.343 14.149 1.00 62.51 N ATOM 3978 CA LEU B 136 1.072 2.890 15.533 1.00 72.41 C ATOM 3979 C LEU B 136 0.129 1.704 15.694 1.00 41.21 C ATOM 3980 O LEU B 136 -1.087 1.832 15.532 1.00 33.52 O ATOM 3981 CB LEU B 136 0.656 4.040 16.456 1.00 60.04 C ATOM 3982 CG LEU B 136 1.733 5.114 16.677 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.219 6.218 17.596 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.007 4.484 17.243 1.00 0.00 C ATOM 0 H LEU B 136 0.394 4.033 13.914 1.00 62.51 H new ATOM 0 HA LEU B 136 2.073 2.563 15.813 1.00 72.41 H new ATOM 0 HB2 LEU B 136 -0.232 4.517 16.041 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.373 3.626 17.424 1.00 60.04 H new ATOM 0 HG LEU B 136 1.971 5.564 15.713 1.00 34.22 H new ATOM 0 HD11 LEU B 136 1.999 6.966 17.737 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.343 6.687 17.147 1.00 41.31 H new ATOM 0 HD13 LEU B 136 0.947 5.791 18.561 1.00 41.31 H new ATOM 0 HD21 LEU B 136 3.760 5.258 17.394 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.783 4.005 18.196 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.387 3.740 16.543 1.00 0.00 H new ATOM 3996 N VAL B 137 0.709 0.552 16.011 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.044 -0.684 16.189 1.00 61.13 C ATOM 3998 C VAL B 137 0.106 -1.199 17.625 1.00 31.22 C ATOM 3999 O VAL B 137 1.194 -1.562 18.065 1.00 63.04 O ATOM 4000 CB VAL B 137 0.394 -1.763 15.151 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.887 -1.652 14.836 1.00 20.11 C ATOM 4002 CG2 VAL B 137 0.056 -3.174 15.640 1.00 5.14 C ATOM 0 H VAL B 137 1.714 0.449 16.152 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.099 -0.472 16.013 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.165 -1.578 14.234 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.163 -2.416 14.110 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.099 -0.666 14.423 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.463 -1.795 15.750 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.374 -3.903 14.895 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.573 -3.367 16.580 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.020 -3.258 15.794 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.000 -1.199 18.357 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.017 -1.644 19.746 1.00 24.22 C ATOM 4014 C VAL B 138 -1.519 -3.081 19.832 1.00 70.52 C ATOM 4015 O VAL B 138 -2.437 -3.478 19.110 1.00 62.24 O ATOM 4016 CB VAL B 138 -1.875 -0.734 20.660 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.550 0.737 20.424 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.355 -1.014 20.471 1.00 0.20 C ATOM 0 H VAL B 138 -1.908 -0.892 18.007 1.00 51.04 H new ATOM 0 HA VAL B 138 0.010 -1.585 20.106 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.627 -0.964 21.696 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.166 1.355 21.078 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.497 0.916 20.641 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.755 0.993 19.384 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -3.935 -0.362 21.124 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.631 -0.827 19.433 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.563 -2.055 20.720 1.00 0.20 H new ATOM 4028 N ALA B 139 -0.871 -3.856 20.674 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.150 -5.285 20.799 1.00 52.34 C ATOM 4030 C ALA B 139 -2.545 -5.530 21.384 1.00 22.31 C ATOM 4031 O ALA B 139 -3.442 -5.961 20.625 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.080 -5.961 21.647 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.740 -5.284 22.592 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.134 -3.521 21.295 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.130 -5.723 19.801 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.301 -7.025 21.731 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.894 -5.829 21.177 1.00 71.35 H new ATOM 0 HB3 ALA B 139 -0.067 -5.513 22.641 1.00 71.35 H new