USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=63 USER MOD reduce.3.24.130724 removed 2000 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 126 ASN : amide:sc= 1.51 K(o=-1.6,f=-4) USER MOD Set 1.2: A 130 ASN : amide:sc= 0.774 K(o=-1.6,f=-4) USER MOD Set 1.3: B 131 ASN : amide:sc= -3.84! K(o=-1.6!,f=-4) USER MOD Set 2.1: A 11 SER OG : rot -32:sc= 0.806 USER MOD Set 2.2: B 55 SER OG : rot -11:sc= 0.647 USER MOD Set 3.1: A 80 THR OG1 : rot 180:sc= 0.0471 USER MOD Set 3.2: B 10 THR OG1 : rot 75:sc= 0.0451 USER MOD Set 4.1: A 78 THR OG1 : rot 180:sc= -0.185 USER MOD Set 4.2: B 12 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 54 TYR OH : rot 66:sc= 0.0699 USER MOD Set 5.2: A 128 THR OG1 : rot 169:sc= 0.64 USER MOD Set 6.1: A 45 ASN : amide:sc= -0.789 K(o=-0.69,f=-3.9!) USER MOD Set 6.2: B 5 TYR OH : rot 180:sc= 0.0983 USER MOD Set 7.1: A 44 THR OG1 : rot 180:sc= 0.323 USER MOD Set 7.2: A 48 GLN :FLIP amide:sc= 1.43 F(o=-0.84!,f=1.7) USER MOD Set 7.3: B 7 THR OG1 : rot -164:sc= 1.26 USER MOD Set 7.4: B 21 SER OG : rot 70:sc= -1.28 USER MOD Set 8.1: A 21 SER OG : rot 23:sc= 0.231 USER MOD Set 8.2: B 48 GLN : amide:sc= -2.41 X(o=-2.2,f=-2.2) USER MOD Set 9.1: A 10 THR OG1 : rot 87:sc= 0.613 USER MOD Set 9.2: B 80 THR OG1 : rot 180:sc= 0.559 USER MOD Set10.1: A 7 THR OG1 : rot -140:sc= 0.121 USER MOD Set10.2: A 25 LYS NZ :NH3+ 160:sc= -1.04! (180deg=-4.47!) USER MOD Set11.1: A 5 TYR OH : rot 180:sc= 0.493 USER MOD Set11.2: B 45 ASN : amide:sc= -1.3! X(o=-0.81!,f=-1.1) USER MOD Single : A 1 MET CE :methyl 161:sc= -3.09! (180deg=-4.17) USER MOD Single : A 1 MET N :NH3+ -120:sc= 0.116 (180deg=-0.00253) USER MOD Single : A 2 ASN : amide:sc= -0.0132 K(o=-0.013,f=-0.54) USER MOD Single : A 6 LYS NZ :NH3+ 161:sc= 1.22 (180deg=1.14) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 78:sc= -0.72! USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 GLN : amide:sc= 0.0339 X(o=0.034,f=-0.13) USER MOD Single : A 29 LYS NZ :NH3+ -110:sc= -0.315 (180deg=-1.54) USER MOD Single : A 31 SER OG : rot -12:sc= -1.82! USER MOD Single : A 55 SER OG : rot -166:sc= 0.0604 USER MOD Single : A 57 CYS SG : rot -158:sc= 0.016 USER MOD Single : A 60 SER OG : rot 82:sc= 0.33 USER MOD Single : A 62 MET CE :methyl -140:sc= -1.03 (180deg=-3.74!) USER MOD Single : A 63 LYS NZ :NH3+ -159:sc= 0.874 (180deg=0.492) USER MOD Single : A 68 GLN : amide:sc= -0.0189 X(o=-0.019,f=0.35) USER MOD Single : A 69 ASN : amide:sc= -2.65! C(o=-2.6!,f=-8.1!) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 GLN : amide:sc= -0.196 X(o=-0.2,f=0) USER MOD Single : A 72 THR OG1 : rot 45:sc= 0.0295 USER MOD Single : A 77 THR OG1 : rot 44:sc= 0.981 USER MOD Single : A 88 ASN : amide:sc= -0.0657 K(o=-0.066,f=-5.8!) USER MOD Single : A 112 LYS NZ :NH3+ -130:sc= -1.6! (180deg=-4.14!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= -0.707 K(o=-0.71,f=-7.1!) USER MOD Single : A 120 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 122 CYS SG : rot 85:sc= 0.802 USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= -0.203 USER MOD Single : A 131 ASN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : B 1 MET CE :methyl -149:sc= -1.58 (180deg=-4.52!) USER MOD Single : B 1 MET N :NH3+ -114:sc= 0.102 (180deg=-0.154) USER MOD Single : B 2 ASN : amide:sc= 0 X(o=0,f=-0.41) USER MOD Single : B 6 LYS NZ :NH3+ 152:sc= 1.29 (180deg=1) USER MOD Single : B 11 SER OG : rot -170:sc= 0 USER MOD Single : B 20 THR OG1 : rot -110:sc= 0.944 USER MOD Single : B 22 HIS : no HD1:sc= -0.104 X(o=-0.1,f=-0.1) USER MOD Single : B 24 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.18) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -138:sc= -0.442 (180deg=-3.68!) USER MOD Single : B 31 SER OG : rot -168:sc= 0.0107 USER MOD Single : B 44 THR OG1 : rot 180:sc= -1.27 USER MOD Single : B 54 TYR OH : rot 74:sc= -0.612 USER MOD Single : B 57 CYS SG : rot -22:sc= 0.00821 USER MOD Single : B 60 SER OG : rot -118:sc= 0.84 USER MOD Single : B 62 MET CE :methyl -149:sc= -0.204 (180deg=-0.815) USER MOD Single : B 63 LYS NZ :NH3+ -177:sc= 1.91 (180deg=1.86) USER MOD Single : B 68 GLN : amide:sc=-0.00132 X(o=-0.0013,f=0) USER MOD Single : B 69 ASN :FLIP amide:sc= -0.134 F(o=-2.9,f=-0.13) USER MOD Single : B 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 71 GLN : amide:sc= -0.421 X(o=-0.42,f=0) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 31:sc= 1.13 USER MOD Single : B 78 THR OG1 : rot 180:sc= -0.0611 USER MOD Single : B 88 ASN : amide:sc= -0.432 K(o=-0.43,f=-11!) USER MOD Single : B 112 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.093) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 119 HIS : no HE2:sc= -0.145 K(o=-0.15,f=-4.3!) USER MOD Single : B 120 HIS : no HD1:sc= -0.0136 X(o=-0.014,f=-0.014) USER MOD Single : B 122 CYS SG : rot 153:sc= 1.12 USER MOD Single : B 124 TYR OH : rot 8:sc= 0.741 USER MOD Single : B 128 THR OG1 : rot 180:sc= -0.287 USER MOD Single : B 130 ASN : amide:sc= -0.923 K(o=-0.92,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.310 0.011 1.571 1.00 60.05 N ATOM 2 CA MET A 1 2.590 0.439 0.181 1.00 3.23 C ATOM 3 C MET A 1 3.481 -0.584 -0.520 1.00 42.13 C ATOM 4 O MET A 1 3.737 -1.665 0.018 1.00 30.31 O ATOM 5 CB MET A 1 3.270 1.810 0.161 1.00 13.52 C ATOM 6 CG MET A 1 4.672 1.784 0.725 1.00 60.32 C ATOM 7 SD MET A 1 5.524 3.364 0.559 1.00 71.43 S ATOM 8 CE MET A 1 7.217 2.849 0.828 1.00 20.11 C ATOM 0 H1 MET A 1 1.284 -0.104 1.699 1.00 60.05 H new ATOM 0 H2 MET A 1 2.786 -0.895 1.758 1.00 60.05 H new ATOM 0 H3 MET A 1 2.663 0.731 2.234 1.00 60.05 H new ATOM 0 HA MET A 1 1.639 0.511 -0.348 1.00 3.23 H new ATOM 0 HB2 MET A 1 3.304 2.177 -0.865 1.00 13.52 H new ATOM 0 HB3 MET A 1 2.668 2.516 0.733 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.629 1.509 1.779 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.248 1.011 0.217 1.00 60.32 H new ATOM 0 HE1 MET A 1 7.895 3.608 0.437 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.393 2.721 1.896 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.396 1.904 0.315 1.00 20.11 H new ATOM 20 N ASN A 2 3.964 -0.241 -1.713 1.00 22.52 N ATOM 21 CA ASN A 2 4.874 -1.110 -2.459 1.00 14.33 C ATOM 22 C ASN A 2 6.283 -1.044 -1.865 1.00 22.14 C ATOM 23 O ASN A 2 7.171 -0.377 -2.396 1.00 72.55 O ATOM 24 CB ASN A 2 4.894 -0.725 -3.948 1.00 31.34 C ATOM 25 CG ASN A 2 5.837 -1.592 -4.774 1.00 75.52 C ATOM 26 OD1 ASN A 2 6.074 -2.757 -4.453 1.00 52.13 O ATOM 27 ND2 ASN A 2 6.375 -1.030 -5.848 1.00 35.23 N ATOM 0 H ASN A 2 3.740 0.635 -2.185 1.00 22.52 H new ATOM 0 HA ASN A 2 4.514 -2.136 -2.378 1.00 14.33 H new ATOM 0 HB2 ASN A 2 3.885 -0.807 -4.353 1.00 31.34 H new ATOM 0 HB3 ASN A 2 5.192 0.319 -4.044 1.00 31.34 H new ATOM 0 HD21 ASN A 2 7.009 -1.566 -6.440 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.155 -0.062 -6.082 1.00 35.23 H new ATOM 34 N ILE A 3 6.448 -1.684 -0.716 1.00 0.23 N ATOM 35 CA ILE A 3 7.742 -1.815 -0.067 1.00 51.02 C ATOM 36 C ILE A 3 8.651 -2.767 -0.840 1.00 3.13 C ATOM 37 O ILE A 3 8.244 -3.870 -1.207 1.00 22.24 O ATOM 38 CB ILE A 3 7.567 -2.343 1.376 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.725 -1.363 2.202 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.921 -2.586 2.040 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.427 -0.053 2.479 1.00 23.10 C ATOM 0 H ILE A 3 5.684 -2.128 -0.207 1.00 0.23 H new ATOM 0 HA ILE A 3 8.202 -0.827 -0.045 1.00 51.02 H new ATOM 0 HB ILE A 3 7.043 -3.298 1.329 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.793 -1.162 1.674 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.460 -1.832 3.150 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.768 -2.957 3.053 1.00 24.42 H new ATOM 0 HG22 ILE A 3 9.481 -3.323 1.465 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.481 -1.652 2.076 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.774 0.592 3.067 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.346 -0.243 3.034 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.668 0.437 1.536 1.00 23.10 H new ATOM 53 N LEU A 4 9.878 -2.331 -1.077 1.00 41.13 N ATOM 54 CA LEU A 4 10.887 -3.160 -1.730 1.00 42.04 C ATOM 55 C LEU A 4 11.614 -4.012 -0.697 1.00 41.22 C ATOM 56 O LEU A 4 11.851 -5.203 -0.909 1.00 74.21 O ATOM 57 CB LEU A 4 11.902 -2.288 -2.482 1.00 22.30 C ATOM 58 CG LEU A 4 11.314 -1.380 -3.569 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.412 -0.527 -4.207 1.00 73.22 C ATOM 60 CD2 LEU A 4 10.576 -2.207 -4.627 1.00 52.13 C ATOM 0 H LEU A 4 10.205 -1.398 -0.825 1.00 41.13 H new ATOM 0 HA LEU A 4 10.383 -3.810 -2.446 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.427 -1.665 -1.758 1.00 22.30 H new ATOM 0 HB3 LEU A 4 12.646 -2.940 -2.940 1.00 22.30 H new ATOM 0 HG LEU A 4 10.591 -0.710 -3.104 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.976 0.111 -4.976 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.881 0.094 -3.443 1.00 73.22 H new ATOM 0 HD13 LEU A 4 13.162 -1.177 -4.657 1.00 73.22 H new ATOM 0 HD21 LEU A 4 10.167 -1.542 -5.388 1.00 52.13 H new ATOM 0 HD22 LEU A 4 11.271 -2.907 -5.092 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.765 -2.761 -4.155 1.00 52.13 H new ATOM 72 N TYR A 5 11.961 -3.392 0.429 1.00 24.01 N ATOM 73 CA TYR A 5 12.713 -4.075 1.480 1.00 4.44 C ATOM 74 C TYR A 5 12.154 -3.704 2.851 1.00 12.52 C ATOM 75 O TYR A 5 11.965 -2.532 3.141 1.00 21.34 O ATOM 76 CB TYR A 5 14.198 -3.689 1.386 1.00 54.43 C ATOM 77 CG TYR A 5 15.103 -4.408 2.374 1.00 2.54 C ATOM 78 CD1 TYR A 5 15.246 -3.952 3.681 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.823 -5.535 1.992 1.00 14.20 C ATOM 80 CE1 TYR A 5 16.074 -4.596 4.576 1.00 2.54 C ATOM 81 CE2 TYR A 5 16.654 -6.186 2.885 1.00 4.33 C ATOM 82 CZ TYR A 5 16.775 -5.712 4.174 1.00 33.20 C ATOM 83 OH TYR A 5 17.606 -6.354 5.065 1.00 31.30 O ATOM 0 H TYR A 5 11.734 -2.420 0.637 1.00 24.01 H new ATOM 0 HA TYR A 5 12.617 -5.153 1.348 1.00 4.44 H new ATOM 0 HB2 TYR A 5 14.550 -3.895 0.375 1.00 54.43 H new ATOM 0 HB3 TYR A 5 14.291 -2.614 1.544 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.698 -3.078 4.000 1.00 4.50 H new ATOM 0 HD2 TYR A 5 15.732 -5.907 0.982 1.00 14.20 H new ATOM 0 HE1 TYR A 5 16.173 -4.228 5.586 1.00 2.54 H new ATOM 0 HE2 TYR A 5 17.205 -7.061 2.574 1.00 4.33 H new ATOM 0 HH TYR A 5 18.026 -7.123 4.625 1.00 31.30 H new ATOM 93 N LYS A 6 11.878 -4.703 3.684 1.00 51.40 N ATOM 94 CA LYS A 6 11.391 -4.464 5.040 1.00 43.32 C ATOM 95 C LYS A 6 11.961 -5.488 6.017 1.00 62.42 C ATOM 96 O LYS A 6 11.904 -6.693 5.771 1.00 13.53 O ATOM 97 CB LYS A 6 9.852 -4.483 5.089 1.00 1.54 C ATOM 98 CG LYS A 6 9.292 -4.485 6.511 1.00 51.03 C ATOM 99 CD LYS A 6 7.787 -4.229 6.563 1.00 30.33 C ATOM 100 CE LYS A 6 7.446 -2.754 6.374 1.00 61.32 C ATOM 101 NZ LYS A 6 6.050 -2.452 6.792 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.983 -5.689 3.443 1.00 51.40 H new ATOM 0 HA LYS A 6 11.733 -3.473 5.340 1.00 43.32 H new ATOM 0 HB2 LYS A 6 9.468 -3.613 4.556 1.00 1.54 H new ATOM 0 HB3 LYS A 6 9.490 -5.366 4.562 1.00 1.54 H new ATOM 0 HG2 LYS A 6 9.507 -5.446 6.978 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.805 -3.723 7.098 1.00 51.03 H new ATOM 0 HD2 LYS A 6 7.293 -4.816 5.789 1.00 30.33 H new ATOM 0 HD3 LYS A 6 7.395 -4.571 7.521 1.00 30.33 H new ATOM 0 HE2 LYS A 6 8.139 -2.144 6.953 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.579 -2.481 5.327 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.951 -1.430 6.958 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 5.392 -2.747 6.043 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.831 -2.968 7.668 1.00 4.41 H new ATOM 115 N THR A 7 12.494 -4.993 7.130 1.00 30.21 N ATOM 116 CA THR A 7 13.068 -5.833 8.174 1.00 33.22 C ATOM 117 C THR A 7 12.413 -5.511 9.521 1.00 54.23 C ATOM 118 O THR A 7 12.002 -4.369 9.763 1.00 73.02 O ATOM 119 CB THR A 7 14.603 -5.634 8.267 1.00 43.13 C ATOM 120 OG1 THR A 7 15.163 -6.469 9.294 1.00 11.53 O ATOM 121 CG2 THR A 7 14.964 -4.175 8.539 1.00 62.33 C ATOM 0 H THR A 7 12.540 -3.994 7.333 1.00 30.21 H new ATOM 0 HA THR A 7 12.876 -6.875 7.920 1.00 33.22 H new ATOM 0 HB THR A 7 15.024 -5.919 7.303 1.00 43.13 H new ATOM 0 HG1 THR A 7 15.856 -5.973 9.777 1.00 11.53 H new ATOM 0 HG21 THR A 7 16.048 -4.073 8.598 1.00 62.33 H new ATOM 0 HG22 THR A 7 14.584 -3.549 7.731 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.518 -3.860 9.482 1.00 62.33 H new ATOM 129 N ALA A 8 12.310 -6.515 10.392 1.00 51.42 N ATOM 130 CA ALA A 8 11.632 -6.353 11.675 1.00 62.45 C ATOM 131 C ALA A 8 12.605 -6.405 12.848 1.00 64.34 C ATOM 132 O ALA A 8 13.685 -7.003 12.760 1.00 4.53 O ATOM 133 CB ALA A 8 10.563 -7.423 11.839 1.00 11.23 C ATOM 0 H ALA A 8 12.688 -7.449 10.231 1.00 51.42 H new ATOM 0 HA ALA A 8 11.167 -5.367 11.677 1.00 62.45 H new ATOM 0 HB1 ALA A 8 10.063 -7.294 12.799 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.833 -7.334 11.035 1.00 11.23 H new ATOM 0 HB3 ALA A 8 11.026 -8.409 11.801 1.00 11.23 H new ATOM 139 N ALA A 9 12.197 -5.787 13.949 1.00 62.04 N ATOM 140 CA ALA A 9 12.959 -5.784 15.187 1.00 13.24 C ATOM 141 C ALA A 9 12.014 -5.603 16.371 1.00 53.42 C ATOM 142 O ALA A 9 11.343 -4.581 16.484 1.00 45.34 O ATOM 143 CB ALA A 9 14.009 -4.676 15.166 1.00 65.14 C ATOM 0 H ALA A 9 11.320 -5.270 14.006 1.00 62.04 H new ATOM 0 HA ALA A 9 13.475 -6.739 15.288 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.570 -4.689 16.100 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.691 -4.837 14.331 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.517 -3.710 15.051 1.00 65.14 H new ATOM 149 N THR A 10 11.951 -6.600 17.241 1.00 61.23 N ATOM 150 CA THR A 10 11.075 -6.551 18.401 1.00 51.35 C ATOM 151 C THR A 10 11.890 -6.228 19.653 1.00 43.21 C ATOM 152 O THR A 10 13.032 -6.668 19.787 1.00 73.43 O ATOM 153 CB THR A 10 10.304 -7.884 18.580 1.00 34.35 C ATOM 154 OG1 THR A 10 9.291 -7.736 19.585 1.00 3.15 O ATOM 155 CG2 THR A 10 11.239 -9.033 18.953 1.00 70.40 C ATOM 0 H THR A 10 12.499 -7.457 17.164 1.00 61.23 H new ATOM 0 HA THR A 10 10.338 -5.763 18.243 1.00 51.35 H new ATOM 0 HB THR A 10 9.839 -8.127 17.624 1.00 34.35 H new ATOM 0 HG1 THR A 10 8.471 -7.389 19.175 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.661 -9.950 19.070 1.00 70.40 H new ATOM 0 HG22 THR A 10 11.980 -9.169 18.165 1.00 70.40 H new ATOM 0 HG23 THR A 10 11.744 -8.801 19.891 1.00 70.40 H new ATOM 163 N SER A 11 11.311 -5.444 20.547 1.00 71.32 N ATOM 164 CA SER A 11 11.998 -5.019 21.759 1.00 2.43 C ATOM 165 C SER A 11 11.154 -5.314 23.002 1.00 11.12 C ATOM 166 O SER A 11 10.071 -4.758 23.183 1.00 53.54 O ATOM 167 CB SER A 11 12.351 -3.525 21.673 1.00 22.21 C ATOM 168 OG SER A 11 11.223 -2.746 21.316 1.00 52.01 O ATOM 0 H SER A 11 10.360 -5.086 20.457 1.00 71.32 H new ATOM 0 HA SER A 11 12.924 -5.588 21.848 1.00 2.43 H new ATOM 0 HB2 SER A 11 12.740 -3.186 22.633 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.143 -3.379 20.939 1.00 22.21 H new ATOM 0 HG SER A 11 10.634 -3.271 20.735 1.00 52.01 H new ATOM 174 N THR A 12 11.644 -6.224 23.833 1.00 54.12 N ATOM 175 CA THR A 12 10.991 -6.570 25.083 1.00 52.53 C ATOM 176 C THR A 12 11.331 -5.551 26.171 1.00 72.12 C ATOM 177 O THR A 12 12.362 -4.852 26.097 1.00 13.04 O ATOM 178 CB THR A 12 11.439 -7.967 25.562 1.00 35.03 C ATOM 179 OG1 THR A 12 11.538 -8.852 24.435 1.00 61.53 O ATOM 180 CG2 THR A 12 10.462 -8.550 26.581 1.00 33.34 C ATOM 0 H THR A 12 12.505 -6.742 23.657 1.00 54.12 H new ATOM 0 HA THR A 12 9.916 -6.569 24.903 1.00 52.53 H new ATOM 0 HB THR A 12 12.411 -7.862 26.045 1.00 35.03 H new ATOM 0 HG1 THR A 12 11.824 -9.738 24.739 1.00 61.53 H new ATOM 0 HG21 THR A 12 10.809 -9.534 26.896 1.00 33.34 H new ATOM 0 HG22 THR A 12 10.404 -7.891 27.447 1.00 33.34 H new ATOM 0 HG23 THR A 12 9.475 -8.641 26.128 1.00 33.34 H new ATOM 188 N GLY A 13 10.468 -5.479 27.178 1.00 62.44 N ATOM 189 CA GLY A 13 10.713 -4.629 28.319 1.00 34.44 C ATOM 190 C GLY A 13 11.800 -5.176 29.223 1.00 13.14 C ATOM 191 O GLY A 13 11.518 -5.716 30.296 1.00 50.55 O ATOM 0 H GLY A 13 9.594 -6.003 27.220 1.00 62.44 H new ATOM 0 HA2 GLY A 13 10.997 -3.635 27.974 1.00 34.44 H new ATOM 0 HA3 GLY A 13 9.791 -4.517 28.890 1.00 34.44 H new ATOM 195 N GLY A 14 13.046 -5.079 28.763 1.00 62.02 N ATOM 196 CA GLY A 14 14.181 -5.406 29.607 1.00 43.32 C ATOM 197 C GLY A 14 14.340 -4.412 30.744 1.00 33.13 C ATOM 198 O GLY A 14 13.451 -3.594 30.979 1.00 44.52 O ATOM 0 H GLY A 14 13.289 -4.779 27.819 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.054 -6.409 30.015 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.090 -5.419 29.006 1.00 43.32 H new ATOM 202 N ARG A 15 15.468 -4.477 31.451 1.00 24.13 N ATOM 203 CA ARG A 15 15.735 -3.550 32.556 1.00 34.21 C ATOM 204 C ARG A 15 15.535 -2.107 32.100 1.00 4.22 C ATOM 205 O ARG A 15 14.907 -1.306 32.796 1.00 73.04 O ATOM 206 CB ARG A 15 17.161 -3.737 33.108 1.00 34.44 C ATOM 207 CG ARG A 15 17.318 -4.899 34.091 1.00 1.44 C ATOM 208 CD ARG A 15 16.971 -6.244 33.467 1.00 44.04 C ATOM 209 NE ARG A 15 17.173 -7.348 34.406 1.00 64.51 N ATOM 210 CZ ARG A 15 16.620 -8.554 34.277 1.00 22.54 C ATOM 211 NH1 ARG A 15 15.772 -8.804 33.289 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 16.896 -9.506 35.157 1.00 44.23 N ATOM 0 H ARG A 15 16.209 -5.157 31.282 1.00 24.13 H new ATOM 0 HA ARG A 15 15.029 -3.771 33.356 1.00 34.21 H new ATOM 0 HB2 ARG A 15 17.843 -3.892 32.272 1.00 34.44 H new ATOM 0 HB3 ARG A 15 17.468 -2.816 33.603 1.00 34.44 H new ATOM 0 HG2 ARG A 15 18.345 -4.926 34.455 1.00 1.44 H new ATOM 0 HG3 ARG A 15 16.677 -4.728 34.956 1.00 1.44 H new ATOM 0 HD2 ARG A 15 15.932 -6.234 33.136 1.00 44.04 H new ATOM 0 HD3 ARG A 15 17.586 -6.403 32.581 1.00 44.04 H new ATOM 0 HE ARG A 15 17.776 -7.184 35.212 1.00 64.51 H new ATOM 0 HH11 ARG A 15 15.538 -8.071 32.620 1.00 12.40 H new ATOM 0 HH12 ARG A 15 15.354 -9.730 33.198 1.00 12.40 H new ATOM 0 HH21 ARG A 15 17.531 -9.315 35.932 1.00 44.23 H new ATOM 0 HH22 ARG A 15 16.473 -10.429 35.059 1.00 44.23 H new ATOM 226 N ASP A 16 16.095 -1.780 30.940 1.00 4.14 N ATOM 227 CA ASP A 16 15.876 -0.477 30.318 1.00 22.02 C ATOM 228 C ASP A 16 15.368 -0.670 28.887 1.00 52.02 C ATOM 229 O ASP A 16 14.439 0.012 28.457 1.00 74.22 O ATOM 230 CB ASP A 16 17.174 0.320 30.342 1.00 50.13 C ATOM 231 CG ASP A 16 17.006 1.780 29.937 1.00 53.42 C ATOM 232 OD1 ASP A 16 17.247 2.108 28.761 1.00 45.04 O ATOM 233 OD2 ASP A 16 16.660 2.608 30.810 1.00 61.02 O1- ATOM 0 H ASP A 16 16.706 -2.401 30.409 1.00 4.14 H new ATOM 0 HA ASP A 16 15.122 0.080 30.873 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.597 0.277 31.346 1.00 50.13 H new ATOM 0 HB3 ASP A 16 17.892 -0.153 29.672 1.00 50.13 H new ATOM 238 N GLY A 17 15.975 -1.618 28.150 1.00 73.12 N ATOM 239 CA GLY A 17 15.362 -2.088 26.913 1.00 31.14 C ATOM 240 C GLY A 17 15.968 -3.397 26.441 1.00 63.12 C ATOM 241 O GLY A 17 17.163 -3.627 26.631 1.00 34.35 O ATOM 0 H GLY A 17 16.864 -2.058 28.387 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.291 -2.219 27.066 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.484 -1.332 26.138 1.00 31.14 H new ATOM 245 N ARG A 18 15.155 -4.272 25.846 1.00 71.41 N ATOM 246 CA ARG A 18 15.648 -5.556 25.340 1.00 64.41 C ATOM 247 C ARG A 18 15.308 -5.679 23.850 1.00 2.04 C ATOM 248 O ARG A 18 14.184 -6.002 23.499 1.00 73.24 O ATOM 249 CB ARG A 18 15.006 -6.687 26.170 1.00 30.54 C ATOM 250 CG ARG A 18 15.813 -7.981 26.264 1.00 21.30 C ATOM 251 CD ARG A 18 15.620 -8.900 25.064 1.00 2.42 C ATOM 252 NE ARG A 18 16.183 -10.225 25.330 1.00 61.43 N ATOM 253 CZ ARG A 18 16.450 -11.136 24.399 1.00 42.21 C ATOM 254 NH1 ARG A 18 16.156 -10.908 23.128 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 17.007 -12.289 24.748 1.00 11.32 N ATOM 0 H ARG A 18 14.157 -4.117 25.703 1.00 71.41 H new ATOM 0 HA ARG A 18 16.731 -5.626 25.438 1.00 64.41 H new ATOM 0 HB2 ARG A 18 14.830 -6.316 27.180 1.00 30.54 H new ATOM 0 HB3 ARG A 18 14.031 -6.919 25.741 1.00 30.54 H new ATOM 0 HG2 ARG A 18 16.871 -7.735 26.358 1.00 21.30 H new ATOM 0 HG3 ARG A 18 15.527 -8.514 27.171 1.00 21.30 H new ATOM 0 HD2 ARG A 18 14.558 -8.990 24.836 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.099 -8.466 24.186 1.00 2.42 H new ATOM 0 HE ARG A 18 16.385 -10.467 26.300 1.00 61.43 H new ATOM 0 HH11 ARG A 18 15.721 -10.027 22.855 1.00 65.11 H new ATOM 0 HH12 ARG A 18 16.365 -11.614 22.422 1.00 65.11 H new ATOM 0 HH21 ARG A 18 17.228 -12.473 25.727 1.00 11.32 H new ATOM 0 HH22 ARG A 18 17.214 -12.991 24.038 1.00 11.32 H new ATOM 269 N ALA A 19 16.285 -5.427 22.981 1.00 71.12 N ATOM 270 CA ALA A 19 16.039 -5.306 21.543 1.00 34.25 C ATOM 271 C ALA A 19 16.503 -6.551 20.797 1.00 41.03 C ATOM 272 O ALA A 19 17.552 -7.118 21.096 1.00 12.34 O ATOM 273 CB ALA A 19 16.738 -4.066 20.994 1.00 5.35 C ATOM 0 H ALA A 19 17.261 -5.302 23.249 1.00 71.12 H new ATOM 0 HA ALA A 19 14.965 -5.206 21.390 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.549 -3.985 19.924 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.354 -3.179 21.498 1.00 5.35 H new ATOM 0 HB3 ALA A 19 17.811 -4.146 21.167 1.00 5.35 H new ATOM 279 N THR A 20 15.716 -6.970 19.824 1.00 63.53 N ATOM 280 CA THR A 20 16.003 -8.172 19.051 1.00 0.02 C ATOM 281 C THR A 20 15.459 -8.046 17.627 1.00 61.21 C ATOM 282 O THR A 20 14.247 -8.001 17.422 1.00 50.32 O ATOM 283 CB THR A 20 15.376 -9.410 19.741 1.00 22.13 C ATOM 284 OG1 THR A 20 15.763 -9.430 21.123 1.00 4.20 O ATOM 285 CG2 THR A 20 15.811 -10.716 19.074 1.00 30.30 C ATOM 0 H THR A 20 14.860 -6.490 19.545 1.00 63.53 H new ATOM 0 HA THR A 20 17.085 -8.294 19.001 1.00 0.02 H new ATOM 0 HB THR A 20 14.293 -9.332 19.649 1.00 22.13 H new ATOM 0 HG1 THR A 20 15.222 -8.784 21.624 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.349 -11.559 19.588 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.499 -10.713 18.030 1.00 30.30 H new ATOM 0 HG23 THR A 20 16.896 -10.808 19.128 1.00 30.30 H new ATOM 293 N SER A 21 16.354 -7.990 16.641 1.00 52.22 N ATOM 294 CA SER A 21 15.929 -7.917 15.251 1.00 61.23 C ATOM 295 C SER A 21 15.323 -9.252 14.878 1.00 4.01 C ATOM 296 O SER A 21 16.055 -10.255 14.776 1.00 53.51 O ATOM 297 CB SER A 21 17.083 -7.567 14.305 1.00 62.30 C ATOM 298 OG SER A 21 16.649 -7.505 12.952 1.00 0.33 O ATOM 0 H SER A 21 17.365 -7.994 16.780 1.00 52.22 H new ATOM 0 HA SER A 21 15.197 -7.116 15.147 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.514 -6.608 14.594 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.872 -8.313 14.401 1.00 62.30 H new ATOM 0 HG SER A 21 15.683 -7.343 12.925 1.00 0.33 H new ATOM 304 N HIS A 22 13.994 -9.212 14.664 1.00 22.03 N ATOM 305 CA HIS A 22 13.116 -10.385 14.569 1.00 2.11 C ATOM 306 C HIS A 22 13.569 -11.377 13.509 1.00 71.44 C ATOM 307 O HIS A 22 13.278 -12.567 13.603 1.00 63.31 O ATOM 308 CB HIS A 22 11.681 -9.921 14.271 1.00 42.33 C ATOM 309 CG HIS A 22 10.665 -11.027 14.202 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.202 -11.554 13.017 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.003 -11.683 15.184 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.300 -12.480 13.272 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.159 -12.579 14.579 1.00 41.54 N ATOM 0 H HIS A 22 13.490 -8.333 14.549 1.00 22.03 H new ATOM 0 HA HIS A 22 13.160 -10.905 15.526 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.375 -9.213 15.041 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.677 -9.383 13.323 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.118 -11.529 16.247 1.00 33.23 H new ATOM 0 HE1 HIS A 22 8.766 -13.060 12.534 1.00 21.33 H new ATOM 0 HE2 HIS A 22 8.526 -13.217 15.061 1.00 41.54 H new ATOM 322 N ASP A 23 14.307 -10.899 12.519 1.00 65.30 N ATOM 323 CA ASP A 23 14.811 -11.773 11.464 1.00 52.23 C ATOM 324 C ASP A 23 16.056 -12.506 11.956 1.00 2.53 C ATOM 325 O ASP A 23 16.838 -13.031 11.162 1.00 21.54 O ATOM 326 CB ASP A 23 15.143 -10.967 10.199 1.00 41.44 C ATOM 327 CG ASP A 23 13.996 -10.077 9.737 1.00 73.43 C ATOM 328 OD1 ASP A 23 14.049 -8.854 10.000 1.00 71.33 O ATOM 329 OD2 ASP A 23 13.047 -10.589 9.105 1.00 13.13 O1- ATOM 0 H ASP A 23 14.570 -9.918 12.421 1.00 65.30 H new ATOM 0 HA ASP A 23 14.037 -12.498 11.214 1.00 52.23 H new ATOM 0 HB2 ASP A 23 16.020 -10.349 10.390 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.407 -11.655 9.396 1.00 41.44 H new ATOM 334 N GLN A 24 16.236 -12.507 13.283 1.00 30.45 N ATOM 335 CA GLN A 24 17.336 -13.201 13.947 1.00 23.53 C ATOM 336 C GLN A 24 18.653 -12.508 13.633 1.00 71.34 C ATOM 337 O GLN A 24 19.729 -13.083 13.786 1.00 22.01 O ATOM 338 CB GLN A 24 17.376 -14.690 13.553 1.00 42.54 C ATOM 339 CG GLN A 24 16.085 -15.443 13.874 1.00 72.53 C ATOM 340 CD GLN A 24 15.685 -15.339 15.340 1.00 14.50 C ATOM 341 OE1 GLN A 24 16.099 -16.151 16.172 1.00 45.33 O ATOM 342 NE2 GLN A 24 14.872 -14.346 15.670 1.00 4.22 N ATOM 0 H GLN A 24 15.614 -12.020 13.928 1.00 30.45 H new ATOM 0 HA GLN A 24 17.173 -13.159 15.024 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.577 -14.769 12.485 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.206 -15.172 14.070 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.278 -15.051 13.254 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.208 -16.493 13.610 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.549 -13.693 14.956 1.00 4.22 H new ATOM 0 HE22 GLN A 24 14.569 -14.235 16.638 1.00 4.22 H new ATOM 351 N LYS A 25 18.551 -11.247 13.221 1.00 22.35 N ATOM 352 CA LYS A 25 19.721 -10.453 12.878 1.00 24.04 C ATOM 353 C LYS A 25 20.309 -9.780 14.113 1.00 45.31 C ATOM 354 O LYS A 25 21.503 -9.467 14.136 1.00 73.44 O ATOM 355 CB LYS A 25 19.379 -9.393 11.818 1.00 30.31 C ATOM 356 CG LYS A 25 19.138 -9.960 10.419 1.00 12.14 C ATOM 357 CD LYS A 25 19.034 -8.847 9.375 1.00 61.23 C ATOM 358 CE LYS A 25 17.762 -8.016 9.542 1.00 52.51 C ATOM 359 NZ LYS A 25 16.610 -8.611 8.816 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.664 -10.754 13.117 1.00 22.35 H new ATOM 0 HA LYS A 25 20.466 -11.133 12.464 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.488 -8.851 12.136 1.00 30.31 H new ATOM 0 HB3 LYS A 25 20.192 -8.669 11.769 1.00 30.31 H new ATOM 0 HG2 LYS A 25 19.952 -10.635 10.153 1.00 12.14 H new ATOM 0 HG3 LYS A 25 18.221 -10.550 10.417 1.00 12.14 H new ATOM 0 HD2 LYS A 25 19.904 -8.196 9.453 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.052 -9.285 8.377 1.00 61.23 H new ATOM 0 HE2 LYS A 25 17.519 -7.933 10.601 1.00 52.51 H new ATOM 0 HE3 LYS A 25 17.939 -7.005 9.175 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 15.722 -8.239 9.209 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 16.671 -8.366 7.807 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 16.629 -9.645 8.923 1.00 22.01 H new ATOM 373 N LEU A 26 19.488 -9.542 15.145 1.00 32.33 N ATOM 374 CA LEU A 26 19.998 -8.865 16.343 1.00 24.31 C ATOM 375 C LEU A 26 19.317 -9.384 17.600 1.00 21.31 C ATOM 376 O LEU A 26 18.153 -9.756 17.558 1.00 11.34 O ATOM 377 CB LEU A 26 19.792 -7.351 16.212 1.00 35.55 C ATOM 378 CG LEU A 26 20.149 -6.515 17.446 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.645 -6.588 17.748 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.694 -5.075 17.249 1.00 74.42 C ATOM 0 H LEU A 26 18.501 -9.798 15.176 1.00 32.33 H new ATOM 0 HA LEU A 26 21.064 -9.077 16.429 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.388 -6.995 15.372 1.00 35.55 H new ATOM 0 HB3 LEU A 26 18.747 -7.167 15.963 1.00 35.55 H new ATOM 0 HG LEU A 26 19.625 -6.927 18.308 1.00 2.25 H new ATOM 0 HD11 LEU A 26 21.868 -5.985 18.628 1.00 31.22 H new ATOM 0 HD12 LEU A 26 21.928 -7.624 17.936 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.207 -6.207 16.895 1.00 31.22 H new ATOM 0 HD21 LEU A 26 19.952 -4.488 18.131 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.190 -4.653 16.375 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.614 -5.052 17.100 1.00 74.42 H new ATOM 392 N ASP A 27 20.056 -9.389 18.709 1.00 3.11 N ATOM 393 CA ASP A 27 19.547 -9.851 20.001 1.00 12.11 C ATOM 394 C ASP A 27 20.433 -9.314 21.132 1.00 11.44 C ATOM 395 O ASP A 27 21.452 -9.916 21.470 1.00 42.31 O ATOM 396 CB ASP A 27 19.492 -11.392 20.023 1.00 5.04 C ATOM 397 CG ASP A 27 19.133 -11.981 21.384 1.00 74.13 C ATOM 398 OD1 ASP A 27 17.931 -12.173 21.656 1.00 54.23 O ATOM 399 OD2 ASP A 27 20.055 -12.288 22.174 1.00 11.42 O1- ATOM 0 H ASP A 27 21.025 -9.073 18.737 1.00 3.11 H new ATOM 0 HA ASP A 27 18.536 -9.472 20.150 1.00 12.11 H new ATOM 0 HB2 ASP A 27 18.761 -11.730 19.288 1.00 5.04 H new ATOM 0 HB3 ASP A 27 20.460 -11.784 19.713 1.00 5.04 H new ATOM 404 N VAL A 28 20.070 -8.146 21.667 1.00 5.03 N ATOM 405 CA VAL A 28 20.806 -7.519 22.772 1.00 42.02 C ATOM 406 C VAL A 28 19.887 -6.701 23.674 1.00 62.12 C ATOM 407 O VAL A 28 18.686 -6.578 23.435 1.00 32.30 O ATOM 408 CB VAL A 28 21.943 -6.581 22.277 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.145 -7.380 21.790 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.427 -5.636 21.191 1.00 1.00 C ATOM 0 H VAL A 28 19.263 -7.609 21.350 1.00 5.03 H new ATOM 0 HA VAL A 28 21.240 -8.349 23.331 1.00 42.02 H new ATOM 0 HB VAL A 28 22.275 -5.976 23.121 1.00 24.24 H new ATOM 0 HG11 VAL A 28 23.923 -6.696 21.450 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.530 -7.992 22.606 1.00 34.22 H new ATOM 0 HG13 VAL A 28 22.843 -8.025 20.965 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.237 -4.988 20.858 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.058 -6.219 20.347 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.617 -5.027 21.593 1.00 1.00 H new ATOM 420 N LYS A 29 20.485 -6.142 24.713 1.00 24.10 N ATOM 421 CA LYS A 29 19.807 -5.258 25.647 1.00 44.35 C ATOM 422 C LYS A 29 20.518 -3.912 25.667 1.00 43.02 C ATOM 423 O LYS A 29 21.730 -3.843 25.453 1.00 12.55 O ATOM 424 CB LYS A 29 19.813 -5.894 27.049 1.00 13.02 C ATOM 425 CG LYS A 29 19.622 -4.913 28.206 1.00 22.53 C ATOM 426 CD LYS A 29 19.980 -5.521 29.568 1.00 24.23 C ATOM 427 CE LYS A 29 19.217 -6.812 29.875 1.00 1.41 C ATOM 428 NZ LYS A 29 19.850 -8.017 29.263 1.00 62.42 N1+ ATOM 0 H LYS A 29 21.469 -6.292 24.935 1.00 24.10 H new ATOM 0 HA LYS A 29 18.773 -5.107 25.337 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.023 -6.644 27.094 1.00 13.02 H new ATOM 0 HB3 LYS A 29 20.758 -6.418 27.189 1.00 13.02 H new ATOM 0 HG2 LYS A 29 20.239 -4.031 28.034 1.00 22.53 H new ATOM 0 HG3 LYS A 29 18.585 -4.578 28.224 1.00 22.53 H new ATOM 0 HD2 LYS A 29 21.050 -5.724 29.597 1.00 24.23 H new ATOM 0 HD3 LYS A 29 19.773 -4.790 30.350 1.00 24.23 H new ATOM 0 HE2 LYS A 29 19.159 -6.946 30.955 1.00 1.41 H new ATOM 0 HE3 LYS A 29 18.194 -6.720 29.510 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 19.249 -8.371 28.492 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 20.785 -7.764 28.885 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 19.958 -8.757 29.985 1.00 62.42 H new ATOM 442 N LEU A 30 19.769 -2.840 25.893 1.00 2.53 N ATOM 443 CA LEU A 30 20.350 -1.527 26.075 1.00 41.03 C ATOM 444 C LEU A 30 19.825 -0.896 27.361 1.00 64.12 C ATOM 445 O LEU A 30 18.744 -1.279 27.869 1.00 54.30 O ATOM 446 CB LEU A 30 20.127 -0.623 24.839 1.00 11.12 C ATOM 447 CG LEU A 30 18.736 -0.633 24.173 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.455 -1.956 23.459 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.645 -0.300 25.179 1.00 54.12 C ATOM 0 H LEU A 30 18.751 -2.861 25.954 1.00 2.53 H new ATOM 0 HA LEU A 30 21.430 -1.637 26.174 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.349 0.403 25.132 1.00 11.12 H new ATOM 0 HB3 LEU A 30 20.860 -0.904 24.083 1.00 11.12 H new ATOM 0 HG LEU A 30 18.735 0.146 23.410 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.465 -1.921 23.004 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.205 -2.118 22.685 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.494 -2.773 24.179 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.675 -0.314 24.682 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.652 -1.038 25.981 1.00 54.12 H new ATOM 0 HD23 LEU A 30 17.825 0.691 25.596 1.00 54.12 H new ATOM 461 N SER A 31 20.610 0.038 27.897 1.00 75.34 N ATOM 462 CA SER A 31 20.315 0.671 29.170 1.00 34.22 C ATOM 463 C SER A 31 21.056 1.992 29.314 1.00 62.41 C ATOM 464 O SER A 31 22.213 2.115 28.910 1.00 64.13 O ATOM 465 CB SER A 31 20.686 -0.266 30.332 1.00 52.23 C ATOM 466 OG SER A 31 19.969 -1.491 30.259 1.00 11.31 O ATOM 0 H SER A 31 21.467 0.373 27.457 1.00 75.34 H new ATOM 0 HA SER A 31 19.245 0.874 29.201 1.00 34.22 H new ATOM 0 HB2 SER A 31 21.757 -0.468 30.311 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.473 0.226 31.281 1.00 52.23 H new ATOM 0 HG SER A 31 19.254 -1.412 29.593 1.00 11.31 H new ATOM 472 N ALA A 32 20.370 2.978 29.885 1.00 52.21 N ATOM 473 CA ALA A 32 20.989 4.254 30.215 1.00 43.51 C ATOM 474 C ALA A 32 22.120 4.028 31.222 1.00 25.12 C ATOM 475 O ALA A 32 22.010 3.156 32.087 1.00 4.30 O ATOM 476 CB ALA A 32 19.942 5.219 30.766 1.00 22.44 C ATOM 0 H ALA A 32 19.382 2.915 30.129 1.00 52.21 H new ATOM 0 HA ALA A 32 21.412 4.699 29.315 1.00 43.51 H new ATOM 0 HB1 ALA A 32 20.416 6.170 31.009 1.00 22.44 H new ATOM 0 HB2 ALA A 32 19.167 5.381 30.017 1.00 22.44 H new ATOM 0 HB3 ALA A 32 19.495 4.796 31.665 1.00 22.44 H new ATOM 482 N PRO A 33 23.201 4.829 31.152 1.00 32.33 N ATOM 483 CA PRO A 33 24.444 4.580 31.914 1.00 35.40 C ATOM 484 C PRO A 33 24.304 4.727 33.438 1.00 50.42 C ATOM 485 O PRO A 33 25.312 4.809 34.139 1.00 70.53 O ATOM 486 CB PRO A 33 25.412 5.638 31.363 1.00 73.33 C ATOM 487 CG PRO A 33 24.531 6.729 30.858 1.00 10.15 C ATOM 488 CD PRO A 33 23.307 6.042 30.315 1.00 32.53 C ATOM 0 HA PRO A 33 24.770 3.548 31.787 1.00 35.40 H new ATOM 0 HB2 PRO A 33 26.086 6.000 32.139 1.00 73.33 H new ATOM 0 HB3 PRO A 33 26.033 5.230 30.566 1.00 73.33 H new ATOM 0 HG2 PRO A 33 24.269 7.423 31.657 1.00 10.15 H new ATOM 0 HG3 PRO A 33 25.031 7.310 30.083 1.00 10.15 H new ATOM 0 HD2 PRO A 33 22.421 6.670 30.402 1.00 32.53 H new ATOM 0 HD3 PRO A 33 23.419 5.794 29.259 1.00 32.53 H new ATOM 496 N ARG A 34 23.065 4.758 33.946 1.00 10.53 N ATOM 497 CA ARG A 34 22.788 4.830 35.379 1.00 33.33 C ATOM 498 C ARG A 34 23.115 6.206 35.986 1.00 40.12 C ATOM 499 O ARG A 34 22.377 6.683 36.846 1.00 0.24 O ATOM 500 CB ARG A 34 23.508 3.693 36.130 1.00 35.21 C ATOM 501 CG ARG A 34 22.577 2.912 37.040 1.00 34.41 C ATOM 502 CD ARG A 34 22.014 3.790 38.142 1.00 50.12 C ATOM 503 NE ARG A 34 23.011 4.075 39.179 1.00 3.50 N ATOM 504 CZ ARG A 34 22.722 4.503 40.410 1.00 2.33 C ATOM 505 NH1 ARG A 34 21.461 4.691 40.779 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 23.700 4.742 41.273 1.00 21.42 N ATOM 0 H ARG A 34 22.225 4.734 33.368 1.00 10.53 H new ATOM 0 HA ARG A 34 21.713 4.698 35.501 1.00 33.33 H new ATOM 0 HB2 ARG A 34 23.958 3.013 35.407 1.00 35.21 H new ATOM 0 HB3 ARG A 34 24.322 4.112 36.722 1.00 35.21 H new ATOM 0 HG2 ARG A 34 21.759 2.493 36.453 1.00 34.41 H new ATOM 0 HG3 ARG A 34 23.116 2.073 37.481 1.00 34.41 H new ATOM 0 HD2 ARG A 34 21.658 4.727 37.713 1.00 50.12 H new ATOM 0 HD3 ARG A 34 21.152 3.298 38.593 1.00 50.12 H new ATOM 0 HE ARG A 34 23.994 3.937 38.943 1.00 3.50 H new ATOM 0 HH11 ARG A 34 20.704 4.508 40.120 1.00 23.02 H new ATOM 0 HH12 ARG A 34 21.249 5.018 41.721 1.00 23.02 H new ATOM 0 HH21 ARG A 34 24.671 4.599 40.996 1.00 21.42 H new ATOM 0 HH22 ARG A 34 23.481 5.069 42.214 1.00 21.42 H new ATOM 520 N GLU A 35 24.191 6.842 35.519 1.00 72.31 N ATOM 521 CA GLU A 35 24.603 8.169 35.998 1.00 75.14 C ATOM 522 C GLU A 35 23.427 9.146 36.022 1.00 65.21 C ATOM 523 O GLU A 35 23.351 10.044 36.864 1.00 33.12 O ATOM 524 CB GLU A 35 25.699 8.738 35.078 1.00 20.34 C ATOM 525 CG GLU A 35 26.861 7.785 34.818 1.00 71.30 C ATOM 526 CD GLU A 35 27.553 7.328 36.091 1.00 31.03 C ATOM 527 OE1 GLU A 35 27.168 6.274 36.638 1.00 31.45 O ATOM 528 OE2 GLU A 35 28.498 8.009 36.542 1.00 43.03 O1- ATOM 0 H GLU A 35 24.802 6.455 34.800 1.00 72.31 H new ATOM 0 HA GLU A 35 24.981 8.051 37.014 1.00 75.14 H new ATOM 0 HB2 GLU A 35 25.249 9.012 34.124 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.089 9.654 35.521 1.00 20.34 H new ATOM 0 HG2 GLU A 35 26.494 6.912 34.278 1.00 71.30 H new ATOM 0 HG3 GLU A 35 27.589 8.276 34.172 1.00 71.30 H new ATOM 535 N LEU A 36 22.509 8.946 35.087 1.00 33.22 N ATOM 536 CA LEU A 36 21.420 9.883 34.838 1.00 32.24 C ATOM 537 C LEU A 36 20.083 9.305 35.306 1.00 55.25 C ATOM 538 O LEU A 36 19.018 9.789 34.925 1.00 40.24 O ATOM 539 CB LEU A 36 21.391 10.181 33.334 1.00 11.21 C ATOM 540 CG LEU A 36 22.777 10.459 32.715 1.00 24.22 C ATOM 541 CD1 LEU A 36 22.722 10.413 31.195 1.00 52.21 C ATOM 542 CD2 LEU A 36 23.331 11.800 33.197 1.00 63.44 C ATOM 0 H LEU A 36 22.497 8.128 34.478 1.00 33.22 H new ATOM 0 HA LEU A 36 21.583 10.803 35.399 1.00 32.24 H new ATOM 0 HB2 LEU A 36 20.938 9.335 32.817 1.00 11.21 H new ATOM 0 HB3 LEU A 36 20.748 11.044 33.159 1.00 11.21 H new ATOM 0 HG LEU A 36 23.453 9.671 33.049 1.00 24.22 H new ATOM 0 HD11 LEU A 36 23.714 10.613 30.789 1.00 52.21 H new ATOM 0 HD12 LEU A 36 22.390 9.426 30.873 1.00 52.21 H new ATOM 0 HD13 LEU A 36 22.023 11.167 30.833 1.00 52.21 H new ATOM 0 HD21 LEU A 36 24.308 11.973 32.747 1.00 63.44 H new ATOM 0 HD22 LEU A 36 22.651 12.600 32.906 1.00 63.44 H new ATOM 0 HD23 LEU A 36 23.429 11.784 34.282 1.00 63.44 H new ATOM 554 N GLY A 37 20.151 8.283 36.155 1.00 72.22 N ATOM 555 CA GLY A 37 18.947 7.600 36.605 1.00 12.23 C ATOM 556 C GLY A 37 18.461 6.589 35.580 1.00 31.23 C ATOM 557 O GLY A 37 17.308 6.626 35.150 1.00 41.24 O ATOM 0 H GLY A 37 21.020 7.914 36.541 1.00 72.22 H new ATOM 0 HA2 GLY A 37 19.147 7.094 37.550 1.00 12.23 H new ATOM 0 HA3 GLY A 37 18.162 8.332 36.795 1.00 12.23 H new ATOM 561 N GLY A 38 19.357 5.685 35.188 1.00 73.44 N ATOM 562 CA GLY A 38 19.045 4.707 34.153 1.00 31.42 C ATOM 563 C GLY A 38 18.309 3.493 34.688 1.00 22.15 C ATOM 564 O GLY A 38 17.075 3.457 34.687 1.00 21.21 O ATOM 0 H GLY A 38 20.300 5.611 35.570 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.438 5.183 33.382 1.00 31.42 H new ATOM 0 HA3 GLY A 38 19.970 4.383 33.676 1.00 31.42 H new ATOM 568 N ALA A 39 19.070 2.489 35.131 1.00 14.21 N ATOM 569 CA ALA A 39 18.493 1.269 35.690 1.00 43.43 C ATOM 570 C ALA A 39 19.556 0.428 36.396 1.00 63.22 C ATOM 571 O ALA A 39 19.324 -0.100 37.486 1.00 3.43 O ATOM 572 CB ALA A 39 17.819 0.452 34.593 1.00 5.43 C ATOM 0 H ALA A 39 20.090 2.500 35.112 1.00 14.21 H new ATOM 0 HA ALA A 39 17.745 1.558 36.428 1.00 43.43 H new ATOM 0 HB1 ALA A 39 17.393 -0.454 35.024 1.00 5.43 H new ATOM 0 HB2 ALA A 39 17.026 1.043 34.134 1.00 5.43 H new ATOM 0 HB3 ALA A 39 18.555 0.183 33.836 1.00 5.43 H new ATOM 578 N GLY A 40 20.722 0.310 35.770 1.00 15.31 N ATOM 579 CA GLY A 40 21.780 -0.535 36.303 1.00 42.15 C ATOM 580 C GLY A 40 21.758 -1.896 35.643 1.00 45.53 C ATOM 581 O GLY A 40 21.501 -2.914 36.293 1.00 15.12 O ATOM 0 H GLY A 40 20.956 0.786 34.899 1.00 15.31 H new ATOM 0 HA2 GLY A 40 22.748 -0.061 36.140 1.00 42.15 H new ATOM 0 HA3 GLY A 40 21.657 -0.645 37.380 1.00 42.15 H new ATOM 585 N ALA A 41 22.010 -1.914 34.341 1.00 5.32 N ATOM 586 CA ALA A 41 21.909 -3.139 33.558 1.00 5.21 C ATOM 587 C ALA A 41 23.082 -3.299 32.605 1.00 44.21 C ATOM 588 O ALA A 41 23.940 -2.421 32.494 1.00 13.22 O ATOM 589 CB ALA A 41 20.604 -3.156 32.780 1.00 40.21 C ATOM 0 H ALA A 41 22.286 -1.092 33.803 1.00 5.32 H new ATOM 0 HA ALA A 41 21.930 -3.977 34.255 1.00 5.21 H new ATOM 0 HB1 ALA A 41 20.539 -4.076 32.199 1.00 40.21 H new ATOM 0 HB2 ALA A 41 19.766 -3.106 33.475 1.00 40.21 H new ATOM 0 HB3 ALA A 41 20.570 -2.299 32.108 1.00 40.21 H new ATOM 595 N GLU A 42 23.090 -4.430 31.909 1.00 32.32 N ATOM 596 CA GLU A 42 24.156 -4.771 30.981 1.00 71.23 C ATOM 597 C GLU A 42 23.687 -4.540 29.560 1.00 1.12 C ATOM 598 O GLU A 42 23.242 -5.457 28.866 1.00 55.43 O ATOM 599 CB GLU A 42 24.564 -6.221 31.188 1.00 42.31 C ATOM 600 CG GLU A 42 24.603 -6.584 32.655 1.00 52.14 C ATOM 601 CD GLU A 42 24.867 -8.059 32.894 1.00 31.41 C ATOM 602 OE1 GLU A 42 23.917 -8.865 32.776 1.00 24.22 O ATOM 603 OE2 GLU A 42 26.023 -8.425 33.189 1.00 54.53 O1- ATOM 0 H GLU A 42 22.356 -5.135 31.974 1.00 32.32 H new ATOM 0 HA GLU A 42 25.023 -4.137 31.165 1.00 71.23 H new ATOM 0 HB2 GLU A 42 23.863 -6.875 30.669 1.00 42.31 H new ATOM 0 HB3 GLU A 42 25.545 -6.390 30.744 1.00 42.31 H new ATOM 0 HG2 GLU A 42 25.378 -5.997 33.148 1.00 52.14 H new ATOM 0 HG3 GLU A 42 23.654 -6.311 33.117 1.00 52.14 H new ATOM 610 N GLY A 43 23.735 -3.291 29.169 1.00 3.30 N ATOM 611 CA GLY A 43 23.315 -2.900 27.837 1.00 20.41 C ATOM 612 C GLY A 43 24.151 -1.772 27.271 1.00 55.55 C ATOM 613 O GLY A 43 25.230 -1.475 27.784 1.00 25.21 O ATOM 0 H GLY A 43 24.061 -2.521 29.753 1.00 3.30 H new ATOM 0 HA2 GLY A 43 23.377 -3.762 27.173 1.00 20.41 H new ATOM 0 HA3 GLY A 43 22.269 -2.594 27.865 1.00 20.41 H new ATOM 617 N THR A 44 23.652 -1.149 26.207 1.00 1.14 N ATOM 618 CA THR A 44 24.337 -0.029 25.572 1.00 0.00 C ATOM 619 C THR A 44 23.529 1.246 25.804 1.00 54.32 C ATOM 620 O THR A 44 22.306 1.189 25.958 1.00 53.24 O ATOM 621 CB THR A 44 24.540 -0.275 24.049 1.00 74.01 C ATOM 622 OG1 THR A 44 25.324 0.775 23.464 1.00 60.01 O ATOM 623 CG2 THR A 44 23.210 -0.379 23.313 1.00 54.14 C ATOM 0 H THR A 44 22.769 -1.404 25.764 1.00 1.14 H new ATOM 0 HA THR A 44 25.326 0.075 26.018 1.00 0.00 H new ATOM 0 HB THR A 44 25.068 -1.223 23.947 1.00 74.01 H new ATOM 0 HG1 THR A 44 25.442 0.601 22.507 1.00 60.01 H new ATOM 0 HG21 THR A 44 23.394 -0.551 22.252 1.00 54.14 H new ATOM 0 HG22 THR A 44 22.633 -1.209 23.720 1.00 54.14 H new ATOM 0 HG23 THR A 44 22.651 0.548 23.439 1.00 54.14 H new ATOM 631 N ASN A 45 24.210 2.381 25.857 1.00 72.33 N ATOM 632 CA ASN A 45 23.561 3.657 26.139 1.00 33.43 C ATOM 633 C ASN A 45 22.603 4.032 24.999 1.00 24.30 C ATOM 634 O ASN A 45 22.933 3.847 23.828 1.00 63.01 O ATOM 635 CB ASN A 45 24.612 4.756 26.330 1.00 4.20 C ATOM 636 CG ASN A 45 25.643 4.446 27.402 1.00 5.33 C ATOM 637 OD1 ASN A 45 25.987 3.291 27.650 1.00 50.31 O ATOM 638 ND2 ASN A 45 26.156 5.488 28.038 1.00 41.45 N ATOM 0 H ASN A 45 25.217 2.446 25.708 1.00 72.33 H new ATOM 0 HA ASN A 45 22.986 3.559 27.060 1.00 33.43 H new ATOM 0 HB2 ASN A 45 25.126 4.921 25.383 1.00 4.20 H new ATOM 0 HB3 ASN A 45 24.107 5.687 26.585 1.00 4.20 H new ATOM 0 HD21 ASN A 45 26.862 5.347 28.761 1.00 41.45 H new ATOM 0 HD22 ASN A 45 25.846 6.431 27.805 1.00 41.45 H new ATOM 645 N PRO A 46 21.408 4.566 25.325 1.00 63.04 N ATOM 646 CA PRO A 46 20.365 4.874 24.327 1.00 61.02 C ATOM 647 C PRO A 46 20.831 5.877 23.266 1.00 4.44 C ATOM 648 O PRO A 46 20.818 5.581 22.063 1.00 23.02 O ATOM 649 CB PRO A 46 19.219 5.466 25.170 1.00 23.35 C ATOM 650 CG PRO A 46 19.478 4.988 26.559 1.00 42.23 C ATOM 651 CD PRO A 46 20.974 4.915 26.690 1.00 1.14 C ATOM 0 HA PRO A 46 20.080 3.988 23.760 1.00 61.02 H new ATOM 0 HB2 PRO A 46 19.214 6.555 25.121 1.00 23.35 H new ATOM 0 HB3 PRO A 46 18.248 5.127 24.810 1.00 23.35 H new ATOM 0 HG2 PRO A 46 19.053 5.671 27.294 1.00 42.23 H new ATOM 0 HG3 PRO A 46 19.022 4.013 26.729 1.00 42.23 H new ATOM 0 HD2 PRO A 46 21.397 5.864 27.018 1.00 1.14 H new ATOM 0 HD3 PRO A 46 21.280 4.162 27.416 1.00 1.14 H new ATOM 659 N GLU A 47 21.247 7.061 23.712 1.00 25.31 N ATOM 660 CA GLU A 47 21.675 8.117 22.795 1.00 53.11 C ATOM 661 C GLU A 47 22.953 7.699 22.063 1.00 42.42 C ATOM 662 O GLU A 47 23.176 8.078 20.911 1.00 0.52 O ATOM 663 CB GLU A 47 21.861 9.458 23.539 1.00 52.55 C ATOM 664 CG GLU A 47 23.039 9.513 24.515 1.00 35.10 C ATOM 665 CD GLU A 47 23.026 8.396 25.549 1.00 32.04 C ATOM 666 OE1 GLU A 47 22.060 8.314 26.338 1.00 53.13 O ATOM 667 OE2 GLU A 47 23.972 7.588 25.560 1.00 62.13 O1- ATOM 0 H GLU A 47 21.297 7.313 24.699 1.00 25.31 H new ATOM 0 HA GLU A 47 20.893 8.267 22.051 1.00 53.11 H new ATOM 0 HB2 GLU A 47 21.987 10.249 22.800 1.00 52.55 H new ATOM 0 HB3 GLU A 47 20.946 9.678 24.089 1.00 52.55 H new ATOM 0 HG2 GLU A 47 23.970 9.464 23.951 1.00 35.10 H new ATOM 0 HG3 GLU A 47 23.029 10.474 25.030 1.00 35.10 H new ATOM 674 N GLN A 48 23.777 6.903 22.742 1.00 41.14 N ATOM 675 CA GLN A 48 24.975 6.319 22.141 1.00 71.11 C ATOM 676 C GLN A 48 24.592 5.385 20.997 1.00 34.04 C ATOM 677 O GLN A 48 25.196 5.411 19.922 1.00 32.22 O ATOM 678 CB GLN A 48 25.760 5.541 23.203 1.00 12.45 C ATOM 679 CG GLN A 48 27.009 4.837 22.683 1.00 72.35 C ATOM 680 CD GLN A 48 27.650 3.940 23.732 1.00 3.55 C ATOM 681 OE1 GLN A 48 28.572 4.489 24.506 1.00 43.42 O flip ATOM 682 NE2 GLN A 48 27.323 2.758 23.843 1.00 72.04 N flip ATOM 0 H GLN A 48 23.635 6.646 23.719 1.00 41.14 H new ATOM 0 HA GLN A 48 25.597 7.122 21.746 1.00 71.11 H new ATOM 0 HB2 GLN A 48 26.051 6.229 23.997 1.00 12.45 H new ATOM 0 HB3 GLN A 48 25.100 4.798 23.651 1.00 12.45 H new ATOM 0 HG2 GLN A 48 26.749 4.240 21.809 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.733 5.583 22.355 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.608 2.367 23.229 1.00 72.04 H new ATOM 0 HE22 GLN A 48 27.767 2.170 24.548 1.00 72.04 H new ATOM 691 N LEU A 49 23.576 4.564 21.249 1.00 51.33 N ATOM 692 CA LEU A 49 23.084 3.594 20.278 1.00 61.13 C ATOM 693 C LEU A 49 22.582 4.320 19.029 1.00 21.55 C ATOM 694 O LEU A 49 22.967 3.986 17.905 1.00 71.11 O ATOM 695 CB LEU A 49 21.969 2.743 20.927 1.00 4.20 C ATOM 696 CG LEU A 49 21.454 1.524 20.125 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.499 1.947 19.007 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.622 0.708 19.566 1.00 52.41 C ATOM 0 H LEU A 49 23.070 4.554 22.135 1.00 51.33 H new ATOM 0 HA LEU A 49 23.890 2.927 19.973 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.334 2.385 21.889 1.00 4.20 H new ATOM 0 HB3 LEU A 49 21.121 3.396 21.131 1.00 4.20 H new ATOM 0 HG LEU A 49 20.892 0.892 20.813 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.158 1.064 18.466 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.640 2.462 19.437 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.017 2.616 18.320 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.236 -0.144 19.006 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.221 1.335 18.905 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.242 0.351 20.388 1.00 52.41 H new ATOM 710 N PHE A 50 21.732 5.325 19.240 1.00 3.42 N ATOM 711 CA PHE A 50 21.201 6.129 18.141 1.00 25.51 C ATOM 712 C PHE A 50 22.339 6.802 17.369 1.00 64.45 C ATOM 713 O PHE A 50 22.389 6.731 16.142 1.00 15.22 O ATOM 714 CB PHE A 50 20.213 7.177 18.676 1.00 52.14 C ATOM 715 CG PHE A 50 19.778 8.203 17.652 1.00 40.34 C ATOM 716 CD1 PHE A 50 19.079 7.829 16.511 1.00 40.14 C ATOM 717 CD2 PHE A 50 20.058 9.547 17.842 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.676 8.771 15.585 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.659 10.490 16.920 1.00 34.34 C ATOM 720 CZ PHE A 50 18.968 10.104 15.789 1.00 61.21 C ATOM 0 H PHE A 50 21.397 5.601 20.163 1.00 3.42 H new ATOM 0 HA PHE A 50 20.667 5.471 17.455 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.330 6.665 19.058 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.671 7.694 19.519 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.848 6.787 16.346 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.596 9.859 18.725 1.00 31.01 H new ATOM 0 HE1 PHE A 50 18.133 8.465 14.703 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.887 11.533 17.082 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.657 10.843 15.066 1.00 61.21 H new ATOM 730 N ALA A 51 23.242 7.450 18.098 1.00 33.43 N ATOM 731 CA ALA A 51 24.409 8.103 17.500 1.00 33.33 C ATOM 732 C ALA A 51 25.206 7.144 16.616 1.00 4.13 C ATOM 733 O ALA A 51 25.471 7.438 15.451 1.00 52.03 O ATOM 734 CB ALA A 51 25.307 8.668 18.588 1.00 51.41 C ATOM 0 H ALA A 51 23.190 7.539 19.113 1.00 33.43 H new ATOM 0 HA ALA A 51 24.044 8.914 16.869 1.00 33.33 H new ATOM 0 HB1 ALA A 51 26.171 9.151 18.132 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.751 9.399 19.176 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.644 7.860 19.238 1.00 51.41 H new ATOM 740 N ALA A 52 25.576 5.998 17.178 1.00 32.43 N ATOM 741 CA ALA A 52 26.370 5.001 16.464 1.00 41.10 C ATOM 742 C ALA A 52 25.645 4.521 15.208 1.00 30.53 C ATOM 743 O ALA A 52 26.239 4.435 14.129 1.00 13.40 O ATOM 744 CB ALA A 52 26.691 3.827 17.384 1.00 51.43 C ATOM 0 H ALA A 52 25.337 5.734 18.134 1.00 32.43 H new ATOM 0 HA ALA A 52 27.305 5.466 16.152 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.283 3.090 16.841 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.256 4.183 18.245 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.763 3.367 17.724 1.00 51.43 H new ATOM 750 N GLY A 53 24.354 4.224 15.358 1.00 32.23 N ATOM 751 CA GLY A 53 23.558 3.748 14.239 1.00 45.35 C ATOM 752 C GLY A 53 23.392 4.801 13.161 1.00 24.44 C ATOM 753 O GLY A 53 23.464 4.496 11.972 1.00 23.31 O ATOM 0 H GLY A 53 23.845 4.305 16.238 1.00 32.23 H new ATOM 0 HA2 GLY A 53 24.030 2.864 13.810 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.576 3.442 14.599 1.00 45.35 H new ATOM 757 N TYR A 54 23.180 6.042 13.585 1.00 20.42 N ATOM 758 CA TYR A 54 23.009 7.165 12.666 1.00 1.52 C ATOM 759 C TYR A 54 24.333 7.481 11.970 1.00 10.14 C ATOM 760 O TYR A 54 24.356 7.773 10.780 1.00 3.35 O ATOM 761 CB TYR A 54 22.476 8.389 13.435 1.00 4.31 C ATOM 762 CG TYR A 54 22.262 9.653 12.605 1.00 71.40 C ATOM 763 CD1 TYR A 54 22.077 9.608 11.223 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.239 10.898 13.223 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.881 10.766 10.490 1.00 65.13 C ATOM 766 CE2 TYR A 54 22.042 12.055 12.497 1.00 14.31 C ATOM 767 CZ TYR A 54 21.863 11.986 11.133 1.00 61.32 C ATOM 768 OH TYR A 54 21.671 13.141 10.408 1.00 14.13 O ATOM 0 H TYR A 54 23.122 6.299 14.570 1.00 20.42 H new ATOM 0 HA TYR A 54 22.282 6.900 11.898 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.528 8.118 13.900 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.173 8.620 14.241 1.00 4.31 H new ATOM 0 HD1 TYR A 54 22.087 8.654 10.717 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.378 10.961 14.292 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.743 10.714 9.420 1.00 65.13 H new ATOM 0 HE2 TYR A 54 22.028 13.012 12.997 1.00 14.31 H new ATOM 0 HH TYR A 54 20.766 13.145 10.032 1.00 14.13 H new ATOM 778 N SER A 55 25.429 7.395 12.715 1.00 11.10 N ATOM 779 CA SER A 55 26.757 7.648 12.163 1.00 22.53 C ATOM 780 C SER A 55 27.078 6.610 11.087 1.00 50.31 C ATOM 781 O SER A 55 27.506 6.951 9.980 1.00 23.31 O ATOM 782 CB SER A 55 27.812 7.616 13.278 1.00 0.44 C ATOM 783 OG SER A 55 29.093 7.963 12.787 1.00 35.10 O ATOM 0 H SER A 55 25.425 7.151 13.705 1.00 11.10 H new ATOM 0 HA SER A 55 26.771 8.639 11.708 1.00 22.53 H new ATOM 0 HB2 SER A 55 27.526 8.306 14.072 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.847 6.620 13.719 1.00 0.44 H new ATOM 0 HG SER A 55 29.774 7.719 13.448 1.00 35.10 H new ATOM 789 N ALA A 56 26.838 5.342 11.414 1.00 25.24 N ATOM 790 CA ALA A 56 27.061 4.249 10.479 1.00 63.14 C ATOM 791 C ALA A 56 26.124 4.372 9.278 1.00 34.41 C ATOM 792 O ALA A 56 26.539 4.214 8.131 1.00 72.41 O ATOM 793 CB ALA A 56 26.864 2.913 11.182 1.00 2.41 C ATOM 0 H ALA A 56 26.487 5.048 12.326 1.00 25.24 H new ATOM 0 HA ALA A 56 28.087 4.302 10.115 1.00 63.14 H new ATOM 0 HB1 ALA A 56 27.033 2.101 10.475 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.571 2.828 12.007 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.847 2.852 11.568 1.00 2.41 H new ATOM 799 N CYS A 57 24.858 4.666 9.557 1.00 43.11 N ATOM 800 CA CYS A 57 23.862 4.872 8.510 1.00 65.50 C ATOM 801 C CYS A 57 24.278 6.034 7.616 1.00 1.30 C ATOM 802 O CYS A 57 24.087 6.000 6.406 1.00 31.43 O ATOM 803 CB CYS A 57 22.485 5.144 9.131 1.00 74.40 C ATOM 804 SG CYS A 57 21.140 5.311 7.933 1.00 3.24 S ATOM 0 H CYS A 57 24.496 4.767 10.505 1.00 43.11 H new ATOM 0 HA CYS A 57 23.796 3.968 7.904 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.244 4.333 9.818 1.00 74.40 H new ATOM 0 HB3 CYS A 57 22.542 6.057 9.724 1.00 74.40 H new ATOM 0 HG CYS A 57 20.157 5.968 8.473 1.00 3.24 H new ATOM 810 N PHE A 58 24.875 7.048 8.235 1.00 12.51 N ATOM 811 CA PHE A 58 25.278 8.263 7.539 1.00 55.51 C ATOM 812 C PHE A 58 26.327 7.953 6.472 1.00 60.31 C ATOM 813 O PHE A 58 26.187 8.356 5.316 1.00 54.45 O ATOM 814 CB PHE A 58 25.828 9.285 8.548 1.00 64.12 C ATOM 815 CG PHE A 58 25.921 10.693 8.012 1.00 32.51 C ATOM 816 CD1 PHE A 58 27.110 11.185 7.489 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.813 11.527 8.043 1.00 40.52 C ATOM 818 CE1 PHE A 58 27.188 12.477 7.006 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.885 12.819 7.561 1.00 51.42 C ATOM 820 CZ PHE A 58 26.075 13.296 7.043 1.00 5.31 C ATOM 0 H PHE A 58 25.092 7.050 9.232 1.00 12.51 H new ATOM 0 HA PHE A 58 24.404 8.687 7.043 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.190 9.286 9.432 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.819 8.964 8.870 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.983 10.550 7.460 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.882 11.161 8.449 1.00 40.52 H new ATOM 0 HE1 PHE A 58 28.118 12.847 6.600 1.00 60.42 H new ATOM 0 HE2 PHE A 58 24.013 13.456 7.589 1.00 51.42 H new ATOM 0 HZ PHE A 58 26.135 14.307 6.668 1.00 5.31 H new ATOM 830 N LEU A 59 27.372 7.224 6.861 1.00 64.51 N ATOM 831 CA LEU A 59 28.460 6.901 5.940 1.00 63.33 C ATOM 832 C LEU A 59 27.992 5.921 4.858 1.00 14.15 C ATOM 833 O LEU A 59 28.380 6.042 3.693 1.00 3.51 O ATOM 834 CB LEU A 59 29.693 6.368 6.706 1.00 74.12 C ATOM 835 CG LEU A 59 29.482 5.114 7.585 1.00 31.41 C ATOM 836 CD1 LEU A 59 29.598 3.826 6.770 1.00 61.22 C ATOM 837 CD2 LEU A 59 30.470 5.095 8.746 1.00 2.33 C ATOM 0 H LEU A 59 27.488 6.848 7.802 1.00 64.51 H new ATOM 0 HA LEU A 59 28.763 7.818 5.435 1.00 63.33 H new ATOM 0 HB2 LEU A 59 30.474 6.145 5.979 1.00 74.12 H new ATOM 0 HB3 LEU A 59 30.069 7.169 7.342 1.00 74.12 H new ATOM 0 HG LEU A 59 28.470 5.166 7.985 1.00 31.41 H new ATOM 0 HD11 LEU A 59 29.444 2.967 7.423 1.00 61.22 H new ATOM 0 HD12 LEU A 59 28.843 3.824 5.983 1.00 61.22 H new ATOM 0 HD13 LEU A 59 30.590 3.767 6.322 1.00 61.22 H new ATOM 0 HD21 LEU A 59 30.303 4.204 9.351 1.00 2.33 H new ATOM 0 HD22 LEU A 59 31.488 5.084 8.357 1.00 2.33 H new ATOM 0 HD23 LEU A 59 30.326 5.983 9.361 1.00 2.33 H new ATOM 849 N SER A 60 27.139 4.969 5.236 1.00 34.05 N ATOM 850 CA SER A 60 26.589 4.006 4.284 1.00 74.40 C ATOM 851 C SER A 60 25.635 4.700 3.308 1.00 42.34 C ATOM 852 O SER A 60 25.622 4.395 2.113 1.00 41.15 O ATOM 853 CB SER A 60 25.873 2.874 5.033 1.00 52.34 C ATOM 854 OG SER A 60 26.766 2.194 5.901 1.00 74.20 O ATOM 0 H SER A 60 26.814 4.845 6.195 1.00 34.05 H new ATOM 0 HA SER A 60 27.408 3.576 3.708 1.00 74.40 H new ATOM 0 HB2 SER A 60 25.042 3.282 5.608 1.00 52.34 H new ATOM 0 HB3 SER A 60 25.450 2.170 4.317 1.00 52.34 H new ATOM 0 HG SER A 60 26.854 2.696 6.738 1.00 74.20 H new ATOM 860 N ALA A 61 24.856 5.650 3.821 1.00 5.22 N ATOM 861 CA ALA A 61 23.929 6.418 2.994 1.00 61.10 C ATOM 862 C ALA A 61 24.703 7.303 2.027 1.00 23.52 C ATOM 863 O ALA A 61 24.355 7.414 0.853 1.00 64.15 O ATOM 864 CB ALA A 61 23.000 7.262 3.862 1.00 23.00 C ATOM 0 H ALA A 61 24.849 5.907 4.808 1.00 5.22 H new ATOM 0 HA ALA A 61 23.317 5.721 2.422 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.319 7.825 3.225 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.426 6.610 4.521 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.591 7.954 4.462 1.00 23.00 H new ATOM 870 N MET A 62 25.764 7.923 2.536 1.00 1.42 N ATOM 871 CA MET A 62 26.648 8.757 1.724 1.00 22.23 C ATOM 872 C MET A 62 27.288 7.913 0.618 1.00 52.25 C ATOM 873 O MET A 62 27.407 8.349 -0.531 1.00 52.11 O ATOM 874 CB MET A 62 27.728 9.391 2.619 1.00 12.31 C ATOM 875 CG MET A 62 28.650 10.394 1.924 1.00 13.45 C ATOM 876 SD MET A 62 27.853 11.969 1.525 1.00 13.34 S ATOM 877 CE MET A 62 27.044 11.607 -0.031 1.00 61.32 C ATOM 0 H MET A 62 26.035 7.863 3.517 1.00 1.42 H new ATOM 0 HA MET A 62 26.070 9.555 1.258 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.237 9.892 3.453 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.339 8.594 3.042 1.00 12.31 H new ATOM 0 HG2 MET A 62 29.511 10.586 2.565 1.00 13.45 H new ATOM 0 HG3 MET A 62 29.030 9.947 1.005 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.144 12.461 -0.701 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.507 10.732 -0.487 1.00 61.32 H new ATOM 0 HE3 MET A 62 25.987 11.407 0.146 1.00 61.32 H new ATOM 887 N LYS A 63 27.681 6.693 0.979 1.00 50.31 N ATOM 888 CA LYS A 63 28.260 5.744 0.031 1.00 32.21 C ATOM 889 C LYS A 63 27.226 5.383 -1.044 1.00 55.33 C ATOM 890 O LYS A 63 27.543 5.321 -2.236 1.00 31.21 O ATOM 891 CB LYS A 63 28.728 4.478 0.774 1.00 32.54 C ATOM 892 CG LYS A 63 29.610 3.534 -0.050 1.00 62.32 C ATOM 893 CD LYS A 63 31.033 4.073 -0.224 1.00 52.53 C ATOM 894 CE LYS A 63 31.938 3.060 -0.925 1.00 52.13 C ATOM 895 NZ LYS A 63 33.358 3.510 -0.982 1.00 51.23 N1+ ATOM 0 H LYS A 63 27.608 6.336 1.932 1.00 50.31 H new ATOM 0 HA LYS A 63 29.122 6.202 -0.453 1.00 32.21 H new ATOM 0 HB2 LYS A 63 29.278 4.780 1.665 1.00 32.54 H new ATOM 0 HB3 LYS A 63 27.850 3.928 1.113 1.00 32.54 H new ATOM 0 HG2 LYS A 63 29.650 2.560 0.437 1.00 62.32 H new ATOM 0 HG3 LYS A 63 29.159 3.382 -1.031 1.00 62.32 H new ATOM 0 HD2 LYS A 63 31.004 4.997 -0.802 1.00 52.53 H new ATOM 0 HD3 LYS A 63 31.451 4.320 0.752 1.00 52.53 H new ATOM 0 HE2 LYS A 63 31.883 2.105 -0.402 1.00 52.13 H new ATOM 0 HE3 LYS A 63 31.573 2.890 -1.938 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 33.853 3.002 -1.743 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 33.391 4.532 -1.170 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 33.822 3.310 -0.073 1.00 51.23 H new ATOM 909 N PHE A 64 25.983 5.162 -0.605 1.00 54.13 N ATOM 910 CA PHE A 64 24.871 4.857 -1.508 1.00 15.41 C ATOM 911 C PHE A 64 24.640 6.014 -2.482 1.00 43.31 C ATOM 912 O PHE A 64 24.547 5.812 -3.695 1.00 31.42 O ATOM 913 CB PHE A 64 23.592 4.572 -0.703 1.00 54.23 C ATOM 914 CG PHE A 64 22.378 4.294 -1.558 1.00 22.52 C ATOM 915 CD1 PHE A 64 22.257 3.096 -2.248 1.00 70.34 C ATOM 916 CD2 PHE A 64 21.357 5.231 -1.675 1.00 44.41 C ATOM 917 CE1 PHE A 64 21.148 2.841 -3.032 1.00 70.35 C ATOM 918 CE2 PHE A 64 20.250 4.975 -2.458 1.00 31.33 C ATOM 919 CZ PHE A 64 20.148 3.780 -3.138 1.00 62.32 C ATOM 0 H PHE A 64 25.721 5.189 0.380 1.00 54.13 H new ATOM 0 HA PHE A 64 25.126 3.967 -2.083 1.00 15.41 H new ATOM 0 HB2 PHE A 64 23.768 3.717 -0.051 1.00 54.23 H new ATOM 0 HB3 PHE A 64 23.382 5.426 -0.059 1.00 54.23 H new ATOM 0 HD1 PHE A 64 23.038 2.355 -2.171 1.00 70.34 H new ATOM 0 HD2 PHE A 64 21.431 6.170 -1.147 1.00 44.41 H new ATOM 0 HE1 PHE A 64 21.066 1.904 -3.562 1.00 70.35 H new ATOM 0 HE2 PHE A 64 19.463 5.711 -2.538 1.00 31.33 H new ATOM 0 HZ PHE A 64 19.283 3.581 -3.754 1.00 62.32 H new ATOM 929 N VAL A 65 24.563 7.227 -1.938 1.00 22.12 N ATOM 930 CA VAL A 65 24.396 8.433 -2.744 1.00 1.13 C ATOM 931 C VAL A 65 25.471 8.506 -3.821 1.00 2.04 C ATOM 932 O VAL A 65 25.175 8.719 -5.001 1.00 1.42 O ATOM 933 CB VAL A 65 24.455 9.715 -1.877 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.547 10.964 -2.752 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.244 9.793 -0.949 1.00 41.32 C ATOM 0 H VAL A 65 24.614 7.400 -0.934 1.00 22.12 H new ATOM 0 HA VAL A 65 23.412 8.376 -3.208 1.00 1.13 H new ATOM 0 HB VAL A 65 25.355 9.667 -1.264 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.587 11.850 -2.118 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.448 10.914 -3.364 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.672 11.020 -3.399 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.304 10.701 -0.348 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.331 9.811 -1.544 1.00 41.32 H new ATOM 0 HG23 VAL A 65 23.232 8.923 -0.292 1.00 41.32 H new ATOM 945 N ALA A 66 26.718 8.303 -3.411 1.00 10.53 N ATOM 946 CA ALA A 66 27.841 8.314 -4.339 1.00 34.24 C ATOM 947 C ALA A 66 27.592 7.345 -5.490 1.00 52.01 C ATOM 948 O ALA A 66 27.943 7.619 -6.640 1.00 55.45 O ATOM 949 CB ALA A 66 29.133 7.964 -3.611 1.00 2.15 C ATOM 0 H ALA A 66 26.976 8.129 -2.440 1.00 10.53 H new ATOM 0 HA ALA A 66 27.940 9.317 -4.753 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.963 7.976 -4.317 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.316 8.695 -2.823 1.00 2.15 H new ATOM 0 HB3 ALA A 66 29.045 6.970 -3.171 1.00 2.15 H new ATOM 955 N GLY A 67 26.927 6.238 -5.171 1.00 41.30 N ATOM 956 CA GLY A 67 26.672 5.201 -6.152 1.00 41.44 C ATOM 957 C GLY A 67 25.680 5.642 -7.209 1.00 65.01 C ATOM 958 O GLY A 67 25.774 5.238 -8.370 1.00 24.21 O ATOM 0 H GLY A 67 26.558 6.041 -4.241 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.609 4.919 -6.632 1.00 41.44 H new ATOM 0 HA3 GLY A 67 26.292 4.312 -5.648 1.00 41.44 H new ATOM 962 N GLN A 68 24.743 6.503 -6.818 1.00 2.22 N ATOM 963 CA GLN A 68 23.717 6.991 -7.734 1.00 3.22 C ATOM 964 C GLN A 68 24.114 8.363 -8.259 1.00 13.50 C ATOM 965 O GLN A 68 23.462 8.925 -9.137 1.00 73.33 O ATOM 966 CB GLN A 68 22.346 7.054 -7.043 1.00 70.02 C ATOM 967 CG GLN A 68 22.335 7.867 -5.754 1.00 23.14 C ATOM 968 CD GLN A 68 20.933 8.127 -5.236 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.396 7.365 -4.441 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.326 9.205 -5.704 1.00 55.13 N ATOM 0 H GLN A 68 24.674 6.877 -5.872 1.00 2.22 H new ATOM 0 HA GLN A 68 23.635 6.297 -8.570 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.621 7.482 -7.736 1.00 70.02 H new ATOM 0 HB3 GLN A 68 22.015 6.039 -6.822 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.907 7.339 -4.991 1.00 23.14 H new ATOM 0 HG3 GLN A 68 22.837 8.819 -5.926 1.00 23.14 H new ATOM 0 HE21 GLN A 68 20.807 9.815 -6.365 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.377 9.426 -5.404 1.00 55.13 H new ATOM 979 N ASN A 69 25.189 8.899 -7.689 1.00 45.10 N ATOM 980 CA ASN A 69 25.757 10.176 -8.119 1.00 61.12 C ATOM 981 C ASN A 69 26.977 9.947 -9.001 1.00 41.24 C ATOM 982 O ASN A 69 27.657 10.893 -9.400 1.00 42.44 O ATOM 983 CB ASN A 69 26.127 11.044 -6.905 1.00 43.31 C ATOM 984 CG ASN A 69 24.936 11.760 -6.285 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.047 12.897 -5.830 1.00 73.01 O ATOM 986 ND2 ASN A 69 23.796 11.092 -6.232 1.00 73.35 N ATOM 0 H ASN A 69 25.692 8.462 -6.917 1.00 45.10 H new ATOM 0 HA ASN A 69 25.003 10.706 -8.701 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.597 10.415 -6.149 1.00 43.31 H new ATOM 0 HB3 ASN A 69 26.867 11.784 -7.209 1.00 43.31 H new ATOM 0 HD21 ASN A 69 22.974 11.519 -5.804 1.00 73.35 H new ATOM 0 HD22 ASN A 69 23.738 10.150 -6.619 1.00 73.35 H new ATOM 993 N LYS A 70 27.245 8.673 -9.275 1.00 63.25 N ATOM 994 CA LYS A 70 28.246 8.262 -10.262 1.00 32.31 C ATOM 995 C LYS A 70 29.653 8.668 -9.822 1.00 12.34 C ATOM 996 O LYS A 70 30.567 8.789 -10.642 1.00 70.50 O ATOM 997 CB LYS A 70 27.917 8.857 -11.647 1.00 4.35 C ATOM 998 CG LYS A 70 26.434 8.789 -12.040 1.00 13.20 C ATOM 999 CD LYS A 70 25.774 7.472 -11.623 1.00 32.43 C ATOM 1000 CE LYS A 70 24.445 7.244 -12.341 1.00 4.32 C ATOM 1001 NZ LYS A 70 23.888 5.891 -12.068 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.774 7.892 -8.818 1.00 63.25 H new ATOM 0 HA LYS A 70 28.219 7.175 -10.337 1.00 32.31 H new ATOM 0 HB2 LYS A 70 28.236 9.899 -11.664 1.00 4.35 H new ATOM 0 HB3 LYS A 70 28.503 8.332 -12.401 1.00 4.35 H new ATOM 0 HG2 LYS A 70 25.901 9.620 -11.578 1.00 13.20 H new ATOM 0 HG3 LYS A 70 26.342 8.911 -13.119 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.449 6.644 -11.839 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.608 7.475 -10.546 1.00 32.43 H new ATOM 0 HE2 LYS A 70 23.728 8.002 -12.025 1.00 4.32 H new ATOM 0 HE3 LYS A 70 24.587 7.368 -13.415 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 22.986 5.778 -12.574 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 24.560 5.167 -12.392 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 23.727 5.781 -11.046 1.00 52.12 H new ATOM 1015 N GLN A 71 29.817 8.843 -8.517 1.00 41.25 N ATOM 1016 CA GLN A 71 31.091 9.250 -7.931 1.00 41.44 C ATOM 1017 C GLN A 71 31.591 8.186 -6.958 1.00 11.15 C ATOM 1018 O GLN A 71 30.842 7.287 -6.569 1.00 3.32 O ATOM 1019 CB GLN A 71 30.949 10.600 -7.216 1.00 65.11 C ATOM 1020 CG GLN A 71 29.739 10.669 -6.297 1.00 11.32 C ATOM 1021 CD GLN A 71 29.872 11.709 -5.202 1.00 14.24 C ATOM 1022 OE1 GLN A 71 29.577 12.887 -5.396 1.00 4.02 O ATOM 1023 NE2 GLN A 71 30.272 11.258 -4.028 1.00 60.02 N ATOM 0 H GLN A 71 29.072 8.707 -7.834 1.00 41.25 H new ATOM 0 HA GLN A 71 31.820 9.360 -8.734 1.00 41.44 H new ATOM 0 HB2 GLN A 71 31.850 10.792 -6.634 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.876 11.392 -7.961 1.00 65.11 H new ATOM 0 HG2 GLN A 71 28.853 10.890 -6.892 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.582 9.691 -5.842 1.00 11.32 H new ATOM 0 HE21 GLN A 71 30.506 10.272 -3.913 1.00 60.02 H new ATOM 0 HE22 GLN A 71 30.347 11.895 -3.235 1.00 60.02 H new ATOM 1032 N THR A 72 32.853 8.294 -6.560 1.00 0.13 N ATOM 1033 CA THR A 72 33.461 7.321 -5.661 1.00 33.54 C ATOM 1034 C THR A 72 33.989 7.985 -4.399 1.00 64.51 C ATOM 1035 O THR A 72 34.726 8.970 -4.469 1.00 2.32 O ATOM 1036 CB THR A 72 34.618 6.566 -6.342 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.503 7.495 -6.994 1.00 1.42 O ATOM 1038 CG2 THR A 72 34.096 5.555 -7.352 1.00 71.13 C ATOM 0 H THR A 72 33.477 9.048 -6.847 1.00 0.13 H new ATOM 0 HA THR A 72 32.675 6.613 -5.397 1.00 33.54 H new ATOM 0 HB THR A 72 35.167 6.027 -5.570 1.00 55.21 H new ATOM 0 HG1 THR A 72 35.677 8.254 -6.399 1.00 1.42 H new ATOM 0 HG21 THR A 72 34.936 5.038 -7.816 1.00 71.13 H new ATOM 0 HG22 THR A 72 33.459 4.830 -6.845 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.519 6.072 -8.119 1.00 71.13 H new ATOM 1046 N LEU A 73 33.603 7.442 -3.253 1.00 24.22 N ATOM 1047 CA LEU A 73 34.077 7.932 -1.962 1.00 2.33 C ATOM 1048 C LEU A 73 35.023 6.919 -1.319 1.00 44.11 C ATOM 1049 O LEU A 73 34.760 5.715 -1.357 1.00 52.40 O ATOM 1050 CB LEU A 73 32.883 8.227 -1.054 1.00 54.54 C ATOM 1051 CG LEU A 73 31.943 9.313 -1.590 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.695 9.418 -0.725 1.00 63.13 C ATOM 1053 CD2 LEU A 73 32.660 10.662 -1.672 1.00 44.41 C ATOM 0 H LEU A 73 32.957 6.655 -3.189 1.00 24.22 H new ATOM 0 HA LEU A 73 34.635 8.856 -2.112 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.314 7.308 -0.909 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.252 8.531 -0.074 1.00 54.54 H new ATOM 0 HG LEU A 73 31.638 9.030 -2.598 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.041 10.194 -1.122 1.00 63.13 H new ATOM 0 HD12 LEU A 73 30.169 8.463 -0.728 1.00 63.13 H new ATOM 0 HD13 LEU A 73 30.980 9.672 0.296 1.00 63.13 H new ATOM 0 HD21 LEU A 73 31.973 11.417 -2.055 1.00 44.41 H new ATOM 0 HD22 LEU A 73 33.002 10.953 -0.679 1.00 44.41 H new ATOM 0 HD23 LEU A 73 33.517 10.579 -2.341 1.00 44.41 H new ATOM 1065 N PRO A 74 36.133 7.400 -0.720 1.00 14.33 N ATOM 1066 CA PRO A 74 37.165 6.537 -0.116 1.00 71.54 C ATOM 1067 C PRO A 74 36.624 5.639 0.998 1.00 22.35 C ATOM 1068 O PRO A 74 35.771 6.054 1.783 1.00 71.04 O ATOM 1069 CB PRO A 74 38.177 7.542 0.464 1.00 0.31 C ATOM 1070 CG PRO A 74 37.957 8.793 -0.313 1.00 75.32 C ATOM 1071 CD PRO A 74 36.482 8.831 -0.595 1.00 21.31 C ATOM 0 HA PRO A 74 37.584 5.849 -0.851 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.009 7.703 1.529 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.200 7.182 0.353 1.00 0.31 H new ATOM 0 HG2 PRO A 74 38.272 9.669 0.255 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.534 8.788 -1.238 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.929 9.313 0.211 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.259 9.382 -1.508 1.00 21.31 H new ATOM 1079 N ALA A 75 37.124 4.408 1.061 1.00 74.43 N ATOM 1080 CA ALA A 75 36.785 3.486 2.146 1.00 72.21 C ATOM 1081 C ALA A 75 37.558 3.841 3.414 1.00 34.41 C ATOM 1082 O ALA A 75 37.294 3.318 4.496 1.00 42.34 O ATOM 1083 CB ALA A 75 37.070 2.047 1.730 1.00 2.05 C ATOM 0 H ALA A 75 37.769 4.023 0.371 1.00 74.43 H new ATOM 0 HA ALA A 75 35.720 3.580 2.358 1.00 72.21 H new ATOM 0 HB1 ALA A 75 36.813 1.374 2.548 1.00 2.05 H new ATOM 0 HB2 ALA A 75 36.473 1.797 0.853 1.00 2.05 H new ATOM 0 HB3 ALA A 75 38.128 1.940 1.492 1.00 2.05 H new ATOM 1089 N ASP A 76 38.502 4.753 3.259 1.00 35.21 N ATOM 1090 CA ASP A 76 39.397 5.168 4.337 1.00 24.42 C ATOM 1091 C ASP A 76 38.761 6.268 5.195 1.00 33.35 C ATOM 1092 O ASP A 76 39.438 6.948 5.965 1.00 61.01 O ATOM 1093 CB ASP A 76 40.704 5.657 3.702 1.00 72.44 C ATOM 1094 CG ASP A 76 41.807 5.936 4.713 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.228 7.108 4.841 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.272 4.982 5.372 1.00 42.23 O1- ATOM 0 H ASP A 76 38.674 5.233 2.376 1.00 35.21 H new ATOM 0 HA ASP A 76 39.593 4.325 5.000 1.00 24.42 H new ATOM 0 HB2 ASP A 76 41.055 4.909 2.992 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.504 6.566 3.135 1.00 72.44 H new ATOM 1101 N THR A 77 37.451 6.422 5.073 1.00 11.55 N ATOM 1102 CA THR A 77 36.731 7.477 5.771 1.00 12.43 C ATOM 1103 C THR A 77 36.137 6.974 7.089 1.00 50.31 C ATOM 1104 O THR A 77 35.991 5.765 7.304 1.00 30.02 O ATOM 1105 CB THR A 77 35.612 8.057 4.879 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.891 9.075 5.581 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.642 6.970 4.425 1.00 73.22 C ATOM 0 H THR A 77 36.861 5.825 4.493 1.00 11.55 H new ATOM 0 HA THR A 77 37.449 8.265 5.999 1.00 12.43 H new ATOM 0 HB THR A 77 36.086 8.488 3.997 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.523 9.661 6.047 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.867 7.412 3.799 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.183 6.215 3.854 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.182 6.505 5.297 1.00 73.22 H new ATOM 1115 N THR A 78 35.811 7.913 7.973 1.00 13.54 N ATOM 1116 CA THR A 78 35.227 7.605 9.270 1.00 2.03 C ATOM 1117 C THR A 78 34.333 8.759 9.723 1.00 41.21 C ATOM 1118 O THR A 78 34.587 9.918 9.390 1.00 33.42 O ATOM 1119 CB THR A 78 36.325 7.372 10.341 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.284 6.409 9.874 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.727 6.886 11.657 1.00 52.04 C ATOM 0 H THR A 78 35.946 8.910 7.807 1.00 13.54 H new ATOM 0 HA THR A 78 34.641 6.692 9.163 1.00 2.03 H new ATOM 0 HB THR A 78 36.818 8.328 10.515 1.00 65.01 H new ATOM 0 HG1 THR A 78 37.971 6.273 10.559 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.524 6.733 12.384 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.028 7.631 12.036 1.00 52.04 H new ATOM 0 HG23 THR A 78 35.201 5.946 11.492 1.00 52.04 H new ATOM 1129 N VAL A 79 33.297 8.436 10.481 1.00 13.33 N ATOM 1130 CA VAL A 79 32.403 9.434 11.054 1.00 51.35 C ATOM 1131 C VAL A 79 32.242 9.174 12.541 1.00 40.33 C ATOM 1132 O VAL A 79 31.825 8.089 12.954 1.00 15.54 O ATOM 1133 CB VAL A 79 31.011 9.441 10.376 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.072 10.434 11.064 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.150 9.770 8.897 1.00 4.51 C ATOM 0 H VAL A 79 33.051 7.475 10.717 1.00 13.33 H new ATOM 0 HA VAL A 79 32.853 10.412 10.884 1.00 51.35 H new ATOM 0 HB VAL A 79 30.576 8.446 10.474 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.101 10.420 10.569 1.00 32.33 H new ATOM 0 HG12 VAL A 79 29.950 10.154 12.110 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.495 11.437 11.004 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.165 9.772 8.431 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.607 10.753 8.784 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.778 9.021 8.415 1.00 4.51 H new ATOM 1145 N THR A 80 32.601 10.162 13.335 1.00 3.21 N ATOM 1146 CA THR A 80 32.558 10.042 14.781 1.00 52.54 C ATOM 1147 C THR A 80 31.376 10.822 15.355 1.00 43.34 C ATOM 1148 O THR A 80 31.310 12.048 15.240 1.00 4.30 O ATOM 1149 CB THR A 80 33.882 10.530 15.418 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.992 9.834 14.824 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.888 10.293 16.926 1.00 20.33 C ATOM 0 H THR A 80 32.930 11.068 13.000 1.00 3.21 H new ATOM 0 HA THR A 80 32.429 8.987 15.024 1.00 52.54 H new ATOM 0 HB THR A 80 33.971 11.601 15.235 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.828 10.146 15.228 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.830 10.645 17.346 1.00 20.33 H new ATOM 0 HG22 THR A 80 33.061 10.836 17.383 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.777 9.227 17.127 1.00 20.33 H new ATOM 1159 N ALA A 81 30.441 10.094 15.956 1.00 63.21 N ATOM 1160 CA ALA A 81 29.271 10.681 16.592 1.00 75.00 C ATOM 1161 C ALA A 81 29.462 10.697 18.105 1.00 14.40 C ATOM 1162 O ALA A 81 29.399 9.652 18.757 1.00 73.21 O ATOM 1163 CB ALA A 81 28.013 9.901 16.217 1.00 42.42 C ATOM 0 H ALA A 81 30.475 9.076 16.015 1.00 63.21 H new ATOM 0 HA ALA A 81 29.152 11.706 16.241 1.00 75.00 H new ATOM 0 HB1 ALA A 81 27.147 10.353 16.701 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.878 9.926 15.136 1.00 42.42 H new ATOM 0 HB3 ALA A 81 28.114 8.867 16.547 1.00 42.42 H new ATOM 1169 N GLU A 82 29.737 11.872 18.653 1.00 71.31 N ATOM 1170 CA GLU A 82 29.949 12.020 20.089 1.00 72.51 C ATOM 1171 C GLU A 82 28.727 12.667 20.735 1.00 53.13 C ATOM 1172 O GLU A 82 28.423 13.831 20.476 1.00 25.01 O ATOM 1173 CB GLU A 82 31.209 12.854 20.357 1.00 74.00 C ATOM 1174 CG GLU A 82 31.536 13.006 21.837 1.00 3.23 C ATOM 1175 CD GLU A 82 32.834 13.756 22.078 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.826 13.127 22.500 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.868 14.982 21.843 1.00 51.44 O1- ATOM 0 H GLU A 82 29.819 12.740 18.124 1.00 71.31 H new ATOM 0 HA GLU A 82 30.091 11.033 20.529 1.00 72.51 H new ATOM 0 HB2 GLU A 82 32.056 12.390 19.852 1.00 74.00 H new ATOM 0 HB3 GLU A 82 31.080 13.843 19.918 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.720 13.532 22.333 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.602 12.018 22.293 1.00 3.23 H new ATOM 1184 N VAL A 83 28.025 11.907 21.567 1.00 31.40 N ATOM 1185 CA VAL A 83 26.797 12.382 22.199 1.00 74.25 C ATOM 1186 C VAL A 83 27.018 12.736 23.662 1.00 12.15 C ATOM 1187 O VAL A 83 27.704 12.023 24.394 1.00 3.30 O ATOM 1188 CB VAL A 83 25.656 11.339 22.099 1.00 22.15 C ATOM 1189 CG1 VAL A 83 25.130 11.253 20.673 1.00 60.03 C ATOM 1190 CG2 VAL A 83 26.125 9.969 22.585 1.00 42.03 C ATOM 0 H VAL A 83 28.286 10.954 21.822 1.00 31.40 H new ATOM 0 HA VAL A 83 26.504 13.280 21.655 1.00 74.25 H new ATOM 0 HB VAL A 83 24.841 11.666 22.745 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.329 10.515 20.624 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.745 12.226 20.368 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.938 10.956 20.004 1.00 60.03 H new ATOM 0 HG21 VAL A 83 25.306 9.254 22.505 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.961 9.632 21.972 1.00 42.03 H new ATOM 0 HG23 VAL A 83 26.443 10.041 23.625 1.00 42.03 H new ATOM 1200 N GLY A 84 26.440 13.855 24.068 1.00 33.12 N ATOM 1201 CA GLY A 84 26.454 14.269 25.449 1.00 23.12 C ATOM 1202 C GLY A 84 25.081 14.705 25.911 1.00 64.22 C ATOM 1203 O GLY A 84 24.212 15.024 25.099 1.00 21.33 O ATOM 0 H GLY A 84 25.950 14.497 23.445 1.00 33.12 H new ATOM 0 HA2 GLY A 84 26.805 13.447 26.073 1.00 23.12 H new ATOM 0 HA3 GLY A 84 27.160 15.090 25.577 1.00 23.12 H new ATOM 1207 N ILE A 85 24.886 14.709 27.215 1.00 23.52 N ATOM 1208 CA ILE A 85 23.627 15.121 27.818 1.00 1.40 C ATOM 1209 C ILE A 85 23.913 15.857 29.119 1.00 61.15 C ATOM 1210 O ILE A 85 24.762 15.425 29.905 1.00 10.52 O ATOM 1211 CB ILE A 85 22.705 13.895 28.071 1.00 52.02 C ATOM 1212 CG1 ILE A 85 21.376 14.293 28.758 1.00 53.33 C ATOM 1213 CG2 ILE A 85 23.448 12.841 28.888 1.00 35.55 C ATOM 1214 CD1 ILE A 85 21.422 14.315 30.278 1.00 71.32 C ATOM 0 H ILE A 85 25.596 14.426 27.891 1.00 23.52 H new ATOM 0 HA ILE A 85 23.105 15.789 27.133 1.00 1.40 H new ATOM 0 HB ILE A 85 22.442 13.473 27.101 1.00 52.02 H new ATOM 0 HG12 ILE A 85 21.083 15.281 28.404 1.00 53.33 H new ATOM 0 HG13 ILE A 85 20.598 13.597 28.443 1.00 53.33 H new ATOM 0 HG21 ILE A 85 22.794 11.986 29.060 1.00 35.55 H new ATOM 0 HG22 ILE A 85 24.334 12.516 28.343 1.00 35.55 H new ATOM 0 HG23 ILE A 85 23.747 13.267 29.846 1.00 35.55 H new ATOM 0 HD11 ILE A 85 20.446 14.605 30.667 1.00 71.32 H new ATOM 0 HD12 ILE A 85 21.681 13.323 30.649 1.00 71.32 H new ATOM 0 HD13 ILE A 85 22.172 15.033 30.609 1.00 71.32 H new ATOM 1226 N GLY A 86 23.210 16.962 29.335 1.00 43.44 N ATOM 1227 CA GLY A 86 23.421 17.785 30.516 1.00 64.20 C ATOM 1228 C GLY A 86 22.170 18.555 30.886 1.00 43.21 C ATOM 1229 O GLY A 86 21.212 18.561 30.117 1.00 31.32 O ATOM 0 H GLY A 86 22.487 17.308 28.705 1.00 43.44 H new ATOM 0 HA2 GLY A 86 23.722 17.153 31.352 1.00 64.20 H new ATOM 0 HA3 GLY A 86 24.238 18.483 30.334 1.00 64.20 H new ATOM 1233 N PRO A 87 22.132 19.203 32.064 1.00 20.43 N ATOM 1234 CA PRO A 87 20.956 19.946 32.514 1.00 73.43 C ATOM 1235 C PRO A 87 20.796 21.257 31.743 1.00 33.24 C ATOM 1236 O PRO A 87 21.769 21.984 31.526 1.00 11.41 O ATOM 1237 CB PRO A 87 21.229 20.220 34.009 1.00 75.13 C ATOM 1238 CG PRO A 87 22.500 19.493 34.334 1.00 24.22 C ATOM 1239 CD PRO A 87 23.229 19.310 33.032 1.00 44.21 C ATOM 0 HA PRO A 87 20.032 19.391 32.349 1.00 73.43 H new ATOM 0 HB2 PRO A 87 21.331 21.289 34.198 1.00 75.13 H new ATOM 0 HB3 PRO A 87 20.406 19.864 34.628 1.00 75.13 H new ATOM 0 HG2 PRO A 87 23.104 20.063 35.040 1.00 24.22 H new ATOM 0 HG3 PRO A 87 22.289 18.530 34.799 1.00 24.22 H new ATOM 0 HD2 PRO A 87 23.883 20.153 32.812 1.00 44.21 H new ATOM 0 HD3 PRO A 87 23.853 18.416 33.039 1.00 44.21 H new ATOM 1247 N ASN A 88 19.573 21.542 31.316 1.00 50.13 N ATOM 1248 CA ASN A 88 19.276 22.775 30.598 1.00 62.23 C ATOM 1249 C ASN A 88 18.931 23.877 31.593 1.00 31.22 C ATOM 1250 O ASN A 88 18.364 23.598 32.652 1.00 11.01 O ATOM 1251 CB ASN A 88 18.104 22.566 29.630 1.00 63.43 C ATOM 1252 CG ASN A 88 17.915 23.742 28.682 1.00 21.32 C ATOM 1253 OD1 ASN A 88 17.213 24.701 28.997 1.00 63.22 O ATOM 1254 ND2 ASN A 88 18.534 23.671 27.513 1.00 22.41 N ATOM 0 H ASN A 88 18.767 20.933 31.455 1.00 50.13 H new ATOM 0 HA ASN A 88 20.155 23.065 30.023 1.00 62.23 H new ATOM 0 HB2 ASN A 88 18.273 21.659 29.050 1.00 63.43 H new ATOM 0 HB3 ASN A 88 17.188 22.413 30.201 1.00 63.43 H new ATOM 0 HD21 ASN A 88 18.437 24.429 26.838 1.00 22.41 H new ATOM 0 HD22 ASN A 88 19.108 22.858 27.288 1.00 22.41 H new ATOM 1261 N GLU A 89 19.245 25.120 31.241 1.00 43.32 N ATOM 1262 CA GLU A 89 19.005 26.269 32.120 1.00 2.23 C ATOM 1263 C GLU A 89 17.509 26.461 32.396 1.00 10.40 C ATOM 1264 O GLU A 89 17.126 27.208 33.298 1.00 74.31 O ATOM 1265 CB GLU A 89 19.614 27.534 31.502 1.00 13.04 C ATOM 1266 CG GLU A 89 19.011 27.931 30.158 1.00 64.14 C ATOM 1267 CD GLU A 89 19.866 28.944 29.412 1.00 35.31 C ATOM 1268 OE1 GLU A 89 20.535 28.556 28.426 1.00 70.11 O ATOM 1269 OE2 GLU A 89 19.895 30.125 29.817 1.00 74.23 O1- ATOM 0 H GLU A 89 19.670 25.363 30.346 1.00 43.32 H new ATOM 0 HA GLU A 89 19.488 26.075 33.078 1.00 2.23 H new ATOM 0 HB2 GLU A 89 19.490 28.361 32.201 1.00 13.04 H new ATOM 0 HB3 GLU A 89 20.686 27.382 31.375 1.00 13.04 H new ATOM 0 HG2 GLU A 89 18.888 27.041 29.542 1.00 64.14 H new ATOM 0 HG3 GLU A 89 18.017 28.348 30.318 1.00 64.14 H new ATOM 1276 N GLU A 90 16.674 25.780 31.613 1.00 62.24 N ATOM 1277 CA GLU A 90 15.225 25.777 31.825 1.00 33.11 C ATOM 1278 C GLU A 90 14.873 25.059 33.133 1.00 41.22 C ATOM 1279 O GLU A 90 13.833 25.316 33.741 1.00 23.51 O ATOM 1280 CB GLU A 90 14.523 25.083 30.648 1.00 62.35 C ATOM 1281 CG GLU A 90 13.027 24.870 30.854 1.00 2.12 C ATOM 1282 CD GLU A 90 12.388 24.062 29.736 1.00 32.41 C ATOM 1283 OE1 GLU A 90 11.663 24.649 28.905 1.00 34.55 O ATOM 1284 OE2 GLU A 90 12.614 22.837 29.678 1.00 15.02 O1- ATOM 0 H GLU A 90 16.979 25.218 30.818 1.00 62.24 H new ATOM 0 HA GLU A 90 14.884 26.810 31.890 1.00 33.11 H new ATOM 0 HB2 GLU A 90 14.674 25.678 29.747 1.00 62.35 H new ATOM 0 HB3 GLU A 90 14.996 24.117 30.475 1.00 62.35 H new ATOM 0 HG2 GLU A 90 12.865 24.360 31.803 1.00 2.12 H new ATOM 0 HG3 GLU A 90 12.533 25.839 30.924 1.00 2.12 H new ATOM 1291 N GLY A 91 15.763 24.173 33.564 1.00 4.53 N ATOM 1292 CA GLY A 91 15.513 23.357 34.742 1.00 50.31 C ATOM 1293 C GLY A 91 15.149 21.932 34.373 1.00 52.42 C ATOM 1294 O GLY A 91 14.334 21.292 35.041 1.00 50.31 O ATOM 0 H GLY A 91 16.663 24.003 33.115 1.00 4.53 H new ATOM 0 HA2 GLY A 91 16.399 23.353 35.376 1.00 50.31 H new ATOM 0 HA3 GLY A 91 14.705 23.799 35.326 1.00 50.31 H new ATOM 1298 N GLY A 92 15.763 21.441 33.300 1.00 31.10 N ATOM 1299 CA GLY A 92 15.505 20.093 32.821 1.00 44.24 C ATOM 1300 C GLY A 92 16.737 19.496 32.177 1.00 74.12 C ATOM 1301 O GLY A 92 17.854 19.767 32.614 1.00 42.22 O ATOM 0 H GLY A 92 16.444 21.961 32.747 1.00 31.10 H new ATOM 0 HA2 GLY A 92 15.185 19.464 33.652 1.00 44.24 H new ATOM 0 HA3 GLY A 92 14.687 20.111 32.101 1.00 44.24 H new ATOM 1305 N PHE A 93 16.548 18.700 31.131 1.00 65.13 N ATOM 1306 CA PHE A 93 17.670 18.088 30.417 1.00 72.25 C ATOM 1307 C PHE A 93 17.898 18.767 29.070 1.00 30.35 C ATOM 1308 O PHE A 93 17.039 19.502 28.577 1.00 35.35 O ATOM 1309 CB PHE A 93 17.435 16.586 30.203 1.00 70.53 C ATOM 1310 CG PHE A 93 17.432 15.775 31.475 1.00 33.33 C ATOM 1311 CD1 PHE A 93 16.376 14.923 31.770 1.00 41.34 C ATOM 1312 CD2 PHE A 93 18.490 15.862 32.373 1.00 64.21 C ATOM 1313 CE1 PHE A 93 16.374 14.173 32.928 1.00 2.11 C ATOM 1314 CE2 PHE A 93 18.491 15.113 33.535 1.00 3.04 C ATOM 1315 CZ PHE A 93 17.432 14.270 33.815 1.00 12.34 C ATOM 0 H PHE A 93 15.630 18.461 30.756 1.00 65.13 H new ATOM 0 HA PHE A 93 18.559 18.221 31.034 1.00 72.25 H new ATOM 0 HB2 PHE A 93 16.481 16.447 29.694 1.00 70.53 H new ATOM 0 HB3 PHE A 93 18.209 16.199 29.540 1.00 70.53 H new ATOM 0 HD1 PHE A 93 15.545 14.846 31.084 1.00 41.34 H new ATOM 0 HD2 PHE A 93 19.319 16.521 32.161 1.00 64.21 H new ATOM 0 HE1 PHE A 93 15.548 13.511 33.142 1.00 2.11 H new ATOM 0 HE2 PHE A 93 19.319 15.187 34.224 1.00 3.04 H new ATOM 0 HZ PHE A 93 17.430 13.688 34.725 1.00 12.34 H new ATOM 1325 N ALA A 94 19.065 18.511 28.490 1.00 73.43 N ATOM 1326 CA ALA A 94 19.431 19.031 27.180 1.00 60.33 C ATOM 1327 C ALA A 94 20.360 18.039 26.499 1.00 65.32 C ATOM 1328 O ALA A 94 21.317 17.556 27.112 1.00 32.10 O ATOM 1329 CB ALA A 94 20.102 20.396 27.306 1.00 64.21 C ATOM 0 H ALA A 94 19.788 17.933 28.919 1.00 73.43 H new ATOM 0 HA ALA A 94 18.531 19.161 26.579 1.00 60.33 H new ATOM 0 HB1 ALA A 94 20.366 20.764 26.315 1.00 64.21 H new ATOM 0 HB2 ALA A 94 19.416 21.096 27.782 1.00 64.21 H new ATOM 0 HB3 ALA A 94 21.004 20.304 27.911 1.00 64.21 H new ATOM 1335 N LEU A 95 20.060 17.719 25.247 1.00 31.23 N ATOM 1336 CA LEU A 95 20.841 16.745 24.495 1.00 75.45 C ATOM 1337 C LEU A 95 21.818 17.434 23.552 1.00 41.42 C ATOM 1338 O LEU A 95 21.535 18.507 23.013 1.00 2.34 O ATOM 1339 CB LEU A 95 19.916 15.788 23.718 1.00 51.22 C ATOM 1340 CG LEU A 95 19.429 14.553 24.502 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.594 13.606 24.793 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.737 14.962 25.803 1.00 71.23 C ATOM 0 H LEU A 95 19.279 18.121 24.729 1.00 31.23 H new ATOM 0 HA LEU A 95 21.421 16.159 25.208 1.00 75.45 H new ATOM 0 HB2 LEU A 95 19.045 16.348 23.379 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.442 15.446 22.826 1.00 51.22 H new ATOM 0 HG LEU A 95 18.701 14.030 23.882 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.230 12.741 25.347 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.037 13.275 23.854 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.346 14.126 25.386 1.00 64.34 H new ATOM 0 HD21 LEU A 95 18.404 14.070 26.334 1.00 71.23 H new ATOM 0 HD22 LEU A 95 19.436 15.517 26.428 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.876 15.591 25.575 1.00 71.23 H new ATOM 1354 N ASP A 96 22.956 16.786 23.370 1.00 51.32 N ATOM 1355 CA ASP A 96 24.053 17.286 22.556 1.00 15.24 C ATOM 1356 C ASP A 96 24.599 16.138 21.719 1.00 33.43 C ATOM 1357 O ASP A 96 24.792 15.041 22.234 1.00 1.11 O ATOM 1358 CB ASP A 96 25.148 17.836 23.487 1.00 62.10 C ATOM 1359 CG ASP A 96 26.423 18.253 22.767 1.00 42.14 C ATOM 1360 OD1 ASP A 96 27.417 17.493 22.807 1.00 0.44 O ATOM 1361 OD2 ASP A 96 26.441 19.349 22.179 1.00 11.32 O1- ATOM 0 H ASP A 96 23.148 15.878 23.793 1.00 51.32 H new ATOM 0 HA ASP A 96 23.713 18.083 21.895 1.00 15.24 H new ATOM 0 HB2 ASP A 96 24.752 18.695 24.029 1.00 62.10 H new ATOM 0 HB3 ASP A 96 25.394 17.077 24.229 1.00 62.10 H new ATOM 1366 N VAL A 97 24.790 16.350 20.424 1.00 3.45 N ATOM 1367 CA VAL A 97 25.415 15.327 19.588 1.00 33.41 C ATOM 1368 C VAL A 97 26.254 15.946 18.474 1.00 35.23 C ATOM 1369 O VAL A 97 25.766 16.723 17.662 1.00 5.33 O ATOM 1370 CB VAL A 97 24.363 14.336 19.010 1.00 12.11 C ATOM 1371 CG1 VAL A 97 23.074 15.056 18.648 1.00 31.40 C ATOM 1372 CG2 VAL A 97 24.919 13.569 17.806 1.00 41.42 C ATOM 0 H VAL A 97 24.527 17.205 19.933 1.00 3.45 H new ATOM 0 HA VAL A 97 26.087 14.758 20.231 1.00 33.41 H new ATOM 0 HB VAL A 97 24.135 13.608 19.789 1.00 12.11 H new ATOM 0 HG11 VAL A 97 22.357 14.339 18.247 1.00 31.40 H new ATOM 0 HG12 VAL A 97 22.657 15.526 19.539 1.00 31.40 H new ATOM 0 HG13 VAL A 97 23.282 15.820 17.898 1.00 31.40 H new ATOM 0 HG21 VAL A 97 24.159 12.886 17.427 1.00 41.42 H new ATOM 0 HG22 VAL A 97 25.197 14.274 17.022 1.00 41.42 H new ATOM 0 HG23 VAL A 97 25.798 13.001 18.111 1.00 41.42 H new ATOM 1382 N GLU A 98 27.530 15.591 18.465 1.00 23.12 N ATOM 1383 CA GLU A 98 28.491 16.092 17.491 1.00 44.32 C ATOM 1384 C GLU A 98 28.710 15.054 16.390 1.00 21.31 C ATOM 1385 O GLU A 98 29.067 13.910 16.681 1.00 34.12 O ATOM 1386 CB GLU A 98 29.821 16.398 18.206 1.00 13.10 C ATOM 1387 CG GLU A 98 30.905 16.978 17.303 1.00 35.31 C ATOM 1388 CD GLU A 98 32.248 17.126 18.009 1.00 11.53 C ATOM 1389 OE1 GLU A 98 32.350 17.952 18.943 1.00 51.52 O ATOM 1390 OE2 GLU A 98 33.212 16.418 17.633 1.00 21.24 O1- ATOM 0 H GLU A 98 27.932 14.941 19.140 1.00 23.12 H new ATOM 0 HA GLU A 98 28.107 17.004 17.034 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.629 17.099 19.019 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.195 15.480 18.658 1.00 13.10 H new ATOM 0 HG2 GLU A 98 31.027 16.335 16.431 1.00 35.31 H new ATOM 0 HG3 GLU A 98 30.583 17.953 16.937 1.00 35.31 H new ATOM 1397 N LEU A 99 28.474 15.442 15.135 1.00 4.53 N ATOM 1398 CA LEU A 99 28.744 14.564 13.999 1.00 32.31 C ATOM 1399 C LEU A 99 30.000 15.031 13.274 1.00 52.01 C ATOM 1400 O LEU A 99 29.985 16.040 12.565 1.00 21.43 O ATOM 1401 CB LEU A 99 27.553 14.534 13.030 1.00 42.25 C ATOM 1402 CG LEU A 99 26.269 13.882 13.574 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.174 13.884 12.511 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.544 12.460 14.065 1.00 23.33 C ATOM 0 H LEU A 99 28.098 16.356 14.882 1.00 4.53 H new ATOM 0 HA LEU A 99 28.899 13.552 14.374 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.322 15.557 12.734 1.00 42.25 H new ATOM 0 HB3 LEU A 99 27.855 14.002 12.128 1.00 42.25 H new ATOM 0 HG LEU A 99 25.923 14.471 14.424 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.274 13.419 12.914 1.00 73.33 H new ATOM 0 HD12 LEU A 99 24.952 14.910 12.219 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.512 13.324 11.639 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.621 12.021 14.444 1.00 23.33 H new ATOM 0 HD22 LEU A 99 26.920 11.856 13.239 1.00 23.33 H new ATOM 0 HD23 LEU A 99 27.287 12.488 14.862 1.00 23.33 H new ATOM 1416 N ARG A 100 31.070 14.276 13.456 1.00 15.15 N ATOM 1417 CA ARG A 100 32.382 14.607 12.919 1.00 11.05 C ATOM 1418 C ARG A 100 32.666 13.733 11.701 1.00 44.33 C ATOM 1419 O ARG A 100 32.901 12.531 11.839 1.00 60.34 O ATOM 1420 CB ARG A 100 33.423 14.368 14.025 1.00 62.13 C ATOM 1421 CG ARG A 100 34.709 15.170 13.887 1.00 11.51 C ATOM 1422 CD ARG A 100 35.583 14.985 15.122 1.00 61.51 C ATOM 1423 NE ARG A 100 36.673 15.959 15.195 1.00 42.53 N ATOM 1424 CZ ARG A 100 36.776 16.897 16.141 1.00 32.53 C ATOM 1425 NH1 ARG A 100 35.806 17.061 17.040 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 37.844 17.681 16.178 1.00 1.52 N ATOM 0 H ARG A 100 31.053 13.405 13.987 1.00 15.15 H new ATOM 0 HA ARG A 100 32.424 15.649 12.603 1.00 11.05 H new ATOM 0 HB2 ARG A 100 32.968 14.603 14.987 1.00 62.13 H new ATOM 0 HB3 ARG A 100 33.675 13.308 14.042 1.00 62.13 H new ATOM 0 HG2 ARG A 100 35.252 14.850 12.998 1.00 11.51 H new ATOM 0 HG3 ARG A 100 34.474 16.226 13.754 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.965 15.071 16.016 1.00 61.51 H new ATOM 0 HD3 ARG A 100 36.001 13.978 15.119 1.00 61.51 H new ATOM 0 HE ARG A 100 37.399 15.919 14.480 1.00 42.53 H new ATOM 0 HH11 ARG A 100 34.977 16.468 17.009 1.00 73.43 H new ATOM 0 HH12 ARG A 100 35.893 17.780 17.759 1.00 73.43 H new ATOM 0 HH21 ARG A 100 38.584 17.567 15.486 1.00 1.52 H new ATOM 0 HH22 ARG A 100 37.926 18.398 16.899 1.00 1.52 H new ATOM 1440 N VAL A 101 32.631 14.326 10.510 1.00 42.14 N ATOM 1441 CA VAL A 101 32.720 13.552 9.275 1.00 72.23 C ATOM 1442 C VAL A 101 34.119 13.653 8.678 1.00 42.25 C ATOM 1443 O VAL A 101 34.440 14.624 7.994 1.00 41.22 O ATOM 1444 CB VAL A 101 31.671 14.027 8.234 1.00 14.41 C ATOM 1445 CG1 VAL A 101 31.735 13.176 6.964 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.265 14.005 8.835 1.00 42.30 C ATOM 0 H VAL A 101 32.542 15.333 10.374 1.00 42.14 H new ATOM 0 HA VAL A 101 32.511 12.512 9.525 1.00 72.23 H new ATOM 0 HB VAL A 101 31.908 15.055 7.960 1.00 14.41 H new ATOM 0 HG11 VAL A 101 30.990 13.530 6.251 1.00 25.41 H new ATOM 0 HG12 VAL A 101 32.728 13.257 6.521 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.533 12.134 7.213 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.545 14.341 8.089 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.018 12.990 9.146 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.228 14.668 9.699 1.00 42.30 H new ATOM 1456 N ALA A 102 34.954 12.655 8.945 1.00 43.12 N ATOM 1457 CA ALA A 102 36.321 12.646 8.443 1.00 40.03 C ATOM 1458 C ALA A 102 36.389 11.920 7.104 1.00 12.52 C ATOM 1459 O ALA A 102 36.395 10.687 7.051 1.00 73.10 O ATOM 1460 CB ALA A 102 37.255 11.995 9.462 1.00 44.05 C ATOM 0 H ALA A 102 34.707 11.841 9.507 1.00 43.12 H new ATOM 0 HA ALA A 102 36.646 13.675 8.290 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.274 11.995 9.074 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.223 12.556 10.396 1.00 44.05 H new ATOM 0 HB3 ALA A 102 36.936 10.969 9.644 1.00 44.05 H new ATOM 1466 N LEU A 103 36.446 12.694 6.026 1.00 73.31 N ATOM 1467 CA LEU A 103 36.502 12.152 4.671 1.00 63.24 C ATOM 1468 C LEU A 103 37.824 12.538 4.007 1.00 11.33 C ATOM 1469 O LEU A 103 38.110 13.722 3.823 1.00 24.41 O ATOM 1470 CB LEU A 103 35.303 12.655 3.841 1.00 41.13 C ATOM 1471 CG LEU A 103 34.159 11.639 3.650 1.00 32.24 C ATOM 1472 CD1 LEU A 103 32.893 12.332 3.144 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.587 10.534 2.681 1.00 41.41 C ATOM 0 H LEU A 103 36.455 13.713 6.065 1.00 73.31 H new ATOM 0 HA LEU A 103 36.446 11.065 4.722 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.899 13.546 4.321 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.665 12.959 2.859 1.00 41.13 H new ATOM 0 HG LEU A 103 33.936 11.190 4.618 1.00 32.24 H new ATOM 0 HD11 LEU A 103 32.100 11.595 3.017 1.00 55.32 H new ATOM 0 HD12 LEU A 103 32.576 13.084 3.867 1.00 55.32 H new ATOM 0 HD13 LEU A 103 33.099 12.812 2.187 1.00 55.32 H new ATOM 0 HD21 LEU A 103 33.770 9.824 2.555 1.00 41.41 H new ATOM 0 HD22 LEU A 103 34.837 10.974 1.716 1.00 41.41 H new ATOM 0 HD23 LEU A 103 35.459 10.017 3.081 1.00 41.41 H new ATOM 1485 N PRO A 104 38.657 11.538 3.665 1.00 73.52 N ATOM 1486 CA PRO A 104 39.956 11.779 3.035 1.00 62.42 C ATOM 1487 C PRO A 104 39.825 12.181 1.569 1.00 45.15 C ATOM 1488 O PRO A 104 38.890 11.768 0.880 1.00 0.45 O ATOM 1489 CB PRO A 104 40.671 10.434 3.177 1.00 24.31 C ATOM 1490 CG PRO A 104 39.584 9.418 3.236 1.00 63.40 C ATOM 1491 CD PRO A 104 38.401 10.099 3.873 1.00 45.41 C ATOM 0 HA PRO A 104 40.493 12.607 3.499 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.336 10.251 2.333 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.284 10.407 4.078 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.334 9.058 2.238 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.894 8.551 3.819 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.465 9.790 3.408 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.325 9.857 4.933 1.00 45.41 H new ATOM 1499 N GLY A 105 40.770 12.990 1.109 1.00 54.45 N ATOM 1500 CA GLY A 105 40.765 13.460 -0.270 1.00 13.33 C ATOM 1501 C GLY A 105 39.627 14.428 -0.568 1.00 43.42 C ATOM 1502 O GLY A 105 39.325 14.698 -1.732 1.00 1.41 O ATOM 0 H GLY A 105 41.549 13.334 1.670 1.00 54.45 H new ATOM 0 HA2 GLY A 105 41.715 13.949 -0.484 1.00 13.33 H new ATOM 0 HA3 GLY A 105 40.690 12.603 -0.939 1.00 13.33 H new ATOM 1506 N LEU A 106 39.002 14.953 0.480 1.00 4.51 N ATOM 1507 CA LEU A 106 37.844 15.842 0.342 1.00 40.14 C ATOM 1508 C LEU A 106 38.112 17.199 0.999 1.00 43.11 C ATOM 1509 O LEU A 106 38.751 17.275 2.052 1.00 42.33 O ATOM 1510 CB LEU A 106 36.611 15.168 0.969 1.00 65.03 C ATOM 1511 CG LEU A 106 35.361 16.049 1.137 1.00 43.51 C ATOM 1512 CD1 LEU A 106 34.866 16.581 -0.200 1.00 44.14 C ATOM 1513 CD2 LEU A 106 34.251 15.275 1.843 1.00 41.21 C ATOM 0 H LEU A 106 39.278 14.778 1.446 1.00 4.51 H new ATOM 0 HA LEU A 106 37.658 16.022 -0.717 1.00 40.14 H new ATOM 0 HB2 LEU A 106 36.343 14.308 0.355 1.00 65.03 H new ATOM 0 HB3 LEU A 106 36.893 14.784 1.950 1.00 65.03 H new ATOM 0 HG LEU A 106 35.642 16.904 1.752 1.00 43.51 H new ATOM 0 HD11 LEU A 106 33.982 17.199 -0.041 1.00 44.14 H new ATOM 0 HD12 LEU A 106 35.649 17.180 -0.665 1.00 44.14 H new ATOM 0 HD13 LEU A 106 34.612 15.746 -0.853 1.00 44.14 H new ATOM 0 HD21 LEU A 106 33.375 15.914 1.953 1.00 41.21 H new ATOM 0 HD22 LEU A 106 33.988 14.397 1.253 1.00 41.21 H new ATOM 0 HD23 LEU A 106 34.596 14.960 2.828 1.00 41.21 H new ATOM 1525 N ASP A 107 37.624 18.268 0.362 1.00 72.42 N ATOM 1526 CA ASP A 107 37.777 19.630 0.881 1.00 14.02 C ATOM 1527 C ASP A 107 36.816 19.881 2.022 1.00 1.12 C ATOM 1528 O ASP A 107 35.829 19.171 2.182 1.00 10.24 O ATOM 1529 CB ASP A 107 37.471 20.679 -0.191 1.00 13.35 C ATOM 1530 CG ASP A 107 38.320 21.933 -0.053 1.00 12.43 C ATOM 1531 OD1 ASP A 107 38.073 22.720 0.886 1.00 14.01 O ATOM 1532 OD2 ASP A 107 39.224 22.141 -0.890 1.00 2.52 O1- ATOM 0 H ASP A 107 37.116 18.215 -0.521 1.00 72.42 H new ATOM 0 HA ASP A 107 38.812 19.716 1.212 1.00 14.02 H new ATOM 0 HB2 ASP A 107 37.635 20.242 -1.176 1.00 13.35 H new ATOM 0 HB3 ASP A 107 36.417 20.952 -0.134 1.00 13.35 H new ATOM 1537 N ALA A 108 37.085 20.938 2.762 1.00 41.30 N ATOM 1538 CA ALA A 108 36.171 21.435 3.769 1.00 54.32 C ATOM 1539 C ALA A 108 34.930 22.016 3.102 1.00 74.35 C ATOM 1540 O ALA A 108 33.800 21.734 3.501 1.00 33.14 O ATOM 1541 CB ALA A 108 36.867 22.500 4.594 1.00 73.33 C ATOM 0 H ALA A 108 37.947 21.478 2.681 1.00 41.30 H new ATOM 0 HA ALA A 108 35.866 20.616 4.421 1.00 54.32 H new ATOM 0 HB1 ALA A 108 36.182 22.877 5.354 1.00 73.33 H new ATOM 0 HB2 ALA A 108 37.744 22.070 5.077 1.00 73.33 H new ATOM 0 HB3 ALA A 108 37.175 23.319 3.945 1.00 73.33 H new ATOM 1547 N ALA A 109 35.162 22.815 2.058 1.00 23.13 N ATOM 1548 CA ALA A 109 34.088 23.525 1.375 1.00 64.13 C ATOM 1549 C ALA A 109 33.125 22.547 0.712 1.00 31.24 C ATOM 1550 O ALA A 109 31.904 22.717 0.766 1.00 41.21 O ATOM 1551 CB ALA A 109 34.665 24.491 0.345 1.00 33.23 C ATOM 0 H ALA A 109 36.090 22.984 1.669 1.00 23.13 H new ATOM 0 HA ALA A 109 33.530 24.097 2.116 1.00 64.13 H new ATOM 0 HB1 ALA A 109 33.852 25.015 -0.158 1.00 33.23 H new ATOM 0 HB2 ALA A 109 35.308 25.215 0.845 1.00 33.23 H new ATOM 0 HB3 ALA A 109 35.247 23.935 -0.389 1.00 33.23 H new ATOM 1557 N ALA A 110 33.687 21.519 0.087 1.00 73.25 N ATOM 1558 CA ALA A 110 32.892 20.484 -0.555 1.00 12.34 C ATOM 1559 C ALA A 110 32.240 19.596 0.501 1.00 44.05 C ATOM 1560 O ALA A 110 31.051 19.277 0.412 1.00 34.04 O ATOM 1561 CB ALA A 110 33.757 19.661 -1.501 1.00 53.00 C ATOM 0 H ALA A 110 34.695 21.382 0.012 1.00 73.25 H new ATOM 0 HA ALA A 110 32.104 20.955 -1.143 1.00 12.34 H new ATOM 0 HB1 ALA A 110 33.148 18.891 -1.974 1.00 53.00 H new ATOM 0 HB2 ALA A 110 34.178 20.311 -2.267 1.00 53.00 H new ATOM 0 HB3 ALA A 110 34.565 19.191 -0.940 1.00 53.00 H new ATOM 1567 N ALA A 111 33.021 19.222 1.513 1.00 5.14 N ATOM 1568 CA ALA A 111 32.520 18.376 2.597 1.00 43.54 C ATOM 1569 C ALA A 111 31.278 18.984 3.240 1.00 4.44 C ATOM 1570 O ALA A 111 30.321 18.271 3.541 1.00 54.13 O ATOM 1571 CB ALA A 111 33.602 18.146 3.645 1.00 13.31 C ATOM 0 H ALA A 111 34.001 19.490 1.606 1.00 5.14 H new ATOM 0 HA ALA A 111 32.243 17.413 2.167 1.00 43.54 H new ATOM 0 HB1 ALA A 111 33.209 17.515 4.442 1.00 13.31 H new ATOM 0 HB2 ALA A 111 34.458 17.655 3.182 1.00 13.31 H new ATOM 0 HB3 ALA A 111 33.914 19.104 4.062 1.00 13.31 H new ATOM 1577 N LYS A 112 31.288 20.303 3.433 1.00 1.14 N ATOM 1578 CA LYS A 112 30.138 20.998 4.007 1.00 13.13 C ATOM 1579 C LYS A 112 28.864 20.692 3.218 1.00 74.23 C ATOM 1580 O LYS A 112 27.843 20.317 3.797 1.00 4.50 O ATOM 1581 CB LYS A 112 30.365 22.514 4.057 1.00 13.05 C ATOM 1582 CG LYS A 112 31.386 22.951 5.099 1.00 32.13 C ATOM 1583 CD LYS A 112 31.469 24.474 5.228 1.00 10.41 C ATOM 1584 CE LYS A 112 30.206 25.091 5.840 1.00 22.11 C ATOM 1585 NZ LYS A 112 29.076 25.195 4.871 1.00 2.23 N1+ ATOM 0 H LYS A 112 32.076 20.908 3.201 1.00 1.14 H new ATOM 0 HA LYS A 112 30.019 20.634 5.027 1.00 13.13 H new ATOM 0 HB2 LYS A 112 30.694 22.855 3.075 1.00 13.05 H new ATOM 0 HB3 LYS A 112 29.415 23.007 4.264 1.00 13.05 H new ATOM 0 HG2 LYS A 112 31.123 22.521 6.065 1.00 32.13 H new ATOM 0 HG3 LYS A 112 32.366 22.557 4.831 1.00 32.13 H new ATOM 0 HD2 LYS A 112 32.330 24.735 5.844 1.00 10.41 H new ATOM 0 HD3 LYS A 112 31.639 24.908 4.243 1.00 10.41 H new ATOM 0 HE2 LYS A 112 29.891 24.489 6.692 1.00 22.11 H new ATOM 0 HE3 LYS A 112 30.442 26.084 6.221 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 28.689 26.160 4.892 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 29.419 24.980 3.913 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 28.331 24.517 5.132 1.00 2.23 H new ATOM 1599 N THR A 113 28.936 20.828 1.893 1.00 31.43 N ATOM 1600 CA THR A 113 27.763 20.638 1.048 1.00 60.21 C ATOM 1601 C THR A 113 27.364 19.162 1.018 1.00 74.22 C ATOM 1602 O THR A 113 26.176 18.832 0.972 1.00 73.22 O ATOM 1603 CB THR A 113 27.987 21.166 -0.400 1.00 31.33 C ATOM 1604 OG1 THR A 113 26.740 21.602 -0.964 1.00 10.35 O ATOM 1605 CG2 THR A 113 28.591 20.101 -1.313 1.00 32.43 C ATOM 0 H THR A 113 29.789 21.067 1.388 1.00 31.43 H new ATOM 0 HA THR A 113 26.953 21.222 1.484 1.00 60.21 H new ATOM 0 HB THR A 113 28.687 21.998 -0.331 1.00 31.33 H new ATOM 0 HG1 THR A 113 26.891 21.934 -1.874 1.00 10.35 H new ATOM 0 HG21 THR A 113 28.729 20.514 -2.312 1.00 32.43 H new ATOM 0 HG22 THR A 113 29.555 19.784 -0.915 1.00 32.43 H new ATOM 0 HG23 THR A 113 27.920 19.243 -1.365 1.00 32.43 H new ATOM 1613 N LEU A 114 28.364 18.277 1.062 1.00 23.12 N ATOM 1614 CA LEU A 114 28.108 16.840 1.054 1.00 20.51 C ATOM 1615 C LEU A 114 27.360 16.430 2.318 1.00 41.04 C ATOM 1616 O LEU A 114 26.327 15.768 2.248 1.00 13.34 O ATOM 1617 CB LEU A 114 29.415 16.044 0.919 1.00 61.01 C ATOM 1618 CG LEU A 114 30.234 16.333 -0.352 1.00 11.45 C ATOM 1619 CD1 LEU A 114 31.392 15.351 -0.482 1.00 1.51 C ATOM 1620 CD2 LEU A 114 29.346 16.297 -1.596 1.00 50.51 C ATOM 0 H LEU A 114 29.351 18.531 1.103 1.00 23.12 H new ATOM 0 HA LEU A 114 27.487 16.611 0.188 1.00 20.51 H new ATOM 0 HB2 LEU A 114 30.039 16.252 1.788 1.00 61.01 H new ATOM 0 HB3 LEU A 114 29.177 14.980 0.944 1.00 61.01 H new ATOM 0 HG LEU A 114 30.648 17.337 -0.266 1.00 11.45 H new ATOM 0 HD11 LEU A 114 31.958 15.573 -1.387 1.00 1.51 H new ATOM 0 HD12 LEU A 114 32.045 15.442 0.386 1.00 1.51 H new ATOM 0 HD13 LEU A 114 31.003 14.335 -0.538 1.00 1.51 H new ATOM 0 HD21 LEU A 114 29.949 16.504 -2.480 1.00 50.51 H new ATOM 0 HD22 LEU A 114 28.891 15.311 -1.690 1.00 50.51 H new ATOM 0 HD23 LEU A 114 28.563 17.050 -1.506 1.00 50.51 H new ATOM 1632 N VAL A 115 27.872 16.854 3.470 1.00 72.22 N ATOM 1633 CA VAL A 115 27.237 16.565 4.753 1.00 32.34 C ATOM 1634 C VAL A 115 25.862 17.228 4.832 1.00 1.13 C ATOM 1635 O VAL A 115 24.922 16.674 5.417 1.00 25.22 O ATOM 1636 CB VAL A 115 28.115 17.038 5.942 1.00 63.01 C ATOM 1637 CG1 VAL A 115 27.413 16.793 7.280 1.00 14.41 C ATOM 1638 CG2 VAL A 115 29.473 16.341 5.908 1.00 35.24 C ATOM 0 H VAL A 115 28.729 17.402 3.541 1.00 72.22 H new ATOM 0 HA VAL A 115 27.120 15.484 4.823 1.00 32.34 H new ATOM 0 HB VAL A 115 28.272 18.112 5.842 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.052 17.134 8.094 1.00 14.41 H new ATOM 0 HG12 VAL A 115 26.472 17.342 7.303 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.214 15.728 7.397 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.078 16.682 6.748 1.00 35.24 H new ATOM 0 HG22 VAL A 115 29.330 15.263 5.978 1.00 35.24 H new ATOM 0 HG23 VAL A 115 29.981 16.580 4.974 1.00 35.24 H new ATOM 1648 N ASP A 116 25.746 18.413 4.233 1.00 34.11 N ATOM 1649 CA ASP A 116 24.479 19.142 4.207 1.00 22.44 C ATOM 1650 C ASP A 116 23.405 18.294 3.537 1.00 4.20 C ATOM 1651 O ASP A 116 22.414 17.920 4.167 1.00 63.50 O ATOM 1652 CB ASP A 116 24.616 20.480 3.464 1.00 1.42 C ATOM 1653 CG ASP A 116 23.368 21.351 3.586 1.00 43.12 C ATOM 1654 OD1 ASP A 116 22.349 21.041 2.934 1.00 62.34 O ATOM 1655 OD2 ASP A 116 23.403 22.353 4.336 1.00 50.12 O1- ATOM 0 H ASP A 116 26.514 18.888 3.759 1.00 34.11 H new ATOM 0 HA ASP A 116 24.193 19.352 5.238 1.00 22.44 H new ATOM 0 HB2 ASP A 116 25.474 21.024 3.859 1.00 1.42 H new ATOM 0 HB3 ASP A 116 24.818 20.287 2.410 1.00 1.42 H new ATOM 1660 N ARG A 117 23.630 17.957 2.269 1.00 43.12 N ATOM 1661 CA ARG A 117 22.657 17.197 1.498 1.00 25.23 C ATOM 1662 C ARG A 117 22.481 15.799 2.083 1.00 51.42 C ATOM 1663 O ARG A 117 21.377 15.259 2.103 1.00 42.42 O ATOM 1664 CB ARG A 117 23.103 17.121 0.037 1.00 4.30 C ATOM 1665 CG ARG A 117 24.487 16.519 -0.143 1.00 3.24 C ATOM 1666 CD ARG A 117 24.997 16.680 -1.564 1.00 12.41 C ATOM 1667 NE ARG A 117 24.213 15.889 -2.520 1.00 15.40 N ATOM 1668 CZ ARG A 117 24.654 15.481 -3.710 1.00 54.12 C ATOM 1669 NH1 ARG A 117 25.870 15.809 -4.124 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 23.866 14.755 -4.489 1.00 65.24 N ATOM 0 H ARG A 117 24.478 18.199 1.757 1.00 43.12 H new ATOM 0 HA ARG A 117 21.693 17.704 1.546 1.00 25.23 H new ATOM 0 HB2 ARG A 117 22.381 16.528 -0.525 1.00 4.30 H new ATOM 0 HB3 ARG A 117 23.093 18.124 -0.390 1.00 4.30 H new ATOM 0 HG2 ARG A 117 25.182 16.996 0.548 1.00 3.24 H new ATOM 0 HG3 ARG A 117 24.458 15.460 0.114 1.00 3.24 H new ATOM 0 HD2 ARG A 117 24.959 17.732 -1.846 1.00 12.41 H new ATOM 0 HD3 ARG A 117 26.042 16.375 -1.611 1.00 12.41 H new ATOM 0 HE ARG A 117 23.262 15.633 -2.255 1.00 15.40 H new ATOM 0 HH11 ARG A 117 26.475 16.377 -3.531 1.00 44.31 H new ATOM 0 HH12 ARG A 117 26.201 15.493 -5.036 1.00 44.31 H new ATOM 0 HH21 ARG A 117 22.926 14.510 -4.177 1.00 65.24 H new ATOM 0 HH22 ARG A 117 24.199 14.441 -5.400 1.00 65.24 H new ATOM 1684 N ALA A 118 23.576 15.232 2.576 1.00 40.10 N ATOM 1685 CA ALA A 118 23.555 13.897 3.174 1.00 45.33 C ATOM 1686 C ALA A 118 22.554 13.822 4.328 1.00 63.41 C ATOM 1687 O ALA A 118 21.687 12.948 4.350 1.00 0.11 O ATOM 1688 CB ALA A 118 24.947 13.500 3.651 1.00 44.02 C ATOM 0 H ALA A 118 24.494 15.676 2.574 1.00 40.10 H new ATOM 0 HA ALA A 118 23.236 13.193 2.405 1.00 45.33 H new ATOM 0 HB1 ALA A 118 24.910 12.504 4.093 1.00 44.02 H new ATOM 0 HB2 ALA A 118 25.634 13.497 2.805 1.00 44.02 H new ATOM 0 HB3 ALA A 118 25.294 14.215 4.397 1.00 44.02 H new ATOM 1694 N HIS A 119 22.655 14.758 5.276 1.00 52.13 N ATOM 1695 CA HIS A 119 21.754 14.767 6.433 1.00 15.33 C ATOM 1696 C HIS A 119 20.387 15.334 6.047 1.00 0.40 C ATOM 1697 O HIS A 119 19.506 15.461 6.890 1.00 63.33 O ATOM 1698 CB HIS A 119 22.357 15.573 7.605 1.00 54.45 C ATOM 1699 CG HIS A 119 22.066 17.049 7.574 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.812 17.954 6.855 1.00 2.34 N ATOM 1701 CD2 HIS A 119 21.099 17.773 8.189 1.00 20.34 C ATOM 1702 CE1 HIS A 119 22.316 19.168 7.026 1.00 52.23 C ATOM 1703 NE2 HIS A 119 21.275 19.087 7.830 1.00 74.13 N ATOM 0 H HIS A 119 23.343 15.511 5.267 1.00 52.13 H new ATOM 0 HA HIS A 119 21.625 13.736 6.762 1.00 15.33 H new ATOM 0 HB2 HIS A 119 21.979 15.163 8.542 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.438 15.430 7.607 1.00 54.45 H new ATOM 0 HD1 HIS A 119 23.622 17.724 6.279 1.00 2.34 H new ATOM 0 HD2 HIS A 119 20.330 17.387 8.842 1.00 20.34 H new ATOM 0 HE1 HIS A 119 22.700 20.074 6.581 1.00 52.23 H new ATOM 1712 N HIS A 120 20.227 15.686 4.774 1.00 43.52 N ATOM 1713 CA HIS A 120 18.974 16.244 4.267 1.00 31.45 C ATOM 1714 C HIS A 120 18.167 15.179 3.524 1.00 61.14 C ATOM 1715 O HIS A 120 16.936 15.175 3.576 1.00 43.11 O ATOM 1716 CB HIS A 120 19.262 17.432 3.338 1.00 2.24 C ATOM 1717 CG HIS A 120 18.031 18.100 2.803 1.00 45.12 C ATOM 1718 ND1 HIS A 120 17.631 18.006 1.487 1.00 44.32 N ATOM 1719 CD2 HIS A 120 17.119 18.896 3.411 1.00 50.50 C ATOM 1720 CE1 HIS A 120 16.534 18.713 1.310 1.00 65.24 C ATOM 1721 NE2 HIS A 120 16.199 19.264 2.461 1.00 75.14 N ATOM 0 H HIS A 120 20.957 15.594 4.067 1.00 43.52 H new ATOM 0 HA HIS A 120 18.385 16.591 5.116 1.00 31.45 H new ATOM 0 HB2 HIS A 120 19.856 18.168 3.880 1.00 2.24 H new ATOM 0 HB3 HIS A 120 19.869 17.087 2.501 1.00 2.24 H new ATOM 0 HD2 HIS A 120 17.116 19.187 4.451 1.00 50.50 H new ATOM 0 HE1 HIS A 120 15.998 18.823 0.379 1.00 65.24 H new ATOM 0 HE2 HIS A 120 15.390 19.864 2.619 1.00 75.14 H new ATOM 1730 N VAL A 121 18.867 14.282 2.831 1.00 33.11 N ATOM 1731 CA VAL A 121 18.217 13.224 2.054 1.00 23.21 C ATOM 1732 C VAL A 121 17.838 12.042 2.947 1.00 3.02 C ATOM 1733 O VAL A 121 16.971 11.239 2.598 1.00 30.52 O ATOM 1734 CB VAL A 121 19.117 12.724 0.892 1.00 61.42 C ATOM 1735 CG1 VAL A 121 19.420 13.861 -0.085 1.00 74.54 C ATOM 1736 CG2 VAL A 121 20.410 12.103 1.427 1.00 44.31 C ATOM 0 H VAL A 121 19.886 14.266 2.791 1.00 33.11 H new ATOM 0 HA VAL A 121 17.313 13.659 1.627 1.00 23.21 H new ATOM 0 HB VAL A 121 18.573 11.949 0.353 1.00 61.42 H new ATOM 0 HG11 VAL A 121 20.052 13.489 -0.891 1.00 74.54 H new ATOM 0 HG12 VAL A 121 18.487 14.242 -0.501 1.00 74.54 H new ATOM 0 HG13 VAL A 121 19.937 14.664 0.440 1.00 74.54 H new ATOM 0 HG21 VAL A 121 21.022 11.761 0.592 1.00 44.31 H new ATOM 0 HG22 VAL A 121 20.962 12.848 2.000 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.168 11.257 2.070 1.00 44.31 H new ATOM 1746 N CYS A 122 18.494 11.942 4.100 1.00 31.44 N ATOM 1747 CA CYS A 122 18.206 10.884 5.060 1.00 53.14 C ATOM 1748 C CYS A 122 17.019 11.281 5.944 1.00 23.34 C ATOM 1749 O CYS A 122 16.844 12.460 6.254 1.00 24.32 O ATOM 1750 CB CYS A 122 19.442 10.602 5.926 1.00 50.43 C ATOM 1751 SG CYS A 122 20.881 10.028 4.991 1.00 72.12 S ATOM 0 H CYS A 122 19.231 12.584 4.392 1.00 31.44 H new ATOM 0 HA CYS A 122 17.948 9.977 4.514 1.00 53.14 H new ATOM 0 HB2 CYS A 122 19.711 11.511 6.465 1.00 50.43 H new ATOM 0 HB3 CYS A 122 19.185 9.852 6.674 1.00 50.43 H new ATOM 0 HG CYS A 122 21.529 11.052 4.521 1.00 72.12 H new ATOM 1757 N PRO A 123 16.183 10.301 6.359 1.00 50.40 N ATOM 1758 CA PRO A 123 15.018 10.559 7.225 1.00 60.03 C ATOM 1759 C PRO A 123 15.399 11.327 8.493 1.00 74.45 C ATOM 1760 O PRO A 123 14.607 12.108 9.030 1.00 30.15 O ATOM 1761 CB PRO A 123 14.512 9.150 7.574 1.00 24.23 C ATOM 1762 CG PRO A 123 14.976 8.293 6.444 1.00 34.14 C ATOM 1763 CD PRO A 123 16.295 8.872 6.000 1.00 45.03 C ATOM 0 HA PRO A 123 14.270 11.180 6.732 1.00 60.03 H new ATOM 0 HB2 PRO A 123 14.919 8.807 8.525 1.00 24.23 H new ATOM 0 HB3 PRO A 123 13.426 9.130 7.667 1.00 24.23 H new ATOM 0 HG2 PRO A 123 15.092 7.257 6.762 1.00 34.14 H new ATOM 0 HG3 PRO A 123 14.253 8.297 5.628 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.134 8.395 6.507 1.00 45.03 H new ATOM 0 HD3 PRO A 123 16.452 8.738 4.930 1.00 45.03 H new ATOM 1771 N TYR A 124 16.626 11.104 8.954 1.00 53.44 N ATOM 1772 CA TYR A 124 17.157 11.792 10.124 1.00 1.24 C ATOM 1773 C TYR A 124 17.663 13.170 9.686 1.00 42.34 C ATOM 1774 O TYR A 124 18.868 13.410 9.625 1.00 23.13 O ATOM 1775 CB TYR A 124 18.304 10.981 10.773 1.00 65.44 C ATOM 1776 CG TYR A 124 18.129 9.462 10.724 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.736 8.724 11.846 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.368 8.762 9.542 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.591 7.350 11.780 1.00 14.31 C ATOM 1780 CE2 TYR A 124 18.222 7.391 9.476 1.00 12.12 C ATOM 1781 CZ TYR A 124 17.834 6.690 10.595 1.00 5.42 C ATOM 1782 OH TYR A 124 17.687 5.322 10.529 1.00 60.35 O ATOM 0 H TYR A 124 17.277 10.444 8.529 1.00 53.44 H new ATOM 0 HA TYR A 124 16.369 11.900 10.870 1.00 1.24 H new ATOM 0 HB2 TYR A 124 19.239 11.240 10.276 1.00 65.44 H new ATOM 0 HB3 TYR A 124 18.401 11.287 11.815 1.00 65.44 H new ATOM 0 HD1 TYR A 124 17.543 9.235 12.778 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.674 9.304 8.659 1.00 13.25 H new ATOM 0 HE1 TYR A 124 17.288 6.795 12.656 1.00 14.31 H new ATOM 0 HE2 TYR A 124 18.412 6.870 8.549 1.00 12.12 H new ATOM 0 HH TYR A 124 17.895 5.014 9.622 1.00 60.35 H new ATOM 1792 N SER A 125 16.729 14.049 9.331 1.00 23.21 N ATOM 1793 CA SER A 125 17.065 15.367 8.788 1.00 62.44 C ATOM 1794 C SER A 125 16.538 16.493 9.683 1.00 2.13 C ATOM 1795 O SER A 125 17.271 17.046 10.503 1.00 5.11 O ATOM 1796 CB SER A 125 16.499 15.498 7.365 1.00 61.32 C ATOM 1797 OG SER A 125 16.698 16.803 6.839 1.00 44.54 O ATOM 0 H SER A 125 15.727 13.873 9.409 1.00 23.21 H new ATOM 0 HA SER A 125 18.151 15.459 8.754 1.00 62.44 H new ATOM 0 HB2 SER A 125 16.978 14.766 6.714 1.00 61.32 H new ATOM 0 HB3 SER A 125 15.434 15.268 7.374 1.00 61.32 H new ATOM 0 HG SER A 125 16.328 16.850 5.933 1.00 44.54 H new ATOM 1803 N ASN A 126 15.254 16.809 9.540 1.00 23.44 N ATOM 1804 CA ASN A 126 14.630 17.895 10.301 1.00 73.42 C ATOM 1805 C ASN A 126 14.729 17.607 11.794 1.00 24.25 C ATOM 1806 O ASN A 126 15.059 18.483 12.603 1.00 64.13 O ATOM 1807 CB ASN A 126 13.161 18.059 9.879 1.00 54.23 C ATOM 1808 CG ASN A 126 12.419 19.119 10.681 1.00 23.41 C ATOM 1809 OD1 ASN A 126 13.012 20.081 11.164 1.00 4.50 O ATOM 1810 ND2 ASN A 126 11.112 18.953 10.816 1.00 5.31 N ATOM 0 H ASN A 126 14.620 16.328 8.902 1.00 23.44 H new ATOM 0 HA ASN A 126 15.156 18.826 10.091 1.00 73.42 H new ATOM 0 HB2 ASN A 126 13.121 18.319 8.821 1.00 54.23 H new ATOM 0 HB3 ASN A 126 12.649 17.103 9.992 1.00 54.23 H new ATOM 0 HD21 ASN A 126 10.562 19.637 11.336 1.00 5.31 H new ATOM 0 HD22 ASN A 126 10.655 18.141 10.400 1.00 5.31 H new ATOM 1817 N ALA A 127 14.489 16.350 12.138 1.00 54.04 N ATOM 1818 CA ALA A 127 14.522 15.901 13.522 1.00 54.10 C ATOM 1819 C ALA A 127 15.938 15.933 14.094 1.00 52.15 C ATOM 1820 O ALA A 127 16.118 15.861 15.307 1.00 1.24 O ATOM 1821 CB ALA A 127 13.950 14.494 13.626 1.00 41.33 C ATOM 0 H ALA A 127 14.266 15.614 11.467 1.00 54.04 H new ATOM 0 HA ALA A 127 13.912 16.588 14.109 1.00 54.10 H new ATOM 0 HB1 ALA A 127 13.978 14.166 14.665 1.00 41.33 H new ATOM 0 HB2 ALA A 127 12.919 14.494 13.273 1.00 41.33 H new ATOM 0 HB3 ALA A 127 14.543 13.814 13.014 1.00 41.33 H new ATOM 1827 N THR A 128 16.937 16.082 13.226 1.00 1.20 N ATOM 1828 CA THR A 128 18.327 15.946 13.640 1.00 2.03 C ATOM 1829 C THR A 128 19.002 17.312 13.657 1.00 41.31 C ATOM 1830 O THR A 128 20.196 17.429 13.917 1.00 64.41 O ATOM 1831 CB THR A 128 19.102 14.962 12.711 1.00 53.22 C ATOM 1832 OG1 THR A 128 20.088 14.251 13.469 1.00 44.43 O ATOM 1833 CG2 THR A 128 19.789 15.680 11.548 1.00 73.21 C ATOM 0 H THR A 128 16.808 16.296 12.237 1.00 1.20 H new ATOM 0 HA THR A 128 18.344 15.530 14.647 1.00 2.03 H new ATOM 0 HB THR A 128 18.369 14.271 12.294 1.00 53.22 H new ATOM 0 HG1 THR A 128 20.452 13.519 12.928 1.00 44.43 H new ATOM 0 HG21 THR A 128 20.315 14.952 10.931 1.00 73.21 H new ATOM 0 HG22 THR A 128 19.041 16.194 10.945 1.00 73.21 H new ATOM 0 HG23 THR A 128 20.502 16.406 11.939 1.00 73.21 H new ATOM 1841 N ARG A 129 18.227 18.350 13.374 1.00 15.30 N ATOM 1842 CA ARG A 129 18.757 19.701 13.367 1.00 1.24 C ATOM 1843 C ARG A 129 17.904 20.624 14.233 1.00 21.22 C ATOM 1844 O ARG A 129 18.395 21.226 15.186 1.00 60.25 O ATOM 1845 CB ARG A 129 18.870 20.223 11.919 1.00 61.34 C ATOM 1846 CG ARG A 129 17.558 20.295 11.138 1.00 45.30 C ATOM 1847 CD ARG A 129 17.796 20.720 9.693 1.00 1.10 C ATOM 1848 NE ARG A 129 18.522 21.989 9.612 1.00 10.14 N ATOM 1849 CZ ARG A 129 19.340 22.335 8.615 1.00 72.04 C ATOM 1850 NH1 ARG A 129 19.479 21.554 7.545 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 19.995 23.486 8.677 1.00 55.55 N ATOM 0 H ARG A 129 17.235 18.281 13.148 1.00 15.30 H new ATOM 0 HA ARG A 129 19.758 19.687 13.798 1.00 1.24 H new ATOM 0 HB2 ARG A 129 19.312 21.219 11.944 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.562 19.581 11.374 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.067 19.322 11.157 1.00 45.30 H new ATOM 0 HG3 ARG A 129 16.883 21.002 11.621 1.00 45.30 H new ATOM 0 HD2 ARG A 129 18.360 19.945 9.174 1.00 1.10 H new ATOM 0 HD3 ARG A 129 16.839 20.815 9.180 1.00 1.10 H new ATOM 0 HE ARG A 129 18.394 22.657 10.372 1.00 10.14 H new ATOM 0 HH11 ARG A 129 18.957 20.680 7.480 1.00 12.15 H new ATOM 0 HH12 ARG A 129 20.107 21.830 6.790 1.00 12.15 H new ATOM 0 HH21 ARG A 129 19.872 24.100 9.482 1.00 55.55 H new ATOM 0 HH22 ARG A 129 20.622 23.758 7.919 1.00 55.55 H new ATOM 1865 N ASN A 130 16.632 20.743 13.890 1.00 53.23 N ATOM 1866 CA ASN A 130 15.721 21.634 14.596 1.00 71.44 C ATOM 1867 C ASN A 130 15.238 21.009 15.897 1.00 71.52 C ATOM 1868 O ASN A 130 15.017 21.705 16.888 1.00 41.25 O ATOM 1869 CB ASN A 130 14.553 22.001 13.680 1.00 51.21 C ATOM 1870 CG ASN A 130 15.027 22.786 12.467 1.00 65.44 C ATOM 1871 OD1 ASN A 130 15.915 23.637 12.567 1.00 64.05 O ATOM 1872 ND2 ASN A 130 14.484 22.473 11.309 1.00 32.23 N ATOM 0 H ASN A 130 16.202 20.230 13.120 1.00 53.23 H new ATOM 0 HA ASN A 130 16.253 22.547 14.863 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.046 21.093 13.353 1.00 51.21 H new ATOM 0 HB3 ASN A 130 13.824 22.591 14.235 1.00 51.21 H new ATOM 0 HD21 ASN A 130 14.796 22.939 10.457 1.00 32.23 H new ATOM 0 HD22 ASN A 130 13.752 21.764 11.264 1.00 32.23 H new ATOM 1879 N ASN A 131 15.071 19.687 15.888 1.00 23.53 N ATOM 1880 CA ASN A 131 14.537 18.971 17.048 1.00 43.51 C ATOM 1881 C ASN A 131 15.657 18.535 17.999 1.00 71.03 C ATOM 1882 O ASN A 131 15.496 18.588 19.220 1.00 72.12 O ATOM 1883 CB ASN A 131 13.714 17.760 16.584 1.00 43.33 C ATOM 1884 CG ASN A 131 13.015 17.037 17.727 1.00 4.41 C ATOM 1885 OD1 ASN A 131 13.609 15.954 18.204 1.00 52.34 O flip ATOM 1886 ND2 ASN A 131 11.931 17.440 18.161 1.00 53.22 N flip ATOM 0 H ASN A 131 15.297 19.090 15.092 1.00 23.53 H new ATOM 0 HA ASN A 131 13.886 19.650 17.599 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.968 18.091 15.862 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.370 17.060 16.067 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.504 18.279 17.768 1.00 53.22 H new ATOM 0 HD22 ASN A 131 11.463 16.934 18.913 1.00 53.22 H new ATOM 1893 N VAL A 132 16.795 18.119 17.440 1.00 22.24 N ATOM 1894 CA VAL A 132 17.936 17.661 18.241 1.00 51.15 C ATOM 1895 C VAL A 132 19.172 18.511 17.943 1.00 30.12 C ATOM 1896 O VAL A 132 19.438 18.844 16.787 1.00 33.10 O ATOM 1897 CB VAL A 132 18.257 16.163 17.978 1.00 54.43 C ATOM 1898 CG1 VAL A 132 19.470 15.711 18.792 1.00 31.31 C ATOM 1899 CG2 VAL A 132 17.041 15.286 18.286 1.00 70.22 C ATOM 0 H VAL A 132 16.953 18.089 16.433 1.00 22.24 H new ATOM 0 HA VAL A 132 17.663 17.771 19.290 1.00 51.15 H new ATOM 0 HB VAL A 132 18.500 16.052 16.921 1.00 54.43 H new ATOM 0 HG11 VAL A 132 19.673 14.659 18.589 1.00 31.31 H new ATOM 0 HG12 VAL A 132 20.338 16.308 18.513 1.00 31.31 H new ATOM 0 HG13 VAL A 132 19.265 15.843 19.854 1.00 31.31 H new ATOM 0 HG21 VAL A 132 17.288 14.242 18.095 1.00 70.22 H new ATOM 0 HG22 VAL A 132 16.761 15.407 19.332 1.00 70.22 H new ATOM 0 HG23 VAL A 132 16.207 15.584 17.650 1.00 70.22 H new ATOM 1909 N ALA A 133 19.914 18.862 18.993 1.00 44.32 N ATOM 1910 CA ALA A 133 21.099 19.704 18.863 1.00 45.42 C ATOM 1911 C ALA A 133 22.294 18.905 18.358 1.00 30.31 C ATOM 1912 O ALA A 133 23.027 18.277 19.136 1.00 14.22 O ATOM 1913 CB ALA A 133 21.423 20.381 20.192 1.00 22.23 C ATOM 0 H ALA A 133 19.711 18.573 19.950 1.00 44.32 H new ATOM 0 HA ALA A 133 20.882 20.476 18.125 1.00 45.42 H new ATOM 0 HB1 ALA A 133 22.309 21.005 20.076 1.00 22.23 H new ATOM 0 HB2 ALA A 133 20.581 21.001 20.499 1.00 22.23 H new ATOM 0 HB3 ALA A 133 21.611 19.622 20.951 1.00 22.23 H new ATOM 1919 N VAL A 134 22.466 18.915 17.043 1.00 55.21 N ATOM 1920 CA VAL A 134 23.592 18.262 16.408 1.00 14.23 C ATOM 1921 C VAL A 134 24.601 19.289 15.911 1.00 75.02 C ATOM 1922 O VAL A 134 24.244 20.251 15.232 1.00 44.45 O ATOM 1923 CB VAL A 134 23.146 17.377 15.225 1.00 13.33 C ATOM 1924 CG1 VAL A 134 24.360 16.764 14.538 1.00 2.32 C ATOM 1925 CG2 VAL A 134 22.186 16.292 15.700 1.00 40.12 C ATOM 0 H VAL A 134 21.829 19.375 16.393 1.00 55.21 H new ATOM 0 HA VAL A 134 24.057 17.627 17.162 1.00 14.23 H new ATOM 0 HB VAL A 134 22.620 18.000 14.502 1.00 13.33 H new ATOM 0 HG11 VAL A 134 24.031 16.142 13.705 1.00 2.32 H new ATOM 0 HG12 VAL A 134 25.006 17.558 14.165 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.912 16.153 15.252 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.882 15.678 14.852 1.00 40.12 H new ATOM 0 HG22 VAL A 134 22.682 15.666 16.442 1.00 40.12 H new ATOM 0 HG23 VAL A 134 21.306 16.755 16.146 1.00 40.12 H new ATOM 1935 N ARG A 135 25.861 19.081 16.258 1.00 5.32 N ATOM 1936 CA ARG A 135 26.942 19.937 15.791 1.00 35.41 C ATOM 1937 C ARG A 135 27.567 19.300 14.553 1.00 62.34 C ATOM 1938 O ARG A 135 28.303 18.317 14.665 1.00 24.24 O ATOM 1939 CB ARG A 135 28.018 20.116 16.882 1.00 72.41 C ATOM 1940 CG ARG A 135 27.492 20.044 18.315 1.00 24.53 C ATOM 1941 CD ARG A 135 26.461 21.121 18.637 1.00 72.30 C ATOM 1942 NE ARG A 135 25.989 20.979 20.013 1.00 54.11 N ATOM 1943 CZ ARG A 135 25.045 21.723 20.592 1.00 2.05 C ATOM 1944 NH1 ARG A 135 24.437 22.698 19.931 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 24.717 21.478 21.851 1.00 32.21 N ATOM 0 H ARG A 135 26.163 18.320 16.867 1.00 5.32 H new ATOM 0 HA ARG A 135 26.539 20.921 15.551 1.00 35.41 H new ATOM 0 HB2 ARG A 135 28.781 19.349 16.750 1.00 72.41 H new ATOM 0 HB3 ARG A 135 28.507 21.079 16.737 1.00 72.41 H new ATOM 0 HG2 ARG A 135 27.046 19.063 18.482 1.00 24.53 H new ATOM 0 HG3 ARG A 135 28.330 20.135 19.007 1.00 24.53 H new ATOM 0 HD2 ARG A 135 26.901 22.108 18.497 1.00 72.30 H new ATOM 0 HD3 ARG A 135 25.620 21.046 17.948 1.00 72.30 H new ATOM 0 HE ARG A 135 26.419 20.248 20.580 1.00 54.11 H new ATOM 0 HH11 ARG A 135 24.688 22.891 18.961 1.00 12.22 H new ATOM 0 HH12 ARG A 135 23.718 23.255 20.392 1.00 12.22 H new ATOM 0 HH21 ARG A 135 25.184 20.730 22.363 1.00 32.21 H new ATOM 0 HH22 ARG A 135 23.997 22.037 22.309 1.00 32.21 H new ATOM 1959 N LEU A 136 27.236 19.818 13.376 1.00 14.32 N ATOM 1960 CA LEU A 136 27.800 19.300 12.138 1.00 2.32 C ATOM 1961 C LEU A 136 29.221 19.813 11.942 1.00 50.04 C ATOM 1962 O LEU A 136 29.449 21.004 11.715 1.00 1.31 O ATOM 1963 CB LEU A 136 26.914 19.659 10.937 1.00 33.50 C ATOM 1964 CG LEU A 136 25.600 18.864 10.846 1.00 40.54 C ATOM 1965 CD1 LEU A 136 24.808 19.251 9.596 1.00 3.54 C ATOM 1966 CD2 LEU A 136 25.883 17.361 10.864 1.00 32.41 C ATOM 0 H LEU A 136 26.583 20.592 13.254 1.00 14.32 H new ATOM 0 HA LEU A 136 27.837 18.213 12.209 1.00 2.32 H new ATOM 0 HB2 LEU A 136 26.677 20.722 10.983 1.00 33.50 H new ATOM 0 HB3 LEU A 136 27.484 19.499 10.022 1.00 33.50 H new ATOM 0 HG LEU A 136 24.992 19.112 11.716 1.00 40.54 H new ATOM 0 HD11 LEU A 136 23.884 18.674 9.557 1.00 3.54 H new ATOM 0 HD12 LEU A 136 24.570 20.314 9.631 1.00 3.54 H new ATOM 0 HD13 LEU A 136 25.404 19.041 8.708 1.00 3.54 H new ATOM 0 HD21 LEU A 136 24.943 16.813 10.799 1.00 32.41 H new ATOM 0 HD22 LEU A 136 26.515 17.100 10.015 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.393 17.098 11.791 1.00 32.41 H new ATOM 1978 N VAL A 137 30.168 18.897 12.054 1.00 24.14 N ATOM 1979 CA VAL A 137 31.583 19.207 11.927 1.00 11.21 C ATOM 1980 C VAL A 137 32.226 18.302 10.879 1.00 22.22 C ATOM 1981 O VAL A 137 32.272 17.082 11.029 1.00 60.11 O ATOM 1982 CB VAL A 137 32.310 19.074 13.298 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.671 17.978 14.144 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.802 18.793 13.115 1.00 51.44 C ATOM 0 H VAL A 137 29.976 17.912 12.237 1.00 24.14 H new ATOM 0 HA VAL A 137 31.682 20.242 11.600 1.00 11.21 H new ATOM 0 HB VAL A 137 32.205 20.027 13.817 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.194 17.902 15.097 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.624 18.221 14.323 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.738 17.026 13.617 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.278 18.706 14.092 1.00 51.44 H new ATOM 0 HG22 VAL A 137 33.932 17.862 12.564 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.261 19.611 12.559 1.00 51.44 H new ATOM 1994 N VAL A 138 32.696 18.912 9.802 1.00 43.23 N ATOM 1995 CA VAL A 138 33.346 18.190 8.720 1.00 53.11 C ATOM 1996 C VAL A 138 34.856 18.173 8.943 1.00 13.33 C ATOM 1997 O VAL A 138 35.444 19.162 9.391 1.00 44.02 O ATOM 1998 CB VAL A 138 33.022 18.793 7.332 1.00 15.42 C ATOM 1999 CG1 VAL A 138 31.530 19.081 7.199 1.00 20.25 C ATOM 2000 CG2 VAL A 138 33.855 20.037 7.083 1.00 13.44 C ATOM 0 H VAL A 138 32.638 19.919 9.654 1.00 43.23 H new ATOM 0 HA VAL A 138 32.958 17.171 8.728 1.00 53.11 H new ATOM 0 HB VAL A 138 33.282 18.061 6.568 1.00 15.42 H new ATOM 0 HG11 VAL A 138 31.327 19.504 6.215 1.00 20.25 H new ATOM 0 HG12 VAL A 138 30.969 18.154 7.318 1.00 20.25 H new ATOM 0 HG13 VAL A 138 31.226 19.791 7.969 1.00 20.25 H new ATOM 0 HG21 VAL A 138 33.613 20.447 6.102 1.00 13.44 H new ATOM 0 HG22 VAL A 138 33.638 20.780 7.850 1.00 13.44 H new ATOM 0 HG23 VAL A 138 34.913 19.779 7.117 1.00 13.44 H new ATOM 2010 N ALA A 139 35.465 17.038 8.676 1.00 53.03 N ATOM 2011 CA ALA A 139 36.886 16.835 8.935 1.00 12.31 C ATOM 2012 C ALA A 139 37.589 16.277 7.698 1.00 73.13 C ATOM 2013 O ALA A 139 37.008 15.496 6.939 1.00 43.50 O ATOM 2014 CB ALA A 139 37.078 15.906 10.129 1.00 22.50 C ATOM 0 H ALA A 139 34.995 16.227 8.274 1.00 53.03 H new ATOM 0 HA ALA A 139 37.335 17.800 9.171 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.143 15.763 10.311 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.615 16.347 11.012 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.613 14.943 9.919 1.00 22.50 H new ATOM 2021 N MET B 1 27.695 24.211 27.838 1.00 72.34 N ATOM 2022 CA MET B 1 26.861 23.678 28.906 1.00 63.32 C ATOM 2023 C MET B 1 27.661 22.718 29.773 1.00 71.35 C ATOM 2024 O MET B 1 28.816 22.397 29.476 1.00 2.40 O ATOM 2025 CB MET B 1 25.626 22.957 28.333 1.00 41.04 C ATOM 2026 CG MET B 1 25.967 21.698 27.546 1.00 5.33 C ATOM 2027 SD MET B 1 24.540 20.972 26.707 1.00 24.33 S ATOM 2028 CE MET B 1 23.687 20.175 28.067 1.00 72.42 C ATOM 0 H1 MET B 1 27.828 25.233 27.979 1.00 72.34 H new ATOM 0 H2 MET B 1 28.620 23.736 27.850 1.00 72.34 H new ATOM 0 H3 MET B 1 27.233 24.045 26.921 1.00 72.34 H new ATOM 0 HA MET B 1 26.522 24.515 29.517 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.957 22.694 29.152 1.00 41.04 H new ATOM 0 HB3 MET B 1 25.082 23.644 27.685 1.00 41.04 H new ATOM 0 HG2 MET B 1 26.732 21.936 26.807 1.00 5.33 H new ATOM 0 HG3 MET B 1 26.396 20.960 28.223 1.00 5.33 H new ATOM 0 HE1 MET B 1 23.167 19.290 27.701 1.00 72.42 H new ATOM 0 HE2 MET B 1 24.410 19.882 28.828 1.00 72.42 H new ATOM 0 HE3 MET B 1 22.965 20.868 28.499 1.00 72.42 H new ATOM 2038 N ASN B 2 27.029 22.260 30.837 1.00 33.33 N ATOM 2039 CA ASN B 2 27.635 21.294 31.746 1.00 51.30 C ATOM 2040 C ASN B 2 27.101 19.904 31.440 1.00 60.31 C ATOM 2041 O ASN B 2 26.100 19.468 32.008 1.00 61.35 O ATOM 2042 CB ASN B 2 27.355 21.652 33.212 1.00 21.53 C ATOM 2043 CG ASN B 2 27.937 20.631 34.184 1.00 32.42 C ATOM 2044 OD1 ASN B 2 28.980 20.026 33.924 1.00 51.33 O ATOM 2045 ND2 ASN B 2 27.259 20.425 35.304 1.00 42.33 N ATOM 0 H ASN B 2 26.085 22.543 31.099 1.00 33.33 H new ATOM 0 HA ASN B 2 28.715 21.315 31.598 1.00 51.30 H new ATOM 0 HB2 ASN B 2 27.773 22.635 33.429 1.00 21.53 H new ATOM 0 HB3 ASN B 2 26.278 21.723 33.366 1.00 21.53 H new ATOM 0 HD21 ASN B 2 27.596 19.746 35.987 1.00 42.33 H new ATOM 0 HD22 ASN B 2 26.400 20.945 35.483 1.00 42.33 H new ATOM 2052 N ILE B 3 27.740 19.237 30.496 1.00 21.23 N ATOM 2053 CA ILE B 3 27.357 17.890 30.120 1.00 72.42 C ATOM 2054 C ILE B 3 27.609 16.911 31.261 1.00 64.03 C ATOM 2055 O ILE B 3 28.743 16.733 31.711 1.00 40.30 O ATOM 2056 CB ILE B 3 28.124 17.434 28.860 1.00 60.30 C ATOM 2057 CG1 ILE B 3 27.759 18.323 27.664 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.830 15.975 28.544 1.00 62.10 C ATOM 2059 CD1 ILE B 3 26.351 18.101 27.159 1.00 13.01 C ATOM 0 H ILE B 3 28.532 19.610 29.973 1.00 21.23 H new ATOM 0 HA ILE B 3 26.290 17.900 29.899 1.00 72.42 H new ATOM 0 HB ILE B 3 29.192 17.531 29.057 1.00 60.30 H new ATOM 0 HG12 ILE B 3 27.874 19.369 27.949 1.00 50.54 H new ATOM 0 HG13 ILE B 3 28.462 18.135 26.853 1.00 50.54 H new ATOM 0 HG21 ILE B 3 28.382 15.677 27.652 1.00 62.10 H new ATOM 0 HG22 ILE B 3 28.136 15.352 29.385 1.00 62.10 H new ATOM 0 HG23 ILE B 3 26.762 15.849 28.368 1.00 62.10 H new ATOM 0 HD11 ILE B 3 26.159 18.761 26.313 1.00 13.01 H new ATOM 0 HD12 ILE B 3 26.237 17.064 26.843 1.00 13.01 H new ATOM 0 HD13 ILE B 3 25.640 18.317 27.956 1.00 13.01 H new ATOM 2071 N LEU B 4 26.536 16.291 31.725 1.00 23.11 N ATOM 2072 CA LEU B 4 26.609 15.294 32.782 1.00 23.43 C ATOM 2073 C LEU B 4 27.265 14.030 32.254 1.00 41.14 C ATOM 2074 O LEU B 4 28.129 13.442 32.909 1.00 62.34 O ATOM 2075 CB LEU B 4 25.208 14.964 33.312 1.00 50.44 C ATOM 2076 CG LEU B 4 24.440 16.149 33.905 1.00 31.23 C ATOM 2077 CD1 LEU B 4 23.031 15.727 34.317 1.00 75.25 C ATOM 2078 CD2 LEU B 4 25.198 16.745 35.092 1.00 11.04 C ATOM 0 H LEU B 4 25.592 16.464 31.381 1.00 23.11 H new ATOM 0 HA LEU B 4 27.205 15.700 33.599 1.00 23.43 H new ATOM 0 HB2 LEU B 4 24.619 14.541 32.498 1.00 50.44 H new ATOM 0 HB3 LEU B 4 25.298 14.191 34.075 1.00 50.44 H new ATOM 0 HG LEU B 4 24.353 16.918 33.138 1.00 31.23 H new ATOM 0 HD11 LEU B 4 22.503 16.583 34.736 1.00 75.25 H new ATOM 0 HD12 LEU B 4 22.492 15.359 33.444 1.00 75.25 H new ATOM 0 HD13 LEU B 4 23.092 14.937 35.065 1.00 75.25 H new ATOM 0 HD21 LEU B 4 24.635 17.585 35.498 1.00 11.04 H new ATOM 0 HD22 LEU B 4 25.322 15.985 35.863 1.00 11.04 H new ATOM 0 HD23 LEU B 4 26.178 17.090 34.762 1.00 11.04 H new ATOM 2090 N TYR B 5 26.856 13.618 31.056 1.00 23.42 N ATOM 2091 CA TYR B 5 27.400 12.402 30.456 1.00 44.15 C ATOM 2092 C TYR B 5 27.635 12.591 28.963 1.00 24.15 C ATOM 2093 O TYR B 5 26.750 13.044 28.245 1.00 75.34 O ATOM 2094 CB TYR B 5 26.456 11.212 30.688 1.00 21.21 C ATOM 2095 CG TYR B 5 27.069 9.874 30.306 1.00 10.12 C ATOM 2096 CD1 TYR B 5 27.122 9.455 28.977 1.00 52.12 C ATOM 2097 CD2 TYR B 5 27.619 9.043 31.275 1.00 71.12 C ATOM 2098 CE1 TYR B 5 27.704 8.251 28.631 1.00 75.45 C ATOM 2099 CE2 TYR B 5 28.198 7.834 30.935 1.00 10.31 C ATOM 2100 CZ TYR B 5 28.242 7.445 29.611 1.00 52.51 C ATOM 2101 OH TYR B 5 28.828 6.246 29.264 1.00 25.44 O ATOM 0 H TYR B 5 26.159 14.100 30.488 1.00 23.42 H new ATOM 0 HA TYR B 5 28.356 12.193 30.937 1.00 44.15 H new ATOM 0 HB2 TYR B 5 26.168 11.185 31.739 1.00 21.21 H new ATOM 0 HB3 TYR B 5 25.543 11.363 30.111 1.00 21.21 H new ATOM 0 HD1 TYR B 5 26.701 10.082 28.205 1.00 52.12 H new ATOM 0 HD2 TYR B 5 27.594 9.347 32.311 1.00 71.12 H new ATOM 0 HE1 TYR B 5 27.737 7.942 27.597 1.00 75.45 H new ATOM 0 HE2 TYR B 5 28.614 7.197 31.702 1.00 10.31 H new ATOM 0 HH TYR B 5 29.159 5.798 30.070 1.00 25.44 H new ATOM 2111 N LYS B 6 28.835 12.243 28.507 1.00 30.03 N ATOM 2112 CA LYS B 6 29.163 12.262 27.087 1.00 63.12 C ATOM 2113 C LYS B 6 29.970 11.025 26.700 1.00 12.41 C ATOM 2114 O LYS B 6 30.957 10.680 27.355 1.00 54.02 O ATOM 2115 CB LYS B 6 29.930 13.543 26.717 1.00 22.40 C ATOM 2116 CG LYS B 6 30.467 13.551 25.287 1.00 43.31 C ATOM 2117 CD LYS B 6 30.833 14.956 24.805 1.00 65.01 C ATOM 2118 CE LYS B 6 29.593 15.807 24.549 1.00 23.11 C ATOM 2119 NZ LYS B 6 29.909 17.051 23.798 1.00 52.41 N1+ ATOM 0 H LYS B 6 29.602 11.942 29.108 1.00 30.03 H new ATOM 0 HA LYS B 6 28.228 12.251 26.527 1.00 63.12 H new ATOM 0 HB2 LYS B 6 29.272 14.401 26.852 1.00 22.40 H new ATOM 0 HB3 LYS B 6 30.763 13.668 27.408 1.00 22.40 H new ATOM 0 HG2 LYS B 6 31.347 12.910 25.229 1.00 43.31 H new ATOM 0 HG3 LYS B 6 29.718 13.125 24.619 1.00 43.31 H new ATOM 0 HD2 LYS B 6 31.461 15.444 25.550 1.00 65.01 H new ATOM 0 HD3 LYS B 6 31.421 14.885 23.890 1.00 65.01 H new ATOM 0 HE2 LYS B 6 28.863 15.223 23.989 1.00 23.11 H new ATOM 0 HE3 LYS B 6 29.130 16.067 25.501 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 29.077 17.345 23.248 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 30.165 17.805 24.467 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 30.706 16.874 23.153 1.00 52.41 H new ATOM 2133 N THR B 7 29.529 10.359 25.642 1.00 10.14 N ATOM 2134 CA THR B 7 30.215 9.191 25.102 1.00 42.05 C ATOM 2135 C THR B 7 30.445 9.381 23.604 1.00 63.52 C ATOM 2136 O THR B 7 29.591 9.928 22.901 1.00 72.52 O ATOM 2137 CB THR B 7 29.407 7.890 25.359 1.00 0.35 C ATOM 2138 OG1 THR B 7 30.100 6.751 24.829 1.00 0.11 O ATOM 2139 CG2 THR B 7 28.015 7.963 24.743 1.00 24.11 C ATOM 0 H THR B 7 28.683 10.613 25.132 1.00 10.14 H new ATOM 0 HA THR B 7 31.174 9.091 25.610 1.00 42.05 H new ATOM 0 HB THR B 7 29.304 7.784 26.439 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.483 5.993 24.766 1.00 0.11 H new ATOM 0 HG21 THR B 7 27.479 7.035 24.943 1.00 24.11 H new ATOM 0 HG22 THR B 7 27.468 8.799 25.178 1.00 24.11 H new ATOM 0 HG23 THR B 7 28.101 8.107 23.666 1.00 24.11 H new ATOM 2147 N ALA B 8 31.602 8.945 23.120 1.00 4.15 N ATOM 2148 CA ALA B 8 31.962 9.118 21.717 1.00 51.31 C ATOM 2149 C ALA B 8 31.951 7.784 20.986 1.00 33.43 C ATOM 2150 O ALA B 8 32.447 6.777 21.494 1.00 64.22 O ATOM 2151 CB ALA B 8 33.331 9.773 21.592 1.00 24.44 C ATOM 0 H ALA B 8 32.309 8.468 23.680 1.00 4.15 H new ATOM 0 HA ALA B 8 31.219 9.769 21.257 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.582 9.894 20.538 1.00 24.44 H new ATOM 0 HB2 ALA B 8 33.312 10.750 22.075 1.00 24.44 H new ATOM 0 HB3 ALA B 8 34.080 9.145 22.074 1.00 24.44 H new ATOM 2157 N ALA B 9 31.377 7.780 19.794 1.00 21.22 N ATOM 2158 CA ALA B 9 31.378 6.604 18.938 1.00 20.22 C ATOM 2159 C ALA B 9 32.019 6.953 17.604 1.00 31.45 C ATOM 2160 O ALA B 9 31.742 8.002 17.040 1.00 1.21 O ATOM 2161 CB ALA B 9 29.958 6.085 18.741 1.00 3.15 C ATOM 0 H ALA B 9 30.899 8.587 19.394 1.00 21.22 H new ATOM 0 HA ALA B 9 31.958 5.812 19.412 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.978 5.205 18.098 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.531 5.818 19.708 1.00 3.15 H new ATOM 0 HB3 ALA B 9 29.349 6.860 18.276 1.00 3.15 H new ATOM 2167 N THR B 10 32.870 6.077 17.107 1.00 33.23 N ATOM 2168 CA THR B 10 33.582 6.305 15.873 1.00 64.31 C ATOM 2169 C THR B 10 33.230 5.183 14.910 1.00 63.33 C ATOM 2170 O THR B 10 33.396 3.998 15.214 1.00 30.04 O ATOM 2171 CB THR B 10 35.115 6.399 16.105 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.788 6.709 14.879 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.683 5.107 16.689 1.00 23.24 C ATOM 0 H THR B 10 33.085 5.185 17.552 1.00 33.23 H new ATOM 0 HA THR B 10 33.282 7.263 15.448 1.00 64.31 H new ATOM 0 HB THR B 10 35.283 7.198 16.827 1.00 62.43 H new ATOM 0 HG1 THR B 10 35.650 7.654 14.660 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.758 5.216 16.836 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.205 4.900 17.647 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.492 4.282 16.002 1.00 23.24 H new ATOM 2181 N SER B 11 32.685 5.560 13.775 1.00 64.42 N ATOM 2182 CA SER B 11 32.140 4.607 12.833 1.00 20.54 C ATOM 2183 C SER B 11 32.873 4.692 11.495 1.00 44.42 C ATOM 2184 O SER B 11 32.801 5.703 10.797 1.00 74.01 O ATOM 2185 CB SER B 11 30.647 4.892 12.672 1.00 74.14 C ATOM 2186 OG SER B 11 29.956 4.715 13.901 1.00 11.25 O ATOM 0 H SER B 11 32.607 6.533 13.479 1.00 64.42 H new ATOM 0 HA SER B 11 32.276 3.591 13.205 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.505 5.912 12.315 1.00 74.14 H new ATOM 0 HB3 SER B 11 30.227 4.229 11.916 1.00 74.14 H new ATOM 0 HG SER B 11 28.990 4.748 13.741 1.00 11.25 H new ATOM 2192 N THR B 12 33.594 3.630 11.152 1.00 44.31 N ATOM 2193 CA THR B 12 34.386 3.590 9.933 1.00 14.13 C ATOM 2194 C THR B 12 33.610 2.912 8.807 1.00 53.42 C ATOM 2195 O THR B 12 32.694 2.127 9.056 1.00 32.44 O ATOM 2196 CB THR B 12 35.700 2.814 10.168 1.00 2.30 C ATOM 2197 OG1 THR B 12 36.267 3.185 11.430 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.716 3.083 9.064 1.00 31.31 C ATOM 0 H THR B 12 33.644 2.778 11.710 1.00 44.31 H new ATOM 0 HA THR B 12 34.612 4.618 9.650 1.00 14.13 H new ATOM 0 HB THR B 12 35.460 1.751 10.163 1.00 2.30 H new ATOM 0 HG1 THR B 12 37.099 2.688 11.574 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.628 2.520 9.264 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.301 2.774 8.105 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.947 4.148 9.033 1.00 31.31 H new ATOM 2206 N GLY B 13 33.988 3.214 7.576 1.00 25.11 N ATOM 2207 CA GLY B 13 33.405 2.547 6.426 1.00 71.12 C ATOM 2208 C GLY B 13 34.237 1.351 6.019 1.00 70.11 C ATOM 2209 O GLY B 13 34.840 1.351 4.948 1.00 42.34 O ATOM 0 H GLY B 13 34.694 3.914 7.349 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.390 2.226 6.662 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.333 3.246 5.593 1.00 71.12 H new ATOM 2213 N GLY B 14 34.289 0.341 6.896 1.00 21.54 N ATOM 2214 CA GLY B 14 35.108 -0.836 6.647 1.00 31.21 C ATOM 2215 C GLY B 14 34.776 -1.533 5.334 1.00 73.40 C ATOM 2216 O GLY B 14 35.221 -1.112 4.268 1.00 13.01 O ATOM 0 H GLY B 14 33.775 0.321 7.777 1.00 21.54 H new ATOM 0 HA2 GLY B 14 36.158 -0.545 6.640 1.00 31.21 H new ATOM 0 HA3 GLY B 14 34.978 -1.541 7.468 1.00 31.21 H new ATOM 2220 N ARG B 15 34.021 -2.621 5.412 1.00 12.42 N ATOM 2221 CA ARG B 15 33.609 -3.358 4.215 1.00 62.32 C ATOM 2222 C ARG B 15 32.299 -2.804 3.663 1.00 53.41 C ATOM 2223 O ARG B 15 32.206 -2.480 2.481 1.00 34.04 O ATOM 2224 CB ARG B 15 33.479 -4.858 4.524 1.00 22.32 C ATOM 2225 CG ARG B 15 34.781 -5.646 4.362 1.00 23.03 C ATOM 2226 CD ARG B 15 35.975 -4.943 5.005 1.00 52.22 C ATOM 2227 NE ARG B 15 37.157 -5.801 5.033 1.00 65.14 N ATOM 2228 CZ ARG B 15 38.408 -5.386 4.839 1.00 55.23 C ATOM 2229 NH1 ARG B 15 38.668 -4.119 4.530 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 39.404 -6.248 4.946 1.00 51.30 N ATOM 0 H ARG B 15 33.680 -3.016 6.288 1.00 12.42 H new ATOM 0 HA ARG B 15 34.378 -3.231 3.453 1.00 62.32 H new ATOM 0 HB2 ARG B 15 33.120 -4.977 5.546 1.00 22.32 H new ATOM 0 HB3 ARG B 15 32.723 -5.289 3.868 1.00 22.32 H new ATOM 0 HG2 ARG B 15 34.662 -6.634 4.808 1.00 23.03 H new ATOM 0 HG3 ARG B 15 34.981 -5.797 3.301 1.00 23.03 H new ATOM 0 HD2 ARG B 15 36.201 -4.031 4.453 1.00 52.22 H new ATOM 0 HD3 ARG B 15 35.718 -4.645 6.021 1.00 52.22 H new ATOM 0 HE ARG B 15 37.013 -6.794 5.215 1.00 65.14 H new ATOM 0 HH11 ARG B 15 37.904 -3.449 4.438 1.00 21.14 H new ATOM 0 HH12 ARG B 15 39.631 -3.817 4.385 1.00 21.14 H new ATOM 0 HH21 ARG B 15 39.212 -7.223 5.176 1.00 51.30 H new ATOM 0 HH22 ARG B 15 40.365 -5.938 4.799 1.00 51.30 H new ATOM 2244 N ASP B 16 31.285 -2.710 4.520 1.00 43.23 N ATOM 2245 CA ASP B 16 29.993 -2.153 4.107 1.00 64.45 C ATOM 2246 C ASP B 16 29.604 -1.014 5.055 1.00 45.23 C ATOM 2247 O ASP B 16 29.153 0.047 4.630 1.00 44.01 O ATOM 2248 CB ASP B 16 28.937 -3.270 4.126 1.00 65.33 C ATOM 2249 CG ASP B 16 27.756 -3.023 3.194 1.00 54.31 C ATOM 2250 OD1 ASP B 16 27.242 -4.010 2.618 1.00 24.34 O ATOM 2251 OD2 ASP B 16 27.326 -1.866 3.050 1.00 12.23 O1- ATOM 0 H ASP B 16 31.328 -3.008 5.495 1.00 43.23 H new ATOM 0 HA ASP B 16 30.059 -1.751 3.096 1.00 64.45 H new ATOM 0 HB2 ASP B 16 29.413 -4.211 3.851 1.00 65.33 H new ATOM 0 HB3 ASP B 16 28.565 -3.387 5.144 1.00 65.33 H new ATOM 2256 N GLY B 17 29.805 -1.246 6.354 1.00 22.41 N ATOM 2257 CA GLY B 17 29.889 -0.157 7.307 1.00 74.22 C ATOM 2258 C GLY B 17 30.332 -0.670 8.659 1.00 32.04 C ATOM 2259 O GLY B 17 30.209 -1.863 8.930 1.00 11.23 O ATOM 0 H GLY B 17 29.911 -2.176 6.760 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.592 0.595 6.948 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.919 0.331 7.397 1.00 74.22 H new ATOM 2263 N ARG B 18 30.860 0.200 9.506 1.00 41.41 N ATOM 2264 CA ARG B 18 31.314 -0.213 10.833 1.00 45.30 C ATOM 2265 C ARG B 18 30.979 0.856 11.870 1.00 1.35 C ATOM 2266 O ARG B 18 30.876 2.036 11.537 1.00 0.54 O ATOM 2267 CB ARG B 18 32.827 -0.490 10.817 1.00 74.40 C ATOM 2268 CG ARG B 18 33.343 -1.115 12.107 1.00 53.04 C ATOM 2269 CD ARG B 18 34.834 -1.427 12.062 1.00 43.11 C ATOM 2270 NE ARG B 18 35.266 -2.158 13.256 1.00 64.22 N ATOM 2271 CZ ARG B 18 36.469 -2.715 13.406 1.00 63.34 C ATOM 2272 NH1 ARG B 18 37.402 -2.575 12.472 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 36.753 -3.387 14.510 1.00 54.01 N ATOM 0 H ARG B 18 30.986 1.192 9.304 1.00 41.41 H new ATOM 0 HA ARG B 18 30.795 -1.132 11.106 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.058 -1.153 9.983 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.358 0.445 10.638 1.00 74.40 H new ATOM 0 HG2 ARG B 18 33.144 -0.438 12.937 1.00 53.04 H new ATOM 0 HG3 ARG B 18 32.791 -2.034 12.306 1.00 53.04 H new ATOM 0 HD2 ARG B 18 35.057 -2.017 11.173 1.00 43.11 H new ATOM 0 HD3 ARG B 18 35.399 -0.498 11.978 1.00 43.11 H new ATOM 0 HE ARG B 18 34.602 -2.247 14.025 1.00 64.22 H new ATOM 0 HH11 ARG B 18 37.203 -2.037 11.629 1.00 23.22 H new ATOM 0 HH12 ARG B 18 38.318 -3.005 12.598 1.00 23.22 H new ATOM 0 HH21 ARG B 18 36.052 -3.479 15.246 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.673 -3.813 14.625 1.00 54.01 H new ATOM 2287 N ALA B 19 30.803 0.430 13.120 1.00 25.44 N ATOM 2288 CA ALA B 19 30.489 1.337 14.218 1.00 25.14 C ATOM 2289 C ALA B 19 31.137 0.848 15.512 1.00 64.21 C ATOM 2290 O ALA B 19 30.911 -0.287 15.940 1.00 14.23 O ATOM 2291 CB ALA B 19 28.977 1.463 14.391 1.00 63.23 C ATOM 0 H ALA B 19 30.874 -0.549 13.397 1.00 25.44 H new ATOM 0 HA ALA B 19 30.891 2.322 13.980 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.760 2.143 15.215 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.537 1.853 13.473 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.553 0.483 14.609 1.00 63.23 H new ATOM 2297 N THR B 20 31.936 1.707 16.131 1.00 63.15 N ATOM 2298 CA THR B 20 32.660 1.360 17.346 1.00 31.24 C ATOM 2299 C THR B 20 32.502 2.456 18.390 1.00 2.34 C ATOM 2300 O THR B 20 33.005 3.561 18.216 1.00 75.11 O ATOM 2301 CB THR B 20 34.167 1.154 17.039 1.00 15.15 C ATOM 2302 OG1 THR B 20 34.319 0.224 15.955 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.923 0.639 18.262 1.00 14.05 C ATOM 0 H THR B 20 32.100 2.660 15.806 1.00 63.15 H new ATOM 0 HA THR B 20 32.243 0.431 17.735 1.00 31.24 H new ATOM 0 HB THR B 20 34.587 2.121 16.762 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.700 -0.613 16.293 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.975 0.506 18.010 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.833 1.359 19.075 1.00 14.05 H new ATOM 0 HG23 THR B 20 34.502 -0.316 18.575 1.00 14.05 H new ATOM 2311 N SER B 21 31.804 2.154 19.479 1.00 21.31 N ATOM 2312 CA SER B 21 31.686 3.102 20.570 1.00 32.44 C ATOM 2313 C SER B 21 33.056 3.233 21.210 1.00 11.23 C ATOM 2314 O SER B 21 33.515 2.295 21.889 1.00 42.34 O ATOM 2315 CB SER B 21 30.637 2.662 21.596 1.00 31.41 C ATOM 2316 OG SER B 21 30.640 3.518 22.728 1.00 74.21 O ATOM 0 H SER B 21 31.318 1.269 19.625 1.00 21.31 H new ATOM 0 HA SER B 21 31.349 4.065 20.188 1.00 32.44 H new ATOM 0 HB2 SER B 21 29.649 2.666 21.135 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.838 1.638 21.910 1.00 31.41 H new ATOM 0 HG SER B 21 30.285 4.396 22.475 1.00 74.21 H new ATOM 2322 N HIS B 22 33.678 4.401 20.965 1.00 5.04 N ATOM 2323 CA HIS B 22 35.099 4.661 21.224 1.00 32.51 C ATOM 2324 C HIS B 22 35.455 4.519 22.699 1.00 35.24 C ATOM 2325 O HIS B 22 36.627 4.388 23.047 1.00 73.12 O ATOM 2326 CB HIS B 22 35.463 6.067 20.714 1.00 3.43 C ATOM 2327 CG HIS B 22 36.886 6.483 20.971 1.00 12.52 C ATOM 2328 ND1 HIS B 22 37.953 6.039 20.221 1.00 31.42 N ATOM 2329 CD2 HIS B 22 37.407 7.329 21.892 1.00 34.34 C ATOM 2330 CE1 HIS B 22 39.065 6.592 20.669 1.00 23.12 C ATOM 2331 NE2 HIS B 22 38.764 7.381 21.683 1.00 12.42 N ATOM 0 H HIS B 22 33.191 5.207 20.572 1.00 5.04 H new ATOM 0 HA HIS B 22 35.680 3.911 20.687 1.00 32.51 H new ATOM 0 HB2 HIS B 22 35.275 6.109 19.641 1.00 3.43 H new ATOM 0 HB3 HIS B 22 34.797 6.792 21.183 1.00 3.43 H new ATOM 0 HD2 HIS B 22 36.857 7.864 22.651 1.00 34.34 H new ATOM 0 HE1 HIS B 22 40.056 6.426 20.272 1.00 23.12 H new ATOM 0 HE2 HIS B 22 39.428 7.937 22.222 1.00 12.42 H new ATOM 2340 N ASP B 23 34.443 4.495 23.557 1.00 44.12 N ATOM 2341 CA ASP B 23 34.658 4.288 24.991 1.00 0.24 C ATOM 2342 C ASP B 23 34.852 2.797 25.267 1.00 62.21 C ATOM 2343 O ASP B 23 34.834 2.354 26.418 1.00 40.03 O ATOM 2344 CB ASP B 23 33.461 4.819 25.796 1.00 12.04 C ATOM 2345 CG ASP B 23 33.338 6.335 25.770 1.00 5.31 C ATOM 2346 OD1 ASP B 23 32.999 6.894 24.705 1.00 63.54 O ATOM 2347 OD2 ASP B 23 33.557 6.975 26.822 1.00 33.23 O1- ATOM 0 H ASP B 23 33.466 4.616 23.290 1.00 44.12 H new ATOM 0 HA ASP B 23 35.550 4.834 25.298 1.00 0.24 H new ATOM 0 HB2 ASP B 23 32.544 4.381 25.401 1.00 12.04 H new ATOM 0 HB3 ASP B 23 33.553 4.487 26.830 1.00 12.04 H new ATOM 2352 N GLN B 24 35.049 2.039 24.182 1.00 3.35 N ATOM 2353 CA GLN B 24 35.235 0.593 24.230 1.00 64.10 C ATOM 2354 C GLN B 24 33.943 -0.076 24.665 1.00 11.02 C ATOM 2355 O GLN B 24 33.934 -1.200 25.166 1.00 0.33 O ATOM 2356 CB GLN B 24 36.414 0.207 25.139 1.00 41.34 C ATOM 2357 CG GLN B 24 37.747 0.793 24.680 1.00 71.43 C ATOM 2358 CD GLN B 24 38.035 0.510 23.213 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.601 -0.526 22.865 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.658 1.434 22.342 1.00 4.32 N ATOM 0 H GLN B 24 35.083 2.422 23.237 1.00 3.35 H new ATOM 0 HA GLN B 24 35.486 0.238 23.230 1.00 64.10 H new ATOM 0 HB2 GLN B 24 36.207 0.545 26.154 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.496 -0.879 25.175 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.742 1.871 24.844 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.551 0.381 25.291 1.00 71.43 H new ATOM 0 HE21 GLN B 24 37.191 2.281 22.667 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.835 1.299 21.347 1.00 4.32 H new ATOM 2369 N LYS B 25 32.842 0.630 24.428 1.00 34.11 N ATOM 2370 CA LYS B 25 31.523 0.120 24.744 1.00 33.22 C ATOM 2371 C LYS B 25 31.034 -0.791 23.625 1.00 40.01 C ATOM 2372 O LYS B 25 30.354 -1.785 23.890 1.00 34.42 O ATOM 2373 CB LYS B 25 30.523 1.269 24.944 1.00 20.21 C ATOM 2374 CG LYS B 25 30.940 2.302 25.987 1.00 22.43 C ATOM 2375 CD LYS B 25 30.973 1.728 27.403 1.00 41.25 C ATOM 2376 CE LYS B 25 31.377 2.794 28.420 1.00 25.52 C ATOM 2377 NZ LYS B 25 31.403 2.273 29.815 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.843 1.563 24.015 1.00 34.11 H new ATOM 0 HA LYS B 25 31.593 -0.447 25.673 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.376 1.775 23.990 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.560 0.848 25.234 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.926 2.691 25.734 1.00 22.43 H new ATOM 0 HG3 LYS B 25 30.248 3.144 25.956 1.00 22.43 H new ATOM 0 HD2 LYS B 25 29.992 1.329 27.660 1.00 41.25 H new ATOM 0 HD3 LYS B 25 31.676 0.896 27.445 1.00 41.25 H new ATOM 0 HE2 LYS B 25 32.363 3.182 28.162 1.00 25.52 H new ATOM 0 HE3 LYS B 25 30.680 3.630 28.361 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 31.683 3.035 30.465 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.457 1.927 30.074 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 32.087 1.493 29.881 1.00 5.33 H new ATOM 2391 N LEU B 26 31.383 -0.470 22.366 1.00 71.52 N ATOM 2392 CA LEU B 26 30.851 -1.238 21.241 1.00 40.15 C ATOM 2393 C LEU B 26 31.843 -1.312 20.089 1.00 62.33 C ATOM 2394 O LEU B 26 32.593 -0.374 19.860 1.00 50.50 O ATOM 2395 CB LEU B 26 29.542 -0.593 20.764 1.00 64.14 C ATOM 2396 CG LEU B 26 28.920 -1.192 19.494 1.00 70.42 C ATOM 2397 CD1 LEU B 26 28.502 -2.646 19.716 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.738 -0.344 19.040 1.00 31.22 C ATOM 0 H LEU B 26 32.011 0.292 22.113 1.00 71.52 H new ATOM 0 HA LEU B 26 30.666 -2.257 21.580 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.811 -0.662 21.570 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.725 0.467 20.590 1.00 64.14 H new ATOM 0 HG LEU B 26 29.673 -1.187 18.706 1.00 70.42 H new ATOM 0 HD11 LEU B 26 28.065 -3.043 18.800 1.00 23.12 H new ATOM 0 HD12 LEU B 26 29.376 -3.238 19.988 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.767 -2.695 20.519 1.00 23.12 H new ATOM 0 HD21 LEU B 26 27.304 -0.777 18.139 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.986 -0.317 19.828 1.00 31.22 H new ATOM 0 HD23 LEU B 26 28.078 0.670 18.828 1.00 31.22 H new ATOM 2410 N ASP B 27 31.827 -2.436 19.376 1.00 22.45 N ATOM 2411 CA ASP B 27 32.613 -2.611 18.156 1.00 53.33 C ATOM 2412 C ASP B 27 31.932 -3.637 17.257 1.00 42.15 C ATOM 2413 O ASP B 27 32.062 -4.844 17.470 1.00 22.10 O ATOM 2414 CB ASP B 27 34.049 -3.057 18.469 1.00 24.13 C ATOM 2415 CG ASP B 27 34.879 -3.285 17.209 1.00 15.20 C ATOM 2416 OD1 ASP B 27 35.021 -4.450 16.772 1.00 3.40 O ATOM 2417 OD2 ASP B 27 35.404 -2.301 16.648 1.00 21.30 O1- ATOM 0 H ASP B 27 31.269 -3.252 19.628 1.00 22.45 H new ATOM 0 HA ASP B 27 32.669 -1.650 17.645 1.00 53.33 H new ATOM 0 HB2 ASP B 27 34.534 -2.302 19.087 1.00 24.13 H new ATOM 0 HB3 ASP B 27 34.021 -3.977 19.053 1.00 24.13 H new ATOM 2422 N VAL B 28 31.173 -3.154 16.283 1.00 42.42 N ATOM 2423 CA VAL B 28 30.466 -4.023 15.342 1.00 61.03 C ATOM 2424 C VAL B 28 30.492 -3.454 13.932 1.00 62.05 C ATOM 2425 O VAL B 28 31.012 -2.364 13.692 1.00 71.42 O ATOM 2426 CB VAL B 28 28.990 -4.267 15.752 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.907 -5.256 16.908 1.00 44.41 C ATOM 2428 CG2 VAL B 28 28.296 -2.950 16.094 1.00 74.12 C ATOM 0 H VAL B 28 31.028 -2.158 16.120 1.00 42.42 H new ATOM 0 HA VAL B 28 30.996 -4.975 15.365 1.00 61.03 H new ATOM 0 HB VAL B 28 28.466 -4.705 14.902 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.863 -5.412 17.179 1.00 44.41 H new ATOM 0 HG12 VAL B 28 29.350 -6.205 16.607 1.00 44.41 H new ATOM 0 HG13 VAL B 28 29.449 -4.859 17.766 1.00 44.41 H new ATOM 0 HG21 VAL B 28 27.262 -3.147 16.378 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.815 -2.470 16.923 1.00 74.12 H new ATOM 0 HG23 VAL B 28 28.314 -2.293 15.225 1.00 74.12 H new ATOM 2438 N LYS B 29 29.909 -4.209 13.016 1.00 64.31 N ATOM 2439 CA LYS B 29 29.874 -3.859 11.607 1.00 24.45 C ATOM 2440 C LYS B 29 28.456 -4.007 11.065 1.00 31.35 C ATOM 2441 O LYS B 29 27.724 -4.918 11.462 1.00 25.23 O ATOM 2442 CB LYS B 29 30.834 -4.774 10.836 1.00 11.40 C ATOM 2443 CG LYS B 29 30.585 -4.816 9.332 1.00 53.23 C ATOM 2444 CD LYS B 29 31.470 -5.834 8.629 1.00 3.25 C ATOM 2445 CE LYS B 29 31.166 -5.891 7.139 1.00 32.51 C ATOM 2446 NZ LYS B 29 29.718 -6.111 6.884 1.00 50.55 N1+ ATOM 0 H LYS B 29 29.443 -5.090 13.232 1.00 64.31 H new ATOM 0 HA LYS B 29 30.185 -2.822 11.482 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.857 -4.442 11.014 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.753 -5.785 11.235 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.539 -5.057 9.146 1.00 53.23 H new ATOM 0 HG3 LYS B 29 30.764 -3.828 8.908 1.00 53.23 H new ATOM 0 HD2 LYS B 29 32.518 -5.574 8.779 1.00 3.25 H new ATOM 0 HD3 LYS B 29 31.319 -6.819 9.072 1.00 3.25 H new ATOM 0 HE2 LYS B 29 31.482 -4.961 6.667 1.00 32.51 H new ATOM 0 HE3 LYS B 29 31.743 -6.694 6.680 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 29.602 -6.798 6.112 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 29.266 -6.479 7.745 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 29.272 -5.210 6.616 1.00 50.55 H new ATOM 2460 N LEU B 30 28.068 -3.113 10.163 1.00 60.42 N ATOM 2461 CA LEU B 30 26.778 -3.193 9.510 1.00 43.12 C ATOM 2462 C LEU B 30 26.936 -3.123 7.992 1.00 50.11 C ATOM 2463 O LEU B 30 28.064 -2.982 7.464 1.00 72.32 O ATOM 2464 CB LEU B 30 25.797 -2.122 10.045 1.00 4.40 C ATOM 2465 CG LEU B 30 26.336 -0.690 10.265 1.00 61.23 C ATOM 2466 CD1 LEU B 30 27.322 -0.621 11.435 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.948 -0.128 8.986 1.00 52.40 C ATOM 0 H LEU B 30 28.638 -2.320 9.869 1.00 60.42 H new ATOM 0 HA LEU B 30 26.338 -4.161 9.750 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.959 -2.060 9.351 1.00 4.40 H new ATOM 0 HB3 LEU B 30 25.399 -2.479 10.995 1.00 4.40 H new ATOM 0 HG LEU B 30 25.485 -0.063 10.530 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.675 0.403 11.553 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.824 -0.941 12.350 1.00 42.23 H new ATOM 0 HD13 LEU B 30 28.170 -1.276 11.235 1.00 42.23 H new ATOM 0 HD21 LEU B 30 27.318 0.880 9.172 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.773 -0.765 8.667 1.00 52.40 H new ATOM 0 HD23 LEU B 30 26.190 -0.097 8.203 1.00 52.40 H new ATOM 2479 N SER B 31 25.809 -3.252 7.303 1.00 24.22 N ATOM 2480 CA SER B 31 25.784 -3.322 5.851 1.00 21.40 C ATOM 2481 C SER B 31 24.535 -2.651 5.274 1.00 43.34 C ATOM 2482 O SER B 31 23.501 -2.566 5.939 1.00 1.33 O ATOM 2483 CB SER B 31 25.837 -4.793 5.423 1.00 62.35 C ATOM 2484 OG SER B 31 24.908 -5.566 6.164 1.00 3.34 O ATOM 0 H SER B 31 24.888 -3.311 7.737 1.00 24.22 H new ATOM 0 HA SER B 31 26.650 -2.786 5.463 1.00 21.40 H new ATOM 0 HB2 SER B 31 25.618 -4.875 4.358 1.00 62.35 H new ATOM 0 HB3 SER B 31 26.843 -5.184 5.572 1.00 62.35 H new ATOM 0 HG SER B 31 25.085 -6.519 6.018 1.00 3.34 H new ATOM 2490 N ALA B 32 24.648 -2.176 4.038 1.00 40.52 N ATOM 2491 CA ALA B 32 23.514 -1.627 3.309 1.00 75.13 C ATOM 2492 C ALA B 32 22.869 -2.724 2.456 1.00 31.44 C ATOM 2493 O ALA B 32 23.566 -3.417 1.706 1.00 42.31 O ATOM 2494 CB ALA B 32 23.962 -0.459 2.435 1.00 44.15 C ATOM 0 H ALA B 32 25.525 -2.161 3.517 1.00 40.52 H new ATOM 0 HA ALA B 32 22.776 -1.256 4.021 1.00 75.13 H new ATOM 0 HB1 ALA B 32 23.104 -0.058 1.896 1.00 44.15 H new ATOM 0 HB2 ALA B 32 24.393 0.321 3.063 1.00 44.15 H new ATOM 0 HB3 ALA B 32 24.710 -0.805 1.721 1.00 44.15 H new ATOM 2500 N PRO B 33 21.532 -2.900 2.558 1.00 64.54 N ATOM 2501 CA PRO B 33 20.806 -3.949 1.824 1.00 71.30 C ATOM 2502 C PRO B 33 21.157 -3.971 0.333 1.00 44.54 C ATOM 2503 O PRO B 33 20.753 -3.084 -0.423 1.00 60.20 O ATOM 2504 CB PRO B 33 19.332 -3.571 2.032 1.00 5.21 C ATOM 2505 CG PRO B 33 19.314 -2.831 3.327 1.00 53.32 C ATOM 2506 CD PRO B 33 20.622 -2.087 3.398 1.00 34.02 C ATOM 0 HA PRO B 33 21.057 -4.947 2.182 1.00 71.30 H new ATOM 0 HB2 PRO B 33 18.963 -2.951 1.215 1.00 5.21 H new ATOM 0 HB3 PRO B 33 18.697 -4.456 2.072 1.00 5.21 H new ATOM 0 HG2 PRO B 33 18.470 -2.142 3.371 1.00 53.32 H new ATOM 0 HG3 PRO B 33 19.209 -3.517 4.167 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.526 -1.070 3.017 1.00 34.02 H new ATOM 0 HD3 PRO B 33 20.984 -2.010 4.423 1.00 34.02 H new ATOM 2514 N ARG B 34 21.908 -4.992 -0.088 1.00 0.10 N ATOM 2515 CA ARG B 34 22.344 -5.103 -1.480 1.00 23.43 C ATOM 2516 C ARG B 34 21.151 -5.297 -2.409 1.00 64.55 C ATOM 2517 O ARG B 34 21.240 -5.052 -3.612 1.00 62.12 O ATOM 2518 CB ARG B 34 23.332 -6.241 -1.666 1.00 33.02 C ATOM 2519 CG ARG B 34 24.079 -6.140 -2.984 1.00 11.34 C ATOM 2520 CD ARG B 34 25.153 -7.189 -3.091 1.00 70.25 C ATOM 2521 NE ARG B 34 26.004 -6.984 -4.262 1.00 41.11 N ATOM 2522 CZ ARG B 34 26.847 -7.891 -4.753 1.00 71.43 C ATOM 2523 NH1 ARG B 34 26.930 -9.098 -4.208 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 27.608 -7.577 -5.793 1.00 21.32 N ATOM 0 H ARG B 34 22.226 -5.751 0.514 1.00 0.10 H new ATOM 0 HA ARG B 34 22.845 -4.170 -1.736 1.00 23.43 H new ATOM 0 HB2 ARG B 34 24.047 -6.238 -0.843 1.00 33.02 H new ATOM 0 HB3 ARG B 34 22.801 -7.192 -1.623 1.00 33.02 H new ATOM 0 HG2 ARG B 34 23.377 -6.251 -3.811 1.00 11.34 H new ATOM 0 HG3 ARG B 34 24.526 -5.150 -3.075 1.00 11.34 H new ATOM 0 HD2 ARG B 34 25.766 -7.173 -2.190 1.00 70.25 H new ATOM 0 HD3 ARG B 34 24.692 -8.175 -3.146 1.00 70.25 H new ATOM 0 HE ARG B 34 25.948 -6.083 -4.737 1.00 41.11 H new ATOM 0 HH11 ARG B 34 26.346 -9.337 -3.407 1.00 70.13 H new ATOM 0 HH12 ARG B 34 27.578 -9.787 -4.590 1.00 70.13 H new ATOM 0 HH21 ARG B 34 27.545 -6.648 -6.209 1.00 21.32 H new ATOM 0 HH22 ARG B 34 28.257 -8.264 -6.176 1.00 21.32 H new ATOM 2538 N GLU B 35 20.040 -5.743 -1.831 1.00 42.24 N ATOM 2539 CA GLU B 35 18.780 -5.902 -2.555 1.00 63.02 C ATOM 2540 C GLU B 35 18.419 -4.639 -3.333 1.00 12.03 C ATOM 2541 O GLU B 35 17.741 -4.705 -4.358 1.00 54.43 O ATOM 2542 CB GLU B 35 17.647 -6.227 -1.569 1.00 72.41 C ATOM 2543 CG GLU B 35 17.836 -7.537 -0.810 1.00 31.33 C ATOM 2544 CD GLU B 35 18.031 -8.727 -1.733 1.00 34.33 C ATOM 2545 OE1 GLU B 35 19.160 -9.254 -1.811 1.00 72.42 O ATOM 2546 OE2 GLU B 35 17.053 -9.135 -2.395 1.00 24.25 O1- ATOM 0 H GLU B 35 19.986 -6.005 -0.847 1.00 42.24 H new ATOM 0 HA GLU B 35 18.906 -6.721 -3.264 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.561 -5.412 -0.850 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.705 -6.270 -2.116 1.00 72.41 H new ATOM 0 HG2 GLU B 35 18.699 -7.449 -0.151 1.00 31.33 H new ATOM 0 HG3 GLU B 35 16.967 -7.713 -0.176 1.00 31.33 H new ATOM 2553 N LEU B 36 18.883 -3.495 -2.835 1.00 53.04 N ATOM 2554 CA LEU B 36 18.518 -2.194 -3.389 1.00 1.52 C ATOM 2555 C LEU B 36 19.712 -1.541 -4.088 1.00 52.10 C ATOM 2556 O LEU B 36 19.682 -0.355 -4.415 1.00 30.14 O ATOM 2557 CB LEU B 36 17.993 -1.308 -2.252 1.00 63.52 C ATOM 2558 CG LEU B 36 16.879 -1.955 -1.406 1.00 20.23 C ATOM 2559 CD1 LEU B 36 16.528 -1.092 -0.202 1.00 52.43 C ATOM 2560 CD2 LEU B 36 15.639 -2.229 -2.254 1.00 15.21 C ATOM 0 H LEU B 36 19.520 -3.444 -2.040 1.00 53.04 H new ATOM 0 HA LEU B 36 17.739 -2.323 -4.140 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.824 -1.046 -1.598 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.617 -0.377 -2.677 1.00 63.52 H new ATOM 0 HG LEU B 36 17.257 -2.908 -1.036 1.00 20.23 H new ATOM 0 HD11 LEU B 36 15.739 -1.575 0.375 1.00 52.43 H new ATOM 0 HD12 LEU B 36 17.411 -0.966 0.425 1.00 52.43 H new ATOM 0 HD13 LEU B 36 16.182 -0.116 -0.542 1.00 52.43 H new ATOM 0 HD21 LEU B 36 14.868 -2.686 -1.634 1.00 15.21 H new ATOM 0 HD22 LEU B 36 15.266 -1.292 -2.666 1.00 15.21 H new ATOM 0 HD23 LEU B 36 15.897 -2.906 -3.068 1.00 15.21 H new ATOM 2572 N GLY B 37 20.755 -2.337 -4.326 1.00 22.45 N ATOM 2573 CA GLY B 37 21.944 -1.848 -5.008 1.00 25.41 C ATOM 2574 C GLY B 37 23.029 -1.394 -4.046 1.00 51.22 C ATOM 2575 O GLY B 37 23.445 -0.235 -4.072 1.00 30.40 O ATOM 0 H GLY B 37 20.797 -3.320 -4.056 1.00 22.45 H new ATOM 0 HA2 GLY B 37 22.340 -2.636 -5.649 1.00 25.41 H new ATOM 0 HA3 GLY B 37 21.669 -1.017 -5.657 1.00 25.41 H new ATOM 2579 N GLY B 38 23.496 -2.311 -3.199 1.00 53.33 N ATOM 2580 CA GLY B 38 24.548 -1.994 -2.246 1.00 54.12 C ATOM 2581 C GLY B 38 25.685 -2.994 -2.313 1.00 61.21 C ATOM 2582 O GLY B 38 26.124 -3.372 -3.402 1.00 64.12 O ATOM 0 H GLY B 38 23.161 -3.274 -3.157 1.00 53.33 H new ATOM 0 HA2 GLY B 38 24.931 -0.993 -2.446 1.00 54.12 H new ATOM 0 HA3 GLY B 38 24.134 -1.981 -1.238 1.00 54.12 H new ATOM 2586 N ALA B 39 26.148 -3.443 -1.152 1.00 3.10 N ATOM 2587 CA ALA B 39 27.239 -4.415 -1.074 1.00 71.25 C ATOM 2588 C ALA B 39 26.771 -5.705 -0.398 1.00 4.43 C ATOM 2589 O ALA B 39 27.270 -6.790 -0.702 1.00 31.41 O ATOM 2590 CB ALA B 39 28.436 -3.815 -0.341 1.00 12.41 C ATOM 0 H ALA B 39 25.784 -3.149 -0.246 1.00 3.10 H new ATOM 0 HA ALA B 39 27.551 -4.665 -2.088 1.00 71.25 H new ATOM 0 HB1 ALA B 39 29.239 -4.551 -0.292 1.00 12.41 H new ATOM 0 HB2 ALA B 39 28.785 -2.932 -0.876 1.00 12.41 H new ATOM 0 HB3 ALA B 39 28.140 -3.533 0.669 1.00 12.41 H new ATOM 2596 N GLY B 40 25.788 -5.578 0.495 1.00 23.34 N ATOM 2597 CA GLY B 40 25.214 -6.732 1.177 1.00 31.44 C ATOM 2598 C GLY B 40 26.249 -7.617 1.842 1.00 1.42 C ATOM 2599 O GLY B 40 26.234 -8.841 1.673 1.00 53.13 O ATOM 0 H GLY B 40 25.374 -4.684 0.761 1.00 23.34 H new ATOM 0 HA2 GLY B 40 24.507 -6.384 1.930 1.00 31.44 H new ATOM 0 HA3 GLY B 40 24.648 -7.325 0.458 1.00 31.44 H new ATOM 2603 N ALA B 41 27.158 -6.997 2.583 1.00 13.10 N ATOM 2604 CA ALA B 41 28.187 -7.730 3.314 1.00 45.11 C ATOM 2605 C ALA B 41 27.622 -8.312 4.609 1.00 24.05 C ATOM 2606 O ALA B 41 26.479 -8.046 4.969 1.00 14.44 O ATOM 2607 CB ALA B 41 29.362 -6.817 3.621 1.00 11.53 C ATOM 0 H ALA B 41 27.205 -5.984 2.695 1.00 13.10 H new ATOM 0 HA ALA B 41 28.531 -8.554 2.688 1.00 45.11 H new ATOM 0 HB1 ALA B 41 30.123 -7.375 4.166 1.00 11.53 H new ATOM 0 HB2 ALA B 41 29.785 -6.442 2.689 1.00 11.53 H new ATOM 0 HB3 ALA B 41 29.022 -5.978 4.228 1.00 11.53 H new ATOM 2613 N GLU B 42 28.439 -9.094 5.312 1.00 15.20 N ATOM 2614 CA GLU B 42 28.050 -9.657 6.604 1.00 53.20 C ATOM 2615 C GLU B 42 27.935 -8.547 7.657 1.00 74.14 C ATOM 2616 O GLU B 42 28.874 -8.262 8.401 1.00 53.42 O ATOM 2617 CB GLU B 42 29.059 -10.724 7.046 1.00 21.14 C ATOM 2618 CG GLU B 42 30.492 -10.218 7.082 1.00 73.23 C ATOM 2619 CD GLU B 42 31.496 -11.317 7.383 1.00 72.34 C ATOM 2620 OE1 GLU B 42 31.712 -11.620 8.574 1.00 61.42 O ATOM 2621 OE2 GLU B 42 32.067 -11.890 6.430 1.00 61.14 O1- ATOM 0 H GLU B 42 29.377 -9.353 5.008 1.00 15.20 H new ATOM 0 HA GLU B 42 27.074 -10.131 6.500 1.00 53.20 H new ATOM 0 HB2 GLU B 42 28.784 -11.086 8.037 1.00 21.14 H new ATOM 0 HB3 GLU B 42 28.998 -11.575 6.367 1.00 21.14 H new ATOM 0 HG2 GLU B 42 30.736 -9.762 6.122 1.00 73.23 H new ATOM 0 HG3 GLU B 42 30.578 -9.437 7.837 1.00 73.23 H new ATOM 2628 N GLY B 43 26.814 -7.858 7.637 1.00 33.24 N ATOM 2629 CA GLY B 43 26.536 -6.836 8.633 1.00 35.43 C ATOM 2630 C GLY B 43 25.064 -6.757 8.986 1.00 2.13 C ATOM 2631 O GLY B 43 24.278 -7.619 8.594 1.00 72.12 O ATOM 0 H GLY B 43 26.077 -7.984 6.943 1.00 33.24 H new ATOM 0 HA2 GLY B 43 27.112 -7.045 9.534 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.869 -5.868 8.259 1.00 35.43 H new ATOM 2635 N THR B 44 24.699 -5.727 9.739 1.00 33.20 N ATOM 2636 CA THR B 44 23.318 -5.507 10.142 1.00 33.40 C ATOM 2637 C THR B 44 22.668 -4.417 9.296 1.00 35.03 C ATOM 2638 O THR B 44 23.303 -3.839 8.415 1.00 4.14 O ATOM 2639 CB THR B 44 23.249 -5.115 11.635 1.00 13.15 C ATOM 2640 OG1 THR B 44 24.149 -4.030 11.901 1.00 1.03 O ATOM 2641 CG2 THR B 44 23.604 -6.299 12.518 1.00 34.45 C ATOM 0 H THR B 44 25.351 -5.023 10.086 1.00 33.20 H new ATOM 0 HA THR B 44 22.773 -6.438 9.989 1.00 33.40 H new ATOM 0 HB THR B 44 22.229 -4.803 11.860 1.00 13.15 H new ATOM 0 HG1 THR B 44 24.097 -3.787 12.849 1.00 1.03 H new ATOM 0 HG21 THR B 44 23.549 -6.001 13.565 1.00 34.45 H new ATOM 0 HG22 THR B 44 22.902 -7.113 12.335 1.00 34.45 H new ATOM 0 HG23 THR B 44 24.616 -6.634 12.288 1.00 34.45 H new ATOM 2649 N ASN B 45 21.400 -4.148 9.574 1.00 4.01 N ATOM 2650 CA ASN B 45 20.647 -3.116 8.871 1.00 51.43 C ATOM 2651 C ASN B 45 20.628 -1.825 9.690 1.00 21.43 C ATOM 2652 O ASN B 45 20.258 -1.846 10.866 1.00 31.35 O ATOM 2653 CB ASN B 45 19.214 -3.601 8.619 1.00 71.14 C ATOM 2654 CG ASN B 45 19.118 -4.610 7.492 1.00 11.33 C ATOM 2655 OD1 ASN B 45 19.296 -5.813 7.697 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.804 -4.132 6.302 1.00 55.34 N ATOM 0 H ASN B 45 20.864 -4.637 10.291 1.00 4.01 H new ATOM 0 HA ASN B 45 21.129 -2.915 7.914 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.822 -4.047 9.533 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.582 -2.744 8.386 1.00 71.14 H new ATOM 0 HD21 ASN B 45 18.700 -4.765 5.509 1.00 55.34 H new ATOM 0 HD22 ASN B 45 18.665 -3.129 6.175 1.00 55.34 H new ATOM 2663 N PRO B 46 21.031 -0.686 9.091 1.00 54.41 N ATOM 2664 CA PRO B 46 21.081 0.605 9.794 1.00 2.04 C ATOM 2665 C PRO B 46 19.693 1.083 10.247 1.00 14.41 C ATOM 2666 O PRO B 46 19.497 1.444 11.418 1.00 12.32 O ATOM 2667 CB PRO B 46 21.689 1.567 8.756 1.00 21.50 C ATOM 2668 CG PRO B 46 21.456 0.916 7.433 1.00 13.22 C ATOM 2669 CD PRO B 46 21.476 -0.568 7.685 1.00 31.44 C ATOM 0 HA PRO B 46 21.663 0.543 10.713 1.00 2.04 H new ATOM 0 HB2 PRO B 46 21.213 2.547 8.802 1.00 21.50 H new ATOM 0 HB3 PRO B 46 22.753 1.720 8.937 1.00 21.50 H new ATOM 0 HG2 PRO B 46 20.501 1.226 7.010 1.00 13.22 H new ATOM 0 HG3 PRO B 46 22.228 1.200 6.718 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.808 -1.099 7.007 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.473 -0.986 7.543 1.00 31.44 H new ATOM 2677 N GLU B 47 18.731 1.078 9.323 1.00 51.12 N ATOM 2678 CA GLU B 47 17.367 1.495 9.640 1.00 42.23 C ATOM 2679 C GLU B 47 16.766 0.569 10.698 1.00 51.31 C ATOM 2680 O GLU B 47 15.977 0.999 11.543 1.00 51.34 O ATOM 2681 CB GLU B 47 16.480 1.547 8.377 1.00 43.35 C ATOM 2682 CG GLU B 47 16.227 0.200 7.687 1.00 13.13 C ATOM 2683 CD GLU B 47 17.467 -0.407 7.042 1.00 41.12 C ATOM 2684 OE1 GLU B 47 18.357 0.353 6.611 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.551 -1.649 6.959 1.00 73.03 O1- ATOM 0 H GLU B 47 18.871 0.791 8.354 1.00 51.12 H new ATOM 0 HA GLU B 47 17.407 2.506 10.045 1.00 42.23 H new ATOM 0 HB2 GLU B 47 15.518 1.982 8.648 1.00 43.35 H new ATOM 0 HB3 GLU B 47 16.943 2.222 7.657 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.830 -0.503 8.419 1.00 13.13 H new ATOM 0 HG3 GLU B 47 15.460 0.333 6.923 1.00 13.13 H new ATOM 2692 N GLN B 48 17.164 -0.701 10.654 1.00 65.22 N ATOM 2693 CA GLN B 48 16.777 -1.670 11.674 1.00 23.21 C ATOM 2694 C GLN B 48 17.383 -1.270 13.014 1.00 44.13 C ATOM 2695 O GLN B 48 16.701 -1.267 14.032 1.00 15.51 O ATOM 2696 CB GLN B 48 17.248 -3.073 11.261 1.00 21.32 C ATOM 2697 CG GLN B 48 16.834 -4.211 12.196 1.00 64.34 C ATOM 2698 CD GLN B 48 17.758 -4.379 13.395 1.00 23.41 C ATOM 2699 OE1 GLN B 48 17.520 -3.833 14.469 1.00 3.40 O ATOM 2700 NE2 GLN B 48 18.824 -5.141 13.213 1.00 12.54 N ATOM 0 H GLN B 48 17.758 -1.083 9.918 1.00 65.22 H new ATOM 0 HA GLN B 48 15.692 -1.685 11.773 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.863 -3.287 10.264 1.00 21.32 H new ATOM 0 HB3 GLN B 48 18.335 -3.065 11.187 1.00 21.32 H new ATOM 0 HG2 GLN B 48 15.820 -4.028 12.552 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.810 -5.144 11.632 1.00 64.34 H new ATOM 0 HE21 GLN B 48 18.989 -5.579 12.307 1.00 12.54 H new ATOM 0 HE22 GLN B 48 19.481 -5.291 13.979 1.00 12.54 H new ATOM 2709 N LEU B 49 18.665 -0.915 12.988 1.00 25.52 N ATOM 2710 CA LEU B 49 19.399 -0.538 14.193 1.00 12.42 C ATOM 2711 C LEU B 49 18.671 0.602 14.910 1.00 73.15 C ATOM 2712 O LEU B 49 18.417 0.531 16.119 1.00 22.33 O ATOM 2713 CB LEU B 49 20.843 -0.142 13.812 1.00 25.41 C ATOM 2714 CG LEU B 49 21.878 -0.088 14.958 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.654 1.118 15.864 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.854 -1.384 15.771 1.00 31.54 C ATOM 0 H LEU B 49 19.223 -0.881 12.135 1.00 25.52 H new ATOM 0 HA LEU B 49 19.449 -1.383 14.879 1.00 12.42 H new ATOM 0 HB2 LEU B 49 21.202 -0.848 13.063 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.812 0.838 13.336 1.00 25.41 H new ATOM 0 HG LEU B 49 22.863 0.020 14.504 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.401 1.121 16.657 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.742 2.034 15.279 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.658 1.063 16.304 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.590 -1.324 16.572 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.862 -1.526 16.199 1.00 31.54 H new ATOM 0 HD23 LEU B 49 22.093 -2.226 15.121 1.00 31.54 H new ATOM 2728 N PHE B 50 18.323 1.647 14.156 1.00 74.53 N ATOM 2729 CA PHE B 50 17.561 2.767 14.714 1.00 13.24 C ATOM 2730 C PHE B 50 16.181 2.301 15.184 1.00 54.12 C ATOM 2731 O PHE B 50 15.725 2.693 16.252 1.00 20.22 O ATOM 2732 CB PHE B 50 17.428 3.905 13.689 1.00 14.34 C ATOM 2733 CG PHE B 50 16.387 4.955 14.042 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.590 5.868 15.078 1.00 53.13 C ATOM 2735 CD2 PHE B 50 15.202 5.030 13.323 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.633 6.820 15.379 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.245 5.980 13.625 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.458 6.873 14.654 1.00 62.30 C ATOM 0 H PHE B 50 18.554 1.742 13.167 1.00 74.53 H new ATOM 0 HA PHE B 50 18.106 3.150 15.577 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.396 4.394 13.581 1.00 14.34 H new ATOM 0 HB3 PHE B 50 17.178 3.475 12.719 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.505 5.831 15.651 1.00 53.13 H new ATOM 0 HD2 PHE B 50 15.025 4.335 12.515 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.804 7.522 16.181 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.329 6.023 13.054 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.708 7.612 14.893 1.00 62.30 H new ATOM 2748 N ALA B 51 15.526 1.463 14.382 1.00 24.13 N ATOM 2749 CA ALA B 51 14.197 0.938 14.719 1.00 31.22 C ATOM 2750 C ALA B 51 14.197 0.226 16.073 1.00 63.22 C ATOM 2751 O ALA B 51 13.391 0.540 16.952 1.00 61.14 O ATOM 2752 CB ALA B 51 13.715 -0.014 13.629 1.00 4.33 C ATOM 0 H ALA B 51 15.893 1.130 13.490 1.00 24.13 H new ATOM 0 HA ALA B 51 13.515 1.785 14.787 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.728 -0.397 13.890 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.658 0.519 12.680 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.414 -0.845 13.537 1.00 4.33 H new ATOM 2758 N ALA B 52 15.108 -0.728 16.236 1.00 2.41 N ATOM 2759 CA ALA B 52 15.221 -1.497 17.473 1.00 55.02 C ATOM 2760 C ALA B 52 15.578 -0.588 18.645 1.00 53.11 C ATOM 2761 O ALA B 52 14.902 -0.590 19.683 1.00 74.31 O ATOM 2762 CB ALA B 52 16.264 -2.599 17.316 1.00 43.35 C ATOM 0 H ALA B 52 15.786 -0.990 15.520 1.00 2.41 H new ATOM 0 HA ALA B 52 14.255 -1.957 17.682 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.338 -3.165 18.245 1.00 43.35 H new ATOM 0 HB2 ALA B 52 15.968 -3.267 16.507 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.231 -2.154 17.084 1.00 43.35 H new ATOM 2768 N GLY B 53 16.637 0.199 18.463 1.00 41.34 N ATOM 2769 CA GLY B 53 17.080 1.107 19.505 1.00 4.13 C ATOM 2770 C GLY B 53 15.991 2.074 19.923 1.00 15.42 C ATOM 2771 O GLY B 53 15.800 2.327 21.107 1.00 73.22 O ATOM 0 H GLY B 53 17.196 0.223 17.610 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.405 0.532 20.372 1.00 4.13 H new ATOM 0 HA3 GLY B 53 17.946 1.668 19.152 1.00 4.13 H new ATOM 2775 N TYR B 54 15.268 2.592 18.938 1.00 15.35 N ATOM 2776 CA TYR B 54 14.187 3.541 19.166 1.00 21.24 C ATOM 2777 C TYR B 54 13.020 2.879 19.900 1.00 2.44 C ATOM 2778 O TYR B 54 12.540 3.404 20.906 1.00 55.40 O ATOM 2779 CB TYR B 54 13.725 4.131 17.821 1.00 22.10 C ATOM 2780 CG TYR B 54 12.458 4.968 17.884 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.145 5.724 19.009 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.576 4.997 16.811 1.00 20.22 C ATOM 2783 CE1 TYR B 54 10.991 6.478 19.062 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.423 5.752 16.857 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.134 6.488 17.984 1.00 15.31 C ATOM 2786 OH TYR B 54 8.982 7.235 18.035 1.00 73.14 O ATOM 0 H TYR B 54 15.416 2.364 17.955 1.00 15.35 H new ATOM 0 HA TYR B 54 14.556 4.348 19.799 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.529 4.747 17.417 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.567 3.313 17.119 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.817 5.721 19.855 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.797 4.419 15.926 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.761 7.057 19.944 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.750 5.766 16.013 1.00 11.21 H new ATOM 0 HH TYR B 54 9.203 8.185 17.937 1.00 73.14 H new ATOM 2796 N SER B 55 12.571 1.732 19.402 1.00 62.44 N ATOM 2797 CA SER B 55 11.429 1.039 19.995 1.00 11.44 C ATOM 2798 C SER B 55 11.700 0.722 21.467 1.00 45.34 C ATOM 2799 O SER B 55 10.839 0.930 22.324 1.00 23.33 O ATOM 2800 CB SER B 55 11.105 -0.238 19.204 1.00 71.55 C ATOM 2801 OG SER B 55 12.249 -1.060 19.057 1.00 22.42 O ATOM 0 H SER B 55 12.977 1.263 18.593 1.00 62.44 H new ATOM 0 HA SER B 55 10.560 1.695 19.947 1.00 11.44 H new ATOM 0 HB2 SER B 55 10.319 -0.794 19.715 1.00 71.55 H new ATOM 0 HB3 SER B 55 10.719 0.030 18.220 1.00 71.55 H new ATOM 0 HG SER B 55 13.047 -0.563 19.336 1.00 22.42 H new ATOM 2807 N ALA B 56 12.912 0.249 21.751 1.00 72.32 N ATOM 2808 CA ALA B 56 13.326 -0.019 23.125 1.00 72.14 C ATOM 2809 C ALA B 56 13.475 1.290 23.906 1.00 34.31 C ATOM 2810 O ALA B 56 13.005 1.408 25.038 1.00 51.54 O ATOM 2811 CB ALA B 56 14.631 -0.807 23.136 1.00 11.32 C ATOM 0 H ALA B 56 13.623 0.044 21.049 1.00 72.32 H new ATOM 0 HA ALA B 56 12.557 -0.618 23.612 1.00 72.14 H new ATOM 0 HB1 ALA B 56 14.930 -1.001 24.166 1.00 11.32 H new ATOM 0 HB2 ALA B 56 14.489 -1.754 22.615 1.00 11.32 H new ATOM 0 HB3 ALA B 56 15.408 -0.230 22.635 1.00 11.32 H new ATOM 2817 N CYS B 57 14.107 2.278 23.271 1.00 24.02 N ATOM 2818 CA CYS B 57 14.344 3.585 23.886 1.00 54.22 C ATOM 2819 C CYS B 57 13.032 4.233 24.309 1.00 22.14 C ATOM 2820 O CYS B 57 12.973 4.934 25.322 1.00 1.03 O ATOM 2821 CB CYS B 57 15.098 4.516 22.925 1.00 72.40 C ATOM 2822 SG CYS B 57 15.477 6.146 23.614 1.00 42.35 S ATOM 0 H CYS B 57 14.468 2.196 22.320 1.00 24.02 H new ATOM 0 HA CYS B 57 14.958 3.425 24.772 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.029 4.035 22.627 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.503 4.646 22.021 1.00 72.40 H new ATOM 0 HG CYS B 57 14.662 6.403 24.594 1.00 42.35 H new ATOM 2828 N PHE B 58 11.986 4.021 23.511 1.00 34.03 N ATOM 2829 CA PHE B 58 10.684 4.616 23.775 1.00 42.11 C ATOM 2830 C PHE B 58 10.195 4.204 25.163 1.00 1.15 C ATOM 2831 O PHE B 58 9.543 4.980 25.865 1.00 52.32 O ATOM 2832 CB PHE B 58 9.682 4.181 22.696 1.00 13.13 C ATOM 2833 CG PHE B 58 8.416 4.997 22.683 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.294 4.585 23.387 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.353 6.183 21.966 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.137 5.339 23.377 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.198 6.940 21.954 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.090 6.518 22.660 1.00 52.03 C ATOM 0 H PHE B 58 12.019 3.439 22.674 1.00 34.03 H new ATOM 0 HA PHE B 58 10.772 5.702 23.748 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.160 4.252 21.719 1.00 13.13 H new ATOM 0 HB3 PHE B 58 9.427 3.133 22.851 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.326 3.664 23.950 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.217 6.518 21.411 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.270 5.007 23.929 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.162 7.862 21.392 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.187 7.110 22.652 1.00 52.03 H new ATOM 2848 N LEU B 59 10.543 2.982 25.556 1.00 60.43 N ATOM 2849 CA LEU B 59 10.193 2.460 26.870 1.00 11.12 C ATOM 2850 C LEU B 59 11.013 3.180 27.938 1.00 60.54 C ATOM 2851 O LEU B 59 10.478 3.584 28.969 1.00 64.41 O ATOM 2852 CB LEU B 59 10.425 0.936 26.911 1.00 33.41 C ATOM 2853 CG LEU B 59 9.838 0.182 28.125 1.00 23.42 C ATOM 2854 CD1 LEU B 59 9.714 -1.307 27.816 1.00 12.45 C ATOM 2855 CD2 LEU B 59 10.691 0.382 29.380 1.00 24.24 C ATOM 0 H LEU B 59 11.072 2.331 24.976 1.00 60.43 H new ATOM 0 HA LEU B 59 9.137 2.640 27.070 1.00 11.12 H new ATOM 0 HB2 LEU B 59 10.004 0.502 26.004 1.00 33.41 H new ATOM 0 HB3 LEU B 59 11.499 0.754 26.883 1.00 33.41 H new ATOM 0 HG LEU B 59 8.848 0.595 28.320 1.00 23.42 H new ATOM 0 HD11 LEU B 59 9.299 -1.825 28.681 1.00 12.45 H new ATOM 0 HD12 LEU B 59 9.056 -1.447 26.959 1.00 12.45 H new ATOM 0 HD13 LEU B 59 10.699 -1.714 27.587 1.00 12.45 H new ATOM 0 HD21 LEU B 59 10.247 -0.163 30.213 1.00 24.24 H new ATOM 0 HD22 LEU B 59 11.699 0.008 29.198 1.00 24.24 H new ATOM 0 HD23 LEU B 59 10.736 1.443 29.624 1.00 24.24 H new ATOM 2867 N SER B 60 12.306 3.345 27.673 1.00 44.21 N ATOM 2868 CA SER B 60 13.207 4.063 28.575 1.00 2.40 C ATOM 2869 C SER B 60 12.672 5.475 28.848 1.00 73.23 C ATOM 2870 O SER B 60 12.610 5.932 30.000 1.00 65.55 O ATOM 2871 CB SER B 60 14.602 4.136 27.942 1.00 63.24 C ATOM 2872 OG SER B 60 14.921 2.917 27.291 1.00 24.13 O ATOM 0 H SER B 60 12.759 2.987 26.832 1.00 44.21 H new ATOM 0 HA SER B 60 13.268 3.531 29.524 1.00 2.40 H new ATOM 0 HB2 SER B 60 14.640 4.957 27.226 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.345 4.349 28.711 1.00 63.24 H new ATOM 0 HG SER B 60 15.709 2.516 27.714 1.00 24.13 H new ATOM 2878 N ALA B 61 12.264 6.150 27.774 1.00 21.42 N ATOM 2879 CA ALA B 61 11.687 7.484 27.868 1.00 31.00 C ATOM 2880 C ALA B 61 10.419 7.446 28.710 1.00 42.41 C ATOM 2881 O ALA B 61 10.258 8.234 29.642 1.00 44.10 O ATOM 2882 CB ALA B 61 11.390 8.038 26.477 1.00 4.34 C ATOM 0 H ALA B 61 12.325 5.788 26.822 1.00 21.42 H new ATOM 0 HA ALA B 61 12.408 8.144 28.351 1.00 31.00 H new ATOM 0 HB1 ALA B 61 10.959 9.035 26.567 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.314 8.092 25.902 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.684 7.382 25.967 1.00 4.34 H new ATOM 2888 N MET B 62 9.534 6.506 28.386 1.00 64.12 N ATOM 2889 CA MET B 62 8.295 6.318 29.138 1.00 62.41 C ATOM 2890 C MET B 62 8.586 5.887 30.573 1.00 51.11 C ATOM 2891 O MET B 62 7.750 6.062 31.457 1.00 53.32 O ATOM 2892 CB MET B 62 7.385 5.290 28.448 1.00 4.11 C ATOM 2893 CG MET B 62 6.624 5.842 27.249 1.00 71.00 C ATOM 2894 SD MET B 62 5.528 7.209 27.694 1.00 51.43 S ATOM 2895 CE MET B 62 4.549 6.466 29.005 1.00 33.40 C ATOM 0 H MET B 62 9.652 5.861 27.605 1.00 64.12 H new ATOM 0 HA MET B 62 7.776 7.276 29.165 1.00 62.41 H new ATOM 0 HB2 MET B 62 7.991 4.444 28.123 1.00 4.11 H new ATOM 0 HB3 MET B 62 6.669 4.908 29.175 1.00 4.11 H new ATOM 0 HG2 MET B 62 7.335 6.181 26.496 1.00 71.00 H new ATOM 0 HG3 MET B 62 6.037 5.043 26.796 1.00 71.00 H new ATOM 0 HE1 MET B 62 3.550 6.902 29.005 1.00 33.40 H new ATOM 0 HE2 MET B 62 4.476 5.391 28.840 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.026 6.654 29.967 1.00 33.40 H new ATOM 2905 N LYS B 63 9.764 5.312 30.800 1.00 72.03 N ATOM 2906 CA LYS B 63 10.185 4.927 32.144 1.00 43.00 C ATOM 2907 C LYS B 63 10.508 6.175 32.958 1.00 70.35 C ATOM 2908 O LYS B 63 10.090 6.302 34.111 1.00 23.43 O ATOM 2909 CB LYS B 63 11.388 3.967 32.087 1.00 31.31 C ATOM 2910 CG LYS B 63 11.977 3.612 33.454 1.00 20.13 C ATOM 2911 CD LYS B 63 12.842 2.348 33.401 1.00 10.22 C ATOM 2912 CE LYS B 63 13.983 2.456 32.391 1.00 1.23 C ATOM 2913 NZ LYS B 63 15.014 3.455 32.791 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.445 5.102 30.070 1.00 72.03 H new ATOM 0 HA LYS B 63 9.369 4.396 32.634 1.00 43.00 H new ATOM 0 HB2 LYS B 63 11.081 3.048 31.587 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.169 4.418 31.474 1.00 31.31 H new ATOM 0 HG2 LYS B 63 12.578 4.446 33.817 1.00 20.13 H new ATOM 0 HG3 LYS B 63 11.168 3.467 34.170 1.00 20.13 H new ATOM 0 HD2 LYS B 63 13.256 2.154 34.391 1.00 10.22 H new ATOM 0 HD3 LYS B 63 12.215 1.494 33.145 1.00 10.22 H new ATOM 0 HE2 LYS B 63 14.454 1.480 32.276 1.00 1.23 H new ATOM 0 HE3 LYS B 63 13.576 2.730 31.418 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 15.737 3.524 32.047 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 14.565 4.383 32.924 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 15.461 3.155 33.681 1.00 55.13 H new ATOM 2927 N PHE B 64 11.235 7.107 32.344 1.00 21.33 N ATOM 2928 CA PHE B 64 11.500 8.401 32.974 1.00 32.24 C ATOM 2929 C PHE B 64 10.187 9.163 33.181 1.00 14.21 C ATOM 2930 O PHE B 64 9.965 9.778 34.227 1.00 73.11 O ATOM 2931 CB PHE B 64 12.476 9.239 32.130 1.00 30.41 C ATOM 2932 CG PHE B 64 12.728 10.620 32.691 1.00 63.34 C ATOM 2933 CD1 PHE B 64 13.223 10.780 33.979 1.00 43.42 C ATOM 2934 CD2 PHE B 64 12.464 11.758 31.936 1.00 31.33 C ATOM 2935 CE1 PHE B 64 13.448 12.041 34.499 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.689 13.018 32.454 1.00 33.41 C ATOM 2937 CZ PHE B 64 13.179 13.161 33.736 1.00 14.04 C ATOM 0 H PHE B 64 11.648 6.993 31.419 1.00 21.33 H new ATOM 0 HA PHE B 64 11.964 8.220 33.944 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.425 8.708 32.053 1.00 30.41 H new ATOM 0 HB3 PHE B 64 12.080 9.333 31.119 1.00 30.41 H new ATOM 0 HD1 PHE B 64 13.435 9.909 34.581 1.00 43.42 H new ATOM 0 HD2 PHE B 64 12.078 11.655 30.932 1.00 31.33 H new ATOM 0 HE1 PHE B 64 13.834 12.151 35.502 1.00 55.11 H new ATOM 0 HE2 PHE B 64 12.481 13.892 31.855 1.00 33.41 H new ATOM 0 HZ PHE B 64 13.352 14.147 34.142 1.00 14.04 H new ATOM 2947 N VAL B 65 9.321 9.106 32.170 1.00 75.05 N ATOM 2948 CA VAL B 65 7.999 9.726 32.237 1.00 40.30 C ATOM 2949 C VAL B 65 7.190 9.145 33.394 1.00 43.44 C ATOM 2950 O VAL B 65 6.630 9.880 34.207 1.00 35.52 O ATOM 2951 CB VAL B 65 7.214 9.530 30.911 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.737 9.888 31.086 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.844 10.353 29.786 1.00 51.21 C ATOM 0 H VAL B 65 9.514 8.632 31.288 1.00 75.05 H new ATOM 0 HA VAL B 65 8.149 10.793 32.399 1.00 40.30 H new ATOM 0 HB VAL B 65 7.271 8.476 30.638 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.213 9.741 30.142 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.295 9.248 31.850 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.649 10.931 31.391 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.280 10.202 28.865 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.826 11.409 30.054 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.876 10.034 29.636 1.00 51.21 H new ATOM 2963 N ALA B 66 7.155 7.823 33.472 1.00 30.22 N ATOM 2964 CA ALA B 66 6.404 7.129 34.511 1.00 74.13 C ATOM 2965 C ALA B 66 6.860 7.581 35.897 1.00 44.35 C ATOM 2966 O ALA B 66 6.059 7.679 36.830 1.00 34.23 O ATOM 2967 CB ALA B 66 6.563 5.622 34.349 1.00 23.44 C ATOM 0 H ALA B 66 7.642 7.204 32.823 1.00 30.22 H new ATOM 0 HA ALA B 66 5.348 7.379 34.409 1.00 74.13 H new ATOM 0 HB1 ALA B 66 5.999 5.111 35.129 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.187 5.319 33.372 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.617 5.357 34.430 1.00 23.44 H new ATOM 2973 N GLY B 67 8.146 7.903 35.998 1.00 23.35 N ATOM 2974 CA GLY B 67 8.729 8.324 37.263 1.00 73.24 C ATOM 2975 C GLY B 67 8.192 9.663 37.735 1.00 45.13 C ATOM 2976 O GLY B 67 8.054 9.902 38.936 1.00 75.04 O ATOM 0 H GLY B 67 8.803 7.880 35.218 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.527 7.568 38.022 1.00 73.24 H new ATOM 0 HA3 GLY B 67 9.812 8.388 37.157 1.00 73.24 H new ATOM 2980 N GLN B 68 7.869 10.535 36.782 1.00 2.12 N ATOM 2981 CA GLN B 68 7.352 11.869 37.091 1.00 44.13 C ATOM 2982 C GLN B 68 5.832 11.865 36.990 1.00 40.32 C ATOM 2983 O GLN B 68 5.156 12.797 37.425 1.00 64.50 O ATOM 2984 CB GLN B 68 7.957 12.914 36.141 1.00 33.05 C ATOM 2985 CG GLN B 68 7.844 12.551 34.667 1.00 52.44 C ATOM 2986 CD GLN B 68 8.324 13.657 33.746 1.00 54.32 C ATOM 2987 OE1 GLN B 68 7.548 14.516 33.324 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.611 13.647 33.433 1.00 53.21 N ATOM 0 H GLN B 68 7.956 10.341 35.784 1.00 2.12 H new ATOM 0 HA GLN B 68 7.637 12.135 38.109 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.462 13.871 36.308 1.00 33.05 H new ATOM 0 HB3 GLN B 68 9.009 13.051 36.391 1.00 33.05 H new ATOM 0 HG2 GLN B 68 8.424 11.648 34.475 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.805 12.317 34.435 1.00 52.44 H new ATOM 0 HE21 GLN B 68 10.220 12.918 33.804 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.993 14.369 32.821 1.00 53.21 H new ATOM 2997 N ASN B 69 5.306 10.793 36.409 1.00 21.43 N ATOM 2998 CA ASN B 69 3.865 10.599 36.272 1.00 41.54 C ATOM 2999 C ASN B 69 3.322 9.749 37.420 1.00 23.00 C ATOM 3000 O ASN B 69 2.125 9.464 37.485 1.00 34.41 O ATOM 3001 CB ASN B 69 3.546 9.944 34.921 1.00 65.13 C ATOM 3002 CG ASN B 69 3.587 10.917 33.749 1.00 21.52 C ATOM 3003 OD1 ASN B 69 4.470 11.905 33.810 1.00 65.21 O flip ATOM 3004 ND2 ASN B 69 2.841 10.769 32.783 1.00 45.52 N flip ATOM 0 H ASN B 69 5.865 10.034 36.020 1.00 21.43 H new ATOM 0 HA ASN B 69 3.379 11.574 36.312 1.00 41.54 H new ATOM 0 HB2 ASN B 69 4.258 9.139 34.740 1.00 65.13 H new ATOM 0 HB3 ASN B 69 2.557 9.489 34.971 1.00 65.13 H new ATOM 0 HD21 ASN B 69 2.173 9.998 32.768 1.00 45.52 H new ATOM 0 HD22 ASN B 69 2.890 11.417 31.997 1.00 45.52 H new ATOM 3011 N LYS B 70 4.223 9.342 38.317 1.00 4.22 N ATOM 3012 CA LYS B 70 3.867 8.599 39.528 1.00 71.04 C ATOM 3013 C LYS B 70 3.243 7.240 39.199 1.00 55.13 C ATOM 3014 O LYS B 70 2.523 6.660 40.014 1.00 71.33 O ATOM 3015 CB LYS B 70 2.922 9.429 40.421 1.00 43.15 C ATOM 3016 CG LYS B 70 3.622 10.508 41.250 1.00 61.50 C ATOM 3017 CD LYS B 70 4.594 11.342 40.418 1.00 21.25 C ATOM 3018 CE LYS B 70 4.993 12.636 41.119 1.00 20.34 C ATOM 3019 NZ LYS B 70 5.735 12.387 42.384 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.223 9.519 38.224 1.00 4.22 H new ATOM 0 HA LYS B 70 4.790 8.412 40.077 1.00 71.04 H new ATOM 0 HB2 LYS B 70 2.170 9.903 39.791 1.00 43.15 H new ATOM 0 HB3 LYS B 70 2.394 8.755 41.096 1.00 43.15 H new ATOM 0 HG2 LYS B 70 2.873 11.164 41.695 1.00 61.50 H new ATOM 0 HG3 LYS B 70 4.162 10.038 42.072 1.00 61.50 H new ATOM 0 HD2 LYS B 70 5.488 10.754 40.210 1.00 21.25 H new ATOM 0 HD3 LYS B 70 4.137 11.578 39.457 1.00 21.25 H new ATOM 0 HE2 LYS B 70 5.611 13.234 40.449 1.00 20.34 H new ATOM 0 HE3 LYS B 70 4.099 13.221 41.334 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 5.985 13.295 42.824 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 5.137 11.839 43.035 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 6.603 11.852 42.178 1.00 73.12 H new ATOM 3033 N GLN B 71 3.556 6.723 38.017 1.00 41.03 N ATOM 3034 CA GLN B 71 3.012 5.444 37.554 1.00 14.44 C ATOM 3035 C GLN B 71 4.136 4.437 37.322 1.00 73.31 C ATOM 3036 O GLN B 71 5.315 4.790 37.351 1.00 34.15 O ATOM 3037 CB GLN B 71 2.204 5.629 36.260 1.00 1.40 C ATOM 3038 CG GLN B 71 2.965 6.371 35.167 1.00 33.32 C ATOM 3039 CD GLN B 71 2.584 5.933 33.769 1.00 34.04 C ATOM 3040 OE1 GLN B 71 1.633 6.433 33.176 1.00 74.24 O ATOM 3041 NE2 GLN B 71 3.362 5.017 33.228 1.00 0.43 N ATOM 0 H GLN B 71 4.189 7.171 37.354 1.00 41.03 H new ATOM 0 HA GLN B 71 2.347 5.062 38.329 1.00 14.44 H new ATOM 0 HB2 GLN B 71 1.907 4.650 35.884 1.00 1.40 H new ATOM 0 HB3 GLN B 71 1.288 6.174 36.488 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.781 7.441 35.268 1.00 33.32 H new ATOM 0 HG3 GLN B 71 4.035 6.217 35.310 1.00 33.32 H new ATOM 0 HE21 GLN B 71 4.141 4.630 33.761 1.00 0.43 H new ATOM 0 HE22 GLN B 71 3.185 4.695 32.277 1.00 0.43 H new ATOM 3050 N THR B 72 3.758 3.182 37.109 1.00 1.35 N ATOM 3051 CA THR B 72 4.707 2.119 36.799 1.00 51.41 C ATOM 3052 C THR B 72 4.290 1.405 35.514 1.00 74.12 C ATOM 3053 O THR B 72 3.099 1.201 35.267 1.00 25.05 O ATOM 3054 CB THR B 72 4.805 1.097 37.958 1.00 13.02 C ATOM 3055 OG1 THR B 72 3.490 0.727 38.395 1.00 4.22 O ATOM 3056 CG2 THR B 72 5.592 1.664 39.136 1.00 71.50 C ATOM 0 H THR B 72 2.787 2.873 37.146 1.00 1.35 H new ATOM 0 HA THR B 72 5.688 2.573 36.662 1.00 51.41 H new ATOM 0 HB THR B 72 5.332 0.219 37.586 1.00 13.02 H new ATOM 0 HG1 THR B 72 3.559 0.079 39.127 1.00 4.22 H new ATOM 0 HG21 THR B 72 5.642 0.921 39.932 1.00 71.50 H new ATOM 0 HG22 THR B 72 6.602 1.916 38.811 1.00 71.50 H new ATOM 0 HG23 THR B 72 5.096 2.561 39.507 1.00 71.50 H new ATOM 3064 N LEU B 73 5.267 1.049 34.690 1.00 74.12 N ATOM 3065 CA LEU B 73 5.002 0.379 33.423 1.00 52.35 C ATOM 3066 C LEU B 73 5.148 -1.134 33.579 1.00 64.24 C ATOM 3067 O LEU B 73 6.072 -1.601 34.247 1.00 14.14 O ATOM 3068 CB LEU B 73 5.965 0.898 32.347 1.00 75.15 C ATOM 3069 CG LEU B 73 5.803 2.381 31.974 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.927 2.826 31.044 1.00 33.12 C ATOM 3071 CD2 LEU B 73 4.440 2.632 31.329 1.00 51.14 C ATOM 0 H LEU B 73 6.256 1.214 34.878 1.00 74.12 H new ATOM 0 HA LEU B 73 3.979 0.596 33.117 1.00 52.35 H new ATOM 0 HB2 LEU B 73 6.987 0.737 32.691 1.00 75.15 H new ATOM 0 HB3 LEU B 73 5.833 0.298 31.446 1.00 75.15 H new ATOM 0 HG LEU B 73 5.860 2.971 32.889 1.00 62.34 H new ATOM 0 HD11 LEU B 73 6.795 3.878 30.791 1.00 33.12 H new ATOM 0 HD12 LEU B 73 7.887 2.690 31.542 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.903 2.228 30.133 1.00 33.12 H new ATOM 0 HD21 LEU B 73 4.347 3.688 31.073 1.00 51.14 H new ATOM 0 HD22 LEU B 73 4.349 2.030 30.425 1.00 51.14 H new ATOM 0 HD23 LEU B 73 3.650 2.357 32.028 1.00 51.14 H new ATOM 3083 N PRO B 74 4.229 -1.917 32.978 1.00 22.31 N ATOM 3084 CA PRO B 74 4.296 -3.386 33.009 1.00 33.15 C ATOM 3085 C PRO B 74 5.578 -3.916 32.367 1.00 51.21 C ATOM 3086 O PRO B 74 5.935 -3.514 31.262 1.00 62.01 O ATOM 3087 CB PRO B 74 3.075 -3.823 32.186 1.00 23.12 C ATOM 3088 CG PRO B 74 2.156 -2.647 32.203 1.00 12.13 C ATOM 3089 CD PRO B 74 3.047 -1.437 32.240 1.00 51.43 C ATOM 0 HA PRO B 74 4.298 -3.770 34.029 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.360 -4.087 31.167 1.00 23.12 H new ATOM 0 HB3 PRO B 74 2.599 -4.702 32.622 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.517 -2.636 31.320 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.498 -2.676 33.072 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.308 -1.097 31.238 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.568 -0.599 32.746 1.00 51.43 H new ATOM 3097 N ALA B 75 6.258 -4.827 33.056 1.00 24.41 N ATOM 3098 CA ALA B 75 7.532 -5.361 32.578 1.00 71.53 C ATOM 3099 C ALA B 75 7.336 -6.397 31.466 1.00 71.01 C ATOM 3100 O ALA B 75 8.277 -6.740 30.750 1.00 12.42 O ATOM 3101 CB ALA B 75 8.322 -5.963 33.737 1.00 50.55 C ATOM 0 H ALA B 75 5.949 -5.212 33.948 1.00 24.41 H new ATOM 0 HA ALA B 75 8.099 -4.532 32.154 1.00 71.53 H new ATOM 0 HB1 ALA B 75 9.268 -6.357 33.366 1.00 50.55 H new ATOM 0 HB2 ALA B 75 8.517 -5.193 34.483 1.00 50.55 H new ATOM 0 HB3 ALA B 75 7.746 -6.770 34.190 1.00 50.55 H new ATOM 3107 N ASP B 76 6.110 -6.891 31.324 1.00 24.20 N ATOM 3108 CA ASP B 76 5.800 -7.919 30.323 1.00 60.22 C ATOM 3109 C ASP B 76 5.504 -7.292 28.953 1.00 14.12 C ATOM 3110 O ASP B 76 5.156 -7.988 27.996 1.00 34.13 O ATOM 3111 CB ASP B 76 4.609 -8.765 30.805 1.00 21.51 C ATOM 3112 CG ASP B 76 4.252 -9.897 29.852 1.00 33.51 C ATOM 3113 OD1 ASP B 76 5.116 -10.763 29.596 1.00 23.44 O ATOM 3114 OD2 ASP B 76 3.101 -9.941 29.369 1.00 41.11 O1- ATOM 0 H ASP B 76 5.311 -6.599 31.887 1.00 24.20 H new ATOM 0 HA ASP B 76 6.671 -8.563 30.204 1.00 60.22 H new ATOM 0 HB2 ASP B 76 4.842 -9.183 31.784 1.00 21.51 H new ATOM 0 HB3 ASP B 76 3.741 -8.119 30.932 1.00 21.51 H new ATOM 3119 N THR B 77 5.672 -5.978 28.856 1.00 44.41 N ATOM 3120 CA THR B 77 5.352 -5.244 27.635 1.00 1.21 C ATOM 3121 C THR B 77 6.411 -5.471 26.550 1.00 31.44 C ATOM 3122 O THR B 77 7.547 -5.862 26.841 1.00 72.52 O ATOM 3123 CB THR B 77 5.207 -3.733 27.927 1.00 44.03 C ATOM 3124 OG1 THR B 77 4.747 -3.032 26.764 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.528 -3.128 28.388 1.00 30.02 C ATOM 0 H THR B 77 6.030 -5.395 29.613 1.00 44.41 H new ATOM 0 HA THR B 77 4.400 -5.625 27.265 1.00 1.21 H new ATOM 0 HB THR B 77 4.474 -3.628 28.727 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.175 -3.623 26.231 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.392 -2.065 28.585 1.00 30.02 H new ATOM 0 HG22 THR B 77 6.858 -3.627 29.299 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.280 -3.260 27.610 1.00 30.02 H new ATOM 3133 N THR B 78 6.018 -5.234 25.298 1.00 70.31 N ATOM 3134 CA THR B 78 6.903 -5.400 24.152 1.00 64.53 C ATOM 3135 C THR B 78 6.515 -4.419 23.039 1.00 71.23 C ATOM 3136 O THR B 78 5.340 -4.070 22.896 1.00 64.44 O ATOM 3137 CB THR B 78 6.811 -6.848 23.600 1.00 53.44 C ATOM 3138 OG1 THR B 78 6.858 -7.791 24.683 1.00 34.22 O ATOM 3139 CG2 THR B 78 7.943 -7.146 22.619 1.00 23.30 C ATOM 0 H THR B 78 5.078 -4.922 25.053 1.00 70.31 H new ATOM 0 HA THR B 78 7.923 -5.201 24.479 1.00 64.53 H new ATOM 0 HB THR B 78 5.864 -6.940 23.069 1.00 53.44 H new ATOM 0 HG1 THR B 78 6.798 -8.702 24.326 1.00 34.22 H new ATOM 0 HG21 THR B 78 7.847 -8.168 22.253 1.00 23.30 H new ATOM 0 HG22 THR B 78 7.889 -6.453 21.779 1.00 23.30 H new ATOM 0 HG23 THR B 78 8.902 -7.030 23.124 1.00 23.30 H new ATOM 3147 N VAL B 79 7.497 -3.984 22.255 1.00 22.45 N ATOM 3148 CA VAL B 79 7.255 -3.132 21.092 1.00 23.02 C ATOM 3149 C VAL B 79 7.980 -3.695 19.882 1.00 31.21 C ATOM 3150 O VAL B 79 9.192 -3.883 19.910 1.00 14.34 O ATOM 3151 CB VAL B 79 7.720 -1.670 21.320 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.584 -0.844 20.038 1.00 1.41 C ATOM 3153 CG2 VAL B 79 6.927 -1.027 22.446 1.00 54.24 C ATOM 0 H VAL B 79 8.480 -4.210 22.406 1.00 22.45 H new ATOM 0 HA VAL B 79 6.178 -3.120 20.925 1.00 23.02 H new ATOM 0 HB VAL B 79 8.773 -1.693 21.602 1.00 21.11 H new ATOM 0 HG11 VAL B 79 7.917 0.177 20.226 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.197 -1.287 19.253 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.541 -0.833 19.721 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.267 -0.002 22.591 1.00 54.24 H new ATOM 0 HG22 VAL B 79 5.868 -1.025 22.190 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.077 -1.593 23.366 1.00 54.24 H new ATOM 3163 N THR B 80 7.243 -3.972 18.822 1.00 72.42 N ATOM 3164 CA THR B 80 7.844 -4.535 17.620 1.00 23.21 C ATOM 3165 C THR B 80 7.914 -3.490 16.506 1.00 63.22 C ATOM 3166 O THR B 80 6.888 -3.076 15.965 1.00 42.43 O ATOM 3167 CB THR B 80 7.070 -5.782 17.134 1.00 22.40 C ATOM 3168 OG1 THR B 80 6.889 -6.696 18.230 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.828 -6.485 16.011 1.00 64.25 C ATOM 0 H THR B 80 6.236 -3.819 18.765 1.00 72.42 H new ATOM 0 HA THR B 80 8.858 -4.843 17.875 1.00 23.21 H new ATOM 0 HB THR B 80 6.100 -5.460 16.755 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.397 -7.485 17.920 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.265 -7.360 15.684 1.00 64.25 H new ATOM 0 HG22 THR B 80 7.953 -5.800 15.172 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.807 -6.798 16.373 1.00 64.25 H new ATOM 3177 N ALA B 81 9.130 -3.055 16.191 1.00 41.34 N ATOM 3178 CA ALA B 81 9.366 -2.088 15.127 1.00 73.43 C ATOM 3179 C ALA B 81 9.756 -2.807 13.841 1.00 13.31 C ATOM 3180 O ALA B 81 10.772 -3.499 13.797 1.00 32.14 O ATOM 3181 CB ALA B 81 10.463 -1.109 15.539 1.00 31.52 C ATOM 0 H ALA B 81 9.978 -3.363 16.666 1.00 41.34 H new ATOM 0 HA ALA B 81 8.447 -1.529 14.950 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.631 -0.391 14.736 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.158 -0.579 16.441 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.385 -1.657 15.734 1.00 31.52 H new ATOM 3187 N GLU B 82 8.947 -2.653 12.804 1.00 50.12 N ATOM 3188 CA GLU B 82 9.219 -3.276 11.516 1.00 53.10 C ATOM 3189 C GLU B 82 9.330 -2.192 10.447 1.00 51.21 C ATOM 3190 O GLU B 82 8.331 -1.576 10.062 1.00 13.21 O ATOM 3191 CB GLU B 82 8.123 -4.298 11.166 1.00 51.24 C ATOM 3192 CG GLU B 82 8.435 -5.130 9.928 1.00 31.41 C ATOM 3193 CD GLU B 82 7.456 -6.277 9.713 1.00 63.34 C ATOM 3194 OE1 GLU B 82 6.513 -6.126 8.907 1.00 35.34 O ATOM 3195 OE2 GLU B 82 7.638 -7.345 10.337 1.00 71.23 O1- ATOM 0 H GLU B 82 8.091 -2.098 12.829 1.00 50.12 H new ATOM 0 HA GLU B 82 10.164 -3.818 11.566 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.977 -4.966 12.015 1.00 51.24 H new ATOM 0 HB3 GLU B 82 7.182 -3.770 11.011 1.00 51.24 H new ATOM 0 HG2 GLU B 82 8.424 -4.483 9.051 1.00 31.41 H new ATOM 0 HG3 GLU B 82 9.444 -5.533 10.014 1.00 31.41 H new ATOM 3202 N VAL B 83 10.552 -1.952 9.984 1.00 40.31 N ATOM 3203 CA VAL B 83 10.834 -0.841 9.078 1.00 71.44 C ATOM 3204 C VAL B 83 10.983 -1.326 7.643 1.00 35.11 C ATOM 3205 O VAL B 83 11.480 -2.425 7.394 1.00 1.44 O ATOM 3206 CB VAL B 83 12.116 -0.077 9.493 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.902 0.648 10.816 1.00 71.22 C ATOM 3208 CG2 VAL B 83 13.312 -1.028 9.582 1.00 51.35 C ATOM 0 H VAL B 83 11.369 -2.515 10.222 1.00 40.31 H new ATOM 0 HA VAL B 83 9.984 -0.161 9.142 1.00 71.44 H new ATOM 0 HB VAL B 83 12.333 0.667 8.726 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.813 1.179 11.091 1.00 71.22 H new ATOM 0 HG12 VAL B 83 11.084 1.361 10.712 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.656 -0.076 11.592 1.00 71.22 H new ATOM 0 HG21 VAL B 83 14.201 -0.469 9.875 1.00 51.35 H new ATOM 0 HG22 VAL B 83 13.108 -1.800 10.324 1.00 51.35 H new ATOM 0 HG23 VAL B 83 13.480 -1.493 8.611 1.00 51.35 H new ATOM 3218 N GLY B 84 10.557 -0.494 6.706 1.00 51.11 N ATOM 3219 CA GLY B 84 10.611 -0.842 5.305 1.00 52.45 C ATOM 3220 C GLY B 84 10.928 0.349 4.431 1.00 30.33 C ATOM 3221 O GLY B 84 10.874 1.495 4.880 1.00 4.21 O ATOM 0 H GLY B 84 10.169 0.430 6.897 1.00 51.11 H new ATOM 0 HA2 GLY B 84 11.367 -1.613 5.153 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.655 -1.269 5.002 1.00 52.45 H new ATOM 3225 N ILE B 85 11.257 0.067 3.184 1.00 72.33 N ATOM 3226 CA ILE B 85 11.596 1.080 2.201 1.00 70.35 C ATOM 3227 C ILE B 85 11.033 0.666 0.845 1.00 24.30 C ATOM 3228 O ILE B 85 11.132 -0.507 0.455 1.00 65.43 O ATOM 3229 CB ILE B 85 13.138 1.284 2.124 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.534 2.330 1.054 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.846 -0.048 1.871 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.720 1.768 -0.344 1.00 22.31 C ATOM 0 H ILE B 85 11.297 -0.885 2.820 1.00 72.33 H new ATOM 0 HA ILE B 85 11.156 2.032 2.498 1.00 70.35 H new ATOM 0 HB ILE B 85 13.462 1.674 3.089 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.767 3.104 1.021 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.461 2.813 1.363 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.922 0.116 1.821 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.622 -0.739 2.683 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.499 -0.471 0.928 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.996 2.572 -1.026 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.509 1.016 -0.332 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.789 1.312 -0.680 1.00 22.31 H new ATOM 3244 N GLY B 86 10.434 1.631 0.150 1.00 43.24 N ATOM 3245 CA GLY B 86 9.829 1.390 -1.152 1.00 50.02 C ATOM 3246 C GLY B 86 9.903 2.622 -2.038 1.00 52.30 C ATOM 3247 O GLY B 86 10.268 3.695 -1.559 1.00 42.02 O ATOM 0 H GLY B 86 10.356 2.595 0.474 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.336 0.558 -1.641 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.787 1.097 -1.021 1.00 50.02 H new ATOM 3251 N PRO B 87 9.576 2.501 -3.338 1.00 42.21 N ATOM 3252 CA PRO B 87 9.659 3.620 -4.283 1.00 30.25 C ATOM 3253 C PRO B 87 8.616 4.699 -3.986 1.00 61.30 C ATOM 3254 O PRO B 87 7.436 4.399 -3.765 1.00 52.32 O ATOM 3255 CB PRO B 87 9.391 2.970 -5.658 1.00 44.10 C ATOM 3256 CG PRO B 87 9.494 1.498 -5.424 1.00 14.42 C ATOM 3257 CD PRO B 87 9.084 1.284 -3.995 1.00 45.13 C ATOM 0 HA PRO B 87 10.623 4.126 -4.228 1.00 30.25 H new ATOM 0 HB2 PRO B 87 8.405 3.240 -6.036 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.118 3.302 -6.399 1.00 44.10 H new ATOM 0 HG2 PRO B 87 8.845 0.947 -6.104 1.00 14.42 H new ATOM 0 HG3 PRO B 87 10.510 1.144 -5.597 1.00 14.42 H new ATOM 0 HD2 PRO B 87 8.004 1.177 -3.894 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.534 0.385 -3.574 1.00 45.13 H new ATOM 3265 N ASN B 88 9.064 5.948 -3.969 1.00 53.24 N ATOM 3266 CA ASN B 88 8.180 7.092 -3.775 1.00 21.43 C ATOM 3267 C ASN B 88 7.744 7.621 -5.136 1.00 21.10 C ATOM 3268 O ASN B 88 8.547 7.673 -6.070 1.00 51.23 O ATOM 3269 CB ASN B 88 8.905 8.195 -2.981 1.00 72.30 C ATOM 3270 CG ASN B 88 7.992 9.336 -2.546 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.980 9.626 -3.183 1.00 5.32 O ATOM 3272 ND2 ASN B 88 8.359 10.008 -1.464 1.00 3.11 N ATOM 0 H ASN B 88 10.046 6.197 -4.089 1.00 53.24 H new ATOM 0 HA ASN B 88 7.302 6.782 -3.208 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.365 7.752 -2.098 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.712 8.600 -3.592 1.00 72.30 H new ATOM 0 HD21 ASN B 88 7.796 10.793 -1.136 1.00 3.11 H new ATOM 0 HD22 ASN B 88 9.204 9.740 -0.960 1.00 3.11 H new ATOM 3279 N GLU B 89 6.480 8.017 -5.244 1.00 65.22 N ATOM 3280 CA GLU B 89 5.923 8.518 -6.499 1.00 51.32 C ATOM 3281 C GLU B 89 6.611 9.816 -6.927 1.00 22.42 C ATOM 3282 O GLU B 89 6.506 10.242 -8.078 1.00 11.02 O ATOM 3283 CB GLU B 89 4.413 8.730 -6.350 1.00 62.31 C ATOM 3284 CG GLU B 89 4.033 9.681 -5.221 1.00 11.15 C ATOM 3285 CD GLU B 89 2.531 9.776 -5.026 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.972 8.930 -4.299 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.901 10.689 -5.603 1.00 35.35 O1- ATOM 0 H GLU B 89 5.815 8.001 -4.471 1.00 65.22 H new ATOM 0 HA GLU B 89 6.101 7.776 -7.278 1.00 51.32 H new ATOM 0 HB2 GLU B 89 4.016 9.118 -7.288 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.936 7.766 -6.176 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.496 9.344 -4.294 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.432 10.672 -5.435 1.00 11.15 H new ATOM 3294 N GLU B 90 7.325 10.427 -5.985 1.00 52.12 N ATOM 3295 CA GLU B 90 8.120 11.624 -6.249 1.00 15.12 C ATOM 3296 C GLU B 90 9.296 11.290 -7.176 1.00 74.05 C ATOM 3297 O GLU B 90 9.867 12.168 -7.827 1.00 53.12 O ATOM 3298 CB GLU B 90 8.626 12.202 -4.919 1.00 14.23 C ATOM 3299 CG GLU B 90 9.680 13.292 -5.071 1.00 30.33 C ATOM 3300 CD GLU B 90 10.151 13.854 -3.739 1.00 5.15 C ATOM 3301 OE1 GLU B 90 9.720 14.967 -3.374 1.00 54.43 O ATOM 3302 OE2 GLU B 90 10.958 13.188 -3.057 1.00 12.50 O1- ATOM 0 H GLU B 90 7.369 10.107 -5.018 1.00 52.12 H new ATOM 0 HA GLU B 90 7.499 12.368 -6.747 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.778 12.607 -4.366 1.00 14.23 H new ATOM 0 HB3 GLU B 90 9.041 11.392 -4.319 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.536 12.889 -5.612 1.00 30.33 H new ATOM 0 HG3 GLU B 90 9.273 14.101 -5.677 1.00 30.33 H new ATOM 3309 N GLY B 91 9.629 10.008 -7.245 1.00 72.20 N ATOM 3310 CA GLY B 91 10.729 9.547 -8.076 1.00 12.11 C ATOM 3311 C GLY B 91 11.960 9.212 -7.261 1.00 71.02 C ATOM 3312 O GLY B 91 13.085 9.284 -7.755 1.00 5.53 O ATOM 0 H GLY B 91 9.150 9.268 -6.733 1.00 72.20 H new ATOM 0 HA2 GLY B 91 10.415 8.666 -8.635 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.977 10.317 -8.807 1.00 12.11 H new ATOM 3316 N GLY B 92 11.740 8.830 -6.005 1.00 60.34 N ATOM 3317 CA GLY B 92 12.832 8.458 -5.122 1.00 61.32 C ATOM 3318 C GLY B 92 12.446 7.303 -4.222 1.00 12.52 C ATOM 3319 O GLY B 92 11.743 6.389 -4.653 1.00 70.13 O ATOM 0 H GLY B 92 10.815 8.771 -5.580 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.704 8.183 -5.715 1.00 61.32 H new ATOM 0 HA3 GLY B 92 13.118 9.316 -4.513 1.00 61.32 H new ATOM 3323 N PHE B 93 12.889 7.342 -2.971 1.00 71.13 N ATOM 3324 CA PHE B 93 12.546 6.309 -1.995 1.00 4.00 C ATOM 3325 C PHE B 93 11.628 6.873 -0.918 1.00 73.12 C ATOM 3326 O PHE B 93 11.558 8.088 -0.718 1.00 63.14 O ATOM 3327 CB PHE B 93 13.811 5.717 -1.350 1.00 42.41 C ATOM 3328 CG PHE B 93 14.641 4.870 -2.288 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.027 4.977 -2.308 1.00 72.40 C ATOM 3330 CD2 PHE B 93 14.031 3.963 -3.146 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.786 4.195 -3.161 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.787 3.180 -4.002 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.165 3.297 -4.010 1.00 20.53 C ATOM 0 H PHE B 93 13.490 8.081 -2.605 1.00 71.13 H new ATOM 0 HA PHE B 93 12.023 5.512 -2.523 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.428 6.531 -0.970 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.519 5.111 -0.492 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.517 5.679 -1.650 1.00 72.40 H new ATOM 0 HD2 PHE B 93 12.955 3.868 -3.145 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.862 4.286 -3.164 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.301 2.478 -4.663 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.755 2.688 -4.678 1.00 20.53 H new ATOM 3343 N ALA B 94 10.918 5.982 -0.244 1.00 22.42 N ATOM 3344 CA ALA B 94 10.032 6.342 0.853 1.00 62.21 C ATOM 3345 C ALA B 94 10.138 5.297 1.954 1.00 42.21 C ATOM 3346 O ALA B 94 10.164 4.094 1.675 1.00 61.15 O ATOM 3347 CB ALA B 94 8.592 6.465 0.362 1.00 43.22 C ATOM 0 H ALA B 94 10.940 4.982 -0.444 1.00 22.42 H new ATOM 0 HA ALA B 94 10.333 7.311 1.252 1.00 62.21 H new ATOM 0 HB1 ALA B 94 7.945 6.735 1.197 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.534 7.236 -0.406 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.267 5.512 -0.056 1.00 43.22 H new ATOM 3353 N LEU B 95 10.225 5.755 3.195 1.00 51.40 N ATOM 3354 CA LEU B 95 10.381 4.867 4.342 1.00 52.52 C ATOM 3355 C LEU B 95 9.037 4.596 5.007 1.00 31.45 C ATOM 3356 O LEU B 95 8.139 5.441 4.997 1.00 74.21 O ATOM 3357 CB LEU B 95 11.375 5.463 5.357 1.00 5.44 C ATOM 3358 CG LEU B 95 12.869 5.234 5.043 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.234 3.758 5.198 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.216 5.725 3.639 1.00 13.14 C ATOM 0 H LEU B 95 10.190 6.746 3.436 1.00 51.40 H new ATOM 0 HA LEU B 95 10.780 3.918 3.983 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.197 6.536 5.425 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.160 5.041 6.339 1.00 5.44 H new ATOM 0 HG LEU B 95 13.454 5.812 5.759 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.291 3.619 4.972 1.00 3.52 H new ATOM 0 HD12 LEU B 95 13.037 3.440 6.222 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.635 3.161 4.511 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.274 5.552 3.444 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.618 5.183 2.906 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.003 6.791 3.564 1.00 13.14 H new ATOM 3372 N ASP B 96 8.922 3.408 5.576 1.00 51.23 N ATOM 3373 CA ASP B 96 7.714 2.969 6.265 1.00 11.24 C ATOM 3374 C ASP B 96 8.102 2.318 7.578 1.00 14.30 C ATOM 3375 O ASP B 96 8.699 1.246 7.592 1.00 55.22 O ATOM 3376 CB ASP B 96 6.968 1.958 5.401 1.00 22.11 C ATOM 3377 CG ASP B 96 5.687 1.429 6.035 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.651 2.125 5.959 1.00 73.12 O ATOM 3379 OD2 ASP B 96 5.701 0.297 6.569 1.00 73.53 O1- ATOM 0 H ASP B 96 9.669 2.713 5.574 1.00 51.23 H new ATOM 0 HA ASP B 96 7.069 3.827 6.453 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.724 2.422 4.445 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.630 1.118 5.188 1.00 22.11 H new ATOM 3384 N VAL B 97 7.789 2.971 8.675 1.00 43.21 N ATOM 3385 CA VAL B 97 8.137 2.452 9.996 1.00 65.34 C ATOM 3386 C VAL B 97 6.888 2.031 10.754 1.00 4.12 C ATOM 3387 O VAL B 97 6.084 2.866 11.147 1.00 1.23 O ATOM 3388 CB VAL B 97 8.923 3.488 10.842 1.00 44.15 C ATOM 3389 CG1 VAL B 97 9.287 2.905 12.211 1.00 31.14 C ATOM 3390 CG2 VAL B 97 10.174 3.963 10.096 1.00 13.32 C ATOM 0 H VAL B 97 7.294 3.863 8.688 1.00 43.21 H new ATOM 0 HA VAL B 97 8.779 1.586 9.834 1.00 65.34 H new ATOM 0 HB VAL B 97 8.281 4.354 11.004 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.838 3.648 12.788 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.376 2.633 12.745 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.907 2.018 12.076 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.709 4.689 10.708 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.823 3.111 9.894 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.882 4.428 9.155 1.00 13.32 H new ATOM 3400 N GLU B 98 6.729 0.734 10.951 1.00 55.41 N ATOM 3401 CA GLU B 98 5.594 0.206 11.692 1.00 61.25 C ATOM 3402 C GLU B 98 5.987 -0.048 13.146 1.00 55.42 C ATOM 3403 O GLU B 98 6.872 -0.857 13.425 1.00 74.01 O ATOM 3404 CB GLU B 98 5.087 -1.086 11.038 1.00 43.20 C ATOM 3405 CG GLU B 98 3.914 -1.720 11.775 1.00 33.43 C ATOM 3406 CD GLU B 98 3.377 -2.969 11.097 1.00 35.25 C ATOM 3407 OE1 GLU B 98 4.177 -3.863 10.773 1.00 70.42 O ATOM 3408 OE2 GLU B 98 2.145 -3.078 10.917 1.00 74.42 O1- ATOM 0 H GLU B 98 7.374 0.023 10.607 1.00 55.41 H new ATOM 0 HA GLU B 98 4.789 0.941 11.673 1.00 61.25 H new ATOM 0 HB2 GLU B 98 4.788 -0.871 10.012 1.00 43.20 H new ATOM 0 HB3 GLU B 98 5.905 -1.804 10.988 1.00 43.20 H new ATOM 0 HG2 GLU B 98 4.225 -1.972 12.789 1.00 33.43 H new ATOM 0 HG3 GLU B 98 3.110 -0.988 11.861 1.00 33.43 H new ATOM 3415 N LEU B 99 5.341 0.661 14.066 1.00 61.12 N ATOM 3416 CA LEU B 99 5.589 0.487 15.496 1.00 54.24 C ATOM 3417 C LEU B 99 4.408 -0.226 16.141 1.00 51.12 C ATOM 3418 O LEU B 99 3.321 0.343 16.260 1.00 12.44 O ATOM 3419 CB LEU B 99 5.824 1.843 16.184 1.00 60.12 C ATOM 3420 CG LEU B 99 7.095 2.596 15.757 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.217 3.919 16.512 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.334 1.731 15.977 1.00 1.13 C ATOM 0 H LEU B 99 4.637 1.366 13.846 1.00 61.12 H new ATOM 0 HA LEU B 99 6.488 -0.117 15.618 1.00 54.24 H new ATOM 0 HB2 LEU B 99 4.963 2.482 15.990 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.864 1.681 17.261 1.00 60.12 H new ATOM 0 HG LEU B 99 7.020 2.817 14.692 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.123 4.436 16.196 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.349 4.542 16.297 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.266 3.723 17.583 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.222 2.282 15.669 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.415 1.474 17.033 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.250 0.819 15.387 1.00 1.13 H new ATOM 3434 N ARG B 100 4.630 -1.468 16.562 1.00 53.41 N ATOM 3435 CA ARG B 100 3.576 -2.284 17.153 1.00 2.45 C ATOM 3436 C ARG B 100 3.691 -2.254 18.670 1.00 14.01 C ATOM 3437 O ARG B 100 4.711 -2.655 19.231 1.00 24.14 O ATOM 3438 CB ARG B 100 3.677 -3.729 16.657 1.00 53.52 C ATOM 3439 CG ARG B 100 3.665 -3.857 15.139 1.00 13.43 C ATOM 3440 CD ARG B 100 3.807 -5.307 14.698 1.00 64.11 C ATOM 3441 NE ARG B 100 3.993 -5.425 13.249 1.00 3.43 N ATOM 3442 CZ ARG B 100 4.518 -6.487 12.634 1.00 52.33 C ATOM 3443 NH1 ARG B 100 4.862 -7.570 13.320 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 4.695 -6.457 11.324 1.00 11.32 N ATOM 0 H ARG B 100 5.536 -1.933 16.504 1.00 53.41 H new ATOM 0 HA ARG B 100 2.610 -1.877 16.854 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.594 -4.173 17.043 1.00 53.52 H new ATOM 0 HB3 ARG B 100 2.847 -4.304 17.068 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.735 -3.446 14.746 1.00 13.43 H new ATOM 0 HG3 ARG B 100 4.478 -3.266 14.717 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.656 -5.760 15.210 1.00 64.11 H new ATOM 0 HD3 ARG B 100 2.919 -5.865 14.996 1.00 64.11 H new ATOM 0 HE ARG B 100 3.700 -4.639 12.669 1.00 3.43 H new ATOM 0 HH11 ARG B 100 4.726 -7.598 14.331 1.00 41.53 H new ATOM 0 HH12 ARG B 100 5.262 -8.374 12.837 1.00 41.53 H new ATOM 0 HH21 ARG B 100 4.431 -5.627 10.793 1.00 11.32 H new ATOM 0 HH22 ARG B 100 5.095 -7.264 10.845 1.00 11.32 H new ATOM 3458 N VAL B 101 2.645 -1.774 19.322 1.00 41.00 N ATOM 3459 CA VAL B 101 2.649 -1.585 20.766 1.00 50.20 C ATOM 3460 C VAL B 101 1.883 -2.699 21.466 1.00 3.30 C ATOM 3461 O VAL B 101 0.659 -2.769 21.368 1.00 1.54 O ATOM 3462 CB VAL B 101 2.015 -0.226 21.140 1.00 60.12 C ATOM 3463 CG1 VAL B 101 1.919 -0.066 22.658 1.00 22.35 C ATOM 3464 CG2 VAL B 101 2.805 0.923 20.511 1.00 51.31 C ATOM 0 H VAL B 101 1.772 -1.505 18.869 1.00 41.00 H new ATOM 0 HA VAL B 101 3.688 -1.605 21.095 1.00 50.20 H new ATOM 0 HB VAL B 101 1.001 -0.198 20.742 1.00 60.12 H new ATOM 0 HG11 VAL B 101 1.470 0.898 22.895 1.00 22.35 H new ATOM 0 HG12 VAL B 101 1.302 -0.865 23.070 1.00 22.35 H new ATOM 0 HG13 VAL B 101 2.917 -0.118 23.093 1.00 22.35 H new ATOM 0 HG21 VAL B 101 2.345 1.873 20.784 1.00 51.31 H new ATOM 0 HG22 VAL B 101 3.833 0.899 20.874 1.00 51.31 H new ATOM 0 HG23 VAL B 101 2.801 0.817 19.426 1.00 51.31 H new ATOM 3474 N ALA B 102 2.603 -3.569 22.162 1.00 24.03 N ATOM 3475 CA ALA B 102 1.976 -4.620 22.952 1.00 53.32 C ATOM 3476 C ALA B 102 2.134 -4.319 24.436 1.00 44.40 C ATOM 3477 O ALA B 102 3.200 -4.537 25.016 1.00 4.42 O ATOM 3478 CB ALA B 102 2.583 -5.978 22.610 1.00 42.24 C ATOM 0 H ALA B 102 3.622 -3.567 22.195 1.00 24.03 H new ATOM 0 HA ALA B 102 0.913 -4.654 22.714 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.103 -6.752 23.209 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.428 -6.190 21.552 1.00 42.24 H new ATOM 0 HB3 ALA B 102 3.652 -5.963 22.824 1.00 42.24 H new ATOM 3484 N LEU B 103 1.074 -3.810 25.049 1.00 61.44 N ATOM 3485 CA LEU B 103 1.078 -3.519 26.475 1.00 72.24 C ATOM 3486 C LEU B 103 0.107 -4.467 27.175 1.00 41.41 C ATOM 3487 O LEU B 103 -1.092 -4.453 26.894 1.00 40.11 O ATOM 3488 CB LEU B 103 0.695 -2.053 26.746 1.00 55.34 C ATOM 3489 CG LEU B 103 0.936 -1.569 28.190 1.00 34.43 C ATOM 3490 CD1 LEU B 103 2.422 -1.601 28.534 1.00 40.33 C ATOM 3491 CD2 LEU B 103 0.376 -0.164 28.400 1.00 1.40 C ATOM 0 H LEU B 103 0.197 -3.589 24.578 1.00 61.44 H new ATOM 0 HA LEU B 103 2.084 -3.668 26.867 1.00 72.24 H new ATOM 0 HB2 LEU B 103 1.260 -1.415 26.067 1.00 55.34 H new ATOM 0 HB3 LEU B 103 -0.360 -1.919 26.506 1.00 55.34 H new ATOM 0 HG LEU B 103 0.410 -2.251 28.858 1.00 34.43 H new ATOM 0 HD11 LEU B 103 2.566 -1.255 29.558 1.00 40.33 H new ATOM 0 HD12 LEU B 103 2.795 -2.621 28.440 1.00 40.33 H new ATOM 0 HD13 LEU B 103 2.968 -0.950 27.851 1.00 40.33 H new ATOM 0 HD21 LEU B 103 0.560 0.151 29.427 1.00 1.40 H new ATOM 0 HD22 LEU B 103 0.864 0.529 27.715 1.00 1.40 H new ATOM 0 HD23 LEU B 103 -0.697 -0.168 28.209 1.00 1.40 H new ATOM 3503 N PRO B 104 0.617 -5.319 28.078 1.00 3.11 N ATOM 3504 CA PRO B 104 -0.183 -6.356 28.729 1.00 24.44 C ATOM 3505 C PRO B 104 -1.291 -5.784 29.593 1.00 5.10 C ATOM 3506 O PRO B 104 -1.115 -4.769 30.278 1.00 15.44 O ATOM 3507 CB PRO B 104 0.829 -7.119 29.588 1.00 10.11 C ATOM 3508 CG PRO B 104 1.954 -6.166 29.789 1.00 31.23 C ATOM 3509 CD PRO B 104 2.012 -5.334 28.541 1.00 74.24 C ATOM 0 HA PRO B 104 -0.693 -6.983 27.998 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.392 -7.421 30.540 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.165 -8.028 29.089 1.00 10.11 H new ATOM 0 HG2 PRO B 104 1.786 -5.543 30.667 1.00 31.23 H new ATOM 0 HG3 PRO B 104 2.892 -6.697 29.949 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.379 -4.328 28.745 1.00 74.24 H new ATOM 0 HD3 PRO B 104 2.678 -5.771 27.797 1.00 74.24 H new ATOM 3517 N GLY B 105 -2.427 -6.454 29.550 1.00 72.34 N ATOM 3518 CA GLY B 105 -3.580 -6.042 30.326 1.00 21.00 C ATOM 3519 C GLY B 105 -4.203 -4.750 29.828 1.00 53.31 C ATOM 3520 O GLY B 105 -5.089 -4.198 30.477 1.00 21.33 O ATOM 0 H GLY B 105 -2.576 -7.289 28.983 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -4.329 -6.833 30.300 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -3.284 -5.918 31.368 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.747 -4.263 28.677 1.00 45.40 N ATOM 3525 CA LEU B 106 -4.255 -3.017 28.112 1.00 45.21 C ATOM 3526 C LEU B 106 -5.229 -3.288 26.970 1.00 60.53 C ATOM 3527 O LEU B 106 -4.992 -4.146 26.115 1.00 55.33 O ATOM 3528 CB LEU B 106 -3.096 -2.128 27.623 1.00 22.13 C ATOM 3529 CG LEU B 106 -3.503 -0.942 26.725 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -4.446 0.010 27.456 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -2.273 -0.195 26.216 1.00 55.01 C ATOM 0 H LEU B 106 -3.024 -4.714 28.116 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.791 -2.489 28.901 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -2.568 -1.738 28.493 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -2.390 -2.751 27.074 1.00 22.13 H new ATOM 0 HG LEU B 106 -4.037 -1.348 25.866 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -4.714 0.835 26.796 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -5.348 -0.526 27.751 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.950 0.402 28.344 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -2.587 0.637 25.585 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -1.703 0.187 27.063 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -1.649 -0.875 25.636 1.00 55.01 H new ATOM 3543 N ASP B 107 -6.329 -2.544 26.976 1.00 0.12 N ATOM 3544 CA ASP B 107 -7.332 -2.605 25.923 1.00 50.41 C ATOM 3545 C ASP B 107 -6.840 -1.890 24.674 1.00 24.13 C ATOM 3546 O ASP B 107 -6.189 -0.852 24.769 1.00 45.41 O ATOM 3547 CB ASP B 107 -8.630 -1.940 26.391 1.00 1.44 C ATOM 3548 CG ASP B 107 -9.258 -2.649 27.580 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.267 -2.071 28.689 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.729 -3.791 27.418 1.00 14.11 O1- ATOM 0 H ASP B 107 -6.550 -1.878 27.716 1.00 0.12 H new ATOM 0 HA ASP B 107 -7.515 -3.654 25.693 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -8.426 -0.903 26.658 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -9.342 -1.923 25.566 1.00 1.44 H new ATOM 3555 N ALA B 108 -7.171 -2.432 23.511 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.804 -1.817 22.239 1.00 21.33 C ATOM 3557 C ALA B 108 -7.425 -0.427 22.105 1.00 4.44 C ATOM 3558 O ALA B 108 -6.777 0.510 21.630 1.00 12.01 O ATOM 3559 CB ALA B 108 -7.235 -2.706 21.085 1.00 34.32 C ATOM 0 H ALA B 108 -7.696 -3.302 23.420 1.00 12.24 H new ATOM 0 HA ALA B 108 -5.720 -1.705 22.211 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.956 -2.238 20.141 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -6.743 -3.675 21.169 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -8.316 -2.844 21.116 1.00 34.32 H new ATOM 3565 N ALA B 109 -8.677 -0.299 22.537 1.00 61.34 N ATOM 3566 CA ALA B 109 -9.394 0.971 22.464 1.00 64.51 C ATOM 3567 C ALA B 109 -8.623 2.067 23.195 1.00 34.40 C ATOM 3568 O ALA B 109 -8.403 3.154 22.658 1.00 22.24 O ATOM 3569 CB ALA B 109 -10.796 0.825 23.048 1.00 34.53 C ATOM 0 H ALA B 109 -9.218 -1.063 22.943 1.00 61.34 H new ATOM 0 HA ALA B 109 -9.483 1.256 21.416 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -11.317 1.780 22.986 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -11.348 0.073 22.484 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -10.725 0.517 24.091 1.00 34.53 H new ATOM 3575 N ALA B 110 -8.200 1.763 24.419 1.00 13.42 N ATOM 3576 CA ALA B 110 -7.417 2.699 25.215 1.00 72.03 C ATOM 3577 C ALA B 110 -6.016 2.834 24.631 1.00 4.25 C ATOM 3578 O ALA B 110 -5.455 3.928 24.574 1.00 22.41 O ATOM 3579 CB ALA B 110 -7.355 2.237 26.669 1.00 4.12 C ATOM 0 H ALA B 110 -8.388 0.873 24.881 1.00 13.42 H new ATOM 0 HA ALA B 110 -7.899 3.676 25.189 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -6.767 2.946 27.251 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -8.364 2.182 27.077 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.889 1.253 26.718 1.00 4.12 H new ATOM 3585 N ALA B 111 -5.476 1.710 24.168 1.00 64.14 N ATOM 3586 CA ALA B 111 -4.128 1.661 23.610 1.00 51.51 C ATOM 3587 C ALA B 111 -3.968 2.671 22.481 1.00 2.23 C ATOM 3588 O ALA B 111 -2.933 3.326 22.371 1.00 42.41 O ATOM 3589 CB ALA B 111 -3.807 0.255 23.117 1.00 4.22 C ATOM 0 H ALA B 111 -5.958 0.811 24.169 1.00 64.14 H new ATOM 0 HA ALA B 111 -3.424 1.923 24.400 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -2.798 0.236 22.704 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -3.872 -0.446 23.949 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -4.521 -0.032 22.345 1.00 4.22 H new ATOM 3595 N LYS B 112 -5.008 2.800 21.658 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.995 3.734 20.535 1.00 34.20 C ATOM 3597 C LYS B 112 -4.600 5.140 20.993 1.00 24.41 C ATOM 3598 O LYS B 112 -3.732 5.778 20.394 1.00 32.01 O ATOM 3599 CB LYS B 112 -6.376 3.778 19.855 1.00 45.31 C ATOM 3600 CG LYS B 112 -6.752 2.501 19.106 1.00 74.45 C ATOM 3601 CD LYS B 112 -5.785 2.204 17.960 1.00 63.04 C ATOM 3602 CE LYS B 112 -6.203 0.970 17.165 1.00 72.33 C ATOM 3603 NZ LYS B 112 -7.477 1.178 16.429 1.00 62.21 N1+ ATOM 0 H LYS B 112 -5.873 2.267 21.749 1.00 32.30 H new ATOM 0 HA LYS B 112 -4.254 3.382 19.818 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -7.134 3.977 20.612 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -6.397 4.614 19.156 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -6.759 1.662 19.801 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -7.764 2.597 18.711 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -5.737 3.065 17.294 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -4.782 2.055 18.361 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -5.415 0.712 16.457 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -6.312 0.123 17.843 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -7.634 0.385 15.775 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -8.265 1.229 17.106 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -7.426 2.066 15.890 1.00 62.21 H new ATOM 3617 N THR B 113 -5.221 5.606 22.074 1.00 71.03 N ATOM 3618 CA THR B 113 -5.003 6.967 22.543 1.00 12.30 C ATOM 3619 C THR B 113 -3.725 7.059 23.380 1.00 72.03 C ATOM 3620 O THR B 113 -3.019 8.070 23.345 1.00 34.03 O ATOM 3621 CB THR B 113 -6.217 7.490 23.354 1.00 51.23 C ATOM 3622 OG1 THR B 113 -6.278 8.920 23.271 1.00 15.33 O ATOM 3623 CG2 THR B 113 -6.149 7.076 24.820 1.00 55.23 C ATOM 0 H THR B 113 -5.875 5.063 22.637 1.00 71.03 H new ATOM 0 HA THR B 113 -4.888 7.600 21.663 1.00 12.30 H new ATOM 0 HB THR B 113 -7.113 7.046 22.920 1.00 51.23 H new ATOM 0 HG1 THR B 113 -7.047 9.245 23.784 1.00 15.33 H new ATOM 0 HG21 THR B 113 -7.020 7.465 25.349 1.00 55.23 H new ATOM 0 HG22 THR B 113 -6.137 5.988 24.891 1.00 55.23 H new ATOM 0 HG23 THR B 113 -5.242 7.479 25.270 1.00 55.23 H new ATOM 3631 N LEU B 114 -3.424 5.996 24.123 1.00 42.02 N ATOM 3632 CA LEU B 114 -2.219 5.960 24.951 1.00 34.43 C ATOM 3633 C LEU B 114 -0.977 6.050 24.069 1.00 70.23 C ATOM 3634 O LEU B 114 -0.045 6.810 24.352 1.00 14.10 O ATOM 3635 CB LEU B 114 -2.174 4.686 25.811 1.00 61.41 C ATOM 3636 CG LEU B 114 -3.362 4.495 26.771 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -3.107 3.331 27.727 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -3.656 5.783 27.537 1.00 20.12 C ATOM 0 H LEU B 114 -3.994 5.152 24.169 1.00 42.02 H new ATOM 0 HA LEU B 114 -2.241 6.817 25.624 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -2.122 3.822 25.148 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -1.254 4.695 26.396 1.00 61.41 H new ATOM 0 HG LEU B 114 -4.243 4.252 26.176 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -3.960 3.216 28.395 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -2.968 2.414 27.155 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -2.211 3.532 28.314 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -4.499 5.622 28.209 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -2.779 6.069 28.118 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -3.900 6.578 26.832 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.992 5.287 22.984 1.00 61.11 N ATOM 3651 CA VAL B 115 0.091 5.300 22.014 1.00 23.35 C ATOM 3652 C VAL B 115 0.220 6.684 21.383 1.00 63.55 C ATOM 3653 O VAL B 115 1.330 7.141 21.098 1.00 10.54 O ATOM 3654 CB VAL B 115 -0.125 4.231 20.909 1.00 32.23 C ATOM 3655 CG1 VAL B 115 0.918 4.355 19.798 1.00 53.51 C ATOM 3656 CG2 VAL B 115 -0.093 2.830 21.517 1.00 32.34 C ATOM 0 H VAL B 115 -1.751 4.646 22.754 1.00 61.11 H new ATOM 0 HA VAL B 115 1.013 5.059 22.542 1.00 23.35 H new ATOM 0 HB VAL B 115 -1.105 4.403 20.463 1.00 32.23 H new ATOM 0 HG11 VAL B 115 0.737 3.591 19.042 1.00 53.51 H new ATOM 0 HG12 VAL B 115 0.847 5.342 19.341 1.00 53.51 H new ATOM 0 HG13 VAL B 115 1.915 4.220 20.218 1.00 53.51 H new ATOM 0 HG21 VAL B 115 -0.246 2.089 20.732 1.00 32.34 H new ATOM 0 HG22 VAL B 115 0.873 2.662 21.992 1.00 32.34 H new ATOM 0 HG23 VAL B 115 -0.884 2.738 22.261 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.918 7.351 21.192 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.939 8.689 20.601 1.00 4.03 C ATOM 3668 C ASP B 116 -0.218 9.690 21.496 1.00 43.14 C ATOM 3669 O ASP B 116 0.786 10.283 21.091 1.00 21.31 O ATOM 3670 CB ASP B 116 -2.379 9.166 20.366 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.425 10.564 19.760 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -3.034 11.469 20.368 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -1.830 10.770 18.680 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.838 6.986 21.438 1.00 33.05 H new ATOM 0 HA ASP B 116 -0.424 8.629 19.642 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.889 8.467 19.704 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.921 9.163 21.312 1.00 75.43 H new ATOM 3678 N ARG B 117 -0.726 9.864 22.716 1.00 65.05 N ATOM 3679 CA ARG B 117 -0.171 10.841 23.654 1.00 30.34 C ATOM 3680 C ARG B 117 1.289 10.531 23.966 1.00 41.22 C ATOM 3681 O ARG B 117 2.125 11.435 24.035 1.00 22.44 O ATOM 3682 CB ARG B 117 -1.014 10.896 24.937 1.00 5.33 C ATOM 3683 CG ARG B 117 -1.203 9.552 25.634 1.00 52.02 C ATOM 3684 CD ARG B 117 -2.330 9.598 26.667 1.00 70.20 C ATOM 3685 NE ARG B 117 -1.987 10.390 27.857 1.00 35.41 N ATOM 3686 CZ ARG B 117 -2.367 11.658 28.067 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -3.001 12.344 27.125 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -2.091 12.244 29.225 1.00 12.43 N ATOM 0 H ARG B 117 -1.522 9.340 23.079 1.00 65.05 H new ATOM 0 HA ARG B 117 -0.206 11.824 23.184 1.00 30.34 H new ATOM 0 HB2 ARG B 117 -0.544 11.589 25.635 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.995 11.305 24.694 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -1.423 8.786 24.891 1.00 52.02 H new ATOM 0 HG3 ARG B 117 -0.273 9.263 26.124 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -3.223 10.017 26.204 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -2.577 8.581 26.973 1.00 70.20 H new ATOM 0 HE ARG B 117 -1.418 9.942 28.575 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -3.205 11.907 26.226 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -3.284 13.308 27.299 1.00 12.31 H new ATOM 0 HH21 ARG B 117 -1.592 11.730 29.951 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -2.378 13.209 29.390 1.00 12.43 H new ATOM 3702 N ALA B 118 1.595 9.247 24.126 1.00 61.11 N ATOM 3703 CA ALA B 118 2.975 8.811 24.337 1.00 4.01 C ATOM 3704 C ALA B 118 3.852 9.236 23.157 1.00 4.12 C ATOM 3705 O ALA B 118 4.936 9.798 23.335 1.00 22.32 O ATOM 3706 CB ALA B 118 3.030 7.297 24.533 1.00 4.44 C ATOM 0 H ALA B 118 0.910 8.491 24.114 1.00 61.11 H new ATOM 0 HA ALA B 118 3.359 9.287 25.239 1.00 4.01 H new ATOM 0 HB1 ALA B 118 4.063 6.988 24.689 1.00 4.44 H new ATOM 0 HB2 ALA B 118 2.433 7.021 25.402 1.00 4.44 H new ATOM 0 HB3 ALA B 118 2.632 6.801 23.648 1.00 4.44 H new ATOM 3712 N HIS B 119 3.355 8.995 21.947 1.00 53.54 N ATOM 3713 CA HIS B 119 4.076 9.356 20.728 1.00 31.05 C ATOM 3714 C HIS B 119 3.915 10.838 20.398 1.00 22.51 C ATOM 3715 O HIS B 119 4.393 11.304 19.361 1.00 73.21 O ATOM 3716 CB HIS B 119 3.599 8.497 19.547 1.00 24.30 C ATOM 3717 CG HIS B 119 4.208 7.127 19.518 1.00 50.32 C ATOM 3718 ND1 HIS B 119 3.706 6.059 20.228 1.00 33.22 N ATOM 3719 CD2 HIS B 119 5.301 6.660 18.865 1.00 55.12 C ATOM 3720 CE1 HIS B 119 4.461 4.995 20.016 1.00 74.31 C ATOM 3721 NE2 HIS B 119 5.435 5.333 19.191 1.00 22.51 N ATOM 0 H HIS B 119 2.452 8.549 21.783 1.00 53.54 H new ATOM 0 HA HIS B 119 5.135 9.164 20.904 1.00 31.05 H new ATOM 0 HB2 HIS B 119 2.514 8.403 19.592 1.00 24.30 H new ATOM 0 HB3 HIS B 119 3.836 9.011 18.615 1.00 24.30 H new ATOM 0 HD1 HIS B 119 2.879 6.085 20.825 1.00 33.22 H new ATOM 0 HD2 HIS B 119 5.946 7.227 18.210 1.00 55.12 H new ATOM 0 HE1 HIS B 119 4.307 4.016 20.445 1.00 74.31 H new ATOM 3730 N HIS B 120 3.245 11.571 21.276 1.00 35.12 N ATOM 3731 CA HIS B 120 3.022 13.000 21.084 1.00 61.52 C ATOM 3732 C HIS B 120 3.984 13.818 21.945 1.00 22.12 C ATOM 3733 O HIS B 120 4.225 14.993 21.666 1.00 21.30 O ATOM 3734 CB HIS B 120 1.565 13.351 21.424 1.00 61.10 C ATOM 3735 CG HIS B 120 1.210 14.797 21.223 1.00 45.20 C ATOM 3736 ND1 HIS B 120 0.619 15.569 22.200 1.00 23.40 N ATOM 3737 CD2 HIS B 120 1.347 15.605 20.143 1.00 61.34 C ATOM 3738 CE1 HIS B 120 0.407 16.783 21.730 1.00 14.23 C ATOM 3739 NE2 HIS B 120 0.840 16.831 20.487 1.00 33.30 N ATOM 0 H HIS B 120 2.843 11.197 22.136 1.00 35.12 H new ATOM 0 HA HIS B 120 3.211 13.246 20.039 1.00 61.52 H new ATOM 0 HB2 HIS B 120 0.904 12.739 20.810 1.00 61.10 H new ATOM 0 HB3 HIS B 120 1.373 13.084 22.463 1.00 61.10 H new ATOM 0 HD2 HIS B 120 1.776 15.333 19.190 1.00 61.34 H new ATOM 0 HE1 HIS B 120 -0.045 17.600 22.273 1.00 14.23 H new ATOM 0 HE2 HIS B 120 0.804 17.649 19.878 1.00 33.30 H new ATOM 3748 N VAL B 121 4.537 13.194 22.987 1.00 53.34 N ATOM 3749 CA VAL B 121 5.416 13.894 23.930 1.00 2.11 C ATOM 3750 C VAL B 121 6.892 13.510 23.749 1.00 31.12 C ATOM 3751 O VAL B 121 7.784 14.319 24.009 1.00 43.14 O ATOM 3752 CB VAL B 121 4.991 13.629 25.401 1.00 52.03 C ATOM 3753 CG1 VAL B 121 3.577 14.151 25.660 1.00 41.33 C ATOM 3754 CG2 VAL B 121 5.091 12.139 25.742 1.00 63.42 C ATOM 0 H VAL B 121 4.393 12.207 23.200 1.00 53.34 H new ATOM 0 HA VAL B 121 5.311 14.956 23.710 1.00 2.11 H new ATOM 0 HB VAL B 121 5.678 14.170 26.052 1.00 52.03 H new ATOM 0 HG11 VAL B 121 3.301 13.955 26.696 1.00 41.33 H new ATOM 0 HG12 VAL B 121 3.546 15.224 25.473 1.00 41.33 H new ATOM 0 HG13 VAL B 121 2.876 13.647 24.996 1.00 41.33 H new ATOM 0 HG21 VAL B 121 4.788 11.982 26.777 1.00 63.42 H new ATOM 0 HG22 VAL B 121 4.437 11.570 25.082 1.00 63.42 H new ATOM 0 HG23 VAL B 121 6.120 11.804 25.610 1.00 63.42 H new ATOM 3764 N CYS B 122 7.150 12.281 23.302 1.00 64.23 N ATOM 3765 CA CYS B 122 8.523 11.786 23.179 1.00 24.42 C ATOM 3766 C CYS B 122 9.301 12.535 22.082 1.00 23.34 C ATOM 3767 O CYS B 122 8.826 12.660 20.949 1.00 74.53 O ATOM 3768 CB CYS B 122 8.520 10.281 22.902 1.00 15.34 C ATOM 3769 SG CYS B 122 7.817 9.288 24.238 1.00 14.44 S ATOM 0 H CYS B 122 6.432 11.613 23.020 1.00 64.23 H new ATOM 0 HA CYS B 122 9.030 11.972 24.126 1.00 24.42 H new ATOM 0 HB2 CYS B 122 7.957 10.092 21.988 1.00 15.34 H new ATOM 0 HB3 CYS B 122 9.544 9.954 22.720 1.00 15.34 H new ATOM 0 HG CYS B 122 7.338 8.182 23.751 1.00 14.44 H new ATOM 3775 N PRO B 123 10.520 13.028 22.413 1.00 45.45 N ATOM 3776 CA PRO B 123 11.355 13.830 21.493 1.00 1.30 C ATOM 3777 C PRO B 123 11.772 13.073 20.228 1.00 21.43 C ATOM 3778 O PRO B 123 12.053 13.687 19.198 1.00 1.12 O ATOM 3779 CB PRO B 123 12.593 14.185 22.338 1.00 65.25 C ATOM 3780 CG PRO B 123 12.157 14.001 23.751 1.00 12.41 C ATOM 3781 CD PRO B 123 11.175 12.865 23.725 1.00 30.51 C ATOM 0 HA PRO B 123 10.806 14.696 21.122 1.00 1.30 H new ATOM 0 HB2 PRO B 123 13.435 13.537 22.097 1.00 65.25 H new ATOM 0 HB3 PRO B 123 12.916 15.210 22.154 1.00 65.25 H new ATOM 0 HG2 PRO B 123 13.005 13.772 24.396 1.00 12.41 H new ATOM 0 HG3 PRO B 123 11.696 14.909 24.141 1.00 12.41 H new ATOM 0 HD2 PRO B 123 11.672 11.899 23.811 1.00 30.51 H new ATOM 0 HD3 PRO B 123 10.460 12.930 24.545 1.00 30.51 H new ATOM 3789 N TYR B 124 11.835 11.746 20.314 1.00 44.15 N ATOM 3790 CA TYR B 124 12.149 10.909 19.148 1.00 41.53 C ATOM 3791 C TYR B 124 10.863 10.411 18.491 1.00 41.03 C ATOM 3792 O TYR B 124 10.893 9.502 17.664 1.00 24.42 O ATOM 3793 CB TYR B 124 13.021 9.702 19.550 1.00 11.44 C ATOM 3794 CG TYR B 124 14.494 10.022 19.778 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.490 9.477 18.956 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.896 10.856 20.818 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.823 9.755 19.168 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.234 11.140 21.030 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.192 10.587 20.204 1.00 65.35 C ATOM 3800 OH TYR B 124 18.524 10.864 20.419 1.00 21.31 O ATOM 0 H TYR B 124 11.674 11.224 21.175 1.00 44.15 H new ATOM 0 HA TYR B 124 12.706 11.521 18.439 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.614 9.266 20.462 1.00 11.44 H new ATOM 0 HB3 TYR B 124 12.945 8.942 18.772 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.207 8.827 18.141 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.152 11.288 21.470 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.576 9.323 18.525 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.528 11.792 21.839 1.00 2.53 H new ATOM 0 HH TYR B 124 19.057 10.498 19.683 1.00 21.31 H new ATOM 3845 N THR B 128 8.834 11.848 14.401 1.00 13.32 N ATOM 3846 CA THR B 128 8.826 10.562 13.708 1.00 55.14 C ATOM 3847 C THR B 128 7.448 10.322 13.106 1.00 13.14 C ATOM 3848 O THR B 128 7.297 9.588 12.137 1.00 21.45 O ATOM 3849 CB THR B 128 9.225 9.374 14.634 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.861 8.345 13.862 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.013 8.774 15.349 1.00 11.25 C ATOM 0 HA THR B 128 9.578 10.608 12.921 1.00 55.14 H new ATOM 0 HB THR B 128 9.910 9.766 15.386 1.00 41.45 H new ATOM 0 HG1 THR B 128 10.111 7.602 14.450 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.337 7.949 15.984 1.00 11.25 H new ATOM 0 HG22 THR B 128 7.537 9.539 15.963 1.00 11.25 H new ATOM 0 HG23 THR B 128 7.301 8.406 14.611 1.00 11.25 H new ATOM 3859 N ARG B 129 6.447 10.993 13.665 1.00 41.51 N ATOM 3860 CA ARG B 129 5.075 10.830 13.222 1.00 75.21 C ATOM 3861 C ARG B 129 4.707 11.980 12.304 1.00 73.32 C ATOM 3862 O ARG B 129 4.146 11.790 11.225 1.00 44.41 O ATOM 3863 CB ARG B 129 4.120 10.778 14.434 1.00 21.01 C ATOM 3864 CG ARG B 129 4.197 11.990 15.363 1.00 45.10 C ATOM 3865 CD ARG B 129 3.174 11.916 16.496 1.00 21.21 C ATOM 3866 NE ARG B 129 1.799 12.091 16.019 1.00 2.44 N ATOM 3867 CZ ARG B 129 0.706 11.843 16.752 1.00 0.21 C ATOM 3868 NH1 ARG B 129 0.811 11.377 17.992 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 -0.495 12.061 16.241 1.00 44.44 N ATOM 0 H ARG B 129 6.565 11.658 14.430 1.00 41.51 H new ATOM 0 HA ARG B 129 4.980 9.891 12.677 1.00 75.21 H new ATOM 0 HB2 ARG B 129 3.097 10.682 14.069 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.338 9.880 15.012 1.00 21.01 H new ATOM 0 HG2 ARG B 129 5.200 12.059 15.785 1.00 45.10 H new ATOM 0 HG3 ARG B 129 4.031 12.899 14.785 1.00 45.10 H new ATOM 0 HD2 ARG B 129 3.262 10.953 16.999 1.00 21.21 H new ATOM 0 HD3 ARG B 129 3.399 12.684 17.236 1.00 21.21 H new ATOM 0 HE ARG B 129 1.666 12.424 15.064 1.00 2.44 H new ATOM 0 HH11 ARG B 129 1.732 11.204 18.396 1.00 5.12 H new ATOM 0 HH12 ARG B 129 -0.029 11.192 18.540 1.00 5.12 H new ATOM 0 HH21 ARG B 129 -0.587 12.418 15.290 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -1.328 11.872 16.798 1.00 44.44 H new ATOM 3883 N ASN B 130 5.040 13.178 12.755 1.00 21.53 N ATOM 3884 CA ASN B 130 4.682 14.398 12.060 1.00 53.34 C ATOM 3885 C ASN B 130 5.618 14.676 10.885 1.00 22.35 C ATOM 3886 O ASN B 130 5.238 15.335 9.917 1.00 70.41 O ATOM 3887 CB ASN B 130 4.668 15.563 13.050 1.00 70.21 C ATOM 3888 CG ASN B 130 3.634 15.343 14.143 1.00 33.52 C ATOM 3889 OD1 ASN B 130 2.552 14.815 13.895 1.00 60.32 O ATOM 3890 ND2 ASN B 130 3.979 15.685 15.366 1.00 74.14 N ATOM 0 H ASN B 130 5.567 13.330 13.615 1.00 21.53 H new ATOM 0 HA ASN B 130 3.683 14.278 11.640 1.00 53.34 H new ATOM 0 HB2 ASN B 130 5.656 15.676 13.497 1.00 70.21 H new ATOM 0 HB3 ASN B 130 4.450 16.491 12.521 1.00 70.21 H new ATOM 0 HD21 ASN B 130 3.341 15.514 16.143 1.00 74.14 H new ATOM 0 HD22 ASN B 130 4.885 16.121 15.537 1.00 74.14 H new ATOM 3897 N ASN B 131 6.846 14.170 10.981 1.00 34.23 N ATOM 3898 CA ASN B 131 7.888 14.477 9.999 1.00 31.43 C ATOM 3899 C ASN B 131 8.064 13.341 8.986 1.00 54.44 C ATOM 3900 O ASN B 131 8.304 13.591 7.803 1.00 13.44 O ATOM 3901 CB ASN B 131 9.218 14.751 10.718 1.00 3.33 C ATOM 3902 CG ASN B 131 10.323 15.203 9.772 1.00 61.21 C ATOM 3903 OD1 ASN B 131 10.484 16.393 9.511 1.00 75.43 O ATOM 3904 ND2 ASN B 131 11.104 14.258 9.268 1.00 34.33 N ATOM 0 H ASN B 131 7.146 13.545 11.729 1.00 34.23 H new ATOM 0 HA ASN B 131 7.579 15.366 9.450 1.00 31.43 H new ATOM 0 HB2 ASN B 131 9.063 15.516 11.479 1.00 3.33 H new ATOM 0 HB3 ASN B 131 9.538 13.847 11.236 1.00 3.33 H new ATOM 0 HD21 ASN B 131 11.869 14.509 8.641 1.00 34.33 H new ATOM 0 HD22 ASN B 131 10.940 13.280 9.507 1.00 34.33 H new ATOM 3911 N VAL B 132 7.945 12.095 9.448 1.00 52.13 N ATOM 3912 CA VAL B 132 8.138 10.924 8.577 1.00 11.30 C ATOM 3913 C VAL B 132 6.994 9.926 8.738 1.00 11.32 C ATOM 3914 O VAL B 132 6.087 10.138 9.544 1.00 35.23 O ATOM 3915 CB VAL B 132 9.501 10.213 8.825 1.00 15.30 C ATOM 3916 CG1 VAL B 132 10.662 11.072 8.328 1.00 32.53 C ATOM 3917 CG2 VAL B 132 9.687 9.869 10.300 1.00 3.12 C ATOM 0 H VAL B 132 7.717 11.867 10.416 1.00 52.13 H new ATOM 0 HA VAL B 132 8.144 11.300 7.554 1.00 11.30 H new ATOM 0 HB VAL B 132 9.493 9.281 8.259 1.00 15.30 H new ATOM 0 HG11 VAL B 132 11.603 10.554 8.512 1.00 32.53 H new ATOM 0 HG12 VAL B 132 10.550 11.251 7.259 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.663 12.025 8.858 1.00 32.53 H new ATOM 0 HG21 VAL B 132 10.648 9.374 10.440 1.00 3.12 H new ATOM 0 HG22 VAL B 132 9.660 10.783 10.893 1.00 3.12 H new ATOM 0 HG23 VAL B 132 8.886 9.204 10.622 1.00 3.12 H new ATOM 3927 N ALA B 133 7.042 8.843 7.961 1.00 53.04 N ATOM 3928 CA ALA B 133 5.950 7.874 7.904 1.00 53.01 C ATOM 3929 C ALA B 133 6.144 6.741 8.903 1.00 72.23 C ATOM 3930 O ALA B 133 6.908 5.793 8.667 1.00 0.23 O ATOM 3931 CB ALA B 133 5.809 7.328 6.487 1.00 11.23 C ATOM 0 H ALA B 133 7.833 8.615 7.358 1.00 53.04 H new ATOM 0 HA ALA B 133 5.030 8.390 8.179 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.993 6.607 6.455 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.596 8.148 5.801 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.737 6.839 6.191 1.00 11.23 H new ATOM 3937 N VAL B 134 5.447 6.856 10.025 1.00 34.41 N ATOM 3938 CA VAL B 134 5.456 5.831 11.055 1.00 31.34 C ATOM 3939 C VAL B 134 4.033 5.368 11.360 1.00 33.12 C ATOM 3940 O VAL B 134 3.235 6.100 11.950 1.00 12.15 O ATOM 3941 CB VAL B 134 6.138 6.321 12.355 1.00 33.43 C ATOM 3942 CG1 VAL B 134 6.014 5.268 13.452 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.606 6.663 12.097 1.00 5.41 C ATOM 0 H VAL B 134 4.861 7.661 10.245 1.00 34.41 H new ATOM 0 HA VAL B 134 6.036 4.993 10.669 1.00 31.34 H new ATOM 0 HB VAL B 134 5.632 7.226 12.690 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.499 5.629 14.359 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.960 5.077 13.655 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.494 4.345 13.126 1.00 61.10 H new ATOM 0 HG21 VAL B 134 8.068 7.006 13.023 1.00 5.41 H new ATOM 0 HG22 VAL B 134 8.128 5.777 11.737 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.670 7.451 11.347 1.00 5.41 H new ATOM 3953 N ARG B 135 3.729 4.153 10.934 1.00 11.21 N ATOM 3954 CA ARG B 135 2.436 3.539 11.171 1.00 24.23 C ATOM 3955 C ARG B 135 2.347 3.022 12.607 1.00 24.22 C ATOM 3956 O ARG B 135 3.012 2.049 12.973 1.00 54.44 O ATOM 3957 CB ARG B 135 2.214 2.400 10.164 1.00 74.32 C ATOM 3958 CG ARG B 135 1.115 1.414 10.554 1.00 34.13 C ATOM 3959 CD ARG B 135 0.836 0.409 9.439 1.00 2.43 C ATOM 3960 NE ARG B 135 0.610 -0.940 9.959 1.00 1.50 N ATOM 3961 CZ ARG B 135 -0.555 -1.585 9.934 1.00 23.13 C ATOM 3962 NH1 ARG B 135 -1.665 -0.974 9.533 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -0.609 -2.843 10.344 1.00 14.33 N ATOM 0 H ARG B 135 4.377 3.563 10.412 1.00 11.21 H new ATOM 0 HA ARG B 135 1.653 4.285 11.034 1.00 24.23 H new ATOM 0 HB2 ARG B 135 1.969 2.833 9.194 1.00 74.32 H new ATOM 0 HB3 ARG B 135 3.149 1.853 10.042 1.00 74.32 H new ATOM 0 HG2 ARG B 135 1.408 0.882 11.459 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.202 1.961 10.788 1.00 34.13 H new ATOM 0 HD2 ARG B 135 -0.038 0.730 8.872 1.00 2.43 H new ATOM 0 HD3 ARG B 135 1.677 0.394 8.746 1.00 2.43 H new ATOM 0 HE ARG B 135 1.407 -1.424 10.373 1.00 1.50 H new ATOM 0 HH11 ARG B 135 -1.632 0.002 9.239 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -2.550 -1.481 9.519 1.00 1.54 H new ATOM 0 HH21 ARG B 135 0.236 -3.308 10.675 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -1.496 -3.347 10.329 1.00 14.33 H new ATOM 3977 N LEU B 136 1.548 3.699 13.421 1.00 62.51 N ATOM 3978 CA LEU B 136 1.302 3.277 14.789 1.00 72.41 C ATOM 3979 C LEU B 136 0.234 2.187 14.823 1.00 41.21 C ATOM 3980 O LEU B 136 -0.899 2.395 14.384 1.00 33.52 O ATOM 3981 CB LEU B 136 0.885 4.480 15.649 1.00 60.04 C ATOM 3982 CG LEU B 136 2.007 5.496 15.927 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.483 6.689 16.725 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.161 4.824 16.665 1.00 0.00 C ATOM 0 H LEU B 136 1.056 4.551 13.152 1.00 62.51 H new ATOM 0 HA LEU B 136 2.222 2.864 15.202 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.062 4.995 15.153 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.503 4.113 16.601 1.00 60.04 H new ATOM 0 HG LEU B 136 2.373 5.867 14.970 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.297 7.391 16.907 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.695 7.186 16.160 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.083 6.342 17.678 1.00 41.31 H new ATOM 0 HD21 LEU B 136 3.947 5.555 16.854 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.802 4.423 17.613 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.560 4.013 16.056 1.00 0.00 H new ATOM 3996 N VAL B 137 0.618 1.023 15.329 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.263 -0.136 15.419 1.00 61.13 C ATOM 3998 C VAL B 137 -0.261 -0.672 16.846 1.00 31.22 C ATOM 3999 O VAL B 137 0.789 -1.004 17.392 1.00 63.04 O ATOM 4000 CB VAL B 137 0.168 -1.246 14.409 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.643 -1.104 14.064 1.00 20.11 C ATOM 4002 CG2 VAL B 137 -0.110 -2.659 14.941 1.00 5.14 C ATOM 0 H VAL B 137 1.556 0.854 15.692 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.275 0.172 15.158 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.433 -1.110 13.510 1.00 72.22 H new ATOM 0 HG11 VAL B 137 1.929 -1.885 13.359 1.00 20.11 H new ATOM 0 HG12 VAL B 137 1.819 -0.127 13.614 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.240 -1.198 14.971 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.207 -3.395 14.202 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.442 -2.814 15.868 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.177 -2.773 15.131 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.437 -0.723 17.455 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.575 -1.217 18.818 1.00 24.22 C ATOM 4014 C VAL B 138 -1.998 -2.684 18.785 1.00 70.52 C ATOM 4015 O VAL B 138 -2.818 -3.086 17.952 1.00 62.24 O ATOM 4016 CB VAL B 138 -2.589 -0.385 19.647 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -2.420 1.107 19.371 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -4.019 -0.840 19.394 1.00 0.20 C ATOM 0 H VAL B 138 -2.313 -0.427 17.025 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.607 -1.118 19.308 1.00 24.22 H new ATOM 0 HB VAL B 138 -2.379 -0.555 20.703 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -3.141 1.671 19.963 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -1.410 1.415 19.641 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -2.588 1.302 18.312 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.704 -0.237 19.990 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -4.257 -0.721 18.337 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -4.122 -1.888 19.674 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.400 -3.475 19.655 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.631 -4.917 19.678 1.00 52.34 C ATOM 4030 C ALA B 139 -2.953 -5.247 20.378 1.00 22.31 C ATOM 4031 O ALA B 139 -3.942 -5.554 19.676 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.464 -5.630 20.356 1.00 71.35 C ATOM 4033 OXT ALA B 139 -3.000 -5.188 21.625 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.744 -3.145 20.363 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.700 -5.271 18.649 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.650 -6.704 20.366 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.455 -5.426 19.807 1.00 71.35 H new ATOM 0 HB3 ALA B 139 -0.363 -5.270 21.380 1.00 71.35 H new