USER MOD reduce.3.24.130724 H: found=0, std=0, add=2018, rem=0, adj=66 USER MOD reduce.3.24.130724 removed 2016 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 126 ASN : amide:sc= 0.871 K(o=-0.52,f=-3.1) USER MOD Set 1.2: B 130 ASN : amide:sc= -1.39 K(o=-0.52,f=-2.1) USER MOD Set 2.1: B 54 TYR OH : rot -141:sc= 1.05 USER MOD Set 2.2: B 119 HIS :FLIP no HE2:sc= -1.09! F(o=-7.2,f=-3.9!) USER MOD Set 2.3: B 122 CYS SG : rot -76:sc= -3.91! USER MOD Set 3.1: A 10 THR OG1 : rot 86:sc= 0.189 USER MOD Set 3.2: B 80 THR OG1 : rot 180:sc= 0.685 USER MOD Set 4.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 78 THR OG1 : rot 180:sc= -0.32 USER MOD Set 5.1: B 57 CYS SG : rot -141:sc= -2.18! USER MOD Set 5.2: B 124 TYR OH : rot -179:sc= 0.416 USER MOD Set 6.1: A 131 ASN : amide:sc= -2.57! C(o=-2.3!,f=-4.7!) USER MOD Set 6.2: B 125 SER OG : rot 120:sc= 0.298 USER MOD Set 7.1: A 125 SER OG : rot 180:sc= -0.0165 USER MOD Set 7.2: A 126 ASN : amide:sc= 0.239 K(o=0.7,f=-4.6!) USER MOD Set 7.3: B 131 ASN : amide:sc= 0.473 K(o=0.7,f=-1.9!) USER MOD Set 8.1: A 57 CYS SG : rot 76:sc= -2.82! USER MOD Set 8.2: A 124 TYR OH : rot -108:sc= 0.0807 USER MOD Set 9.1: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 9.2: B 10 THR OG1 : rot 180:sc= -0.759 USER MOD Set10.1: A 54 TYR OH : rot -34:sc= 1.58 USER MOD Set10.2: A 119 HIS : no HD1:sc= -1.32 K(o=1.6,f=-4.4!) USER MOD Set10.3: A 128 THR OG1 : rot -129:sc= 1.3 USER MOD Set11.1: A 45 ASN :FLIP amide:sc= -2.47! C(o=-6.2!,f=-4.5!) USER MOD Set11.2: A 48 GLN : amide:sc= -0.303 K(o=-4.5,f=-7.6) USER MOD Set11.3: B 7 THR OG1 : rot -88:sc= 0.402 USER MOD Set11.4: B 21 SER OG : rot 46:sc= -2.18! USER MOD Set12.1: A 11 SER OG : rot 34:sc= 1.57 USER MOD Set12.2: B 55 SER OG : rot -96:sc= 0.706 USER MOD Set13.1: A 5 TYR OH : rot 180:sc= 0 USER MOD Set13.2: A 7 THR OG1 : rot 26:sc= 1.76 USER MOD Set13.3: A 25 LYS NZ :NH3+ -176:sc= 2.37 (180deg=-0.0568) USER MOD Set13.4: B 45 ASN : amide:sc= 1.66 K(o=5.8,f=-5.9!) USER MOD Single : A 1 MET CE :methyl 160:sc= -2.38 (180deg=-3.73) USER MOD Single : A 1 MET N :NH3+ -124:sc= 0.1 (180deg=0) USER MOD Single : A 2 ASN :FLIP amide:sc= -0.0123 F(o=-2.1!,f=-0.012) USER MOD Single : A 6 LYS NZ :NH3+ 175:sc= 2.38 (180deg=2.25) USER MOD Single : A 20 THR OG1 : rot -114:sc= 0.669 USER MOD Single : A 21 SER OG : rot 26:sc= -0.529 USER MOD Single : A 22 HIS : no HD1:sc= -0.0358 X(o=-0.036,f=-0.041) USER MOD Single : A 24 GLN : amide:sc= 0.141 X(o=0.14,f=-0.12) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= -0.0896 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 75:sc= -0.474 USER MOD Single : A 60 SER OG : rot 113:sc= 0.265 USER MOD Single : A 62 MET CE :methyl -140:sc= -1.17 (180deg=-4.02!) USER MOD Single : A 63 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0315) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0.067) USER MOD Single : A 69 ASN : amide:sc= -0.556 X(o=-0.56,f=-0.27) USER MOD Single : A 70 LYS NZ :NH3+ 145:sc= 0.707 (180deg=0.155) USER MOD Single : A 71 GLN :FLIP amide:sc= 0 F(o=-0.83,f=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 48:sc= -0.0391 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.492 USER MOD Single : A 88 ASN : amide:sc= -0.377 K(o=-0.38,f=-11!) USER MOD Single : A 112 LYS NZ :NH3+ -174:sc=-0.00214 (180deg=-0.0612) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HD1:sc= -0.346 X(o=-0.35,f=0) USER MOD Single : A 122 CYS SG : rot -54:sc= -4.32 USER MOD Single : A 130 ASN : amide:sc= -1.91 K(o=-1.9,f=-2.5!) USER MOD Single : B 1 MET CE :methyl -154:sc= -0.552 (180deg=-2.18) USER MOD Single : B 1 MET N :NH3+ 129:sc= 0.0943 (180deg=-0.101) USER MOD Single : B 2 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : B 5 TYR OH : rot 180:sc=-0.00878 USER MOD Single : B 6 LYS NZ :NH3+ -156:sc= 1.27 (180deg=1.21) USER MOD Single : B 11 SER OG : rot -170:sc=-0.00928 USER MOD Single : B 12 THR OG1 : rot -140:sc= -0.152 USER MOD Single : B 20 THR OG1 : rot -133:sc= 0.937 USER MOD Single : B 22 HIS : no HE2:sc= 0.302 K(o=0.3,f=-1.2) USER MOD Single : B 24 GLN : amide:sc= 0.371 K(o=0.37,f=-0.13) USER MOD Single : B 25 LYS NZ :NH3+ -173:sc= 1.21 (180deg=1.02) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot -6:sc= -1.29! USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -3.55! C(o=-3.6!,f=-4.2!) USER MOD Single : B 60 SER OG : rot -103:sc= 0.424 USER MOD Single : B 62 MET CE :methyl -138:sc= -1.25 (180deg=-4.54!) USER MOD Single : B 63 LYS NZ :NH3+ -177:sc=-0.00464 (180deg=-0.234) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0.099) USER MOD Single : B 69 ASN :FLIP amide:sc= -0.0967 F(o=-2.6!,f=-0.097) USER MOD Single : B 70 LYS NZ :NH3+ 146:sc= 0.211 (180deg=0.00265) USER MOD Single : B 71 GLN :FLIP amide:sc= -0.217 F(o=-1.5,f=-0.22) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 36:sc= 1.06 USER MOD Single : B 88 ASN : amide:sc= -0.109 K(o=-0.11,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc=-0.00144 X(o=-0.0014,f=-0.33) USER MOD Single : B 128 THR OG1 : rot -41:sc= 0.171 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.152 0.641 3.218 1.00 60.05 N ATOM 2 CA MET A 1 2.293 1.159 1.834 1.00 3.23 C ATOM 3 C MET A 1 2.993 0.125 0.947 1.00 42.13 C ATOM 4 O MET A 1 3.245 -1.002 1.378 1.00 30.31 O ATOM 5 CB MET A 1 3.095 2.460 1.821 1.00 13.52 C ATOM 6 CG MET A 1 4.556 2.240 2.126 1.00 60.32 C ATOM 7 SD MET A 1 5.563 3.713 1.896 1.00 71.43 S ATOM 8 CE MET A 1 7.191 2.971 1.869 1.00 20.11 C ATOM 0 H1 MET A 1 1.150 0.664 3.497 1.00 60.05 H new ATOM 0 H2 MET A 1 2.501 -0.338 3.260 1.00 60.05 H new ATOM 0 H3 MET A 1 2.706 1.234 3.869 1.00 60.05 H new ATOM 0 HA MET A 1 1.293 1.354 1.445 1.00 3.23 H new ATOM 0 HB2 MET A 1 2.998 2.933 0.844 1.00 13.52 H new ATOM 0 HB3 MET A 1 2.674 3.150 2.552 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.657 1.897 3.156 1.00 60.32 H new ATOM 0 HG3 MET A 1 4.937 1.444 1.486 1.00 60.32 H new ATOM 0 HE1 MET A 1 7.894 3.654 1.392 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.516 2.770 2.890 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.156 2.037 1.309 1.00 20.11 H new ATOM 20 N ASN A 2 3.325 0.525 -0.282 1.00 22.52 N ATOM 21 CA ASN A 2 4.046 -0.336 -1.221 1.00 14.33 C ATOM 22 C ASN A 2 5.517 -0.484 -0.805 1.00 22.14 C ATOM 23 O ASN A 2 6.407 0.166 -1.355 1.00 72.55 O ATOM 24 CB ASN A 2 3.940 0.230 -2.647 1.00 31.34 C ATOM 25 CG ASN A 2 4.619 -0.620 -3.683 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.735 -0.149 -4.158 1.00 52.13 O flip ATOM 27 ND2 ASN A 2 4.108 -1.662 -4.094 1.00 35.23 N flip ATOM 0 H ASN A 2 3.103 1.449 -0.653 1.00 22.52 H new ATOM 0 HA ASN A 2 3.590 -1.326 -1.204 1.00 14.33 H new ATOM 0 HB2 ASN A 2 2.887 0.337 -2.909 1.00 31.34 H new ATOM 0 HB3 ASN A 2 4.376 1.229 -2.666 1.00 31.34 H new ATOM 0 HD21 ASN A 2 3.231 -1.993 -3.691 1.00 35.23 H new ATOM 0 HD22 ASN A 2 4.561 -2.194 -4.837 1.00 35.23 H new ATOM 34 N ILE A 3 5.744 -1.293 0.222 1.00 0.23 N ATOM 35 CA ILE A 3 7.082 -1.604 0.711 1.00 51.02 C ATOM 36 C ILE A 3 7.804 -2.590 -0.207 1.00 3.13 C ATOM 37 O ILE A 3 7.197 -3.515 -0.751 1.00 22.24 O ATOM 38 CB ILE A 3 7.006 -2.214 2.135 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.343 -1.228 3.105 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.389 -2.618 2.637 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.202 -0.028 3.431 1.00 23.10 C ATOM 0 H ILE A 3 4.999 -1.756 0.743 1.00 0.23 H new ATOM 0 HA ILE A 3 7.642 -0.669 0.731 1.00 51.02 H new ATOM 0 HB ILE A 3 6.395 -3.115 2.084 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.403 -0.885 2.674 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.098 -1.751 4.030 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.303 -3.042 3.637 1.00 24.42 H new ATOM 0 HG22 ILE A 3 8.818 -3.360 1.964 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.035 -1.741 2.669 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.668 0.625 4.122 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.132 -0.361 3.892 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.426 0.519 2.515 1.00 23.10 H new ATOM 53 N LEU A 4 9.102 -2.374 -0.373 1.00 41.13 N ATOM 54 CA LEU A 4 9.973 -3.309 -1.076 1.00 42.04 C ATOM 55 C LEU A 4 10.635 -4.256 -0.079 1.00 41.22 C ATOM 56 O LEU A 4 10.668 -5.472 -0.286 1.00 74.21 O ATOM 57 CB LEU A 4 11.053 -2.556 -1.857 1.00 22.30 C ATOM 58 CG LEU A 4 10.535 -1.576 -2.914 1.00 5.11 C ATOM 59 CD1 LEU A 4 11.697 -0.840 -3.576 1.00 73.22 C ATOM 60 CD2 LEU A 4 9.683 -2.299 -3.956 1.00 52.13 C ATOM 0 H LEU A 4 9.582 -1.545 -0.024 1.00 41.13 H new ATOM 0 HA LEU A 4 9.366 -3.883 -1.776 1.00 42.04 H new ATOM 0 HB2 LEU A 4 11.673 -2.006 -1.149 1.00 22.30 H new ATOM 0 HB3 LEU A 4 11.698 -3.285 -2.347 1.00 22.30 H new ATOM 0 HG LEU A 4 9.903 -0.840 -2.417 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.310 -0.148 -4.324 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.253 -0.284 -2.821 1.00 73.22 H new ATOM 0 HD13 LEU A 4 12.358 -1.561 -4.056 1.00 73.22 H new ATOM 0 HD21 LEU A 4 9.327 -1.582 -4.696 1.00 52.13 H new ATOM 0 HD22 LEU A 4 10.283 -3.063 -4.451 1.00 52.13 H new ATOM 0 HD23 LEU A 4 8.830 -2.769 -3.466 1.00 52.13 H new ATOM 72 N TYR A 5 11.162 -3.693 1.009 1.00 24.01 N ATOM 73 CA TYR A 5 11.844 -4.490 2.028 1.00 4.44 C ATOM 74 C TYR A 5 11.436 -4.021 3.419 1.00 12.52 C ATOM 75 O TYR A 5 11.441 -2.830 3.698 1.00 21.34 O ATOM 76 CB TYR A 5 13.369 -4.391 1.862 1.00 54.43 C ATOM 77 CG TYR A 5 14.161 -5.270 2.822 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.511 -4.816 4.093 1.00 4.50 C ATOM 79 CD2 TYR A 5 14.564 -6.553 2.457 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.234 -5.609 4.965 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.286 -7.352 3.325 1.00 4.33 C ATOM 82 CZ TYR A 5 15.619 -6.877 4.577 1.00 33.20 C ATOM 83 OH TYR A 5 16.340 -7.672 5.446 1.00 31.30 O ATOM 0 H TYR A 5 11.130 -2.693 1.206 1.00 24.01 H new ATOM 0 HA TYR A 5 11.551 -5.533 1.905 1.00 4.44 H new ATOM 0 HB2 TYR A 5 13.630 -4.663 0.839 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.672 -3.354 2.003 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.212 -3.826 4.402 1.00 4.50 H new ATOM 0 HD2 TYR A 5 14.308 -6.931 1.478 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.496 -5.238 5.945 1.00 2.54 H new ATOM 0 HE2 TYR A 5 15.588 -8.344 3.024 1.00 4.33 H new ATOM 0 HH TYR A 5 16.530 -8.534 5.020 1.00 31.30 H new ATOM 93 N LYS A 6 11.080 -4.962 4.279 1.00 51.40 N ATOM 94 CA LYS A 6 10.680 -4.656 5.653 1.00 43.32 C ATOM 95 C LYS A 6 11.286 -5.668 6.622 1.00 62.42 C ATOM 96 O LYS A 6 11.274 -6.874 6.362 1.00 13.53 O ATOM 97 CB LYS A 6 9.142 -4.624 5.780 1.00 1.54 C ATOM 98 CG LYS A 6 8.638 -4.497 7.220 1.00 51.03 C ATOM 99 CD LYS A 6 7.168 -4.075 7.296 1.00 30.33 C ATOM 100 CE LYS A 6 6.975 -2.599 6.953 1.00 61.32 C ATOM 101 NZ LYS A 6 5.554 -2.175 7.077 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.058 -5.956 4.051 1.00 51.40 H new ATOM 0 HA LYS A 6 11.059 -3.667 5.911 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.757 -3.788 5.196 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.733 -5.534 5.342 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.765 -5.452 7.731 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.249 -3.768 7.752 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.580 -4.686 6.611 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.788 -4.266 8.300 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.593 -1.990 7.613 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.320 -2.416 5.935 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.482 -1.150 6.918 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.979 -2.676 6.370 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.206 -2.402 8.030 1.00 4.41 H new ATOM 115 N THR A 7 11.823 -5.165 7.730 1.00 30.21 N ATOM 116 CA THR A 7 12.475 -5.992 8.736 1.00 33.22 C ATOM 117 C THR A 7 11.974 -5.608 10.132 1.00 54.23 C ATOM 118 O THR A 7 11.696 -4.431 10.402 1.00 73.02 O ATOM 119 CB THR A 7 14.017 -5.841 8.648 1.00 43.13 C ATOM 120 OG1 THR A 7 14.673 -6.702 9.591 1.00 11.53 O ATOM 121 CG2 THR A 7 14.449 -4.396 8.883 1.00 62.33 C ATOM 0 H THR A 7 11.817 -4.170 7.954 1.00 30.21 H new ATOM 0 HA THR A 7 12.225 -7.036 8.549 1.00 33.22 H new ATOM 0 HB THR A 7 14.312 -6.131 7.640 1.00 43.13 H new ATOM 0 HG1 THR A 7 14.094 -7.466 9.794 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.535 -4.325 8.815 1.00 62.33 H new ATOM 0 HG22 THR A 7 13.995 -3.753 8.129 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.126 -4.076 9.874 1.00 62.33 H new ATOM 129 N ALA A 8 11.842 -6.602 11.008 1.00 51.42 N ATOM 130 CA ALA A 8 11.272 -6.392 12.336 1.00 62.45 C ATOM 131 C ALA A 8 12.319 -6.552 13.432 1.00 64.34 C ATOM 132 O ALA A 8 13.292 -7.302 13.288 1.00 4.53 O ATOM 133 CB ALA A 8 10.122 -7.362 12.570 1.00 11.23 C ATOM 0 H ALA A 8 12.123 -7.564 10.820 1.00 51.42 H new ATOM 0 HA ALA A 8 10.900 -5.368 12.378 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.704 -7.198 13.563 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.349 -7.198 11.819 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.489 -8.386 12.496 1.00 11.23 H new ATOM 139 N ALA A 9 12.103 -5.847 14.534 1.00 62.04 N ATOM 140 CA ALA A 9 12.966 -5.937 15.698 1.00 13.24 C ATOM 141 C ALA A 9 12.170 -5.634 16.960 1.00 53.42 C ATOM 142 O ALA A 9 11.631 -4.540 17.121 1.00 45.34 O ATOM 143 CB ALA A 9 14.154 -4.994 15.554 1.00 65.14 C ATOM 0 H ALA A 9 11.324 -5.198 14.644 1.00 62.04 H new ATOM 0 HA ALA A 9 13.355 -6.952 15.776 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.791 -5.074 16.435 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.727 -5.263 14.667 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.795 -3.969 15.457 1.00 65.14 H new ATOM 149 N THR A 10 12.090 -6.618 17.842 1.00 61.23 N ATOM 150 CA THR A 10 11.326 -6.508 19.068 1.00 51.35 C ATOM 151 C THR A 10 12.267 -6.198 20.231 1.00 43.21 C ATOM 152 O THR A 10 13.336 -6.798 20.355 1.00 73.43 O ATOM 153 CB THR A 10 10.521 -7.811 19.328 1.00 34.35 C ATOM 154 OG1 THR A 10 9.573 -7.615 20.383 1.00 3.15 O ATOM 155 CG2 THR A 10 11.436 -8.984 19.669 1.00 70.40 C ATOM 0 H THR A 10 12.556 -7.518 17.724 1.00 61.23 H new ATOM 0 HA THR A 10 10.609 -5.692 18.974 1.00 51.35 H new ATOM 0 HB THR A 10 9.991 -8.052 18.406 1.00 34.35 H new ATOM 0 HG1 THR A 10 8.747 -7.236 20.015 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.834 -9.876 19.844 1.00 70.40 H new ATOM 0 HG22 THR A 10 12.120 -9.165 18.840 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.008 -8.750 20.567 1.00 70.40 H new ATOM 163 N SER A 11 11.892 -5.229 21.049 1.00 71.32 N ATOM 164 CA SER A 11 12.723 -4.796 22.164 1.00 2.43 C ATOM 165 C SER A 11 12.012 -5.044 23.491 1.00 11.12 C ATOM 166 O SER A 11 10.989 -4.421 23.786 1.00 53.54 O ATOM 167 CB SER A 11 13.059 -3.310 21.997 1.00 22.21 C ATOM 168 OG SER A 11 11.885 -2.521 21.935 1.00 52.01 O ATOM 0 H SER A 11 11.011 -4.723 20.962 1.00 71.32 H new ATOM 0 HA SER A 11 13.648 -5.373 22.169 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.678 -2.979 22.831 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.644 -3.167 21.089 1.00 22.21 H new ATOM 0 HG SER A 11 11.194 -2.917 22.506 1.00 52.01 H new ATOM 174 N THR A 12 12.557 -5.960 24.285 1.00 54.12 N ATOM 175 CA THR A 12 11.965 -6.327 25.570 1.00 52.53 C ATOM 176 C THR A 12 12.517 -5.460 26.701 1.00 72.12 C ATOM 177 O THR A 12 13.598 -4.877 26.580 1.00 13.04 O ATOM 178 CB THR A 12 12.252 -7.808 25.895 1.00 35.03 C ATOM 179 OG1 THR A 12 12.064 -8.605 24.717 1.00 61.53 O ATOM 180 CG2 THR A 12 11.336 -8.321 27.004 1.00 33.34 C ATOM 0 H THR A 12 13.414 -6.466 24.060 1.00 54.12 H new ATOM 0 HA THR A 12 10.890 -6.167 25.489 1.00 52.53 H new ATOM 0 HB THR A 12 13.284 -7.885 26.239 1.00 35.03 H new ATOM 0 HG1 THR A 12 12.248 -9.545 24.925 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.564 -9.367 27.209 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.493 -7.732 27.907 1.00 33.34 H new ATOM 0 HG23 THR A 12 10.297 -8.231 26.688 1.00 33.34 H new ATOM 188 N GLY A 13 11.772 -5.378 27.797 1.00 62.44 N ATOM 189 CA GLY A 13 12.237 -4.659 28.963 1.00 34.44 C ATOM 190 C GLY A 13 13.142 -5.510 29.834 1.00 13.14 C ATOM 191 O GLY A 13 12.730 -5.973 30.896 1.00 50.55 O ATOM 0 H GLY A 13 10.849 -5.800 27.897 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.775 -3.765 28.647 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.380 -4.325 29.548 1.00 34.44 H new ATOM 195 N GLY A 14 14.369 -5.731 29.366 1.00 62.02 N ATOM 196 CA GLY A 14 15.343 -6.503 30.127 1.00 43.32 C ATOM 197 C GLY A 14 15.845 -5.757 31.352 1.00 33.13 C ATOM 198 O GLY A 14 15.053 -5.357 32.206 1.00 44.52 O ATOM 0 H GLY A 14 14.709 -5.387 28.468 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.892 -7.445 30.438 1.00 43.32 H new ATOM 0 HA3 GLY A 14 16.188 -6.751 29.485 1.00 43.32 H new ATOM 202 N ARG A 15 17.164 -5.569 31.453 1.00 24.13 N ATOM 203 CA ARG A 15 17.730 -4.773 32.541 1.00 34.21 C ATOM 204 C ARG A 15 17.193 -3.353 32.440 1.00 4.22 C ATOM 205 O ARG A 15 16.611 -2.819 33.384 1.00 73.04 O ATOM 206 CB ARG A 15 19.265 -4.761 32.483 1.00 34.44 C ATOM 207 CG ARG A 15 19.924 -4.025 33.652 1.00 1.44 C ATOM 208 CD ARG A 15 19.945 -4.857 34.938 1.00 44.04 C ATOM 209 NE ARG A 15 18.616 -5.348 35.325 1.00 64.51 N ATOM 210 CZ ARG A 15 18.016 -5.071 36.484 1.00 22.54 C ATOM 211 NH1 ARG A 15 18.597 -4.278 37.376 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 16.824 -5.589 36.743 1.00 44.23 N ATOM 0 H ARG A 15 17.850 -5.952 30.803 1.00 24.13 H new ATOM 0 HA ARG A 15 17.439 -5.218 33.493 1.00 34.21 H new ATOM 0 HB2 ARG A 15 19.626 -5.789 32.464 1.00 34.44 H new ATOM 0 HB3 ARG A 15 19.580 -4.295 31.549 1.00 34.44 H new ATOM 0 HG2 ARG A 15 20.945 -3.759 33.379 1.00 1.44 H new ATOM 0 HG3 ARG A 15 19.390 -3.093 33.836 1.00 1.44 H new ATOM 0 HD2 ARG A 15 20.615 -5.706 34.804 1.00 44.04 H new ATOM 0 HD3 ARG A 15 20.353 -4.253 35.748 1.00 44.04 H new ATOM 0 HE ARG A 15 18.117 -5.942 34.662 1.00 64.51 H new ATOM 0 HH11 ARG A 15 19.512 -3.873 37.179 1.00 12.40 H new ATOM 0 HH12 ARG A 15 18.128 -4.074 38.259 1.00 12.40 H new ATOM 0 HH21 ARG A 15 16.372 -6.195 36.058 1.00 44.23 H new ATOM 0 HH22 ARG A 15 16.359 -5.382 37.627 1.00 44.23 H new ATOM 226 N ASP A 16 17.391 -2.756 31.272 1.00 4.14 N ATOM 227 CA ASP A 16 16.709 -1.519 30.921 1.00 22.02 C ATOM 228 C ASP A 16 15.997 -1.716 29.603 1.00 52.02 C ATOM 229 O ASP A 16 14.838 -1.325 29.446 1.00 74.22 O ATOM 230 CB ASP A 16 17.686 -0.356 30.795 1.00 50.13 C ATOM 231 CG ASP A 16 16.984 0.973 30.522 1.00 53.42 C ATOM 232 OD1 ASP A 16 15.864 1.182 31.050 1.00 45.04 O ATOM 233 OD2 ASP A 16 17.554 1.809 29.789 1.00 61.02 O1- ATOM 0 H ASP A 16 18.020 -3.110 30.551 1.00 4.14 H new ATOM 0 HA ASP A 16 16.000 -1.278 31.713 1.00 22.02 H new ATOM 0 HB2 ASP A 16 18.268 -0.274 31.713 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.390 -0.563 29.989 1.00 50.13 H new ATOM 238 N GLY A 17 16.674 -2.369 28.663 1.00 73.12 N ATOM 239 CA GLY A 17 16.023 -2.719 27.428 1.00 31.14 C ATOM 240 C GLY A 17 16.756 -3.800 26.688 1.00 63.12 C ATOM 241 O GLY A 17 17.892 -4.140 27.023 1.00 34.35 O ATOM 0 H GLY A 17 17.650 -2.656 28.739 1.00 73.12 H new ATOM 0 HA2 GLY A 17 15.005 -3.049 27.636 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.948 -1.835 26.795 1.00 31.14 H new ATOM 245 N ARG A 18 16.094 -4.358 25.703 1.00 71.41 N ATOM 246 CA ARG A 18 16.695 -5.313 24.795 1.00 64.41 C ATOM 247 C ARG A 18 16.386 -4.911 23.374 1.00 2.04 C ATOM 248 O ARG A 18 15.607 -3.991 23.140 1.00 73.24 O ATOM 249 CB ARG A 18 16.194 -6.742 25.052 1.00 30.54 C ATOM 250 CG ARG A 18 16.807 -7.400 26.284 1.00 21.30 C ATOM 251 CD ARG A 18 17.071 -8.884 26.050 1.00 2.42 C ATOM 252 NE ARG A 18 15.836 -9.667 25.921 1.00 61.43 N ATOM 253 CZ ARG A 18 15.692 -10.700 25.084 1.00 42.21 C ATOM 254 NH1 ARG A 18 16.699 -11.065 24.296 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 14.544 -11.369 25.044 1.00 11.32 N ATOM 0 H ARG A 18 15.113 -4.162 25.505 1.00 71.41 H new ATOM 0 HA ARG A 18 17.772 -5.308 24.963 1.00 64.41 H new ATOM 0 HB2 ARG A 18 15.110 -6.722 25.165 1.00 30.54 H new ATOM 0 HB3 ARG A 18 16.412 -7.356 24.178 1.00 30.54 H new ATOM 0 HG2 ARG A 18 17.741 -6.899 26.539 1.00 21.30 H new ATOM 0 HG3 ARG A 18 16.137 -7.278 27.135 1.00 21.30 H new ATOM 0 HD2 ARG A 18 17.668 -9.004 25.146 1.00 2.42 H new ATOM 0 HD3 ARG A 18 17.661 -9.278 26.877 1.00 2.42 H new ATOM 0 HE ARG A 18 15.040 -9.408 26.504 1.00 61.43 H new ATOM 0 HH11 ARG A 18 17.583 -10.557 24.329 1.00 65.11 H new ATOM 0 HH12 ARG A 18 16.588 -11.853 23.658 1.00 65.11 H new ATOM 0 HH21 ARG A 18 13.772 -11.095 25.652 1.00 11.32 H new ATOM 0 HH22 ARG A 18 14.435 -12.157 24.405 1.00 11.32 H new ATOM 269 N ALA A 19 17.014 -5.584 22.438 1.00 71.12 N ATOM 270 CA ALA A 19 16.719 -5.401 21.033 1.00 34.25 C ATOM 271 C ALA A 19 16.962 -6.710 20.313 1.00 41.03 C ATOM 272 O ALA A 19 18.067 -7.252 20.352 1.00 12.34 O ATOM 273 CB ALA A 19 17.580 -4.286 20.444 1.00 5.35 C ATOM 0 H ALA A 19 17.742 -6.273 22.627 1.00 71.12 H new ATOM 0 HA ALA A 19 15.676 -5.108 20.910 1.00 34.25 H new ATOM 0 HB1 ALA A 19 17.344 -4.164 19.387 1.00 5.35 H new ATOM 0 HB2 ALA A 19 17.378 -3.354 20.971 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.633 -4.544 20.553 1.00 5.35 H new ATOM 279 N THR A 20 15.940 -7.203 19.643 1.00 63.53 N ATOM 280 CA THR A 20 16.022 -8.480 18.964 1.00 0.02 C ATOM 281 C THR A 20 15.406 -8.383 17.578 1.00 61.21 C ATOM 282 O THR A 20 14.193 -8.248 17.441 1.00 50.32 O ATOM 283 CB THR A 20 15.303 -9.585 19.780 1.00 22.13 C ATOM 284 OG1 THR A 20 15.800 -9.593 21.129 1.00 4.20 O ATOM 285 CG2 THR A 20 15.503 -10.964 19.152 1.00 30.30 C ATOM 0 H THR A 20 15.038 -6.735 19.554 1.00 63.53 H new ATOM 0 HA THR A 20 17.075 -8.745 18.869 1.00 0.02 H new ATOM 0 HB THR A 20 14.236 -9.364 19.779 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.278 -10.432 21.297 1.00 4.20 H new ATOM 0 HG21 THR A 20 14.986 -11.714 19.750 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.099 -10.965 18.140 1.00 30.30 H new ATOM 0 HG23 THR A 20 16.567 -11.198 19.118 1.00 30.30 H new ATOM 293 N SER A 21 16.238 -8.454 16.548 1.00 52.22 N ATOM 294 CA SER A 21 15.730 -8.447 15.193 1.00 61.23 C ATOM 295 C SER A 21 15.002 -9.752 14.992 1.00 4.01 C ATOM 296 O SER A 21 15.650 -10.810 14.885 1.00 53.51 O ATOM 297 CB SER A 21 16.841 -8.286 14.151 1.00 62.30 C ATOM 298 OG SER A 21 16.317 -8.297 12.831 1.00 0.33 O ATOM 0 H SER A 21 17.253 -8.516 16.627 1.00 52.22 H new ATOM 0 HA SER A 21 15.067 -7.593 15.056 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.373 -7.351 14.325 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.567 -9.091 14.263 1.00 62.30 H new ATOM 0 HG SER A 21 15.386 -7.992 12.846 1.00 0.33 H new ATOM 304 N HIS A 22 13.664 -9.644 14.952 1.00 22.03 N ATOM 305 CA HIS A 22 12.742 -10.780 15.002 1.00 2.11 C ATOM 306 C HIS A 22 12.958 -11.729 13.836 1.00 71.44 C ATOM 307 O HIS A 22 12.510 -12.876 13.867 1.00 63.31 O ATOM 308 CB HIS A 22 11.291 -10.277 15.016 1.00 42.33 C ATOM 309 CG HIS A 22 10.266 -11.372 15.074 1.00 64.41 C ATOM 310 ND1 HIS A 22 9.256 -11.511 14.148 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.095 -12.377 15.968 1.00 33.23 C ATOM 312 CE1 HIS A 22 8.510 -12.550 14.469 1.00 21.33 C ATOM 313 NE2 HIS A 22 8.997 -13.094 15.569 1.00 41.54 N ATOM 0 H HIS A 22 13.188 -8.745 14.883 1.00 22.03 H new ATOM 0 HA HIS A 22 12.942 -11.334 15.919 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.154 -9.619 15.874 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.117 -9.677 14.123 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.710 -12.576 16.834 1.00 33.23 H new ATOM 0 HE1 HIS A 22 7.645 -12.898 13.923 1.00 21.33 H new ATOM 0 HE2 HIS A 22 8.618 -13.913 16.044 1.00 41.54 H new ATOM 322 N ASP A 23 13.681 -11.262 12.830 1.00 65.30 N ATOM 323 CA ASP A 23 14.045 -12.109 11.698 1.00 52.23 C ATOM 324 C ASP A 23 15.243 -12.974 12.085 1.00 2.53 C ATOM 325 O ASP A 23 15.890 -13.586 11.233 1.00 21.54 O ATOM 326 CB ASP A 23 14.393 -11.252 10.473 1.00 41.44 C ATOM 327 CG ASP A 23 13.288 -10.272 10.100 1.00 73.43 C ATOM 328 OD1 ASP A 23 13.375 -9.088 10.497 1.00 71.33 O ATOM 329 OD2 ASP A 23 12.328 -10.679 9.413 1.00 13.13 O1- ATOM 0 H ASP A 23 14.028 -10.305 12.771 1.00 65.30 H new ATOM 0 HA ASP A 23 13.198 -12.745 11.441 1.00 52.23 H new ATOM 0 HB2 ASP A 23 15.310 -10.698 10.672 1.00 41.44 H new ATOM 0 HB3 ASP A 23 14.593 -11.906 9.624 1.00 41.44 H new ATOM 334 N GLN A 24 15.523 -13.002 13.395 1.00 30.45 N ATOM 335 CA GLN A 24 16.610 -13.784 13.970 1.00 23.53 C ATOM 336 C GLN A 24 17.945 -13.245 13.480 1.00 71.34 C ATOM 337 O GLN A 24 18.932 -13.976 13.356 1.00 22.01 O ATOM 338 CB GLN A 24 16.444 -15.276 13.644 1.00 42.54 C ATOM 339 CG GLN A 24 15.108 -15.859 14.102 1.00 72.53 C ATOM 340 CD GLN A 24 14.834 -15.621 15.579 1.00 14.50 C ATOM 341 OE1 GLN A 24 15.217 -16.421 16.433 1.00 45.33 O ATOM 342 NE2 GLN A 24 14.149 -14.529 15.890 1.00 4.22 N ATOM 0 H GLN A 24 14.991 -12.474 14.087 1.00 30.45 H new ATOM 0 HA GLN A 24 16.582 -13.690 15.056 1.00 23.53 H new ATOM 0 HB2 GLN A 24 16.542 -15.417 12.568 1.00 42.54 H new ATOM 0 HB3 GLN A 24 17.254 -15.834 14.114 1.00 42.54 H new ATOM 0 HG2 GLN A 24 14.304 -15.418 13.513 1.00 72.53 H new ATOM 0 HG3 GLN A 24 15.098 -16.931 13.904 1.00 72.53 H new ATOM 0 HE21 GLN A 24 13.848 -13.889 15.155 1.00 4.22 H new ATOM 0 HE22 GLN A 24 13.923 -14.329 16.864 1.00 4.22 H new ATOM 351 N LYS A 25 17.960 -11.943 13.218 1.00 22.35 N ATOM 352 CA LYS A 25 19.160 -11.259 12.768 1.00 24.04 C ATOM 353 C LYS A 25 19.854 -10.563 13.934 1.00 45.31 C ATOM 354 O LYS A 25 21.038 -10.234 13.837 1.00 73.44 O ATOM 355 CB LYS A 25 18.829 -10.245 11.656 1.00 30.31 C ATOM 356 CG LYS A 25 18.288 -10.894 10.384 1.00 12.14 C ATOM 357 CD LYS A 25 18.089 -9.888 9.247 1.00 61.23 C ATOM 358 CE LYS A 25 17.068 -8.807 9.593 1.00 52.51 C ATOM 359 NZ LYS A 25 16.708 -7.981 8.408 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.144 -11.338 13.312 1.00 22.35 H new ATOM 0 HA LYS A 25 19.840 -12.006 12.359 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.095 -9.532 12.032 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.728 -9.679 11.412 1.00 30.31 H new ATOM 0 HG2 LYS A 25 18.976 -11.674 10.058 1.00 12.14 H new ATOM 0 HG3 LYS A 25 17.337 -11.380 10.605 1.00 12.14 H new ATOM 0 HD2 LYS A 25 19.044 -9.419 9.011 1.00 61.23 H new ATOM 0 HD3 LYS A 25 17.763 -10.417 8.351 1.00 61.23 H new ATOM 0 HE2 LYS A 25 16.169 -9.273 9.997 1.00 52.51 H new ATOM 0 HE3 LYS A 25 17.472 -8.163 10.374 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 16.065 -7.217 8.700 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 17.570 -7.570 7.997 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 16.237 -8.578 7.699 1.00 22.01 H new ATOM 373 N LEU A 26 19.134 -10.327 15.042 1.00 32.33 N ATOM 374 CA LEU A 26 19.763 -9.679 16.202 1.00 24.31 C ATOM 375 C LEU A 26 19.088 -10.076 17.510 1.00 21.31 C ATOM 376 O LEU A 26 17.889 -10.313 17.533 1.00 11.34 O ATOM 377 CB LEU A 26 19.707 -8.155 16.027 1.00 35.55 C ATOM 378 CG LEU A 26 20.130 -7.323 17.246 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.615 -7.508 17.554 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.793 -5.856 17.016 1.00 74.42 C ATOM 0 H LEU A 26 18.149 -10.566 15.159 1.00 32.33 H new ATOM 0 HA LEU A 26 20.800 -10.012 16.254 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.345 -7.882 15.186 1.00 35.55 H new ATOM 0 HB3 LEU A 26 18.688 -7.877 15.758 1.00 35.55 H new ATOM 0 HG LEU A 26 19.574 -7.674 18.115 1.00 2.25 H new ATOM 0 HD11 LEU A 26 21.884 -6.906 18.422 1.00 31.22 H new ATOM 0 HD12 LEU A 26 21.815 -8.559 17.765 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.207 -7.191 16.695 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.096 -5.272 17.885 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.322 -5.495 16.134 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.719 -5.749 16.864 1.00 74.42 H new ATOM 392 N ASP A 27 19.877 -10.130 18.591 1.00 3.11 N ATOM 393 CA ASP A 27 19.361 -10.377 19.943 1.00 12.11 C ATOM 394 C ASP A 27 20.369 -9.889 20.990 1.00 11.44 C ATOM 395 O ASP A 27 21.367 -10.560 21.266 1.00 42.31 O ATOM 396 CB ASP A 27 19.060 -11.869 20.157 1.00 5.04 C ATOM 397 CG ASP A 27 18.522 -12.166 21.553 1.00 74.13 C ATOM 398 OD1 ASP A 27 17.302 -12.023 21.772 1.00 54.23 O ATOM 399 OD2 ASP A 27 19.313 -12.551 22.440 1.00 11.42 O1- ATOM 0 H ASP A 27 20.888 -10.004 18.553 1.00 3.11 H new ATOM 0 HA ASP A 27 18.429 -9.822 20.056 1.00 12.11 H new ATOM 0 HB2 ASP A 27 18.334 -12.199 19.414 1.00 5.04 H new ATOM 0 HB3 ASP A 27 19.970 -12.446 19.992 1.00 5.04 H new ATOM 404 N VAL A 28 20.119 -8.701 21.544 1.00 5.03 N ATOM 405 CA VAL A 28 21.007 -8.081 22.544 1.00 42.02 C ATOM 406 C VAL A 28 20.222 -7.278 23.578 1.00 62.12 C ATOM 407 O VAL A 28 18.997 -7.190 23.517 1.00 32.30 O ATOM 408 CB VAL A 28 22.064 -7.145 21.901 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.179 -7.953 21.251 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.408 -6.195 20.899 1.00 1.00 C ATOM 0 H VAL A 28 19.299 -8.139 21.317 1.00 5.03 H new ATOM 0 HA VAL A 28 21.517 -8.912 23.031 1.00 42.02 H new ATOM 0 HB VAL A 28 22.511 -6.540 22.690 1.00 24.24 H new ATOM 0 HG11 VAL A 28 23.908 -7.275 20.807 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.669 -8.569 22.005 1.00 34.22 H new ATOM 0 HG13 VAL A 28 22.759 -8.594 20.475 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.167 -5.548 20.460 1.00 1.00 H new ATOM 0 HG22 VAL A 28 20.925 -6.774 20.111 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.663 -5.585 21.410 1.00 1.00 H new ATOM 420 N LYS A 29 20.952 -6.716 24.538 1.00 24.10 N ATOM 421 CA LYS A 29 20.378 -5.903 25.609 1.00 44.35 C ATOM 422 C LYS A 29 21.164 -4.606 25.771 1.00 43.02 C ATOM 423 O LYS A 29 22.383 -4.584 25.599 1.00 12.55 O ATOM 424 CB LYS A 29 20.389 -6.703 26.922 1.00 13.02 C ATOM 425 CG LYS A 29 20.558 -5.865 28.194 1.00 22.53 C ATOM 426 CD LYS A 29 20.945 -6.729 29.398 1.00 24.23 C ATOM 427 CE LYS A 29 19.930 -7.837 29.668 1.00 1.41 C ATOM 428 NZ LYS A 29 20.380 -8.757 30.749 1.00 62.42 N1+ ATOM 0 H LYS A 29 21.966 -6.812 24.596 1.00 24.10 H new ATOM 0 HA LYS A 29 19.349 -5.649 25.353 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.457 -7.263 26.996 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.197 -7.434 26.877 1.00 13.02 H new ATOM 0 HG2 LYS A 29 21.323 -5.106 28.030 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.628 -5.339 28.409 1.00 22.53 H new ATOM 0 HD2 LYS A 29 21.925 -7.172 29.224 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.033 -6.097 30.282 1.00 24.23 H new ATOM 0 HE2 LYS A 29 18.974 -7.393 29.945 1.00 1.41 H new ATOM 0 HE3 LYS A 29 19.764 -8.407 28.754 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 19.661 -9.494 30.899 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 21.279 -9.202 30.475 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 20.514 -8.219 31.629 1.00 62.42 H new ATOM 442 N LEU A 30 20.461 -3.527 26.101 1.00 2.53 N ATOM 443 CA LEU A 30 21.092 -2.254 26.384 1.00 41.03 C ATOM 444 C LEU A 30 20.607 -1.699 27.729 1.00 64.12 C ATOM 445 O LEU A 30 19.558 -2.127 28.266 1.00 54.30 O ATOM 446 CB LEU A 30 20.870 -1.252 25.224 1.00 11.12 C ATOM 447 CG LEU A 30 19.444 -1.130 24.634 1.00 54.41 C ATOM 448 CD1 LEU A 30 19.055 -2.358 23.811 1.00 21.32 C ATOM 449 CD2 LEU A 30 18.421 -0.860 25.725 1.00 54.12 C ATOM 0 H LEU A 30 19.444 -3.516 26.178 1.00 2.53 H new ATOM 0 HA LEU A 30 22.168 -2.410 26.465 1.00 41.03 H new ATOM 0 HB2 LEU A 30 21.173 -0.265 25.573 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.545 -1.525 24.413 1.00 11.12 H new ATOM 0 HG LEU A 30 19.452 -0.277 23.955 1.00 54.41 H new ATOM 0 HD11 LEU A 30 18.047 -2.228 23.417 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.755 -2.478 22.984 1.00 21.32 H new ATOM 0 HD13 LEU A 30 19.085 -3.245 24.444 1.00 21.32 H new ATOM 0 HD21 LEU A 30 17.429 -0.779 25.281 1.00 54.12 H new ATOM 0 HD22 LEU A 30 18.431 -1.679 26.444 1.00 54.12 H new ATOM 0 HD23 LEU A 30 18.668 0.072 26.233 1.00 54.12 H new ATOM 461 N SER A 31 21.379 -0.758 28.271 1.00 75.34 N ATOM 462 CA SER A 31 21.114 -0.183 29.583 1.00 34.22 C ATOM 463 C SER A 31 21.756 1.198 29.704 1.00 62.41 C ATOM 464 O SER A 31 22.905 1.398 29.300 1.00 64.13 O ATOM 465 CB SER A 31 21.640 -1.110 30.693 1.00 52.23 C ATOM 466 OG SER A 31 21.027 -2.389 30.628 1.00 11.31 O ATOM 0 H SER A 31 22.205 -0.375 27.811 1.00 75.34 H new ATOM 0 HA SER A 31 20.035 -0.077 29.697 1.00 34.22 H new ATOM 0 HB2 SER A 31 22.721 -1.217 30.599 1.00 52.23 H new ATOM 0 HB3 SER A 31 21.447 -0.661 31.667 1.00 52.23 H new ATOM 0 HG SER A 31 21.381 -2.958 31.343 1.00 11.31 H new ATOM 472 N ALA A 32 21.001 2.149 30.241 1.00 52.21 N ATOM 473 CA ALA A 32 21.510 3.492 30.483 1.00 43.51 C ATOM 474 C ALA A 32 22.356 3.515 31.760 1.00 25.12 C ATOM 475 O ALA A 32 22.011 2.860 32.747 1.00 4.30 O ATOM 476 CB ALA A 32 20.353 4.482 30.588 1.00 22.44 C ATOM 0 H ALA A 32 20.029 2.013 30.518 1.00 52.21 H new ATOM 0 HA ALA A 32 22.142 3.786 29.645 1.00 43.51 H new ATOM 0 HB1 ALA A 32 20.746 5.483 30.769 1.00 22.44 H new ATOM 0 HB2 ALA A 32 19.785 4.478 29.658 1.00 22.44 H new ATOM 0 HB3 ALA A 32 19.701 4.194 31.412 1.00 22.44 H new ATOM 482 N PRO A 33 23.476 4.262 31.765 1.00 32.33 N ATOM 483 CA PRO A 33 24.341 4.371 32.945 1.00 35.40 C ATOM 484 C PRO A 33 23.621 5.074 34.094 1.00 50.42 C ATOM 485 O PRO A 33 22.758 5.926 33.869 1.00 70.53 O ATOM 486 CB PRO A 33 25.534 5.201 32.445 1.00 73.33 C ATOM 487 CG PRO A 33 25.000 5.965 31.281 1.00 10.15 C ATOM 488 CD PRO A 33 23.983 5.063 30.634 1.00 32.53 C ATOM 0 HA PRO A 33 24.640 3.400 33.341 1.00 35.40 H new ATOM 0 HB2 PRO A 33 25.905 5.870 33.222 1.00 73.33 H new ATOM 0 HB3 PRO A 33 26.366 4.562 32.151 1.00 73.33 H new ATOM 0 HG2 PRO A 33 24.544 6.901 31.603 1.00 10.15 H new ATOM 0 HG3 PRO A 33 25.796 6.222 30.582 1.00 10.15 H new ATOM 0 HD2 PRO A 33 23.187 5.632 30.155 1.00 32.53 H new ATOM 0 HD3 PRO A 33 24.433 4.435 29.865 1.00 32.53 H new ATOM 496 N ARG A 34 23.976 4.727 35.325 1.00 10.53 N ATOM 497 CA ARG A 34 23.277 5.251 36.496 1.00 33.33 C ATOM 498 C ARG A 34 23.812 6.640 36.859 1.00 40.12 C ATOM 499 O ARG A 34 23.384 7.239 37.846 1.00 0.24 O ATOM 500 CB ARG A 34 23.424 4.288 37.684 1.00 35.21 C ATOM 501 CG ARG A 34 22.295 4.402 38.706 1.00 34.41 C ATOM 502 CD ARG A 34 21.006 3.756 38.218 1.00 50.12 C ATOM 503 NE ARG A 34 19.848 4.154 39.025 1.00 3.50 N ATOM 504 CZ ARG A 34 18.786 3.376 39.261 1.00 2.33 C ATOM 505 NH1 ARG A 34 18.803 2.090 38.926 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 17.729 3.876 39.886 1.00 21.42 N ATOM 0 H ARG A 34 24.741 4.087 35.540 1.00 10.53 H new ATOM 0 HA ARG A 34 22.217 5.342 36.257 1.00 33.33 H new ATOM 0 HB2 ARG A 34 23.462 3.265 37.309 1.00 35.21 H new ATOM 0 HB3 ARG A 34 24.374 4.481 38.182 1.00 35.21 H new ATOM 0 HG2 ARG A 34 22.604 3.931 39.639 1.00 34.41 H new ATOM 0 HG3 ARG A 34 22.111 5.454 38.925 1.00 34.41 H new ATOM 0 HD2 ARG A 34 20.834 4.032 37.178 1.00 50.12 H new ATOM 0 HD3 ARG A 34 21.111 2.671 38.247 1.00 50.12 H new ATOM 0 HE ARG A 34 19.853 5.088 39.434 1.00 3.50 H new ATOM 0 HH11 ARG A 34 19.631 1.689 38.485 1.00 23.02 H new ATOM 0 HH12 ARG A 34 17.988 1.504 39.110 1.00 23.02 H new ATOM 0 HH21 ARG A 34 17.727 4.851 40.185 1.00 21.42 H new ATOM 0 HH22 ARG A 34 16.917 3.286 40.068 1.00 21.42 H new ATOM 520 N GLU A 35 24.731 7.141 36.028 1.00 72.31 N ATOM 521 CA GLU A 35 25.329 8.472 36.197 1.00 75.14 C ATOM 522 C GLU A 35 24.275 9.509 36.580 1.00 65.21 C ATOM 523 O GLU A 35 24.325 10.111 37.652 1.00 33.12 O ATOM 524 CB GLU A 35 26.007 8.906 34.886 1.00 20.34 C ATOM 525 CG GLU A 35 27.056 7.930 34.362 1.00 71.30 C ATOM 526 CD GLU A 35 28.179 7.668 35.350 1.00 31.03 C ATOM 527 OE1 GLU A 35 29.128 8.476 35.409 1.00 31.45 O ATOM 528 OE2 GLU A 35 28.122 6.644 36.065 1.00 43.03 O1- ATOM 0 H GLU A 35 25.083 6.634 35.216 1.00 72.31 H new ATOM 0 HA GLU A 35 26.064 8.410 36.999 1.00 75.14 H new ATOM 0 HB2 GLU A 35 25.241 9.040 34.123 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.477 9.877 35.039 1.00 20.34 H new ATOM 0 HG2 GLU A 35 26.572 6.985 34.114 1.00 71.30 H new ATOM 0 HG3 GLU A 35 27.479 8.324 33.438 1.00 71.30 H new ATOM 535 N LEU A 36 23.309 9.696 35.689 1.00 33.22 N ATOM 536 CA LEU A 36 22.256 10.693 35.873 1.00 32.24 C ATOM 537 C LEU A 36 21.007 10.055 36.477 1.00 55.25 C ATOM 538 O LEU A 36 19.940 10.668 36.516 1.00 40.24 O ATOM 539 CB LEU A 36 21.920 11.363 34.527 1.00 11.21 C ATOM 540 CG LEU A 36 22.924 12.429 34.030 1.00 24.22 C ATOM 541 CD1 LEU A 36 24.351 11.891 33.993 1.00 52.21 C ATOM 542 CD2 LEU A 36 22.519 12.935 32.649 1.00 63.44 C ATOM 0 H LEU A 36 23.231 9.165 34.822 1.00 33.22 H new ATOM 0 HA LEU A 36 22.617 11.454 36.564 1.00 32.24 H new ATOM 0 HB2 LEU A 36 21.840 10.586 33.767 1.00 11.21 H new ATOM 0 HB3 LEU A 36 20.938 11.829 34.611 1.00 11.21 H new ATOM 0 HG LEU A 36 22.900 13.257 34.739 1.00 24.22 H new ATOM 0 HD11 LEU A 36 25.025 12.671 33.638 1.00 52.21 H new ATOM 0 HD12 LEU A 36 24.649 11.582 34.995 1.00 52.21 H new ATOM 0 HD13 LEU A 36 24.400 11.035 33.319 1.00 52.21 H new ATOM 0 HD21 LEU A 36 23.235 13.685 32.312 1.00 63.44 H new ATOM 0 HD22 LEU A 36 22.507 12.102 31.946 1.00 63.44 H new ATOM 0 HD23 LEU A 36 21.525 13.380 32.701 1.00 63.44 H new ATOM 554 N GLY A 37 21.161 8.832 36.977 1.00 72.22 N ATOM 555 CA GLY A 37 20.037 8.097 37.534 1.00 12.23 C ATOM 556 C GLY A 37 19.387 7.181 36.517 1.00 31.23 C ATOM 557 O GLY A 37 18.175 6.969 36.553 1.00 41.24 O ATOM 0 H GLY A 37 22.050 8.334 37.006 1.00 72.22 H new ATOM 0 HA2 GLY A 37 20.378 7.507 38.385 1.00 12.23 H new ATOM 0 HA3 GLY A 37 19.296 8.802 37.911 1.00 12.23 H new ATOM 561 N GLY A 38 20.196 6.646 35.603 1.00 73.44 N ATOM 562 CA GLY A 38 19.696 5.718 34.600 1.00 31.42 C ATOM 563 C GLY A 38 19.390 4.349 35.181 1.00 22.15 C ATOM 564 O GLY A 38 18.611 4.232 36.125 1.00 21.21 O ATOM 0 H GLY A 38 21.195 6.841 35.540 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.793 6.128 34.147 1.00 31.42 H new ATOM 0 HA3 GLY A 38 20.433 5.615 33.804 1.00 31.42 H new ATOM 568 N ALA A 39 20.012 3.306 34.634 1.00 14.21 N ATOM 569 CA ALA A 39 19.774 1.942 35.104 1.00 43.43 C ATOM 570 C ALA A 39 21.039 1.302 35.677 1.00 63.22 C ATOM 571 O ALA A 39 20.954 0.306 36.389 1.00 3.43 O ATOM 572 CB ALA A 39 19.203 1.090 33.974 1.00 5.43 C ATOM 0 H ALA A 39 20.682 3.378 33.868 1.00 14.21 H new ATOM 0 HA ALA A 39 19.047 1.994 35.915 1.00 43.43 H new ATOM 0 HB1 ALA A 39 19.030 0.076 34.335 1.00 5.43 H new ATOM 0 HB2 ALA A 39 18.261 1.520 33.634 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.910 1.064 33.145 1.00 5.43 H new ATOM 578 N GLY A 40 22.199 1.874 35.355 1.00 15.31 N ATOM 579 CA GLY A 40 23.464 1.410 35.917 1.00 42.15 C ATOM 580 C GLY A 40 23.716 -0.072 35.726 1.00 45.53 C ATOM 581 O GLY A 40 23.549 -0.863 36.658 1.00 15.12 O ATOM 0 H GLY A 40 22.287 2.658 34.709 1.00 15.31 H new ATOM 0 HA2 GLY A 40 24.280 1.969 35.459 1.00 42.15 H new ATOM 0 HA3 GLY A 40 23.481 1.637 36.983 1.00 42.15 H new ATOM 585 N ALA A 41 24.130 -0.447 34.524 1.00 5.32 N ATOM 586 CA ALA A 41 24.438 -1.845 34.223 1.00 5.21 C ATOM 587 C ALA A 41 25.279 -1.977 32.963 1.00 44.21 C ATOM 588 O ALA A 41 25.632 -0.983 32.323 1.00 13.22 O ATOM 589 CB ALA A 41 23.162 -2.658 34.077 1.00 40.21 C ATOM 0 H ALA A 41 24.261 0.193 33.740 1.00 5.32 H new ATOM 0 HA ALA A 41 25.017 -2.234 35.061 1.00 5.21 H new ATOM 0 HB1 ALA A 41 23.415 -3.694 33.853 1.00 40.21 H new ATOM 0 HB2 ALA A 41 22.595 -2.615 35.007 1.00 40.21 H new ATOM 0 HB3 ALA A 41 22.560 -2.248 33.266 1.00 40.21 H new ATOM 595 N GLU A 42 25.580 -3.223 32.609 1.00 32.32 N ATOM 596 CA GLU A 42 26.425 -3.534 31.465 1.00 71.23 C ATOM 597 C GLU A 42 25.590 -3.644 30.206 1.00 1.12 C ATOM 598 O GLU A 42 25.191 -4.734 29.783 1.00 55.43 O ATOM 599 CB GLU A 42 27.181 -4.829 31.727 1.00 42.31 C ATOM 600 CG GLU A 42 27.821 -4.835 33.096 1.00 52.14 C ATOM 601 CD GLU A 42 28.453 -6.171 33.449 1.00 31.41 C ATOM 602 OE1 GLU A 42 27.905 -6.885 34.317 1.00 24.22 O ATOM 603 OE2 GLU A 42 29.486 -6.528 32.839 1.00 54.53 O1- ATOM 0 H GLU A 42 25.243 -4.046 33.109 1.00 32.32 H new ATOM 0 HA GLU A 42 27.145 -2.729 31.321 1.00 71.23 H new ATOM 0 HB2 GLU A 42 26.497 -5.673 31.641 1.00 42.31 H new ATOM 0 HB3 GLU A 42 27.949 -4.962 30.965 1.00 42.31 H new ATOM 0 HG2 GLU A 42 28.583 -4.056 33.139 1.00 52.14 H new ATOM 0 HG3 GLU A 42 27.068 -4.586 33.844 1.00 52.14 H new ATOM 610 N GLY A 43 25.291 -2.497 29.651 1.00 3.30 N ATOM 611 CA GLY A 43 24.523 -2.422 28.421 1.00 20.41 C ATOM 612 C GLY A 43 24.916 -1.228 27.583 1.00 55.55 C ATOM 613 O GLY A 43 25.758 -0.426 27.993 1.00 25.21 O ATOM 0 H GLY A 43 25.568 -1.592 30.031 1.00 3.30 H new ATOM 0 HA2 GLY A 43 24.671 -3.335 27.844 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.461 -2.365 28.659 1.00 20.41 H new ATOM 617 N THR A 44 24.308 -1.105 26.409 1.00 1.14 N ATOM 618 CA THR A 44 24.585 0.010 25.518 1.00 0.00 C ATOM 619 C THR A 44 23.673 1.184 25.866 1.00 54.32 C ATOM 620 O THR A 44 22.580 0.987 26.401 1.00 53.24 O ATOM 621 CB THR A 44 24.374 -0.404 24.040 1.00 74.01 C ATOM 622 OG1 THR A 44 25.104 -1.609 23.770 1.00 60.01 O ATOM 623 CG2 THR A 44 24.827 0.691 23.075 1.00 54.14 C ATOM 0 H THR A 44 23.618 -1.767 26.053 1.00 1.14 H new ATOM 0 HA THR A 44 25.626 0.309 25.645 1.00 0.00 H new ATOM 0 HB THR A 44 23.307 -0.567 23.888 1.00 74.01 H new ATOM 0 HG1 THR A 44 24.969 -1.871 22.835 1.00 60.01 H new ATOM 0 HG21 THR A 44 24.663 0.362 22.049 1.00 54.14 H new ATOM 0 HG22 THR A 44 24.254 1.600 23.261 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.887 0.893 23.226 1.00 54.14 H new ATOM 631 N ASN A 45 24.122 2.400 25.588 1.00 72.33 N ATOM 632 CA ASN A 45 23.317 3.583 25.851 1.00 33.43 C ATOM 633 C ASN A 45 22.406 3.839 24.653 1.00 24.30 C ATOM 634 O ASN A 45 22.898 3.995 23.538 1.00 63.01 O ATOM 635 CB ASN A 45 24.219 4.800 26.115 1.00 4.20 C ATOM 636 CG ASN A 45 25.331 4.516 27.118 1.00 5.33 C ATOM 637 OD1 ASN A 45 25.098 3.597 28.048 1.00 50.31 O flip ATOM 638 ND2 ASN A 45 26.404 5.109 27.045 1.00 41.45 N flip ATOM 0 H ASN A 45 25.037 2.592 25.181 1.00 72.33 H new ATOM 0 HA ASN A 45 22.708 3.419 26.740 1.00 33.43 H new ATOM 0 HB2 ASN A 45 24.662 5.127 25.174 1.00 4.20 H new ATOM 0 HB3 ASN A 45 23.608 5.624 26.483 1.00 4.20 H new ATOM 0 HD21 ASN A 45 26.551 5.810 26.318 1.00 41.45 H new ATOM 0 HD22 ASN A 45 27.148 4.901 27.711 1.00 41.45 H new ATOM 645 N PRO A 46 21.074 3.879 24.863 1.00 63.04 N ATOM 646 CA PRO A 46 20.089 3.998 23.774 1.00 61.02 C ATOM 647 C PRO A 46 20.447 5.094 22.762 1.00 4.44 C ATOM 648 O PRO A 46 20.530 4.841 21.554 1.00 23.02 O ATOM 649 CB PRO A 46 18.767 4.326 24.506 1.00 23.35 C ATOM 650 CG PRO A 46 19.146 4.591 25.931 1.00 42.23 C ATOM 651 CD PRO A 46 20.407 3.812 26.173 1.00 1.14 C ATOM 0 HA PRO A 46 20.038 3.087 23.178 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.279 5.194 24.063 1.00 23.35 H new ATOM 0 HB3 PRO A 46 18.064 3.496 24.436 1.00 23.35 H new ATOM 0 HG2 PRO A 46 19.306 5.656 26.101 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.355 4.275 26.611 1.00 42.23 H new ATOM 0 HD2 PRO A 46 21.014 4.256 26.962 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.199 2.784 26.471 1.00 1.14 H new ATOM 659 N GLU A 47 20.695 6.302 23.260 1.00 25.31 N ATOM 660 CA GLU A 47 20.976 7.441 22.391 1.00 53.11 C ATOM 661 C GLU A 47 22.300 7.239 21.655 1.00 42.42 C ATOM 662 O GLU A 47 22.465 7.670 20.513 1.00 0.52 O ATOM 663 CB GLU A 47 21.008 8.743 23.204 1.00 52.55 C ATOM 664 CG GLU A 47 20.637 9.972 22.386 1.00 35.10 C ATOM 665 CD GLU A 47 19.231 9.872 21.811 1.00 32.04 C ATOM 666 OE1 GLU A 47 18.261 10.170 22.543 1.00 53.13 O ATOM 667 OE2 GLU A 47 19.088 9.479 20.632 1.00 62.13 O1- ATOM 0 H GLU A 47 20.707 6.517 24.257 1.00 25.31 H new ATOM 0 HA GLU A 47 20.178 7.515 21.652 1.00 53.11 H new ATOM 0 HB2 GLU A 47 20.321 8.655 24.046 1.00 52.55 H new ATOM 0 HB3 GLU A 47 22.006 8.879 23.620 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.710 10.860 23.013 1.00 35.10 H new ATOM 0 HG3 GLU A 47 21.353 10.096 21.573 1.00 35.10 H new ATOM 674 N GLN A 48 23.242 6.570 22.315 1.00 41.14 N ATOM 675 CA GLN A 48 24.528 6.254 21.702 1.00 71.11 C ATOM 676 C GLN A 48 24.341 5.203 20.611 1.00 34.04 C ATOM 677 O GLN A 48 25.076 5.173 19.622 1.00 32.22 O ATOM 678 CB GLN A 48 25.523 5.752 22.755 1.00 12.45 C ATOM 679 CG GLN A 48 26.931 5.525 22.208 1.00 72.35 C ATOM 680 CD GLN A 48 27.975 5.321 23.291 1.00 3.55 C ATOM 681 OE1 GLN A 48 29.142 5.657 23.106 1.00 43.42 O ATOM 682 NE2 GLN A 48 27.571 4.775 24.429 1.00 72.04 N ATOM 0 H GLN A 48 23.139 6.237 23.273 1.00 41.14 H new ATOM 0 HA GLN A 48 24.932 7.163 21.256 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.571 6.474 23.570 1.00 12.45 H new ATOM 0 HB3 GLN A 48 25.152 4.818 23.177 1.00 12.45 H new ATOM 0 HG2 GLN A 48 26.922 4.653 21.554 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.217 6.380 21.595 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.594 4.508 24.548 1.00 72.04 H new ATOM 0 HE22 GLN A 48 28.237 4.622 25.186 1.00 72.04 H new ATOM 691 N LEU A 49 23.348 4.342 20.807 1.00 51.33 N ATOM 692 CA LEU A 49 23.007 3.322 19.824 1.00 61.13 C ATOM 693 C LEU A 49 22.454 4.009 18.574 1.00 21.55 C ATOM 694 O LEU A 49 22.826 3.671 17.448 1.00 71.11 O ATOM 695 CB LEU A 49 21.994 2.331 20.436 1.00 4.20 C ATOM 696 CG LEU A 49 21.755 1.011 19.668 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.884 1.227 18.436 1.00 0.52 C ATOM 698 CD2 LEU A 49 23.085 0.359 19.284 1.00 52.41 C ATOM 0 H LEU A 49 22.763 4.331 21.642 1.00 51.33 H new ATOM 0 HA LEU A 49 23.890 2.751 19.538 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.329 2.082 21.443 1.00 4.20 H new ATOM 0 HB3 LEU A 49 21.037 2.843 20.536 1.00 4.20 H new ATOM 0 HG LEU A 49 21.219 0.336 20.335 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.738 0.277 17.922 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.917 1.627 18.740 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.373 1.932 17.764 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.893 -0.568 18.744 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.653 1.038 18.648 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.658 0.142 20.186 1.00 52.41 H new ATOM 710 N PHE A 50 21.579 4.994 18.789 1.00 3.42 N ATOM 711 CA PHE A 50 21.063 5.821 17.696 1.00 25.51 C ATOM 712 C PHE A 50 22.204 6.560 16.997 1.00 64.45 C ATOM 713 O PHE A 50 22.257 6.604 15.775 1.00 15.22 O ATOM 714 CB PHE A 50 20.021 6.820 18.219 1.00 52.14 C ATOM 715 CG PHE A 50 19.645 7.908 17.234 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.994 7.612 16.042 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.926 9.234 17.516 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.640 8.614 15.158 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.578 10.238 16.637 1.00 34.34 C ATOM 720 CZ PHE A 50 18.935 9.929 15.454 1.00 61.21 C ATOM 0 H PHE A 50 21.213 5.238 19.709 1.00 3.42 H new ATOM 0 HA PHE A 50 20.580 5.166 16.971 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.120 6.273 18.499 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.406 7.286 19.126 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.762 6.585 15.803 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.426 9.486 18.439 1.00 31.01 H new ATOM 0 HE1 PHE A 50 18.133 8.368 14.237 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.808 11.266 16.874 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.664 10.714 14.763 1.00 61.21 H new ATOM 730 N ALA A 51 23.101 7.149 17.785 1.00 33.43 N ATOM 731 CA ALA A 51 24.286 7.829 17.257 1.00 33.33 C ATOM 732 C ALA A 51 25.081 6.917 16.320 1.00 4.13 C ATOM 733 O ALA A 51 25.416 7.302 15.193 1.00 52.03 O ATOM 734 CB ALA A 51 25.170 8.301 18.406 1.00 51.41 C ATOM 0 H ALA A 51 23.030 7.170 18.802 1.00 33.43 H new ATOM 0 HA ALA A 51 23.952 8.692 16.680 1.00 33.33 H new ATOM 0 HB1 ALA A 51 26.049 8.806 18.005 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.610 8.993 19.035 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.484 7.443 19.000 1.00 51.41 H new ATOM 740 N ALA A 52 25.374 5.707 16.790 1.00 32.43 N ATOM 741 CA ALA A 52 26.116 4.729 16.000 1.00 41.10 C ATOM 742 C ALA A 52 25.370 4.409 14.707 1.00 30.53 C ATOM 743 O ALA A 52 25.951 4.418 13.619 1.00 13.40 O ATOM 744 CB ALA A 52 26.352 3.460 16.813 1.00 51.43 C ATOM 0 H ALA A 52 25.107 5.380 17.718 1.00 32.43 H new ATOM 0 HA ALA A 52 27.084 5.156 15.739 1.00 41.10 H new ATOM 0 HB1 ALA A 52 26.906 2.740 16.211 1.00 51.43 H new ATOM 0 HB2 ALA A 52 26.925 3.703 17.708 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.393 3.029 17.102 1.00 51.43 H new ATOM 750 N GLY A 53 24.072 4.151 14.839 1.00 32.23 N ATOM 751 CA GLY A 53 23.241 3.845 13.689 1.00 45.35 C ATOM 752 C GLY A 53 23.152 5.006 12.720 1.00 24.44 C ATOM 753 O GLY A 53 23.111 4.808 11.511 1.00 23.31 O ATOM 0 H GLY A 53 23.578 4.149 15.731 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.645 2.974 13.173 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.240 3.579 14.027 1.00 45.35 H new ATOM 757 N TYR A 54 23.138 6.218 13.262 1.00 20.42 N ATOM 758 CA TYR A 54 23.065 7.438 12.464 1.00 1.52 C ATOM 759 C TYR A 54 24.319 7.554 11.604 1.00 10.14 C ATOM 760 O TYR A 54 24.239 7.784 10.396 1.00 3.35 O ATOM 761 CB TYR A 54 22.924 8.656 13.401 1.00 4.31 C ATOM 762 CG TYR A 54 22.645 9.997 12.726 1.00 71.40 C ATOM 763 CD1 TYR A 54 22.506 10.119 11.342 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.521 11.152 13.494 1.00 12.15 C ATOM 765 CE1 TYR A 54 22.252 11.347 10.754 1.00 65.13 C ATOM 766 CE2 TYR A 54 22.266 12.379 12.911 1.00 14.31 C ATOM 767 CZ TYR A 54 22.133 12.471 11.544 1.00 61.32 C ATOM 768 OH TYR A 54 21.884 13.697 10.961 1.00 14.13 O ATOM 0 H TYR A 54 23.177 6.384 14.268 1.00 20.42 H new ATOM 0 HA TYR A 54 22.196 7.405 11.807 1.00 1.52 H new ATOM 0 HB2 TYR A 54 22.119 8.454 14.107 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.841 8.749 13.982 1.00 4.31 H new ATOM 0 HD1 TYR A 54 22.598 9.241 10.720 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.626 11.088 14.567 1.00 12.15 H new ATOM 0 HE1 TYR A 54 22.148 11.424 9.682 1.00 65.13 H new ATOM 0 HE2 TYR A 54 22.171 13.262 13.526 1.00 14.31 H new ATOM 0 HH TYR A 54 22.330 13.742 10.090 1.00 14.13 H new ATOM 778 N SER A 55 25.472 7.359 12.233 1.00 11.10 N ATOM 779 CA SER A 55 26.752 7.407 11.537 1.00 22.53 C ATOM 780 C SER A 55 26.811 6.326 10.457 1.00 50.31 C ATOM 781 O SER A 55 27.171 6.590 9.306 1.00 23.31 O ATOM 782 CB SER A 55 27.897 7.217 12.540 1.00 0.44 C ATOM 783 OG SER A 55 27.792 8.138 13.611 1.00 35.10 O ATOM 0 H SER A 55 25.546 7.165 13.232 1.00 11.10 H new ATOM 0 HA SER A 55 26.857 8.380 11.058 1.00 22.53 H new ATOM 0 HB2 SER A 55 27.880 6.199 12.928 1.00 0.44 H new ATOM 0 HB3 SER A 55 28.854 7.349 12.035 1.00 0.44 H new ATOM 0 HG SER A 55 27.068 7.861 14.211 1.00 35.10 H new ATOM 789 N ALA A 56 26.427 5.112 10.841 1.00 25.24 N ATOM 790 CA ALA A 56 26.455 3.963 9.944 1.00 63.14 C ATOM 791 C ALA A 56 25.486 4.147 8.774 1.00 34.41 C ATOM 792 O ALA A 56 25.823 3.853 7.625 1.00 72.41 O ATOM 793 CB ALA A 56 26.129 2.697 10.725 1.00 2.41 C ATOM 0 H ALA A 56 26.089 4.898 11.779 1.00 25.24 H new ATOM 0 HA ALA A 56 27.457 3.874 9.524 1.00 63.14 H new ATOM 0 HB1 ALA A 56 26.150 1.839 10.053 1.00 2.41 H new ATOM 0 HB2 ALA A 56 26.866 2.557 11.515 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.137 2.787 11.167 1.00 2.41 H new ATOM 799 N CYS A 57 24.289 4.650 9.069 1.00 43.11 N ATOM 800 CA CYS A 57 23.274 4.871 8.042 1.00 65.50 C ATOM 801 C CYS A 57 23.709 5.988 7.101 1.00 1.30 C ATOM 802 O CYS A 57 23.503 5.907 5.893 1.00 31.43 O ATOM 803 CB CYS A 57 21.920 5.213 8.675 1.00 74.40 C ATOM 804 SG CYS A 57 21.219 3.889 9.690 1.00 3.24 S ATOM 0 H CYS A 57 23.999 4.912 10.011 1.00 43.11 H new ATOM 0 HA CYS A 57 23.163 3.949 7.471 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.035 6.105 9.290 1.00 74.40 H new ATOM 0 HB3 CYS A 57 21.214 5.461 7.883 1.00 74.40 H new ATOM 0 HG CYS A 57 21.842 3.840 10.830 1.00 3.24 H new ATOM 810 N PHE A 58 24.325 7.021 7.669 1.00 12.51 N ATOM 811 CA PHE A 58 24.801 8.160 6.893 1.00 55.51 C ATOM 812 C PHE A 58 25.874 7.696 5.912 1.00 60.31 C ATOM 813 O PHE A 58 25.898 8.106 4.753 1.00 54.45 O ATOM 814 CB PHE A 58 25.363 9.237 7.838 1.00 64.12 C ATOM 815 CG PHE A 58 25.559 10.593 7.199 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.725 10.899 6.509 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.573 11.566 7.300 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.899 12.145 5.933 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.744 12.810 6.727 1.00 51.42 C ATOM 820 CZ PHE A 58 25.907 13.101 6.042 1.00 5.31 C ATOM 0 H PHE A 58 24.507 7.092 8.670 1.00 12.51 H new ATOM 0 HA PHE A 58 23.972 8.591 6.331 1.00 55.51 H new ATOM 0 HB2 PHE A 58 24.689 9.344 8.688 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.320 8.893 8.232 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.504 10.156 6.421 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.660 11.346 7.834 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.810 12.370 5.398 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.968 13.556 6.814 1.00 51.42 H new ATOM 0 HZ PHE A 58 26.041 14.074 5.592 1.00 5.31 H new ATOM 830 N LEU A 59 26.746 6.812 6.394 1.00 64.51 N ATOM 831 CA LEU A 59 27.853 6.292 5.596 1.00 63.33 C ATOM 832 C LEU A 59 27.326 5.398 4.466 1.00 14.15 C ATOM 833 O LEU A 59 27.695 5.570 3.302 1.00 3.51 O ATOM 834 CB LEU A 59 28.833 5.520 6.510 1.00 74.12 C ATOM 835 CG LEU A 59 30.275 5.323 5.983 1.00 31.41 C ATOM 836 CD1 LEU A 59 30.323 4.363 4.796 1.00 61.22 C ATOM 837 CD2 LEU A 59 30.901 6.670 5.616 1.00 2.33 C ATOM 0 H LEU A 59 26.705 6.439 7.342 1.00 64.51 H new ATOM 0 HA LEU A 59 28.389 7.123 5.137 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.889 6.043 7.465 1.00 74.12 H new ATOM 0 HB3 LEU A 59 28.407 4.537 6.709 1.00 74.12 H new ATOM 0 HG LEU A 59 30.858 4.873 6.786 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.353 4.254 4.458 1.00 61.22 H new ATOM 0 HD12 LEU A 59 29.935 3.390 5.099 1.00 61.22 H new ATOM 0 HD13 LEU A 59 29.715 4.759 3.983 1.00 61.22 H new ATOM 0 HD21 LEU A 59 31.915 6.512 5.248 1.00 2.33 H new ATOM 0 HD22 LEU A 59 30.304 7.150 4.841 1.00 2.33 H new ATOM 0 HD23 LEU A 59 30.931 7.310 6.498 1.00 2.33 H new ATOM 849 N SER A 60 26.454 4.451 4.813 1.00 34.05 N ATOM 850 CA SER A 60 25.898 3.517 3.833 1.00 74.40 C ATOM 851 C SER A 60 25.062 4.273 2.789 1.00 42.34 C ATOM 852 O SER A 60 25.186 4.038 1.578 1.00 41.15 O ATOM 853 CB SER A 60 25.054 2.443 4.541 1.00 52.34 C ATOM 854 OG SER A 60 24.617 1.446 3.632 1.00 74.20 O ATOM 0 H SER A 60 26.117 4.310 5.765 1.00 34.05 H new ATOM 0 HA SER A 60 26.718 3.020 3.315 1.00 74.40 H new ATOM 0 HB2 SER A 60 25.641 1.981 5.335 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.190 2.910 5.014 1.00 52.34 H new ATOM 0 HG SER A 60 25.054 0.595 3.845 1.00 74.20 H new ATOM 860 N ALA A 61 24.231 5.203 3.260 1.00 5.22 N ATOM 861 CA ALA A 61 23.429 6.036 2.371 1.00 61.10 C ATOM 862 C ALA A 61 24.338 6.838 1.447 1.00 23.52 C ATOM 863 O ALA A 61 24.086 6.943 0.248 1.00 64.15 O ATOM 864 CB ALA A 61 22.519 6.962 3.175 1.00 23.00 C ATOM 0 H ALA A 61 24.097 5.397 4.253 1.00 5.22 H new ATOM 0 HA ALA A 61 22.796 5.390 1.762 1.00 61.10 H new ATOM 0 HB1 ALA A 61 21.929 7.575 2.493 1.00 23.00 H new ATOM 0 HB2 ALA A 61 21.851 6.366 3.797 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.126 7.607 3.810 1.00 23.00 H new ATOM 870 N MET A 62 25.412 7.375 2.019 1.00 1.42 N ATOM 871 CA MET A 62 26.412 8.121 1.259 1.00 22.23 C ATOM 872 C MET A 62 26.999 7.239 0.153 1.00 52.25 C ATOM 873 O MET A 62 27.258 7.704 -0.961 1.00 52.11 O ATOM 874 CB MET A 62 27.520 8.618 2.205 1.00 12.31 C ATOM 875 CG MET A 62 28.576 9.523 1.569 1.00 13.45 C ATOM 876 SD MET A 62 28.024 11.225 1.297 1.00 13.34 S ATOM 877 CE MET A 62 27.022 11.071 -0.179 1.00 61.32 C ATOM 0 H MET A 62 25.614 7.306 3.017 1.00 1.42 H new ATOM 0 HA MET A 62 25.939 8.985 0.792 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.054 9.158 3.029 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.022 7.751 2.635 1.00 12.31 H new ATOM 0 HG2 MET A 62 29.459 9.537 2.207 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.879 9.094 0.614 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.202 11.925 -0.832 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.285 10.152 -0.703 1.00 61.32 H new ATOM 0 HE3 MET A 62 25.968 11.042 0.098 1.00 61.32 H new ATOM 887 N LYS A 63 27.194 5.957 0.472 1.00 50.31 N ATOM 888 CA LYS A 63 27.679 4.976 -0.499 1.00 32.21 C ATOM 889 C LYS A 63 26.690 4.841 -1.657 1.00 55.33 C ATOM 890 O LYS A 63 27.075 4.917 -2.825 1.00 31.21 O ATOM 891 CB LYS A 63 27.897 3.611 0.174 1.00 32.54 C ATOM 892 CG LYS A 63 29.049 3.588 1.177 1.00 62.32 C ATOM 893 CD LYS A 63 29.037 2.327 2.046 1.00 52.53 C ATOM 894 CE LYS A 63 29.065 1.046 1.219 1.00 52.13 C ATOM 895 NZ LYS A 63 30.273 0.959 0.359 1.00 51.23 N1+ ATOM 0 H LYS A 63 27.022 5.574 1.401 1.00 50.31 H new ATOM 0 HA LYS A 63 28.634 5.325 -0.892 1.00 32.21 H new ATOM 0 HB2 LYS A 63 26.979 3.319 0.684 1.00 32.54 H new ATOM 0 HB3 LYS A 63 28.085 2.864 -0.597 1.00 32.54 H new ATOM 0 HG2 LYS A 63 29.996 3.648 0.641 1.00 62.32 H new ATOM 0 HG3 LYS A 63 28.988 4.468 1.817 1.00 62.32 H new ATOM 0 HD2 LYS A 63 29.898 2.343 2.715 1.00 52.53 H new ATOM 0 HD3 LYS A 63 28.146 2.331 2.674 1.00 52.53 H new ATOM 0 HE2 LYS A 63 29.033 0.184 1.886 1.00 52.13 H new ATOM 0 HE3 LYS A 63 28.173 0.999 0.595 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 30.301 0.030 -0.107 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 30.240 1.707 -0.362 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 31.125 1.079 0.944 1.00 51.23 H new ATOM 909 N PHE A 64 25.413 4.648 -1.320 1.00 54.13 N ATOM 910 CA PHE A 64 24.359 4.549 -2.333 1.00 15.41 C ATOM 911 C PHE A 64 24.318 5.811 -3.197 1.00 43.31 C ATOM 912 O PHE A 64 24.268 5.737 -4.428 1.00 31.42 O ATOM 913 CB PHE A 64 22.991 4.321 -1.671 1.00 54.23 C ATOM 914 CG PHE A 64 21.833 4.380 -2.642 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.717 3.444 -3.660 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.866 5.374 -2.542 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.666 3.497 -4.556 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.813 5.429 -3.436 1.00 31.33 C ATOM 919 CZ PHE A 64 19.714 4.490 -4.444 1.00 62.32 C ATOM 0 H PHE A 64 25.084 4.557 -0.359 1.00 54.13 H new ATOM 0 HA PHE A 64 24.586 3.696 -2.972 1.00 15.41 H new ATOM 0 HB2 PHE A 64 22.992 3.349 -1.178 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.842 5.072 -0.895 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.458 2.664 -3.753 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.938 6.112 -1.757 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.590 2.762 -5.343 1.00 70.35 H new ATOM 0 HE2 PHE A 64 19.068 6.206 -3.346 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.893 4.533 -5.144 1.00 62.32 H new ATOM 929 N VAL A 65 24.353 6.966 -2.540 1.00 22.12 N ATOM 930 CA VAL A 65 24.330 8.253 -3.225 1.00 1.13 C ATOM 931 C VAL A 65 25.486 8.363 -4.220 1.00 2.04 C ATOM 932 O VAL A 65 25.314 8.832 -5.351 1.00 1.42 O ATOM 933 CB VAL A 65 24.398 9.426 -2.216 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.618 10.751 -2.939 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.129 9.476 -1.366 1.00 41.32 C ATOM 0 H VAL A 65 24.398 7.036 -1.523 1.00 22.12 H new ATOM 0 HA VAL A 65 23.387 8.315 -3.769 1.00 1.13 H new ATOM 0 HB VAL A 65 25.247 9.258 -1.554 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.662 11.560 -2.210 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.555 10.711 -3.494 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.794 10.930 -3.630 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.195 10.306 -0.663 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.263 9.616 -2.013 1.00 41.32 H new ATOM 0 HG23 VAL A 65 23.023 8.541 -0.815 1.00 41.32 H new ATOM 945 N ALA A 66 26.660 7.917 -3.799 1.00 10.53 N ATOM 946 CA ALA A 66 27.837 7.918 -4.661 1.00 34.24 C ATOM 947 C ALA A 66 27.565 7.120 -5.932 1.00 52.01 C ATOM 948 O ALA A 66 28.050 7.456 -7.016 1.00 55.45 O ATOM 949 CB ALA A 66 29.039 7.344 -3.917 1.00 2.15 C ATOM 0 H ALA A 66 26.825 7.548 -2.863 1.00 10.53 H new ATOM 0 HA ALA A 66 28.063 8.947 -4.941 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.910 7.351 -4.572 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.244 7.950 -3.035 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.823 6.320 -3.612 1.00 2.15 H new ATOM 955 N GLY A 67 26.736 6.094 -5.788 1.00 41.30 N ATOM 956 CA GLY A 67 26.443 5.192 -6.887 1.00 41.44 C ATOM 957 C GLY A 67 25.562 5.828 -7.946 1.00 65.01 C ATOM 958 O GLY A 67 25.617 5.449 -9.118 1.00 24.21 O ATOM 0 H GLY A 67 26.255 5.868 -4.917 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.378 4.867 -7.344 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.951 4.300 -6.499 1.00 41.44 H new ATOM 962 N GLN A 68 24.758 6.808 -7.543 1.00 2.22 N ATOM 963 CA GLN A 68 23.836 7.470 -8.463 1.00 3.22 C ATOM 964 C GLN A 68 24.452 8.769 -8.962 1.00 13.50 C ATOM 965 O GLN A 68 24.106 9.268 -10.033 1.00 73.33 O ATOM 966 CB GLN A 68 22.485 7.742 -7.781 1.00 70.02 C ATOM 967 CG GLN A 68 22.601 8.483 -6.454 1.00 23.14 C ATOM 968 CD GLN A 68 21.255 8.898 -5.890 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.630 8.160 -5.134 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.800 10.085 -6.259 1.00 55.13 N ATOM 0 H GLN A 68 24.726 7.161 -6.587 1.00 2.22 H new ATOM 0 HA GLN A 68 23.657 6.812 -9.313 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.858 8.324 -8.457 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.977 6.793 -7.613 1.00 70.02 H new ATOM 0 HG2 GLN A 68 23.111 7.846 -5.731 1.00 23.14 H new ATOM 0 HG3 GLN A 68 23.221 9.369 -6.591 1.00 23.14 H new ATOM 0 HE21 GLN A 68 21.350 10.669 -6.889 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.899 10.416 -5.913 1.00 55.13 H new ATOM 979 N ASN A 69 25.385 9.298 -8.176 1.00 45.10 N ATOM 980 CA ASN A 69 26.079 10.537 -8.516 1.00 61.12 C ATOM 981 C ASN A 69 27.333 10.264 -9.345 1.00 41.24 C ATOM 982 O ASN A 69 28.039 11.197 -9.735 1.00 42.44 O ATOM 983 CB ASN A 69 26.429 11.313 -7.238 1.00 43.31 C ATOM 984 CG ASN A 69 25.251 12.122 -6.714 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.070 13.287 -7.068 1.00 73.01 O ATOM 986 ND2 ASN A 69 24.433 11.508 -5.877 1.00 73.35 N ATOM 0 H ASN A 69 25.680 8.884 -7.292 1.00 45.10 H new ATOM 0 HA ASN A 69 25.410 11.145 -9.125 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.758 10.614 -6.469 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.266 11.982 -7.439 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.622 12.000 -5.503 1.00 73.35 H new ATOM 0 HD22 ASN A 69 24.613 10.542 -5.605 1.00 73.35 H new ATOM 993 N LYS A 70 27.595 8.982 -9.611 1.00 63.25 N ATOM 994 CA LYS A 70 28.723 8.562 -10.451 1.00 32.31 C ATOM 995 C LYS A 70 30.066 8.972 -9.836 1.00 12.34 C ATOM 996 O LYS A 70 31.066 9.133 -10.542 1.00 70.50 O ATOM 997 CB LYS A 70 28.586 9.133 -11.876 1.00 4.35 C ATOM 998 CG LYS A 70 27.623 8.356 -12.777 1.00 13.20 C ATOM 999 CD LYS A 70 26.268 8.121 -12.114 1.00 32.43 C ATOM 1000 CE LYS A 70 25.183 7.805 -13.137 1.00 4.32 C ATOM 1001 NZ LYS A 70 23.845 7.661 -12.510 1.00 52.12 N1+ ATOM 0 H LYS A 70 27.035 8.208 -9.253 1.00 63.25 H new ATOM 0 HA LYS A 70 28.701 7.474 -10.509 1.00 32.31 H new ATOM 0 HB2 LYS A 70 28.248 10.167 -11.809 1.00 4.35 H new ATOM 0 HB3 LYS A 70 29.570 9.149 -12.344 1.00 4.35 H new ATOM 0 HG2 LYS A 70 27.479 8.904 -13.708 1.00 13.20 H new ATOM 0 HG3 LYS A 70 28.068 7.396 -13.038 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.349 7.298 -11.404 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.984 9.006 -11.545 1.00 32.43 H new ATOM 0 HE2 LYS A 70 25.149 8.598 -13.884 1.00 4.32 H new ATOM 0 HE3 LYS A 70 25.438 6.884 -13.661 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 23.118 8.029 -13.156 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 23.659 6.656 -12.316 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 23.820 8.196 -11.619 1.00 52.12 H new ATOM 1015 N GLN A 71 30.085 9.105 -8.515 1.00 41.25 N ATOM 1016 CA GLN A 71 31.288 9.504 -7.787 1.00 41.44 C ATOM 1017 C GLN A 71 31.807 8.345 -6.938 1.00 11.15 C ATOM 1018 O GLN A 71 31.126 7.332 -6.772 1.00 3.32 O ATOM 1019 CB GLN A 71 31.001 10.722 -6.897 1.00 65.11 C ATOM 1020 CG GLN A 71 29.755 10.568 -6.033 1.00 11.32 C ATOM 1021 CD GLN A 71 29.878 11.233 -4.677 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.271 10.448 -3.698 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 29.590 12.415 -4.512 1.00 60.02 N flip ATOM 0 H GLN A 71 29.273 8.941 -7.919 1.00 41.25 H new ATOM 0 HA GLN A 71 32.053 9.776 -8.514 1.00 41.44 H new ATOM 0 HB2 GLN A 71 31.861 10.900 -6.251 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.888 11.604 -7.528 1.00 65.11 H new ATOM 0 HG2 GLN A 71 28.901 10.992 -6.561 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.548 9.507 -5.892 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.290 12.982 -5.305 1.00 60.02 H new ATOM 0 HE22 GLN A 71 29.651 12.830 -3.582 1.00 60.02 H new ATOM 1032 N THR A 72 33.011 8.505 -6.395 1.00 0.13 N ATOM 1033 CA THR A 72 33.644 7.462 -5.590 1.00 33.54 C ATOM 1034 C THR A 72 33.996 7.987 -4.198 1.00 64.51 C ATOM 1035 O THR A 72 34.411 9.141 -4.045 1.00 2.32 O ATOM 1036 CB THR A 72 34.920 6.925 -6.279 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.769 8.020 -6.658 1.00 1.42 O ATOM 1038 CG2 THR A 72 34.573 6.098 -7.514 1.00 71.13 C ATOM 0 H THR A 72 33.571 9.351 -6.498 1.00 0.13 H new ATOM 0 HA THR A 72 32.928 6.646 -5.491 1.00 33.54 H new ATOM 0 HB THR A 72 35.442 6.283 -5.569 1.00 55.21 H new ATOM 0 HG1 THR A 72 36.576 7.673 -7.092 1.00 1.42 H new ATOM 0 HG21 THR A 72 35.490 5.734 -7.977 1.00 71.13 H new ATOM 0 HG22 THR A 72 33.953 5.251 -7.222 1.00 71.13 H new ATOM 0 HG23 THR A 72 34.028 6.718 -8.226 1.00 71.13 H new ATOM 1046 N LEU A 73 33.813 7.143 -3.190 1.00 24.22 N ATOM 1047 CA LEU A 73 34.105 7.502 -1.804 1.00 2.33 C ATOM 1048 C LEU A 73 35.337 6.754 -1.293 1.00 44.11 C ATOM 1049 O LEU A 73 35.540 5.584 -1.631 1.00 52.40 O ATOM 1050 CB LEU A 73 32.897 7.181 -0.920 1.00 54.54 C ATOM 1051 CG LEU A 73 31.628 7.988 -1.221 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.459 7.462 -0.398 1.00 63.13 C ATOM 1053 CD2 LEU A 73 31.861 9.474 -0.949 1.00 44.41 C ATOM 0 H LEU A 73 33.459 6.193 -3.307 1.00 24.22 H new ATOM 0 HA LEU A 73 34.312 8.571 -1.762 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.665 6.121 -1.022 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.175 7.348 0.121 1.00 54.54 H new ATOM 0 HG LEU A 73 31.383 7.872 -2.277 1.00 53.14 H new ATOM 0 HD11 LEU A 73 29.565 8.044 -0.622 1.00 63.13 H new ATOM 0 HD12 LEU A 73 30.282 6.415 -0.645 1.00 63.13 H new ATOM 0 HD13 LEU A 73 30.693 7.550 0.663 1.00 63.13 H new ATOM 0 HD21 LEU A 73 30.950 10.031 -1.168 1.00 44.41 H new ATOM 0 HD22 LEU A 73 32.129 9.615 0.098 1.00 44.41 H new ATOM 0 HD23 LEU A 73 32.670 9.837 -1.583 1.00 44.41 H new ATOM 1065 N PRO A 74 36.173 7.418 -0.469 1.00 14.33 N ATOM 1066 CA PRO A 74 37.361 6.796 0.131 1.00 71.54 C ATOM 1067 C PRO A 74 36.990 5.701 1.137 1.00 22.35 C ATOM 1068 O PRO A 74 36.033 5.843 1.892 1.00 71.04 O ATOM 1069 CB PRO A 74 38.070 7.967 0.844 1.00 0.31 C ATOM 1070 CG PRO A 74 37.445 9.206 0.289 1.00 75.32 C ATOM 1071 CD PRO A 74 36.036 8.829 -0.062 1.00 21.31 C ATOM 0 HA PRO A 74 37.983 6.304 -0.616 1.00 71.54 H new ATOM 0 HB2 PRO A 74 37.935 7.909 1.924 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.143 7.950 0.655 1.00 0.31 H new ATOM 0 HG2 PRO A 74 37.463 10.015 1.020 1.00 75.32 H new ATOM 0 HG3 PRO A 74 37.986 9.558 -0.589 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.362 8.942 0.787 1.00 21.31 H new ATOM 0 HD3 PRO A 74 35.640 9.447 -0.868 1.00 21.31 H new ATOM 1079 N ALA A 75 37.759 4.618 1.143 1.00 74.43 N ATOM 1080 CA ALA A 75 37.539 3.503 2.068 1.00 72.21 C ATOM 1081 C ALA A 75 38.050 3.846 3.466 1.00 34.41 C ATOM 1082 O ALA A 75 37.724 3.180 4.451 1.00 42.34 O ATOM 1083 CB ALA A 75 38.251 2.261 1.552 1.00 2.05 C ATOM 0 H ALA A 75 38.549 4.485 0.512 1.00 74.43 H new ATOM 0 HA ALA A 75 36.468 3.313 2.130 1.00 72.21 H new ATOM 0 HB1 ALA A 75 38.086 1.434 2.242 1.00 2.05 H new ATOM 0 HB2 ALA A 75 37.858 1.998 0.570 1.00 2.05 H new ATOM 0 HB3 ALA A 75 39.320 2.460 1.474 1.00 2.05 H new ATOM 1089 N ASP A 76 38.856 4.894 3.529 1.00 35.21 N ATOM 1090 CA ASP A 76 39.564 5.287 4.748 1.00 24.42 C ATOM 1091 C ASP A 76 38.770 6.297 5.574 1.00 33.35 C ATOM 1092 O ASP A 76 39.307 6.906 6.505 1.00 61.01 O ATOM 1093 CB ASP A 76 40.916 5.890 4.355 1.00 72.44 C ATOM 1094 CG ASP A 76 41.982 4.841 4.099 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.208 4.491 2.921 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.592 4.353 5.075 1.00 42.23 O1- ATOM 0 H ASP A 76 39.042 5.504 2.733 1.00 35.21 H new ATOM 0 HA ASP A 76 39.700 4.400 5.367 1.00 24.42 H new ATOM 0 HB2 ASP A 76 40.790 6.498 3.459 1.00 72.44 H new ATOM 0 HB3 ASP A 76 41.254 6.557 5.148 1.00 72.44 H new ATOM 1101 N THR A 77 37.504 6.475 5.236 1.00 11.55 N ATOM 1102 CA THR A 77 36.667 7.476 5.885 1.00 12.43 C ATOM 1103 C THR A 77 35.961 6.917 7.125 1.00 50.31 C ATOM 1104 O THR A 77 35.716 5.711 7.232 1.00 30.02 O ATOM 1105 CB THR A 77 35.628 8.043 4.893 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.804 9.022 5.535 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.742 6.943 4.316 1.00 73.22 C ATOM 0 H THR A 77 37.029 5.937 4.511 1.00 11.55 H new ATOM 0 HA THR A 77 37.325 8.281 6.213 1.00 12.43 H new ATOM 0 HB THR A 77 36.182 8.506 4.077 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.369 9.653 6.027 1.00 73.42 H new ATOM 0 HG21 THR A 77 34.024 7.381 3.623 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.360 6.217 3.788 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.208 6.444 5.125 1.00 73.22 H new ATOM 1115 N THR A 78 35.647 7.814 8.057 1.00 13.54 N ATOM 1116 CA THR A 78 34.963 7.464 9.294 1.00 2.03 C ATOM 1117 C THR A 78 34.005 8.574 9.709 1.00 41.21 C ATOM 1118 O THR A 78 34.191 9.735 9.349 1.00 33.42 O ATOM 1119 CB THR A 78 35.969 7.209 10.443 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.060 8.134 10.356 1.00 41.13 O ATOM 1121 CG2 THR A 78 36.494 5.783 10.409 1.00 52.04 C ATOM 0 H THR A 78 35.862 8.808 7.973 1.00 13.54 H new ATOM 0 HA THR A 78 34.404 6.548 9.106 1.00 2.03 H new ATOM 0 HB THR A 78 35.446 7.356 11.388 1.00 65.01 H new ATOM 0 HG1 THR A 78 37.690 7.966 11.088 1.00 41.13 H new ATOM 0 HG21 THR A 78 37.198 5.635 11.228 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.662 5.086 10.515 1.00 52.04 H new ATOM 0 HG23 THR A 78 36.999 5.604 9.460 1.00 52.04 H new ATOM 1129 N VAL A 79 32.981 8.202 10.459 1.00 13.33 N ATOM 1130 CA VAL A 79 32.034 9.162 11.017 1.00 51.35 C ATOM 1131 C VAL A 79 31.855 8.890 12.501 1.00 40.33 C ATOM 1132 O VAL A 79 31.521 7.771 12.897 1.00 15.54 O ATOM 1133 CB VAL A 79 30.655 9.109 10.309 1.00 73.54 C ATOM 1134 CG1 VAL A 79 29.651 10.035 10.998 1.00 32.33 C ATOM 1135 CG2 VAL A 79 30.803 9.484 8.841 1.00 4.51 C ATOM 0 H VAL A 79 32.780 7.231 10.699 1.00 13.33 H new ATOM 0 HA VAL A 79 32.444 10.160 10.859 1.00 51.35 H new ATOM 0 HB VAL A 79 30.275 8.089 10.375 1.00 73.54 H new ATOM 0 HG11 VAL A 79 28.692 9.980 10.483 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.524 9.726 12.036 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.021 11.060 10.967 1.00 32.33 H new ATOM 0 HG21 VAL A 79 29.828 9.443 8.355 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.206 10.494 8.762 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.481 8.784 8.353 1.00 4.51 H new ATOM 1145 N THR A 80 32.103 9.903 13.319 1.00 3.21 N ATOM 1146 CA THR A 80 31.992 9.762 14.761 1.00 52.54 C ATOM 1147 C THR A 80 30.843 10.613 15.296 1.00 43.34 C ATOM 1148 O THR A 80 30.906 11.842 15.270 1.00 4.30 O ATOM 1149 CB THR A 80 33.314 10.158 15.456 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.402 9.418 14.878 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.252 9.881 16.956 1.00 20.33 C ATOM 0 H THR A 80 32.383 10.833 13.006 1.00 3.21 H new ATOM 0 HA THR A 80 31.786 8.715 14.982 1.00 52.54 H new ATOM 0 HB THR A 80 33.470 11.227 15.309 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.240 9.671 15.318 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.196 10.169 17.419 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.440 10.457 17.399 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.076 8.818 17.123 1.00 20.33 H new ATOM 1159 N ALA A 81 29.790 9.952 15.759 1.00 63.21 N ATOM 1160 CA ALA A 81 28.642 10.637 16.338 1.00 75.00 C ATOM 1161 C ALA A 81 28.811 10.743 17.845 1.00 14.40 C ATOM 1162 O ALA A 81 28.715 9.747 18.566 1.00 73.21 O ATOM 1163 CB ALA A 81 27.349 9.908 15.993 1.00 42.42 C ATOM 0 H ALA A 81 29.707 8.935 15.744 1.00 63.21 H new ATOM 0 HA ALA A 81 28.584 11.641 15.918 1.00 75.00 H new ATOM 0 HB1 ALA A 81 26.504 10.436 16.435 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.229 9.873 14.910 1.00 42.42 H new ATOM 0 HB3 ALA A 81 27.388 8.892 16.387 1.00 42.42 H new ATOM 1169 N GLU A 82 29.098 11.947 18.308 1.00 71.31 N ATOM 1170 CA GLU A 82 29.304 12.200 19.726 1.00 72.51 C ATOM 1171 C GLU A 82 28.078 12.912 20.288 1.00 53.13 C ATOM 1172 O GLU A 82 27.842 14.083 19.996 1.00 25.01 O ATOM 1173 CB GLU A 82 30.574 13.041 19.918 1.00 74.00 C ATOM 1174 CG GLU A 82 31.034 13.174 21.364 1.00 3.23 C ATOM 1175 CD GLU A 82 32.385 13.865 21.473 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.422 13.167 21.509 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.418 15.110 21.494 1.00 51.44 O1- ATOM 0 H GLU A 82 29.195 12.773 17.717 1.00 71.31 H new ATOM 0 HA GLU A 82 29.436 11.261 20.263 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.380 12.597 19.334 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.399 14.038 19.513 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.292 13.738 21.930 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.096 12.184 21.817 1.00 3.23 H new ATOM 1184 N VAL A 83 27.290 12.194 21.079 1.00 31.40 N ATOM 1185 CA VAL A 83 26.010 12.706 21.567 1.00 74.25 C ATOM 1186 C VAL A 83 26.115 13.184 23.008 1.00 12.15 C ATOM 1187 O VAL A 83 26.799 12.570 23.830 1.00 3.30 O ATOM 1188 CB VAL A 83 24.884 11.640 21.466 1.00 22.15 C ATOM 1189 CG1 VAL A 83 24.573 11.318 20.007 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.258 10.369 22.231 1.00 42.03 C ATOM 0 H VAL A 83 27.514 11.252 21.399 1.00 31.40 H new ATOM 0 HA VAL A 83 25.753 13.550 20.926 1.00 74.25 H new ATOM 0 HB VAL A 83 23.987 12.057 21.924 1.00 22.15 H new ATOM 0 HG11 VAL A 83 23.782 10.570 19.960 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.246 12.224 19.496 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.468 10.930 19.521 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.452 9.641 22.143 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.173 9.949 21.814 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.416 10.610 23.282 1.00 42.03 H new ATOM 1200 N GLY A 84 25.437 14.285 23.303 1.00 33.12 N ATOM 1201 CA GLY A 84 25.382 14.799 24.651 1.00 23.12 C ATOM 1202 C GLY A 84 23.960 15.106 25.062 1.00 64.22 C ATOM 1203 O GLY A 84 23.114 15.392 24.216 1.00 21.33 O ATOM 0 H GLY A 84 24.918 14.836 22.619 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.813 14.071 25.338 1.00 23.12 H new ATOM 0 HA3 GLY A 84 25.987 15.703 24.723 1.00 23.12 H new ATOM 1207 N ILE A 85 23.698 15.047 26.357 1.00 23.52 N ATOM 1208 CA ILE A 85 22.372 15.305 26.896 1.00 1.40 C ATOM 1209 C ILE A 85 22.485 16.256 28.076 1.00 61.15 C ATOM 1210 O ILE A 85 23.339 16.075 28.952 1.00 10.52 O ATOM 1211 CB ILE A 85 21.655 13.985 27.319 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.236 14.254 27.878 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.494 13.213 28.333 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.189 14.569 29.364 1.00 71.32 C ATOM 0 H ILE A 85 24.397 14.819 27.064 1.00 23.52 H new ATOM 0 HA ILE A 85 21.765 15.763 26.115 1.00 1.40 H new ATOM 0 HB ILE A 85 21.544 13.375 26.423 1.00 52.02 H new ATOM 0 HG12 ILE A 85 19.796 15.087 27.330 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.613 13.381 27.685 1.00 53.33 H new ATOM 0 HG21 ILE A 85 21.974 12.297 28.613 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.459 12.962 27.892 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.649 13.828 29.220 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.156 14.743 29.667 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.595 13.729 29.927 1.00 71.32 H new ATOM 0 HD13 ILE A 85 20.781 15.461 29.566 1.00 71.32 H new ATOM 1226 N GLY A 86 21.629 17.271 28.076 1.00 43.44 N ATOM 1227 CA GLY A 86 21.608 18.263 29.138 1.00 64.20 C ATOM 1228 C GLY A 86 20.210 18.807 29.351 1.00 43.21 C ATOM 1229 O GLY A 86 19.319 18.524 28.551 1.00 31.32 O ATOM 0 H GLY A 86 20.936 17.427 27.344 1.00 43.44 H new ATOM 0 HA2 GLY A 86 21.973 17.817 30.063 1.00 64.20 H new ATOM 0 HA3 GLY A 86 22.285 19.080 28.890 1.00 64.20 H new ATOM 1233 N PRO A 87 19.976 19.578 30.425 1.00 20.43 N ATOM 1234 CA PRO A 87 18.649 20.110 30.727 1.00 73.43 C ATOM 1235 C PRO A 87 18.256 21.233 29.771 1.00 33.24 C ATOM 1236 O PRO A 87 19.070 22.095 29.433 1.00 11.41 O ATOM 1237 CB PRO A 87 18.791 20.638 32.158 1.00 75.13 C ATOM 1238 CG PRO A 87 20.236 20.990 32.286 1.00 24.22 C ATOM 1239 CD PRO A 87 20.985 20.019 31.406 1.00 44.21 C ATOM 0 HA PRO A 87 17.868 19.357 30.621 1.00 73.43 H new ATOM 0 HB2 PRO A 87 18.155 21.507 32.325 1.00 75.13 H new ATOM 0 HB3 PRO A 87 18.500 19.884 32.890 1.00 75.13 H new ATOM 0 HG2 PRO A 87 20.416 22.018 31.972 1.00 24.22 H new ATOM 0 HG3 PRO A 87 20.566 20.911 33.322 1.00 24.22 H new ATOM 0 HD2 PRO A 87 21.835 20.496 30.918 1.00 44.21 H new ATOM 0 HD3 PRO A 87 21.377 19.180 31.981 1.00 44.21 H new ATOM 1247 N ASN A 88 17.007 21.209 29.338 1.00 50.13 N ATOM 1248 CA ASN A 88 16.477 22.233 28.451 1.00 62.23 C ATOM 1249 C ASN A 88 16.031 23.426 29.281 1.00 31.22 C ATOM 1250 O ASN A 88 15.441 23.253 30.348 1.00 11.01 O ATOM 1251 CB ASN A 88 15.295 21.675 27.638 1.00 63.43 C ATOM 1252 CG ASN A 88 14.820 22.612 26.531 1.00 21.32 C ATOM 1253 OD1 ASN A 88 14.996 23.831 26.601 1.00 63.22 O ATOM 1254 ND2 ASN A 88 14.189 22.051 25.513 1.00 22.41 N ATOM 0 H ASN A 88 16.335 20.484 29.589 1.00 50.13 H new ATOM 0 HA ASN A 88 17.253 22.547 27.752 1.00 62.23 H new ATOM 0 HB2 ASN A 88 15.586 20.722 27.196 1.00 63.43 H new ATOM 0 HB3 ASN A 88 14.464 21.473 28.313 1.00 63.43 H new ATOM 0 HD21 ASN A 88 13.830 22.630 24.754 1.00 22.41 H new ATOM 0 HD22 ASN A 88 14.061 21.039 25.487 1.00 22.41 H new ATOM 1261 N GLU A 89 16.304 24.628 28.789 1.00 43.32 N ATOM 1262 CA GLU A 89 15.930 25.853 29.490 1.00 2.23 C ATOM 1263 C GLU A 89 14.406 25.954 29.631 1.00 10.40 C ATOM 1264 O GLU A 89 13.894 26.744 30.426 1.00 74.31 O ATOM 1265 CB GLU A 89 16.475 27.076 28.747 1.00 13.04 C ATOM 1266 CG GLU A 89 15.979 27.189 27.311 1.00 64.14 C ATOM 1267 CD GLU A 89 16.499 28.431 26.613 1.00 35.31 C ATOM 1268 OE1 GLU A 89 15.857 29.497 26.737 1.00 70.11 O ATOM 1269 OE2 GLU A 89 17.549 28.349 25.943 1.00 74.23 O1- ATOM 0 H GLU A 89 16.785 24.782 27.903 1.00 43.32 H new ATOM 0 HA GLU A 89 16.366 25.824 30.488 1.00 2.23 H new ATOM 0 HB2 GLU A 89 16.193 27.977 29.292 1.00 13.04 H new ATOM 0 HB3 GLU A 89 17.564 27.033 28.744 1.00 13.04 H new ATOM 0 HG2 GLU A 89 16.289 26.306 26.752 1.00 64.14 H new ATOM 0 HG3 GLU A 89 14.889 27.203 27.306 1.00 64.14 H new ATOM 1276 N GLU A 90 13.703 25.155 28.835 1.00 62.24 N ATOM 1277 CA GLU A 90 12.247 25.042 28.897 1.00 33.11 C ATOM 1278 C GLU A 90 11.802 24.367 30.200 1.00 41.22 C ATOM 1279 O GLU A 90 10.651 24.492 30.623 1.00 23.51 O ATOM 1280 CB GLU A 90 11.757 24.236 27.685 1.00 62.35 C ATOM 1281 CG GLU A 90 10.295 23.820 27.755 1.00 2.12 C ATOM 1282 CD GLU A 90 9.895 22.929 26.595 1.00 32.41 C ATOM 1283 OE1 GLU A 90 9.141 23.389 25.712 1.00 34.55 O ATOM 1284 OE2 GLU A 90 10.346 21.765 26.548 1.00 15.02 O1- ATOM 0 H GLU A 90 14.129 24.562 28.123 1.00 62.24 H new ATOM 0 HA GLU A 90 11.812 26.041 28.877 1.00 33.11 H new ATOM 0 HB2 GLU A 90 11.910 24.829 26.784 1.00 62.35 H new ATOM 0 HB3 GLU A 90 12.372 23.342 27.586 1.00 62.35 H new ATOM 0 HG2 GLU A 90 10.113 23.295 28.693 1.00 2.12 H new ATOM 0 HG3 GLU A 90 9.666 24.710 27.761 1.00 2.12 H new ATOM 1291 N GLY A 91 12.732 23.660 30.832 1.00 4.53 N ATOM 1292 CA GLY A 91 12.430 22.925 32.049 1.00 50.31 C ATOM 1293 C GLY A 91 12.314 21.433 31.797 1.00 52.42 C ATOM 1294 O GLY A 91 11.500 20.750 32.422 1.00 50.31 O ATOM 0 H GLY A 91 13.700 23.582 30.520 1.00 4.53 H new ATOM 0 HA2 GLY A 91 13.211 23.109 32.787 1.00 50.31 H new ATOM 0 HA3 GLY A 91 11.497 23.295 32.474 1.00 50.31 H new ATOM 1298 N GLY A 92 13.127 20.931 30.871 1.00 31.10 N ATOM 1299 CA GLY A 92 13.127 19.512 30.555 1.00 44.24 C ATOM 1300 C GLY A 92 14.519 19.019 30.218 1.00 74.12 C ATOM 1301 O GLY A 92 15.485 19.374 30.896 1.00 42.22 O ATOM 0 H GLY A 92 13.790 21.486 30.330 1.00 31.10 H new ATOM 0 HA2 GLY A 92 12.736 18.949 31.403 1.00 44.24 H new ATOM 0 HA3 GLY A 92 12.460 19.325 29.713 1.00 44.24 H new ATOM 1305 N PHE A 93 14.633 18.223 29.163 1.00 65.13 N ATOM 1306 CA PHE A 93 15.927 17.710 28.709 1.00 72.25 C ATOM 1307 C PHE A 93 16.127 18.038 27.236 1.00 30.35 C ATOM 1308 O PHE A 93 15.170 18.366 26.530 1.00 35.35 O ATOM 1309 CB PHE A 93 16.026 16.195 28.931 1.00 70.53 C ATOM 1310 CG PHE A 93 16.021 15.794 30.387 1.00 33.33 C ATOM 1311 CD1 PHE A 93 14.890 15.240 30.972 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.153 15.976 31.170 1.00 64.21 C ATOM 1313 CE1 PHE A 93 14.889 14.878 32.306 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.157 15.615 32.504 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.024 15.065 33.073 1.00 12.34 C ATOM 0 H PHE A 93 13.841 17.915 28.599 1.00 65.13 H new ATOM 0 HA PHE A 93 16.711 18.191 29.294 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.192 15.707 28.426 1.00 70.53 H new ATOM 0 HB3 PHE A 93 16.940 15.827 28.465 1.00 70.53 H new ATOM 0 HD1 PHE A 93 14.001 15.090 30.378 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.042 16.405 30.731 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.002 14.449 32.749 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.045 15.763 33.101 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.025 14.782 34.115 1.00 12.34 H new ATOM 1325 N ALA A 94 17.370 17.950 26.776 1.00 73.43 N ATOM 1326 CA ALA A 94 17.704 18.288 25.403 1.00 60.33 C ATOM 1327 C ALA A 94 18.900 17.473 24.929 1.00 65.32 C ATOM 1328 O ALA A 94 19.796 17.144 25.719 1.00 32.10 O ATOM 1329 CB ALA A 94 17.977 19.785 25.283 1.00 64.21 C ATOM 0 H ALA A 94 18.164 17.646 27.339 1.00 73.43 H new ATOM 0 HA ALA A 94 16.857 18.042 24.763 1.00 60.33 H new ATOM 0 HB1 ALA A 94 18.226 20.028 24.250 1.00 64.21 H new ATOM 0 HB2 ALA A 94 17.089 20.342 25.582 1.00 64.21 H new ATOM 0 HB3 ALA A 94 18.811 20.056 25.931 1.00 64.21 H new ATOM 1335 N LEU A 95 18.897 17.153 23.637 1.00 31.23 N ATOM 1336 CA LEU A 95 19.924 16.310 23.035 1.00 75.45 C ATOM 1337 C LEU A 95 20.747 17.128 22.041 1.00 41.42 C ATOM 1338 O LEU A 95 20.192 17.878 21.234 1.00 2.34 O ATOM 1339 CB LEU A 95 19.267 15.102 22.331 1.00 51.22 C ATOM 1340 CG LEU A 95 19.953 13.742 22.558 1.00 42.15 C ATOM 1341 CD1 LEU A 95 21.370 13.728 21.987 1.00 64.34 C ATOM 1342 CD2 LEU A 95 19.959 13.402 24.047 1.00 71.23 C ATOM 0 H LEU A 95 18.184 17.470 22.980 1.00 31.23 H new ATOM 0 HA LEU A 95 20.588 15.937 23.815 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.233 15.027 22.668 1.00 51.22 H new ATOM 0 HB3 LEU A 95 19.240 15.300 21.259 1.00 51.22 H new ATOM 0 HG LEU A 95 19.384 12.979 22.027 1.00 42.15 H new ATOM 0 HD11 LEU A 95 21.824 12.753 22.165 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.332 13.920 20.915 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.966 14.500 22.473 1.00 64.34 H new ATOM 0 HD21 LEU A 95 20.446 12.439 24.198 1.00 71.23 H new ATOM 0 HD22 LEU A 95 20.502 14.173 24.594 1.00 71.23 H new ATOM 0 HD23 LEU A 95 18.933 13.351 24.413 1.00 71.23 H new ATOM 1354 N ASP A 96 22.060 16.972 22.109 1.00 51.32 N ATOM 1355 CA ASP A 96 22.987 17.710 21.254 1.00 15.24 C ATOM 1356 C ASP A 96 24.009 16.740 20.671 1.00 33.43 C ATOM 1357 O ASP A 96 24.824 16.183 21.408 1.00 1.11 O ATOM 1358 CB ASP A 96 23.701 18.790 22.077 1.00 62.10 C ATOM 1359 CG ASP A 96 24.384 19.841 21.211 1.00 42.14 C ATOM 1360 OD1 ASP A 96 25.572 19.661 20.874 1.00 0.44 O ATOM 1361 OD2 ASP A 96 23.738 20.860 20.869 1.00 11.32 O1- ATOM 0 H ASP A 96 22.517 16.331 22.758 1.00 51.32 H new ATOM 0 HA ASP A 96 22.438 18.189 20.444 1.00 15.24 H new ATOM 0 HB2 ASP A 96 22.978 19.279 22.730 1.00 62.10 H new ATOM 0 HB3 ASP A 96 24.444 18.318 22.720 1.00 62.10 H new ATOM 1366 N VAL A 97 23.962 16.511 19.361 1.00 3.45 N ATOM 1367 CA VAL A 97 24.823 15.505 18.737 1.00 33.41 C ATOM 1368 C VAL A 97 25.847 16.132 17.786 1.00 35.23 C ATOM 1369 O VAL A 97 25.493 16.760 16.791 1.00 5.33 O ATOM 1370 CB VAL A 97 23.988 14.424 17.995 1.00 12.11 C ATOM 1371 CG1 VAL A 97 22.925 15.059 17.107 1.00 31.40 C ATOM 1372 CG2 VAL A 97 24.890 13.495 17.179 1.00 41.42 C ATOM 0 H VAL A 97 23.344 17.002 18.715 1.00 3.45 H new ATOM 0 HA VAL A 97 25.372 15.022 19.545 1.00 33.41 H new ATOM 0 HB VAL A 97 23.480 13.826 18.751 1.00 12.11 H new ATOM 0 HG11 VAL A 97 22.358 14.277 16.602 1.00 31.40 H new ATOM 0 HG12 VAL A 97 22.251 15.658 17.719 1.00 31.40 H new ATOM 0 HG13 VAL A 97 23.405 15.697 16.364 1.00 31.40 H new ATOM 0 HG21 VAL A 97 24.279 12.749 16.671 1.00 41.42 H new ATOM 0 HG22 VAL A 97 25.440 14.078 16.440 1.00 41.42 H new ATOM 0 HG23 VAL A 97 25.594 12.995 17.844 1.00 41.42 H new ATOM 1382 N GLU A 98 27.120 15.953 18.115 1.00 23.12 N ATOM 1383 CA GLU A 98 28.228 16.398 17.278 1.00 44.32 C ATOM 1384 C GLU A 98 28.577 15.303 16.278 1.00 21.31 C ATOM 1385 O GLU A 98 29.180 14.291 16.641 1.00 34.12 O ATOM 1386 CB GLU A 98 29.455 16.732 18.145 1.00 13.10 C ATOM 1387 CG GLU A 98 29.230 17.887 19.115 1.00 35.31 C ATOM 1388 CD GLU A 98 30.423 18.145 20.025 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.442 18.693 19.547 1.00 51.52 O ATOM 1390 OE2 GLU A 98 30.341 17.817 21.224 1.00 21.24 O1- ATOM 0 H GLU A 98 27.415 15.492 18.976 1.00 23.12 H new ATOM 0 HA GLU A 98 27.931 17.299 16.741 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.740 15.845 18.711 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.293 16.976 17.492 1.00 13.10 H new ATOM 0 HG2 GLU A 98 29.011 18.792 18.548 1.00 35.31 H new ATOM 0 HG3 GLU A 98 28.353 17.674 19.727 1.00 35.31 H new ATOM 1397 N LEU A 99 28.179 15.490 15.027 1.00 4.53 N ATOM 1398 CA LEU A 99 28.421 14.494 13.994 1.00 32.31 C ATOM 1399 C LEU A 99 29.717 14.829 13.263 1.00 52.01 C ATOM 1400 O LEU A 99 29.801 15.833 12.546 1.00 21.43 O ATOM 1401 CB LEU A 99 27.239 14.426 13.014 1.00 42.25 C ATOM 1402 CG LEU A 99 27.128 13.117 12.216 1.00 64.41 C ATOM 1403 CD1 LEU A 99 26.893 11.933 13.158 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.013 13.212 11.175 1.00 23.33 C ATOM 0 H LEU A 99 27.687 16.323 14.704 1.00 4.53 H new ATOM 0 HA LEU A 99 28.519 13.513 14.459 1.00 32.31 H new ATOM 0 HB2 LEU A 99 26.315 14.572 13.573 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.321 15.256 12.312 1.00 42.25 H new ATOM 0 HG LEU A 99 28.069 12.954 11.690 1.00 64.41 H new ATOM 0 HD11 LEU A 99 26.817 11.015 12.576 1.00 73.33 H new ATOM 0 HD12 LEU A 99 27.726 11.852 13.856 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.968 12.088 13.714 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.951 12.275 10.621 1.00 23.33 H new ATOM 0 HD22 LEU A 99 25.063 13.401 11.675 1.00 23.33 H new ATOM 0 HD23 LEU A 99 26.228 14.028 10.485 1.00 23.33 H new ATOM 1416 N ARG A 100 30.726 13.994 13.474 1.00 15.15 N ATOM 1417 CA ARG A 100 32.066 14.236 12.949 1.00 11.05 C ATOM 1418 C ARG A 100 32.293 13.426 11.686 1.00 44.33 C ATOM 1419 O ARG A 100 32.153 12.202 11.694 1.00 60.34 O ATOM 1420 CB ARG A 100 33.113 13.870 14.004 1.00 62.13 C ATOM 1421 CG ARG A 100 32.826 14.501 15.357 1.00 11.51 C ATOM 1422 CD ARG A 100 33.893 14.181 16.391 1.00 61.51 C ATOM 1423 NE ARG A 100 33.548 14.731 17.708 1.00 42.53 N ATOM 1424 CZ ARG A 100 33.393 16.033 17.966 1.00 32.53 C ATOM 1425 NH1 ARG A 100 33.716 16.944 17.056 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 32.946 16.422 19.153 1.00 1.52 N ATOM 0 H ARG A 100 30.640 13.132 14.012 1.00 15.15 H new ATOM 0 HA ARG A 100 32.161 15.294 12.705 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.150 12.786 14.113 1.00 62.13 H new ATOM 0 HB3 ARG A 100 34.097 14.189 13.660 1.00 62.13 H new ATOM 0 HG2 ARG A 100 32.751 15.582 15.241 1.00 11.51 H new ATOM 0 HG3 ARG A 100 31.859 14.152 15.719 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.015 13.101 16.467 1.00 61.51 H new ATOM 0 HD3 ARG A 100 34.850 14.587 16.065 1.00 61.51 H new ATOM 0 HE ARG A 100 33.418 14.075 18.478 1.00 42.53 H new ATOM 0 HH11 ARG A 100 34.086 16.652 16.151 1.00 73.43 H new ATOM 0 HH12 ARG A 100 33.594 17.936 17.262 1.00 73.43 H new ATOM 0 HH21 ARG A 100 32.722 15.728 19.866 1.00 1.52 H new ATOM 0 HH22 ARG A 100 32.827 17.415 19.353 1.00 1.52 H new ATOM 1440 N VAL A 101 32.655 14.108 10.609 1.00 42.14 N ATOM 1441 CA VAL A 101 32.826 13.460 9.315 1.00 72.23 C ATOM 1442 C VAL A 101 34.293 13.464 8.912 1.00 42.25 C ATOM 1443 O VAL A 101 34.797 14.463 8.404 1.00 41.22 O ATOM 1444 CB VAL A 101 31.994 14.167 8.218 1.00 14.41 C ATOM 1445 CG1 VAL A 101 32.101 13.424 6.885 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.533 14.305 8.653 1.00 42.30 C ATOM 0 H VAL A 101 32.836 15.112 10.605 1.00 42.14 H new ATOM 0 HA VAL A 101 32.475 12.433 9.412 1.00 72.23 H new ATOM 0 HB VAL A 101 32.401 15.168 8.075 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.507 13.941 6.131 1.00 25.41 H new ATOM 0 HG12 VAL A 101 33.143 13.394 6.568 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.729 12.407 7.005 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.965 14.805 7.868 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.112 13.316 8.832 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.480 14.893 9.569 1.00 42.30 H new ATOM 1456 N ALA A 102 34.977 12.353 9.145 1.00 43.12 N ATOM 1457 CA ALA A 102 36.387 12.247 8.808 1.00 40.03 C ATOM 1458 C ALA A 102 36.544 11.683 7.404 1.00 12.52 C ATOM 1459 O ALA A 102 36.413 10.478 7.187 1.00 73.10 O ATOM 1460 CB ALA A 102 37.116 11.373 9.824 1.00 44.05 C ATOM 0 H ALA A 102 34.578 11.514 9.566 1.00 43.12 H new ATOM 0 HA ALA A 102 36.831 13.242 8.837 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.170 11.305 9.556 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.022 11.813 10.817 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.677 10.375 9.827 1.00 44.05 H new ATOM 1466 N LEU A 103 36.815 12.568 6.454 1.00 73.31 N ATOM 1467 CA LEU A 103 36.997 12.188 5.059 1.00 63.24 C ATOM 1468 C LEU A 103 38.443 12.421 4.640 1.00 11.33 C ATOM 1469 O LEU A 103 38.915 13.559 4.632 1.00 24.41 O ATOM 1470 CB LEU A 103 36.035 12.979 4.155 1.00 41.13 C ATOM 1471 CG LEU A 103 34.599 12.429 4.089 1.00 32.24 C ATOM 1472 CD1 LEU A 103 33.662 13.424 3.407 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.576 11.088 3.355 1.00 41.41 C ATOM 0 H LEU A 103 36.915 13.568 6.628 1.00 73.31 H new ATOM 0 HA LEU A 103 36.769 11.128 4.951 1.00 63.24 H new ATOM 0 HB2 LEU A 103 35.997 14.010 4.506 1.00 41.13 H new ATOM 0 HB3 LEU A 103 36.446 13.001 3.146 1.00 41.13 H new ATOM 0 HG LEU A 103 34.247 12.277 5.109 1.00 32.24 H new ATOM 0 HD11 LEU A 103 32.654 13.010 3.374 1.00 55.32 H new ATOM 0 HD12 LEU A 103 33.652 14.358 3.968 1.00 55.32 H new ATOM 0 HD13 LEU A 103 34.010 13.614 2.392 1.00 55.32 H new ATOM 0 HD21 LEU A 103 33.554 10.712 3.316 1.00 41.41 H new ATOM 0 HD22 LEU A 103 34.952 11.222 2.341 1.00 41.41 H new ATOM 0 HD23 LEU A 103 35.206 10.373 3.884 1.00 41.41 H new ATOM 1485 N PRO A 104 39.173 11.340 4.319 1.00 73.52 N ATOM 1486 CA PRO A 104 40.567 11.430 3.886 1.00 62.42 C ATOM 1487 C PRO A 104 40.685 11.965 2.466 1.00 45.15 C ATOM 1488 O PRO A 104 39.770 11.803 1.653 1.00 0.45 O ATOM 1489 CB PRO A 104 41.054 9.982 3.971 1.00 24.31 C ATOM 1490 CG PRO A 104 39.835 9.161 3.758 1.00 63.40 C ATOM 1491 CD PRO A 104 38.699 9.942 4.357 1.00 45.41 C ATOM 0 HA PRO A 104 41.152 12.119 4.496 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.809 9.773 3.213 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.508 9.773 4.940 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.667 8.980 2.696 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.933 8.186 4.236 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.781 9.815 3.784 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.486 9.620 5.376 1.00 45.41 H new ATOM 1499 N GLY A 105 41.810 12.604 2.181 1.00 54.45 N ATOM 1500 CA GLY A 105 42.034 13.181 0.868 1.00 13.33 C ATOM 1501 C GLY A 105 41.124 14.365 0.585 1.00 43.42 C ATOM 1502 O GLY A 105 40.993 14.795 -0.562 1.00 1.41 O ATOM 0 H GLY A 105 42.578 12.735 2.840 1.00 54.45 H new ATOM 0 HA2 GLY A 105 43.073 13.499 0.788 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.876 12.416 0.108 1.00 13.33 H new ATOM 1506 N LEU A 106 40.501 14.896 1.635 1.00 4.51 N ATOM 1507 CA LEU A 106 39.561 16.011 1.510 1.00 40.14 C ATOM 1508 C LEU A 106 39.960 17.147 2.448 1.00 43.11 C ATOM 1509 O LEU A 106 40.418 16.904 3.567 1.00 42.33 O ATOM 1510 CB LEU A 106 38.134 15.527 1.820 1.00 65.03 C ATOM 1511 CG LEU A 106 37.065 16.622 1.983 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.922 17.455 0.716 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.722 16.008 2.369 1.00 41.21 C ATOM 0 H LEU A 106 40.632 14.569 2.592 1.00 4.51 H new ATOM 0 HA LEU A 106 39.588 16.388 0.488 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.818 14.857 1.021 1.00 65.03 H new ATOM 0 HB3 LEU A 106 38.164 14.938 2.737 1.00 65.03 H new ATOM 0 HG LEU A 106 37.392 17.285 2.784 1.00 43.51 H new ATOM 0 HD11 LEU A 106 36.159 18.218 0.867 1.00 44.14 H new ATOM 0 HD12 LEU A 106 37.874 17.934 0.486 1.00 44.14 H new ATOM 0 HD13 LEU A 106 36.631 16.810 -0.113 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.979 16.798 2.480 1.00 41.21 H new ATOM 0 HD22 LEU A 106 35.402 15.315 1.591 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.825 15.472 3.312 1.00 41.21 H new ATOM 1525 N ASP A 107 39.809 18.385 1.980 1.00 72.42 N ATOM 1526 CA ASP A 107 40.161 19.563 2.776 1.00 14.02 C ATOM 1527 C ASP A 107 39.090 19.867 3.795 1.00 1.12 C ATOM 1528 O ASP A 107 37.958 19.420 3.665 1.00 10.24 O ATOM 1529 CB ASP A 107 40.306 20.810 1.903 1.00 13.35 C ATOM 1530 CG ASP A 107 41.365 21.763 2.436 1.00 12.43 C ATOM 1531 OD1 ASP A 107 41.010 22.669 3.220 1.00 14.01 O ATOM 1532 OD2 ASP A 107 42.557 21.599 2.096 1.00 2.52 O1- ATOM 0 H ASP A 107 39.445 18.600 1.052 1.00 72.42 H new ATOM 0 HA ASP A 107 41.108 19.328 3.262 1.00 14.02 H new ATOM 0 HB2 ASP A 107 40.565 20.512 0.887 1.00 13.35 H new ATOM 0 HB3 ASP A 107 39.348 21.327 1.849 1.00 13.35 H new ATOM 1537 N ALA A 108 39.450 20.680 4.770 1.00 41.30 N ATOM 1538 CA ALA A 108 38.490 21.243 5.698 1.00 54.32 C ATOM 1539 C ALA A 108 37.566 22.206 4.962 1.00 74.35 C ATOM 1540 O ALA A 108 36.352 22.174 5.143 1.00 33.14 O ATOM 1541 CB ALA A 108 39.223 21.972 6.806 1.00 73.33 C ATOM 0 H ALA A 108 40.414 20.968 4.940 1.00 41.30 H new ATOM 0 HA ALA A 108 37.892 20.441 6.132 1.00 54.32 H new ATOM 0 HB1 ALA A 108 38.500 22.395 7.503 1.00 73.33 H new ATOM 0 HB2 ALA A 108 39.871 21.273 7.335 1.00 73.33 H new ATOM 0 HB3 ALA A 108 39.826 22.773 6.378 1.00 73.33 H new ATOM 1547 N ALA A 109 38.164 23.046 4.115 1.00 23.13 N ATOM 1548 CA ALA A 109 37.427 24.077 3.388 1.00 64.13 C ATOM 1549 C ALA A 109 36.333 23.456 2.524 1.00 31.24 C ATOM 1550 O ALA A 109 35.171 23.861 2.583 1.00 41.21 O ATOM 1551 CB ALA A 109 38.379 24.906 2.530 1.00 33.23 C ATOM 0 H ALA A 109 39.164 23.030 3.916 1.00 23.13 H new ATOM 0 HA ALA A 109 36.952 24.734 4.116 1.00 64.13 H new ATOM 0 HB1 ALA A 109 37.815 25.670 1.995 1.00 33.23 H new ATOM 0 HB2 ALA A 109 39.122 25.384 3.169 1.00 33.23 H new ATOM 0 HB3 ALA A 109 38.881 24.257 1.813 1.00 33.23 H new ATOM 1557 N ALA A 110 36.714 22.458 1.736 1.00 73.25 N ATOM 1558 CA ALA A 110 35.768 21.768 0.868 1.00 12.34 C ATOM 1559 C ALA A 110 34.810 20.929 1.705 1.00 44.05 C ATOM 1560 O ALA A 110 33.593 20.947 1.490 1.00 34.04 O ATOM 1561 CB ALA A 110 36.510 20.903 -0.144 1.00 53.00 C ATOM 0 H ALA A 110 37.671 22.109 1.680 1.00 73.25 H new ATOM 0 HA ALA A 110 35.187 22.507 0.317 1.00 12.34 H new ATOM 0 HB1 ALA A 110 35.790 20.394 -0.785 1.00 53.00 H new ATOM 0 HB2 ALA A 110 37.158 21.532 -0.754 1.00 53.00 H new ATOM 0 HB3 ALA A 110 37.113 20.163 0.382 1.00 53.00 H new ATOM 1567 N ALA A 111 35.367 20.217 2.683 1.00 5.14 N ATOM 1568 CA ALA A 111 34.560 19.369 3.567 1.00 43.54 C ATOM 1569 C ALA A 111 33.432 20.157 4.233 1.00 4.44 C ATOM 1570 O ALA A 111 32.343 19.623 4.440 1.00 54.13 O ATOM 1571 CB ALA A 111 35.428 18.710 4.625 1.00 13.31 C ATOM 0 H ALA A 111 36.367 20.208 2.885 1.00 5.14 H new ATOM 0 HA ALA A 111 34.110 18.595 2.946 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.807 18.086 5.268 1.00 13.31 H new ATOM 0 HB2 ALA A 111 36.185 18.092 4.142 1.00 13.31 H new ATOM 0 HB3 ALA A 111 35.916 19.478 5.225 1.00 13.31 H new ATOM 1577 N LYS A 112 33.692 21.428 4.557 1.00 1.14 N ATOM 1578 CA LYS A 112 32.684 22.285 5.185 1.00 13.13 C ATOM 1579 C LYS A 112 31.383 22.273 4.386 1.00 74.23 C ATOM 1580 O LYS A 112 30.303 22.060 4.939 1.00 4.50 O ATOM 1581 CB LYS A 112 33.188 23.736 5.318 1.00 13.05 C ATOM 1582 CG LYS A 112 34.241 23.951 6.407 1.00 32.13 C ATOM 1583 CD LYS A 112 33.695 23.662 7.805 1.00 10.41 C ATOM 1584 CE LYS A 112 32.510 24.560 8.163 1.00 22.11 C ATOM 1585 NZ LYS A 112 32.867 26.005 8.161 1.00 2.23 N1+ ATOM 0 H LYS A 112 34.590 21.884 4.395 1.00 1.14 H new ATOM 0 HA LYS A 112 32.496 21.884 6.181 1.00 13.13 H new ATOM 0 HB2 LYS A 112 33.605 24.050 4.361 1.00 13.05 H new ATOM 0 HB3 LYS A 112 32.336 24.385 5.523 1.00 13.05 H new ATOM 0 HG2 LYS A 112 35.098 23.306 6.213 1.00 32.13 H new ATOM 0 HG3 LYS A 112 34.600 24.979 6.365 1.00 32.13 H new ATOM 0 HD2 LYS A 112 33.387 22.618 7.864 1.00 10.41 H new ATOM 0 HD3 LYS A 112 34.489 23.802 8.539 1.00 10.41 H new ATOM 0 HE2 LYS A 112 31.701 24.388 7.453 1.00 22.11 H new ATOM 0 HE3 LYS A 112 32.134 24.284 9.148 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 32.060 26.562 8.507 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 33.687 26.161 8.781 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 33.103 26.303 7.193 1.00 2.23 H new ATOM 1599 N THR A 113 31.496 22.484 3.078 1.00 31.43 N ATOM 1600 CA THR A 113 30.325 22.579 2.223 1.00 60.21 C ATOM 1601 C THR A 113 29.794 21.186 1.889 1.00 74.22 C ATOM 1602 O THR A 113 28.580 20.972 1.807 1.00 73.22 O ATOM 1603 CB THR A 113 30.634 23.361 0.919 1.00 31.33 C ATOM 1604 OG1 THR A 113 29.424 23.886 0.352 1.00 10.35 O ATOM 1605 CG2 THR A 113 31.317 22.478 -0.114 1.00 32.43 C ATOM 0 H THR A 113 32.386 22.592 2.591 1.00 31.43 H new ATOM 0 HA THR A 113 29.560 23.130 2.771 1.00 60.21 H new ATOM 0 HB THR A 113 31.307 24.177 1.184 1.00 31.33 H new ATOM 0 HG1 THR A 113 29.634 24.378 -0.469 1.00 10.35 H new ATOM 0 HG21 THR A 113 31.518 23.059 -1.014 1.00 32.43 H new ATOM 0 HG22 THR A 113 32.256 22.102 0.292 1.00 32.43 H new ATOM 0 HG23 THR A 113 30.667 21.639 -0.362 1.00 32.43 H new ATOM 1613 N LEU A 114 30.715 20.235 1.715 1.00 23.12 N ATOM 1614 CA LEU A 114 30.343 18.871 1.357 1.00 20.51 C ATOM 1615 C LEU A 114 29.456 18.249 2.431 1.00 41.04 C ATOM 1616 O LEU A 114 28.383 17.734 2.129 1.00 13.34 O ATOM 1617 CB LEU A 114 31.587 18.000 1.117 1.00 61.01 C ATOM 1618 CG LEU A 114 32.501 18.462 -0.032 1.00 11.45 C ATOM 1619 CD1 LEU A 114 33.554 17.403 -0.349 1.00 1.51 C ATOM 1620 CD2 LEU A 114 31.683 18.805 -1.274 1.00 50.51 C ATOM 0 H LEU A 114 31.719 20.387 1.816 1.00 23.12 H new ATOM 0 HA LEU A 114 29.777 18.917 0.427 1.00 20.51 H new ATOM 0 HB2 LEU A 114 32.173 17.971 2.036 1.00 61.01 H new ATOM 0 HB3 LEU A 114 31.262 16.980 0.913 1.00 61.01 H new ATOM 0 HG LEU A 114 33.018 19.366 0.291 1.00 11.45 H new ATOM 0 HD11 LEU A 114 34.188 17.753 -1.164 1.00 1.51 H new ATOM 0 HD12 LEU A 114 34.166 17.223 0.535 1.00 1.51 H new ATOM 0 HD13 LEU A 114 33.061 16.477 -0.644 1.00 1.51 H new ATOM 0 HD21 LEU A 114 32.351 19.129 -2.072 1.00 50.51 H new ATOM 0 HD22 LEU A 114 31.129 17.924 -1.600 1.00 50.51 H new ATOM 0 HD23 LEU A 114 30.983 19.607 -1.039 1.00 50.51 H new ATOM 1632 N VAL A 115 29.900 18.320 3.682 1.00 72.22 N ATOM 1633 CA VAL A 115 29.132 17.783 4.804 1.00 32.34 C ATOM 1634 C VAL A 115 27.804 18.524 4.946 1.00 1.13 C ATOM 1635 O VAL A 115 26.764 17.918 5.229 1.00 25.22 O ATOM 1636 CB VAL A 115 29.928 17.878 6.131 1.00 63.01 C ATOM 1637 CG1 VAL A 115 29.080 17.414 7.314 1.00 14.41 C ATOM 1638 CG2 VAL A 115 31.216 17.064 6.040 1.00 35.24 C ATOM 0 H VAL A 115 30.789 18.745 3.946 1.00 72.22 H new ATOM 0 HA VAL A 115 28.937 16.731 4.595 1.00 32.34 H new ATOM 0 HB VAL A 115 30.189 18.923 6.295 1.00 63.01 H new ATOM 0 HG11 VAL A 115 29.663 17.491 8.232 1.00 14.41 H new ATOM 0 HG12 VAL A 115 28.193 18.042 7.394 1.00 14.41 H new ATOM 0 HG13 VAL A 115 28.779 16.378 7.161 1.00 14.41 H new ATOM 0 HG21 VAL A 115 31.763 17.142 6.980 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.973 16.019 5.847 1.00 35.24 H new ATOM 0 HG23 VAL A 115 31.833 17.449 5.228 1.00 35.24 H new ATOM 1648 N ASP A 116 27.849 19.835 4.724 1.00 34.11 N ATOM 1649 CA ASP A 116 26.664 20.685 4.822 1.00 22.44 C ATOM 1650 C ASP A 116 25.553 20.157 3.924 1.00 4.20 C ATOM 1651 O ASP A 116 24.468 19.803 4.393 1.00 63.50 O ATOM 1652 CB ASP A 116 26.998 22.124 4.413 1.00 1.42 C ATOM 1653 CG ASP A 116 25.797 23.051 4.530 1.00 43.12 C ATOM 1654 OD1 ASP A 116 25.520 23.548 5.643 1.00 62.34 O ATOM 1655 OD2 ASP A 116 25.116 23.286 3.508 1.00 50.12 O1- ATOM 0 H ASP A 116 28.701 20.336 4.473 1.00 34.11 H new ATOM 0 HA ASP A 116 26.328 20.673 5.859 1.00 22.44 H new ATOM 0 HB2 ASP A 116 27.806 22.499 5.040 1.00 1.42 H new ATOM 0 HB3 ASP A 116 27.362 22.132 3.386 1.00 1.42 H new ATOM 1660 N ARG A 117 25.843 20.088 2.630 1.00 43.12 N ATOM 1661 CA ARG A 117 24.860 19.652 1.651 1.00 25.23 C ATOM 1662 C ARG A 117 24.564 18.167 1.811 1.00 51.42 C ATOM 1663 O ARG A 117 23.433 17.722 1.604 1.00 42.42 O ATOM 1664 CB ARG A 117 25.372 19.952 0.245 1.00 4.30 C ATOM 1665 CG ARG A 117 26.711 19.298 -0.065 1.00 3.24 C ATOM 1666 CD ARG A 117 27.325 19.854 -1.335 1.00 12.41 C ATOM 1667 NE ARG A 117 26.495 19.579 -2.512 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.401 20.388 -3.571 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.113 21.505 -3.625 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.601 20.073 -4.583 1.00 65.24 N ATOM 0 H ARG A 117 26.752 20.329 2.236 1.00 43.12 H new ATOM 0 HA ARG A 117 23.930 20.197 1.814 1.00 25.23 H new ATOM 0 HB2 ARG A 117 24.634 19.613 -0.482 1.00 4.30 H new ATOM 0 HB3 ARG A 117 25.467 21.031 0.124 1.00 4.30 H new ATOM 0 HG2 ARG A 117 27.395 19.455 0.769 1.00 3.24 H new ATOM 0 HG3 ARG A 117 26.575 18.221 -0.167 1.00 3.24 H new ATOM 0 HD2 ARG A 117 27.461 20.930 -1.231 1.00 12.41 H new ATOM 0 HD3 ARG A 117 28.314 19.420 -1.480 1.00 12.41 H new ATOM 0 HE ARG A 117 25.954 18.714 -2.523 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.736 21.750 -2.856 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.038 22.119 -4.436 1.00 44.31 H new ATOM 0 HH21 ARG A 117 25.056 19.211 -4.553 1.00 65.24 H new ATOM 0 HH22 ARG A 117 25.531 20.693 -5.390 1.00 65.24 H new ATOM 1684 N ALA A 118 25.590 17.408 2.189 1.00 40.10 N ATOM 1685 CA ALA A 118 25.449 15.971 2.434 1.00 45.33 C ATOM 1686 C ALA A 118 24.398 15.712 3.505 1.00 63.41 C ATOM 1687 O ALA A 118 23.619 14.765 3.414 1.00 0.11 O ATOM 1688 CB ALA A 118 26.785 15.356 2.842 1.00 44.02 C ATOM 0 H ALA A 118 26.534 17.765 2.334 1.00 40.10 H new ATOM 0 HA ALA A 118 25.124 15.500 1.506 1.00 45.33 H new ATOM 0 HB1 ALA A 118 26.655 14.288 3.019 1.00 44.02 H new ATOM 0 HB2 ALA A 118 27.513 15.506 2.045 1.00 44.02 H new ATOM 0 HB3 ALA A 118 27.142 15.834 3.754 1.00 44.02 H new ATOM 1694 N HIS A 119 24.359 16.592 4.500 1.00 52.13 N ATOM 1695 CA HIS A 119 23.428 16.461 5.616 1.00 15.33 C ATOM 1696 C HIS A 119 21.979 16.664 5.155 1.00 0.40 C ATOM 1697 O HIS A 119 21.043 16.448 5.924 1.00 63.33 O ATOM 1698 CB HIS A 119 23.785 17.471 6.716 1.00 54.45 C ATOM 1699 CG HIS A 119 23.283 17.093 8.079 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.566 17.944 8.892 1.00 2.34 N ATOM 1701 CD2 HIS A 119 23.435 15.948 8.783 1.00 20.34 C ATOM 1702 CE1 HIS A 119 22.299 17.336 10.036 1.00 52.23 C ATOM 1703 NE2 HIS A 119 22.814 16.124 9.993 1.00 74.13 N ATOM 0 H HIS A 119 24.966 17.410 4.556 1.00 52.13 H new ATOM 0 HA HIS A 119 23.513 15.451 6.017 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.869 17.580 6.757 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.376 18.445 6.447 1.00 54.45 H new ATOM 0 HD2 HIS A 119 23.951 15.058 8.453 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.752 17.761 10.865 1.00 52.23 H new ATOM 0 HE2 HIS A 119 22.760 15.430 10.738 1.00 74.13 H new ATOM 1712 N HIS A 120 21.805 17.114 3.909 1.00 43.52 N ATOM 1713 CA HIS A 120 20.473 17.267 3.313 1.00 31.45 C ATOM 1714 C HIS A 120 20.219 16.210 2.232 1.00 61.14 C ATOM 1715 O HIS A 120 19.129 15.641 2.156 1.00 43.11 O ATOM 1716 CB HIS A 120 20.299 18.676 2.717 1.00 2.24 C ATOM 1717 CG HIS A 120 18.964 18.904 2.064 1.00 45.12 C ATOM 1718 ND1 HIS A 120 18.755 19.871 1.107 1.00 44.32 N ATOM 1719 CD2 HIS A 120 17.765 18.291 2.237 1.00 50.50 C ATOM 1720 CE1 HIS A 120 17.494 19.842 0.719 1.00 65.24 C ATOM 1721 NE2 HIS A 120 16.870 18.891 1.388 1.00 75.14 N ATOM 0 H HIS A 120 22.572 17.380 3.291 1.00 43.52 H new ATOM 0 HA HIS A 120 19.742 17.126 4.110 1.00 31.45 H new ATOM 0 HB2 HIS A 120 20.435 19.413 3.508 1.00 2.24 H new ATOM 0 HB3 HIS A 120 21.085 18.848 1.982 1.00 2.24 H new ATOM 0 HD2 HIS A 120 17.554 17.480 2.918 1.00 50.50 H new ATOM 0 HE1 HIS A 120 17.047 20.488 -0.022 1.00 65.24 H new ATOM 0 HE2 HIS A 120 15.885 18.643 1.290 1.00 75.14 H new ATOM 1730 N VAL A 121 21.218 15.959 1.389 1.00 33.11 N ATOM 1731 CA VAL A 121 21.046 15.050 0.253 1.00 23.21 C ATOM 1732 C VAL A 121 21.197 13.585 0.674 1.00 3.02 C ATOM 1733 O VAL A 121 20.725 12.684 -0.019 1.00 30.52 O ATOM 1734 CB VAL A 121 22.037 15.364 -0.899 1.00 61.42 C ATOM 1735 CG1 VAL A 121 21.859 16.802 -1.389 1.00 74.54 C ATOM 1736 CG2 VAL A 121 23.480 15.110 -0.473 1.00 44.31 C ATOM 0 H VAL A 121 22.149 16.368 1.468 1.00 33.11 H new ATOM 0 HA VAL A 121 20.031 15.209 -0.112 1.00 23.21 H new ATOM 0 HB VAL A 121 21.812 14.690 -1.726 1.00 61.42 H new ATOM 0 HG11 VAL A 121 22.563 17.001 -2.197 1.00 74.54 H new ATOM 0 HG12 VAL A 121 20.841 16.939 -1.754 1.00 74.54 H new ATOM 0 HG13 VAL A 121 22.046 17.492 -0.566 1.00 74.54 H new ATOM 0 HG21 VAL A 121 24.150 15.339 -1.302 1.00 44.31 H new ATOM 0 HG22 VAL A 121 23.725 15.745 0.378 1.00 44.31 H new ATOM 0 HG23 VAL A 121 23.597 14.064 -0.190 1.00 44.31 H new ATOM 1746 N CYS A 122 21.834 13.358 1.820 1.00 31.44 N ATOM 1747 CA CYS A 122 22.057 12.004 2.329 1.00 53.14 C ATOM 1748 C CYS A 122 21.896 11.958 3.855 1.00 23.34 C ATOM 1749 O CYS A 122 22.814 11.558 4.574 1.00 24.32 O ATOM 1750 CB CYS A 122 23.458 11.525 1.922 1.00 50.43 C ATOM 1751 SG CYS A 122 23.862 9.855 2.478 1.00 72.12 S ATOM 0 H CYS A 122 22.207 14.096 2.417 1.00 31.44 H new ATOM 0 HA CYS A 122 21.310 11.339 1.895 1.00 53.14 H new ATOM 0 HB2 CYS A 122 23.541 11.564 0.836 1.00 50.43 H new ATOM 0 HB3 CYS A 122 24.197 12.218 2.324 1.00 50.43 H new ATOM 0 HG CYS A 122 23.677 9.768 3.762 1.00 72.12 H new ATOM 1757 N PRO A 123 20.722 12.372 4.377 1.00 50.40 N ATOM 1758 CA PRO A 123 20.443 12.382 5.803 1.00 60.03 C ATOM 1759 C PRO A 123 19.609 11.176 6.238 1.00 74.45 C ATOM 1760 O PRO A 123 19.410 10.232 5.472 1.00 30.15 O ATOM 1761 CB PRO A 123 19.622 13.663 5.923 1.00 24.23 C ATOM 1762 CG PRO A 123 18.802 13.693 4.665 1.00 34.14 C ATOM 1763 CD PRO A 123 19.557 12.875 3.628 1.00 45.03 C ATOM 0 HA PRO A 123 21.338 12.338 6.424 1.00 60.03 H new ATOM 0 HB2 PRO A 123 18.990 13.649 6.811 1.00 24.23 H new ATOM 0 HB3 PRO A 123 20.263 14.541 6.002 1.00 24.23 H new ATOM 0 HG2 PRO A 123 17.811 13.275 4.840 1.00 34.14 H new ATOM 0 HG3 PRO A 123 18.660 14.717 4.321 1.00 34.14 H new ATOM 0 HD2 PRO A 123 18.948 12.060 3.237 1.00 45.03 H new ATOM 0 HD3 PRO A 123 19.859 13.485 2.776 1.00 45.03 H new ATOM 1771 N TYR A 124 19.118 11.222 7.473 1.00 53.44 N ATOM 1772 CA TYR A 124 18.187 10.212 7.966 1.00 1.24 C ATOM 1773 C TYR A 124 16.768 10.794 7.956 1.00 42.34 C ATOM 1774 O TYR A 124 15.793 10.100 8.236 1.00 23.13 O ATOM 1775 CB TYR A 124 18.595 9.750 9.382 1.00 65.44 C ATOM 1776 CG TYR A 124 18.389 8.262 9.634 1.00 10.42 C ATOM 1777 CD1 TYR A 124 18.133 7.765 10.913 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.465 7.349 8.584 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.962 6.412 11.127 1.00 14.31 C ATOM 1780 CE2 TYR A 124 18.292 5.997 8.796 1.00 12.12 C ATOM 1781 CZ TYR A 124 18.042 5.533 10.068 1.00 5.42 C ATOM 1782 OH TYR A 124 17.875 4.184 10.282 1.00 60.35 O ATOM 0 H TYR A 124 19.349 11.948 8.151 1.00 53.44 H new ATOM 0 HA TYR A 124 18.213 9.337 7.317 1.00 1.24 H new ATOM 0 HB2 TYR A 124 19.645 9.993 9.543 1.00 65.44 H new ATOM 0 HB3 TYR A 124 18.021 10.315 10.116 1.00 65.44 H new ATOM 0 HD1 TYR A 124 18.068 8.448 11.747 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.663 7.707 7.585 1.00 13.25 H new ATOM 0 HE1 TYR A 124 17.766 6.043 12.123 1.00 14.31 H new ATOM 0 HE2 TYR A 124 18.352 5.306 7.968 1.00 12.12 H new ATOM 0 HH TYR A 124 18.739 3.730 10.196 1.00 60.35 H new ATOM 1792 N SER A 125 16.692 12.086 7.615 1.00 23.21 N ATOM 1793 CA SER A 125 15.438 12.841 7.534 1.00 62.44 C ATOM 1794 C SER A 125 15.767 14.322 7.333 1.00 2.13 C ATOM 1795 O SER A 125 16.907 14.734 7.548 1.00 5.11 O ATOM 1796 CB SER A 125 14.599 12.664 8.812 1.00 61.32 C ATOM 1797 OG SER A 125 13.408 13.432 8.760 1.00 44.54 O ATOM 0 H SER A 125 17.514 12.644 7.384 1.00 23.21 H new ATOM 0 HA SER A 125 14.853 12.465 6.694 1.00 62.44 H new ATOM 0 HB2 SER A 125 14.349 11.611 8.942 1.00 61.32 H new ATOM 0 HB3 SER A 125 15.188 12.961 9.680 1.00 61.32 H new ATOM 0 HG SER A 125 12.896 13.298 9.585 1.00 44.54 H new ATOM 1803 N ASN A 126 14.791 15.123 6.921 1.00 23.44 N ATOM 1804 CA ASN A 126 14.981 16.575 6.834 1.00 73.42 C ATOM 1805 C ASN A 126 15.022 17.148 8.246 1.00 24.25 C ATOM 1806 O ASN A 126 15.739 18.110 8.533 1.00 64.13 O ATOM 1807 CB ASN A 126 13.869 17.253 6.016 1.00 54.23 C ATOM 1808 CG ASN A 126 12.504 17.179 6.691 1.00 23.41 C ATOM 1809 OD1 ASN A 126 12.188 16.205 7.370 1.00 4.50 O ATOM 1810 ND2 ASN A 126 11.694 18.213 6.518 1.00 5.31 N ATOM 0 H ASN A 126 13.865 14.799 6.643 1.00 23.44 H new ATOM 0 HA ASN A 126 15.921 16.772 6.318 1.00 73.42 H new ATOM 0 HB2 ASN A 126 14.131 18.298 5.853 1.00 54.23 H new ATOM 0 HB3 ASN A 126 13.809 16.782 5.035 1.00 54.23 H new ATOM 0 HD21 ASN A 126 10.773 18.218 6.956 1.00 5.31 H new ATOM 0 HD22 ASN A 126 11.992 19.004 5.947 1.00 5.31 H new ATOM 1817 N ALA A 127 14.276 16.503 9.132 1.00 54.04 N ATOM 1818 CA ALA A 127 14.172 16.900 10.530 1.00 54.10 C ATOM 1819 C ALA A 127 15.461 16.604 11.300 1.00 52.15 C ATOM 1820 O ALA A 127 15.531 16.798 12.508 1.00 1.24 O ATOM 1821 CB ALA A 127 12.987 16.186 11.174 1.00 41.33 C ATOM 0 H ALA A 127 13.720 15.681 8.898 1.00 54.04 H new ATOM 0 HA ALA A 127 14.014 17.978 10.570 1.00 54.10 H new ATOM 0 HB1 ALA A 127 12.908 16.482 12.220 1.00 41.33 H new ATOM 0 HB2 ALA A 127 12.070 16.457 10.650 1.00 41.33 H new ATOM 0 HB3 ALA A 127 13.135 15.108 11.113 1.00 41.33 H new ATOM 1827 N THR A 128 16.502 16.180 10.595 1.00 1.20 N ATOM 1828 CA THR A 128 17.712 15.708 11.243 1.00 2.03 C ATOM 1829 C THR A 128 18.673 16.870 11.376 1.00 41.31 C ATOM 1830 O THR A 128 19.776 16.729 11.900 1.00 64.41 O ATOM 1831 CB THR A 128 18.385 14.559 10.442 1.00 53.22 C ATOM 1832 OG1 THR A 128 19.264 13.810 11.288 1.00 44.43 O ATOM 1833 CG2 THR A 128 19.185 15.095 9.255 1.00 73.21 C ATOM 0 H THR A 128 16.530 16.154 9.576 1.00 1.20 H new ATOM 0 HA THR A 128 17.449 15.311 12.224 1.00 2.03 H new ATOM 0 HB THR A 128 17.587 13.917 10.068 1.00 53.22 H new ATOM 0 HG1 THR A 128 20.141 13.729 10.858 1.00 44.43 H new ATOM 0 HG21 THR A 128 19.641 14.263 8.718 1.00 73.21 H new ATOM 0 HG22 THR A 128 18.520 15.639 8.584 1.00 73.21 H new ATOM 0 HG23 THR A 128 19.965 15.766 9.615 1.00 73.21 H new ATOM 1841 N ARG A 129 18.244 18.020 10.864 1.00 15.30 N ATOM 1842 CA ARG A 129 19.070 19.213 10.886 1.00 1.24 C ATOM 1843 C ARG A 129 18.327 20.407 11.489 1.00 21.22 C ATOM 1844 O ARG A 129 18.872 21.120 12.330 1.00 60.25 O ATOM 1845 CB ARG A 129 19.563 19.513 9.465 1.00 61.34 C ATOM 1846 CG ARG A 129 18.473 19.871 8.464 1.00 45.30 C ATOM 1847 CD ARG A 129 19.053 20.148 7.081 1.00 1.10 C ATOM 1848 NE ARG A 129 20.141 21.129 7.128 1.00 10.14 N ATOM 1849 CZ ARG A 129 20.797 21.581 6.055 1.00 72.04 C ATOM 1850 NH1 ARG A 129 20.398 21.248 4.833 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 21.831 22.397 6.203 1.00 55.55 N ATOM 0 H ARG A 129 17.330 18.146 10.430 1.00 15.30 H new ATOM 0 HA ARG A 129 19.931 19.032 11.529 1.00 1.24 H new ATOM 0 HB2 ARG A 129 20.277 20.336 9.511 1.00 61.34 H new ATOM 0 HB3 ARG A 129 20.104 18.643 9.094 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.753 19.055 8.401 1.00 45.30 H new ATOM 0 HG3 ARG A 129 17.930 20.749 8.814 1.00 45.30 H new ATOM 0 HD2 ARG A 129 19.422 19.218 6.650 1.00 1.10 H new ATOM 0 HD3 ARG A 129 18.264 20.513 6.423 1.00 1.10 H new ATOM 0 HE ARG A 129 20.416 21.491 8.041 1.00 10.14 H new ATOM 0 HH11 ARG A 129 19.586 20.643 4.709 1.00 12.15 H new ATOM 0 HH12 ARG A 129 20.904 21.597 4.019 1.00 12.15 H new ATOM 0 HH21 ARG A 129 22.127 22.681 7.137 1.00 55.55 H new ATOM 0 HH22 ARG A 129 22.331 22.741 5.383 1.00 55.55 H new ATOM 1865 N ASN A 130 17.086 20.630 11.058 1.00 53.23 N ATOM 1866 CA ASN A 130 16.271 21.721 11.608 1.00 71.44 C ATOM 1867 C ASN A 130 15.689 21.334 12.962 1.00 71.52 C ATOM 1868 O ASN A 130 15.760 22.090 13.932 1.00 41.25 O ATOM 1869 CB ASN A 130 15.141 22.119 10.656 1.00 51.21 C ATOM 1870 CG ASN A 130 14.687 20.954 9.837 1.00 65.44 C ATOM 1871 OD1 ASN A 130 13.781 20.209 10.210 1.00 64.05 O ATOM 1872 ND2 ASN A 130 15.347 20.778 8.719 1.00 32.23 N ATOM 0 H ASN A 130 16.623 20.077 10.336 1.00 53.23 H new ATOM 0 HA ASN A 130 16.930 22.580 11.734 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.302 22.513 11.229 1.00 51.21 H new ATOM 0 HB3 ASN A 130 15.481 22.919 9.998 1.00 51.21 H new ATOM 0 HD21 ASN A 130 15.118 19.993 8.110 1.00 32.23 H new ATOM 0 HD22 ASN A 130 16.090 21.426 8.458 1.00 32.23 H new ATOM 1879 N ASN A 131 15.113 20.144 13.003 1.00 23.53 N ATOM 1880 CA ASN A 131 14.411 19.648 14.183 1.00 43.51 C ATOM 1881 C ASN A 131 15.398 19.155 15.245 1.00 71.03 C ATOM 1882 O ASN A 131 15.243 19.445 16.434 1.00 72.12 O ATOM 1883 CB ASN A 131 13.469 18.517 13.757 1.00 43.33 C ATOM 1884 CG ASN A 131 12.517 18.050 14.848 1.00 4.41 C ATOM 1885 OD1 ASN A 131 12.130 16.884 14.873 1.00 52.34 O ATOM 1886 ND2 ASN A 131 12.115 18.947 15.740 1.00 53.22 N ATOM 0 H ASN A 131 15.117 19.491 12.220 1.00 23.53 H new ATOM 0 HA ASN A 131 13.835 20.460 14.626 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.885 18.850 12.899 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.067 17.668 13.425 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.464 18.677 16.477 1.00 53.22 H new ATOM 0 HD22 ASN A 131 12.457 19.906 15.688 1.00 53.22 H new ATOM 1893 N VAL A 132 16.420 18.419 14.807 1.00 22.24 N ATOM 1894 CA VAL A 132 17.420 17.857 15.717 1.00 51.15 C ATOM 1895 C VAL A 132 18.702 18.689 15.682 1.00 30.12 C ATOM 1896 O VAL A 132 19.170 19.076 14.610 1.00 33.10 O ATOM 1897 CB VAL A 132 17.751 16.382 15.358 1.00 54.43 C ATOM 1898 CG1 VAL A 132 18.790 15.801 16.319 1.00 31.31 C ATOM 1899 CG2 VAL A 132 16.480 15.531 15.358 1.00 70.22 C ATOM 0 H VAL A 132 16.578 18.197 13.824 1.00 22.24 H new ATOM 0 HA VAL A 132 16.997 17.881 16.721 1.00 51.15 H new ATOM 0 HB VAL A 132 18.177 16.367 14.355 1.00 54.43 H new ATOM 0 HG11 VAL A 132 19.002 14.768 16.044 1.00 31.31 H new ATOM 0 HG12 VAL A 132 19.707 16.388 16.262 1.00 31.31 H new ATOM 0 HG13 VAL A 132 18.402 15.833 17.337 1.00 31.31 H new ATOM 0 HG21 VAL A 132 16.732 14.501 15.104 1.00 70.22 H new ATOM 0 HG22 VAL A 132 16.023 15.560 16.347 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.779 15.925 14.622 1.00 70.22 H new ATOM 1909 N ALA A 133 19.261 18.956 16.861 1.00 44.32 N ATOM 1910 CA ALA A 133 20.475 19.756 16.983 1.00 45.42 C ATOM 1911 C ALA A 133 21.715 18.907 16.735 1.00 30.31 C ATOM 1912 O ALA A 133 22.172 18.167 17.617 1.00 14.22 O ATOM 1913 CB ALA A 133 20.540 20.419 18.357 1.00 22.23 C ATOM 0 H ALA A 133 18.888 18.626 17.751 1.00 44.32 H new ATOM 0 HA ALA A 133 20.446 20.537 16.223 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.451 21.012 18.432 1.00 22.23 H new ATOM 0 HB2 ALA A 133 19.674 21.067 18.490 1.00 22.23 H new ATOM 0 HB3 ALA A 133 20.541 19.652 19.131 1.00 22.23 H new ATOM 1919 N VAL A 134 22.244 19.003 15.521 1.00 55.21 N ATOM 1920 CA VAL A 134 23.428 18.253 15.139 1.00 14.23 C ATOM 1921 C VAL A 134 24.571 19.190 14.769 1.00 75.02 C ATOM 1922 O VAL A 134 24.493 19.920 13.775 1.00 44.45 O ATOM 1923 CB VAL A 134 23.158 17.307 13.946 1.00 13.33 C ATOM 1924 CG1 VAL A 134 24.336 16.355 13.761 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.853 16.538 14.134 1.00 40.12 C ATOM 0 H VAL A 134 21.867 19.597 14.783 1.00 55.21 H new ATOM 0 HA VAL A 134 23.704 17.653 16.006 1.00 14.23 H new ATOM 0 HB VAL A 134 23.051 17.909 13.044 1.00 13.33 H new ATOM 0 HG11 VAL A 134 24.139 15.692 12.919 1.00 2.32 H new ATOM 0 HG12 VAL A 134 25.241 16.930 13.566 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.471 15.762 14.666 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.691 15.882 13.279 1.00 40.12 H new ATOM 0 HG22 VAL A 134 21.910 15.941 15.044 1.00 40.12 H new ATOM 0 HG23 VAL A 134 21.024 17.242 14.213 1.00 40.12 H new ATOM 1935 N ARG A 135 25.627 19.166 15.577 1.00 5.32 N ATOM 1936 CA ARG A 135 26.830 19.935 15.298 1.00 35.41 C ATOM 1937 C ARG A 135 27.609 19.252 14.180 1.00 62.34 C ATOM 1938 O ARG A 135 28.241 18.220 14.407 1.00 24.24 O ATOM 1939 CB ARG A 135 27.727 20.022 16.544 1.00 72.41 C ATOM 1940 CG ARG A 135 26.989 20.312 17.845 1.00 24.53 C ATOM 1941 CD ARG A 135 26.441 21.729 17.908 1.00 72.30 C ATOM 1942 NE ARG A 135 25.772 21.972 19.183 1.00 54.11 N ATOM 1943 CZ ARG A 135 25.948 23.052 19.940 1.00 2.05 C ATOM 1944 NH1 ARG A 135 26.813 23.994 19.580 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 25.268 23.170 21.070 1.00 32.21 N ATOM 0 H ARG A 135 25.671 18.617 16.436 1.00 5.32 H new ATOM 0 HA ARG A 135 26.537 20.943 15.004 1.00 35.41 H new ATOM 0 HB2 ARG A 135 28.267 19.082 16.651 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.472 20.801 16.384 1.00 72.41 H new ATOM 0 HG2 ARG A 135 26.168 19.604 17.957 1.00 24.53 H new ATOM 0 HG3 ARG A 135 27.665 20.151 18.685 1.00 24.53 H new ATOM 0 HD2 ARG A 135 27.253 22.444 17.777 1.00 72.30 H new ATOM 0 HD3 ARG A 135 25.740 21.889 17.089 1.00 72.30 H new ATOM 0 HE ARG A 135 25.122 21.261 19.518 1.00 54.11 H new ATOM 0 HH11 ARG A 135 27.348 23.892 18.718 1.00 12.22 H new ATOM 0 HH12 ARG A 135 26.942 24.819 20.166 1.00 12.22 H new ATOM 0 HH21 ARG A 135 24.617 22.437 21.352 1.00 32.21 H new ATOM 0 HH22 ARG A 135 25.395 23.994 21.658 1.00 32.21 H new ATOM 1959 N LEU A 136 27.540 19.794 12.974 1.00 14.32 N ATOM 1960 CA LEU A 136 28.301 19.245 11.864 1.00 2.32 C ATOM 1961 C LEU A 136 29.760 19.664 11.972 1.00 50.04 C ATOM 1962 O LEU A 136 30.102 20.836 11.788 1.00 1.31 O ATOM 1963 CB LEU A 136 27.699 19.670 10.519 1.00 33.50 C ATOM 1964 CG LEU A 136 26.417 18.916 10.126 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.911 19.372 8.762 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.659 17.405 10.135 1.00 32.41 C ATOM 0 H LEU A 136 26.970 20.607 12.740 1.00 14.32 H new ATOM 0 HA LEU A 136 28.251 18.157 11.914 1.00 2.32 H new ATOM 0 HB2 LEU A 136 27.481 20.737 10.554 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.446 19.523 9.739 1.00 33.50 H new ATOM 0 HG LEU A 136 25.649 19.147 10.864 1.00 40.54 H new ATOM 0 HD11 LEU A 136 25.004 18.823 8.508 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.693 20.439 8.793 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.674 19.180 8.008 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.741 16.888 9.855 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.447 17.158 9.423 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.962 17.091 11.134 1.00 32.41 H new ATOM 1978 N VAL A 137 30.605 18.697 12.303 1.00 24.14 N ATOM 1979 CA VAL A 137 32.033 18.921 12.465 1.00 11.21 C ATOM 1980 C VAL A 137 32.804 18.050 11.479 1.00 22.22 C ATOM 1981 O VAL A 137 32.724 16.821 11.513 1.00 60.11 O ATOM 1982 CB VAL A 137 32.487 18.652 13.933 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.571 17.635 14.609 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.947 18.188 13.999 1.00 51.44 C ATOM 0 H VAL A 137 30.317 17.732 12.467 1.00 24.14 H new ATOM 0 HA VAL A 137 32.249 19.968 12.252 1.00 11.21 H new ATOM 0 HB VAL A 137 32.415 19.596 14.473 1.00 74.42 H new ATOM 0 HG11 VAL A 137 31.908 17.464 15.631 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.550 18.017 14.623 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.599 16.696 14.056 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.226 18.011 15.038 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.062 17.265 13.430 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.593 18.958 13.576 1.00 51.44 H new ATOM 1994 N VAL A 138 33.520 18.702 10.580 1.00 43.23 N ATOM 1995 CA VAL A 138 34.263 18.014 9.537 1.00 53.11 C ATOM 1996 C VAL A 138 35.662 17.669 10.040 1.00 13.33 C ATOM 1997 O VAL A 138 36.292 18.457 10.752 1.00 44.02 O ATOM 1998 CB VAL A 138 34.359 18.854 8.239 1.00 15.42 C ATOM 1999 CG1 VAL A 138 33.021 19.515 7.923 1.00 20.25 C ATOM 2000 CG2 VAL A 138 35.476 19.880 8.342 1.00 13.44 C ATOM 0 H VAL A 138 33.603 19.718 10.551 1.00 43.23 H new ATOM 0 HA VAL A 138 33.721 17.100 9.295 1.00 53.11 H new ATOM 0 HB VAL A 138 34.601 18.185 7.413 1.00 15.42 H new ATOM 0 HG11 VAL A 138 33.111 20.100 7.008 1.00 20.25 H new ATOM 0 HG12 VAL A 138 32.259 18.748 7.790 1.00 20.25 H new ATOM 0 HG13 VAL A 138 32.736 20.171 8.746 1.00 20.25 H new ATOM 0 HG21 VAL A 138 35.525 20.458 7.419 1.00 13.44 H new ATOM 0 HG22 VAL A 138 35.279 20.549 9.180 1.00 13.44 H new ATOM 0 HG23 VAL A 138 36.426 19.369 8.501 1.00 13.44 H new ATOM 2010 N ALA A 139 36.116 16.479 9.707 1.00 53.03 N ATOM 2011 CA ALA A 139 37.419 15.991 10.153 1.00 12.31 C ATOM 2012 C ALA A 139 38.236 15.470 8.973 1.00 73.13 C ATOM 2013 O ALA A 139 37.675 15.070 7.948 1.00 43.50 O ATOM 2014 CB ALA A 139 37.242 14.906 11.209 1.00 22.50 C ATOM 0 H ALA A 139 35.601 15.820 9.123 1.00 53.03 H new ATOM 0 HA ALA A 139 37.966 16.822 10.598 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.220 14.551 11.533 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.703 15.315 12.064 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.676 14.076 10.786 1.00 22.50 H new TER 2020 ALA A 139 ATOM 2021 N MET B 1 25.029 24.382 24.910 1.00 72.34 N ATOM 2022 CA MET B 1 24.154 24.067 26.034 1.00 63.32 C ATOM 2023 C MET B 1 24.947 23.443 27.177 1.00 71.35 C ATOM 2024 O MET B 1 26.154 23.215 27.059 1.00 2.40 O ATOM 2025 CB MET B 1 23.044 23.106 25.598 1.00 41.04 C ATOM 2026 CG MET B 1 23.564 21.750 25.165 1.00 5.33 C ATOM 2027 SD MET B 1 22.253 20.599 24.710 1.00 24.33 S ATOM 2028 CE MET B 1 21.594 20.170 26.319 1.00 72.42 C ATOM 0 H1 MET B 1 24.629 23.984 24.036 1.00 72.34 H new ATOM 0 H2 MET B 1 25.112 25.414 24.814 1.00 72.34 H new ATOM 0 H3 MET B 1 25.970 23.973 25.078 1.00 72.34 H new ATOM 0 HA MET B 1 23.706 24.998 26.381 1.00 63.32 H new ATOM 0 HB2 MET B 1 22.343 22.973 26.422 1.00 41.04 H new ATOM 0 HB3 MET B 1 22.487 23.554 24.775 1.00 41.04 H new ATOM 0 HG2 MET B 1 24.236 21.880 24.316 1.00 5.33 H new ATOM 0 HG3 MET B 1 24.153 21.318 25.974 1.00 5.33 H new ATOM 0 HE1 MET B 1 21.134 19.183 26.272 1.00 72.42 H new ATOM 0 HE2 MET B 1 22.401 20.160 27.052 1.00 72.42 H new ATOM 0 HE3 MET B 1 20.846 20.906 26.614 1.00 72.42 H new ATOM 2038 N ASN B 2 24.250 23.143 28.264 1.00 33.33 N ATOM 2039 CA ASN B 2 24.866 22.558 29.452 1.00 51.30 C ATOM 2040 C ASN B 2 24.712 21.042 29.420 1.00 60.31 C ATOM 2041 O ASN B 2 23.740 20.493 29.942 1.00 61.35 O ATOM 2042 CB ASN B 2 24.235 23.128 30.733 1.00 21.53 C ATOM 2043 CG ASN B 2 24.850 22.550 32.000 1.00 32.42 C ATOM 2044 OD1 ASN B 2 26.035 22.225 32.037 1.00 51.33 O ATOM 2045 ND2 ASN B 2 24.049 22.415 33.047 1.00 42.33 N ATOM 0 H ASN B 2 23.245 23.297 28.350 1.00 33.33 H new ATOM 0 HA ASN B 2 25.926 22.812 29.453 1.00 51.30 H new ATOM 0 HB2 ASN B 2 24.352 24.212 30.739 1.00 21.53 H new ATOM 0 HB3 ASN B 2 23.164 22.923 30.728 1.00 21.53 H new ATOM 0 HD21 ASN B 2 24.411 22.031 33.920 1.00 42.33 H new ATOM 0 HD22 ASN B 2 23.071 22.695 32.980 1.00 42.33 H new ATOM 2052 N ILE B 3 25.641 20.378 28.749 1.00 21.23 N ATOM 2053 CA ILE B 3 25.628 18.929 28.646 1.00 72.42 C ATOM 2054 C ILE B 3 25.994 18.268 29.969 1.00 64.03 C ATOM 2055 O ILE B 3 27.079 18.486 30.510 1.00 40.30 O ATOM 2056 CB ILE B 3 26.597 18.457 27.541 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.172 19.053 26.197 1.00 50.54 C ATOM 2058 CG2 ILE B 3 26.640 16.932 27.467 1.00 62.10 C ATOM 2059 CD1 ILE B 3 24.850 18.508 25.694 1.00 13.01 C ATOM 0 H ILE B 3 26.419 20.825 28.264 1.00 21.23 H new ATOM 0 HA ILE B 3 24.612 18.630 28.387 1.00 72.42 H new ATOM 0 HB ILE B 3 27.602 18.804 27.782 1.00 60.30 H new ATOM 0 HG12 ILE B 3 26.098 20.136 26.294 1.00 50.54 H new ATOM 0 HG13 ILE B 3 26.946 18.852 25.456 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.330 16.625 26.681 1.00 62.10 H new ATOM 0 HG22 ILE B 3 26.977 16.531 28.423 1.00 62.10 H new ATOM 0 HG23 ILE B 3 25.644 16.550 27.245 1.00 62.10 H new ATOM 0 HD11 ILE B 3 24.606 18.971 24.738 1.00 13.01 H new ATOM 0 HD12 ILE B 3 24.927 17.428 25.566 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.065 18.733 26.416 1.00 13.01 H new ATOM 2071 N LEU B 4 25.074 17.461 30.471 1.00 23.11 N ATOM 2072 CA LEU B 4 25.278 16.697 31.694 1.00 23.43 C ATOM 2073 C LEU B 4 26.045 15.419 31.390 1.00 41.14 C ATOM 2074 O LEU B 4 26.992 15.064 32.098 1.00 62.34 O ATOM 2075 CB LEU B 4 23.932 16.343 32.338 1.00 50.44 C ATOM 2076 CG LEU B 4 23.055 17.540 32.721 1.00 31.23 C ATOM 2077 CD1 LEU B 4 21.716 17.064 33.284 1.00 75.25 C ATOM 2078 CD2 LEU B 4 23.774 18.449 33.719 1.00 11.04 C ATOM 0 H LEU B 4 24.160 17.316 30.041 1.00 23.11 H new ATOM 0 HA LEU B 4 25.853 17.309 32.388 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.373 15.710 31.649 1.00 50.44 H new ATOM 0 HB3 LEU B 4 24.121 15.751 33.233 1.00 50.44 H new ATOM 0 HG LEU B 4 22.861 18.122 31.820 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.106 17.927 33.551 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.196 16.470 32.532 1.00 75.25 H new ATOM 0 HD13 LEU B 4 21.890 16.455 34.171 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.130 19.291 33.974 1.00 11.04 H new ATOM 0 HD22 LEU B 4 24.008 17.885 34.622 1.00 11.04 H new ATOM 0 HD23 LEU B 4 24.697 18.820 33.273 1.00 11.04 H new ATOM 2090 N TYR B 5 25.637 14.730 30.326 1.00 23.42 N ATOM 2091 CA TYR B 5 26.271 13.465 29.956 1.00 44.15 C ATOM 2092 C TYR B 5 26.525 13.416 28.457 1.00 24.15 C ATOM 2093 O TYR B 5 25.642 13.707 27.662 1.00 75.34 O ATOM 2094 CB TYR B 5 25.404 12.271 30.388 1.00 21.21 C ATOM 2095 CG TYR B 5 26.040 10.916 30.109 1.00 10.12 C ATOM 2096 CD1 TYR B 5 25.898 10.297 28.869 1.00 52.12 C ATOM 2097 CD2 TYR B 5 26.782 10.258 31.086 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.472 9.068 28.612 1.00 75.45 C ATOM 2099 CE2 TYR B 5 27.361 9.027 30.833 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.203 8.437 29.595 1.00 52.51 C ATOM 2101 OH TYR B 5 27.776 7.210 29.341 1.00 25.44 O ATOM 0 H TYR B 5 24.878 15.022 29.710 1.00 23.42 H new ATOM 0 HA TYR B 5 27.227 13.400 30.476 1.00 44.15 H new ATOM 0 HB2 TYR B 5 25.197 12.352 31.455 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.445 12.325 29.872 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.328 10.788 28.094 1.00 52.12 H new ATOM 0 HD2 TYR B 5 26.908 10.715 32.056 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.349 8.603 27.645 1.00 75.45 H new ATOM 0 HE2 TYR B 5 27.934 8.530 31.601 1.00 10.31 H new ATOM 0 HH TYR B 5 28.258 6.903 30.137 1.00 25.44 H new ATOM 2111 N LYS B 6 27.738 13.048 28.085 1.00 30.03 N ATOM 2112 CA LYS B 6 28.119 12.931 26.681 1.00 63.12 C ATOM 2113 C LYS B 6 28.934 11.658 26.452 1.00 12.41 C ATOM 2114 O LYS B 6 29.729 11.258 27.304 1.00 54.02 O ATOM 2115 CB LYS B 6 28.909 14.175 26.242 1.00 22.40 C ATOM 2116 CG LYS B 6 29.417 14.116 24.804 1.00 43.31 C ATOM 2117 CD LYS B 6 30.043 15.437 24.360 1.00 65.01 C ATOM 2118 CE LYS B 6 29.007 16.554 24.267 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.614 17.833 23.816 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.486 12.822 28.740 1.00 30.03 H new ATOM 0 HA LYS B 6 27.215 12.866 26.075 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.274 15.054 26.356 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.759 14.307 26.911 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.154 13.318 24.713 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.591 13.865 24.138 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.824 15.724 25.064 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.522 15.304 23.390 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.218 16.262 23.574 1.00 23.11 H new ATOM 0 HE3 LYS B 6 28.539 16.697 25.241 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 29.028 18.629 24.140 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 30.570 17.923 24.214 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.669 17.844 22.778 1.00 52.41 H new ATOM 2133 N THR B 7 28.713 11.026 25.302 1.00 10.14 N ATOM 2134 CA THR B 7 29.415 9.804 24.924 1.00 42.05 C ATOM 2135 C THR B 7 29.583 9.773 23.401 1.00 63.52 C ATOM 2136 O THR B 7 28.783 10.375 22.676 1.00 72.52 O ATOM 2137 CB THR B 7 28.648 8.547 25.420 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.434 7.364 25.217 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.301 8.401 24.715 1.00 24.11 C ATOM 0 H THR B 7 28.041 11.348 24.605 1.00 10.14 H new ATOM 0 HA THR B 7 30.398 9.795 25.396 1.00 42.05 H new ATOM 0 HB THR B 7 28.464 8.676 26.487 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.259 7.004 24.322 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.791 7.512 25.086 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.689 9.280 24.915 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.461 8.306 23.641 1.00 24.11 H new ATOM 2147 N ALA B 8 30.617 9.088 22.912 1.00 4.15 N ATOM 2148 CA ALA B 8 30.957 9.126 21.488 1.00 51.31 C ATOM 2149 C ALA B 8 30.912 7.741 20.846 1.00 33.43 C ATOM 2150 O ALA B 8 31.242 6.732 21.475 1.00 64.22 O ATOM 2151 CB ALA B 8 32.341 9.740 21.301 1.00 24.44 C ATOM 0 H ALA B 8 31.232 8.502 23.477 1.00 4.15 H new ATOM 0 HA ALA B 8 30.208 9.741 20.990 1.00 51.31 H new ATOM 0 HB1 ALA B 8 32.587 9.765 20.240 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.346 10.755 21.699 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.080 9.139 21.831 1.00 24.44 H new ATOM 2157 N ALA B 9 30.508 7.706 19.580 1.00 21.22 N ATOM 2158 CA ALA B 9 30.513 6.482 18.790 1.00 20.22 C ATOM 2159 C ALA B 9 31.201 6.732 17.448 1.00 31.45 C ATOM 2160 O ALA B 9 30.939 7.734 16.787 1.00 1.21 O ATOM 2161 CB ALA B 9 29.090 5.973 18.592 1.00 3.15 C ATOM 0 H ALA B 9 30.169 8.524 19.075 1.00 21.22 H new ATOM 0 HA ALA B 9 31.072 5.713 19.324 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.110 5.058 18.000 1.00 3.15 H new ATOM 0 HB2 ALA B 9 28.639 5.767 19.563 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.502 6.729 18.072 1.00 3.15 H new ATOM 2167 N THR B 10 32.059 5.806 17.050 1.00 33.23 N ATOM 2168 CA THR B 10 32.897 5.947 15.880 1.00 64.31 C ATOM 2169 C THR B 10 32.586 4.819 14.910 1.00 63.33 C ATOM 2170 O THR B 10 32.678 3.640 15.259 1.00 30.04 O ATOM 2171 CB THR B 10 34.392 5.901 16.267 1.00 62.43 C ATOM 2172 OG1 THR B 10 34.690 6.963 17.184 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.284 6.018 15.038 1.00 23.24 C ATOM 0 H THR B 10 32.191 4.922 17.542 1.00 33.23 H new ATOM 0 HA THR B 10 32.694 6.911 15.413 1.00 64.31 H new ATOM 0 HB THR B 10 34.590 4.940 16.741 1.00 62.43 H new ATOM 0 HG1 THR B 10 35.639 6.928 17.427 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.330 5.982 15.343 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.076 5.192 14.358 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.085 6.963 14.533 1.00 23.24 H new ATOM 2181 N SER B 11 32.201 5.177 13.706 1.00 64.42 N ATOM 2182 CA SER B 11 31.766 4.199 12.728 1.00 20.54 C ATOM 2183 C SER B 11 32.572 4.318 11.432 1.00 44.42 C ATOM 2184 O SER B 11 32.755 5.414 10.903 1.00 74.01 O ATOM 2185 CB SER B 11 30.273 4.392 12.475 1.00 74.14 C ATOM 2186 OG SER B 11 29.536 4.238 13.676 1.00 11.25 O ATOM 0 H SER B 11 32.179 6.142 13.377 1.00 64.42 H new ATOM 0 HA SER B 11 31.939 3.195 13.114 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.095 5.383 12.058 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.928 3.669 11.736 1.00 74.14 H new ATOM 0 HG SER B 11 28.578 4.208 13.470 1.00 11.25 H new ATOM 2192 N THR B 12 33.064 3.183 10.943 1.00 44.31 N ATOM 2193 CA THR B 12 33.892 3.134 9.752 1.00 14.13 C ATOM 2194 C THR B 12 33.127 2.519 8.579 1.00 53.42 C ATOM 2195 O THR B 12 32.146 1.787 8.770 1.00 32.44 O ATOM 2196 CB THR B 12 35.142 2.278 10.021 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.708 2.633 11.288 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.186 2.462 8.932 1.00 31.31 C ATOM 0 H THR B 12 32.896 2.270 11.367 1.00 44.31 H new ATOM 0 HA THR B 12 34.177 4.155 9.500 1.00 14.13 H new ATOM 0 HB THR B 12 34.837 1.232 10.029 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.686 2.641 11.219 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.056 1.843 9.153 1.00 31.31 H new ATOM 0 HG22 THR B 12 35.765 2.166 7.971 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.487 3.509 8.890 1.00 31.31 H new ATOM 2206 N GLY B 13 33.596 2.801 7.371 1.00 25.11 N ATOM 2207 CA GLY B 13 33.021 2.205 6.187 1.00 71.12 C ATOM 2208 C GLY B 13 33.613 0.840 5.898 1.00 70.11 C ATOM 2209 O GLY B 13 34.458 0.697 5.009 1.00 42.34 O ATOM 0 H GLY B 13 34.372 3.438 7.192 1.00 25.11 H new ATOM 0 HA2 GLY B 13 31.942 2.114 6.314 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.187 2.861 5.333 1.00 71.12 H new ATOM 2213 N GLY B 14 33.197 -0.159 6.681 1.00 21.54 N ATOM 2214 CA GLY B 14 33.629 -1.529 6.452 1.00 31.21 C ATOM 2215 C GLY B 14 33.037 -2.118 5.181 1.00 73.40 C ATOM 2216 O GLY B 14 32.853 -1.403 4.193 1.00 13.01 O ATOM 0 H GLY B 14 32.565 -0.040 7.473 1.00 21.54 H new ATOM 0 HA2 GLY B 14 34.717 -1.559 6.391 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.341 -2.145 7.304 1.00 31.21 H new ATOM 2220 N ARG B 15 32.740 -3.419 5.202 1.00 12.42 N ATOM 2221 CA ARG B 15 32.140 -4.095 4.048 1.00 62.32 C ATOM 2222 C ARG B 15 30.901 -3.344 3.568 1.00 53.41 C ATOM 2223 O ARG B 15 30.785 -3.013 2.387 1.00 34.04 O ATOM 2224 CB ARG B 15 31.793 -5.552 4.398 1.00 22.32 C ATOM 2225 CG ARG B 15 31.120 -6.337 3.268 1.00 23.03 C ATOM 2226 CD ARG B 15 31.864 -6.204 1.941 1.00 52.22 C ATOM 2227 NE ARG B 15 33.294 -6.506 2.065 1.00 65.14 N ATOM 2228 CZ ARG B 15 34.262 -5.753 1.539 1.00 55.23 C ATOM 2229 NH1 ARG B 15 33.957 -4.647 0.868 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 35.535 -6.099 1.684 1.00 51.30 N ATOM 0 H ARG B 15 32.905 -4.026 6.005 1.00 12.42 H new ATOM 0 HA ARG B 15 32.868 -4.102 3.237 1.00 62.32 H new ATOM 0 HB2 ARG B 15 32.707 -6.070 4.688 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.135 -5.556 5.267 1.00 22.32 H new ATOM 0 HG2 ARG B 15 31.063 -7.390 3.545 1.00 23.03 H new ATOM 0 HG3 ARG B 15 30.096 -5.984 3.144 1.00 23.03 H new ATOM 0 HD2 ARG B 15 31.416 -6.876 1.209 1.00 52.22 H new ATOM 0 HD3 ARG B 15 31.742 -5.190 1.560 1.00 52.22 H new ATOM 0 HE ARG B 15 33.565 -7.341 2.584 1.00 65.14 H new ATOM 0 HH11 ARG B 15 32.981 -4.372 0.754 1.00 21.14 H new ATOM 0 HH12 ARG B 15 34.699 -4.073 0.467 1.00 21.14 H new ATOM 0 HH21 ARG B 15 35.778 -6.945 2.200 1.00 51.30 H new ATOM 0 HH22 ARG B 15 36.270 -5.519 1.280 1.00 51.30 H new ATOM 2244 N ASP B 16 29.975 -3.085 4.485 1.00 43.23 N ATOM 2245 CA ASP B 16 28.824 -2.236 4.188 1.00 64.45 C ATOM 2246 C ASP B 16 28.761 -1.114 5.224 1.00 45.23 C ATOM 2247 O ASP B 16 28.554 0.052 4.880 1.00 44.01 O ATOM 2248 CB ASP B 16 27.543 -3.075 4.198 1.00 65.33 C ATOM 2249 CG ASP B 16 26.343 -2.384 3.555 1.00 54.31 C ATOM 2250 OD1 ASP B 16 25.819 -2.915 2.548 1.00 24.34 O ATOM 2251 OD2 ASP B 16 25.897 -1.339 4.073 1.00 12.23 O1- ATOM 0 H ASP B 16 29.997 -3.449 5.438 1.00 43.23 H new ATOM 0 HA ASP B 16 28.924 -1.795 3.196 1.00 64.45 H new ATOM 0 HB2 ASP B 16 27.731 -4.013 3.676 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.294 -3.328 5.229 1.00 65.33 H new ATOM 2256 N GLY B 17 28.986 -1.467 6.499 1.00 22.41 N ATOM 2257 CA GLY B 17 29.264 -0.464 7.508 1.00 74.22 C ATOM 2258 C GLY B 17 29.800 -1.095 8.773 1.00 32.04 C ATOM 2259 O GLY B 17 29.616 -2.292 8.992 1.00 11.23 O ATOM 0 H GLY B 17 28.979 -2.428 6.841 1.00 22.41 H new ATOM 0 HA2 GLY B 17 29.988 0.254 7.122 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.353 0.091 7.733 1.00 74.22 H new ATOM 2263 N ARG B 18 30.475 -0.315 9.602 1.00 41.41 N ATOM 2264 CA ARG B 18 31.013 -0.824 10.861 1.00 45.30 C ATOM 2265 C ARG B 18 30.843 0.221 11.958 1.00 1.35 C ATOM 2266 O ARG B 18 31.381 1.319 11.856 1.00 0.54 O ATOM 2267 CB ARG B 18 32.494 -1.215 10.683 1.00 74.40 C ATOM 2268 CG ARG B 18 33.102 -1.964 11.874 1.00 53.04 C ATOM 2269 CD ARG B 18 33.785 -1.032 12.875 1.00 43.11 C ATOM 2270 NE ARG B 18 35.058 -0.515 12.362 1.00 64.22 N ATOM 2271 CZ ARG B 18 35.969 0.129 13.102 1.00 63.34 C ATOM 2272 NH1 ARG B 18 35.739 0.377 14.386 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 37.111 0.522 12.552 1.00 54.01 N ATOM 0 H ARG B 18 30.665 0.672 9.429 1.00 41.41 H new ATOM 0 HA ARG B 18 30.463 -1.717 11.156 1.00 45.30 H new ATOM 0 HB2 ARG B 18 32.588 -1.837 9.793 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.076 -0.311 10.503 1.00 74.40 H new ATOM 0 HG2 ARG B 18 32.318 -2.525 12.383 1.00 53.04 H new ATOM 0 HG3 ARG B 18 33.827 -2.691 11.508 1.00 53.04 H new ATOM 0 HD2 ARG B 18 33.122 -0.199 13.106 1.00 43.11 H new ATOM 0 HD3 ARG B 18 33.960 -1.568 13.808 1.00 43.11 H new ATOM 0 HE ARG B 18 35.263 -0.656 11.373 1.00 64.22 H new ATOM 0 HH11 ARG B 18 34.864 0.076 14.815 1.00 23.22 H new ATOM 0 HH12 ARG B 18 36.438 0.868 14.944 1.00 23.22 H new ATOM 0 HH21 ARG B 18 37.294 0.333 11.566 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.806 1.013 13.115 1.00 54.01 H new ATOM 2287 N ALA B 19 30.092 -0.128 12.997 1.00 25.44 N ATOM 2288 CA ALA B 19 29.793 0.798 14.086 1.00 25.14 C ATOM 2289 C ALA B 19 30.484 0.359 15.369 1.00 64.21 C ATOM 2290 O ALA B 19 30.290 -0.766 15.837 1.00 14.23 O ATOM 2291 CB ALA B 19 28.289 0.891 14.308 1.00 63.23 C ATOM 0 H ALA B 19 29.676 -1.053 13.109 1.00 25.44 H new ATOM 0 HA ALA B 19 30.169 1.783 13.808 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.084 1.585 15.123 1.00 63.23 H new ATOM 0 HB2 ALA B 19 27.808 1.248 13.397 1.00 63.23 H new ATOM 0 HB3 ALA B 19 27.897 -0.094 14.563 1.00 63.23 H new ATOM 2297 N THR B 20 31.277 1.249 15.938 1.00 63.15 N ATOM 2298 CA THR B 20 32.001 0.973 17.168 1.00 31.24 C ATOM 2299 C THR B 20 31.804 2.114 18.155 1.00 2.34 C ATOM 2300 O THR B 20 32.264 3.227 17.926 1.00 75.11 O ATOM 2301 CB THR B 20 33.508 0.778 16.879 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.686 -0.278 15.923 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.291 0.449 18.146 1.00 14.05 C ATOM 0 H THR B 20 31.438 2.183 15.562 1.00 63.15 H new ATOM 0 HA THR B 20 31.609 0.053 17.602 1.00 31.24 H new ATOM 0 HB THR B 20 33.891 1.717 16.479 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.390 -0.885 16.233 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.345 0.320 17.899 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.183 1.264 18.862 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.905 -0.472 18.583 1.00 14.05 H new ATOM 2311 N SER B 21 31.113 1.835 19.251 1.00 21.31 N ATOM 2312 CA SER B 21 30.926 2.824 20.290 1.00 32.44 C ATOM 2313 C SER B 21 32.287 3.127 20.887 1.00 11.23 C ATOM 2314 O SER B 21 32.851 2.284 21.613 1.00 42.34 O ATOM 2315 CB SER B 21 29.948 2.331 21.358 1.00 31.41 C ATOM 2316 OG SER B 21 29.893 3.217 22.458 1.00 74.21 O ATOM 0 H SER B 21 30.676 0.933 19.439 1.00 21.31 H new ATOM 0 HA SER B 21 30.490 3.731 19.870 1.00 32.44 H new ATOM 0 HB2 SER B 21 28.954 2.227 20.923 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.250 1.342 21.701 1.00 31.41 H new ATOM 0 HG SER B 21 29.814 4.138 22.133 1.00 74.21 H new ATOM 2322 N HIS B 22 32.769 4.337 20.553 1.00 5.04 N ATOM 2323 CA HIS B 22 34.152 4.787 20.747 1.00 32.51 C ATOM 2324 C HIS B 22 34.682 4.497 22.138 1.00 35.24 C ATOM 2325 O HIS B 22 35.842 4.118 22.303 1.00 73.12 O ATOM 2326 CB HIS B 22 34.226 6.298 20.459 1.00 3.43 C ATOM 2327 CG HIS B 22 35.417 6.992 21.047 1.00 12.52 C ATOM 2328 ND1 HIS B 22 35.380 7.643 22.261 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.675 7.151 20.574 1.00 34.34 C ATOM 2330 CE1 HIS B 22 36.563 8.170 22.508 1.00 23.12 C ATOM 2331 NE2 HIS B 22 37.368 7.887 21.502 1.00 12.42 N ATOM 0 H HIS B 22 32.181 5.052 20.125 1.00 5.04 H new ATOM 0 HA HIS B 22 34.782 4.228 20.055 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.232 6.448 19.379 1.00 3.43 H new ATOM 0 HB3 HIS B 22 33.322 6.771 20.842 1.00 3.43 H new ATOM 0 HD1 HIS B 22 34.566 7.707 22.872 1.00 31.42 H new ATOM 0 HD2 HIS B 22 37.061 6.770 19.640 1.00 34.34 H new ATOM 0 HE1 HIS B 22 36.829 8.738 23.387 1.00 23.12 H new ATOM 2340 N ASP B 23 33.830 4.646 23.131 1.00 44.12 N ATOM 2341 CA ASP B 23 34.238 4.476 24.522 1.00 0.24 C ATOM 2342 C ASP B 23 34.295 2.997 24.896 1.00 62.21 C ATOM 2343 O ASP B 23 34.143 2.628 26.062 1.00 40.03 O ATOM 2344 CB ASP B 23 33.297 5.262 25.440 1.00 12.04 C ATOM 2345 CG ASP B 23 33.505 6.766 25.305 1.00 5.31 C ATOM 2346 OD1 ASP B 23 33.060 7.350 24.290 1.00 63.54 O ATOM 2347 OD2 ASP B 23 34.143 7.363 26.198 1.00 33.23 O1- ATOM 0 H ASP B 23 32.846 4.885 23.006 1.00 44.12 H new ATOM 0 HA ASP B 23 35.244 4.875 24.650 1.00 0.24 H new ATOM 0 HB2 ASP B 23 32.263 5.014 25.199 1.00 12.04 H new ATOM 0 HB3 ASP B 23 33.464 4.963 26.475 1.00 12.04 H new ATOM 2352 N GLN B 24 34.509 2.159 23.875 1.00 3.35 N ATOM 2353 CA GLN B 24 34.735 0.724 24.037 1.00 64.10 C ATOM 2354 C GLN B 24 33.459 0.036 24.491 1.00 11.02 C ATOM 2355 O GLN B 24 33.486 -1.065 25.041 1.00 0.33 O ATOM 2356 CB GLN B 24 35.889 0.459 25.017 1.00 41.34 C ATOM 2357 CG GLN B 24 37.206 1.107 24.597 1.00 71.43 C ATOM 2358 CD GLN B 24 37.638 0.706 23.195 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.336 -0.290 23.009 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.233 1.480 22.196 1.00 4.32 N ATOM 0 H GLN B 24 34.530 2.465 22.902 1.00 3.35 H new ATOM 0 HA GLN B 24 35.020 0.307 23.071 1.00 64.10 H new ATOM 0 HB2 GLN B 24 35.610 0.829 26.003 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.036 -0.617 25.110 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.104 2.191 24.645 1.00 71.43 H new ATOM 0 HG3 GLN B 24 37.985 0.829 25.306 1.00 71.43 H new ATOM 0 HE21 GLN B 24 36.655 2.298 22.387 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.500 1.257 21.237 1.00 4.32 H new ATOM 2369 N LYS B 25 32.340 0.698 24.233 1.00 34.11 N ATOM 2370 CA LYS B 25 31.037 0.186 24.612 1.00 33.22 C ATOM 2371 C LYS B 25 30.469 -0.735 23.536 1.00 40.01 C ATOM 2372 O LYS B 25 29.636 -1.591 23.841 1.00 34.42 O ATOM 2373 CB LYS B 25 30.076 1.350 24.881 1.00 20.21 C ATOM 2374 CG LYS B 25 30.625 2.361 25.881 1.00 22.43 C ATOM 2375 CD LYS B 25 30.714 1.780 27.294 1.00 41.25 C ATOM 2376 CE LYS B 25 31.665 2.582 28.181 1.00 25.52 C ATOM 2377 NZ LYS B 25 32.981 1.905 28.338 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.313 1.600 23.758 1.00 34.11 H new ATOM 0 HA LYS B 25 31.153 -0.400 25.524 1.00 33.22 H new ATOM 0 HB2 LYS B 25 29.859 1.858 23.942 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.132 0.954 25.255 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.614 2.687 25.560 1.00 22.43 H new ATOM 0 HG3 LYS B 25 29.986 3.244 25.892 1.00 22.43 H new ATOM 0 HD2 LYS B 25 29.721 1.767 27.744 1.00 41.25 H new ATOM 0 HD3 LYS B 25 31.053 0.745 27.240 1.00 41.25 H new ATOM 0 HE2 LYS B 25 31.815 3.572 27.750 1.00 25.52 H new ATOM 0 HE3 LYS B 25 31.212 2.726 29.162 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 33.554 2.418 29.038 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 32.832 0.928 28.661 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 33.478 1.896 27.424 1.00 5.33 H new ATOM 2391 N LEU B 26 30.899 -0.570 22.275 1.00 71.52 N ATOM 2392 CA LEU B 26 30.379 -1.431 21.206 1.00 40.15 C ATOM 2393 C LEU B 26 31.330 -1.508 20.042 1.00 62.33 C ATOM 2394 O LEU B 26 32.090 -0.584 19.796 1.00 50.50 O ATOM 2395 CB LEU B 26 29.006 -0.911 20.754 1.00 64.14 C ATOM 2396 CG LEU B 26 28.422 -1.538 19.479 1.00 70.42 C ATOM 2397 CD1 LEU B 26 28.026 -2.996 19.707 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.238 -0.711 18.992 1.00 31.22 C ATOM 0 H LEU B 26 31.582 0.127 21.979 1.00 71.52 H new ATOM 0 HA LEU B 26 30.272 -2.442 21.599 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.297 -1.068 21.567 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.082 0.165 20.601 1.00 64.14 H new ATOM 0 HG LEU B 26 29.190 -1.534 18.706 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.616 -3.410 18.786 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.904 -3.569 20.004 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.274 -3.050 20.495 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.828 -1.160 18.088 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.470 -0.685 19.765 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.568 0.305 18.775 1.00 31.22 H new ATOM 2410 N ASP B 27 31.271 -2.626 19.335 1.00 22.45 N ATOM 2411 CA ASP B 27 32.126 -2.868 18.193 1.00 53.33 C ATOM 2412 C ASP B 27 31.524 -3.956 17.299 1.00 42.15 C ATOM 2413 O ASP B 27 31.691 -5.148 17.550 1.00 22.10 O ATOM 2414 CB ASP B 27 33.538 -3.245 18.668 1.00 24.13 C ATOM 2415 CG ASP B 27 33.585 -4.487 19.553 1.00 15.20 C ATOM 2416 OD1 ASP B 27 34.100 -5.535 19.101 1.00 3.40 O ATOM 2417 OD2 ASP B 27 33.122 -4.417 20.712 1.00 21.30 O1- ATOM 0 H ASP B 27 30.627 -3.389 19.541 1.00 22.45 H new ATOM 0 HA ASP B 27 32.201 -1.957 17.599 1.00 53.33 H new ATOM 0 HB2 ASP B 27 34.172 -3.409 17.796 1.00 24.13 H new ATOM 0 HB3 ASP B 27 33.962 -2.404 19.217 1.00 24.13 H new ATOM 2422 N VAL B 28 30.771 -3.533 16.284 1.00 42.42 N ATOM 2423 CA VAL B 28 30.143 -4.461 15.337 1.00 61.03 C ATOM 2424 C VAL B 28 30.113 -3.895 13.921 1.00 62.05 C ATOM 2425 O VAL B 28 30.530 -2.762 13.670 1.00 71.42 O ATOM 2426 CB VAL B 28 28.692 -4.831 15.747 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.684 -5.820 16.907 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.886 -3.576 16.084 1.00 74.12 C ATOM 0 H VAL B 28 30.579 -2.549 16.094 1.00 42.42 H new ATOM 0 HA VAL B 28 30.760 -5.359 15.359 1.00 61.03 H new ATOM 0 HB VAL B 28 28.215 -5.318 14.896 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.655 -6.061 17.173 1.00 44.41 H new ATOM 0 HG12 VAL B 28 29.205 -6.731 16.612 1.00 44.41 H new ATOM 0 HG13 VAL B 28 29.186 -5.376 17.767 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.873 -3.860 16.368 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.361 -3.050 16.912 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.849 -2.923 15.212 1.00 74.12 H new ATOM 2438 N LYS B 29 29.599 -4.707 13.007 1.00 64.31 N ATOM 2439 CA LYS B 29 29.458 -4.346 11.604 1.00 24.45 C ATOM 2440 C LYS B 29 28.008 -4.499 11.176 1.00 31.35 C ATOM 2441 O LYS B 29 27.326 -5.442 11.581 1.00 25.23 O ATOM 2442 CB LYS B 29 30.370 -5.239 10.749 1.00 11.40 C ATOM 2443 CG LYS B 29 29.965 -5.363 9.278 1.00 53.23 C ATOM 2444 CD LYS B 29 30.840 -6.370 8.534 1.00 3.25 C ATOM 2445 CE LYS B 29 32.318 -5.993 8.596 1.00 32.51 C ATOM 2446 NZ LYS B 29 33.187 -7.058 8.035 1.00 50.55 N1+ ATOM 0 H LYS B 29 29.264 -5.646 13.222 1.00 64.31 H new ATOM 0 HA LYS B 29 29.753 -3.306 11.463 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.386 -4.847 10.798 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.392 -6.236 11.189 1.00 11.40 H new ATOM 0 HG2 LYS B 29 28.921 -5.670 9.213 1.00 53.23 H new ATOM 0 HG3 LYS B 29 30.042 -4.388 8.796 1.00 53.23 H new ATOM 0 HD2 LYS B 29 30.700 -7.361 8.965 1.00 3.25 H new ATOM 0 HD3 LYS B 29 30.523 -6.427 7.493 1.00 3.25 H new ATOM 0 HE2 LYS B 29 32.479 -5.066 8.046 1.00 32.51 H new ATOM 0 HE3 LYS B 29 32.601 -5.802 9.631 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 34.182 -6.762 8.096 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 33.053 -7.936 8.576 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 32.935 -7.223 7.039 1.00 50.55 H new ATOM 2460 N LEU B 30 27.538 -3.571 10.356 1.00 60.42 N ATOM 2461 CA LEU B 30 26.191 -3.623 9.839 1.00 43.12 C ATOM 2462 C LEU B 30 26.214 -3.540 8.316 1.00 50.11 C ATOM 2463 O LEU B 30 27.270 -3.259 7.703 1.00 72.32 O ATOM 2464 CB LEU B 30 25.299 -2.527 10.469 1.00 4.40 C ATOM 2465 CG LEU B 30 25.855 -1.089 10.536 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.965 -0.955 11.575 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.318 -0.614 9.168 1.00 52.40 C ATOM 0 H LEU B 30 28.080 -2.769 10.036 1.00 60.42 H new ATOM 0 HA LEU B 30 25.747 -4.578 10.118 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.363 -2.497 9.911 1.00 4.40 H new ATOM 0 HB3 LEU B 30 25.055 -2.838 11.485 1.00 4.40 H new ATOM 0 HG LEU B 30 25.038 -0.442 10.855 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.328 0.073 11.589 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.576 -1.216 12.559 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.785 -1.626 11.320 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.704 0.402 9.247 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.104 -1.274 8.801 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.478 -0.629 8.474 1.00 52.40 H new ATOM 2479 N SER B 31 25.059 -3.786 7.710 1.00 24.22 N ATOM 2480 CA SER B 31 24.958 -3.868 6.270 1.00 21.40 C ATOM 2481 C SER B 31 23.538 -3.646 5.789 1.00 43.34 C ATOM 2482 O SER B 31 22.586 -4.192 6.350 1.00 1.33 O ATOM 2483 CB SER B 31 25.429 -5.245 5.787 1.00 62.35 C ATOM 2484 OG SER B 31 26.737 -5.539 6.251 1.00 3.34 O ATOM 0 H SER B 31 24.178 -3.932 8.203 1.00 24.22 H new ATOM 0 HA SER B 31 25.591 -3.082 5.859 1.00 21.40 H new ATOM 0 HB2 SER B 31 24.737 -6.011 6.137 1.00 62.35 H new ATOM 0 HB3 SER B 31 25.413 -5.275 4.698 1.00 62.35 H new ATOM 0 HG SER B 31 27.109 -4.752 6.701 1.00 3.34 H new ATOM 2490 N ALA B 32 23.413 -2.827 4.759 1.00 40.52 N ATOM 2491 CA ALA B 32 22.219 -2.789 3.947 1.00 75.13 C ATOM 2492 C ALA B 32 22.421 -3.786 2.807 1.00 31.44 C ATOM 2493 O ALA B 32 23.029 -3.446 1.790 1.00 42.31 O ATOM 2494 CB ALA B 32 21.980 -1.378 3.422 1.00 44.15 C ATOM 0 H ALA B 32 24.138 -2.172 4.466 1.00 40.52 H new ATOM 0 HA ALA B 32 21.337 -3.060 4.528 1.00 75.13 H new ATOM 0 HB1 ALA B 32 21.077 -1.365 2.812 1.00 44.15 H new ATOM 0 HB2 ALA B 32 21.861 -0.693 4.261 1.00 44.15 H new ATOM 0 HB3 ALA B 32 22.831 -1.066 2.817 1.00 44.15 H new ATOM 2500 N PRO B 33 21.949 -5.043 2.983 1.00 64.54 N ATOM 2501 CA PRO B 33 22.302 -6.174 2.101 1.00 71.30 C ATOM 2502 C PRO B 33 21.763 -6.017 0.679 1.00 44.54 C ATOM 2503 O PRO B 33 20.943 -6.812 0.226 1.00 60.20 O ATOM 2504 CB PRO B 33 21.660 -7.384 2.804 1.00 5.21 C ATOM 2505 CG PRO B 33 20.528 -6.806 3.581 1.00 53.32 C ATOM 2506 CD PRO B 33 21.006 -5.456 4.044 1.00 34.02 C ATOM 0 HA PRO B 33 23.380 -6.262 1.969 1.00 71.30 H new ATOM 0 HB2 PRO B 33 21.310 -8.123 2.083 1.00 5.21 H new ATOM 0 HB3 PRO B 33 22.373 -7.888 3.456 1.00 5.21 H new ATOM 0 HG2 PRO B 33 19.634 -6.715 2.964 1.00 53.32 H new ATOM 0 HG3 PRO B 33 20.268 -7.442 4.427 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.181 -4.751 4.145 1.00 34.02 H new ATOM 0 HD3 PRO B 33 21.496 -5.515 5.016 1.00 34.02 H new ATOM 2514 N ARG B 34 22.265 -5.008 -0.022 1.00 0.10 N ATOM 2515 CA ARG B 34 21.803 -4.671 -1.357 1.00 23.43 C ATOM 2516 C ARG B 34 20.290 -4.552 -1.408 1.00 64.55 C ATOM 2517 O ARG B 34 19.758 -3.506 -1.043 1.00 62.12 O ATOM 2518 CB ARG B 34 22.348 -5.669 -2.394 1.00 33.02 C ATOM 2519 CG ARG B 34 23.703 -5.269 -2.965 1.00 11.34 C ATOM 2520 CD ARG B 34 23.628 -3.948 -3.720 1.00 70.25 C ATOM 2521 NE ARG B 34 24.933 -3.522 -4.230 1.00 41.11 N ATOM 2522 CZ ARG B 34 25.113 -2.453 -5.009 1.00 71.43 C ATOM 2523 NH1 ARG B 34 24.065 -1.769 -5.455 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 26.338 -2.089 -5.371 1.00 21.32 N ATOM 0 H ARG B 34 23.007 -4.400 0.324 1.00 0.10 H new ATOM 0 HA ARG B 34 22.200 -3.689 -1.616 1.00 23.43 H new ATOM 0 HB2 ARG B 34 22.433 -6.652 -1.931 1.00 33.02 H new ATOM 0 HB3 ARG B 34 21.631 -5.762 -3.210 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.429 -5.185 -2.156 1.00 11.34 H new ATOM 0 HG3 ARG B 34 24.061 -6.051 -3.634 1.00 11.34 H new ATOM 0 HD2 ARG B 34 22.931 -4.047 -4.552 1.00 70.25 H new ATOM 0 HD3 ARG B 34 23.230 -3.177 -3.060 1.00 70.25 H new ATOM 0 HE ARG B 34 25.752 -4.074 -3.975 1.00 41.11 H new ATOM 0 HH11 ARG B 34 23.121 -2.060 -5.202 1.00 70.13 H new ATOM 0 HH12 ARG B 34 24.205 -0.952 -6.050 1.00 70.13 H new ATOM 0 HH21 ARG B 34 27.145 -2.627 -5.054 1.00 21.32 H new ATOM 0 HH22 ARG B 34 26.472 -1.272 -5.966 1.00 21.32 H new ATOM 2538 N GLU B 35 19.624 -5.622 -1.825 1.00 42.24 N ATOM 2539 CA GLU B 35 18.172 -5.661 -1.984 1.00 63.02 C ATOM 2540 C GLU B 35 17.638 -4.480 -2.796 1.00 12.03 C ATOM 2541 O GLU B 35 17.295 -4.627 -3.971 1.00 54.43 O ATOM 2542 CB GLU B 35 17.466 -5.750 -0.620 1.00 72.41 C ATOM 2543 CG GLU B 35 17.866 -6.967 0.207 1.00 31.33 C ATOM 2544 CD GLU B 35 17.681 -8.280 -0.540 1.00 34.33 C ATOM 2545 OE1 GLU B 35 18.647 -8.755 -1.179 1.00 72.42 O ATOM 2546 OE2 GLU B 35 16.571 -8.853 -0.485 1.00 24.25 O1- ATOM 0 H GLU B 35 20.082 -6.501 -2.066 1.00 42.24 H new ATOM 0 HA GLU B 35 17.946 -6.564 -2.550 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.685 -4.848 -0.049 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.388 -5.771 -0.781 1.00 72.41 H new ATOM 0 HG2 GLU B 35 18.910 -6.869 0.506 1.00 31.33 H new ATOM 0 HG3 GLU B 35 17.273 -6.989 1.121 1.00 31.33 H new ATOM 2553 N LEU B 36 17.605 -3.308 -2.179 1.00 53.04 N ATOM 2554 CA LEU B 36 17.029 -2.125 -2.809 1.00 1.52 C ATOM 2555 C LEU B 36 18.093 -1.458 -3.665 1.00 52.10 C ATOM 2556 O LEU B 36 17.815 -0.936 -4.745 1.00 30.14 O ATOM 2557 CB LEU B 36 16.495 -1.131 -1.758 1.00 63.52 C ATOM 2558 CG LEU B 36 15.490 -1.695 -0.729 1.00 20.23 C ATOM 2559 CD1 LEU B 36 14.475 -2.623 -1.393 1.00 52.43 C ATOM 2560 CD2 LEU B 36 16.209 -2.400 0.418 1.00 15.21 C ATOM 0 H LEU B 36 17.971 -3.149 -1.240 1.00 53.04 H new ATOM 0 HA LEU B 36 16.186 -2.432 -3.428 1.00 1.52 H new ATOM 0 HB2 LEU B 36 17.345 -0.718 -1.215 1.00 63.52 H new ATOM 0 HB3 LEU B 36 16.019 -0.302 -2.282 1.00 63.52 H new ATOM 0 HG LEU B 36 14.942 -0.851 -0.310 1.00 20.23 H new ATOM 0 HD11 LEU B 36 13.783 -3.002 -0.641 1.00 52.43 H new ATOM 0 HD12 LEU B 36 13.920 -2.072 -2.152 1.00 52.43 H new ATOM 0 HD13 LEU B 36 14.997 -3.458 -1.860 1.00 52.43 H new ATOM 0 HD21 LEU B 36 15.475 -2.786 1.125 1.00 15.21 H new ATOM 0 HD22 LEU B 36 16.801 -3.225 0.023 1.00 15.21 H new ATOM 0 HD23 LEU B 36 16.865 -1.693 0.926 1.00 15.21 H new ATOM 2572 N GLY B 37 19.320 -1.511 -3.164 1.00 22.45 N ATOM 2573 CA GLY B 37 20.451 -0.917 -3.845 1.00 25.41 C ATOM 2574 C GLY B 37 21.530 -0.504 -2.870 1.00 51.22 C ATOM 2575 O GLY B 37 22.145 0.546 -3.032 1.00 30.40 O ATOM 0 H GLY B 37 19.553 -1.964 -2.281 1.00 22.45 H new ATOM 0 HA2 GLY B 37 20.860 -1.629 -4.562 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.120 -0.047 -4.413 1.00 25.41 H new ATOM 2579 N GLY B 38 21.759 -1.334 -1.849 1.00 53.33 N ATOM 2580 CA GLY B 38 22.752 -1.006 -0.841 1.00 54.12 C ATOM 2581 C GLY B 38 24.160 -1.266 -1.335 1.00 61.21 C ATOM 2582 O GLY B 38 24.544 -0.812 -2.413 1.00 64.12 O ATOM 0 H GLY B 38 21.276 -2.221 -1.705 1.00 53.33 H new ATOM 0 HA2 GLY B 38 22.653 0.043 -0.560 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.567 -1.595 0.057 1.00 54.12 H new ATOM 2586 N ALA B 39 24.926 -2.011 -0.559 1.00 3.10 N ATOM 2587 CA ALA B 39 26.278 -2.396 -0.961 1.00 71.25 C ATOM 2588 C ALA B 39 26.362 -3.907 -1.122 1.00 4.43 C ATOM 2589 O ALA B 39 26.872 -4.405 -2.131 1.00 31.41 O ATOM 2590 CB ALA B 39 27.313 -1.894 0.037 1.00 12.41 C ATOM 0 H ALA B 39 24.640 -2.364 0.354 1.00 3.10 H new ATOM 0 HA ALA B 39 26.499 -1.930 -1.921 1.00 71.25 H new ATOM 0 HB1 ALA B 39 28.309 -2.196 -0.289 1.00 12.41 H new ATOM 0 HB2 ALA B 39 27.264 -0.807 0.096 1.00 12.41 H new ATOM 0 HB3 ALA B 39 27.108 -2.320 1.019 1.00 12.41 H new ATOM 2596 N GLY B 40 25.839 -4.633 -0.136 1.00 23.34 N ATOM 2597 CA GLY B 40 25.790 -6.082 -0.216 1.00 31.44 C ATOM 2598 C GLY B 40 26.665 -6.749 0.823 1.00 1.42 C ATOM 2599 O GLY B 40 27.888 -6.798 0.674 1.00 53.13 O ATOM 0 H GLY B 40 25.447 -4.240 0.720 1.00 23.34 H new ATOM 0 HA2 GLY B 40 24.760 -6.415 -0.087 1.00 31.44 H new ATOM 0 HA3 GLY B 40 26.106 -6.399 -1.210 1.00 31.44 H new ATOM 2603 N ALA B 41 26.037 -7.259 1.875 1.00 13.10 N ATOM 2604 CA ALA B 41 26.760 -7.947 2.946 1.00 45.11 C ATOM 2605 C ALA B 41 25.806 -8.679 3.893 1.00 24.05 C ATOM 2606 O ALA B 41 24.591 -8.698 3.678 1.00 14.44 O ATOM 2607 CB ALA B 41 27.633 -6.960 3.711 1.00 11.53 C ATOM 0 H ALA B 41 25.027 -7.211 2.013 1.00 13.10 H new ATOM 0 HA ALA B 41 27.401 -8.700 2.488 1.00 45.11 H new ATOM 0 HB1 ALA B 41 28.165 -7.484 4.505 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.353 -6.507 3.029 1.00 11.53 H new ATOM 0 HB3 ALA B 41 27.006 -6.182 4.147 1.00 11.53 H new ATOM 2613 N GLU B 42 26.368 -9.273 4.948 1.00 15.20 N ATOM 2614 CA GLU B 42 25.611 -10.107 5.888 1.00 53.20 C ATOM 2615 C GLU B 42 25.485 -9.438 7.262 1.00 74.14 C ATOM 2616 O GLU B 42 25.180 -10.099 8.260 1.00 53.42 O ATOM 2617 CB GLU B 42 26.305 -11.472 6.028 1.00 21.14 C ATOM 2618 CG GLU B 42 27.734 -11.384 6.558 1.00 73.23 C ATOM 2619 CD GLU B 42 28.434 -12.735 6.614 1.00 72.34 C ATOM 2620 OE1 GLU B 42 29.370 -12.964 5.818 1.00 61.42 O ATOM 2621 OE2 GLU B 42 28.060 -13.572 7.459 1.00 61.14 O1- ATOM 0 H GLU B 42 27.359 -9.191 5.176 1.00 15.20 H new ATOM 0 HA GLU B 42 24.604 -10.240 5.494 1.00 53.20 H new ATOM 0 HB2 GLU B 42 25.717 -12.101 6.696 1.00 21.14 H new ATOM 0 HB3 GLU B 42 26.317 -11.964 5.056 1.00 21.14 H new ATOM 0 HG2 GLU B 42 28.309 -10.709 5.924 1.00 73.23 H new ATOM 0 HG3 GLU B 42 27.719 -10.948 7.557 1.00 73.23 H new ATOM 2628 N GLY B 43 25.720 -8.129 7.310 1.00 33.24 N ATOM 2629 CA GLY B 43 25.632 -7.396 8.566 1.00 35.43 C ATOM 2630 C GLY B 43 24.199 -7.076 8.961 1.00 2.13 C ATOM 2631 O GLY B 43 23.252 -7.644 8.414 1.00 72.12 O ATOM 0 H GLY B 43 25.970 -7.560 6.501 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.100 -7.982 9.357 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.197 -6.468 8.480 1.00 35.43 H new ATOM 2635 N THR B 44 24.039 -6.147 9.898 1.00 33.20 N ATOM 2636 CA THR B 44 22.726 -5.810 10.440 1.00 33.40 C ATOM 2637 C THR B 44 22.105 -4.636 9.674 1.00 35.03 C ATOM 2638 O THR B 44 22.795 -3.668 9.362 1.00 4.14 O ATOM 2639 CB THR B 44 22.843 -5.453 11.941 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.556 -6.494 12.627 1.00 1.03 O ATOM 2641 CG2 THR B 44 21.470 -5.269 12.581 1.00 34.45 C ATOM 0 H THR B 44 24.808 -5.611 10.300 1.00 33.20 H new ATOM 0 HA THR B 44 22.079 -6.680 10.327 1.00 33.40 H new ATOM 0 HB THR B 44 23.384 -4.510 12.023 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.632 -6.267 13.577 1.00 1.03 H new ATOM 0 HG21 THR B 44 21.590 -5.019 13.635 1.00 34.45 H new ATOM 0 HG22 THR B 44 20.938 -4.463 12.076 1.00 34.45 H new ATOM 0 HG23 THR B 44 20.899 -6.193 12.490 1.00 34.45 H new ATOM 2649 N ASN B 45 20.813 -4.734 9.367 1.00 4.01 N ATOM 2650 CA ASN B 45 20.106 -3.671 8.647 1.00 51.43 C ATOM 2651 C ASN B 45 20.124 -2.366 9.442 1.00 21.43 C ATOM 2652 O ASN B 45 19.632 -2.325 10.571 1.00 31.35 O ATOM 2653 CB ASN B 45 18.650 -4.081 8.371 1.00 71.14 C ATOM 2654 CG ASN B 45 18.529 -5.120 7.271 1.00 11.33 C ATOM 2655 OD1 ASN B 45 18.618 -6.323 7.525 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.304 -4.666 6.048 1.00 55.34 N ATOM 0 H ASN B 45 20.232 -5.538 9.605 1.00 4.01 H new ATOM 0 HA ASN B 45 20.622 -3.514 7.700 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.209 -4.475 9.287 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.075 -3.197 8.094 1.00 71.14 H new ATOM 0 HD21 ASN B 45 18.197 -5.320 5.273 1.00 55.34 H new ATOM 0 HD22 ASN B 45 18.237 -3.662 5.881 1.00 55.34 H new ATOM 2663 N PRO B 46 20.709 -1.291 8.875 1.00 54.41 N ATOM 2664 CA PRO B 46 20.684 0.047 9.485 1.00 2.04 C ATOM 2665 C PRO B 46 19.264 0.472 9.884 1.00 14.41 C ATOM 2666 O PRO B 46 19.053 1.057 10.956 1.00 12.32 O ATOM 2667 CB PRO B 46 21.235 0.950 8.372 1.00 21.50 C ATOM 2668 CG PRO B 46 22.119 0.056 7.570 1.00 13.22 C ATOM 2669 CD PRO B 46 21.462 -1.299 7.601 1.00 31.44 C ATOM 0 HA PRO B 46 21.261 0.094 10.409 1.00 2.04 H new ATOM 0 HB2 PRO B 46 20.432 1.364 7.763 1.00 21.50 H new ATOM 0 HB3 PRO B 46 21.791 1.793 8.783 1.00 21.50 H new ATOM 0 HG2 PRO B 46 22.219 0.419 6.547 1.00 13.22 H new ATOM 0 HG3 PRO B 46 23.122 0.015 7.994 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.802 -1.444 6.746 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.198 -2.102 7.575 1.00 31.44 H new ATOM 2677 N GLU B 47 18.297 0.152 9.021 1.00 51.12 N ATOM 2678 CA GLU B 47 16.888 0.449 9.290 1.00 42.23 C ATOM 2679 C GLU B 47 16.473 -0.228 10.592 1.00 51.31 C ATOM 2680 O GLU B 47 15.896 0.393 11.486 1.00 51.34 O ATOM 2681 CB GLU B 47 15.962 -0.050 8.155 1.00 43.35 C ATOM 2682 CG GLU B 47 16.509 0.108 6.737 1.00 13.13 C ATOM 2683 CD GLU B 47 17.463 -1.015 6.351 1.00 41.12 C ATOM 2684 OE1 GLU B 47 16.990 -2.146 6.111 1.00 53.12 O ATOM 2685 OE2 GLU B 47 18.685 -0.776 6.314 1.00 73.03 O1- ATOM 0 H GLU B 47 18.464 -0.313 8.129 1.00 51.12 H new ATOM 0 HA GLU B 47 16.786 1.532 9.361 1.00 42.23 H new ATOM 0 HB2 GLU B 47 15.744 -1.104 8.326 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.015 0.486 8.221 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.679 0.133 6.031 1.00 13.13 H new ATOM 0 HG3 GLU B 47 17.026 1.064 6.655 1.00 13.13 H new ATOM 2692 N GLN B 48 16.794 -1.517 10.677 1.00 65.22 N ATOM 2693 CA GLN B 48 16.482 -2.332 11.846 1.00 23.21 C ATOM 2694 C GLN B 48 17.216 -1.791 13.070 1.00 44.13 C ATOM 2695 O GLN B 48 16.685 -1.808 14.181 1.00 15.51 O ATOM 2696 CB GLN B 48 16.871 -3.796 11.566 1.00 21.32 C ATOM 2697 CG GLN B 48 16.522 -4.793 12.675 1.00 64.34 C ATOM 2698 CD GLN B 48 17.613 -4.940 13.729 1.00 23.41 C ATOM 2699 OE1 GLN B 48 18.527 -5.744 13.578 1.00 3.40 O ATOM 2700 NE2 GLN B 48 17.509 -4.191 14.813 1.00 12.54 N ATOM 0 H GLN B 48 17.278 -2.025 9.937 1.00 65.22 H new ATOM 0 HA GLN B 48 15.412 -2.290 12.051 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.380 -4.115 10.647 1.00 21.32 H new ATOM 0 HB3 GLN B 48 17.945 -3.840 11.386 1.00 21.32 H new ATOM 0 HG2 GLN B 48 15.600 -4.475 13.161 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.327 -5.768 12.228 1.00 64.34 H new ATOM 0 HE21 GLN B 48 16.736 -3.532 14.906 1.00 12.54 H new ATOM 0 HE22 GLN B 48 18.202 -4.272 15.557 1.00 12.54 H new ATOM 2709 N LEU B 49 18.432 -1.305 12.848 1.00 25.52 N ATOM 2710 CA LEU B 49 19.272 -0.788 13.922 1.00 12.42 C ATOM 2711 C LEU B 49 18.592 0.407 14.598 1.00 73.15 C ATOM 2712 O LEU B 49 18.400 0.411 15.817 1.00 22.33 O ATOM 2713 CB LEU B 49 20.661 -0.413 13.360 1.00 25.41 C ATOM 2714 CG LEU B 49 21.789 -0.187 14.391 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.626 1.140 15.125 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.850 -1.346 15.386 1.00 31.54 C ATOM 0 H LEU B 49 18.861 -1.258 11.924 1.00 25.52 H new ATOM 0 HA LEU B 49 19.411 -1.558 14.681 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.977 -1.203 12.678 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.554 0.496 12.768 1.00 25.41 H new ATOM 0 HG LEU B 49 22.730 -0.146 13.842 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.439 1.262 15.841 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.650 1.959 14.406 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.673 1.149 15.653 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.651 -1.168 16.104 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.900 -1.422 15.914 1.00 31.54 H new ATOM 0 HD23 LEU B 49 22.043 -2.276 14.850 1.00 31.54 H new ATOM 2728 N PHE B 50 18.215 1.411 13.805 1.00 74.53 N ATOM 2729 CA PHE B 50 17.510 2.584 14.335 1.00 13.24 C ATOM 2730 C PHE B 50 16.159 2.177 14.917 1.00 54.12 C ATOM 2731 O PHE B 50 15.763 2.663 15.975 1.00 20.22 O ATOM 2732 CB PHE B 50 17.327 3.642 13.241 1.00 14.34 C ATOM 2733 CG PHE B 50 16.303 4.717 13.553 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.516 5.656 14.562 1.00 53.13 C ATOM 2735 CD2 PHE B 50 15.130 4.798 12.817 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.586 6.641 14.821 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.196 5.781 13.079 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.425 6.704 14.081 1.00 62.30 C ATOM 0 H PHE B 50 18.384 1.438 12.799 1.00 74.53 H new ATOM 0 HA PHE B 50 18.113 3.016 15.133 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.289 4.120 13.055 1.00 14.34 H new ATOM 0 HB3 PHE B 50 17.036 3.141 12.318 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.422 5.611 15.149 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.945 4.083 12.029 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.768 7.363 15.604 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.286 5.828 12.500 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.695 7.474 14.284 1.00 62.30 H new ATOM 2748 N ALA B 51 15.462 1.294 14.215 1.00 24.13 N ATOM 2749 CA ALA B 51 14.182 0.764 14.686 1.00 31.22 C ATOM 2750 C ALA B 51 14.310 0.222 16.105 1.00 63.22 C ATOM 2751 O ALA B 51 13.562 0.609 17.002 1.00 61.14 O ATOM 2752 CB ALA B 51 13.683 -0.328 13.750 1.00 4.33 C ATOM 0 H ALA B 51 15.760 0.926 13.312 1.00 24.13 H new ATOM 0 HA ALA B 51 13.458 1.579 14.693 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.730 -0.712 14.114 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.550 0.083 12.749 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.411 -1.138 13.715 1.00 4.33 H new ATOM 2758 N ALA B 52 15.283 -0.661 16.299 1.00 2.41 N ATOM 2759 CA ALA B 52 15.511 -1.302 17.588 1.00 55.02 C ATOM 2760 C ALA B 52 15.981 -0.286 18.625 1.00 53.11 C ATOM 2761 O ALA B 52 15.542 -0.312 19.778 1.00 74.31 O ATOM 2762 CB ALA B 52 16.527 -2.428 17.443 1.00 43.35 C ATOM 0 H ALA B 52 15.934 -0.952 15.570 1.00 2.41 H new ATOM 0 HA ALA B 52 14.568 -1.724 17.934 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.689 -2.899 18.413 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.151 -3.169 16.738 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.469 -2.023 17.075 1.00 43.35 H new ATOM 2768 N GLY B 53 16.871 0.605 18.199 1.00 41.34 N ATOM 2769 CA GLY B 53 17.383 1.637 19.081 1.00 4.13 C ATOM 2770 C GLY B 53 16.285 2.542 19.604 1.00 15.42 C ATOM 2771 O GLY B 53 16.193 2.788 20.804 1.00 73.22 O ATOM 0 H GLY B 53 17.249 0.630 17.252 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.898 1.171 19.921 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.121 2.236 18.547 1.00 4.13 H new ATOM 2775 N TYR B 54 15.439 3.017 18.695 1.00 15.35 N ATOM 2776 CA TYR B 54 14.332 3.902 19.046 1.00 21.24 C ATOM 2777 C TYR B 54 13.270 3.132 19.827 1.00 2.44 C ATOM 2778 O TYR B 54 12.671 3.666 20.756 1.00 55.40 O ATOM 2779 CB TYR B 54 13.731 4.532 17.775 1.00 22.10 C ATOM 2780 CG TYR B 54 12.556 5.478 18.012 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.404 6.175 19.212 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.602 5.681 17.017 1.00 20.22 C ATOM 2783 CE1 TYR B 54 11.339 7.037 19.409 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.538 6.542 17.211 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.412 7.217 18.407 1.00 15.31 C ATOM 2786 OH TYR B 54 9.353 8.077 18.604 1.00 73.14 O ATOM 0 H TYR B 54 15.500 2.801 17.700 1.00 15.35 H new ATOM 0 HA TYR B 54 14.707 4.705 19.680 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.517 5.078 17.253 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.404 3.731 17.111 1.00 22.10 H new ATOM 0 HD1 TYR B 54 13.130 6.039 20.000 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.695 5.156 16.078 1.00 20.22 H new ATOM 0 HE1 TYR B 54 11.236 7.566 20.345 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.808 6.686 16.428 1.00 11.21 H new ATOM 0 HH TYR B 54 8.543 7.695 18.206 1.00 73.14 H new ATOM 2796 N SER B 55 13.059 1.876 19.457 1.00 62.44 N ATOM 2797 CA SER B 55 12.081 1.026 20.132 1.00 11.44 C ATOM 2798 C SER B 55 12.467 0.854 21.605 1.00 45.34 C ATOM 2799 O SER B 55 11.653 1.071 22.508 1.00 23.33 O ATOM 2800 CB SER B 55 11.997 -0.337 19.427 1.00 71.55 C ATOM 2801 OG SER B 55 10.861 -1.071 19.841 1.00 22.42 O ATOM 0 H SER B 55 13.553 1.420 18.690 1.00 62.44 H new ATOM 0 HA SER B 55 11.100 1.499 20.086 1.00 11.44 H new ATOM 0 HB2 SER B 55 11.960 -0.187 18.348 1.00 71.55 H new ATOM 0 HB3 SER B 55 12.899 -0.912 19.638 1.00 71.55 H new ATOM 0 HG SER B 55 11.114 -1.689 20.558 1.00 22.42 H new ATOM 2807 N ALA B 56 13.729 0.496 21.839 1.00 72.32 N ATOM 2808 CA ALA B 56 14.240 0.304 23.193 1.00 72.14 C ATOM 2809 C ALA B 56 14.333 1.640 23.928 1.00 34.31 C ATOM 2810 O ALA B 56 13.949 1.747 25.094 1.00 51.54 O ATOM 2811 CB ALA B 56 15.601 -0.384 23.154 1.00 11.32 C ATOM 0 H ALA B 56 14.418 0.333 21.104 1.00 72.32 H new ATOM 0 HA ALA B 56 13.545 -0.336 23.737 1.00 72.14 H new ATOM 0 HB1 ALA B 56 15.969 -0.520 24.171 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.504 -1.356 22.670 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.304 0.232 22.593 1.00 11.32 H new ATOM 2817 N CYS B 57 14.825 2.660 23.226 1.00 24.02 N ATOM 2818 CA CYS B 57 14.958 4.001 23.788 1.00 54.22 C ATOM 2819 C CYS B 57 13.591 4.537 24.201 1.00 22.14 C ATOM 2820 O CYS B 57 13.459 5.235 25.208 1.00 1.03 O ATOM 2821 CB CYS B 57 15.620 4.951 22.777 1.00 72.40 C ATOM 2822 SG CYS B 57 16.032 6.581 23.445 1.00 42.35 S ATOM 0 H CYS B 57 15.140 2.580 22.259 1.00 24.02 H new ATOM 0 HA CYS B 57 15.595 3.943 24.671 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.531 4.485 22.401 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.952 5.079 21.925 1.00 72.40 H new ATOM 0 HG CYS B 57 15.799 7.490 22.545 1.00 42.35 H new ATOM 2828 N PHE B 58 12.571 4.201 23.414 1.00 34.03 N ATOM 2829 CA PHE B 58 11.212 4.635 23.693 1.00 42.11 C ATOM 2830 C PHE B 58 10.733 3.990 24.986 1.00 1.15 C ATOM 2831 O PHE B 58 10.011 4.602 25.776 1.00 52.32 O ATOM 2832 CB PHE B 58 10.283 4.257 22.531 1.00 13.13 C ATOM 2833 CG PHE B 58 8.945 4.944 22.579 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.824 4.299 23.088 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.812 6.244 22.116 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.600 4.940 23.130 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.594 6.886 22.156 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.485 6.236 22.663 1.00 52.03 C ATOM 0 H PHE B 58 12.665 3.627 22.576 1.00 34.03 H new ATOM 0 HA PHE B 58 11.195 5.719 23.804 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.774 4.503 21.590 1.00 13.13 H new ATOM 0 HB3 PHE B 58 10.128 3.178 22.537 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.910 3.287 23.454 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.674 6.760 21.719 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.735 4.429 23.527 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.506 7.899 21.791 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.530 6.740 22.694 1.00 52.03 H new ATOM 2848 N LEU B 59 11.171 2.754 25.201 1.00 60.43 N ATOM 2849 CA LEU B 59 10.825 2.007 26.399 1.00 11.12 C ATOM 2850 C LEU B 59 11.554 2.592 27.614 1.00 60.54 C ATOM 2851 O LEU B 59 10.991 2.658 28.707 1.00 64.41 O ATOM 2852 CB LEU B 59 11.164 0.519 26.217 1.00 33.41 C ATOM 2853 CG LEU B 59 10.643 -0.419 27.318 1.00 23.42 C ATOM 2854 CD1 LEU B 59 9.123 -0.321 27.438 1.00 12.45 C ATOM 2855 CD2 LEU B 59 11.068 -1.859 27.037 1.00 24.24 C ATOM 0 H LEU B 59 11.772 2.246 24.552 1.00 60.43 H new ATOM 0 HA LEU B 59 9.752 2.090 26.571 1.00 11.12 H new ATOM 0 HB2 LEU B 59 10.761 0.187 25.260 1.00 33.41 H new ATOM 0 HB3 LEU B 59 12.248 0.416 26.159 1.00 33.41 H new ATOM 0 HG LEU B 59 11.079 -0.109 28.267 1.00 23.42 H new ATOM 0 HD11 LEU B 59 8.776 -0.993 28.223 1.00 12.45 H new ATOM 0 HD12 LEU B 59 8.843 0.703 27.687 1.00 12.45 H new ATOM 0 HD13 LEU B 59 8.664 -0.603 26.490 1.00 12.45 H new ATOM 0 HD21 LEU B 59 10.691 -2.510 27.826 1.00 24.24 H new ATOM 0 HD22 LEU B 59 10.661 -2.178 26.078 1.00 24.24 H new ATOM 0 HD23 LEU B 59 12.156 -1.918 27.007 1.00 24.24 H new ATOM 2867 N SER B 60 12.801 3.024 27.417 1.00 44.21 N ATOM 2868 CA SER B 60 13.558 3.712 28.465 1.00 2.40 C ATOM 2869 C SER B 60 12.875 5.040 28.824 1.00 73.23 C ATOM 2870 O SER B 60 12.694 5.375 30.004 1.00 65.55 O ATOM 2871 CB SER B 60 15.000 3.952 27.999 1.00 63.24 C ATOM 2872 OG SER B 60 15.630 2.729 27.649 1.00 24.13 O ATOM 0 H SER B 60 13.309 2.909 26.540 1.00 44.21 H new ATOM 0 HA SER B 60 13.583 3.086 29.357 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.002 4.625 27.142 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.565 4.443 28.791 1.00 63.24 H new ATOM 0 HG SER B 60 16.234 2.454 28.370 1.00 24.13 H new ATOM 2878 N ALA B 61 12.477 5.784 27.797 1.00 21.42 N ATOM 2879 CA ALA B 61 11.720 7.015 27.987 1.00 31.00 C ATOM 2880 C ALA B 61 10.417 6.706 28.716 1.00 42.41 C ATOM 2881 O ALA B 61 9.970 7.470 29.566 1.00 44.10 O ATOM 2882 CB ALA B 61 11.442 7.682 26.643 1.00 4.34 C ATOM 0 H ALA B 61 12.667 5.554 26.822 1.00 21.42 H new ATOM 0 HA ALA B 61 12.307 7.707 28.591 1.00 31.00 H new ATOM 0 HB1 ALA B 61 10.876 8.600 26.802 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.386 7.919 26.152 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.865 7.005 26.013 1.00 4.34 H new ATOM 2888 N MET B 62 9.832 5.559 28.378 1.00 64.12 N ATOM 2889 CA MET B 62 8.619 5.071 29.028 1.00 62.41 C ATOM 2890 C MET B 62 8.889 4.810 30.515 1.00 51.11 C ATOM 2891 O MET B 62 8.034 5.077 31.368 1.00 53.32 O ATOM 2892 CB MET B 62 8.138 3.792 28.322 1.00 4.11 C ATOM 2893 CG MET B 62 6.781 3.260 28.777 1.00 71.00 C ATOM 2894 SD MET B 62 5.376 4.251 28.209 1.00 51.43 S ATOM 2895 CE MET B 62 5.320 5.562 29.427 1.00 33.40 C ATOM 0 H MET B 62 10.186 4.943 27.646 1.00 64.12 H new ATOM 0 HA MET B 62 7.835 5.825 28.954 1.00 62.41 H new ATOM 0 HB2 MET B 62 8.092 3.985 27.250 1.00 4.11 H new ATOM 0 HB3 MET B 62 8.884 3.012 28.474 1.00 4.11 H new ATOM 0 HG2 MET B 62 6.662 2.239 28.415 1.00 71.00 H new ATOM 0 HG3 MET B 62 6.766 3.216 29.866 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.284 5.757 29.705 1.00 33.40 H new ATOM 0 HE2 MET B 62 5.882 5.262 30.311 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.759 6.467 29.008 1.00 33.40 H new ATOM 2905 N LYS B 63 10.091 4.299 30.820 1.00 72.03 N ATOM 2906 CA LYS B 63 10.526 4.107 32.209 1.00 43.00 C ATOM 2907 C LYS B 63 10.502 5.446 32.934 1.00 70.35 C ATOM 2908 O LYS B 63 9.912 5.585 34.009 1.00 23.43 O ATOM 2909 CB LYS B 63 11.962 3.560 32.282 1.00 31.31 C ATOM 2910 CG LYS B 63 12.233 2.298 31.472 1.00 20.13 C ATOM 2911 CD LYS B 63 11.651 1.045 32.115 1.00 10.22 C ATOM 2912 CE LYS B 63 12.176 -0.211 31.426 1.00 1.23 C ATOM 2913 NZ LYS B 63 13.665 -0.278 31.462 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.778 4.012 30.123 1.00 72.03 H new ATOM 0 HA LYS B 63 9.846 3.391 32.671 1.00 43.00 H new ATOM 0 HB2 LYS B 63 12.645 4.339 31.944 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.201 3.357 33.326 1.00 31.31 H new ATOM 0 HG2 LYS B 63 11.813 2.416 30.473 1.00 20.13 H new ATOM 0 HG3 LYS B 63 13.309 2.173 31.353 1.00 20.13 H new ATOM 0 HD2 LYS B 63 11.910 1.020 33.173 1.00 10.22 H new ATOM 0 HD3 LYS B 63 10.563 1.071 32.054 1.00 10.22 H new ATOM 0 HE2 LYS B 63 11.760 -1.094 31.912 1.00 1.23 H new ATOM 0 HE3 LYS B 63 11.836 -0.227 30.391 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 13.987 -1.118 30.941 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 14.062 0.576 31.021 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 13.986 -0.339 32.449 1.00 55.13 H new ATOM 2927 N PHE B 64 11.163 6.430 32.321 1.00 21.33 N ATOM 2928 CA PHE B 64 11.294 7.759 32.912 1.00 32.24 C ATOM 2929 C PHE B 64 9.923 8.409 33.098 1.00 14.21 C ATOM 2930 O PHE B 64 9.637 8.981 34.153 1.00 73.11 O ATOM 2931 CB PHE B 64 12.200 8.652 32.050 1.00 30.41 C ATOM 2932 CG PHE B 64 12.475 10.001 32.669 1.00 63.34 C ATOM 2933 CD1 PHE B 64 13.216 10.099 33.840 1.00 43.42 C ATOM 2934 CD2 PHE B 64 11.992 11.168 32.091 1.00 31.33 C ATOM 2935 CE1 PHE B 64 13.468 11.328 34.419 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.242 12.399 32.666 1.00 33.41 C ATOM 2937 CZ PHE B 64 12.981 12.478 33.832 1.00 14.04 C ATOM 0 H PHE B 64 11.616 6.329 31.413 1.00 21.33 H new ATOM 0 HA PHE B 64 11.755 7.647 33.893 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.146 8.139 31.879 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.734 8.796 31.075 1.00 30.41 H new ATOM 0 HD1 PHE B 64 13.600 9.203 34.304 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.414 11.112 31.181 1.00 31.33 H new ATOM 0 HE1 PHE B 64 14.045 11.388 35.330 1.00 55.11 H new ATOM 0 HE2 PHE B 64 11.861 13.298 32.205 1.00 33.41 H new ATOM 0 HZ PHE B 64 13.177 13.439 34.283 1.00 14.04 H new ATOM 2947 N VAL B 65 9.075 8.307 32.076 1.00 75.05 N ATOM 2948 CA VAL B 65 7.720 8.847 32.147 1.00 40.30 C ATOM 2949 C VAL B 65 6.981 8.262 33.345 1.00 43.44 C ATOM 2950 O VAL B 65 6.451 8.999 34.176 1.00 35.52 O ATOM 2951 CB VAL B 65 6.905 8.565 30.859 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.435 8.937 31.060 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.495 9.319 29.669 1.00 51.21 C ATOM 0 H VAL B 65 9.303 7.856 31.190 1.00 75.05 H new ATOM 0 HA VAL B 65 7.816 9.927 32.255 1.00 40.30 H new ATOM 0 HB VAL B 65 6.962 7.497 30.646 1.00 54.45 H new ATOM 0 HG11 VAL B 65 4.879 8.732 30.145 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.019 8.348 31.877 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.358 9.997 31.301 1.00 70.43 H new ATOM 0 HG21 VAL B 65 6.907 9.106 28.776 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.474 10.390 29.870 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.525 8.999 29.510 1.00 51.21 H new ATOM 2963 N ALA B 66 6.972 6.935 33.443 1.00 30.22 N ATOM 2964 CA ALA B 66 6.347 6.261 34.575 1.00 74.13 C ATOM 2965 C ALA B 66 6.946 6.769 35.886 1.00 44.35 C ATOM 2966 O ALA B 66 6.247 6.918 36.891 1.00 34.23 O ATOM 2967 CB ALA B 66 6.519 4.751 34.454 1.00 23.44 C ATOM 0 H ALA B 66 7.389 6.308 32.755 1.00 30.22 H new ATOM 0 HA ALA B 66 5.280 6.485 34.573 1.00 74.13 H new ATOM 0 HB1 ALA B 66 6.047 4.262 35.306 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.052 4.404 33.532 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.581 4.506 34.437 1.00 23.44 H new ATOM 2973 N GLY B 67 8.235 7.088 35.835 1.00 23.35 N ATOM 2974 CA GLY B 67 8.960 7.515 37.017 1.00 73.24 C ATOM 2975 C GLY B 67 8.534 8.889 37.495 1.00 45.13 C ATOM 2976 O GLY B 67 8.547 9.167 38.697 1.00 75.04 O ATOM 0 H GLY B 67 8.796 7.057 34.984 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.803 6.791 37.817 1.00 73.24 H new ATOM 0 HA3 GLY B 67 10.028 7.524 36.800 1.00 73.24 H new ATOM 2980 N GLN B 68 8.133 9.749 36.556 1.00 2.12 N ATOM 2981 CA GLN B 68 7.719 11.109 36.889 1.00 44.13 C ATOM 2982 C GLN B 68 6.207 11.147 37.058 1.00 40.32 C ATOM 2983 O GLN B 68 5.652 12.082 37.633 1.00 64.50 O ATOM 2984 CB GLN B 68 8.168 12.104 35.804 1.00 33.05 C ATOM 2985 CG GLN B 68 7.697 11.744 34.398 1.00 52.44 C ATOM 2986 CD GLN B 68 7.890 12.872 33.399 1.00 54.32 C ATOM 2987 OE1 GLN B 68 8.919 12.962 32.732 1.00 53.51 O ATOM 2988 NE2 GLN B 68 6.903 13.750 33.304 1.00 53.21 N ATOM 0 H GLN B 68 8.087 9.526 35.562 1.00 2.12 H new ATOM 0 HA GLN B 68 8.195 11.405 37.824 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.794 13.096 36.058 1.00 33.05 H new ATOM 0 HB3 GLN B 68 9.256 12.163 35.807 1.00 33.05 H new ATOM 0 HG2 GLN B 68 8.240 10.864 34.053 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.642 11.474 34.433 1.00 52.44 H new ATOM 0 HE21 GLN B 68 6.065 13.639 33.875 1.00 53.21 H new ATOM 0 HE22 GLN B 68 6.981 14.537 32.659 1.00 53.21 H new ATOM 2997 N ASN B 69 5.555 10.109 36.547 1.00 21.43 N ATOM 2998 CA ASN B 69 4.109 9.949 36.656 1.00 41.54 C ATOM 2999 C ASN B 69 3.748 9.186 37.932 1.00 23.00 C ATOM 3000 O ASN B 69 2.571 8.973 38.226 1.00 34.41 O ATOM 3001 CB ASN B 69 3.566 9.216 35.417 1.00 65.13 C ATOM 3002 CG ASN B 69 3.398 10.111 34.192 1.00 21.52 C ATOM 3003 OD1 ASN B 69 4.224 11.137 34.072 1.00 65.21 O flip ATOM 3004 ND2 ASN B 69 2.529 9.875 33.353 1.00 45.52 N flip ATOM 0 H ASN B 69 6.016 9.351 36.043 1.00 21.43 H new ATOM 0 HA ASN B 69 3.650 10.936 36.708 1.00 41.54 H new ATOM 0 HB2 ASN B 69 4.241 8.397 35.167 1.00 65.13 H new ATOM 0 HB3 ASN B 69 2.602 8.771 35.664 1.00 65.13 H new ATOM 0 HD21 ASN B 69 1.907 9.076 33.474 1.00 45.52 H new ATOM 0 HD22 ASN B 69 2.431 10.479 32.537 1.00 45.52 H new ATOM 3011 N LYS B 70 4.779 8.776 38.680 1.00 4.22 N ATOM 3012 CA LYS B 70 4.611 8.073 39.956 1.00 71.04 C ATOM 3013 C LYS B 70 3.884 6.739 39.769 1.00 55.13 C ATOM 3014 O LYS B 70 3.287 6.198 40.704 1.00 71.33 O ATOM 3015 CB LYS B 70 3.879 8.961 40.978 1.00 43.15 C ATOM 3016 CG LYS B 70 4.787 9.969 41.684 1.00 61.50 C ATOM 3017 CD LYS B 70 5.656 10.757 40.706 1.00 21.25 C ATOM 3018 CE LYS B 70 6.266 11.994 41.357 1.00 20.34 C ATOM 3019 NZ LYS B 70 7.046 12.811 40.389 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.754 8.923 38.417 1.00 4.22 H new ATOM 0 HA LYS B 70 5.605 7.853 40.346 1.00 71.04 H new ATOM 0 HB2 LYS B 70 3.080 9.500 40.470 1.00 43.15 H new ATOM 0 HB3 LYS B 70 3.408 8.324 41.727 1.00 43.15 H new ATOM 0 HG2 LYS B 70 4.175 10.662 42.262 1.00 61.50 H new ATOM 0 HG3 LYS B 70 5.427 9.443 42.392 1.00 61.50 H new ATOM 0 HD2 LYS B 70 6.452 10.115 40.329 1.00 21.25 H new ATOM 0 HD3 LYS B 70 5.055 11.057 39.847 1.00 21.25 H new ATOM 0 HE2 LYS B 70 5.473 12.604 41.788 1.00 20.34 H new ATOM 0 HE3 LYS B 70 6.915 11.688 42.178 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 6.954 13.818 40.632 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 8.048 12.535 40.430 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 6.682 12.652 39.428 1.00 73.12 H new ATOM 3033 N GLN B 71 3.973 6.201 38.563 1.00 41.03 N ATOM 3034 CA GLN B 71 3.357 4.923 38.231 1.00 14.44 C ATOM 3035 C GLN B 71 4.434 3.895 37.898 1.00 73.31 C ATOM 3036 O GLN B 71 5.581 4.252 37.628 1.00 34.15 O ATOM 3037 CB GLN B 71 2.396 5.078 37.047 1.00 1.40 C ATOM 3038 CG GLN B 71 3.027 5.778 35.852 1.00 33.32 C ATOM 3039 CD GLN B 71 2.389 5.412 34.529 1.00 34.04 C ATOM 3040 OE1 GLN B 71 2.983 4.446 33.860 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 1.405 6.009 34.101 1.00 0.43 N flip ATOM 0 H GLN B 71 4.473 6.636 37.787 1.00 41.03 H new ATOM 0 HA GLN B 71 2.789 4.578 39.095 1.00 14.44 H new ATOM 0 HB2 GLN B 71 2.046 4.093 36.740 1.00 1.40 H new ATOM 0 HB3 GLN B 71 1.520 5.641 37.369 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.956 6.856 35.994 1.00 33.32 H new ATOM 0 HG3 GLN B 71 4.088 5.531 35.815 1.00 33.32 H new ATOM 0 HE21 GLN B 71 0.978 6.751 34.655 1.00 0.43 H new ATOM 0 HE22 GLN B 71 1.015 5.763 33.191 1.00 0.43 H new ATOM 3050 N THR B 72 4.059 2.626 37.911 1.00 1.35 N ATOM 3051 CA THR B 72 4.990 1.544 37.617 1.00 51.41 C ATOM 3052 C THR B 72 4.442 0.658 36.503 1.00 74.12 C ATOM 3053 O THR B 72 3.253 0.329 36.488 1.00 25.05 O ATOM 3054 CB THR B 72 5.274 0.693 38.877 1.00 13.02 C ATOM 3055 OG1 THR B 72 4.041 0.306 39.506 1.00 4.22 O ATOM 3056 CG2 THR B 72 6.139 1.460 39.875 1.00 71.50 C ATOM 0 H THR B 72 3.110 2.317 38.123 1.00 1.35 H new ATOM 0 HA THR B 72 5.928 1.991 37.288 1.00 51.41 H new ATOM 0 HB THR B 72 5.815 -0.199 38.562 1.00 13.02 H new ATOM 0 HG1 THR B 72 4.235 -0.233 40.301 1.00 4.22 H new ATOM 0 HG21 THR B 72 6.323 0.838 40.751 1.00 71.50 H new ATOM 0 HG22 THR B 72 7.089 1.720 39.409 1.00 71.50 H new ATOM 0 HG23 THR B 72 5.623 2.371 40.179 1.00 71.50 H new ATOM 3064 N LEU B 73 5.312 0.293 35.571 1.00 74.12 N ATOM 3065 CA LEU B 73 4.931 -0.513 34.416 1.00 52.35 C ATOM 3066 C LEU B 73 5.515 -1.923 34.536 1.00 64.24 C ATOM 3067 O LEU B 73 6.615 -2.096 35.068 1.00 14.14 O ATOM 3068 CB LEU B 73 5.415 0.172 33.130 1.00 75.15 C ATOM 3069 CG LEU B 73 4.806 1.560 32.867 1.00 62.34 C ATOM 3070 CD1 LEU B 73 5.456 2.215 31.656 1.00 33.12 C ATOM 3071 CD2 LEU B 73 3.291 1.460 32.682 1.00 51.14 C ATOM 0 H LEU B 73 6.300 0.546 35.593 1.00 74.12 H new ATOM 0 HA LEU B 73 3.845 -0.601 34.379 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.500 0.270 33.174 1.00 75.15 H new ATOM 0 HB3 LEU B 73 5.187 -0.475 32.283 1.00 75.15 H new ATOM 0 HG LEU B 73 5.002 2.187 33.737 1.00 62.34 H new ATOM 0 HD11 LEU B 73 5.010 3.195 31.489 1.00 33.12 H new ATOM 0 HD12 LEU B 73 6.525 2.329 31.834 1.00 33.12 H new ATOM 0 HD13 LEU B 73 5.299 1.590 30.777 1.00 33.12 H new ATOM 0 HD21 LEU B 73 2.881 2.453 32.497 1.00 51.14 H new ATOM 0 HD22 LEU B 73 3.070 0.812 31.834 1.00 51.14 H new ATOM 0 HD23 LEU B 73 2.841 1.043 33.583 1.00 51.14 H new ATOM 3083 N PRO B 74 4.779 -2.949 34.061 1.00 22.31 N ATOM 3084 CA PRO B 74 5.227 -4.350 34.128 1.00 33.15 C ATOM 3085 C PRO B 74 6.560 -4.583 33.407 1.00 51.21 C ATOM 3086 O PRO B 74 6.868 -3.917 32.418 1.00 62.01 O ATOM 3087 CB PRO B 74 4.099 -5.124 33.427 1.00 23.12 C ATOM 3088 CG PRO B 74 2.907 -4.230 33.518 1.00 12.13 C ATOM 3089 CD PRO B 74 3.446 -2.829 33.438 1.00 51.43 C ATOM 0 HA PRO B 74 5.406 -4.663 35.157 1.00 33.15 H new ATOM 0 HB2 PRO B 74 4.353 -5.339 32.389 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.914 -6.081 33.915 1.00 23.12 H new ATOM 0 HG2 PRO B 74 2.206 -4.427 32.707 1.00 12.13 H new ATOM 0 HG3 PRO B 74 2.367 -4.390 34.451 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.512 -2.480 32.407 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.813 -2.122 33.974 1.00 51.43 H new ATOM 3097 N ALA B 75 7.334 -5.542 33.905 1.00 24.41 N ATOM 3098 CA ALA B 75 8.620 -5.901 33.306 1.00 71.53 C ATOM 3099 C ALA B 75 8.417 -6.726 32.043 1.00 71.01 C ATOM 3100 O ALA B 75 9.265 -6.759 31.151 1.00 12.42 O ATOM 3101 CB ALA B 75 9.447 -6.695 34.301 1.00 50.55 C ATOM 0 H ALA B 75 7.092 -6.091 34.730 1.00 24.41 H new ATOM 0 HA ALA B 75 9.144 -4.982 33.043 1.00 71.53 H new ATOM 0 HB1 ALA B 75 10.403 -6.960 33.850 1.00 50.55 H new ATOM 0 HB2 ALA B 75 9.621 -6.092 35.193 1.00 50.55 H new ATOM 0 HB3 ALA B 75 8.912 -7.604 34.576 1.00 50.55 H new ATOM 3107 N ASP B 76 7.263 -7.360 31.977 1.00 24.20 N ATOM 3108 CA ASP B 76 6.938 -8.320 30.927 1.00 60.22 C ATOM 3109 C ASP B 76 6.490 -7.617 29.644 1.00 14.12 C ATOM 3110 O ASP B 76 5.859 -8.229 28.779 1.00 34.13 O ATOM 3111 CB ASP B 76 5.819 -9.232 31.434 1.00 21.51 C ATOM 3112 CG ASP B 76 6.236 -10.104 32.607 1.00 33.51 C ATOM 3113 OD1 ASP B 76 6.341 -9.579 33.736 1.00 23.44 O ATOM 3114 OD2 ASP B 76 6.426 -11.320 32.413 1.00 41.11 O1- ATOM 0 H ASP B 76 6.513 -7.226 32.655 1.00 24.20 H new ATOM 0 HA ASP B 76 7.830 -8.900 30.691 1.00 60.22 H new ATOM 0 HB2 ASP B 76 4.968 -8.620 31.731 1.00 21.51 H new ATOM 0 HB3 ASP B 76 5.483 -9.871 30.617 1.00 21.51 H new ATOM 3119 N THR B 77 6.822 -6.340 29.522 1.00 44.41 N ATOM 3120 CA THR B 77 6.397 -5.539 28.385 1.00 1.21 C ATOM 3121 C THR B 77 7.449 -5.552 27.275 1.00 31.44 C ATOM 3122 O THR B 77 8.631 -5.824 27.519 1.00 72.52 O ATOM 3123 CB THR B 77 6.097 -4.084 28.813 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.617 -3.323 27.694 1.00 73.25 O ATOM 3125 CG2 THR B 77 7.333 -3.406 29.396 1.00 30.02 C ATOM 0 H THR B 77 7.389 -5.834 30.202 1.00 44.41 H new ATOM 0 HA THR B 77 5.481 -5.984 27.997 1.00 1.21 H new ATOM 0 HB THR B 77 5.329 -4.122 29.586 1.00 44.03 H new ATOM 0 HG1 THR B 77 5.065 -3.896 27.122 1.00 73.25 H new ATOM 0 HG21 THR B 77 7.085 -2.385 29.686 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.673 -3.959 30.271 1.00 30.02 H new ATOM 0 HG23 THR B 77 8.125 -3.389 28.648 1.00 30.02 H new ATOM 3133 N THR B 78 7.008 -5.268 26.054 1.00 70.31 N ATOM 3134 CA THR B 78 7.883 -5.255 24.889 1.00 64.53 C ATOM 3135 C THR B 78 7.335 -4.301 23.825 1.00 71.23 C ATOM 3136 O THR B 78 6.126 -4.082 23.735 1.00 64.44 O ATOM 3137 CB THR B 78 8.021 -6.672 24.277 1.00 53.44 C ATOM 3138 OG1 THR B 78 8.480 -7.608 25.265 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.984 -6.688 23.097 1.00 23.30 C ATOM 0 H THR B 78 6.036 -5.041 25.845 1.00 70.31 H new ATOM 0 HA THR B 78 8.866 -4.916 25.217 1.00 64.53 H new ATOM 0 HB THR B 78 7.031 -6.961 23.924 1.00 53.44 H new ATOM 0 HG1 THR B 78 8.560 -8.497 24.861 1.00 34.22 H new ATOM 0 HG21 THR B 78 9.052 -7.700 22.697 1.00 23.30 H new ATOM 0 HG22 THR B 78 8.620 -6.015 22.321 1.00 23.30 H new ATOM 0 HG23 THR B 78 9.970 -6.361 23.428 1.00 23.30 H new ATOM 3147 N VAL B 79 8.235 -3.737 23.034 1.00 22.45 N ATOM 3148 CA VAL B 79 7.870 -2.886 21.904 1.00 23.02 C ATOM 3149 C VAL B 79 8.504 -3.439 20.644 1.00 31.21 C ATOM 3150 O VAL B 79 9.720 -3.600 20.576 1.00 14.34 O ATOM 3151 CB VAL B 79 8.316 -1.413 22.095 1.00 21.11 C ATOM 3152 CG1 VAL B 79 8.007 -0.581 20.847 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.638 -0.809 23.314 1.00 54.24 C ATOM 0 H VAL B 79 9.241 -3.855 23.155 1.00 22.45 H new ATOM 0 HA VAL B 79 6.783 -2.889 21.830 1.00 23.02 H new ATOM 0 HB VAL B 79 9.395 -1.402 22.252 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.329 0.448 21.007 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.537 -0.999 19.991 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.934 -0.599 20.654 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.961 0.225 23.435 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.557 -0.838 23.181 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.910 -1.380 24.202 1.00 54.24 H new ATOM 3163 N THR B 80 7.683 -3.744 19.659 1.00 72.42 N ATOM 3164 CA THR B 80 8.168 -4.363 18.433 1.00 23.21 C ATOM 3165 C THR B 80 8.170 -3.366 17.277 1.00 63.22 C ATOM 3166 O THR B 80 7.117 -3.003 16.754 1.00 42.43 O ATOM 3167 CB THR B 80 7.328 -5.604 18.059 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.193 -6.458 19.204 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.984 -6.381 16.922 1.00 64.25 C ATOM 0 H THR B 80 6.677 -3.575 19.680 1.00 72.42 H new ATOM 0 HA THR B 80 9.193 -4.684 18.618 1.00 23.21 H new ATOM 0 HB THR B 80 6.345 -5.268 17.730 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.658 -7.244 18.965 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.374 -7.250 16.676 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.071 -5.739 16.045 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.976 -6.709 17.231 1.00 64.25 H new ATOM 3177 N ALA B 81 9.362 -2.922 16.893 1.00 41.34 N ATOM 3178 CA ALA B 81 9.519 -1.976 15.798 1.00 73.43 C ATOM 3179 C ALA B 81 9.761 -2.719 14.491 1.00 13.31 C ATOM 3180 O ALA B 81 10.774 -3.404 14.334 1.00 32.14 O ATOM 3181 CB ALA B 81 10.670 -1.020 16.089 1.00 31.52 C ATOM 0 H ALA B 81 10.239 -3.206 17.329 1.00 41.34 H new ATOM 0 HA ALA B 81 8.602 -1.395 15.701 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.777 -0.317 15.263 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.463 -0.471 17.008 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.594 -1.587 16.205 1.00 31.52 H new ATOM 3187 N GLU B 82 8.822 -2.597 13.563 1.00 50.12 N ATOM 3188 CA GLU B 82 8.943 -3.233 12.258 1.00 53.10 C ATOM 3189 C GLU B 82 9.008 -2.154 11.184 1.00 51.21 C ATOM 3190 O GLU B 82 8.017 -1.471 10.914 1.00 13.21 O ATOM 3191 CB GLU B 82 7.766 -4.195 12.016 1.00 51.24 C ATOM 3192 CG GLU B 82 7.931 -5.065 10.774 1.00 31.41 C ATOM 3193 CD GLU B 82 6.841 -6.119 10.635 1.00 63.34 C ATOM 3194 OE1 GLU B 82 5.804 -5.832 10.000 1.00 35.34 O ATOM 3195 OE2 GLU B 82 7.018 -7.243 11.159 1.00 71.23 O1- ATOM 0 H GLU B 82 7.964 -2.061 13.691 1.00 50.12 H new ATOM 0 HA GLU B 82 9.858 -3.824 12.220 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.650 -4.839 12.887 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.848 -3.615 11.923 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.928 -4.429 9.889 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.903 -5.558 10.809 1.00 31.41 H new ATOM 3202 N VAL B 83 10.186 -1.982 10.598 1.00 40.31 N ATOM 3203 CA VAL B 83 10.426 -0.895 9.654 1.00 71.44 C ATOM 3204 C VAL B 83 10.525 -1.422 8.233 1.00 35.11 C ATOM 3205 O VAL B 83 10.945 -2.556 8.010 1.00 1.44 O ATOM 3206 CB VAL B 83 11.716 -0.113 9.998 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.556 0.631 11.319 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.925 -1.049 10.042 1.00 51.35 C ATOM 0 H VAL B 83 10.994 -2.583 10.760 1.00 40.31 H new ATOM 0 HA VAL B 83 9.576 -0.217 9.731 1.00 71.44 H new ATOM 0 HB VAL B 83 11.889 0.622 9.212 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.474 1.175 11.544 1.00 71.22 H new ATOM 0 HG12 VAL B 83 10.727 1.334 11.242 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.353 -0.084 12.117 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.820 -0.476 10.286 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.766 -1.814 10.802 1.00 51.35 H new ATOM 0 HG23 VAL B 83 13.052 -1.525 9.070 1.00 51.35 H new ATOM 3218 N GLY B 84 10.147 -0.591 7.278 1.00 51.11 N ATOM 3219 CA GLY B 84 10.183 -0.980 5.889 1.00 52.45 C ATOM 3220 C GLY B 84 10.593 0.160 4.993 1.00 30.33 C ATOM 3221 O GLY B 84 10.577 1.322 5.402 1.00 4.21 O ATOM 0 H GLY B 84 9.812 0.358 7.444 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.880 -1.809 5.763 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.200 -1.342 5.588 1.00 52.45 H new ATOM 3225 N ILE B 85 10.950 -0.178 3.770 1.00 72.33 N ATOM 3226 CA ILE B 85 11.365 0.788 2.774 1.00 70.35 C ATOM 3227 C ILE B 85 10.704 0.439 1.449 1.00 24.30 C ATOM 3228 O ILE B 85 10.718 -0.725 1.022 1.00 65.43 O ATOM 3229 CB ILE B 85 12.918 0.828 2.630 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.368 1.857 1.567 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.468 -0.562 2.311 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.388 1.328 0.146 1.00 22.31 C ATOM 0 H ILE B 85 10.960 -1.142 3.437 1.00 72.33 H new ATOM 0 HA ILE B 85 11.051 1.783 3.089 1.00 70.35 H new ATOM 0 HB ILE B 85 13.328 1.149 3.587 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.703 2.719 1.610 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.366 2.211 1.823 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.553 -0.511 2.215 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.207 -1.250 3.115 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.037 -0.918 1.375 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.715 2.117 -0.531 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.076 0.485 0.081 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.387 1.001 -0.135 1.00 22.31 H new ATOM 3244 N GLY B 86 10.103 1.449 0.830 1.00 43.24 N ATOM 3245 CA GLY B 86 9.429 1.288 -0.445 1.00 50.02 C ATOM 3246 C GLY B 86 9.655 2.489 -1.343 1.00 52.30 C ATOM 3247 O GLY B 86 10.187 3.504 -0.885 1.00 42.02 O ATOM 0 H GLY B 86 10.071 2.399 1.200 1.00 43.24 H new ATOM 0 HA2 GLY B 86 9.793 0.388 -0.940 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.360 1.151 -0.279 1.00 50.02 H new ATOM 3251 N PRO B 87 9.277 2.411 -2.631 1.00 42.21 N ATOM 3252 CA PRO B 87 9.494 3.492 -3.583 1.00 30.25 C ATOM 3253 C PRO B 87 8.469 4.609 -3.419 1.00 61.30 C ATOM 3254 O PRO B 87 7.259 4.380 -3.505 1.00 52.32 O ATOM 3255 CB PRO B 87 9.345 2.816 -4.962 1.00 44.10 C ATOM 3256 CG PRO B 87 9.058 1.370 -4.688 1.00 14.42 C ATOM 3257 CD PRO B 87 8.582 1.289 -3.262 1.00 45.13 C ATOM 0 HA PRO B 87 10.465 3.966 -3.443 1.00 30.25 H new ATOM 0 HB2 PRO B 87 8.537 3.272 -5.534 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.255 2.928 -5.551 1.00 44.10 H new ATOM 0 HG2 PRO B 87 8.300 0.989 -5.372 1.00 14.42 H new ATOM 0 HG3 PRO B 87 9.952 0.763 -4.833 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.499 1.390 -3.189 1.00 45.13 H new ATOM 0 HD3 PRO B 87 8.845 0.337 -2.800 1.00 45.13 H new ATOM 3265 N ASN B 88 8.960 5.812 -3.167 1.00 53.24 N ATOM 3266 CA ASN B 88 8.106 6.990 -3.095 1.00 21.43 C ATOM 3267 C ASN B 88 7.585 7.295 -4.490 1.00 21.10 C ATOM 3268 O ASN B 88 8.344 7.236 -5.460 1.00 51.23 O ATOM 3269 CB ASN B 88 8.891 8.196 -2.546 1.00 72.30 C ATOM 3270 CG ASN B 88 8.019 9.418 -2.273 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.953 9.591 -2.866 1.00 5.32 O ATOM 3272 ND2 ASN B 88 8.485 10.293 -1.396 1.00 3.11 N ATOM 0 H ASN B 88 9.950 6.000 -3.008 1.00 53.24 H new ATOM 0 HA ASN B 88 7.273 6.796 -2.419 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.392 7.904 -1.623 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.670 8.467 -3.259 1.00 72.30 H new ATOM 0 HD21 ASN B 88 7.958 11.142 -1.193 1.00 3.11 H new ATOM 0 HD22 ASN B 88 9.372 10.118 -0.923 1.00 3.11 H new ATOM 3279 N GLU B 89 6.301 7.617 -4.593 1.00 65.22 N ATOM 3280 CA GLU B 89 5.679 7.911 -5.882 1.00 51.32 C ATOM 3281 C GLU B 89 6.325 9.133 -6.543 1.00 22.42 C ATOM 3282 O GLU B 89 6.175 9.355 -7.745 1.00 11.02 O ATOM 3283 CB GLU B 89 4.168 8.115 -5.712 1.00 62.31 C ATOM 3284 CG GLU B 89 3.796 9.104 -4.612 1.00 11.15 C ATOM 3285 CD GLU B 89 2.299 9.356 -4.540 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.578 8.552 -3.911 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.835 10.357 -5.122 1.00 35.35 O1- ATOM 0 H GLU B 89 5.667 7.682 -3.797 1.00 65.22 H new ATOM 0 HA GLU B 89 5.840 7.057 -6.540 1.00 51.32 H new ATOM 0 HB2 GLU B 89 3.750 8.464 -6.656 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.704 7.153 -5.494 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.144 8.723 -3.652 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.312 10.048 -4.786 1.00 11.15 H new ATOM 3294 N GLU B 90 7.050 9.915 -5.746 1.00 52.12 N ATOM 3295 CA GLU B 90 7.818 11.055 -6.250 1.00 15.12 C ATOM 3296 C GLU B 90 8.981 10.578 -7.131 1.00 74.05 C ATOM 3297 O GLU B 90 9.494 11.316 -7.975 1.00 53.12 O ATOM 3298 CB GLU B 90 8.343 11.881 -5.066 1.00 14.23 C ATOM 3299 CG GLU B 90 9.343 12.959 -5.460 1.00 30.33 C ATOM 3300 CD GLU B 90 9.801 13.803 -4.280 1.00 5.15 C ATOM 3301 OE1 GLU B 90 10.818 13.455 -3.648 1.00 54.43 O ATOM 3302 OE2 GLU B 90 9.142 14.824 -3.982 1.00 12.50 O1- ATOM 0 H GLU B 90 7.123 9.779 -4.738 1.00 52.12 H new ATOM 0 HA GLU B 90 7.167 11.679 -6.862 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.499 12.350 -4.560 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.812 11.209 -4.347 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.211 12.490 -5.923 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.893 13.608 -6.211 1.00 30.33 H new ATOM 3309 N GLY B 91 9.357 9.321 -6.952 1.00 72.20 N ATOM 3310 CA GLY B 91 10.476 8.749 -7.682 1.00 12.11 C ATOM 3311 C GLY B 91 11.708 8.618 -6.809 1.00 71.02 C ATOM 3312 O GLY B 91 12.835 8.796 -7.273 1.00 5.53 O ATOM 0 H GLY B 91 8.902 8.677 -6.306 1.00 72.20 H new ATOM 0 HA2 GLY B 91 10.196 7.768 -8.066 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.706 9.375 -8.544 1.00 12.11 H new ATOM 3316 N GLY B 92 11.481 8.316 -5.535 1.00 60.34 N ATOM 3317 CA GLY B 92 12.567 8.111 -4.594 1.00 61.32 C ATOM 3318 C GLY B 92 12.256 6.967 -3.657 1.00 12.52 C ATOM 3319 O GLY B 92 11.554 6.030 -4.038 1.00 70.13 O ATOM 0 H GLY B 92 10.550 8.208 -5.133 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.489 7.903 -5.136 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.734 9.022 -4.020 1.00 61.32 H new ATOM 3323 N PHE B 93 12.748 7.042 -2.430 1.00 71.13 N ATOM 3324 CA PHE B 93 12.473 6.013 -1.432 1.00 4.00 C ATOM 3325 C PHE B 93 11.738 6.616 -0.245 1.00 73.12 C ATOM 3326 O PHE B 93 11.847 7.814 0.022 1.00 63.14 O ATOM 3327 CB PHE B 93 13.770 5.337 -0.975 1.00 42.41 C ATOM 3328 CG PHE B 93 14.453 4.556 -2.070 1.00 52.32 C ATOM 3329 CD1 PHE B 93 15.711 4.922 -2.528 1.00 72.40 C ATOM 3330 CD2 PHE B 93 13.830 3.456 -2.646 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.333 4.206 -3.534 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.449 2.738 -3.651 1.00 20.53 C ATOM 3333 CZ PHE B 93 15.702 3.114 -4.096 1.00 20.53 C ATOM 0 H PHE B 93 13.340 7.804 -2.099 1.00 71.13 H new ATOM 0 HA PHE B 93 11.838 5.253 -1.887 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.455 6.097 -0.599 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.549 4.667 -0.144 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.210 5.776 -2.094 1.00 72.40 H new ATOM 0 HD2 PHE B 93 12.850 3.158 -2.304 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.313 4.501 -3.880 1.00 54.33 H new ATOM 0 HE2 PHE B 93 13.954 1.884 -4.088 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.187 2.555 -4.882 1.00 20.53 H new ATOM 3343 N ALA B 94 10.988 5.779 0.458 1.00 22.42 N ATOM 3344 CA ALA B 94 10.195 6.215 1.595 1.00 62.21 C ATOM 3345 C ALA B 94 10.245 5.162 2.696 1.00 42.21 C ATOM 3346 O ALA B 94 10.149 3.962 2.421 1.00 61.15 O ATOM 3347 CB ALA B 94 8.757 6.489 1.158 1.00 43.22 C ATOM 0 H ALA B 94 10.913 4.782 0.256 1.00 22.42 H new ATOM 0 HA ALA B 94 10.610 7.142 1.991 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.171 6.815 2.018 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.750 7.270 0.397 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.322 5.578 0.747 1.00 43.22 H new ATOM 3353 N LEU B 95 10.420 5.616 3.934 1.00 51.40 N ATOM 3354 CA LEU B 95 10.529 4.721 5.082 1.00 52.52 C ATOM 3355 C LEU B 95 9.206 4.639 5.833 1.00 31.45 C ATOM 3356 O LEU B 95 8.577 5.659 6.126 1.00 74.21 O ATOM 3357 CB LEU B 95 11.654 5.184 6.028 1.00 5.44 C ATOM 3358 CG LEU B 95 13.079 4.746 5.633 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.239 3.234 5.781 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.414 5.183 4.208 1.00 13.14 C ATOM 0 H LEU B 95 10.490 6.606 4.169 1.00 51.40 H new ATOM 0 HA LEU B 95 10.776 3.726 4.711 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.631 6.272 6.086 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.441 4.807 7.028 1.00 5.44 H new ATOM 0 HG LEU B 95 13.779 5.236 6.310 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.251 2.946 5.497 1.00 3.52 H new ATOM 0 HD12 LEU B 95 13.057 2.949 6.817 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.523 2.727 5.134 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.424 4.861 3.957 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.706 4.732 3.513 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.351 6.269 4.136 1.00 13.14 H new ATOM 3372 N ASP B 96 8.804 3.413 6.132 1.00 51.23 N ATOM 3373 CA ASP B 96 7.569 3.131 6.861 1.00 11.24 C ATOM 3374 C ASP B 96 7.899 2.408 8.160 1.00 14.30 C ATOM 3375 O ASP B 96 8.422 1.294 8.144 1.00 55.22 O ATOM 3376 CB ASP B 96 6.650 2.263 6.003 1.00 22.11 C ATOM 3377 CG ASP B 96 5.364 1.861 6.714 1.00 4.43 C ATOM 3378 OD1 ASP B 96 5.174 0.649 6.977 1.00 73.12 O ATOM 3379 OD2 ASP B 96 4.527 2.745 6.993 1.00 73.53 O1- ATOM 0 H ASP B 96 9.328 2.576 5.875 1.00 51.23 H new ATOM 0 HA ASP B 96 7.062 4.068 7.090 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.399 2.804 5.091 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.187 1.363 5.703 1.00 22.11 H new ATOM 3384 N VAL B 97 7.605 3.047 9.277 1.00 43.21 N ATOM 3385 CA VAL B 97 7.942 2.506 10.593 1.00 65.34 C ATOM 3386 C VAL B 97 6.680 2.158 11.370 1.00 4.12 C ATOM 3387 O VAL B 97 5.923 3.040 11.763 1.00 1.23 O ATOM 3388 CB VAL B 97 8.780 3.507 11.427 1.00 44.15 C ATOM 3389 CG1 VAL B 97 9.148 2.907 12.786 1.00 31.14 C ATOM 3390 CG2 VAL B 97 10.030 3.939 10.660 1.00 13.32 C ATOM 0 H VAL B 97 7.130 3.949 9.305 1.00 43.21 H new ATOM 0 HA VAL B 97 8.534 1.607 10.423 1.00 65.34 H new ATOM 0 HB VAL B 97 8.173 4.394 11.606 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.736 3.627 13.354 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.238 2.667 13.336 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.732 1.999 12.637 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.603 4.642 11.265 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.643 3.065 10.441 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.736 4.419 9.727 1.00 13.32 H new ATOM 3400 N GLU B 98 6.449 0.874 11.588 1.00 55.41 N ATOM 3401 CA GLU B 98 5.289 0.429 12.346 1.00 61.25 C ATOM 3402 C GLU B 98 5.716 -0.004 13.747 1.00 55.42 C ATOM 3403 O GLU B 98 6.341 -1.053 13.925 1.00 74.01 O ATOM 3404 CB GLU B 98 4.577 -0.704 11.595 1.00 43.20 C ATOM 3405 CG GLU B 98 4.231 -0.331 10.154 1.00 33.43 C ATOM 3406 CD GLU B 98 3.338 -1.348 9.467 1.00 35.25 C ATOM 3407 OE1 GLU B 98 3.828 -2.446 9.135 1.00 70.42 O ATOM 3408 OE2 GLU B 98 2.142 -1.048 9.244 1.00 74.42 O1- ATOM 0 H GLU B 98 7.049 0.121 11.251 1.00 55.41 H new ATOM 0 HA GLU B 98 4.584 1.253 12.453 1.00 61.25 H new ATOM 0 HB2 GLU B 98 5.213 -1.589 11.594 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.663 -0.969 12.127 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.736 0.640 10.147 1.00 33.43 H new ATOM 0 HG3 GLU B 98 5.153 -0.223 9.583 1.00 33.43 H new ATOM 3415 N LEU B 99 5.394 0.828 14.735 1.00 61.12 N ATOM 3416 CA LEU B 99 5.781 0.581 16.122 1.00 54.24 C ATOM 3417 C LEU B 99 4.664 -0.145 16.864 1.00 51.12 C ATOM 3418 O LEU B 99 3.564 0.393 17.027 1.00 12.44 O ATOM 3419 CB LEU B 99 6.103 1.904 16.836 1.00 60.12 C ATOM 3420 CG LEU B 99 7.302 2.688 16.274 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.491 4.001 17.029 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.576 1.846 16.333 1.00 1.13 C ATOM 0 H LEU B 99 4.861 1.687 14.598 1.00 61.12 H new ATOM 0 HA LEU B 99 6.673 -0.046 16.120 1.00 54.24 H new ATOM 0 HB2 LEU B 99 5.221 2.543 16.793 1.00 60.12 H new ATOM 0 HB3 LEU B 99 6.292 1.692 17.888 1.00 60.12 H new ATOM 0 HG LEU B 99 7.095 2.921 15.230 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.344 4.539 16.615 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.593 4.611 16.928 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.671 3.792 18.083 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.411 2.420 15.931 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.786 1.577 17.368 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.441 0.940 15.742 1.00 1.13 H new ATOM 3434 N ARG B 100 4.953 -1.362 17.309 1.00 53.41 N ATOM 3435 CA ARG B 100 3.978 -2.184 18.014 1.00 2.45 C ATOM 3436 C ARG B 100 4.211 -2.101 19.515 1.00 14.01 C ATOM 3437 O ARG B 100 5.331 -2.290 19.986 1.00 24.14 O ATOM 3438 CB ARG B 100 4.071 -3.642 17.557 1.00 53.52 C ATOM 3439 CG ARG B 100 3.877 -3.837 16.058 1.00 13.43 C ATOM 3440 CD ARG B 100 3.954 -5.304 15.676 1.00 64.11 C ATOM 3441 NE ARG B 100 3.758 -5.518 14.243 1.00 3.43 N ATOM 3442 CZ ARG B 100 3.286 -6.648 13.713 1.00 52.33 C ATOM 3443 NH1 ARG B 100 2.905 -7.651 14.502 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 3.179 -6.763 12.397 1.00 11.32 N ATOM 0 H ARG B 100 5.865 -1.805 17.192 1.00 53.41 H new ATOM 0 HA ARG B 100 2.981 -1.807 17.783 1.00 2.45 H new ATOM 0 HB2 ARG B 100 5.045 -4.039 17.841 1.00 53.52 H new ATOM 0 HB3 ARG B 100 3.321 -4.227 18.089 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.910 -3.432 15.759 1.00 13.43 H new ATOM 0 HG3 ARG B 100 4.639 -3.278 15.515 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.925 -5.703 15.971 1.00 64.11 H new ATOM 0 HD3 ARG B 100 3.199 -5.861 16.230 1.00 64.11 H new ATOM 0 HE ARG B 100 3.997 -4.756 13.609 1.00 3.43 H new ATOM 0 HH11 ARG B 100 2.973 -7.557 15.515 1.00 41.53 H new ATOM 0 HH12 ARG B 100 2.545 -8.513 14.093 1.00 41.53 H new ATOM 0 HH21 ARG B 100 3.457 -5.989 11.793 1.00 11.32 H new ATOM 0 HH22 ARG B 100 2.819 -7.625 11.988 1.00 11.32 H new ATOM 3458 N VAL B 101 3.153 -1.819 20.261 1.00 41.00 N ATOM 3459 CA VAL B 101 3.246 -1.675 21.708 1.00 50.20 C ATOM 3460 C VAL B 101 2.551 -2.832 22.416 1.00 3.30 C ATOM 3461 O VAL B 101 1.326 -2.951 22.363 1.00 1.54 O ATOM 3462 CB VAL B 101 2.620 -0.339 22.170 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.578 -0.249 23.696 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.382 0.843 21.571 1.00 51.31 C ATOM 0 H VAL B 101 2.214 -1.684 19.886 1.00 41.00 H new ATOM 0 HA VAL B 101 4.304 -1.682 21.971 1.00 50.20 H new ATOM 0 HB VAL B 101 1.592 -0.301 21.809 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.133 0.701 23.992 1.00 22.35 H new ATOM 0 HG12 VAL B 101 1.980 -1.069 24.093 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.591 -0.314 24.092 1.00 22.35 H new ATOM 0 HG21 VAL B 101 2.928 1.776 21.906 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.422 0.808 21.896 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.340 0.789 20.483 1.00 51.31 H new ATOM 3474 N ALA B 102 3.335 -3.684 23.071 1.00 24.03 N ATOM 3475 CA ALA B 102 2.791 -4.800 23.832 1.00 53.32 C ATOM 3476 C ALA B 102 3.009 -4.581 25.327 1.00 44.40 C ATOM 3477 O ALA B 102 4.113 -4.778 25.841 1.00 4.42 O ATOM 3478 CB ALA B 102 3.431 -6.110 23.381 1.00 42.24 C ATOM 0 H ALA B 102 4.353 -3.620 23.089 1.00 24.03 H new ATOM 0 HA ALA B 102 1.718 -4.859 23.647 1.00 53.32 H new ATOM 0 HB1 ALA B 102 3.015 -6.936 23.958 1.00 42.24 H new ATOM 0 HB2 ALA B 102 3.227 -6.269 22.322 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.508 -6.062 23.540 1.00 42.24 H new ATOM 3484 N LEU B 103 1.956 -4.158 26.016 1.00 61.44 N ATOM 3485 CA LEU B 103 2.004 -3.960 27.461 1.00 72.24 C ATOM 3486 C LEU B 103 1.067 -4.964 28.133 1.00 41.41 C ATOM 3487 O LEU B 103 -0.135 -4.973 27.858 1.00 40.11 O ATOM 3488 CB LEU B 103 1.609 -2.518 27.827 1.00 55.34 C ATOM 3489 CG LEU B 103 1.800 -2.127 29.308 1.00 34.43 C ATOM 3490 CD1 LEU B 103 3.275 -2.159 29.698 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.211 -0.747 29.589 1.00 1.40 C ATOM 0 H LEU B 103 1.052 -3.944 25.594 1.00 61.44 H new ATOM 0 HA LEU B 103 3.022 -4.123 27.814 1.00 72.24 H new ATOM 0 HB2 LEU B 103 2.193 -1.834 27.211 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.562 -2.370 27.563 1.00 55.34 H new ATOM 0 HG LEU B 103 1.268 -2.861 29.913 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.380 -1.879 30.746 1.00 40.33 H new ATOM 0 HD12 LEU B 103 3.669 -3.164 29.549 1.00 40.33 H new ATOM 0 HD13 LEU B 103 3.831 -1.456 29.077 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.359 -0.495 30.639 1.00 1.40 H new ATOM 0 HD22 LEU B 103 1.709 -0.005 28.965 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.144 -0.754 29.364 1.00 1.40 H new ATOM 3503 N PRO B 104 1.608 -5.843 28.996 1.00 3.11 N ATOM 3504 CA PRO B 104 0.820 -6.886 29.656 1.00 24.44 C ATOM 3505 C PRO B 104 -0.129 -6.319 30.705 1.00 5.10 C ATOM 3506 O PRO B 104 0.170 -5.313 31.352 1.00 15.44 O ATOM 3507 CB PRO B 104 1.882 -7.781 30.304 1.00 10.11 C ATOM 3508 CG PRO B 104 3.063 -6.898 30.502 1.00 31.23 C ATOM 3509 CD PRO B 104 3.024 -5.880 29.397 1.00 74.24 C ATOM 0 HA PRO B 104 0.175 -7.417 28.956 1.00 24.44 H new ATOM 0 HB2 PRO B 104 1.530 -8.187 31.252 1.00 10.11 H new ATOM 0 HB3 PRO B 104 2.126 -8.629 29.665 1.00 10.11 H new ATOM 0 HG2 PRO B 104 3.026 -6.413 31.478 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.988 -7.473 30.467 1.00 31.23 H new ATOM 0 HD2 PRO B 104 3.367 -4.904 29.741 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.667 -6.169 28.565 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.268 -6.981 30.865 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.277 -6.527 31.811 1.00 21.00 C ATOM 3519 C GLY B 105 -2.992 -5.271 31.338 1.00 53.31 C ATOM 3520 O GLY B 105 -3.653 -4.590 32.126 1.00 21.33 O ATOM 0 H GLY B 105 -1.515 -7.829 30.355 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.008 -7.321 31.967 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -1.806 -6.333 32.775 1.00 21.00 H new ATOM 3524 N LEU B 106 -2.846 -4.962 30.052 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.418 -3.755 29.458 1.00 45.21 C ATOM 3526 C LEU B 106 -4.369 -4.104 28.307 1.00 60.53 C ATOM 3527 O LEU B 106 -4.178 -5.102 27.607 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.287 -2.835 28.959 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.721 -1.681 28.030 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.610 -0.677 28.761 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.510 -0.979 27.426 1.00 55.01 C ATOM 0 H LEU B 106 -2.328 -5.541 29.391 1.00 45.40 H new ATOM 0 HA LEU B 106 -3.995 -3.234 30.222 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -1.782 -2.408 29.826 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.554 -3.445 28.431 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.305 -2.119 27.220 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.896 0.121 28.076 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.505 -1.181 29.125 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.064 -0.254 29.604 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.845 -0.171 26.776 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -0.891 -0.570 28.224 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.927 -1.694 26.845 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.413 -3.292 28.148 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.339 -3.402 27.019 1.00 50.41 C ATOM 3545 C ASP B 107 -5.887 -2.517 25.861 1.00 24.13 C ATOM 3546 O ASP B 107 -5.306 -1.450 26.076 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.760 -3.004 27.448 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.540 -4.161 28.049 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -8.180 -4.612 29.157 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.510 -4.627 27.411 1.00 14.11 O1- ATOM 0 H ASP B 107 -5.642 -2.539 28.797 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.343 -4.441 26.688 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -7.701 -2.195 28.176 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.300 -2.617 26.584 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.188 -2.950 24.641 1.00 12.24 N ATOM 3556 CA ALA B 108 -5.789 -2.226 23.438 1.00 21.33 C ATOM 3557 C ALA B 108 -6.450 -0.851 23.388 1.00 4.44 C ATOM 3558 O ALA B 108 -5.817 0.136 23.015 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.138 -3.039 22.193 1.00 34.32 C ATOM 0 H ALA B 108 -6.711 -3.806 24.458 1.00 12.24 H new ATOM 0 HA ALA B 108 -4.709 -2.079 23.465 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -5.835 -2.488 21.302 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -5.615 -3.995 22.224 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.213 -3.215 22.163 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.717 -0.794 23.792 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.484 0.452 23.784 1.00 64.51 C ATOM 3567 C ALA B 109 -7.771 1.544 24.588 1.00 34.40 C ATOM 3568 O ALA B 109 -7.661 2.690 24.141 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.887 0.212 24.326 1.00 34.53 C ATOM 0 H ALA B 109 -8.238 -1.602 24.132 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.564 0.797 22.753 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.446 1.147 24.314 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.397 -0.523 23.704 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.823 -0.160 25.349 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.281 1.178 25.771 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.525 2.105 26.612 1.00 72.03 C ATOM 3577 C ALA B 110 -5.128 2.322 26.035 1.00 4.25 C ATOM 3578 O ALA B 110 -4.602 3.444 26.026 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.442 1.578 28.041 1.00 4.12 C ATOM 0 H ALA B 110 -7.394 0.246 26.169 1.00 13.42 H new ATOM 0 HA ALA B 110 -7.043 3.064 26.631 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.876 2.279 28.655 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.447 1.469 28.448 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -5.943 0.609 28.043 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.542 1.242 25.529 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.216 1.293 24.926 1.00 51.51 C ATOM 3587 C ALA B 111 -3.166 2.345 23.824 1.00 2.23 C ATOM 3588 O ALA B 111 -2.163 3.034 23.656 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.833 -0.076 24.381 1.00 4.22 C ATOM 0 H ALA B 111 -4.968 0.315 25.525 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.496 1.574 25.694 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.841 -0.025 23.933 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -2.827 -0.803 25.194 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.557 -0.382 23.625 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.271 2.472 23.091 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.385 3.453 22.018 1.00 34.20 C ATOM 3597 C LYS B 112 -4.107 4.869 22.528 1.00 24.41 C ATOM 3598 O LYS B 112 -3.368 5.625 21.896 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.772 3.361 21.370 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.982 2.045 20.628 1.00 74.45 C ATOM 3601 CD LYS B 112 -7.414 1.861 20.148 1.00 63.04 C ATOM 3602 CE LYS B 112 -7.799 2.864 19.069 1.00 72.33 C ATOM 3603 NZ LYS B 112 -9.185 2.642 18.577 1.00 62.21 N1+ ATOM 0 H LYS B 112 -5.106 1.901 23.224 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.632 3.228 21.263 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.537 3.467 22.139 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.901 4.191 20.675 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -5.309 2.004 19.772 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.714 1.217 21.284 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.537 0.850 19.760 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -8.094 1.963 20.994 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -7.712 3.876 19.465 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -7.101 2.787 18.236 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -9.410 3.344 17.844 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -9.262 1.686 18.176 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -9.854 2.741 19.367 1.00 62.21 H new ATOM 3617 N THR B 113 -4.671 5.218 23.689 1.00 71.03 N ATOM 3618 CA THR B 113 -4.464 6.549 24.258 1.00 12.30 C ATOM 3619 C THR B 113 -3.068 6.653 24.861 1.00 72.03 C ATOM 3620 O THR B 113 -2.433 7.706 24.795 1.00 34.03 O ATOM 3621 CB THR B 113 -5.526 6.922 25.329 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.636 8.351 25.430 1.00 15.33 O ATOM 3623 CG2 THR B 113 -5.176 6.363 26.705 1.00 55.23 C ATOM 0 H THR B 113 -5.267 4.605 24.245 1.00 71.03 H new ATOM 0 HA THR B 113 -4.571 7.259 23.438 1.00 12.30 H new ATOM 0 HB THR B 113 -6.471 6.483 25.009 1.00 51.23 H new ATOM 0 HG1 THR B 113 -6.308 8.580 26.105 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.947 6.649 27.421 1.00 55.23 H new ATOM 0 HG22 THR B 113 -5.116 5.276 26.652 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.215 6.764 27.027 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.595 5.552 25.446 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.269 5.527 26.065 1.00 34.43 C ATOM 3633 C LEU B 114 -0.181 5.816 25.029 1.00 70.23 C ATOM 3634 O LEU B 114 0.687 6.667 25.241 1.00 14.10 O ATOM 3635 CB LEU B 114 -1.011 4.177 26.752 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.024 3.790 27.846 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.573 2.531 28.585 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.243 4.947 28.820 1.00 20.12 C ATOM 0 H LEU B 114 -3.106 4.671 25.504 1.00 42.02 H new ATOM 0 HA LEU B 114 -1.238 6.309 26.824 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -1.007 3.396 25.992 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.015 4.197 27.194 1.00 61.41 H new ATOM 0 HG LEU B 114 -2.977 3.573 27.363 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.304 2.278 29.352 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.488 1.705 27.879 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.605 2.710 29.052 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -2.962 4.649 29.583 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.297 5.207 29.295 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.626 5.811 28.278 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.247 5.120 23.900 1.00 61.11 N ATOM 3651 CA VAL B 115 0.723 5.303 22.823 1.00 23.35 C ATOM 3652 C VAL B 115 0.558 6.681 22.186 1.00 63.55 C ATOM 3653 O VAL B 115 1.538 7.324 21.797 1.00 10.54 O ATOM 3654 CB VAL B 115 0.568 4.208 21.740 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.615 4.367 20.638 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.652 2.823 22.376 1.00 32.34 C ATOM 0 H VAL B 115 -0.964 4.421 23.705 1.00 61.11 H new ATOM 0 HA VAL B 115 1.720 5.223 23.257 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.413 4.320 21.278 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.480 3.583 19.892 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.500 5.342 20.165 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.613 4.289 21.070 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.542 2.061 21.604 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.618 2.706 22.866 1.00 32.34 H new ATOM 0 HG23 VAL B 115 -0.144 2.712 23.112 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.691 7.127 22.095 1.00 33.05 N ATOM 3667 CA ASP B 116 -1.020 8.440 21.539 1.00 4.03 C ATOM 3668 C ASP B 116 -0.268 9.540 22.282 1.00 43.14 C ATOM 3669 O ASP B 116 0.471 10.329 21.680 1.00 21.31 O ATOM 3670 CB ASP B 116 -2.532 8.683 21.647 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.981 9.995 21.023 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -3.263 10.956 21.770 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -3.081 10.065 19.779 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.503 6.592 22.403 1.00 33.05 H new ATOM 0 HA ASP B 116 -0.721 8.460 20.491 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -3.060 7.861 21.164 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.820 8.672 22.698 1.00 75.43 H new ATOM 3678 N ARG B 117 -0.445 9.556 23.600 1.00 65.05 N ATOM 3679 CA ARG B 117 0.139 10.583 24.457 1.00 30.34 C ATOM 3680 C ARG B 117 1.659 10.424 24.566 1.00 41.22 C ATOM 3681 O ARG B 117 2.401 11.407 24.495 1.00 22.44 O ATOM 3682 CB ARG B 117 -0.504 10.535 25.854 1.00 5.33 C ATOM 3683 CG ARG B 117 -0.405 9.167 26.528 1.00 52.02 C ATOM 3684 CD ARG B 117 -1.192 9.095 27.834 1.00 70.20 C ATOM 3685 NE ARG B 117 -0.505 9.773 28.938 1.00 35.41 N ATOM 3686 CZ ARG B 117 -1.059 10.022 30.128 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -2.348 9.768 30.333 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -0.327 10.552 31.097 1.00 12.43 N ATOM 0 H ARG B 117 -0.995 8.860 24.103 1.00 65.05 H new ATOM 0 HA ARG B 117 -0.062 11.553 24.003 1.00 30.34 H new ATOM 0 HB2 ARG B 117 -0.026 11.279 26.490 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.554 10.814 25.771 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.773 8.402 25.844 1.00 52.02 H new ATOM 0 HG3 ARG B 117 0.642 8.939 26.727 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -2.174 9.546 27.689 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -1.357 8.051 28.099 1.00 70.20 H new ATOM 0 HE ARG B 117 0.458 10.074 28.788 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -2.918 9.382 29.580 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -2.767 9.960 31.243 1.00 12.31 H new ATOM 0 HH21 ARG B 117 0.656 10.769 30.933 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -0.747 10.743 32.007 1.00 12.43 H new ATOM 3702 N ALA B 118 2.114 9.183 24.733 1.00 61.11 N ATOM 3703 CA ALA B 118 3.540 8.899 24.920 1.00 4.01 C ATOM 3704 C ALA B 118 4.347 9.268 23.675 1.00 4.12 C ATOM 3705 O ALA B 118 5.363 9.960 23.758 1.00 22.32 O ATOM 3706 CB ALA B 118 3.749 7.429 25.274 1.00 4.44 C ATOM 0 H ALA B 118 1.517 8.356 24.743 1.00 61.11 H new ATOM 0 HA ALA B 118 3.898 9.513 25.746 1.00 4.01 H new ATOM 0 HB1 ALA B 118 4.813 7.235 25.409 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.218 7.198 26.197 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.366 6.803 24.468 1.00 4.44 H new ATOM 3712 N HIS B 119 3.865 8.838 22.512 1.00 53.54 N ATOM 3713 CA HIS B 119 4.577 9.055 21.250 1.00 31.05 C ATOM 3714 C HIS B 119 4.370 10.488 20.745 1.00 22.51 C ATOM 3715 O HIS B 119 4.654 10.800 19.588 1.00 73.21 O ATOM 3716 CB HIS B 119 4.111 8.030 20.200 1.00 24.30 C ATOM 3717 CG HIS B 119 4.982 7.962 18.974 1.00 50.32 C ATOM 3718 ND1 HIS B 119 4.855 8.541 17.755 1.00 33.22 N flip ATOM 3719 CD2 HIS B 119 6.134 7.203 18.913 1.00 55.12 C flip ATOM 3720 CE1 HIS B 119 5.919 8.125 16.992 1.00 74.31 C flip ATOM 3721 NE2 HIS B 119 6.674 7.322 17.712 1.00 22.51 N flip ATOM 0 H HIS B 119 2.983 8.336 22.414 1.00 53.54 H new ATOM 0 HA HIS B 119 5.644 8.916 21.423 1.00 31.05 H new ATOM 0 HB2 HIS B 119 4.076 7.043 20.662 1.00 24.30 H new ATOM 0 HB3 HIS B 119 3.094 8.275 19.896 1.00 24.30 H new ATOM 0 HD1 HIS B 119 4.108 9.169 17.459 1.00 33.22 H new ATOM 0 HD2 HIS B 119 6.532 6.606 19.720 1.00 55.12 H new ATOM 0 HE1 HIS B 119 6.106 8.411 15.967 1.00 74.31 H new ATOM 3730 N HIS B 120 3.857 11.355 21.611 1.00 35.12 N ATOM 3731 CA HIS B 120 3.665 12.766 21.277 1.00 61.52 C ATOM 3732 C HIS B 120 4.827 13.607 21.810 1.00 22.12 C ATOM 3733 O HIS B 120 5.095 14.698 21.303 1.00 21.30 O ATOM 3734 CB HIS B 120 2.336 13.268 21.858 1.00 61.10 C ATOM 3735 CG HIS B 120 2.066 14.722 21.597 1.00 45.20 C ATOM 3736 ND1 HIS B 120 2.220 15.703 22.555 1.00 23.40 N ATOM 3737 CD2 HIS B 120 1.657 15.357 20.475 1.00 61.34 C ATOM 3738 CE1 HIS B 120 1.919 16.877 22.030 1.00 14.23 C ATOM 3739 NE2 HIS B 120 1.576 16.694 20.771 1.00 33.30 N ATOM 0 H HIS B 120 3.564 11.106 22.556 1.00 35.12 H new ATOM 0 HA HIS B 120 3.637 12.866 20.192 1.00 61.52 H new ATOM 0 HB2 HIS B 120 1.522 12.677 21.439 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.334 13.096 22.934 1.00 61.10 H new ATOM 0 HD2 HIS B 120 1.435 14.897 19.523 1.00 61.34 H new ATOM 0 HE1 HIS B 120 1.949 17.826 22.545 1.00 14.23 H new ATOM 0 HE2 HIS B 120 1.295 17.428 20.121 1.00 33.30 H new ATOM 3748 N VAL B 121 5.520 13.081 22.821 1.00 53.34 N ATOM 3749 CA VAL B 121 6.600 13.806 23.499 1.00 2.11 C ATOM 3750 C VAL B 121 7.873 12.954 23.570 1.00 31.12 C ATOM 3751 O VAL B 121 8.598 12.975 24.572 1.00 43.14 O ATOM 3752 CB VAL B 121 6.173 14.225 24.932 1.00 52.03 C ATOM 3753 CG1 VAL B 121 5.094 15.305 24.884 1.00 41.33 C ATOM 3754 CG2 VAL B 121 5.686 13.015 25.734 1.00 63.42 C ATOM 0 H VAL B 121 5.351 12.146 23.193 1.00 53.34 H new ATOM 0 HA VAL B 121 6.808 14.703 22.916 1.00 2.11 H new ATOM 0 HB VAL B 121 7.048 14.637 25.435 1.00 52.03 H new ATOM 0 HG11 VAL B 121 4.811 15.582 25.900 1.00 41.33 H new ATOM 0 HG12 VAL B 121 5.479 16.181 24.363 1.00 41.33 H new ATOM 0 HG13 VAL B 121 4.220 14.923 24.355 1.00 41.33 H new ATOM 0 HG21 VAL B 121 5.393 13.335 26.734 1.00 63.42 H new ATOM 0 HG22 VAL B 121 4.829 12.566 25.231 1.00 63.42 H new ATOM 0 HG23 VAL B 121 6.488 12.281 25.809 1.00 63.42 H new ATOM 3764 N CYS B 122 8.150 12.243 22.481 1.00 64.23 N ATOM 3765 CA CYS B 122 9.295 11.336 22.403 1.00 24.42 C ATOM 3766 C CYS B 122 10.622 12.102 22.489 1.00 23.34 C ATOM 3767 O CYS B 122 10.686 13.277 22.123 1.00 74.53 O ATOM 3768 CB CYS B 122 9.248 10.565 21.076 1.00 15.34 C ATOM 3769 SG CYS B 122 7.670 9.752 20.731 1.00 14.44 S ATOM 0 H CYS B 122 7.590 12.278 21.629 1.00 64.23 H new ATOM 0 HA CYS B 122 9.238 10.647 23.246 1.00 24.42 H new ATOM 0 HB2 CYS B 122 9.471 11.255 20.262 1.00 15.34 H new ATOM 0 HB3 CYS B 122 10.036 9.812 21.081 1.00 15.34 H new ATOM 0 HG CYS B 122 7.565 8.681 21.460 1.00 14.44 H new ATOM 3775 N PRO B 123 11.699 11.446 22.984 1.00 45.45 N ATOM 3776 CA PRO B 123 13.055 12.017 22.944 1.00 1.30 C ATOM 3777 C PRO B 123 13.467 12.310 21.501 1.00 21.43 C ATOM 3778 O PRO B 123 14.045 13.357 21.202 1.00 1.12 O ATOM 3779 CB PRO B 123 13.942 10.921 23.572 1.00 65.25 C ATOM 3780 CG PRO B 123 13.116 9.675 23.531 1.00 12.41 C ATOM 3781 CD PRO B 123 11.682 10.120 23.630 1.00 30.51 C ATOM 0 HA PRO B 123 13.136 12.964 23.477 1.00 1.30 H new ATOM 0 HB2 PRO B 123 14.869 10.797 23.013 1.00 65.25 H new ATOM 0 HB3 PRO B 123 14.218 11.177 24.595 1.00 65.25 H new ATOM 0 HG2 PRO B 123 13.290 9.123 22.607 1.00 12.41 H new ATOM 0 HG3 PRO B 123 13.375 9.009 24.354 1.00 12.41 H new ATOM 0 HD2 PRO B 123 11.010 9.431 23.119 1.00 30.51 H new ATOM 0 HD3 PRO B 123 11.349 10.180 24.666 1.00 30.51 H new ATOM 3789 N TYR B 124 13.156 11.368 20.614 1.00 44.15 N ATOM 3790 CA TYR B 124 13.275 11.585 19.180 1.00 41.53 C ATOM 3791 C TYR B 124 12.094 12.459 18.769 1.00 41.03 C ATOM 3792 O TYR B 124 10.942 12.024 18.832 1.00 24.42 O ATOM 3793 CB TYR B 124 13.307 10.234 18.424 1.00 11.44 C ATOM 3794 CG TYR B 124 14.421 9.307 18.911 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.498 8.931 18.097 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.414 8.845 20.225 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.514 8.134 18.590 1.00 22.14 C ATOM 3798 CE2 TYR B 124 15.421 8.045 20.710 1.00 2.53 C ATOM 3799 CZ TYR B 124 16.468 7.693 19.895 1.00 65.35 C ATOM 3800 OH TYR B 124 17.481 6.908 20.392 1.00 21.31 O ATOM 0 H TYR B 124 12.817 10.440 20.869 1.00 44.15 H new ATOM 0 HA TYR B 124 14.209 12.087 18.925 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.346 9.733 18.544 1.00 11.44 H new ATOM 0 HB3 TYR B 124 13.438 10.422 17.358 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.535 9.268 17.072 1.00 62.34 H new ATOM 0 HD2 TYR B 124 13.599 9.122 20.877 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.342 7.857 17.954 1.00 22.14 H new ATOM 0 HE2 TYR B 124 15.389 7.694 21.731 1.00 2.53 H new ATOM 0 HH TYR B 124 17.286 6.672 21.323 1.00 21.31 H new ATOM 3810 N SER B 125 12.402 13.697 18.390 1.00 44.35 N ATOM 3811 CA SER B 125 11.437 14.799 18.349 1.00 1.10 C ATOM 3812 C SER B 125 10.120 14.477 17.619 1.00 64.23 C ATOM 3813 O SER B 125 10.003 13.501 16.881 1.00 63.41 O ATOM 3814 CB SER B 125 12.096 16.038 17.730 1.00 3.32 C ATOM 3815 OG SER B 125 11.236 17.168 17.791 1.00 24.10 O ATOM 0 H SER B 125 13.341 13.969 18.098 1.00 44.35 H new ATOM 0 HA SER B 125 11.153 14.986 19.385 1.00 1.10 H new ATOM 0 HB2 SER B 125 13.026 16.258 18.255 1.00 3.32 H new ATOM 0 HB3 SER B 125 12.357 15.833 16.692 1.00 3.32 H new ATOM 0 HG SER B 125 11.666 17.878 18.312 1.00 24.10 H new ATOM 3821 N ASN B 126 9.154 15.372 17.821 1.00 74.24 N ATOM 3822 CA ASN B 126 7.763 15.218 17.378 1.00 34.45 C ATOM 3823 C ASN B 126 7.661 14.851 15.894 1.00 33.32 C ATOM 3824 O ASN B 126 6.741 14.145 15.476 1.00 24.11 O ATOM 3825 CB ASN B 126 6.980 16.504 17.671 1.00 64.21 C ATOM 3826 CG ASN B 126 5.501 16.378 17.353 1.00 24.21 C ATOM 3827 OD1 ASN B 126 5.067 16.670 16.241 1.00 13.11 O ATOM 3828 ND2 ASN B 126 4.715 15.948 18.331 1.00 21.23 N ATOM 0 H ASN B 126 9.319 16.251 18.311 1.00 74.24 H new ATOM 0 HA ASN B 126 7.327 14.390 17.938 1.00 34.45 H new ATOM 0 HB2 ASN B 126 7.100 16.765 18.722 1.00 64.21 H new ATOM 0 HB3 ASN B 126 7.404 17.322 17.089 1.00 64.21 H new ATOM 0 HD21 ASN B 126 3.712 15.850 18.173 1.00 21.23 H new ATOM 0 HD22 ASN B 126 5.114 15.716 19.241 1.00 21.23 H new ATOM 3835 N ALA B 127 8.611 15.332 15.102 1.00 42.24 N ATOM 3836 CA ALA B 127 8.661 15.060 13.662 1.00 65.30 C ATOM 3837 C ALA B 127 8.888 13.568 13.365 1.00 53.42 C ATOM 3838 O ALA B 127 9.046 13.170 12.215 1.00 63.33 O ATOM 3839 CB ALA B 127 9.749 15.907 13.010 1.00 44.52 C ATOM 0 H ALA B 127 9.372 15.923 15.436 1.00 42.24 H new ATOM 0 HA ALA B 127 7.693 15.328 13.239 1.00 65.30 H new ATOM 0 HB1 ALA B 127 9.780 15.699 11.940 1.00 44.52 H new ATOM 0 HB2 ALA B 127 9.532 16.963 13.168 1.00 44.52 H new ATOM 0 HB3 ALA B 127 10.714 15.665 13.455 1.00 44.52 H new ATOM 3845 N THR B 128 8.863 12.744 14.403 1.00 13.32 N ATOM 3846 CA THR B 128 9.187 11.336 14.288 1.00 55.14 C ATOM 3847 C THR B 128 7.906 10.565 14.041 1.00 13.14 C ATOM 3848 O THR B 128 7.903 9.339 13.955 1.00 21.45 O ATOM 3849 CB THR B 128 9.872 10.812 15.580 1.00 41.45 C ATOM 3850 OG1 THR B 128 10.470 9.526 15.348 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.870 10.698 16.728 1.00 11.25 C ATOM 0 H THR B 128 8.617 13.037 15.348 1.00 13.32 H new ATOM 0 HA THR B 128 9.882 11.197 13.460 1.00 55.14 H new ATOM 0 HB THR B 128 10.645 11.530 15.855 1.00 41.45 H new ATOM 0 HG1 THR B 128 9.871 8.982 14.796 1.00 41.22 H new ATOM 0 HG21 THR B 128 9.378 10.329 17.619 1.00 11.25 H new ATOM 0 HG22 THR B 128 8.441 11.678 16.935 1.00 11.25 H new ATOM 0 HG23 THR B 128 8.076 10.005 16.450 1.00 11.25 H new ATOM 3859 N ARG B 129 6.804 11.306 13.953 1.00 41.51 N ATOM 3860 CA ARG B 129 5.495 10.700 13.774 1.00 75.21 C ATOM 3861 C ARG B 129 4.709 11.355 12.634 1.00 73.32 C ATOM 3862 O ARG B 129 4.123 10.662 11.804 1.00 44.41 O ATOM 3863 CB ARG B 129 4.718 10.764 15.092 1.00 21.01 C ATOM 3864 CG ARG B 129 4.477 12.169 15.628 1.00 45.10 C ATOM 3865 CD ARG B 129 3.618 12.148 16.885 1.00 21.21 C ATOM 3866 NE ARG B 129 2.280 11.600 16.630 1.00 2.44 N ATOM 3867 CZ ARG B 129 1.468 11.108 17.571 1.00 0.21 C ATOM 3868 NH1 ARG B 129 1.863 11.058 18.843 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 0.264 10.664 17.235 1.00 44.44 N ATOM 0 H ARG B 129 6.795 12.325 14.003 1.00 41.51 H new ATOM 0 HA ARG B 129 5.636 9.657 13.492 1.00 75.21 H new ATOM 0 HB2 ARG B 129 3.754 10.274 14.953 1.00 21.01 H new ATOM 0 HB3 ARG B 129 5.261 10.192 15.845 1.00 21.01 H new ATOM 0 HG2 ARG B 129 5.433 12.645 15.847 1.00 45.10 H new ATOM 0 HG3 ARG B 129 3.989 12.773 14.863 1.00 45.10 H new ATOM 0 HD2 ARG B 129 4.113 11.553 17.652 1.00 21.21 H new ATOM 0 HD3 ARG B 129 3.526 13.161 17.278 1.00 21.21 H new ATOM 0 HE ARG B 129 1.946 11.594 15.666 1.00 2.44 H new ATOM 0 HH11 ARG B 129 2.789 11.396 19.103 1.00 5.12 H new ATOM 0 HH12 ARG B 129 1.239 10.681 19.556 1.00 5.12 H new ATOM 0 HH21 ARG B 129 -0.039 10.699 16.262 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -0.359 10.288 17.950 1.00 44.44 H new ATOM 3883 N ASN B 130 4.666 12.684 12.609 1.00 21.53 N ATOM 3884 CA ASN B 130 3.987 13.407 11.525 1.00 53.34 C ATOM 3885 C ASN B 130 4.852 13.451 10.273 1.00 22.35 C ATOM 3886 O ASN B 130 4.397 13.132 9.173 1.00 70.41 O ATOM 3887 CB ASN B 130 3.596 14.826 11.940 1.00 70.21 C ATOM 3888 CG ASN B 130 4.540 15.374 12.960 1.00 33.52 C ATOM 3889 OD1 ASN B 130 5.536 16.026 12.641 1.00 60.32 O ATOM 3890 ND2 ASN B 130 4.241 15.073 14.199 1.00 74.14 N ATOM 0 H ASN B 130 5.088 13.283 13.318 1.00 21.53 H new ATOM 0 HA ASN B 130 3.072 12.858 11.304 1.00 53.34 H new ATOM 0 HB2 ASN B 130 3.588 15.474 11.064 1.00 70.21 H new ATOM 0 HB3 ASN B 130 2.583 14.823 12.343 1.00 70.21 H new ATOM 0 HD21 ASN B 130 4.847 15.382 14.959 1.00 74.14 H new ATOM 0 HD22 ASN B 130 3.402 14.530 14.404 1.00 74.14 H new ATOM 3897 N ASN B 131 6.104 13.860 10.459 1.00 34.23 N ATOM 3898 CA ASN B 131 7.041 14.031 9.346 1.00 31.43 C ATOM 3899 C ASN B 131 7.421 12.672 8.755 1.00 54.44 C ATOM 3900 O ASN B 131 7.449 12.495 7.533 1.00 13.44 O ATOM 3901 CB ASN B 131 8.296 14.764 9.845 1.00 3.33 C ATOM 3902 CG ASN B 131 9.229 15.220 8.731 1.00 61.21 C ATOM 3903 OD1 ASN B 131 9.320 14.601 7.673 1.00 75.43 O ATOM 3904 ND2 ASN B 131 9.941 16.310 8.972 1.00 34.33 N ATOM 0 H ASN B 131 6.497 14.081 11.374 1.00 34.23 H new ATOM 0 HA ASN B 131 6.565 14.622 8.564 1.00 31.43 H new ATOM 0 HB2 ASN B 131 7.990 15.633 10.427 1.00 3.33 H new ATOM 0 HB3 ASN B 131 8.845 14.106 10.519 1.00 3.33 H new ATOM 0 HD21 ASN B 131 10.590 16.661 8.268 1.00 34.33 H new ATOM 0 HD22 ASN B 131 9.840 16.799 9.862 1.00 34.33 H new ATOM 3911 N VAL B 132 7.691 11.715 9.635 1.00 52.13 N ATOM 3912 CA VAL B 132 8.057 10.363 9.229 1.00 11.30 C ATOM 3913 C VAL B 132 6.844 9.445 9.317 1.00 11.32 C ATOM 3914 O VAL B 132 6.136 9.441 10.325 1.00 35.23 O ATOM 3915 CB VAL B 132 9.198 9.796 10.116 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.652 8.422 9.617 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.372 10.774 10.177 1.00 3.12 C ATOM 0 H VAL B 132 7.663 11.853 10.645 1.00 52.13 H new ATOM 0 HA VAL B 132 8.411 10.409 8.199 1.00 11.30 H new ATOM 0 HB VAL B 132 8.810 9.670 11.127 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.452 8.049 10.257 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.811 7.729 9.645 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.017 8.509 8.593 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.161 10.357 10.804 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.758 10.942 9.172 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.035 11.721 10.599 1.00 3.12 H new ATOM 3927 N ALA B 133 6.609 8.685 8.253 1.00 53.04 N ATOM 3928 CA ALA B 133 5.483 7.763 8.194 1.00 53.01 C ATOM 3929 C ALA B 133 5.647 6.651 9.218 1.00 72.23 C ATOM 3930 O ALA B 133 6.372 5.677 8.996 1.00 0.23 O ATOM 3931 CB ALA B 133 5.341 7.200 6.786 1.00 11.23 C ATOM 0 H ALA B 133 7.189 8.691 7.414 1.00 53.04 H new ATOM 0 HA ALA B 133 4.570 8.306 8.438 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.496 6.512 6.753 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.172 8.016 6.083 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.253 6.669 6.513 1.00 11.23 H new ATOM 3937 N VAL B 134 4.994 6.826 10.357 1.00 34.41 N ATOM 3938 CA VAL B 134 5.061 5.868 11.444 1.00 31.34 C ATOM 3939 C VAL B 134 3.663 5.388 11.830 1.00 33.12 C ATOM 3940 O VAL B 134 2.808 6.179 12.236 1.00 12.15 O ATOM 3941 CB VAL B 134 5.769 6.474 12.684 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.765 5.487 13.847 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.197 6.892 12.336 1.00 5.41 C ATOM 0 H VAL B 134 4.404 7.635 10.551 1.00 34.41 H new ATOM 0 HA VAL B 134 5.644 5.016 11.094 1.00 31.34 H new ATOM 0 HB VAL B 134 5.217 7.362 12.992 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.267 5.934 14.705 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.737 5.244 14.114 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.289 4.577 13.554 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.678 7.315 13.218 1.00 5.41 H new ATOM 0 HG22 VAL B 134 7.759 6.021 11.999 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.174 7.639 11.542 1.00 5.41 H new ATOM 3953 N ARG B 135 3.437 4.088 11.680 1.00 11.21 N ATOM 3954 CA ARG B 135 2.180 3.464 12.063 1.00 24.23 C ATOM 3955 C ARG B 135 2.228 3.088 13.541 1.00 24.22 C ATOM 3956 O ARG B 135 3.090 2.314 13.960 1.00 54.44 O ATOM 3957 CB ARG B 135 1.936 2.201 11.226 1.00 74.32 C ATOM 3958 CG ARG B 135 0.557 1.575 11.434 1.00 34.13 C ATOM 3959 CD ARG B 135 -0.502 2.219 10.545 1.00 2.43 C ATOM 3960 NE ARG B 135 -0.322 1.841 9.140 1.00 1.50 N ATOM 3961 CZ ARG B 135 -0.870 2.479 8.101 1.00 23.13 C ATOM 3962 NH1 ARG B 135 -1.586 3.585 8.283 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -0.680 2.010 6.873 1.00 14.33 N ATOM 0 H ARG B 135 4.120 3.439 11.290 1.00 11.21 H new ATOM 0 HA ARG B 135 1.368 4.170 11.887 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.057 2.448 10.171 1.00 74.32 H new ATOM 0 HB3 ARG B 135 2.700 1.462 11.470 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.608 0.507 11.222 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.265 1.679 12.479 1.00 34.13 H new ATOM 0 HD2 ARG B 135 -1.494 1.917 10.881 1.00 2.43 H new ATOM 0 HD3 ARG B 135 -0.450 3.303 10.641 1.00 2.43 H new ATOM 0 HE ARG B 135 0.265 1.031 8.940 1.00 1.50 H new ATOM 0 HH11 ARG B 135 -1.722 3.955 9.224 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -1.999 4.063 7.482 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -0.120 1.170 6.729 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -1.094 2.490 6.074 1.00 14.33 H new ATOM 3977 N LEU B 136 1.326 3.653 14.333 1.00 62.51 N ATOM 3978 CA LEU B 136 1.223 3.306 15.737 1.00 72.41 C ATOM 3979 C LEU B 136 0.236 2.164 15.923 1.00 41.21 C ATOM 3980 O LEU B 136 -0.974 2.333 15.764 1.00 33.52 O ATOM 3981 CB LEU B 136 0.818 4.531 16.554 1.00 60.04 C ATOM 3982 CG LEU B 136 1.905 5.610 16.653 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.422 6.801 17.480 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.190 5.021 17.238 1.00 0.00 C ATOM 0 H LEU B 136 0.655 4.355 14.022 1.00 62.51 H new ATOM 0 HA LEU B 136 2.196 2.971 16.096 1.00 72.41 H new ATOM 0 HB2 LEU B 136 -0.075 4.971 16.110 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.548 4.210 17.560 1.00 60.04 H new ATOM 0 HG LEU B 136 2.121 5.971 15.648 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.212 7.551 17.534 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.540 7.236 17.010 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.170 6.467 18.486 1.00 41.31 H new ATOM 0 HD21 LEU B 136 3.951 5.799 17.302 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.989 4.628 18.234 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.547 4.216 16.595 1.00 0.00 H new ATOM 3996 N VAL B 137 0.777 1.001 16.237 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.009 -0.220 16.383 1.00 61.13 C ATOM 3998 C VAL B 137 0.096 -0.761 17.810 1.00 31.22 C ATOM 3999 O VAL B 137 1.173 -1.119 18.285 1.00 63.04 O ATOM 4000 CB VAL B 137 0.425 -1.294 15.335 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.908 -1.163 15.002 1.00 20.11 C ATOM 4002 CG2 VAL B 137 0.107 -2.716 15.812 1.00 5.14 C ATOM 0 H VAL B 137 1.776 0.872 16.399 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.055 0.022 16.192 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.153 -1.111 14.429 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.185 -1.922 14.270 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.102 -0.173 14.589 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.498 -1.300 15.908 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.424 -3.433 15.055 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.636 -2.914 16.744 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -0.966 -2.813 15.977 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.039 -0.787 18.493 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.123 -1.272 19.865 1.00 24.22 C ATOM 4014 C VAL B 138 -1.574 -2.724 19.877 1.00 70.52 C ATOM 4015 O VAL B 138 -2.420 -3.131 19.073 1.00 62.24 O ATOM 4016 CB VAL B 138 -2.073 -0.423 20.742 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.837 1.065 20.514 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.527 -0.802 20.497 1.00 0.20 C ATOM 0 H VAL B 138 -1.931 -0.472 18.111 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.125 -1.186 20.294 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.851 -0.636 21.788 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.517 1.642 21.142 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.807 1.314 20.771 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -2.018 1.306 19.466 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.173 -0.190 21.126 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.775 -0.633 19.449 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.675 -1.854 20.740 1.00 0.20 H new ATOM 4028 N ALA B 139 -0.954 -3.506 20.735 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.233 -4.934 20.828 1.00 52.34 C ATOM 4030 C ALA B 139 -2.667 -5.180 21.316 1.00 22.31 C ATOM 4031 O ALA B 139 -3.570 -5.329 20.461 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.213 -5.600 21.746 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.892 -5.209 22.541 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.243 -3.177 21.388 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.147 -5.377 19.836 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.425 -6.667 21.813 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.789 -5.454 21.343 1.00 71.35 H new ATOM 0 HB3 ALA B 139 -0.273 -5.156 22.739 1.00 71.35 H new TER 4039 ALA B 139