USER MOD reduce.3.24.130724 H: found=0, std=0, add=2001, rem=0, adj=65 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 10 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: B 78 THR OG1 : rot 25:sc= 0.605 USER MOD Set 1.4: B 80 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: B 60 SER OG : rot 73:sc= 0.307 USER MOD Set 2.2: B 63 LYS NZ :NH3+ -176:sc= 0.543! (180deg=0.457) USER MOD Set 3.1: B 57 CYS SG : rot -156:sc= 2.52 USER MOD Set 3.2: B 124 TYR OH : rot -125:sc= 1.02 USER MOD Set 4.1: B 44 THR OG1 : rot -120:sc= -0.0328 USER MOD Set 4.2: B 48 GLN : amide:sc= -1.54 K(o=-1.6,f=-2.7) USER MOD Set 5.1: A 54 TYR OH : rot 114:sc= 1.54 USER MOD Set 5.2: A 119 HIS : no HD1:sc= -3.83! C(o=-0.98!,f=-5.8!) USER MOD Set 5.3: A 128 THR OG1 : rot -39:sc= 1.31 USER MOD Set 6.1: A 126 ASN : amide:sc= 0.634 K(o=-0.59,f=-3) USER MOD Set 6.2: A 130 ASN : amide:sc= -1.22! K(o=-0.59!,f=-2.2) USER MOD Set 7.1: A 125 SER OG : rot 180:sc= 0.578 USER MOD Set 7.2: B 131 ASN :FLIP amide:sc= 0.669 F(o=-0.2,f=1.2) USER MOD Set 8.1: A 80 THR OG1 : rot 180:sc= 0.00271 USER MOD Set 8.2: B 10 THR OG1 : rot -74:sc= 0.957 USER MOD Set 8.3: B 22 HIS : no HE2:sc= 0.92 K(o=1.9,f=-5.6!) USER MOD Set 9.1: A 57 CYS SG : rot -1:sc= -7.41! USER MOD Set 9.2: A 124 TYR OH : rot -148:sc= 1.42 USER MOD Set10.1: A 45 ASN : amide:sc= -0.225! K(o=3.4!,f=-1.7) USER MOD Set10.2: B 5 TYR OH : rot 180:sc= 0.245 USER MOD Set10.3: B 7 THR OG1 : rot -100:sc= 0.965 USER MOD Set10.4: B 25 LYS NZ :NH3+ 169:sc= 2.43 (180deg=0) USER MOD Set11.1: A 11 SER OG : rot -58:sc= 0.763 USER MOD Set11.2: B 55 SER OG : rot -81:sc= 0.64 USER MOD Set12.1: A 5 TYR OH : rot 180:sc= 0.576 USER MOD Set12.2: A 7 THR OG1 : rot 33:sc= 1.29 USER MOD Set12.3: A 25 LYS NZ :NH3+ 154:sc= 1.49! (180deg=-0.726) USER MOD Set12.4: B 45 ASN : amide:sc= -6.78! C(o=-3.4!,f=-12!) USER MOD Single : A 1 MET CE :methyl -141:sc= -1.36 (180deg=-3.73!) USER MOD Single : A 1 MET N :NH3+ 133:sc= 0.095 (180deg=-0.163) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 6 LYS NZ :NH3+ 171:sc= 1.33 (180deg=1.19) USER MOD Single : A 20 THR OG1 : rot -102:sc= 0.538 USER MOD Single : A 21 SER OG : rot 80:sc= -0.0509 USER MOD Single : A 22 HIS : no HD1:sc= -0.0361 X(o=-0.036,f=-0.036) USER MOD Single : A 24 GLN : amide:sc= -0.141 X(o=-0.14,f=-0.12) USER MOD Single : A 29 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00771) USER MOD Single : A 31 SER OG : rot 145:sc= -1.64! USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.684 K(o=-0.68,f=-1.9) USER MOD Single : A 55 SER OG : rot 72:sc= -3.25! USER MOD Single : A 60 SER OG : rot 133:sc= 0.444 USER MOD Single : A 62 MET CE :methyl 175:sc= -0.0289 (180deg=-0.0953) USER MOD Single : A 63 LYS NZ :NH3+ -102:sc= -0.444 (180deg=-1.51!) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0.19) USER MOD Single : A 69 ASN :FLIP amide:sc= -0.0612 F(o=-2.3!,f=-0.061) USER MOD Single : A 70 LYS NZ :NH3+ -158:sc= 1.18 (180deg=1.11) USER MOD Single : A 71 GLN :FLIP amide:sc= -0.0069 F(o=-1,f=-0.0069) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 52:sc= 0.53 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.654 USER MOD Single : A 88 ASN : amide:sc= 0.841 K(o=0.84,f=-6.1!) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 HIS : no HE2:sc= -1.35 K(o=-1.4,f=-5.3) USER MOD Single : A 122 CYS SG : rot -4:sc= -0.137 USER MOD Single : A 131 ASN :FLIP amide:sc= 0 F(o=-0.69,f=0) USER MOD Single : B 1 MET CE :methyl 165:sc= -4.55! (180deg=-4.7!) USER MOD Single : B 1 MET N :NH3+ 130:sc= 0.118 (180deg=-0.0355) USER MOD Single : B 2 ASN : amide:sc= -0.0183 K(o=-0.018,f=-0.55) USER MOD Single : B 6 LYS NZ :NH3+ 170:sc= 1.23 (180deg=1.14) USER MOD Single : B 11 SER OG : rot -12:sc= -0.49 USER MOD Single : B 12 THR OG1 : rot -150:sc= 1.05 USER MOD Single : B 20 THR OG1 : rot -150:sc= -0.0413 USER MOD Single : B 21 SER OG : rot -69:sc= -0.458 USER MOD Single : B 24 GLN : amide:sc= 0.418 K(o=0.42,f=-0.18) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 31 SER OG : rot -120:sc= -0.414 USER MOD Single : B 54 TYR OH : rot 60:sc= 0.881 USER MOD Single : B 62 MET CE :methyl -132:sc= -1.02 (180deg=-5.29!) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0.26) USER MOD Single : B 69 ASN : amide:sc= 0.0259 X(o=0.026,f=-0.11) USER MOD Single : B 70 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0261) USER MOD Single : B 71 GLN : amide:sc= -0.741 X(o=-0.74,f=-0.27) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 33:sc= 0.878 USER MOD Single : B 88 ASN : amide:sc= 0.82 K(o=0.82,f=-5.9!) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 119 HIS : no HD1:sc= -3.11! C(o=-3.1!,f=-5!) USER MOD Single : B 120 HIS : no HE2:sc= 0.827 K(o=0.83,f=-2.5!) USER MOD Single : B 122 CYS SG : rot 30:sc= -2.38! USER MOD Single : B 128 THR OG1 : rot -44:sc= 0.0104 USER MOD Single : B 130 ASN : amide:sc=-0.00179 X(o=-0.0018,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.999 1.159 1.319 1.00 60.05 N ATOM 2 CA MET A 1 2.909 1.315 0.155 1.00 3.23 C ATOM 3 C MET A 1 3.411 -0.047 -0.293 1.00 42.13 C ATOM 4 O MET A 1 3.050 -1.071 0.289 1.00 30.31 O ATOM 5 CB MET A 1 4.104 2.215 0.512 1.00 13.52 C ATOM 6 CG MET A 1 4.957 1.658 1.640 1.00 60.32 C ATOM 7 SD MET A 1 6.350 2.717 2.075 1.00 71.43 S ATOM 8 CE MET A 1 7.493 2.356 0.744 1.00 20.11 C ATOM 0 H1 MET A 1 2.258 1.845 2.057 1.00 60.05 H new ATOM 0 H2 MET A 1 1.018 1.329 1.018 1.00 60.05 H new ATOM 0 H3 MET A 1 2.083 0.194 1.698 1.00 60.05 H new ATOM 0 HA MET A 1 2.352 1.784 -0.656 1.00 3.23 H new ATOM 0 HB2 MET A 1 4.726 2.350 -0.373 1.00 13.52 H new ATOM 0 HB3 MET A 1 3.736 3.201 0.796 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.332 1.513 2.521 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.333 0.677 1.351 1.00 60.32 H new ATOM 0 HE1 MET A 1 8.508 2.313 1.138 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.237 1.396 0.295 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.430 3.139 -0.012 1.00 20.11 H new ATOM 20 N ASN A 2 4.257 -0.060 -1.314 1.00 22.52 N ATOM 21 CA ASN A 2 4.800 -1.308 -1.842 1.00 14.33 C ATOM 22 C ASN A 2 6.187 -1.555 -1.264 1.00 22.14 C ATOM 23 O ASN A 2 7.200 -1.168 -1.848 1.00 72.55 O ATOM 24 CB ASN A 2 4.857 -1.287 -3.376 1.00 31.34 C ATOM 25 CG ASN A 2 5.319 -2.618 -3.957 1.00 75.52 C ATOM 26 OD1 ASN A 2 5.097 -3.681 -3.370 1.00 52.13 O ATOM 27 ND2 ASN A 2 5.955 -2.572 -5.117 1.00 35.23 N ATOM 0 H ASN A 2 4.583 0.779 -1.794 1.00 22.52 H new ATOM 0 HA ASN A 2 4.137 -2.121 -1.545 1.00 14.33 H new ATOM 0 HB2 ASN A 2 3.870 -1.044 -3.771 1.00 31.34 H new ATOM 0 HB3 ASN A 2 5.534 -0.497 -3.701 1.00 31.34 H new ATOM 0 HD21 ASN A 2 6.280 -3.434 -5.555 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.120 -1.675 -5.573 1.00 35.23 H new ATOM 34 N ILE A 3 6.216 -2.158 -0.086 1.00 0.23 N ATOM 35 CA ILE A 3 7.460 -2.448 0.608 1.00 51.02 C ATOM 36 C ILE A 3 8.255 -3.546 -0.093 1.00 3.13 C ATOM 37 O ILE A 3 7.739 -4.636 -0.349 1.00 22.24 O ATOM 38 CB ILE A 3 7.172 -2.866 2.066 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.467 -1.721 2.801 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.457 -3.257 2.788 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.348 -0.508 3.004 1.00 23.10 C ATOM 0 H ILE A 3 5.380 -2.459 0.415 1.00 0.23 H new ATOM 0 HA ILE A 3 8.060 -1.538 0.599 1.00 51.02 H new ATOM 0 HB ILE A 3 6.519 -3.739 2.056 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.581 -1.428 2.238 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.124 -2.079 3.772 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.225 -3.547 3.813 1.00 24.42 H new ATOM 0 HG22 ILE A 3 8.924 -4.095 2.271 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.142 -2.409 2.797 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.788 0.265 3.530 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.222 -0.787 3.593 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.671 -0.126 2.035 1.00 23.10 H new ATOM 53 N LEU A 4 9.508 -3.240 -0.398 1.00 41.13 N ATOM 54 CA LEU A 4 10.431 -4.206 -0.986 1.00 42.04 C ATOM 55 C LEU A 4 11.014 -5.095 0.106 1.00 41.22 C ATOM 56 O LEU A 4 11.135 -6.310 -0.064 1.00 74.21 O ATOM 57 CB LEU A 4 11.567 -3.484 -1.724 1.00 22.30 C ATOM 58 CG LEU A 4 11.129 -2.546 -2.855 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.333 -1.828 -3.459 1.00 73.22 C ATOM 60 CD2 LEU A 4 10.361 -3.314 -3.930 1.00 52.13 C ATOM 0 H LEU A 4 9.915 -2.317 -0.246 1.00 41.13 H new ATOM 0 HA LEU A 4 9.883 -4.820 -1.700 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.139 -2.907 -0.998 1.00 22.30 H new ATOM 0 HB3 LEU A 4 12.242 -4.233 -2.138 1.00 22.30 H new ATOM 0 HG LEU A 4 10.462 -1.795 -2.433 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.999 -1.168 -4.259 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.831 -1.240 -2.688 1.00 73.22 H new ATOM 0 HD13 LEU A 4 13.030 -2.563 -3.862 1.00 73.22 H new ATOM 0 HD21 LEU A 4 10.060 -2.628 -4.722 1.00 52.13 H new ATOM 0 HD22 LEU A 4 11.000 -4.093 -4.347 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.475 -3.770 -3.489 1.00 52.13 H new ATOM 72 N TYR A 5 11.372 -4.480 1.232 1.00 24.01 N ATOM 73 CA TYR A 5 11.976 -5.219 2.345 1.00 4.44 C ATOM 74 C TYR A 5 11.474 -4.682 3.678 1.00 12.52 C ATOM 75 O TYR A 5 11.454 -3.478 3.896 1.00 21.34 O ATOM 76 CB TYR A 5 13.508 -5.115 2.269 1.00 54.43 C ATOM 77 CG TYR A 5 14.262 -5.913 3.327 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.499 -5.387 4.596 1.00 4.50 C ATOM 79 CD2 TYR A 5 14.760 -7.183 3.044 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.205 -6.102 5.547 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.464 -7.903 3.993 1.00 4.33 C ATOM 82 CZ TYR A 5 15.686 -7.358 5.240 1.00 33.20 C ATOM 83 OH TYR A 5 16.399 -8.073 6.184 1.00 31.30 O ATOM 0 H TYR A 5 11.257 -3.480 1.400 1.00 24.01 H new ATOM 0 HA TYR A 5 11.687 -6.267 2.269 1.00 4.44 H new ATOM 0 HB2 TYR A 5 13.831 -5.451 1.284 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.791 -4.066 2.357 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.125 -4.404 4.841 1.00 4.50 H new ATOM 0 HD2 TYR A 5 14.594 -7.613 2.067 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.379 -5.679 6.525 1.00 2.54 H new ATOM 0 HE2 TYR A 5 15.838 -8.888 3.758 1.00 4.33 H new ATOM 0 HH TYR A 5 16.664 -8.938 5.807 1.00 31.30 H new ATOM 93 N LYS A 6 11.060 -5.579 4.562 1.00 51.40 N ATOM 94 CA LYS A 6 10.618 -5.199 5.900 1.00 43.32 C ATOM 95 C LYS A 6 11.173 -6.173 6.933 1.00 62.42 C ATOM 96 O LYS A 6 11.312 -7.370 6.665 1.00 13.53 O ATOM 97 CB LYS A 6 9.081 -5.126 5.978 1.00 1.54 C ATOM 98 CG LYS A 6 8.543 -4.909 7.395 1.00 51.03 C ATOM 99 CD LYS A 6 7.081 -4.449 7.417 1.00 30.33 C ATOM 100 CE LYS A 6 6.944 -2.958 7.113 1.00 61.32 C ATOM 101 NZ LYS A 6 5.567 -2.457 7.380 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.020 -6.581 4.377 1.00 51.40 H new ATOM 0 HA LYS A 6 11.004 -4.204 6.120 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.732 -4.315 5.339 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.662 -6.049 5.578 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.634 -5.838 7.958 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.159 -4.167 7.902 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.510 -5.022 6.686 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.649 -4.660 8.395 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.657 -2.398 7.718 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.200 -2.776 6.069 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.555 -1.420 7.308 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.910 -2.860 6.682 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.273 -2.741 8.336 1.00 4.41 H new ATOM 115 N THR A 7 11.502 -5.644 8.101 1.00 30.21 N ATOM 116 CA THR A 7 12.088 -6.424 9.175 1.00 33.22 C ATOM 117 C THR A 7 11.548 -5.946 10.523 1.00 54.23 C ATOM 118 O THR A 7 11.313 -4.746 10.721 1.00 73.02 O ATOM 119 CB THR A 7 13.631 -6.313 9.143 1.00 43.13 C ATOM 120 OG1 THR A 7 14.232 -7.161 10.134 1.00 11.53 O ATOM 121 CG2 THR A 7 14.090 -4.874 9.356 1.00 62.33 C ATOM 0 H THR A 7 11.369 -4.659 8.330 1.00 30.21 H new ATOM 0 HA THR A 7 11.815 -7.470 9.038 1.00 33.22 H new ATOM 0 HB THR A 7 13.954 -6.640 8.155 1.00 43.13 H new ATOM 0 HG1 THR A 7 13.683 -7.964 10.254 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.179 -4.831 9.328 1.00 62.33 H new ATOM 0 HG22 THR A 7 13.682 -4.241 8.568 1.00 62.33 H new ATOM 0 HG23 THR A 7 13.738 -4.519 10.325 1.00 62.33 H new ATOM 129 N ALA A 8 11.344 -6.886 11.440 1.00 51.42 N ATOM 130 CA ALA A 8 10.778 -6.575 12.745 1.00 62.45 C ATOM 131 C ALA A 8 11.817 -6.762 13.841 1.00 64.34 C ATOM 132 O ALA A 8 12.567 -7.741 13.840 1.00 4.53 O ATOM 133 CB ALA A 8 9.561 -7.450 13.017 1.00 11.23 C ATOM 0 H ALA A 8 11.564 -7.872 11.301 1.00 51.42 H new ATOM 0 HA ALA A 8 10.465 -5.531 12.742 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.149 -7.206 13.996 1.00 11.23 H new ATOM 0 HB2 ALA A 8 8.806 -7.272 12.251 1.00 11.23 H new ATOM 0 HB3 ALA A 8 9.856 -8.499 12.999 1.00 11.23 H new ATOM 139 N ALA A 9 11.865 -5.817 14.763 1.00 62.04 N ATOM 140 CA ALA A 9 12.736 -5.908 15.921 1.00 13.24 C ATOM 141 C ALA A 9 11.938 -5.627 17.187 1.00 53.42 C ATOM 142 O ALA A 9 11.397 -4.537 17.358 1.00 45.34 O ATOM 143 CB ALA A 9 13.909 -4.945 15.781 1.00 65.14 C ATOM 0 H ALA A 9 11.303 -4.967 14.730 1.00 62.04 H new ATOM 0 HA ALA A 9 13.143 -6.917 15.988 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.552 -5.025 16.657 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.480 -5.195 14.887 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.534 -3.925 15.699 1.00 65.14 H new ATOM 149 N THR A 10 11.852 -6.620 18.059 1.00 61.23 N ATOM 150 CA THR A 10 11.083 -6.512 19.283 1.00 51.35 C ATOM 151 C THR A 10 11.995 -6.102 20.432 1.00 43.21 C ATOM 152 O THR A 10 13.066 -6.682 20.633 1.00 73.43 O ATOM 153 CB THR A 10 10.357 -7.843 19.622 1.00 34.35 C ATOM 154 OG1 THR A 10 9.646 -7.720 20.861 1.00 3.15 O ATOM 155 CG2 THR A 10 11.336 -9.011 19.709 1.00 70.40 C ATOM 0 H THR A 10 12.314 -7.521 17.936 1.00 61.23 H new ATOM 0 HA THR A 10 10.319 -5.748 19.135 1.00 51.35 H new ATOM 0 HB THR A 10 9.653 -8.047 18.815 1.00 34.35 H new ATOM 0 HG1 THR A 10 9.192 -8.565 21.063 1.00 3.15 H new ATOM 0 HG21 THR A 10 10.792 -9.925 19.948 1.00 70.40 H new ATOM 0 HG22 THR A 10 11.845 -9.131 18.753 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.071 -8.812 20.489 1.00 70.40 H new ATOM 163 N SER A 11 11.585 -5.080 21.158 1.00 71.32 N ATOM 164 CA SER A 11 12.359 -4.580 22.277 1.00 2.43 C ATOM 165 C SER A 11 11.597 -4.811 23.580 1.00 11.12 C ATOM 166 O SER A 11 10.524 -4.247 23.795 1.00 53.54 O ATOM 167 CB SER A 11 12.676 -3.098 22.064 1.00 22.21 C ATOM 168 OG SER A 11 11.494 -2.323 21.979 1.00 52.01 O ATOM 0 H SER A 11 10.714 -4.577 20.991 1.00 71.32 H new ATOM 0 HA SER A 11 13.304 -5.120 22.343 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.293 -2.735 22.886 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.259 -2.977 21.151 1.00 22.21 H new ATOM 0 HG SER A 11 10.938 -2.654 21.243 1.00 52.01 H new ATOM 174 N THR A 12 12.138 -5.675 24.430 1.00 54.12 N ATOM 175 CA THR A 12 11.481 -6.065 25.663 1.00 52.53 C ATOM 176 C THR A 12 12.172 -5.435 26.870 1.00 72.12 C ATOM 177 O THR A 12 13.329 -5.021 26.786 1.00 13.04 O ATOM 178 CB THR A 12 11.519 -7.597 25.806 1.00 35.03 C ATOM 179 OG1 THR A 12 11.209 -8.211 24.544 1.00 61.53 O ATOM 180 CG2 THR A 12 10.529 -8.073 26.853 1.00 33.34 C ATOM 0 H THR A 12 13.043 -6.122 24.281 1.00 54.12 H new ATOM 0 HA THR A 12 10.449 -5.717 25.626 1.00 52.53 H new ATOM 0 HB THR A 12 12.522 -7.883 26.122 1.00 35.03 H new ATOM 0 HG1 THR A 12 11.236 -9.186 24.639 1.00 61.53 H new ATOM 0 HG21 THR A 12 10.578 -9.159 26.933 1.00 33.34 H new ATOM 0 HG22 THR A 12 10.776 -7.627 27.816 1.00 33.34 H new ATOM 0 HG23 THR A 12 9.521 -7.775 26.563 1.00 33.34 H new ATOM 188 N GLY A 13 11.465 -5.367 27.989 1.00 62.44 N ATOM 189 CA GLY A 13 12.066 -4.885 29.213 1.00 34.44 C ATOM 190 C GLY A 13 12.870 -5.966 29.915 1.00 13.14 C ATOM 191 O GLY A 13 12.401 -6.553 30.888 1.00 50.55 O ATOM 0 H GLY A 13 10.485 -5.638 28.070 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.715 -4.038 28.990 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.286 -4.521 29.882 1.00 34.44 H new ATOM 195 N GLY A 14 14.065 -6.265 29.383 1.00 62.02 N ATOM 196 CA GLY A 14 14.964 -7.214 30.033 1.00 43.32 C ATOM 197 C GLY A 14 15.360 -6.778 31.441 1.00 33.13 C ATOM 198 O GLY A 14 14.572 -6.891 32.380 1.00 44.52 O ATOM 0 H GLY A 14 14.423 -5.866 28.515 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.482 -8.191 30.081 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.862 -7.331 29.427 1.00 43.32 H new ATOM 202 N ARG A 15 16.597 -6.304 31.600 1.00 24.13 N ATOM 203 CA ARG A 15 17.046 -5.765 32.886 1.00 34.21 C ATOM 204 C ARG A 15 16.736 -4.272 32.973 1.00 4.22 C ATOM 205 O ARG A 15 16.197 -3.797 33.975 1.00 73.04 O ATOM 206 CB ARG A 15 18.541 -6.029 33.105 1.00 34.44 C ATOM 207 CG ARG A 15 18.893 -7.514 33.207 1.00 1.44 C ATOM 208 CD ARG A 15 18.009 -8.245 34.219 1.00 44.04 C ATOM 209 NE ARG A 15 18.035 -7.618 35.546 1.00 64.51 N ATOM 210 CZ ARG A 15 17.147 -7.866 36.517 1.00 22.54 C ATOM 211 NH1 ARG A 15 16.169 -8.747 36.330 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 17.251 -7.231 37.678 1.00 44.23 N ATOM 0 H ARG A 15 17.301 -6.282 30.862 1.00 24.13 H new ATOM 0 HA ARG A 15 16.502 -6.277 33.680 1.00 34.21 H new ATOM 0 HB2 ARG A 15 19.104 -5.587 32.283 1.00 34.44 H new ATOM 0 HB3 ARG A 15 18.860 -5.525 34.017 1.00 34.44 H new ATOM 0 HG2 ARG A 15 18.785 -7.980 32.228 1.00 1.44 H new ATOM 0 HG3 ARG A 15 19.939 -7.620 33.496 1.00 1.44 H new ATOM 0 HD2 ARG A 15 16.983 -8.267 33.851 1.00 44.04 H new ATOM 0 HD3 ARG A 15 18.339 -9.280 34.304 1.00 44.04 H new ATOM 0 HE ARG A 15 18.779 -6.949 35.742 1.00 64.51 H new ATOM 0 HH11 ARG A 15 16.090 -9.241 35.441 1.00 12.40 H new ATOM 0 HH12 ARG A 15 15.497 -8.929 37.076 1.00 12.40 H new ATOM 0 HH21 ARG A 15 18.004 -6.559 37.826 1.00 44.23 H new ATOM 0 HH22 ARG A 15 16.578 -7.415 38.422 1.00 44.23 H new ATOM 226 N ASP A 16 17.101 -3.535 31.926 1.00 4.14 N ATOM 227 CA ASP A 16 16.679 -2.139 31.778 1.00 22.02 C ATOM 228 C ASP A 16 16.004 -1.969 30.426 1.00 52.02 C ATOM 229 O ASP A 16 14.966 -1.309 30.308 1.00 74.22 O ATOM 230 CB ASP A 16 17.874 -1.185 31.886 1.00 50.13 C ATOM 231 CG ASP A 16 17.460 0.282 31.789 1.00 53.42 C ATOM 232 OD1 ASP A 16 17.305 0.936 32.836 1.00 45.04 O ATOM 233 OD2 ASP A 16 17.284 0.785 30.659 1.00 61.02 O1- ATOM 0 H ASP A 16 17.688 -3.879 31.166 1.00 4.14 H new ATOM 0 HA ASP A 16 15.982 -1.895 32.580 1.00 22.02 H new ATOM 0 HB2 ASP A 16 18.385 -1.353 32.834 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.588 -1.411 31.094 1.00 50.13 H new ATOM 238 N GLY A 17 16.604 -2.577 29.405 1.00 73.12 N ATOM 239 CA GLY A 17 15.931 -2.741 28.138 1.00 31.14 C ATOM 240 C GLY A 17 16.597 -3.811 27.305 1.00 63.12 C ATOM 241 O GLY A 17 17.742 -4.180 27.564 1.00 34.35 O ATOM 0 H GLY A 17 17.549 -2.959 29.439 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.887 -3.005 28.308 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.936 -1.796 27.594 1.00 31.14 H new ATOM 245 N ARG A 18 15.887 -4.321 26.317 1.00 71.41 N ATOM 246 CA ARG A 18 16.432 -5.318 25.409 1.00 64.41 C ATOM 247 C ARG A 18 15.934 -5.055 23.998 1.00 2.04 C ATOM 248 O ARG A 18 14.801 -4.627 23.815 1.00 73.24 O ATOM 249 CB ARG A 18 16.038 -6.734 25.855 1.00 30.54 C ATOM 250 CG ARG A 18 16.599 -7.822 24.948 1.00 21.30 C ATOM 251 CD ARG A 18 16.395 -9.221 25.506 1.00 2.42 C ATOM 252 NE ARG A 18 15.001 -9.673 25.435 1.00 61.43 N ATOM 253 CZ ARG A 18 14.571 -10.826 25.961 1.00 42.21 C ATOM 254 NH1 ARG A 18 15.409 -11.602 26.639 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 13.308 -11.201 25.806 1.00 11.32 N ATOM 0 H ARG A 18 14.921 -4.059 26.120 1.00 71.41 H new ATOM 0 HA ARG A 18 17.520 -5.246 25.425 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.391 -6.900 26.873 1.00 30.54 H new ATOM 0 HB3 ARG A 18 14.951 -6.812 25.878 1.00 30.54 H new ATOM 0 HG2 ARG A 18 16.123 -7.754 23.970 1.00 21.30 H new ATOM 0 HG3 ARG A 18 17.664 -7.648 24.797 1.00 21.30 H new ATOM 0 HD2 ARG A 18 17.025 -9.920 24.956 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.725 -9.243 26.545 1.00 2.42 H new ATOM 0 HE ARG A 18 14.324 -9.077 24.959 1.00 61.43 H new ATOM 0 HH11 ARG A 18 16.382 -11.319 26.759 1.00 65.11 H new ATOM 0 HH12 ARG A 18 15.080 -12.481 27.039 1.00 65.11 H new ATOM 0 HH21 ARG A 18 12.661 -10.610 25.284 1.00 11.32 H new ATOM 0 HH22 ARG A 18 12.984 -12.081 26.208 1.00 11.32 H new ATOM 269 N ALA A 19 16.785 -5.310 23.012 1.00 71.12 N ATOM 270 CA ALA A 19 16.432 -5.125 21.611 1.00 34.25 C ATOM 271 C ALA A 19 16.798 -6.376 20.824 1.00 41.03 C ATOM 272 O ALA A 19 17.952 -6.810 20.832 1.00 12.34 O ATOM 273 CB ALA A 19 17.141 -3.901 21.040 1.00 5.35 C ATOM 0 H ALA A 19 17.735 -5.649 23.160 1.00 71.12 H new ATOM 0 HA ALA A 19 15.358 -4.959 21.531 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.866 -3.777 19.992 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.844 -3.014 21.600 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.220 -4.036 21.119 1.00 5.35 H new ATOM 279 N THR A 20 15.817 -6.946 20.145 1.00 63.53 N ATOM 280 CA THR A 20 16.000 -8.198 19.429 1.00 0.02 C ATOM 281 C THR A 20 15.326 -8.141 18.063 1.00 61.21 C ATOM 282 O THR A 20 14.101 -8.107 17.967 1.00 50.32 O ATOM 283 CB THR A 20 15.417 -9.379 20.249 1.00 22.13 C ATOM 284 OG1 THR A 20 15.927 -9.346 21.592 1.00 4.20 O ATOM 285 CG2 THR A 20 15.760 -10.724 19.615 1.00 30.30 C ATOM 0 H THR A 20 14.877 -6.557 20.074 1.00 63.53 H new ATOM 0 HA THR A 20 17.070 -8.354 19.288 1.00 0.02 H new ATOM 0 HB THR A 20 14.333 -9.269 20.260 1.00 22.13 H new ATOM 0 HG1 THR A 20 16.636 -10.016 21.689 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.336 -11.528 20.216 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.347 -10.767 18.607 1.00 30.30 H new ATOM 0 HG23 THR A 20 16.843 -10.839 19.568 1.00 30.30 H new ATOM 293 N SER A 21 16.129 -8.132 17.005 1.00 52.22 N ATOM 294 CA SER A 21 15.594 -8.172 15.659 1.00 61.23 C ATOM 295 C SER A 21 15.063 -9.568 15.418 1.00 4.01 C ATOM 296 O SER A 21 15.857 -10.517 15.289 1.00 53.51 O ATOM 297 CB SER A 21 16.649 -7.810 14.609 1.00 62.30 C ATOM 298 OG SER A 21 16.120 -7.877 13.291 1.00 0.33 O ATOM 0 H SER A 21 17.147 -8.097 17.058 1.00 52.22 H new ATOM 0 HA SER A 21 14.800 -7.432 15.564 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.024 -6.805 14.801 1.00 62.30 H new ATOM 0 HB3 SER A 21 17.498 -8.489 14.696 1.00 62.30 H new ATOM 0 HG SER A 21 15.609 -7.063 13.102 1.00 0.33 H new ATOM 304 N HIS A 22 13.722 -9.648 15.363 1.00 22.03 N ATOM 305 CA HIS A 22 12.957 -10.900 15.370 1.00 2.11 C ATOM 306 C HIS A 22 13.402 -11.864 14.281 1.00 71.44 C ATOM 307 O HIS A 22 13.175 -13.071 14.379 1.00 63.31 O ATOM 308 CB HIS A 22 11.461 -10.590 15.219 1.00 42.33 C ATOM 309 CG HIS A 22 10.583 -11.809 15.150 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.246 -12.558 16.255 1.00 70.44 N ATOM 311 CD2 HIS A 22 9.964 -12.398 14.099 1.00 33.23 C ATOM 312 CE1 HIS A 22 9.459 -13.552 15.886 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.270 -13.477 14.584 1.00 41.54 N ATOM 0 H HIS A 22 13.128 -8.820 15.311 1.00 22.03 H new ATOM 0 HA HIS A 22 13.144 -11.391 16.325 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.142 -9.974 16.060 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.313 -9.998 14.316 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.009 -12.077 13.069 1.00 33.23 H new ATOM 0 HE1 HIS A 22 9.040 -14.301 16.542 1.00 21.33 H new ATOM 0 HE2 HIS A 22 8.701 -14.116 14.028 1.00 41.54 H new ATOM 322 N ASP A 23 14.066 -11.339 13.265 1.00 65.30 N ATOM 323 CA ASP A 23 14.587 -12.170 12.181 1.00 52.23 C ATOM 324 C ASP A 23 15.898 -12.826 12.616 1.00 2.53 C ATOM 325 O ASP A 23 16.667 -13.317 11.788 1.00 21.54 O ATOM 326 CB ASP A 23 14.822 -11.316 10.925 1.00 41.44 C ATOM 327 CG ASP A 23 13.544 -10.706 10.361 1.00 73.43 C ATOM 328 OD1 ASP A 23 13.023 -11.230 9.352 1.00 71.33 O ATOM 329 OD2 ASP A 23 13.062 -9.690 10.916 1.00 13.13 O1- ATOM 0 H ASP A 23 14.259 -10.343 13.164 1.00 65.30 H new ATOM 0 HA ASP A 23 13.857 -12.946 11.948 1.00 52.23 H new ATOM 0 HB2 ASP A 23 15.523 -10.516 11.164 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.291 -11.932 10.158 1.00 41.44 H new ATOM 334 N GLN A 24 16.138 -12.812 13.935 1.00 30.45 N ATOM 335 CA GLN A 24 17.342 -13.374 14.541 1.00 23.53 C ATOM 336 C GLN A 24 18.573 -12.597 14.091 1.00 71.34 C ATOM 337 O GLN A 24 19.709 -13.048 14.257 1.00 22.01 O ATOM 338 CB GLN A 24 17.489 -14.869 14.216 1.00 42.54 C ATOM 339 CG GLN A 24 16.343 -15.731 14.737 1.00 72.53 C ATOM 340 CD GLN A 24 16.121 -15.585 16.234 1.00 14.50 C ATOM 341 OE1 GLN A 24 16.745 -16.281 17.040 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.215 -14.699 16.618 1.00 4.22 N ATOM 0 H GLN A 24 15.493 -12.405 14.613 1.00 30.45 H new ATOM 0 HA GLN A 24 17.249 -13.283 15.623 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.560 -14.990 13.135 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.425 -15.232 14.639 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.426 -15.463 14.212 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.548 -16.776 14.506 1.00 72.53 H new ATOM 0 HE21 GLN A 24 14.720 -14.142 15.922 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.013 -14.574 17.610 1.00 4.22 H new ATOM 351 N LYS A 25 18.335 -11.409 13.543 1.00 22.35 N ATOM 352 CA LYS A 25 19.408 -10.562 13.058 1.00 24.04 C ATOM 353 C LYS A 25 19.996 -9.737 14.196 1.00 45.31 C ATOM 354 O LYS A 25 21.107 -9.217 14.072 1.00 73.44 O ATOM 355 CB LYS A 25 18.918 -9.646 11.924 1.00 30.31 C ATOM 356 CG LYS A 25 18.505 -10.400 10.660 1.00 12.14 C ATOM 357 CD LYS A 25 18.142 -9.454 9.512 1.00 61.23 C ATOM 358 CE LYS A 25 16.986 -8.530 9.879 1.00 52.51 C ATOM 359 NZ LYS A 25 16.580 -7.660 8.743 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.402 -11.014 13.426 1.00 22.35 H new ATOM 0 HA LYS A 25 20.191 -11.206 12.658 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.070 -9.062 12.281 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.709 -8.939 11.673 1.00 30.31 H new ATOM 0 HG2 LYS A 25 19.320 -11.053 10.346 1.00 12.14 H new ATOM 0 HG3 LYS A 25 17.652 -11.040 10.884 1.00 12.14 H new ATOM 0 HD2 LYS A 25 19.014 -8.856 9.245 1.00 61.23 H new ATOM 0 HD3 LYS A 25 17.874 -10.038 8.631 1.00 61.23 H new ATOM 0 HE2 LYS A 25 16.133 -9.128 10.200 1.00 52.51 H new ATOM 0 HE3 LYS A 25 17.275 -7.908 10.726 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 15.582 -7.390 8.852 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 17.171 -6.804 8.732 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 16.703 -8.177 7.849 1.00 22.01 H new ATOM 373 N LEU A 26 19.258 -9.597 15.308 1.00 32.33 N ATOM 374 CA LEU A 26 19.802 -8.892 16.467 1.00 24.31 C ATOM 375 C LEU A 26 19.216 -9.433 17.762 1.00 21.31 C ATOM 376 O LEU A 26 18.053 -9.817 17.799 1.00 11.34 O ATOM 377 CB LEU A 26 19.508 -7.394 16.347 1.00 35.55 C ATOM 378 CG LEU A 26 19.925 -6.535 17.544 1.00 2.25 C ATOM 379 CD1 LEU A 26 21.445 -6.510 17.697 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.361 -5.128 17.400 1.00 74.42 C ATOM 0 H LEU A 26 18.309 -9.953 15.424 1.00 32.33 H new ATOM 0 HA LEU A 26 20.880 -9.051 16.490 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.012 -7.014 15.458 1.00 35.55 H new ATOM 0 HB3 LEU A 26 18.438 -7.265 16.186 1.00 35.55 H new ATOM 0 HG LEU A 26 19.514 -6.978 18.451 1.00 2.25 H new ATOM 0 HD11 LEU A 26 21.714 -5.893 18.554 1.00 31.22 H new ATOM 0 HD12 LEU A 26 21.812 -7.525 17.851 1.00 31.22 H new ATOM 0 HD13 LEU A 26 21.895 -6.094 16.795 1.00 31.22 H new ATOM 0 HD21 LEU A 26 19.663 -4.525 18.256 1.00 74.42 H new ATOM 0 HD22 LEU A 26 19.742 -4.675 16.485 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.273 -5.175 17.356 1.00 74.42 H new ATOM 392 N ASP A 27 20.033 -9.453 18.813 1.00 3.11 N ATOM 393 CA ASP A 27 19.583 -9.831 20.149 1.00 12.11 C ATOM 394 C ASP A 27 20.591 -9.362 21.196 1.00 11.44 C ATOM 395 O ASP A 27 21.598 -10.030 21.443 1.00 42.31 O ATOM 396 CB ASP A 27 19.373 -11.350 20.260 1.00 5.04 C ATOM 397 CG ASP A 27 19.048 -11.789 21.682 1.00 74.13 C ATOM 398 OD1 ASP A 27 19.747 -12.681 22.214 1.00 54.23 O ATOM 399 OD2 ASP A 27 18.102 -11.235 22.285 1.00 11.42 O1- ATOM 0 H ASP A 27 21.022 -9.208 18.762 1.00 3.11 H new ATOM 0 HA ASP A 27 18.624 -9.345 20.331 1.00 12.11 H new ATOM 0 HB2 ASP A 27 18.563 -11.652 19.596 1.00 5.04 H new ATOM 0 HB3 ASP A 27 20.272 -11.864 19.920 1.00 5.04 H new ATOM 404 N VAL A 28 20.331 -8.193 21.774 1.00 5.03 N ATOM 405 CA VAL A 28 21.179 -7.622 22.829 1.00 42.02 C ATOM 406 C VAL A 28 20.344 -6.856 23.846 1.00 62.12 C ATOM 407 O VAL A 28 19.133 -6.708 23.686 1.00 32.30 O ATOM 408 CB VAL A 28 22.269 -6.671 22.265 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.418 -7.465 21.654 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.670 -5.695 21.252 1.00 1.00 C ATOM 0 H VAL A 28 19.530 -7.612 21.529 1.00 5.03 H new ATOM 0 HA VAL A 28 21.672 -8.467 23.310 1.00 42.02 H new ATOM 0 HB VAL A 28 22.671 -6.086 23.092 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.169 -6.777 21.266 1.00 34.22 H new ATOM 0 HG12 VAL A 28 23.868 -8.100 22.417 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.040 -8.086 20.842 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.453 -5.039 20.871 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.230 -6.253 20.425 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.899 -5.096 21.736 1.00 1.00 H new ATOM 420 N LYS A 29 21.009 -6.358 24.883 1.00 24.10 N ATOM 421 CA LYS A 29 20.351 -5.638 25.968 1.00 44.35 C ATOM 422 C LYS A 29 20.998 -4.274 26.166 1.00 43.02 C ATOM 423 O LYS A 29 22.213 -4.117 26.012 1.00 12.55 O ATOM 424 CB LYS A 29 20.404 -6.489 27.259 1.00 13.02 C ATOM 425 CG LYS A 29 20.318 -5.711 28.584 1.00 22.53 C ATOM 426 CD LYS A 29 21.689 -5.239 29.083 1.00 24.23 C ATOM 427 CE LYS A 29 22.649 -6.399 29.340 1.00 1.41 C ATOM 428 NZ LYS A 29 22.217 -7.246 30.485 1.00 62.42 N1+ ATOM 0 H LYS A 29 22.019 -6.442 24.995 1.00 24.10 H new ATOM 0 HA LYS A 29 19.305 -5.468 25.714 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.586 -7.209 27.230 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.332 -7.061 27.256 1.00 13.02 H new ATOM 0 HG2 LYS A 29 19.667 -4.847 28.452 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.858 -6.344 29.343 1.00 22.53 H new ATOM 0 HD2 LYS A 29 22.128 -4.565 28.347 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.560 -4.667 30.002 1.00 24.23 H new ATOM 0 HE2 LYS A 29 22.721 -7.014 28.443 1.00 1.41 H new ATOM 0 HE3 LYS A 29 23.646 -6.006 29.538 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 22.925 -7.989 30.654 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 22.124 -6.657 31.337 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 21.300 -7.685 30.266 1.00 62.42 H new ATOM 442 N LEU A 30 20.184 -3.282 26.505 1.00 2.53 N ATOM 443 CA LEU A 30 20.674 -1.947 26.765 1.00 41.03 C ATOM 444 C LEU A 30 20.160 -1.433 28.110 1.00 64.12 C ATOM 445 O LEU A 30 19.258 -2.039 28.731 1.00 54.30 O ATOM 446 CB LEU A 30 20.335 -0.984 25.601 1.00 11.12 C ATOM 447 CG LEU A 30 18.907 -1.034 25.014 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.652 -2.320 24.226 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.864 -0.832 26.099 1.00 54.12 C ATOM 0 H LEU A 30 19.174 -3.385 26.605 1.00 2.53 H new ATOM 0 HA LEU A 30 21.761 -1.989 26.828 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.520 0.034 25.944 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.037 -1.179 24.790 1.00 11.12 H new ATOM 0 HG LEU A 30 18.820 -0.209 24.307 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.636 -2.310 23.833 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.360 -2.387 23.400 1.00 21.32 H new ATOM 0 HD13 LEU A 30 18.778 -3.180 24.883 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.868 -0.872 25.658 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.961 -1.618 26.848 1.00 54.12 H new ATOM 0 HD23 LEU A 30 18.013 0.139 26.571 1.00 54.12 H new ATOM 461 N SER A 31 20.751 -0.332 28.559 1.00 75.34 N ATOM 462 CA SER A 31 20.451 0.232 29.863 1.00 34.22 C ATOM 463 C SER A 31 20.624 1.749 29.851 1.00 62.41 C ATOM 464 O SER A 31 21.576 2.268 29.265 1.00 64.13 O ATOM 465 CB SER A 31 21.365 -0.393 30.921 1.00 52.23 C ATOM 466 OG SER A 31 21.241 -1.810 30.924 1.00 11.31 O ATOM 0 H SER A 31 21.449 0.191 28.029 1.00 75.34 H new ATOM 0 HA SER A 31 19.412 0.009 30.107 1.00 34.22 H new ATOM 0 HB2 SER A 31 22.400 -0.115 30.724 1.00 52.23 H new ATOM 0 HB3 SER A 31 21.111 0.001 31.905 1.00 52.23 H new ATOM 0 HG SER A 31 22.111 -2.214 31.125 1.00 11.31 H new ATOM 472 N ALA A 32 19.689 2.449 30.489 1.00 52.21 N ATOM 473 CA ALA A 32 19.762 3.899 30.622 1.00 43.51 C ATOM 474 C ALA A 32 20.791 4.288 31.688 1.00 25.12 C ATOM 475 O ALA A 32 20.780 3.737 32.799 1.00 4.30 O ATOM 476 CB ALA A 32 18.387 4.467 30.967 1.00 22.44 C ATOM 0 H ALA A 32 18.867 2.030 30.924 1.00 52.21 H new ATOM 0 HA ALA A 32 20.082 4.322 29.670 1.00 43.51 H new ATOM 0 HB1 ALA A 32 18.455 5.551 31.064 1.00 22.44 H new ATOM 0 HB2 ALA A 32 17.681 4.217 30.175 1.00 22.44 H new ATOM 0 HB3 ALA A 32 18.043 4.040 31.909 1.00 22.44 H new ATOM 482 N PRO A 33 21.697 5.236 31.366 1.00 32.33 N ATOM 483 CA PRO A 33 22.718 5.716 32.307 1.00 35.40 C ATOM 484 C PRO A 33 22.105 6.152 33.637 1.00 50.42 C ATOM 485 O PRO A 33 21.280 7.070 33.679 1.00 70.53 O ATOM 486 CB PRO A 33 23.343 6.916 31.579 1.00 73.33 C ATOM 487 CG PRO A 33 23.110 6.641 30.132 1.00 10.15 C ATOM 488 CD PRO A 33 21.794 5.915 30.054 1.00 32.53 C ATOM 0 HA PRO A 33 23.440 4.941 32.563 1.00 35.40 H new ATOM 0 HB2 PRO A 33 22.876 7.852 31.885 1.00 73.33 H new ATOM 0 HB3 PRO A 33 24.407 7.003 31.800 1.00 73.33 H new ATOM 0 HG2 PRO A 33 23.079 7.568 29.559 1.00 10.15 H new ATOM 0 HG3 PRO A 33 23.915 6.035 29.715 1.00 10.15 H new ATOM 0 HD2 PRO A 33 20.964 6.604 29.896 1.00 32.53 H new ATOM 0 HD3 PRO A 33 21.777 5.201 29.230 1.00 32.53 H new ATOM 496 N ARG A 34 22.512 5.502 34.726 1.00 10.53 N ATOM 497 CA ARG A 34 21.931 5.782 36.035 1.00 33.33 C ATOM 498 C ARG A 34 22.312 7.184 36.503 1.00 40.12 C ATOM 499 O ARG A 34 21.690 7.737 37.411 1.00 0.24 O ATOM 500 CB ARG A 34 22.346 4.728 37.067 1.00 35.21 C ATOM 501 CG ARG A 34 21.629 4.874 38.403 1.00 34.41 C ATOM 502 CD ARG A 34 21.757 3.621 39.260 1.00 50.12 C ATOM 503 NE ARG A 34 21.250 3.823 40.619 1.00 3.50 N ATOM 504 CZ ARG A 34 20.033 3.460 41.046 1.00 2.33 C ATOM 505 NH1 ARG A 34 19.134 2.964 40.200 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 19.714 3.626 42.322 1.00 21.42 N ATOM 0 H ARG A 34 23.236 4.784 34.727 1.00 10.53 H new ATOM 0 HA ARG A 34 20.846 5.736 35.937 1.00 33.33 H new ATOM 0 HB2 ARG A 34 22.146 3.736 36.662 1.00 35.21 H new ATOM 0 HB3 ARG A 34 23.422 4.795 37.231 1.00 35.21 H new ATOM 0 HG2 ARG A 34 22.040 5.726 38.944 1.00 34.41 H new ATOM 0 HG3 ARG A 34 20.575 5.087 38.227 1.00 34.41 H new ATOM 0 HD2 ARG A 34 21.211 2.804 38.789 1.00 50.12 H new ATOM 0 HD3 ARG A 34 22.804 3.320 39.306 1.00 50.12 H new ATOM 0 HE ARG A 34 21.870 4.274 41.291 1.00 3.50 H new ATOM 0 HH11 ARG A 34 19.368 2.856 39.213 1.00 23.02 H new ATOM 0 HH12 ARG A 34 18.211 2.692 40.538 1.00 23.02 H new ATOM 0 HH21 ARG A 34 20.393 4.027 42.969 1.00 21.42 H new ATOM 0 HH22 ARG A 34 18.790 3.353 42.656 1.00 21.42 H new ATOM 520 N GLU A 35 23.326 7.754 35.853 1.00 72.31 N ATOM 521 CA GLU A 35 23.729 9.143 36.082 1.00 75.14 C ATOM 522 C GLU A 35 22.518 10.071 36.011 1.00 65.21 C ATOM 523 O GLU A 35 22.419 11.055 36.745 1.00 33.12 O ATOM 524 CB GLU A 35 24.747 9.573 35.014 1.00 20.34 C ATOM 525 CG GLU A 35 26.049 8.781 35.035 1.00 71.30 C ATOM 526 CD GLU A 35 26.778 8.878 36.366 1.00 31.03 C ATOM 527 OE1 GLU A 35 26.843 7.860 37.090 1.00 31.45 O ATOM 528 OE2 GLU A 35 27.286 9.970 36.693 1.00 43.03 O1- ATOM 0 H GLU A 35 23.890 7.269 35.155 1.00 72.31 H new ATOM 0 HA GLU A 35 24.177 9.211 37.073 1.00 75.14 H new ATOM 0 HB2 GLU A 35 24.289 9.471 34.030 1.00 20.34 H new ATOM 0 HB3 GLU A 35 24.976 10.630 35.151 1.00 20.34 H new ATOM 0 HG2 GLU A 35 25.835 7.734 34.819 1.00 71.30 H new ATOM 0 HG3 GLU A 35 26.702 9.144 34.241 1.00 71.30 H new ATOM 535 N LEU A 36 21.589 9.720 35.132 1.00 33.22 N ATOM 536 CA LEU A 36 20.447 10.566 34.812 1.00 32.24 C ATOM 537 C LEU A 36 19.192 10.083 35.540 1.00 55.25 C ATOM 538 O LEU A 36 18.081 10.536 35.261 1.00 40.24 O ATOM 539 CB LEU A 36 20.248 10.555 33.292 1.00 11.21 C ATOM 540 CG LEU A 36 21.531 10.857 32.493 1.00 24.22 C ATOM 541 CD1 LEU A 36 21.337 10.584 31.007 1.00 52.21 C ATOM 542 CD2 LEU A 36 21.986 12.297 32.723 1.00 63.44 C ATOM 0 H LEU A 36 21.606 8.838 34.619 1.00 33.22 H new ATOM 0 HA LEU A 36 20.635 11.586 35.146 1.00 32.24 H new ATOM 0 HB2 LEU A 36 19.866 9.579 32.992 1.00 11.21 H new ATOM 0 HB3 LEU A 36 19.487 11.290 33.030 1.00 11.21 H new ATOM 0 HG LEU A 36 22.312 10.188 32.855 1.00 24.22 H new ATOM 0 HD11 LEU A 36 22.260 10.807 30.472 1.00 52.21 H new ATOM 0 HD12 LEU A 36 21.077 9.536 30.861 1.00 52.21 H new ATOM 0 HD13 LEU A 36 20.534 11.214 30.623 1.00 52.21 H new ATOM 0 HD21 LEU A 36 22.893 12.488 32.149 1.00 63.44 H new ATOM 0 HD22 LEU A 36 21.202 12.982 32.401 1.00 63.44 H new ATOM 0 HD23 LEU A 36 22.188 12.450 33.783 1.00 63.44 H new ATOM 554 N GLY A 37 19.386 9.173 36.493 1.00 72.22 N ATOM 555 CA GLY A 37 18.280 8.654 37.283 1.00 12.23 C ATOM 556 C GLY A 37 17.656 7.415 36.670 1.00 31.23 C ATOM 557 O GLY A 37 16.447 7.372 36.433 1.00 41.24 O ATOM 0 H GLY A 37 20.297 8.783 36.734 1.00 72.22 H new ATOM 0 HA2 GLY A 37 18.634 8.419 38.287 1.00 12.23 H new ATOM 0 HA3 GLY A 37 17.518 9.427 37.386 1.00 12.23 H new ATOM 561 N GLY A 38 18.482 6.400 36.430 1.00 73.44 N ATOM 562 CA GLY A 38 18.013 5.168 35.821 1.00 31.42 C ATOM 563 C GLY A 38 18.524 3.945 36.555 1.00 22.15 C ATOM 564 O GLY A 38 18.555 3.919 37.785 1.00 21.21 O ATOM 0 H GLY A 38 19.478 6.411 36.649 1.00 73.44 H new ATOM 0 HA2 GLY A 38 16.923 5.158 35.814 1.00 31.42 H new ATOM 0 HA3 GLY A 38 18.339 5.130 34.781 1.00 31.42 H new ATOM 568 N ALA A 39 18.958 2.943 35.802 1.00 14.21 N ATOM 569 CA ALA A 39 19.389 1.669 36.383 1.00 43.43 C ATOM 570 C ALA A 39 20.909 1.528 36.365 1.00 63.22 C ATOM 571 O ALA A 39 21.487 0.895 37.248 1.00 3.43 O ATOM 572 CB ALA A 39 18.745 0.502 35.646 1.00 5.43 C ATOM 0 H ALA A 39 19.023 2.984 34.785 1.00 14.21 H new ATOM 0 HA ALA A 39 19.064 1.656 37.423 1.00 43.43 H new ATOM 0 HB1 ALA A 39 19.076 -0.436 36.091 1.00 5.43 H new ATOM 0 HB2 ALA A 39 17.660 0.577 35.723 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.037 0.529 34.596 1.00 5.43 H new ATOM 578 N GLY A 40 21.554 2.150 35.378 1.00 15.31 N ATOM 579 CA GLY A 40 22.994 2.006 35.205 1.00 42.15 C ATOM 580 C GLY A 40 23.447 0.556 35.136 1.00 45.53 C ATOM 581 O GLY A 40 24.481 0.191 35.702 1.00 15.12 O ATOM 0 H GLY A 40 21.103 2.754 34.691 1.00 15.31 H new ATOM 0 HA2 GLY A 40 23.297 2.518 34.292 1.00 42.15 H new ATOM 0 HA3 GLY A 40 23.504 2.500 36.032 1.00 42.15 H new ATOM 585 N ALA A 41 22.664 -0.270 34.456 1.00 5.32 N ATOM 586 CA ALA A 41 23.004 -1.677 34.279 1.00 5.21 C ATOM 587 C ALA A 41 24.059 -1.830 33.184 1.00 44.21 C ATOM 588 O ALA A 41 24.283 -0.909 32.396 1.00 13.22 O ATOM 589 CB ALA A 41 21.751 -2.486 33.952 1.00 40.21 C ATOM 0 H ALA A 41 21.787 0.010 34.017 1.00 5.32 H new ATOM 0 HA ALA A 41 23.422 -2.062 35.209 1.00 5.21 H new ATOM 0 HB1 ALA A 41 22.019 -3.535 33.822 1.00 40.21 H new ATOM 0 HB2 ALA A 41 21.034 -2.393 34.768 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.304 -2.109 33.032 1.00 40.21 H new ATOM 595 N GLU A 42 24.712 -2.988 33.148 1.00 32.32 N ATOM 596 CA GLU A 42 25.764 -3.257 32.166 1.00 71.23 C ATOM 597 C GLU A 42 25.169 -3.531 30.782 1.00 1.12 C ATOM 598 O GLU A 42 25.226 -4.651 30.267 1.00 55.43 O ATOM 599 CB GLU A 42 26.633 -4.435 32.630 1.00 42.31 C ATOM 600 CG GLU A 42 25.832 -5.681 32.994 1.00 52.14 C ATOM 601 CD GLU A 42 26.705 -6.814 33.501 1.00 31.41 C ATOM 602 OE1 GLU A 42 26.716 -7.894 32.874 1.00 24.22 O ATOM 603 OE2 GLU A 42 27.397 -6.626 34.525 1.00 54.53 O1- ATOM 0 H GLU A 42 24.532 -3.760 33.790 1.00 32.32 H new ATOM 0 HA GLU A 42 26.393 -2.371 32.086 1.00 71.23 H new ATOM 0 HB2 GLU A 42 27.341 -4.687 31.840 1.00 42.31 H new ATOM 0 HB3 GLU A 42 27.219 -4.124 33.495 1.00 42.31 H new ATOM 0 HG2 GLU A 42 25.097 -5.425 33.757 1.00 52.14 H new ATOM 0 HG3 GLU A 42 25.277 -6.019 32.119 1.00 52.14 H new ATOM 610 N GLY A 43 24.589 -2.499 30.191 1.00 3.30 N ATOM 611 CA GLY A 43 23.998 -2.617 28.874 1.00 20.41 C ATOM 612 C GLY A 43 24.544 -1.589 27.909 1.00 55.55 C ATOM 613 O GLY A 43 25.560 -0.947 28.184 1.00 25.21 O ATOM 0 H GLY A 43 24.516 -1.570 30.606 1.00 3.30 H new ATOM 0 HA2 GLY A 43 24.185 -3.617 28.482 1.00 20.41 H new ATOM 0 HA3 GLY A 43 22.917 -2.502 28.951 1.00 20.41 H new ATOM 617 N THR A 44 23.865 -1.426 26.783 1.00 1.14 N ATOM 618 CA THR A 44 24.277 -0.470 25.766 1.00 0.00 C ATOM 619 C THR A 44 23.589 0.876 26.004 1.00 54.32 C ATOM 620 O THR A 44 22.456 0.919 26.482 1.00 53.24 O ATOM 621 CB THR A 44 23.929 -0.995 24.351 1.00 74.01 C ATOM 622 OG1 THR A 44 24.495 -2.300 24.166 1.00 60.01 O ATOM 623 CG2 THR A 44 24.446 -0.060 23.259 1.00 54.14 C ATOM 0 H THR A 44 23.020 -1.948 26.550 1.00 1.14 H new ATOM 0 HA THR A 44 25.357 -0.339 25.833 1.00 0.00 H new ATOM 0 HB THR A 44 22.843 -1.042 24.272 1.00 74.01 H new ATOM 0 HG1 THR A 44 24.271 -2.630 23.271 1.00 60.01 H new ATOM 0 HG21 THR A 44 24.182 -0.462 22.281 1.00 54.14 H new ATOM 0 HG22 THR A 44 23.995 0.925 23.380 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.530 0.025 23.336 1.00 54.14 H new ATOM 631 N ASN A 45 24.283 1.965 25.693 1.00 72.33 N ATOM 632 CA ASN A 45 23.707 3.303 25.797 1.00 33.43 C ATOM 633 C ASN A 45 22.792 3.569 24.608 1.00 24.30 C ATOM 634 O ASN A 45 23.253 3.549 23.465 1.00 63.01 O ATOM 635 CB ASN A 45 24.811 4.370 25.834 1.00 4.20 C ATOM 636 CG ASN A 45 25.572 4.399 27.142 1.00 5.33 C ATOM 637 OD1 ASN A 45 26.518 3.636 27.340 1.00 50.31 O ATOM 638 ND2 ASN A 45 25.195 5.307 28.027 1.00 41.45 N ATOM 0 H ASN A 45 25.249 1.948 25.366 1.00 72.33 H new ATOM 0 HA ASN A 45 23.134 3.355 26.722 1.00 33.43 H new ATOM 0 HB2 ASN A 45 25.511 4.187 25.019 1.00 4.20 H new ATOM 0 HB3 ASN A 45 24.366 5.349 25.659 1.00 4.20 H new ATOM 0 HD21 ASN A 45 25.694 5.394 28.912 1.00 41.45 H new ATOM 0 HD22 ASN A 45 24.406 5.920 27.824 1.00 41.45 H new ATOM 645 N PRO A 46 21.485 3.794 24.851 1.00 63.04 N ATOM 646 CA PRO A 46 20.540 4.177 23.794 1.00 61.02 C ATOM 647 C PRO A 46 21.095 5.301 22.914 1.00 4.44 C ATOM 648 O PRO A 46 20.993 5.253 21.682 1.00 23.02 O ATOM 649 CB PRO A 46 19.311 4.648 24.582 1.00 23.35 C ATOM 650 CG PRO A 46 19.359 3.866 25.853 1.00 42.23 C ATOM 651 CD PRO A 46 20.823 3.678 26.169 1.00 1.14 C ATOM 0 HA PRO A 46 20.326 3.360 23.104 1.00 61.02 H new ATOM 0 HB2 PRO A 46 19.350 5.720 24.774 1.00 23.35 H new ATOM 0 HB3 PRO A 46 18.390 4.456 24.032 1.00 23.35 H new ATOM 0 HG2 PRO A 46 18.851 4.397 26.658 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.858 2.905 25.739 1.00 42.23 H new ATOM 0 HD2 PRO A 46 21.183 4.435 26.866 1.00 1.14 H new ATOM 0 HD3 PRO A 46 21.012 2.708 26.628 1.00 1.14 H new ATOM 659 N GLU A 47 21.709 6.293 23.564 1.00 25.31 N ATOM 660 CA GLU A 47 22.325 7.424 22.863 1.00 53.11 C ATOM 661 C GLU A 47 23.406 6.909 21.914 1.00 42.42 C ATOM 662 O GLU A 47 23.435 7.248 20.729 1.00 0.52 O ATOM 663 CB GLU A 47 22.968 8.433 23.846 1.00 52.55 C ATOM 664 CG GLU A 47 22.262 8.586 25.193 1.00 35.10 C ATOM 665 CD GLU A 47 22.620 7.474 26.173 1.00 32.04 C ATOM 666 OE1 GLU A 47 23.782 7.429 26.633 1.00 53.13 O ATOM 667 OE2 GLU A 47 21.751 6.635 26.471 1.00 62.13 O1- ATOM 0 H GLU A 47 21.793 6.336 24.580 1.00 25.31 H new ATOM 0 HA GLU A 47 21.537 7.936 22.311 1.00 53.11 H new ATOM 0 HB2 GLU A 47 23.998 8.128 24.029 1.00 52.55 H new ATOM 0 HB3 GLU A 47 23.006 9.409 23.363 1.00 52.55 H new ATOM 0 HG2 GLU A 47 22.526 9.549 25.630 1.00 35.10 H new ATOM 0 HG3 GLU A 47 21.184 8.593 25.035 1.00 35.10 H new ATOM 674 N GLN A 48 24.285 6.076 22.463 1.00 41.14 N ATOM 675 CA GLN A 48 25.412 5.513 21.729 1.00 71.11 C ATOM 676 C GLN A 48 24.930 4.628 20.583 1.00 34.04 C ATOM 677 O GLN A 48 25.559 4.568 19.523 1.00 32.22 O ATOM 678 CB GLN A 48 26.295 4.723 22.708 1.00 12.45 C ATOM 679 CG GLN A 48 27.450 3.944 22.081 1.00 72.35 C ATOM 680 CD GLN A 48 27.105 2.484 21.814 1.00 3.55 C ATOM 681 OE1 GLN A 48 27.258 1.632 22.687 1.00 43.42 O ATOM 682 NE2 GLN A 48 26.656 2.182 20.606 1.00 72.04 N ATOM 0 H GLN A 48 24.235 5.771 23.435 1.00 41.14 H new ATOM 0 HA GLN A 48 25.997 6.319 21.286 1.00 71.11 H new ATOM 0 HB2 GLN A 48 26.706 5.419 23.440 1.00 12.45 H new ATOM 0 HB3 GLN A 48 25.663 4.022 23.254 1.00 12.45 H new ATOM 0 HG2 GLN A 48 27.737 4.421 21.144 1.00 72.35 H new ATOM 0 HG3 GLN A 48 28.315 3.993 22.742 1.00 72.35 H new ATOM 0 HE21 GLN A 48 26.541 2.915 19.906 1.00 72.04 H new ATOM 0 HE22 GLN A 48 26.424 1.216 20.375 1.00 72.04 H new ATOM 691 N LEU A 49 23.812 3.945 20.802 1.00 51.33 N ATOM 692 CA LEU A 49 23.255 3.038 19.808 1.00 61.13 C ATOM 693 C LEU A 49 22.759 3.841 18.604 1.00 21.55 C ATOM 694 O LEU A 49 23.140 3.566 17.462 1.00 71.11 O ATOM 695 CB LEU A 49 22.122 2.204 20.445 1.00 4.20 C ATOM 696 CG LEU A 49 21.642 0.968 19.652 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.841 1.369 18.418 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.830 0.089 19.256 1.00 52.41 C ATOM 0 H LEU A 49 23.271 4.004 21.665 1.00 51.33 H new ATOM 0 HA LEU A 49 24.022 2.348 19.458 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.456 1.870 21.427 1.00 4.20 H new ATOM 0 HB3 LEU A 49 21.266 2.859 20.606 1.00 4.20 H new ATOM 0 HG LEU A 49 20.982 0.395 20.303 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.520 0.474 17.886 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.966 1.943 18.723 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.463 1.978 17.762 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.472 -0.777 18.698 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.516 0.663 18.634 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.349 -0.247 20.154 1.00 52.41 H new ATOM 710 N PHE A 50 21.924 4.840 18.873 1.00 3.42 N ATOM 711 CA PHE A 50 21.406 5.716 17.823 1.00 25.51 C ATOM 712 C PHE A 50 22.552 6.431 17.104 1.00 64.45 C ATOM 713 O PHE A 50 22.576 6.502 15.879 1.00 15.22 O ATOM 714 CB PHE A 50 20.424 6.732 18.419 1.00 52.14 C ATOM 715 CG PHE A 50 20.011 7.832 17.467 1.00 40.34 C ATOM 716 CD1 PHE A 50 19.215 7.564 16.357 1.00 40.14 C ATOM 717 CD2 PHE A 50 20.411 9.142 17.689 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.832 8.575 15.500 1.00 11.20 C ATOM 719 CE2 PHE A 50 20.032 10.153 16.832 1.00 34.34 C ATOM 720 CZ PHE A 50 19.239 9.867 15.736 1.00 61.21 C ATOM 0 H PHE A 50 21.590 5.065 19.810 1.00 3.42 H new ATOM 0 HA PHE A 50 20.875 5.107 17.092 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.531 6.203 18.754 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.877 7.183 19.302 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.893 6.551 16.164 1.00 40.14 H new ATOM 0 HD2 PHE A 50 21.028 9.373 18.545 1.00 31.01 H new ATOM 0 HE1 PHE A 50 18.213 8.352 14.644 1.00 11.20 H new ATOM 0 HE2 PHE A 50 20.354 11.167 17.016 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.939 10.659 15.065 1.00 61.21 H new ATOM 730 N ALA A 51 23.490 6.959 17.885 1.00 33.43 N ATOM 731 CA ALA A 51 24.688 7.609 17.350 1.00 33.33 C ATOM 732 C ALA A 51 25.403 6.712 16.342 1.00 4.13 C ATOM 733 O ALA A 51 25.674 7.120 15.205 1.00 52.03 O ATOM 734 CB ALA A 51 25.634 7.961 18.493 1.00 51.41 C ATOM 0 H ALA A 51 23.444 6.950 18.904 1.00 33.43 H new ATOM 0 HA ALA A 51 24.381 8.518 16.833 1.00 33.33 H new ATOM 0 HB1 ALA A 51 26.525 8.445 18.092 1.00 51.41 H new ATOM 0 HB2 ALA A 51 25.133 8.639 19.184 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.921 7.052 19.021 1.00 51.41 H new ATOM 740 N ALA A 52 25.693 5.485 16.769 1.00 32.43 N ATOM 741 CA ALA A 52 26.392 4.515 15.935 1.00 41.10 C ATOM 742 C ALA A 52 25.610 4.222 14.656 1.00 30.53 C ATOM 743 O ALA A 52 26.169 4.249 13.562 1.00 13.40 O ATOM 744 CB ALA A 52 26.641 3.226 16.716 1.00 51.43 C ATOM 0 H ALA A 52 25.451 5.138 17.697 1.00 32.43 H new ATOM 0 HA ALA A 52 27.352 4.944 15.650 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.164 2.511 16.081 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.249 3.444 17.594 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.688 2.802 17.032 1.00 51.43 H new ATOM 750 N GLY A 53 24.316 3.957 14.807 1.00 32.23 N ATOM 751 CA GLY A 53 23.476 3.640 13.662 1.00 45.35 C ATOM 752 C GLY A 53 23.323 4.809 12.706 1.00 24.44 C ATOM 753 O GLY A 53 23.309 4.625 11.488 1.00 23.31 O ATOM 0 H GLY A 53 23.831 3.956 15.704 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.903 2.792 13.127 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.491 3.332 14.013 1.00 45.35 H new ATOM 757 N TYR A 54 23.220 6.010 13.263 1.00 20.42 N ATOM 758 CA TYR A 54 23.042 7.225 12.472 1.00 1.52 C ATOM 759 C TYR A 54 24.291 7.500 11.637 1.00 10.14 C ATOM 760 O TYR A 54 24.208 7.814 10.446 1.00 3.35 O ATOM 761 CB TYR A 54 22.738 8.411 13.402 1.00 4.31 C ATOM 762 CG TYR A 54 22.410 9.725 12.706 1.00 71.40 C ATOM 763 CD1 TYR A 54 22.081 9.778 11.350 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.413 10.917 13.423 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.770 10.982 10.738 1.00 65.13 C ATOM 766 CE2 TYR A 54 22.107 12.119 12.819 1.00 14.31 C ATOM 767 CZ TYR A 54 21.783 12.149 11.480 1.00 61.32 C ATOM 768 OH TYR A 54 21.476 13.352 10.879 1.00 14.13 O ATOM 0 H TYR A 54 23.257 6.170 14.270 1.00 20.42 H new ATOM 0 HA TYR A 54 22.201 7.089 11.792 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.899 8.141 14.043 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.598 8.570 14.052 1.00 4.31 H new ATOM 0 HD1 TYR A 54 22.069 8.867 10.770 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.660 10.901 14.474 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.519 11.009 9.688 1.00 65.13 H new ATOM 0 HE2 TYR A 54 22.121 13.033 13.394 1.00 14.31 H new ATOM 0 HH TYR A 54 20.637 13.698 11.249 1.00 14.13 H new ATOM 778 N SER A 55 25.449 7.373 12.260 1.00 11.10 N ATOM 779 CA SER A 55 26.706 7.576 11.558 1.00 22.53 C ATOM 780 C SER A 55 26.922 6.456 10.544 1.00 50.31 C ATOM 781 O SER A 55 27.212 6.711 9.376 1.00 23.31 O ATOM 782 CB SER A 55 27.853 7.639 12.558 1.00 0.44 C ATOM 783 OG SER A 55 27.606 8.634 13.528 1.00 35.10 O ATOM 0 H SER A 55 25.546 7.131 13.246 1.00 11.10 H new ATOM 0 HA SER A 55 26.672 8.522 11.018 1.00 22.53 H new ATOM 0 HB2 SER A 55 27.974 6.671 13.044 1.00 0.44 H new ATOM 0 HB3 SER A 55 28.786 7.853 12.037 1.00 0.44 H new ATOM 0 HG SER A 55 26.894 8.333 14.131 1.00 35.10 H new ATOM 789 N ALA A 56 26.728 5.219 10.992 1.00 25.24 N ATOM 790 CA ALA A 56 26.887 4.053 10.131 1.00 63.14 C ATOM 791 C ALA A 56 25.987 4.159 8.903 1.00 34.41 C ATOM 792 O ALA A 56 26.387 3.793 7.795 1.00 72.41 O ATOM 793 CB ALA A 56 26.593 2.776 10.906 1.00 2.41 C ATOM 0 H ALA A 56 26.459 4.999 11.951 1.00 25.24 H new ATOM 0 HA ALA A 56 27.921 4.018 9.789 1.00 63.14 H new ATOM 0 HB1 ALA A 56 26.716 1.915 10.249 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.283 2.693 11.746 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.569 2.804 11.279 1.00 2.41 H new ATOM 799 N CYS A 57 24.772 4.677 9.095 1.00 43.11 N ATOM 800 CA CYS A 57 23.856 4.869 7.984 1.00 65.50 C ATOM 801 C CYS A 57 24.314 6.049 7.135 1.00 1.30 C ATOM 802 O CYS A 57 24.175 6.026 5.920 1.00 31.43 O ATOM 803 CB CYS A 57 22.412 5.070 8.463 1.00 74.40 C ATOM 804 SG CYS A 57 22.149 6.535 9.479 1.00 3.24 S ATOM 0 H CYS A 57 24.408 4.967 10.003 1.00 43.11 H new ATOM 0 HA CYS A 57 23.868 3.965 7.376 1.00 65.50 H new ATOM 0 HB2 CYS A 57 21.760 5.128 7.592 1.00 74.40 H new ATOM 0 HB3 CYS A 57 22.107 4.191 9.032 1.00 74.40 H new ATOM 0 HG CYS A 57 23.278 7.157 9.644 1.00 3.24 H new ATOM 810 N PHE A 58 24.863 7.082 7.785 1.00 12.51 N ATOM 811 CA PHE A 58 25.329 8.275 7.082 1.00 55.51 C ATOM 812 C PHE A 58 26.419 7.897 6.072 1.00 60.31 C ATOM 813 O PHE A 58 26.498 8.473 4.987 1.00 54.45 O ATOM 814 CB PHE A 58 25.857 9.317 8.086 1.00 64.12 C ATOM 815 CG PHE A 58 25.824 10.735 7.567 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.931 11.299 6.945 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.678 11.504 7.705 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.891 12.599 6.471 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.632 12.802 7.235 1.00 51.42 C ATOM 820 CZ PHE A 58 25.740 13.351 6.617 1.00 5.31 C ATOM 0 H PHE A 58 24.994 7.112 8.796 1.00 12.51 H new ATOM 0 HA PHE A 58 24.491 8.716 6.541 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.265 9.260 8.999 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.882 9.062 8.355 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.833 10.716 6.830 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.809 11.082 8.187 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.758 13.025 5.988 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.732 13.387 7.350 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.707 14.366 6.249 1.00 5.31 H new ATOM 830 N LEU A 59 27.248 6.915 6.436 1.00 64.51 N ATOM 831 CA LEU A 59 28.266 6.387 5.523 1.00 63.33 C ATOM 832 C LEU A 59 27.611 5.764 4.292 1.00 14.15 C ATOM 833 O LEU A 59 27.860 6.194 3.164 1.00 3.51 O ATOM 834 CB LEU A 59 29.167 5.346 6.223 1.00 74.12 C ATOM 835 CG LEU A 59 30.369 5.910 7.006 1.00 31.41 C ATOM 836 CD1 LEU A 59 31.271 6.739 6.095 1.00 61.22 C ATOM 837 CD2 LEU A 59 29.912 6.734 8.201 1.00 2.33 C ATOM 0 H LEU A 59 27.235 6.470 7.354 1.00 64.51 H new ATOM 0 HA LEU A 59 28.892 7.223 5.210 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.551 4.765 6.910 1.00 74.12 H new ATOM 0 HB3 LEU A 59 29.542 4.654 5.469 1.00 74.12 H new ATOM 0 HG LEU A 59 30.945 5.064 7.382 1.00 31.41 H new ATOM 0 HD11 LEU A 59 32.112 7.126 6.670 1.00 61.22 H new ATOM 0 HD12 LEU A 59 31.644 6.113 5.284 1.00 61.22 H new ATOM 0 HD13 LEU A 59 30.702 7.571 5.679 1.00 61.22 H new ATOM 0 HD21 LEU A 59 30.783 7.118 8.733 1.00 2.33 H new ATOM 0 HD22 LEU A 59 29.301 7.568 7.856 1.00 2.33 H new ATOM 0 HD23 LEU A 59 29.324 6.107 8.872 1.00 2.33 H new ATOM 849 N SER A 60 26.762 4.761 4.513 1.00 34.05 N ATOM 850 CA SER A 60 26.087 4.066 3.418 1.00 74.40 C ATOM 851 C SER A 60 25.232 5.047 2.611 1.00 42.34 C ATOM 852 O SER A 60 25.094 4.916 1.393 1.00 41.15 O ATOM 853 CB SER A 60 25.227 2.915 3.960 1.00 52.34 C ATOM 854 OG SER A 60 24.732 2.100 2.908 1.00 74.20 O ATOM 0 H SER A 60 26.525 4.411 5.442 1.00 34.05 H new ATOM 0 HA SER A 60 26.843 3.644 2.756 1.00 74.40 H new ATOM 0 HB2 SER A 60 25.819 2.308 4.645 1.00 52.34 H new ATOM 0 HB3 SER A 60 24.392 3.320 4.532 1.00 52.34 H new ATOM 0 HG SER A 60 24.882 1.157 3.127 1.00 74.20 H new ATOM 860 N ALA A 61 24.685 6.047 3.298 1.00 5.22 N ATOM 861 CA ALA A 61 23.892 7.085 2.650 1.00 61.10 C ATOM 862 C ALA A 61 24.771 7.899 1.713 1.00 23.52 C ATOM 863 O ALA A 61 24.392 8.178 0.582 1.00 64.15 O ATOM 864 CB ALA A 61 23.232 7.988 3.688 1.00 23.00 C ATOM 0 H ALA A 61 24.778 6.159 4.308 1.00 5.22 H new ATOM 0 HA ALA A 61 23.103 6.610 2.068 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.645 8.755 3.183 1.00 23.00 H new ATOM 0 HB2 ALA A 61 22.578 7.392 4.325 1.00 23.00 H new ATOM 0 HB3 ALA A 61 24.000 8.462 4.299 1.00 23.00 H new ATOM 870 N MET A 62 25.957 8.262 2.195 1.00 1.42 N ATOM 871 CA MET A 62 26.935 8.982 1.382 1.00 22.23 C ATOM 872 C MET A 62 27.367 8.134 0.191 1.00 52.25 C ATOM 873 O MET A 62 27.649 8.662 -0.883 1.00 52.11 O ATOM 874 CB MET A 62 28.161 9.378 2.227 1.00 12.31 C ATOM 875 CG MET A 62 27.968 10.647 3.056 1.00 13.45 C ATOM 876 SD MET A 62 28.811 12.085 2.347 1.00 13.34 S ATOM 877 CE MET A 62 28.099 12.168 0.702 1.00 61.32 C ATOM 0 H MET A 62 26.265 8.069 3.148 1.00 1.42 H new ATOM 0 HA MET A 62 26.464 9.892 1.010 1.00 22.23 H new ATOM 0 HB2 MET A 62 28.408 8.554 2.897 1.00 12.31 H new ATOM 0 HB3 MET A 62 29.015 9.517 1.564 1.00 12.31 H new ATOM 0 HG2 MET A 62 26.903 10.862 3.141 1.00 13.45 H new ATOM 0 HG3 MET A 62 28.340 10.475 4.066 1.00 13.45 H new ATOM 0 HE1 MET A 62 28.465 13.059 0.192 1.00 61.32 H new ATOM 0 HE2 MET A 62 28.387 11.282 0.136 1.00 61.32 H new ATOM 0 HE3 MET A 62 27.013 12.213 0.778 1.00 61.32 H new ATOM 887 N LYS A 63 27.413 6.819 0.391 1.00 50.31 N ATOM 888 CA LYS A 63 27.756 5.885 -0.679 1.00 32.21 C ATOM 889 C LYS A 63 26.675 5.898 -1.760 1.00 55.33 C ATOM 890 O LYS A 63 26.975 6.007 -2.950 1.00 31.21 O ATOM 891 CB LYS A 63 27.940 4.467 -0.115 1.00 32.54 C ATOM 892 CG LYS A 63 29.132 4.334 0.830 1.00 62.32 C ATOM 893 CD LYS A 63 29.207 2.963 1.515 1.00 52.53 C ATOM 894 CE LYS A 63 29.334 1.804 0.525 1.00 52.13 C ATOM 895 NZ LYS A 63 28.026 1.420 -0.076 1.00 51.23 N1+ ATOM 0 H LYS A 63 27.216 6.375 1.288 1.00 50.31 H new ATOM 0 HA LYS A 63 28.698 6.200 -1.128 1.00 32.21 H new ATOM 0 HB2 LYS A 63 27.033 4.175 0.415 1.00 32.54 H new ATOM 0 HB3 LYS A 63 28.064 3.769 -0.943 1.00 32.54 H new ATOM 0 HG2 LYS A 63 30.052 4.505 0.271 1.00 62.32 H new ATOM 0 HG3 LYS A 63 29.073 5.111 1.592 1.00 62.32 H new ATOM 0 HD2 LYS A 63 30.060 2.949 2.193 1.00 52.53 H new ATOM 0 HD3 LYS A 63 28.314 2.818 2.123 1.00 52.53 H new ATOM 0 HE2 LYS A 63 30.027 2.083 -0.269 1.00 52.13 H new ATOM 0 HE3 LYS A 63 29.763 0.941 1.034 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 27.670 0.560 0.388 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 27.343 2.193 0.056 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 28.151 1.238 -1.092 1.00 51.23 H new ATOM 909 N PHE A 64 25.416 5.799 -1.333 1.00 54.13 N ATOM 910 CA PHE A 64 24.282 5.846 -2.255 1.00 15.41 C ATOM 911 C PHE A 64 24.227 7.202 -2.959 1.00 43.31 C ATOM 912 O PHE A 64 24.060 7.276 -4.179 1.00 31.42 O ATOM 913 CB PHE A 64 22.969 5.577 -1.503 1.00 54.23 C ATOM 914 CG PHE A 64 21.736 5.682 -2.372 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.544 4.810 -3.436 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.773 6.654 -2.130 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.420 4.906 -4.237 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.648 6.752 -2.926 1.00 31.33 C ATOM 919 CZ PHE A 64 19.472 5.879 -3.982 1.00 62.32 C ATOM 0 H PHE A 64 25.156 5.686 -0.353 1.00 54.13 H new ATOM 0 HA PHE A 64 24.413 5.069 -3.008 1.00 15.41 H new ATOM 0 HB2 PHE A 64 23.010 4.580 -1.065 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.882 6.284 -0.678 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.281 4.048 -3.641 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.906 7.342 -1.308 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.283 4.221 -5.061 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.907 7.511 -2.723 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.595 5.957 -4.607 1.00 62.32 H new ATOM 929 N VAL A 65 24.385 8.267 -2.180 1.00 22.12 N ATOM 930 CA VAL A 65 24.417 9.622 -2.716 1.00 1.13 C ATOM 931 C VAL A 65 25.513 9.750 -3.768 1.00 2.04 C ATOM 932 O VAL A 65 25.262 10.206 -4.881 1.00 1.42 O ATOM 933 CB VAL A 65 24.643 10.681 -1.605 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.963 12.045 -2.216 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.424 10.771 -0.687 1.00 41.32 C ATOM 0 H VAL A 65 24.494 8.216 -1.167 1.00 22.12 H new ATOM 0 HA VAL A 65 23.444 9.810 -3.171 1.00 1.13 H new ATOM 0 HB VAL A 65 25.497 10.368 -1.005 1.00 51.41 H new ATOM 0 HG11 VAL A 65 25.118 12.773 -1.420 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.867 11.970 -2.820 1.00 35.23 H new ATOM 0 HG13 VAL A 65 24.132 12.366 -2.845 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.604 11.519 0.085 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.549 11.055 -1.271 1.00 41.32 H new ATOM 0 HG23 VAL A 65 23.249 9.802 -0.219 1.00 41.32 H new ATOM 945 N ALA A 66 26.720 9.321 -3.417 1.00 10.53 N ATOM 946 CA ALA A 66 27.852 9.368 -4.336 1.00 34.24 C ATOM 947 C ALA A 66 27.530 8.591 -5.606 1.00 52.01 C ATOM 948 O ALA A 66 27.917 8.984 -6.711 1.00 55.45 O ATOM 949 CB ALA A 66 29.105 8.809 -3.672 1.00 2.15 C ATOM 0 H ALA A 66 26.941 8.935 -2.499 1.00 10.53 H new ATOM 0 HA ALA A 66 28.041 10.408 -4.601 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.939 8.852 -4.373 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.343 9.401 -2.788 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.931 7.774 -3.379 1.00 2.15 H new ATOM 955 N GLY A 67 26.767 7.520 -5.432 1.00 41.30 N ATOM 956 CA GLY A 67 26.416 6.652 -6.536 1.00 41.44 C ATOM 957 C GLY A 67 25.510 7.342 -7.532 1.00 65.01 C ATOM 958 O GLY A 67 25.609 7.116 -8.738 1.00 24.21 O ATOM 0 H GLY A 67 26.381 7.235 -4.532 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.324 6.321 -7.040 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.921 5.760 -6.153 1.00 41.44 H new ATOM 962 N GLN A 68 24.645 8.219 -7.029 1.00 2.22 N ATOM 963 CA GLN A 68 23.702 8.936 -7.878 1.00 3.22 C ATOM 964 C GLN A 68 24.271 10.303 -8.226 1.00 13.50 C ATOM 965 O GLN A 68 23.761 10.999 -9.094 1.00 73.33 O ATOM 966 CB GLN A 68 22.338 9.081 -7.182 1.00 70.02 C ATOM 967 CG GLN A 68 22.413 9.732 -5.806 1.00 23.14 C ATOM 968 CD GLN A 68 21.049 10.119 -5.255 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.408 9.351 -4.541 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.590 11.314 -5.599 1.00 55.13 N ATOM 0 H GLN A 68 24.579 8.449 -6.038 1.00 2.22 H new ATOM 0 HA GLN A 68 23.549 8.366 -8.795 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.678 9.672 -7.817 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.885 8.094 -7.082 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.898 9.046 -5.112 1.00 23.14 H new ATOM 0 HG3 GLN A 68 23.040 10.621 -5.865 1.00 23.14 H new ATOM 0 HE21 GLN A 68 21.151 11.924 -6.193 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.676 11.623 -5.269 1.00 55.13 H new ATOM 979 N ASN A 69 25.341 10.675 -7.532 1.00 45.10 N ATOM 980 CA ASN A 69 26.024 11.947 -7.758 1.00 61.12 C ATOM 981 C ASN A 69 27.215 11.770 -8.686 1.00 41.24 C ATOM 982 O ASN A 69 27.925 12.733 -8.994 1.00 42.44 O ATOM 983 CB ASN A 69 26.478 12.560 -6.426 1.00 43.31 C ATOM 984 CG ASN A 69 25.381 13.315 -5.690 1.00 21.20 C ATOM 985 OD1 ASN A 69 24.144 12.851 -5.802 1.00 73.01 O flip ATOM 986 ND2 ASN A 69 25.651 14.306 -5.009 1.00 73.35 N flip ATOM 0 H ASN A 69 25.760 10.105 -6.797 1.00 45.10 H new ATOM 0 HA ASN A 69 25.317 12.626 -8.234 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.855 11.766 -5.781 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.310 13.239 -6.614 1.00 43.31 H new ATOM 0 HD21 ASN A 69 26.615 14.634 -4.946 1.00 73.35 H new ATOM 0 HD22 ASN A 69 24.911 14.798 -4.508 1.00 73.35 H new ATOM 993 N LYS A 70 27.420 10.531 -9.119 1.00 63.25 N ATOM 994 CA LYS A 70 28.440 10.193 -10.110 1.00 32.31 C ATOM 995 C LYS A 70 29.835 10.550 -9.591 1.00 12.34 C ATOM 996 O LYS A 70 30.731 10.889 -10.363 1.00 70.50 O ATOM 997 CB LYS A 70 28.171 10.916 -11.451 1.00 4.35 C ATOM 998 CG LYS A 70 26.691 11.073 -11.831 1.00 13.20 C ATOM 999 CD LYS A 70 25.866 9.816 -11.563 1.00 32.43 C ATOM 1000 CE LYS A 70 24.497 9.878 -12.242 1.00 4.32 C ATOM 1001 NZ LYS A 70 23.692 11.047 -11.789 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.882 9.728 -8.792 1.00 63.25 H new ATOM 0 HA LYS A 70 28.394 9.118 -10.283 1.00 32.31 H new ATOM 0 HB2 LYS A 70 28.624 11.906 -11.407 1.00 4.35 H new ATOM 0 HB3 LYS A 70 28.677 10.369 -12.247 1.00 4.35 H new ATOM 0 HG2 LYS A 70 26.265 11.906 -11.272 1.00 13.20 H new ATOM 0 HG3 LYS A 70 26.619 11.329 -12.888 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.410 8.942 -11.921 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.733 9.691 -10.488 1.00 32.43 H new ATOM 0 HE2 LYS A 70 24.632 9.930 -13.322 1.00 4.32 H new ATOM 0 HE3 LYS A 70 23.949 8.959 -12.033 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 22.683 10.862 -11.963 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 23.845 11.201 -10.772 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 23.985 11.895 -12.315 1.00 52.12 H new ATOM 1015 N GLN A 71 30.012 10.458 -8.277 1.00 41.25 N ATOM 1016 CA GLN A 71 31.280 10.805 -7.635 1.00 41.44 C ATOM 1017 C GLN A 71 31.820 9.625 -6.836 1.00 11.15 C ATOM 1018 O GLN A 71 31.110 8.648 -6.592 1.00 3.32 O ATOM 1019 CB GLN A 71 31.104 12.011 -6.704 1.00 65.11 C ATOM 1020 CG GLN A 71 29.915 11.870 -5.764 1.00 11.32 C ATOM 1021 CD GLN A 71 30.074 12.629 -4.465 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.558 11.931 -3.458 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 29.735 13.808 -4.362 1.00 60.02 N flip ATOM 0 H GLN A 71 29.289 10.144 -7.630 1.00 41.25 H new ATOM 0 HA GLN A 71 31.991 11.060 -8.420 1.00 41.44 H new ATOM 0 HB2 GLN A 71 32.012 12.144 -6.115 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.980 12.912 -7.305 1.00 65.11 H new ATOM 0 HG2 GLN A 71 29.017 12.222 -6.273 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.762 10.814 -5.541 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.366 14.305 -5.172 1.00 60.02 H new ATOM 0 HE22 GLN A 71 29.824 14.288 -3.466 1.00 60.02 H new ATOM 1032 N THR A 72 33.075 9.734 -6.423 1.00 0.13 N ATOM 1033 CA THR A 72 33.724 8.710 -5.616 1.00 33.54 C ATOM 1034 C THR A 72 34.164 9.292 -4.277 1.00 64.51 C ATOM 1035 O THR A 72 34.598 10.445 -4.203 1.00 2.32 O ATOM 1036 CB THR A 72 34.948 8.110 -6.346 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.830 9.161 -6.775 1.00 1.42 O ATOM 1038 CG2 THR A 72 34.520 7.273 -7.549 1.00 71.13 C ATOM 0 H THR A 72 33.671 10.533 -6.637 1.00 0.13 H new ATOM 0 HA THR A 72 32.999 7.914 -5.447 1.00 33.54 H new ATOM 0 HB THR A 72 35.471 7.459 -5.645 1.00 55.21 H new ATOM 0 HG1 THR A 72 36.603 8.772 -7.235 1.00 1.42 H new ATOM 0 HG21 THR A 72 35.403 6.865 -8.041 1.00 71.13 H new ATOM 0 HG22 THR A 72 33.881 6.456 -7.215 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.970 7.900 -8.251 1.00 71.13 H new ATOM 1046 N LEU A 73 34.037 8.499 -3.222 1.00 24.22 N ATOM 1047 CA LEU A 73 34.420 8.920 -1.881 1.00 2.33 C ATOM 1048 C LEU A 73 35.678 8.176 -1.428 1.00 44.11 C ATOM 1049 O LEU A 73 35.858 7.001 -1.763 1.00 52.40 O ATOM 1050 CB LEU A 73 33.265 8.669 -0.902 1.00 54.54 C ATOM 1051 CG LEU A 73 32.012 9.527 -1.135 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.878 9.073 -0.220 1.00 63.13 C ATOM 1053 CD2 LEU A 73 32.321 11.008 -0.916 1.00 44.41 C ATOM 0 H LEU A 73 33.667 7.550 -3.271 1.00 24.22 H new ATOM 0 HA LEU A 73 34.640 9.987 -1.896 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.982 7.618 -0.961 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.624 8.846 0.112 1.00 54.54 H new ATOM 0 HG LEU A 73 31.694 9.396 -2.169 1.00 53.14 H new ATOM 0 HD11 LEU A 73 29.998 9.691 -0.397 1.00 63.13 H new ATOM 0 HD12 LEU A 73 30.638 8.030 -0.428 1.00 63.13 H new ATOM 0 HD13 LEU A 73 31.188 9.173 0.820 1.00 63.13 H new ATOM 0 HD21 LEU A 73 31.420 11.597 -1.086 1.00 44.41 H new ATOM 0 HD22 LEU A 73 32.666 11.160 0.107 1.00 44.41 H new ATOM 0 HD23 LEU A 73 33.098 11.324 -1.612 1.00 44.41 H new ATOM 1065 N PRO A 74 36.565 8.857 -0.676 1.00 14.33 N ATOM 1066 CA PRO A 74 37.800 8.254 -0.149 1.00 71.54 C ATOM 1067 C PRO A 74 37.515 7.041 0.737 1.00 22.35 C ATOM 1068 O PRO A 74 36.642 7.090 1.599 1.00 71.04 O ATOM 1069 CB PRO A 74 38.420 9.378 0.688 1.00 0.31 C ATOM 1070 CG PRO A 74 37.832 10.634 0.143 1.00 75.32 C ATOM 1071 CD PRO A 74 36.438 10.275 -0.283 1.00 21.31 C ATOM 0 HA PRO A 74 38.446 7.890 -0.948 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.185 9.258 1.746 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.507 9.381 0.602 1.00 0.31 H new ATOM 0 HG2 PRO A 74 37.821 11.421 0.897 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.415 11.007 -0.699 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.722 10.406 0.528 1.00 21.31 H new ATOM 0 HD3 PRO A 74 36.097 10.895 -1.112 1.00 21.31 H new ATOM 1079 N ALA A 75 38.265 5.965 0.535 1.00 74.43 N ATOM 1080 CA ALA A 75 38.040 4.718 1.268 1.00 72.21 C ATOM 1081 C ALA A 75 38.580 4.769 2.701 1.00 34.41 C ATOM 1082 O ALA A 75 38.438 3.805 3.453 1.00 42.34 O ATOM 1083 CB ALA A 75 38.649 3.547 0.505 1.00 2.05 C ATOM 0 H ALA A 75 39.037 5.927 -0.131 1.00 74.43 H new ATOM 0 HA ALA A 75 36.962 4.579 1.347 1.00 72.21 H new ATOM 0 HB1 ALA A 75 38.477 2.624 1.058 1.00 2.05 H new ATOM 0 HB2 ALA A 75 38.185 3.473 -0.479 1.00 2.05 H new ATOM 0 HB3 ALA A 75 39.721 3.706 0.390 1.00 2.05 H new ATOM 1089 N ASP A 76 39.201 5.883 3.079 1.00 35.21 N ATOM 1090 CA ASP A 76 39.798 6.017 4.416 1.00 24.42 C ATOM 1091 C ASP A 76 38.962 6.940 5.303 1.00 33.35 C ATOM 1092 O ASP A 76 39.356 7.282 6.419 1.00 61.01 O ATOM 1093 CB ASP A 76 41.236 6.547 4.294 1.00 72.44 C ATOM 1094 CG ASP A 76 41.976 6.580 5.629 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.167 5.507 6.237 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.395 7.677 6.067 1.00 42.23 O1- ATOM 0 H ASP A 76 39.307 6.706 2.486 1.00 35.21 H new ATOM 0 HA ASP A 76 39.818 5.033 4.885 1.00 24.42 H new ATOM 0 HB2 ASP A 76 41.789 5.921 3.594 1.00 72.44 H new ATOM 0 HB3 ASP A 76 41.212 7.552 3.873 1.00 72.44 H new ATOM 1101 N THR A 77 37.791 7.324 4.812 1.00 11.55 N ATOM 1102 CA THR A 77 36.933 8.260 5.529 1.00 12.43 C ATOM 1103 C THR A 77 36.244 7.589 6.718 1.00 50.31 C ATOM 1104 O THR A 77 36.038 6.369 6.736 1.00 30.02 O ATOM 1105 CB THR A 77 35.882 8.886 4.588 1.00 41.10 C ATOM 1106 OG1 THR A 77 35.063 9.816 5.309 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.995 7.821 3.952 1.00 73.22 C ATOM 0 H THR A 77 37.413 7.002 3.921 1.00 11.55 H new ATOM 0 HA THR A 77 37.573 9.055 5.911 1.00 12.43 H new ATOM 0 HB THR A 77 36.420 9.405 3.795 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.634 10.449 5.792 1.00 73.42 H new ATOM 0 HG21 THR A 77 34.267 8.298 3.296 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.611 7.134 3.372 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.472 7.269 4.733 1.00 73.22 H new ATOM 1115 N THR A 78 35.901 8.394 7.718 1.00 13.54 N ATOM 1116 CA THR A 78 35.291 7.894 8.947 1.00 2.03 C ATOM 1117 C THR A 78 34.404 8.971 9.576 1.00 41.21 C ATOM 1118 O THR A 78 34.663 10.161 9.419 1.00 33.42 O ATOM 1119 CB THR A 78 36.376 7.474 9.970 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.320 6.576 9.361 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.760 6.802 11.193 1.00 52.04 C ATOM 0 H THR A 78 36.036 9.405 7.701 1.00 13.54 H new ATOM 0 HA THR A 78 34.687 7.024 8.689 1.00 2.03 H new ATOM 0 HB THR A 78 36.888 8.381 10.292 1.00 65.01 H new ATOM 0 HG1 THR A 78 38.000 6.321 10.019 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.550 6.520 11.890 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.074 7.494 11.682 1.00 52.04 H new ATOM 0 HG23 THR A 78 35.215 5.910 10.883 1.00 52.04 H new ATOM 1129 N VAL A 79 33.365 8.547 10.285 1.00 13.33 N ATOM 1130 CA VAL A 79 32.484 9.465 11.007 1.00 51.35 C ATOM 1131 C VAL A 79 32.390 9.051 12.466 1.00 40.33 C ATOM 1132 O VAL A 79 32.118 7.890 12.765 1.00 15.54 O ATOM 1133 CB VAL A 79 31.052 9.508 10.406 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.122 10.373 11.259 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.085 10.021 8.974 1.00 4.51 C ATOM 0 H VAL A 79 33.108 7.564 10.377 1.00 13.33 H new ATOM 0 HA VAL A 79 32.919 10.460 10.916 1.00 51.35 H new ATOM 0 HB VAL A 79 30.662 8.490 10.402 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.127 10.385 10.815 1.00 32.33 H new ATOM 0 HG12 VAL A 79 30.065 9.961 12.267 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.511 11.390 11.304 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.072 10.043 8.572 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.504 11.027 8.958 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.703 9.361 8.365 1.00 4.51 H new ATOM 1145 N THR A 80 32.630 9.989 13.369 1.00 3.21 N ATOM 1146 CA THR A 80 32.507 9.727 14.795 1.00 52.54 C ATOM 1147 C THR A 80 31.339 10.517 15.377 1.00 43.34 C ATOM 1148 O THR A 80 31.335 11.750 15.340 1.00 4.30 O ATOM 1149 CB THR A 80 33.806 10.083 15.554 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.901 9.318 15.026 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.664 9.802 17.049 1.00 20.33 C ATOM 0 H THR A 80 32.912 10.942 13.139 1.00 3.21 H new ATOM 0 HA THR A 80 32.324 8.660 14.919 1.00 52.54 H new ATOM 0 HB THR A 80 33.998 11.147 15.419 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.723 9.547 15.508 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.592 10.062 17.558 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.848 10.399 17.456 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.450 8.744 17.202 1.00 20.33 H new ATOM 1159 N ALA A 81 30.344 9.801 15.887 1.00 63.21 N ATOM 1160 CA ALA A 81 29.188 10.425 16.512 1.00 75.00 C ATOM 1161 C ALA A 81 29.410 10.547 18.007 1.00 14.40 C ATOM 1162 O ALA A 81 29.547 9.544 18.709 1.00 73.21 O ATOM 1163 CB ALA A 81 27.925 9.622 16.242 1.00 42.42 C ATOM 0 H ALA A 81 30.317 8.781 15.879 1.00 63.21 H new ATOM 0 HA ALA A 81 29.063 11.419 16.082 1.00 75.00 H new ATOM 0 HB1 ALA A 81 27.075 10.109 16.720 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.753 9.565 15.167 1.00 42.42 H new ATOM 0 HB3 ALA A 81 28.040 8.616 16.645 1.00 42.42 H new ATOM 1169 N GLU A 82 29.443 11.774 18.488 1.00 71.31 N ATOM 1170 CA GLU A 82 29.608 12.033 19.903 1.00 72.51 C ATOM 1171 C GLU A 82 28.314 12.638 20.417 1.00 53.13 C ATOM 1172 O GLU A 82 27.992 13.785 20.121 1.00 25.01 O ATOM 1173 CB GLU A 82 30.800 12.973 20.128 1.00 74.00 C ATOM 1174 CG GLU A 82 31.236 13.087 21.582 1.00 3.23 C ATOM 1175 CD GLU A 82 32.473 13.957 21.758 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.585 13.492 21.420 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.344 15.102 22.241 1.00 51.44 O1- ATOM 0 H GLU A 82 29.357 12.613 17.914 1.00 71.31 H new ATOM 0 HA GLU A 82 29.818 11.112 20.447 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.643 12.622 19.534 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.541 13.965 19.759 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.418 13.502 22.171 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.438 12.091 21.976 1.00 3.23 H new ATOM 1184 N VAL A 83 27.567 11.855 21.173 1.00 31.40 N ATOM 1185 CA VAL A 83 26.226 12.240 21.584 1.00 74.25 C ATOM 1186 C VAL A 83 26.175 12.548 23.066 1.00 12.15 C ATOM 1187 O VAL A 83 26.789 11.859 23.877 1.00 3.30 O ATOM 1188 CB VAL A 83 25.188 11.142 21.250 1.00 22.15 C ATOM 1189 CG1 VAL A 83 24.962 11.062 19.743 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.633 9.790 21.804 1.00 42.03 C ATOM 0 H VAL A 83 27.867 10.943 21.518 1.00 31.40 H new ATOM 0 HA VAL A 83 25.972 13.140 21.024 1.00 74.25 H new ATOM 0 HB VAL A 83 24.243 11.407 21.725 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.229 10.285 19.526 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.593 12.021 19.379 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.902 10.823 19.246 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.889 9.033 21.558 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.591 9.514 21.363 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.738 9.857 22.887 1.00 42.03 H new ATOM 1200 N GLY A 84 25.443 13.593 23.405 1.00 33.12 N ATOM 1201 CA GLY A 84 25.291 13.994 24.776 1.00 23.12 C ATOM 1202 C GLY A 84 23.870 14.393 25.085 1.00 64.22 C ATOM 1203 O GLY A 84 23.084 14.664 24.181 1.00 21.33 O ATOM 0 H GLY A 84 24.943 14.179 22.737 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.590 13.175 25.430 1.00 23.12 H new ATOM 0 HA3 GLY A 84 25.958 14.830 24.987 1.00 23.12 H new ATOM 1207 N ILE A 85 23.545 14.415 26.359 1.00 23.52 N ATOM 1208 CA ILE A 85 22.235 14.816 26.824 1.00 1.40 C ATOM 1209 C ILE A 85 22.401 15.772 27.993 1.00 61.15 C ATOM 1210 O ILE A 85 23.167 15.499 28.929 1.00 10.52 O ATOM 1211 CB ILE A 85 21.377 13.584 27.229 1.00 52.02 C ATOM 1212 CG1 ILE A 85 19.987 14.003 27.762 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.119 12.727 28.251 1.00 35.55 C ATOM 1214 CD1 ILE A 85 19.936 14.275 29.256 1.00 71.32 C ATOM 0 H ILE A 85 24.187 14.153 27.107 1.00 23.52 H new ATOM 0 HA ILE A 85 21.706 15.319 26.014 1.00 1.40 H new ATOM 0 HB ILE A 85 21.211 12.987 26.332 1.00 52.02 H new ATOM 0 HG12 ILE A 85 19.665 14.899 27.232 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.270 13.217 27.525 1.00 53.33 H new ATOM 0 HG21 ILE A 85 21.503 11.870 28.523 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.057 12.378 27.820 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.327 13.321 29.141 1.00 35.55 H new ATOM 0 HD11 ILE A 85 18.923 14.562 29.539 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.224 13.375 29.800 1.00 71.32 H new ATOM 0 HD13 ILE A 85 20.624 15.083 29.502 1.00 71.32 H new ATOM 1226 N GLY A 86 21.711 16.902 27.909 1.00 43.44 N ATOM 1227 CA GLY A 86 21.759 17.915 28.950 1.00 64.20 C ATOM 1228 C GLY A 86 20.416 18.596 29.120 1.00 43.21 C ATOM 1229 O GLY A 86 19.518 18.390 28.303 1.00 31.32 O ATOM 0 H GLY A 86 21.107 17.139 27.122 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.058 17.457 29.893 1.00 64.20 H new ATOM 0 HA3 GLY A 86 22.517 18.658 28.702 1.00 64.20 H new ATOM 1233 N PRO A 87 20.236 19.403 30.177 1.00 20.43 N ATOM 1234 CA PRO A 87 18.980 20.079 30.446 1.00 73.43 C ATOM 1235 C PRO A 87 18.910 21.457 29.790 1.00 33.24 C ATOM 1236 O PRO A 87 19.884 22.215 29.790 1.00 11.41 O ATOM 1237 CB PRO A 87 18.981 20.197 31.973 1.00 75.13 C ATOM 1238 CG PRO A 87 20.432 20.229 32.374 1.00 24.22 C ATOM 1239 CD PRO A 87 21.248 19.747 31.188 1.00 44.21 C ATOM 0 HA PRO A 87 18.121 19.541 30.045 1.00 73.43 H new ATOM 0 HB2 PRO A 87 18.464 21.101 32.297 1.00 75.13 H new ATOM 0 HB3 PRO A 87 18.466 19.353 32.432 1.00 75.13 H new ATOM 0 HG2 PRO A 87 20.729 21.239 32.657 1.00 24.22 H new ATOM 0 HG3 PRO A 87 20.604 19.591 33.241 1.00 24.22 H new ATOM 0 HD2 PRO A 87 21.925 20.522 30.828 1.00 44.21 H new ATOM 0 HD3 PRO A 87 21.861 18.884 31.449 1.00 44.21 H new ATOM 1247 N ASN A 88 17.754 21.769 29.229 1.00 50.13 N ATOM 1248 CA ASN A 88 17.523 23.063 28.598 1.00 62.23 C ATOM 1249 C ASN A 88 16.867 24.010 29.599 1.00 31.22 C ATOM 1250 O ASN A 88 16.093 23.576 30.454 1.00 11.01 O ATOM 1251 CB ASN A 88 16.636 22.907 27.356 1.00 63.43 C ATOM 1252 CG ASN A 88 16.515 24.202 26.569 1.00 21.32 C ATOM 1253 OD1 ASN A 88 15.649 25.031 26.844 1.00 63.22 O ATOM 1254 ND2 ASN A 88 17.388 24.384 25.591 1.00 22.41 N ATOM 0 H ASN A 88 16.952 21.139 29.196 1.00 50.13 H new ATOM 0 HA ASN A 88 18.480 23.478 28.283 1.00 62.23 H new ATOM 0 HB2 ASN A 88 17.049 22.130 26.712 1.00 63.43 H new ATOM 0 HB3 ASN A 88 15.643 22.575 27.660 1.00 63.43 H new ATOM 0 HD21 ASN A 88 17.358 25.237 25.033 1.00 22.41 H new ATOM 0 HD22 ASN A 88 18.091 23.671 25.396 1.00 22.41 H new ATOM 1261 N GLU A 89 17.168 25.298 29.480 1.00 43.32 N ATOM 1262 CA GLU A 89 16.662 26.310 30.410 1.00 2.23 C ATOM 1263 C GLU A 89 15.135 26.424 30.359 1.00 10.40 C ATOM 1264 O GLU A 89 14.518 27.013 31.249 1.00 74.31 O ATOM 1265 CB GLU A 89 17.318 27.660 30.111 1.00 13.04 C ATOM 1266 CG GLU A 89 17.211 28.092 28.652 1.00 64.14 C ATOM 1267 CD GLU A 89 18.006 29.351 28.356 1.00 35.31 C ATOM 1268 OE1 GLU A 89 17.394 30.426 28.185 1.00 70.11 O ATOM 1269 OE2 GLU A 89 19.252 29.271 28.306 1.00 74.23 O1- ATOM 0 H GLU A 89 17.765 25.672 28.743 1.00 43.32 H new ATOM 0 HA GLU A 89 16.923 25.999 31.422 1.00 2.23 H new ATOM 0 HB2 GLU A 89 16.859 28.423 30.740 1.00 13.04 H new ATOM 0 HB3 GLU A 89 18.371 27.610 30.388 1.00 13.04 H new ATOM 0 HG2 GLU A 89 17.565 27.284 28.011 1.00 64.14 H new ATOM 0 HG3 GLU A 89 16.163 28.261 28.403 1.00 64.14 H new ATOM 1276 N GLU A 90 14.532 25.861 29.316 1.00 62.24 N ATOM 1277 CA GLU A 90 13.076 25.809 29.201 1.00 33.11 C ATOM 1278 C GLU A 90 12.485 24.837 30.229 1.00 41.22 C ATOM 1279 O GLU A 90 11.314 24.939 30.600 1.00 23.51 O ATOM 1280 CB GLU A 90 12.663 25.408 27.775 1.00 62.35 C ATOM 1281 CG GLU A 90 11.178 25.109 27.633 1.00 2.12 C ATOM 1282 CD GLU A 90 10.726 24.989 26.186 1.00 32.41 C ATOM 1283 OE1 GLU A 90 10.954 23.930 25.569 1.00 34.55 O ATOM 1284 OE2 GLU A 90 10.126 25.952 25.661 1.00 15.02 O1- ATOM 0 H GLU A 90 15.030 25.433 28.536 1.00 62.24 H new ATOM 0 HA GLU A 90 12.680 26.803 29.407 1.00 33.11 H new ATOM 0 HB2 GLU A 90 12.931 26.211 27.089 1.00 62.35 H new ATOM 0 HB3 GLU A 90 13.233 24.529 27.474 1.00 62.35 H new ATOM 0 HG2 GLU A 90 10.949 24.181 28.156 1.00 2.12 H new ATOM 0 HG3 GLU A 90 10.607 25.899 28.121 1.00 2.12 H new ATOM 1291 N GLY A 91 13.313 23.918 30.707 1.00 4.53 N ATOM 1292 CA GLY A 91 12.880 22.962 31.715 1.00 50.31 C ATOM 1293 C GLY A 91 12.634 21.575 31.149 1.00 52.42 C ATOM 1294 O GLY A 91 11.726 20.868 31.589 1.00 50.31 O ATOM 0 H GLY A 91 14.285 23.815 30.414 1.00 4.53 H new ATOM 0 HA2 GLY A 91 13.636 22.900 32.498 1.00 50.31 H new ATOM 0 HA3 GLY A 91 11.965 23.325 32.183 1.00 50.31 H new ATOM 1298 N GLY A 92 13.445 21.187 30.169 1.00 31.10 N ATOM 1299 CA GLY A 92 13.357 19.855 29.588 1.00 44.24 C ATOM 1300 C GLY A 92 14.732 19.297 29.289 1.00 74.12 C ATOM 1301 O GLY A 92 15.737 19.901 29.667 1.00 42.22 O ATOM 0 H GLY A 92 14.170 21.778 29.762 1.00 31.10 H new ATOM 0 HA2 GLY A 92 12.833 19.190 30.274 1.00 44.24 H new ATOM 0 HA3 GLY A 92 12.770 19.893 28.671 1.00 44.24 H new ATOM 1305 N PHE A 93 14.791 18.153 28.619 1.00 65.13 N ATOM 1306 CA PHE A 93 16.066 17.566 28.214 1.00 72.25 C ATOM 1307 C PHE A 93 16.370 17.916 26.765 1.00 30.35 C ATOM 1308 O PHE A 93 15.461 18.195 25.980 1.00 35.35 O ATOM 1309 CB PHE A 93 16.057 16.041 28.389 1.00 70.53 C ATOM 1310 CG PHE A 93 16.104 15.588 29.827 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.156 14.709 30.328 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.107 16.041 30.677 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.207 14.289 31.644 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.160 15.626 31.994 1.00 3.04 C ATOM 1315 CZ PHE A 93 16.209 14.749 32.478 1.00 12.34 C ATOM 0 H PHE A 93 13.972 17.612 28.344 1.00 65.13 H new ATOM 0 HA PHE A 93 16.843 17.980 28.857 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.159 15.637 27.921 1.00 70.53 H new ATOM 0 HB3 PHE A 93 16.911 15.620 27.858 1.00 70.53 H new ATOM 0 HD1 PHE A 93 14.369 14.348 29.683 1.00 41.34 H new ATOM 0 HD2 PHE A 93 17.854 16.726 30.303 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.464 13.602 32.021 1.00 2.11 H new ATOM 0 HE2 PHE A 93 17.944 15.987 32.644 1.00 3.04 H new ATOM 0 HZ PHE A 93 16.248 14.423 33.507 1.00 12.34 H new ATOM 1325 N ALA A 94 17.646 17.895 26.419 1.00 73.43 N ATOM 1326 CA ALA A 94 18.089 18.249 25.082 1.00 60.33 C ATOM 1327 C ALA A 94 19.193 17.300 24.634 1.00 65.32 C ATOM 1328 O ALA A 94 20.177 17.091 25.354 1.00 32.10 O ATOM 1329 CB ALA A 94 18.567 19.698 25.051 1.00 64.21 C ATOM 0 H ALA A 94 18.400 17.633 27.054 1.00 73.43 H new ATOM 0 HA ALA A 94 17.252 18.155 24.390 1.00 60.33 H new ATOM 0 HB1 ALA A 94 18.896 19.951 24.043 1.00 64.21 H new ATOM 0 HB2 ALA A 94 17.749 20.357 25.342 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.397 19.822 25.746 1.00 64.21 H new ATOM 1335 N LEU A 95 19.010 16.707 23.459 1.00 31.23 N ATOM 1336 CA LEU A 95 19.976 15.768 22.905 1.00 75.45 C ATOM 1337 C LEU A 95 20.893 16.472 21.914 1.00 41.42 C ATOM 1338 O LEU A 95 20.432 17.112 20.967 1.00 2.34 O ATOM 1339 CB LEU A 95 19.261 14.582 22.228 1.00 51.22 C ATOM 1340 CG LEU A 95 18.817 13.447 23.170 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.031 12.720 23.746 1.00 64.34 C ATOM 1342 CD2 LEU A 95 17.930 13.983 24.292 1.00 71.23 C ATOM 0 H LEU A 95 18.193 16.863 22.868 1.00 31.23 H new ATOM 0 HA LEU A 95 20.581 15.379 23.724 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.383 14.961 21.705 1.00 51.22 H new ATOM 0 HB3 LEU A 95 19.926 14.164 21.472 1.00 51.22 H new ATOM 0 HG LEU A 95 18.232 12.735 22.588 1.00 42.15 H new ATOM 0 HD11 LEU A 95 19.696 11.922 24.409 1.00 64.34 H new ATOM 0 HD12 LEU A 95 20.619 12.294 22.933 1.00 64.34 H new ATOM 0 HD13 LEU A 95 20.644 13.425 24.307 1.00 64.34 H new ATOM 0 HD21 LEU A 95 17.630 13.162 24.943 1.00 71.23 H new ATOM 0 HD22 LEU A 95 18.483 14.722 24.872 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.043 14.449 23.863 1.00 71.23 H new ATOM 1354 N ASP A 96 22.186 16.347 22.160 1.00 51.32 N ATOM 1355 CA ASP A 96 23.220 16.925 21.307 1.00 15.24 C ATOM 1356 C ASP A 96 23.957 15.817 20.578 1.00 33.43 C ATOM 1357 O ASP A 96 24.647 15.007 21.193 1.00 1.11 O ATOM 1358 CB ASP A 96 24.223 17.710 22.152 1.00 62.10 C ATOM 1359 CG ASP A 96 25.416 18.233 21.351 1.00 42.14 C ATOM 1360 OD1 ASP A 96 25.209 19.029 20.413 1.00 0.44 O ATOM 1361 OD2 ASP A 96 26.571 17.856 21.676 1.00 11.32 O1- ATOM 0 H ASP A 96 22.555 15.838 22.963 1.00 51.32 H new ATOM 0 HA ASP A 96 22.746 17.595 20.589 1.00 15.24 H new ATOM 0 HB2 ASP A 96 23.712 18.552 22.620 1.00 62.10 H new ATOM 0 HB3 ASP A 96 24.587 17.071 22.957 1.00 62.10 H new ATOM 1366 N VAL A 97 23.797 15.773 19.278 1.00 3.45 N ATOM 1367 CA VAL A 97 24.492 14.788 18.458 1.00 33.41 C ATOM 1368 C VAL A 97 25.583 15.473 17.658 1.00 35.23 C ATOM 1369 O VAL A 97 25.303 16.230 16.737 1.00 5.33 O ATOM 1370 CB VAL A 97 23.543 14.046 17.486 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.320 13.006 16.672 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.384 13.400 18.246 1.00 41.42 C ATOM 0 H VAL A 97 23.192 16.406 18.756 1.00 3.45 H new ATOM 0 HA VAL A 97 24.915 14.047 19.136 1.00 33.41 H new ATOM 0 HB VAL A 97 23.120 14.772 16.792 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.639 12.493 15.993 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.100 13.504 16.096 1.00 31.40 H new ATOM 0 HG13 VAL A 97 24.774 12.281 17.347 1.00 31.40 H new ATOM 0 HG21 VAL A 97 21.730 12.884 17.543 1.00 41.42 H new ATOM 0 HG22 VAL A 97 22.777 12.684 18.968 1.00 41.42 H new ATOM 0 HG23 VAL A 97 21.818 14.170 18.770 1.00 41.42 H new ATOM 1382 N GLU A 98 26.820 15.191 18.005 1.00 23.12 N ATOM 1383 CA GLU A 98 27.964 15.808 17.360 1.00 44.32 C ATOM 1384 C GLU A 98 28.528 14.859 16.306 1.00 21.31 C ATOM 1385 O GLU A 98 29.205 13.885 16.633 1.00 34.12 O ATOM 1386 CB GLU A 98 29.019 16.153 18.417 1.00 13.10 C ATOM 1387 CG GLU A 98 30.136 17.058 17.919 1.00 35.31 C ATOM 1388 CD GLU A 98 31.069 17.501 19.035 1.00 11.53 C ATOM 1389 OE1 GLU A 98 30.571 17.901 20.112 1.00 51.52 O ATOM 1390 OE2 GLU A 98 32.301 17.466 18.838 1.00 21.24 O1- ATOM 0 H GLU A 98 27.063 14.528 18.741 1.00 23.12 H new ATOM 0 HA GLU A 98 27.662 16.730 16.863 1.00 44.32 H new ATOM 0 HB2 GLU A 98 28.526 16.636 19.261 1.00 13.10 H new ATOM 0 HB3 GLU A 98 29.457 15.228 18.791 1.00 13.10 H new ATOM 0 HG2 GLU A 98 30.711 16.533 17.156 1.00 35.31 H new ATOM 0 HG3 GLU A 98 29.702 17.937 17.443 1.00 35.31 H new ATOM 1397 N LEU A 99 28.220 15.133 15.043 1.00 4.53 N ATOM 1398 CA LEU A 99 28.654 14.277 13.944 1.00 32.31 C ATOM 1399 C LEU A 99 29.961 14.795 13.364 1.00 52.01 C ATOM 1400 O LEU A 99 29.988 15.832 12.698 1.00 21.43 O ATOM 1401 CB LEU A 99 27.586 14.216 12.838 1.00 42.25 C ATOM 1402 CG LEU A 99 26.261 13.539 13.226 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.280 13.578 12.056 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.501 12.100 13.685 1.00 23.33 C ATOM 0 H LEU A 99 27.671 15.942 14.754 1.00 4.53 H new ATOM 0 HA LEU A 99 28.804 13.271 14.337 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.371 15.233 12.510 1.00 42.25 H new ATOM 0 HB3 LEU A 99 28.006 13.687 11.982 1.00 42.25 H new ATOM 0 HG LEU A 99 25.825 14.090 14.059 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.347 13.095 12.347 1.00 73.33 H new ATOM 0 HD12 LEU A 99 25.082 14.614 11.782 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.710 13.053 11.203 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.550 11.641 13.955 1.00 23.33 H new ATOM 0 HD22 LEU A 99 26.962 11.532 12.877 1.00 23.33 H new ATOM 0 HD23 LEU A 99 27.162 12.100 14.551 1.00 23.33 H new ATOM 1416 N ARG A 100 31.039 14.074 13.633 1.00 15.15 N ATOM 1417 CA ARG A 100 32.359 14.440 13.140 1.00 11.05 C ATOM 1418 C ARG A 100 32.694 13.622 11.907 1.00 44.33 C ATOM 1419 O ARG A 100 32.787 12.397 11.974 1.00 60.34 O ATOM 1420 CB ARG A 100 33.411 14.210 14.223 1.00 62.13 C ATOM 1421 CG ARG A 100 33.201 15.067 15.459 1.00 11.51 C ATOM 1422 CD ARG A 100 34.219 14.745 16.532 1.00 61.51 C ATOM 1423 NE ARG A 100 34.072 15.609 17.704 1.00 42.53 N ATOM 1424 CZ ARG A 100 34.930 15.664 18.720 1.00 32.53 C ATOM 1425 NH1 ARG A 100 36.054 14.952 18.694 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 34.662 16.444 19.754 1.00 1.52 N ATOM 0 H ARG A 100 31.025 13.223 14.196 1.00 15.15 H new ATOM 0 HA ARG A 100 32.356 15.498 12.876 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.400 13.159 14.512 1.00 62.13 H new ATOM 0 HB3 ARG A 100 34.398 14.417 13.810 1.00 62.13 H new ATOM 0 HG2 ARG A 100 33.274 16.121 15.190 1.00 11.51 H new ATOM 0 HG3 ARG A 100 32.196 14.907 15.849 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.111 13.703 16.834 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.224 14.856 16.124 1.00 61.51 H new ATOM 0 HE ARG A 100 33.252 16.214 17.745 1.00 42.53 H new ATOM 0 HH11 ARG A 100 36.263 14.358 17.891 1.00 73.43 H new ATOM 0 HH12 ARG A 100 36.706 15.000 19.477 1.00 73.43 H new ATOM 0 HH21 ARG A 100 33.804 16.996 19.768 1.00 1.52 H new ATOM 0 HH22 ARG A 100 35.313 16.493 20.538 1.00 1.52 H new ATOM 1440 N VAL A 101 32.890 14.301 10.787 1.00 42.14 N ATOM 1441 CA VAL A 101 33.078 13.630 9.510 1.00 72.23 C ATOM 1442 C VAL A 101 34.503 13.823 9.017 1.00 42.25 C ATOM 1443 O VAL A 101 34.870 14.908 8.570 1.00 41.22 O ATOM 1444 CB VAL A 101 32.091 14.161 8.442 1.00 14.41 C ATOM 1445 CG1 VAL A 101 32.231 13.381 7.135 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.653 14.113 8.961 1.00 42.30 C ATOM 0 H VAL A 101 32.923 15.319 10.737 1.00 42.14 H new ATOM 0 HA VAL A 101 32.884 12.569 9.665 1.00 72.23 H new ATOM 0 HB VAL A 101 32.339 15.202 8.237 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.527 13.773 6.400 1.00 25.41 H new ATOM 0 HG12 VAL A 101 33.247 13.486 6.756 1.00 25.41 H new ATOM 0 HG13 VAL A 101 32.018 12.327 7.316 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.977 14.491 8.194 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.388 13.084 9.204 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.568 14.730 9.855 1.00 42.30 H new ATOM 1456 N ALA A 102 35.308 12.779 9.117 1.00 43.12 N ATOM 1457 CA ALA A 102 36.676 12.832 8.635 1.00 40.03 C ATOM 1458 C ALA A 102 36.731 12.350 7.193 1.00 12.52 C ATOM 1459 O ALA A 102 36.696 11.145 6.928 1.00 73.10 O ATOM 1460 CB ALA A 102 37.587 11.989 9.523 1.00 44.05 C ATOM 0 H ALA A 102 35.037 11.885 9.527 1.00 43.12 H new ATOM 0 HA ALA A 102 37.028 13.863 8.674 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.609 12.040 9.148 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.556 12.371 10.543 1.00 44.05 H new ATOM 0 HB3 ALA A 102 37.248 10.953 9.513 1.00 44.05 H new ATOM 1466 N LEU A 103 36.810 13.312 6.275 1.00 73.31 N ATOM 1467 CA LEU A 103 36.909 13.042 4.846 1.00 63.24 C ATOM 1468 C LEU A 103 38.306 13.404 4.352 1.00 11.33 C ATOM 1469 O LEU A 103 38.638 14.582 4.206 1.00 24.41 O ATOM 1470 CB LEU A 103 35.841 13.833 4.072 1.00 41.13 C ATOM 1471 CG LEU A 103 34.451 13.173 4.012 1.00 32.24 C ATOM 1472 CD1 LEU A 103 33.398 14.158 3.506 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.494 11.934 3.117 1.00 41.41 C ATOM 0 H LEU A 103 36.807 14.306 6.506 1.00 73.31 H new ATOM 0 HA LEU A 103 36.735 11.980 4.672 1.00 63.24 H new ATOM 0 HB2 LEU A 103 35.739 14.817 4.529 1.00 41.13 H new ATOM 0 HB3 LEU A 103 36.195 13.990 3.053 1.00 41.13 H new ATOM 0 HG LEU A 103 34.173 12.871 5.022 1.00 32.24 H new ATOM 0 HD11 LEU A 103 32.426 13.666 3.473 1.00 55.32 H new ATOM 0 HD12 LEU A 103 33.349 15.015 4.178 1.00 55.32 H new ATOM 0 HD13 LEU A 103 33.667 14.496 2.505 1.00 55.32 H new ATOM 0 HD21 LEU A 103 33.506 11.476 3.082 1.00 41.41 H new ATOM 0 HD22 LEU A 103 34.796 12.223 2.110 1.00 41.41 H new ATOM 0 HD23 LEU A 103 35.211 11.219 3.520 1.00 41.41 H new ATOM 1485 N PRO A 104 39.151 12.391 4.115 1.00 73.52 N ATOM 1486 CA PRO A 104 40.535 12.603 3.691 1.00 62.42 C ATOM 1487 C PRO A 104 40.628 13.125 2.259 1.00 45.15 C ATOM 1488 O PRO A 104 39.758 12.855 1.430 1.00 0.45 O ATOM 1489 CB PRO A 104 41.150 11.207 3.813 1.00 24.31 C ATOM 1490 CG PRO A 104 40.010 10.273 3.622 1.00 63.40 C ATOM 1491 CD PRO A 104 38.822 10.958 4.235 1.00 45.41 C ATOM 0 HA PRO A 104 41.045 13.357 4.290 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.922 11.048 3.061 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.619 11.065 4.787 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.843 10.069 2.564 1.00 63.40 H new ATOM 0 HG3 PRO A 104 40.203 9.315 4.105 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.900 10.712 3.707 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.682 10.664 5.275 1.00 45.41 H new ATOM 1499 N GLY A 105 41.685 13.879 1.987 1.00 54.45 N ATOM 1500 CA GLY A 105 41.883 14.453 0.666 1.00 13.33 C ATOM 1501 C GLY A 105 40.884 15.553 0.344 1.00 43.42 C ATOM 1502 O GLY A 105 40.741 15.949 -0.814 1.00 1.41 O ATOM 0 H GLY A 105 42.415 14.106 2.662 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.894 14.855 0.598 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.802 13.665 -0.083 1.00 13.33 H new ATOM 1506 N LEU A 106 40.200 16.053 1.369 1.00 4.51 N ATOM 1507 CA LEU A 106 39.170 17.079 1.200 1.00 40.14 C ATOM 1508 C LEU A 106 39.385 18.230 2.185 1.00 43.11 C ATOM 1509 O LEU A 106 39.776 18.013 3.335 1.00 42.33 O ATOM 1510 CB LEU A 106 37.777 16.445 1.388 1.00 65.03 C ATOM 1511 CG LEU A 106 36.599 17.415 1.595 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.418 18.352 0.403 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.316 16.631 1.855 1.00 41.21 C ATOM 0 H LEU A 106 40.341 15.762 2.336 1.00 4.51 H new ATOM 0 HA LEU A 106 39.238 17.490 0.193 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.562 15.830 0.514 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.821 15.775 2.246 1.00 65.03 H new ATOM 0 HG LEU A 106 36.826 18.033 2.464 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.577 19.020 0.589 1.00 44.14 H new ATOM 0 HD12 LEU A 106 37.324 18.941 0.262 1.00 44.14 H new ATOM 0 HD13 LEU A 106 36.223 17.765 -0.495 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.488 17.325 2.000 1.00 41.21 H new ATOM 0 HD22 LEU A 106 35.104 15.987 1.002 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.438 16.020 2.749 1.00 41.21 H new ATOM 1525 N ASP A 107 39.155 19.455 1.711 1.00 72.42 N ATOM 1526 CA ASP A 107 39.243 20.648 2.549 1.00 14.02 C ATOM 1527 C ASP A 107 38.009 20.778 3.429 1.00 1.12 C ATOM 1528 O ASP A 107 36.887 20.595 2.961 1.00 10.24 O ATOM 1529 CB ASP A 107 39.380 21.908 1.687 1.00 13.35 C ATOM 1530 CG ASP A 107 40.756 22.047 1.057 1.00 12.43 C ATOM 1531 OD1 ASP A 107 40.977 21.483 -0.032 1.00 14.01 O ATOM 1532 OD2 ASP A 107 41.619 22.734 1.644 1.00 2.52 O1- ATOM 0 H ASP A 107 38.904 19.646 0.741 1.00 72.42 H new ATOM 0 HA ASP A 107 40.127 20.546 3.179 1.00 14.02 H new ATOM 0 HB2 ASP A 107 38.626 21.887 0.900 1.00 13.35 H new ATOM 0 HB3 ASP A 107 39.177 22.786 2.300 1.00 13.35 H new ATOM 1537 N ALA A 108 38.227 21.121 4.693 1.00 41.30 N ATOM 1538 CA ALA A 108 37.146 21.304 5.661 1.00 54.32 C ATOM 1539 C ALA A 108 36.097 22.292 5.147 1.00 74.35 C ATOM 1540 O ALA A 108 34.896 22.097 5.345 1.00 33.14 O ATOM 1541 CB ALA A 108 37.718 21.779 6.992 1.00 73.33 C ATOM 0 H ALA A 108 39.158 21.281 5.078 1.00 41.30 H new ATOM 0 HA ALA A 108 36.651 20.343 5.805 1.00 54.32 H new ATOM 0 HB1 ALA A 108 36.908 21.914 7.709 1.00 73.33 H new ATOM 0 HB2 ALA A 108 38.420 21.036 7.372 1.00 73.33 H new ATOM 0 HB3 ALA A 108 38.236 22.727 6.848 1.00 73.33 H new ATOM 1547 N ALA A 109 36.565 23.346 4.480 1.00 23.13 N ATOM 1548 CA ALA A 109 35.682 24.380 3.943 1.00 64.13 C ATOM 1549 C ALA A 109 34.633 23.774 3.010 1.00 31.24 C ATOM 1550 O ALA A 109 33.432 23.999 3.180 1.00 41.21 O ATOM 1551 CB ALA A 109 36.498 25.439 3.212 1.00 33.23 C ATOM 0 H ALA A 109 37.556 23.507 4.298 1.00 23.13 H new ATOM 0 HA ALA A 109 35.159 24.851 4.776 1.00 64.13 H new ATOM 0 HB1 ALA A 109 35.830 26.204 2.816 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.204 25.897 3.905 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.045 24.975 2.391 1.00 33.23 H new ATOM 1557 N ALA A 110 35.091 22.986 2.043 1.00 73.25 N ATOM 1558 CA ALA A 110 34.192 22.343 1.089 1.00 12.34 C ATOM 1559 C ALA A 110 33.461 21.189 1.766 1.00 44.05 C ATOM 1560 O ALA A 110 32.287 20.920 1.499 1.00 34.04 O ATOM 1561 CB ALA A 110 34.971 21.850 -0.126 1.00 53.00 C ATOM 0 H ALA A 110 36.079 22.777 1.898 1.00 73.25 H new ATOM 0 HA ALA A 110 33.456 23.071 0.747 1.00 12.34 H new ATOM 0 HB1 ALA A 110 34.287 21.373 -0.828 1.00 53.00 H new ATOM 0 HB2 ALA A 110 35.459 22.694 -0.612 1.00 53.00 H new ATOM 0 HB3 ALA A 110 35.724 21.130 0.193 1.00 53.00 H new ATOM 1567 N ALA A 111 34.171 20.534 2.674 1.00 5.14 N ATOM 1568 CA ALA A 111 33.643 19.406 3.423 1.00 43.54 C ATOM 1569 C ALA A 111 32.359 19.785 4.153 1.00 4.44 C ATOM 1570 O ALA A 111 31.420 18.989 4.233 1.00 54.13 O ATOM 1571 CB ALA A 111 34.700 18.895 4.391 1.00 13.31 C ATOM 0 H ALA A 111 35.134 20.773 2.912 1.00 5.14 H new ATOM 0 HA ALA A 111 33.392 18.606 2.727 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.302 18.049 4.951 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.581 18.578 3.833 1.00 13.31 H new ATOM 0 HB3 ALA A 111 34.975 19.691 5.083 1.00 13.31 H new ATOM 1577 N LYS A 112 32.316 21.015 4.661 1.00 1.14 N ATOM 1578 CA LYS A 112 31.124 21.530 5.324 1.00 13.13 C ATOM 1579 C LYS A 112 29.915 21.470 4.395 1.00 74.23 C ATOM 1580 O LYS A 112 28.861 20.961 4.773 1.00 4.50 O ATOM 1581 CB LYS A 112 31.335 22.975 5.789 1.00 13.05 C ATOM 1582 CG LYS A 112 32.290 23.123 6.968 1.00 32.13 C ATOM 1583 CD LYS A 112 32.372 24.574 7.429 1.00 10.41 C ATOM 1584 CE LYS A 112 33.191 24.727 8.702 1.00 22.11 C ATOM 1585 NZ LYS A 112 33.172 26.128 9.193 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.095 21.673 4.625 1.00 1.14 H new ATOM 0 HA LYS A 112 30.938 20.900 6.194 1.00 13.13 H new ATOM 0 HB2 LYS A 112 31.716 23.561 4.953 1.00 13.05 H new ATOM 0 HB3 LYS A 112 30.370 23.400 6.063 1.00 13.05 H new ATOM 0 HG2 LYS A 112 31.954 22.494 7.793 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.282 22.772 6.683 1.00 32.13 H new ATOM 0 HD2 LYS A 112 32.815 25.180 6.639 1.00 10.41 H new ATOM 0 HD3 LYS A 112 31.366 24.957 7.598 1.00 10.41 H new ATOM 0 HE2 LYS A 112 32.796 24.064 9.472 1.00 22.11 H new ATOM 0 HE3 LYS A 112 34.220 24.420 8.514 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 33.739 26.199 10.062 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 33.571 26.756 8.466 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 32.192 26.412 9.395 1.00 2.23 H new ATOM 1599 N THR A 113 30.077 21.971 3.171 1.00 31.43 N ATOM 1600 CA THR A 113 28.961 22.051 2.239 1.00 60.21 C ATOM 1601 C THR A 113 28.572 20.656 1.750 1.00 74.22 C ATOM 1602 O THR A 113 27.393 20.373 1.540 1.00 73.22 O ATOM 1603 CB THR A 113 29.273 22.980 1.032 1.00 31.33 C ATOM 1604 OG1 THR A 113 28.055 23.531 0.508 1.00 10.35 O ATOM 1605 CG2 THR A 113 29.996 22.237 -0.084 1.00 32.43 C ATOM 0 H THR A 113 30.962 22.324 2.807 1.00 31.43 H new ATOM 0 HA THR A 113 28.120 22.488 2.777 1.00 60.21 H new ATOM 0 HB THR A 113 29.924 23.775 1.396 1.00 31.33 H new ATOM 0 HG1 THR A 113 28.261 24.116 -0.251 1.00 10.35 H new ATOM 0 HG21 THR A 113 30.195 22.922 -0.908 1.00 32.43 H new ATOM 0 HG22 THR A 113 30.938 21.840 0.294 1.00 32.43 H new ATOM 0 HG23 THR A 113 29.373 21.416 -0.438 1.00 32.43 H new ATOM 1613 N LEU A 114 29.567 19.780 1.589 1.00 23.12 N ATOM 1614 CA LEU A 114 29.318 18.410 1.137 1.00 20.51 C ATOM 1615 C LEU A 114 28.472 17.658 2.158 1.00 41.04 C ATOM 1616 O LEU A 114 27.435 17.082 1.819 1.00 13.34 O ATOM 1617 CB LEU A 114 30.641 17.668 0.880 1.00 61.01 C ATOM 1618 CG LEU A 114 31.581 18.325 -0.150 1.00 11.45 C ATOM 1619 CD1 LEU A 114 32.770 17.418 -0.463 1.00 1.51 C ATOM 1620 CD2 LEU A 114 30.824 18.690 -1.427 1.00 50.51 C ATOM 0 H LEU A 114 30.549 19.994 1.764 1.00 23.12 H new ATOM 0 HA LEU A 114 28.768 18.456 0.197 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.175 17.575 1.826 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.411 16.657 0.543 1.00 61.01 H new ATOM 0 HG LEU A 114 31.966 19.246 0.288 1.00 11.45 H new ATOM 0 HD11 LEU A 114 33.417 17.905 -1.192 1.00 1.51 H new ATOM 0 HD12 LEU A 114 33.332 17.227 0.451 1.00 1.51 H new ATOM 0 HD13 LEU A 114 32.410 16.474 -0.871 1.00 1.51 H new ATOM 0 HD21 LEU A 114 31.510 19.152 -2.137 1.00 50.51 H new ATOM 0 HD22 LEU A 114 30.398 17.789 -1.868 1.00 50.51 H new ATOM 0 HD23 LEU A 114 30.024 19.390 -1.188 1.00 50.51 H new ATOM 1632 N VAL A 115 28.905 17.689 3.410 1.00 72.22 N ATOM 1633 CA VAL A 115 28.177 17.032 4.487 1.00 32.34 C ATOM 1634 C VAL A 115 26.834 17.718 4.728 1.00 1.13 C ATOM 1635 O VAL A 115 25.857 17.067 5.085 1.00 25.22 O ATOM 1636 CB VAL A 115 29.005 17.002 5.796 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.205 16.396 6.949 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.304 16.230 5.579 1.00 35.24 C ATOM 0 H VAL A 115 29.758 18.163 3.706 1.00 72.22 H new ATOM 0 HA VAL A 115 27.996 16.002 4.179 1.00 32.34 H new ATOM 0 HB VAL A 115 29.246 18.030 6.067 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.816 16.390 7.852 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.308 16.991 7.121 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.920 15.374 6.697 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.878 16.215 6.506 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.074 15.208 5.279 1.00 35.24 H new ATOM 0 HG23 VAL A 115 30.889 16.715 4.798 1.00 35.24 H new ATOM 1648 N ASP A 116 26.788 19.032 4.513 1.00 34.11 N ATOM 1649 CA ASP A 116 25.548 19.792 4.675 1.00 22.44 C ATOM 1650 C ASP A 116 24.495 19.307 3.685 1.00 4.20 C ATOM 1651 O ASP A 116 23.417 18.860 4.082 1.00 63.50 O ATOM 1652 CB ASP A 116 25.785 21.293 4.474 1.00 1.42 C ATOM 1653 CG ASP A 116 24.550 22.132 4.787 1.00 43.12 C ATOM 1654 OD1 ASP A 116 24.218 23.031 3.983 1.00 62.34 O ATOM 1655 OD2 ASP A 116 23.893 21.885 5.826 1.00 50.12 O1- ATOM 0 H ASP A 116 27.592 19.591 4.227 1.00 34.11 H new ATOM 0 HA ASP A 116 25.193 19.630 5.693 1.00 22.44 H new ATOM 0 HB2 ASP A 116 26.609 21.615 5.111 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.090 21.474 3.443 1.00 1.42 H new ATOM 1660 N ARG A 117 24.818 19.385 2.394 1.00 43.12 N ATOM 1661 CA ARG A 117 23.888 18.969 1.347 1.00 25.23 C ATOM 1662 C ARG A 117 23.531 17.493 1.514 1.00 51.42 C ATOM 1663 O ARG A 117 22.376 17.093 1.333 1.00 42.42 O ATOM 1664 CB ARG A 117 24.481 19.236 -0.048 1.00 4.30 C ATOM 1665 CG ARG A 117 25.837 18.576 -0.280 1.00 3.24 C ATOM 1666 CD ARG A 117 26.502 19.046 -1.569 1.00 12.41 C ATOM 1667 NE ARG A 117 25.955 18.387 -2.759 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.355 18.643 -4.006 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.232 19.611 -4.245 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.862 17.939 -5.017 1.00 65.24 N ATOM 0 H ARG A 117 25.714 19.731 2.050 1.00 43.12 H new ATOM 0 HA ARG A 117 22.975 19.557 1.440 1.00 25.23 H new ATOM 0 HB2 ARG A 117 23.781 18.880 -0.804 1.00 4.30 H new ATOM 0 HB3 ARG A 117 24.583 20.312 -0.189 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.492 18.793 0.563 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.710 17.494 -0.314 1.00 3.24 H new ATOM 0 HD2 ARG A 117 26.377 20.124 -1.666 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.573 18.853 -1.512 1.00 12.41 H new ATOM 0 HE ARG A 117 25.223 17.689 -2.625 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.604 20.164 -3.473 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.534 19.801 -5.201 1.00 44.31 H new ATOM 0 HH21 ARG A 117 25.178 17.203 -4.840 1.00 65.24 H new ATOM 0 HH22 ARG A 117 26.167 18.134 -5.971 1.00 65.24 H new ATOM 1684 N ALA A 118 24.527 16.695 1.887 1.00 40.10 N ATOM 1685 CA ALA A 118 24.318 15.280 2.177 1.00 45.33 C ATOM 1686 C ALA A 118 23.346 15.114 3.348 1.00 63.41 C ATOM 1687 O ALA A 118 22.466 14.249 3.327 1.00 0.11 O ATOM 1688 CB ALA A 118 25.654 14.608 2.479 1.00 44.02 C ATOM 0 H ALA A 118 25.492 17.006 1.996 1.00 40.10 H new ATOM 0 HA ALA A 118 23.879 14.799 1.303 1.00 45.33 H new ATOM 0 HB1 ALA A 118 25.490 13.552 2.694 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.313 14.704 1.616 1.00 44.02 H new ATOM 0 HB3 ALA A 118 26.115 15.087 3.343 1.00 44.02 H new ATOM 1694 N HIS A 119 23.498 15.981 4.351 1.00 52.13 N ATOM 1695 CA HIS A 119 22.650 15.979 5.543 1.00 15.33 C ATOM 1696 C HIS A 119 21.240 16.478 5.207 1.00 0.40 C ATOM 1697 O HIS A 119 20.360 16.503 6.069 1.00 63.33 O ATOM 1698 CB HIS A 119 23.290 16.869 6.623 1.00 54.45 C ATOM 1699 CG HIS A 119 22.777 16.635 8.012 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.223 17.629 8.798 1.00 2.34 N ATOM 1701 CD2 HIS A 119 22.781 15.519 8.774 1.00 20.34 C ATOM 1702 CE1 HIS A 119 21.911 17.127 9.981 1.00 52.23 C ATOM 1703 NE2 HIS A 119 22.240 15.849 9.990 1.00 74.13 N ATOM 0 H HIS A 119 24.215 16.706 4.359 1.00 52.13 H new ATOM 0 HA HIS A 119 22.565 14.959 5.917 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.368 16.707 6.616 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.123 17.913 6.360 1.00 54.45 H new ATOM 0 HD2 HIS A 119 23.144 14.545 8.479 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.463 17.670 10.800 1.00 52.23 H new ATOM 0 HE2 HIS A 119 22.112 15.210 10.775 1.00 74.13 H new ATOM 1712 N HIS A 120 21.044 16.905 3.957 1.00 43.52 N ATOM 1713 CA HIS A 120 19.729 17.336 3.475 1.00 31.45 C ATOM 1714 C HIS A 120 19.070 16.223 2.667 1.00 61.14 C ATOM 1715 O HIS A 120 17.925 15.850 2.919 1.00 43.11 O ATOM 1716 CB HIS A 120 19.838 18.574 2.567 1.00 2.24 C ATOM 1717 CG HIS A 120 20.534 19.756 3.168 1.00 45.12 C ATOM 1718 ND1 HIS A 120 21.023 20.790 2.404 1.00 44.32 N ATOM 1719 CD2 HIS A 120 20.824 20.070 4.451 1.00 50.50 C ATOM 1720 CE1 HIS A 120 21.586 21.685 3.186 1.00 65.24 C ATOM 1721 NE2 HIS A 120 21.483 21.277 4.437 1.00 75.14 N ATOM 0 H HIS A 120 21.784 16.962 3.257 1.00 43.52 H new ATOM 0 HA HIS A 120 19.133 17.580 4.354 1.00 31.45 H new ATOM 0 HB2 HIS A 120 20.364 18.289 1.656 1.00 2.24 H new ATOM 0 HB3 HIS A 120 18.833 18.877 2.273 1.00 2.24 H new ATOM 0 HD1 HIS A 120 20.959 20.853 1.388 1.00 44.32 H new ATOM 0 HD2 HIS A 120 20.583 19.482 5.324 1.00 50.50 H new ATOM 0 HE1 HIS A 120 22.055 22.601 2.859 1.00 65.24 H new ATOM 1730 N VAL A 121 19.815 15.704 1.691 1.00 33.11 N ATOM 1731 CA VAL A 121 19.262 14.799 0.685 1.00 23.21 C ATOM 1732 C VAL A 121 18.890 13.428 1.254 1.00 3.02 C ATOM 1733 O VAL A 121 17.866 12.858 0.871 1.00 30.52 O ATOM 1734 CB VAL A 121 20.231 14.622 -0.514 1.00 61.42 C ATOM 1735 CG1 VAL A 121 20.459 15.959 -1.217 1.00 74.54 C ATOM 1736 CG2 VAL A 121 21.561 14.012 -0.068 1.00 44.31 C ATOM 0 H VAL A 121 20.810 15.897 1.576 1.00 33.11 H new ATOM 0 HA VAL A 121 18.343 15.272 0.338 1.00 23.21 H new ATOM 0 HB VAL A 121 19.770 13.932 -1.220 1.00 61.42 H new ATOM 0 HG11 VAL A 121 21.141 15.818 -2.056 1.00 74.54 H new ATOM 0 HG12 VAL A 121 19.508 16.344 -1.584 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.891 16.671 -0.514 1.00 74.54 H new ATOM 0 HG21 VAL A 121 22.218 13.901 -0.931 1.00 44.31 H new ATOM 0 HG22 VAL A 121 22.033 14.665 0.666 1.00 44.31 H new ATOM 0 HG23 VAL A 121 21.381 13.034 0.379 1.00 44.31 H new ATOM 1746 N CYS A 122 19.701 12.894 2.167 1.00 31.44 N ATOM 1747 CA CYS A 122 19.448 11.554 2.698 1.00 53.14 C ATOM 1748 C CYS A 122 19.805 11.439 4.185 1.00 23.34 C ATOM 1749 O CYS A 122 20.772 10.768 4.555 1.00 24.32 O ATOM 1750 CB CYS A 122 20.206 10.507 1.870 1.00 50.43 C ATOM 1751 SG CYS A 122 19.725 10.471 0.124 1.00 72.12 S ATOM 0 H CYS A 122 20.525 13.358 2.549 1.00 31.44 H new ATOM 0 HA CYS A 122 18.377 11.365 2.618 1.00 53.14 H new ATOM 0 HB2 CYS A 122 21.275 10.707 1.939 1.00 50.43 H new ATOM 0 HB3 CYS A 122 20.037 9.522 2.304 1.00 50.43 H new ATOM 0 HG CYS A 122 18.742 11.298 -0.072 1.00 72.12 H new ATOM 1757 N PRO A 123 19.047 12.131 5.055 1.00 50.40 N ATOM 1758 CA PRO A 123 19.118 11.961 6.495 1.00 60.03 C ATOM 1759 C PRO A 123 17.954 11.105 7.011 1.00 74.45 C ATOM 1760 O PRO A 123 17.267 10.447 6.229 1.00 30.15 O ATOM 1761 CB PRO A 123 18.982 13.410 6.967 1.00 24.23 C ATOM 1762 CG PRO A 123 18.053 14.049 5.969 1.00 34.14 C ATOM 1763 CD PRO A 123 18.077 13.185 4.718 1.00 45.03 C ATOM 0 HA PRO A 123 20.017 11.453 6.843 1.00 60.03 H new ATOM 0 HB2 PRO A 123 18.575 13.461 7.977 1.00 24.23 H new ATOM 0 HB3 PRO A 123 19.949 13.913 6.987 1.00 24.23 H new ATOM 0 HG2 PRO A 123 17.042 14.116 6.372 1.00 34.14 H new ATOM 0 HG3 PRO A 123 18.373 15.066 5.741 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.094 12.771 4.496 1.00 45.03 H new ATOM 0 HD3 PRO A 123 18.389 13.754 3.842 1.00 45.03 H new ATOM 1771 N TYR A 124 17.732 11.119 8.324 1.00 53.44 N ATOM 1772 CA TYR A 124 16.569 10.445 8.912 1.00 1.24 C ATOM 1773 C TYR A 124 15.326 11.329 8.782 1.00 42.34 C ATOM 1774 O TYR A 124 14.197 10.847 8.862 1.00 23.13 O ATOM 1775 CB TYR A 124 16.842 10.072 10.385 1.00 65.44 C ATOM 1776 CG TYR A 124 17.650 8.788 10.549 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.550 8.005 11.702 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.494 8.343 9.534 1.00 13.25 C ATOM 1779 CE1 TYR A 124 18.260 6.827 11.827 1.00 14.31 C ATOM 1780 CE2 TYR A 124 19.207 7.168 9.659 1.00 12.12 C ATOM 1781 CZ TYR A 124 19.091 6.416 10.807 1.00 5.42 C ATOM 1782 OH TYR A 124 19.800 5.244 10.932 1.00 60.35 O ATOM 0 H TYR A 124 18.336 11.586 9.000 1.00 53.44 H new ATOM 0 HA TYR A 124 16.386 9.519 8.367 1.00 1.24 H new ATOM 0 HB2 TYR A 124 17.376 10.892 10.866 1.00 65.44 H new ATOM 0 HB3 TYR A 124 15.891 9.962 10.906 1.00 65.44 H new ATOM 0 HD1 TYR A 124 16.907 8.326 12.508 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.592 8.929 8.632 1.00 13.25 H new ATOM 0 HE1 TYR A 124 18.164 6.229 12.722 1.00 14.31 H new ATOM 0 HE2 TYR A 124 19.854 6.839 8.859 1.00 12.12 H new ATOM 0 HH TYR A 124 20.652 5.325 10.455 1.00 60.35 H new ATOM 1792 N SER A 125 15.562 12.622 8.563 1.00 23.21 N ATOM 1793 CA SER A 125 14.502 13.607 8.362 1.00 62.44 C ATOM 1794 C SER A 125 15.126 14.990 8.217 1.00 2.13 C ATOM 1795 O SER A 125 16.298 15.177 8.534 1.00 5.11 O ATOM 1796 CB SER A 125 13.510 13.606 9.541 1.00 61.32 C ATOM 1797 OG SER A 125 12.526 14.621 9.391 1.00 44.54 O ATOM 0 H SER A 125 16.501 13.017 8.520 1.00 23.21 H new ATOM 0 HA SER A 125 13.952 13.347 7.458 1.00 62.44 H new ATOM 0 HB2 SER A 125 13.024 12.633 9.609 1.00 61.32 H new ATOM 0 HB3 SER A 125 14.052 13.757 10.475 1.00 61.32 H new ATOM 0 HG SER A 125 11.910 14.595 10.153 1.00 44.54 H new ATOM 1803 N ASN A 126 14.351 15.950 7.729 1.00 23.44 N ATOM 1804 CA ASN A 126 14.785 17.348 7.691 1.00 73.42 C ATOM 1805 C ASN A 126 14.905 17.872 9.114 1.00 24.25 C ATOM 1806 O ASN A 126 15.761 18.702 9.429 1.00 64.13 O ATOM 1807 CB ASN A 126 13.801 18.200 6.879 1.00 54.23 C ATOM 1808 CG ASN A 126 14.235 19.654 6.780 1.00 23.41 C ATOM 1809 OD1 ASN A 126 13.896 20.472 7.631 1.00 4.50 O ATOM 1810 ND2 ASN A 126 14.980 19.985 5.736 1.00 5.31 N ATOM 0 H ASN A 126 13.417 15.790 7.353 1.00 23.44 H new ATOM 0 HA ASN A 126 15.757 17.410 7.202 1.00 73.42 H new ATOM 0 HB2 ASN A 126 13.706 17.783 5.876 1.00 54.23 H new ATOM 0 HB3 ASN A 126 12.815 18.149 7.340 1.00 54.23 H new ATOM 0 HD21 ASN A 126 15.293 20.949 5.618 1.00 5.31 H new ATOM 0 HD22 ASN A 126 15.241 19.276 5.050 1.00 5.31 H new ATOM 1817 N ALA A 127 14.058 17.335 9.976 1.00 54.04 N ATOM 1818 CA ALA A 127 14.021 17.684 11.392 1.00 54.10 C ATOM 1819 C ALA A 127 15.302 17.277 12.128 1.00 52.15 C ATOM 1820 O ALA A 127 15.394 17.422 13.342 1.00 1.24 O ATOM 1821 CB ALA A 127 12.822 17.017 12.038 1.00 41.33 C ATOM 0 H ALA A 127 13.366 16.634 9.711 1.00 54.04 H new ATOM 0 HA ALA A 127 13.940 18.768 11.466 1.00 54.10 H new ATOM 0 HB1 ALA A 127 12.789 17.274 13.097 1.00 41.33 H new ATOM 0 HB2 ALA A 127 11.909 17.361 11.552 1.00 41.33 H new ATOM 0 HB3 ALA A 127 12.905 15.936 11.930 1.00 41.33 H new ATOM 1827 N THR A 128 16.300 16.804 11.395 1.00 1.20 N ATOM 1828 CA THR A 128 17.503 16.263 12.001 1.00 2.03 C ATOM 1829 C THR A 128 18.477 17.398 12.210 1.00 41.31 C ATOM 1830 O THR A 128 19.577 17.213 12.727 1.00 64.41 O ATOM 1831 CB THR A 128 18.157 15.173 11.109 1.00 53.22 C ATOM 1832 OG1 THR A 128 19.189 14.478 11.827 1.00 44.43 O ATOM 1833 CG2 THR A 128 18.757 15.785 9.848 1.00 73.21 C ATOM 0 H THR A 128 16.298 16.785 10.375 1.00 1.20 H new ATOM 0 HA THR A 128 17.239 15.794 12.949 1.00 2.03 H new ATOM 0 HB THR A 128 17.373 14.470 10.828 1.00 53.22 H new ATOM 0 HG1 THR A 128 19.690 15.115 12.378 1.00 44.43 H new ATOM 0 HG21 THR A 128 19.208 15.000 9.242 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.973 16.280 9.275 1.00 73.21 H new ATOM 0 HG23 THR A 128 19.519 16.513 10.124 1.00 73.21 H new ATOM 1841 N ARG A 129 18.065 18.579 11.763 1.00 15.30 N ATOM 1842 CA ARG A 129 18.909 19.751 11.850 1.00 1.24 C ATOM 1843 C ARG A 129 18.192 20.929 12.524 1.00 21.22 C ATOM 1844 O ARG A 129 18.747 21.560 13.425 1.00 60.25 O ATOM 1845 CB ARG A 129 19.402 20.107 10.444 1.00 61.34 C ATOM 1846 CG ARG A 129 18.306 20.515 9.468 1.00 45.30 C ATOM 1847 CD ARG A 129 18.832 20.653 8.043 1.00 1.10 C ATOM 1848 NE ARG A 129 20.039 21.483 7.969 1.00 10.14 N ATOM 1849 CZ ARG A 129 20.251 22.424 7.047 1.00 72.04 C ATOM 1850 NH1 ARG A 129 19.304 22.724 6.166 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 21.411 23.068 7.009 1.00 55.55 N ATOM 0 H ARG A 129 17.152 18.744 11.338 1.00 15.30 H new ATOM 0 HA ARG A 129 19.767 19.528 12.484 1.00 1.24 H new ATOM 0 HB2 ARG A 129 20.122 20.922 10.522 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.935 19.249 10.033 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.507 19.774 9.489 1.00 45.30 H new ATOM 0 HG3 ARG A 129 17.871 21.462 9.787 1.00 45.30 H new ATOM 0 HD2 ARG A 129 19.050 19.663 7.642 1.00 1.10 H new ATOM 0 HD3 ARG A 129 18.056 21.088 7.413 1.00 1.10 H new ATOM 0 HE ARG A 129 20.765 21.331 8.669 1.00 10.14 H new ATOM 0 HH11 ARG A 129 18.410 22.234 6.192 1.00 12.15 H new ATOM 0 HH12 ARG A 129 19.471 23.444 5.463 1.00 12.15 H new ATOM 0 HH21 ARG A 129 22.141 22.844 7.685 1.00 55.55 H new ATOM 0 HH22 ARG A 129 21.572 23.787 6.304 1.00 55.55 H new ATOM 1865 N ASN A 130 16.966 21.225 12.096 1.00 53.23 N ATOM 1866 CA ASN A 130 16.187 22.314 12.705 1.00 71.44 C ATOM 1867 C ASN A 130 15.577 21.871 14.030 1.00 71.52 C ATOM 1868 O ASN A 130 15.734 22.531 15.059 1.00 41.25 O ATOM 1869 CB ASN A 130 15.088 22.820 11.767 1.00 51.21 C ATOM 1870 CG ASN A 130 14.544 21.708 10.933 1.00 65.44 C ATOM 1871 OD1 ASN A 130 13.567 21.049 11.288 1.00 64.05 O ATOM 1872 ND2 ASN A 130 15.212 21.472 9.834 1.00 32.23 N ATOM 0 H ASN A 130 16.490 20.735 11.338 1.00 53.23 H new ATOM 0 HA ASN A 130 16.878 23.136 12.890 1.00 71.44 H new ATOM 0 HB2 ASN A 130 14.284 23.268 12.351 1.00 51.21 H new ATOM 0 HB3 ASN A 130 15.487 23.602 11.121 1.00 51.21 H new ATOM 0 HD21 ASN A 130 14.930 20.708 9.220 1.00 32.23 H new ATOM 0 HD22 ASN A 130 16.015 22.052 9.591 1.00 32.23 H new ATOM 1879 N ASN A 131 14.883 20.738 13.985 1.00 23.53 N ATOM 1880 CA ASN A 131 14.156 20.221 15.139 1.00 43.51 C ATOM 1881 C ASN A 131 15.111 19.693 16.200 1.00 71.03 C ATOM 1882 O ASN A 131 14.950 19.968 17.391 1.00 72.12 O ATOM 1883 CB ASN A 131 13.233 19.077 14.699 1.00 43.33 C ATOM 1884 CG ASN A 131 12.249 18.645 15.778 1.00 4.41 C ATOM 1885 OD1 ASN A 131 11.699 19.603 16.514 1.00 52.34 O flip ATOM 1886 ND2 ASN A 131 11.964 17.455 15.929 1.00 53.22 N flip ATOM 0 H ASN A 131 14.809 20.155 13.151 1.00 23.53 H new ATOM 0 HA ASN A 131 13.574 21.040 15.562 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.677 19.388 13.814 1.00 43.33 H new ATOM 0 HB3 ASN A 131 13.841 18.220 14.408 1.00 43.33 H new ATOM 0 HD21 ASN A 131 12.407 16.746 15.344 1.00 53.22 H new ATOM 0 HD22 ASN A 131 11.285 17.179 16.638 1.00 53.22 H new ATOM 1893 N VAL A 132 16.118 18.951 15.752 1.00 22.24 N ATOM 1894 CA VAL A 132 16.993 18.218 16.654 1.00 51.15 C ATOM 1895 C VAL A 132 18.403 18.792 16.602 1.00 30.12 C ATOM 1896 O VAL A 132 18.940 19.041 15.520 1.00 33.10 O ATOM 1897 CB VAL A 132 17.018 16.712 16.285 1.00 54.43 C ATOM 1898 CG1 VAL A 132 17.843 15.909 17.292 1.00 31.31 C ATOM 1899 CG2 VAL A 132 15.591 16.161 16.181 1.00 70.22 C ATOM 0 H VAL A 132 16.348 18.842 14.764 1.00 22.24 H new ATOM 0 HA VAL A 132 16.606 18.321 17.668 1.00 51.15 H new ATOM 0 HB VAL A 132 17.497 16.610 15.311 1.00 54.43 H new ATOM 0 HG11 VAL A 132 17.842 14.857 17.007 1.00 31.31 H new ATOM 0 HG12 VAL A 132 18.867 16.281 17.302 1.00 31.31 H new ATOM 0 HG13 VAL A 132 17.408 16.016 18.286 1.00 31.31 H new ATOM 0 HG21 VAL A 132 15.628 15.103 15.921 1.00 70.22 H new ATOM 0 HG22 VAL A 132 15.083 16.282 17.138 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.046 16.705 15.410 1.00 70.22 H new ATOM 1909 N ALA A 133 18.988 19.009 17.774 1.00 44.32 N ATOM 1910 CA ALA A 133 20.316 19.598 17.874 1.00 45.42 C ATOM 1911 C ALA A 133 21.390 18.606 17.467 1.00 30.31 C ATOM 1912 O ALA A 133 21.900 17.833 18.280 1.00 14.22 O ATOM 1913 CB ALA A 133 20.563 20.127 19.283 1.00 22.23 C ATOM 0 H ALA A 133 18.560 18.784 18.672 1.00 44.32 H new ATOM 0 HA ALA A 133 20.366 20.438 17.181 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.560 20.563 19.338 1.00 22.23 H new ATOM 0 HB2 ALA A 133 19.820 20.888 19.521 1.00 22.23 H new ATOM 0 HB3 ALA A 133 20.485 19.308 19.998 1.00 22.23 H new ATOM 1919 N VAL A 134 21.701 18.611 16.182 1.00 55.21 N ATOM 1920 CA VAL A 134 22.788 17.815 15.658 1.00 14.23 C ATOM 1921 C VAL A 134 23.913 18.726 15.176 1.00 75.02 C ATOM 1922 O VAL A 134 23.807 19.381 14.133 1.00 44.45 O ATOM 1923 CB VAL A 134 22.332 16.886 14.512 1.00 13.33 C ATOM 1924 CG1 VAL A 134 23.515 16.080 13.997 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.206 15.961 14.979 1.00 40.12 C ATOM 0 H VAL A 134 21.209 19.164 15.480 1.00 55.21 H new ATOM 0 HA VAL A 134 23.148 17.180 16.467 1.00 14.23 H new ATOM 0 HB VAL A 134 21.945 17.498 13.697 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.186 15.427 13.189 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.283 16.758 13.626 1.00 2.32 H new ATOM 0 HG13 VAL A 134 23.925 15.477 14.807 1.00 2.32 H new ATOM 0 HG21 VAL A 134 20.900 15.315 14.156 1.00 40.12 H new ATOM 0 HG22 VAL A 134 21.559 15.348 15.809 1.00 40.12 H new ATOM 0 HG23 VAL A 134 20.356 16.559 15.306 1.00 40.12 H new ATOM 1935 N ARG A 135 24.974 18.774 15.965 1.00 5.32 N ATOM 1936 CA ARG A 135 26.145 19.583 15.677 1.00 35.41 C ATOM 1937 C ARG A 135 26.989 18.925 14.586 1.00 62.34 C ATOM 1938 O ARG A 135 27.688 17.940 14.835 1.00 24.24 O ATOM 1939 CB ARG A 135 26.960 19.759 16.968 1.00 72.41 C ATOM 1940 CG ARG A 135 28.319 20.431 16.790 1.00 24.53 C ATOM 1941 CD ARG A 135 29.054 20.540 18.122 1.00 72.30 C ATOM 1942 NE ARG A 135 30.427 21.026 17.964 1.00 54.11 N ATOM 1943 CZ ARG A 135 31.266 21.239 18.983 1.00 2.05 C ATOM 1944 NH1 ARG A 135 30.874 21.007 20.232 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 32.495 21.676 18.747 1.00 32.21 N ATOM 0 H ARG A 135 25.046 18.245 16.834 1.00 5.32 H new ATOM 0 HA ARG A 135 25.835 20.563 15.313 1.00 35.41 H new ATOM 0 HB2 ARG A 135 26.372 20.346 17.673 1.00 72.41 H new ATOM 0 HB3 ARG A 135 27.113 18.779 17.419 1.00 72.41 H new ATOM 0 HG2 ARG A 135 28.921 19.860 16.084 1.00 24.53 H new ATOM 0 HG3 ARG A 135 28.184 21.425 16.363 1.00 24.53 H new ATOM 0 HD2 ARG A 135 28.507 21.213 18.782 1.00 72.30 H new ATOM 0 HD3 ARG A 135 29.071 19.563 18.606 1.00 72.30 H new ATOM 0 HE ARG A 135 30.763 21.213 17.019 1.00 54.11 H new ATOM 0 HH11 ARG A 135 29.931 20.665 20.415 1.00 12.22 H new ATOM 0 HH12 ARG A 135 31.517 21.171 21.007 1.00 12.22 H new ATOM 0 HH21 ARG A 135 32.799 21.849 17.789 1.00 32.21 H new ATOM 0 HH22 ARG A 135 33.136 21.839 19.523 1.00 32.21 H new ATOM 1959 N LEU A 136 26.893 19.451 13.370 1.00 14.32 N ATOM 1960 CA LEU A 136 27.708 18.970 12.262 1.00 2.32 C ATOM 1961 C LEU A 136 29.104 19.575 12.339 1.00 50.04 C ATOM 1962 O LEU A 136 29.267 20.798 12.322 1.00 1.31 O ATOM 1963 CB LEU A 136 27.057 19.294 10.907 1.00 33.50 C ATOM 1964 CG LEU A 136 25.915 18.354 10.481 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.287 18.825 9.173 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.425 16.920 10.334 1.00 32.41 C ATOM 0 H LEU A 136 26.258 20.211 13.127 1.00 14.32 H new ATOM 0 HA LEU A 136 27.785 17.886 12.343 1.00 2.32 H new ATOM 0 HB2 LEU A 136 26.672 20.313 10.943 1.00 33.50 H new ATOM 0 HB3 LEU A 136 27.829 19.272 10.138 1.00 33.50 H new ATOM 0 HG LEU A 136 25.152 18.375 11.259 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.482 18.146 8.891 1.00 3.54 H new ATOM 0 HD12 LEU A 136 24.885 19.830 9.303 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.044 18.836 8.389 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.603 16.271 10.032 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.209 16.888 9.577 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.827 16.577 11.287 1.00 32.41 H new ATOM 1978 N VAL A 137 30.095 18.706 12.451 1.00 24.14 N ATOM 1979 CA VAL A 137 31.496 19.092 12.494 1.00 11.21 C ATOM 1980 C VAL A 137 32.268 18.259 11.477 1.00 22.22 C ATOM 1981 O VAL A 137 32.357 17.035 11.599 1.00 60.11 O ATOM 1982 CB VAL A 137 32.091 18.925 13.929 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.299 17.890 14.725 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.576 18.540 13.889 1.00 51.44 C ATOM 0 H VAL A 137 29.947 17.699 12.515 1.00 24.14 H new ATOM 0 HA VAL A 137 31.584 20.148 12.239 1.00 11.21 H new ATOM 0 HB VAL A 137 32.011 19.891 14.427 1.00 74.42 H new ATOM 0 HG11 VAL A 137 31.730 17.789 15.721 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.261 18.212 14.810 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.340 16.928 14.213 1.00 2.12 H new ATOM 0 HG21 VAL A 137 33.952 18.434 14.907 1.00 51.44 H new ATOM 0 HG22 VAL A 137 33.693 17.595 13.358 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.140 19.318 13.374 1.00 51.44 H new ATOM 1994 N VAL A 138 32.803 18.911 10.457 1.00 43.23 N ATOM 1995 CA VAL A 138 33.468 18.199 9.377 1.00 53.11 C ATOM 1996 C VAL A 138 34.960 18.494 9.398 1.00 13.33 C ATOM 1997 O VAL A 138 35.377 19.646 9.532 1.00 44.02 O ATOM 1998 CB VAL A 138 32.880 18.549 7.986 1.00 15.42 C ATOM 1999 CG1 VAL A 138 33.213 17.445 6.989 1.00 20.25 C ATOM 2000 CG2 VAL A 138 31.368 18.776 8.071 1.00 13.44 C ATOM 0 H VAL A 138 32.790 19.926 10.354 1.00 43.23 H new ATOM 0 HA VAL A 138 33.299 17.135 9.542 1.00 53.11 H new ATOM 0 HB VAL A 138 33.332 19.479 7.640 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.797 17.698 6.014 1.00 20.25 H new ATOM 0 HG12 VAL A 138 34.295 17.344 6.906 1.00 20.25 H new ATOM 0 HG13 VAL A 138 32.786 16.503 7.333 1.00 20.25 H new ATOM 0 HG21 VAL A 138 30.981 19.020 7.082 1.00 13.44 H new ATOM 0 HG22 VAL A 138 30.884 17.870 8.437 1.00 13.44 H new ATOM 0 HG23 VAL A 138 31.162 19.599 8.755 1.00 13.44 H new ATOM 2010 N ALA A 139 35.752 17.443 9.272 1.00 53.03 N ATOM 2011 CA ALA A 139 37.199 17.547 9.379 1.00 12.31 C ATOM 2012 C ALA A 139 37.831 17.814 8.015 1.00 73.13 C ATOM 2013 O ALA A 139 37.430 17.218 7.014 1.00 43.50 O ATOM 2014 CB ALA A 139 37.761 16.271 9.993 1.00 22.50 C ATOM 0 H ALA A 139 35.413 16.498 9.094 1.00 53.03 H new ATOM 0 HA ALA A 139 37.442 18.390 10.026 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.845 16.352 10.072 1.00 22.50 H new ATOM 0 HB2 ALA A 139 37.335 16.127 10.986 1.00 22.50 H new ATOM 0 HB3 ALA A 139 37.506 15.420 9.361 1.00 22.50 H new ATOM 2021 N MET B 1 26.594 23.042 25.106 1.00 72.34 N ATOM 2022 CA MET B 1 25.851 23.381 26.316 1.00 63.32 C ATOM 2023 C MET B 1 26.328 22.543 27.502 1.00 71.35 C ATOM 2024 O MET B 1 27.263 21.749 27.376 1.00 2.40 O ATOM 2025 CB MET B 1 24.355 23.158 26.104 1.00 41.04 C ATOM 2026 CG MET B 1 24.001 21.709 25.852 1.00 5.33 C ATOM 2027 SD MET B 1 22.222 21.430 25.811 1.00 24.33 S ATOM 2028 CE MET B 1 22.183 19.646 25.886 1.00 72.42 C ATOM 0 H1 MET B 1 25.927 22.862 24.328 1.00 72.34 H new ATOM 0 H2 MET B 1 27.219 23.832 24.850 1.00 72.34 H new ATOM 0 H3 MET B 1 27.165 22.190 25.277 1.00 72.34 H new ATOM 0 HA MET B 1 26.031 24.434 26.534 1.00 63.32 H new ATOM 0 HB2 MET B 1 23.813 23.511 26.981 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.020 23.760 25.259 1.00 41.04 H new ATOM 0 HG2 MET B 1 24.437 21.391 24.905 1.00 5.33 H new ATOM 0 HG3 MET B 1 24.445 21.089 26.631 1.00 5.33 H new ATOM 0 HE1 MET B 1 21.175 19.314 26.136 1.00 72.42 H new ATOM 0 HE2 MET B 1 22.470 19.235 24.918 1.00 72.42 H new ATOM 0 HE3 MET B 1 22.879 19.299 26.649 1.00 72.42 H new ATOM 2038 N ASN B 2 25.665 22.708 28.648 1.00 33.33 N ATOM 2039 CA ASN B 2 26.000 21.953 29.856 1.00 51.30 C ATOM 2040 C ASN B 2 25.451 20.527 29.767 1.00 60.31 C ATOM 2041 O ASN B 2 24.439 20.187 30.384 1.00 61.35 O ATOM 2042 CB ASN B 2 25.461 22.663 31.111 1.00 21.53 C ATOM 2043 CG ASN B 2 25.841 21.955 32.406 1.00 32.42 C ATOM 2044 OD1 ASN B 2 26.870 21.284 32.486 1.00 51.33 O ATOM 2045 ND2 ASN B 2 25.020 22.114 33.435 1.00 42.33 N ATOM 0 H ASN B 2 24.890 23.361 28.765 1.00 33.33 H new ATOM 0 HA ASN B 2 27.086 21.900 29.935 1.00 51.30 H new ATOM 0 HB2 ASN B 2 25.843 23.684 31.136 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.375 22.730 31.045 1.00 21.53 H new ATOM 0 HD21 ASN B 2 25.232 21.673 34.330 1.00 42.33 H new ATOM 0 HD22 ASN B 2 24.176 22.677 33.332 1.00 42.33 H new ATOM 2052 N ILE B 3 26.096 19.723 28.931 1.00 21.23 N ATOM 2053 CA ILE B 3 25.780 18.309 28.795 1.00 72.42 C ATOM 2054 C ILE B 3 25.967 17.568 30.119 1.00 64.03 C ATOM 2055 O ILE B 3 26.992 17.719 30.787 1.00 40.30 O ATOM 2056 CB ILE B 3 26.679 17.652 27.717 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.464 18.329 26.355 1.00 50.54 C ATOM 2058 CG2 ILE B 3 26.407 16.153 27.624 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.120 18.027 25.735 1.00 13.01 C ATOM 0 H ILE B 3 26.856 20.036 28.326 1.00 21.23 H new ATOM 0 HA ILE B 3 24.735 18.237 28.495 1.00 72.42 H new ATOM 0 HB ILE B 3 27.720 17.788 28.009 1.00 60.30 H new ATOM 0 HG12 ILE B 3 26.565 19.408 26.475 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.250 18.009 25.671 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.049 15.713 26.861 1.00 62.10 H new ATOM 0 HG22 ILE B 3 26.614 15.685 28.586 1.00 62.10 H new ATOM 0 HG23 ILE B 3 25.363 15.988 27.358 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.039 18.538 24.776 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.023 16.952 25.583 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.327 18.373 26.399 1.00 13.01 H new ATOM 2071 N LEU B 4 24.967 16.773 30.479 1.00 23.11 N ATOM 2072 CA LEU B 4 25.021 15.938 31.676 1.00 23.43 C ATOM 2073 C LEU B 4 25.752 14.635 31.376 1.00 41.14 C ATOM 2074 O LEU B 4 26.641 14.224 32.122 1.00 62.34 O ATOM 2075 CB LEU B 4 23.604 15.630 32.180 1.00 50.44 C ATOM 2076 CG LEU B 4 22.765 16.852 32.576 1.00 31.23 C ATOM 2077 CD1 LEU B 4 21.363 16.425 33.008 1.00 75.25 C ATOM 2078 CD2 LEU B 4 23.456 17.655 33.680 1.00 11.04 C ATOM 0 H LEU B 4 24.098 16.688 29.952 1.00 23.11 H new ATOM 0 HA LEU B 4 25.561 16.483 32.450 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.072 15.082 31.403 1.00 50.44 H new ATOM 0 HB3 LEU B 4 23.680 14.968 33.042 1.00 50.44 H new ATOM 0 HG LEU B 4 22.670 17.497 31.703 1.00 31.23 H new ATOM 0 HD11 LEU B 4 20.784 17.306 33.285 1.00 75.25 H new ATOM 0 HD12 LEU B 4 20.869 15.910 32.184 1.00 75.25 H new ATOM 0 HD13 LEU B 4 21.435 15.754 33.864 1.00 75.25 H new ATOM 0 HD21 LEU B 4 22.841 18.516 33.943 1.00 11.04 H new ATOM 0 HD22 LEU B 4 23.591 17.024 34.558 1.00 11.04 H new ATOM 0 HD23 LEU B 4 24.428 17.998 33.326 1.00 11.04 H new ATOM 2090 N TYR B 5 25.373 13.984 30.276 1.00 23.42 N ATOM 2091 CA TYR B 5 25.995 12.712 29.894 1.00 44.15 C ATOM 2092 C TYR B 5 26.311 12.693 28.403 1.00 24.15 C ATOM 2093 O TYR B 5 25.435 12.936 27.585 1.00 75.34 O ATOM 2094 CB TYR B 5 25.071 11.534 30.247 1.00 21.21 C ATOM 2095 CG TYR B 5 25.702 10.167 30.022 1.00 10.12 C ATOM 2096 CD1 TYR B 5 25.753 9.593 28.753 1.00 52.12 C ATOM 2097 CD2 TYR B 5 26.256 9.455 31.080 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.337 8.358 28.550 1.00 75.45 C ATOM 2099 CE2 TYR B 5 26.840 8.216 30.884 1.00 10.31 C ATOM 2100 CZ TYR B 5 26.880 7.673 29.616 1.00 52.51 C ATOM 2101 OH TYR B 5 27.466 6.441 29.412 1.00 25.44 O ATOM 0 H TYR B 5 24.647 14.310 29.639 1.00 23.42 H new ATOM 0 HA TYR B 5 26.927 12.611 30.450 1.00 44.15 H new ATOM 0 HB2 TYR B 5 24.774 11.619 31.292 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.162 11.606 29.650 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.328 10.123 27.913 1.00 52.12 H new ATOM 0 HD2 TYR B 5 26.230 9.877 32.074 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.368 7.930 27.559 1.00 75.45 H new ATOM 0 HE2 TYR B 5 27.262 7.677 31.719 1.00 10.31 H new ATOM 0 HH TYR B 5 27.800 6.093 30.265 1.00 25.44 H new ATOM 2111 N LYS B 6 27.562 12.403 28.058 1.00 30.03 N ATOM 2112 CA LYS B 6 27.978 12.290 26.661 1.00 63.12 C ATOM 2113 C LYS B 6 28.840 11.043 26.446 1.00 12.41 C ATOM 2114 O LYS B 6 29.722 10.736 27.248 1.00 54.02 O ATOM 2115 CB LYS B 6 28.727 13.560 26.208 1.00 22.40 C ATOM 2116 CG LYS B 6 29.359 13.450 24.819 1.00 43.31 C ATOM 2117 CD LYS B 6 29.711 14.817 24.224 1.00 65.01 C ATOM 2118 CE LYS B 6 28.472 15.555 23.721 1.00 23.11 C ATOM 2119 NZ LYS B 6 28.819 16.795 22.966 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.311 12.241 28.731 1.00 30.03 H new ATOM 0 HA LYS B 6 27.082 12.189 26.049 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.033 14.400 26.214 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.508 13.787 26.934 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.261 12.841 24.881 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.671 12.933 24.150 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.213 15.423 24.978 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.414 14.685 23.401 1.00 65.01 H new ATOM 0 HE2 LYS B 6 27.892 14.892 23.079 1.00 23.11 H new ATOM 0 HE3 LYS B 6 27.837 15.814 24.568 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 27.967 17.169 22.502 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.197 17.507 23.623 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.536 16.574 22.246 1.00 52.41 H new ATOM 2133 N THR B 7 28.552 10.325 25.364 1.00 10.14 N ATOM 2134 CA THR B 7 29.303 9.135 24.973 1.00 42.05 C ATOM 2135 C THR B 7 29.608 9.206 23.469 1.00 63.52 C ATOM 2136 O THR B 7 28.846 9.810 22.708 1.00 72.52 O ATOM 2137 CB THR B 7 28.512 7.840 25.314 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.294 6.669 25.025 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.193 7.776 24.549 1.00 24.11 C ATOM 0 H THR B 7 27.786 10.554 24.730 1.00 10.14 H new ATOM 0 HA THR B 7 30.239 9.103 25.531 1.00 42.05 H new ATOM 0 HB THR B 7 28.294 7.868 26.382 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.013 6.292 24.165 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.665 6.859 24.810 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.578 8.636 24.812 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.393 7.787 23.478 1.00 24.11 H new ATOM 2147 N ALA B 8 30.722 8.609 23.044 1.00 4.15 N ATOM 2148 CA ALA B 8 31.178 8.729 21.656 1.00 51.31 C ATOM 2149 C ALA B 8 31.308 7.364 20.981 1.00 33.43 C ATOM 2150 O ALA B 8 31.713 6.379 21.604 1.00 64.22 O ATOM 2151 CB ALA B 8 32.509 9.472 21.603 1.00 24.44 C ATOM 0 H ALA B 8 31.325 8.039 23.638 1.00 4.15 H new ATOM 0 HA ALA B 8 30.426 9.297 21.109 1.00 51.31 H new ATOM 0 HB1 ALA B 8 32.838 9.555 20.567 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.386 10.469 22.026 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.255 8.923 22.178 1.00 24.44 H new ATOM 2157 N ALA B 9 30.970 7.321 19.694 1.00 21.22 N ATOM 2158 CA ALA B 9 31.067 6.105 18.898 1.00 20.22 C ATOM 2159 C ALA B 9 31.608 6.424 17.503 1.00 31.45 C ATOM 2160 O ALA B 9 31.128 7.339 16.835 1.00 1.21 O ATOM 2161 CB ALA B 9 29.705 5.419 18.809 1.00 3.15 C ATOM 0 H ALA B 9 30.622 8.128 19.177 1.00 21.22 H new ATOM 0 HA ALA B 9 31.762 5.421 19.385 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.793 4.512 18.211 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.361 5.162 19.811 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.988 6.094 18.341 1.00 3.15 H new ATOM 2167 N THR B 10 32.606 5.664 17.077 1.00 33.23 N ATOM 2168 CA THR B 10 33.256 5.868 15.790 1.00 64.31 C ATOM 2169 C THR B 10 32.779 4.829 14.771 1.00 63.33 C ATOM 2170 O THR B 10 32.867 3.625 15.013 1.00 30.04 O ATOM 2171 CB THR B 10 34.794 5.772 15.943 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.251 6.741 16.901 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.500 5.998 14.610 1.00 23.24 C ATOM 0 H THR B 10 32.989 4.887 17.615 1.00 33.23 H new ATOM 0 HA THR B 10 32.990 6.863 15.432 1.00 64.31 H new ATOM 0 HB THR B 10 35.035 4.768 16.291 1.00 62.43 H new ATOM 0 HG1 THR B 10 35.220 7.635 16.502 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.578 5.924 14.752 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.176 5.243 13.894 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.251 6.989 14.230 1.00 23.24 H new ATOM 2181 N SER B 11 32.260 5.298 13.641 1.00 64.42 N ATOM 2182 CA SER B 11 31.823 4.417 12.562 1.00 20.54 C ATOM 2183 C SER B 11 32.687 4.629 11.317 1.00 44.42 C ATOM 2184 O SER B 11 32.745 5.732 10.768 1.00 74.01 O ATOM 2185 CB SER B 11 30.348 4.673 12.234 1.00 74.14 C ATOM 2186 OG SER B 11 30.133 6.023 11.866 1.00 11.25 O ATOM 0 H SER B 11 32.131 6.291 13.447 1.00 64.42 H new ATOM 0 HA SER B 11 31.935 3.384 12.890 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.034 4.017 11.422 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.732 4.426 13.099 1.00 74.14 H new ATOM 0 HG SER B 11 30.931 6.551 12.078 1.00 11.25 H new ATOM 2192 N THR B 12 33.374 3.576 10.892 1.00 44.31 N ATOM 2193 CA THR B 12 34.240 3.629 9.727 1.00 14.13 C ATOM 2194 C THR B 12 33.546 3.012 8.513 1.00 53.42 C ATOM 2195 O THR B 12 32.648 2.173 8.659 1.00 32.44 O ATOM 2196 CB THR B 12 35.545 2.857 9.999 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.992 3.112 11.340 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.637 3.260 9.020 1.00 31.31 C ATOM 0 H THR B 12 33.345 2.663 11.347 1.00 44.31 H new ATOM 0 HA THR B 12 34.466 4.675 9.522 1.00 14.13 H new ATOM 0 HB THR B 12 35.340 1.794 9.871 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.970 3.052 11.376 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.546 2.698 9.237 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.311 3.044 8.002 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.838 4.327 9.118 1.00 31.31 H new ATOM 2206 N GLY B 13 33.969 3.420 7.325 1.00 25.11 N ATOM 2207 CA GLY B 13 33.443 2.846 6.103 1.00 71.12 C ATOM 2208 C GLY B 13 34.155 1.558 5.742 1.00 70.11 C ATOM 2209 O GLY B 13 35.001 1.543 4.850 1.00 42.34 O ATOM 0 H GLY B 13 34.673 4.145 7.185 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.377 2.653 6.220 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.549 3.562 5.288 1.00 71.12 H new ATOM 2213 N GLY B 14 33.839 0.486 6.472 1.00 21.54 N ATOM 2214 CA GLY B 14 34.433 -0.817 6.205 1.00 31.21 C ATOM 2215 C GLY B 14 34.059 -1.342 4.828 1.00 73.40 C ATOM 2216 O GLY B 14 34.657 -0.953 3.827 1.00 13.01 O ATOM 0 H GLY B 14 33.178 0.498 7.248 1.00 21.54 H new ATOM 0 HA2 GLY B 14 35.518 -0.744 6.283 1.00 31.21 H new ATOM 0 HA3 GLY B 14 34.106 -1.527 6.965 1.00 31.21 H new ATOM 2220 N ARG B 15 33.084 -2.247 4.776 1.00 12.42 N ATOM 2221 CA ARG B 15 32.537 -2.694 3.496 1.00 62.32 C ATOM 2222 C ARG B 15 31.386 -1.790 3.075 1.00 53.41 C ATOM 2223 O ARG B 15 31.393 -1.227 1.979 1.00 34.04 O ATOM 2224 CB ARG B 15 32.068 -4.156 3.579 1.00 22.32 C ATOM 2225 CG ARG B 15 33.180 -5.171 3.335 1.00 23.03 C ATOM 2226 CD ARG B 15 33.748 -5.041 1.924 1.00 52.22 C ATOM 2227 NE ARG B 15 34.762 -6.055 1.634 1.00 65.14 N ATOM 2228 CZ ARG B 15 35.056 -6.488 0.405 1.00 55.23 C ATOM 2229 NH1 ARG B 15 34.433 -5.977 -0.653 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 35.984 -7.418 0.232 1.00 51.30 N ATOM 0 H ARG B 15 32.660 -2.682 5.596 1.00 12.42 H new ATOM 0 HA ARG B 15 33.326 -2.635 2.746 1.00 62.32 H new ATOM 0 HB2 ARG B 15 31.635 -4.334 4.563 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.275 -4.316 2.848 1.00 22.32 H new ATOM 0 HG2 ARG B 15 33.976 -5.024 4.065 1.00 23.03 H new ATOM 0 HG3 ARG B 15 32.794 -6.180 3.483 1.00 23.03 H new ATOM 0 HD2 ARG B 15 32.937 -5.125 1.200 1.00 52.22 H new ATOM 0 HD3 ARG B 15 34.184 -4.050 1.801 1.00 52.22 H new ATOM 0 HE ARG B 15 35.276 -6.456 2.418 1.00 65.14 H new ATOM 0 HH11 ARG B 15 33.727 -5.251 -0.528 1.00 21.14 H new ATOM 0 HH12 ARG B 15 34.661 -6.311 -1.589 1.00 21.14 H new ATOM 0 HH21 ARG B 15 36.475 -7.804 1.038 1.00 51.30 H new ATOM 0 HH22 ARG B 15 36.207 -7.747 -0.707 1.00 51.30 H new ATOM 2244 N ASP B 16 30.395 -1.662 3.949 1.00 43.23 N ATOM 2245 CA ASP B 16 29.299 -0.722 3.733 1.00 64.45 C ATOM 2246 C ASP B 16 29.158 0.192 4.946 1.00 45.23 C ATOM 2247 O ASP B 16 28.983 1.402 4.805 1.00 44.01 O ATOM 2248 CB ASP B 16 28.004 -1.488 3.469 1.00 65.33 C ATOM 2249 CG ASP B 16 26.848 -0.594 3.031 1.00 54.31 C ATOM 2250 OD1 ASP B 16 25.830 -0.530 3.748 1.00 24.34 O ATOM 2251 OD2 ASP B 16 26.953 0.031 1.958 1.00 12.23 O1- ATOM 0 H ASP B 16 30.327 -2.197 4.815 1.00 43.23 H new ATOM 0 HA ASP B 16 29.513 -0.104 2.861 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.185 -2.238 2.699 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.717 -2.023 4.374 1.00 65.33 H new ATOM 2256 N GLY B 17 29.256 -0.396 6.148 1.00 22.41 N ATOM 2257 CA GLY B 17 29.425 0.404 7.348 1.00 74.22 C ATOM 2258 C GLY B 17 29.983 -0.415 8.494 1.00 32.04 C ATOM 2259 O GLY B 17 29.701 -1.607 8.599 1.00 11.23 O ATOM 0 H GLY B 17 29.221 -1.403 6.304 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.094 1.239 7.138 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.465 0.830 7.639 1.00 74.22 H new ATOM 2263 N ARG B 18 30.788 0.211 9.345 1.00 41.41 N ATOM 2264 CA ARG B 18 31.358 -0.462 10.511 1.00 45.30 C ATOM 2265 C ARG B 18 31.234 0.461 11.720 1.00 1.35 C ATOM 2266 O ARG B 18 31.966 1.446 11.830 1.00 0.54 O ATOM 2267 CB ARG B 18 32.828 -0.842 10.235 1.00 74.40 C ATOM 2268 CG ARG B 18 33.429 -1.879 11.194 1.00 53.04 C ATOM 2269 CD ARG B 18 33.746 -1.304 12.572 1.00 43.11 C ATOM 2270 NE ARG B 18 34.646 -0.146 12.494 1.00 64.22 N ATOM 2271 CZ ARG B 18 35.889 -0.122 12.989 1.00 63.34 C ATOM 2272 NH1 ARG B 18 36.389 -1.190 13.605 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 36.628 0.976 12.870 1.00 54.01 N ATOM 0 H ARG B 18 31.063 1.189 9.250 1.00 41.41 H new ATOM 0 HA ARG B 18 30.816 -1.384 10.718 1.00 45.30 H new ATOM 0 HB2 ARG B 18 32.902 -1.227 9.218 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.434 0.063 10.278 1.00 74.40 H new ATOM 0 HG2 ARG B 18 32.732 -2.710 11.305 1.00 53.04 H new ATOM 0 HG3 ARG B 18 34.342 -2.284 10.757 1.00 53.04 H new ATOM 0 HD2 ARG B 18 32.819 -1.009 13.063 1.00 43.11 H new ATOM 0 HD3 ARG B 18 34.203 -2.077 13.190 1.00 43.11 H new ATOM 0 HE ARG B 18 34.301 0.695 12.032 1.00 64.22 H new ATOM 0 HH11 ARG B 18 35.824 -2.034 13.702 1.00 23.22 H new ATOM 0 HH12 ARG B 18 37.337 -1.165 13.980 1.00 23.22 H new ATOM 0 HH21 ARG B 18 36.248 1.799 12.402 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.576 0.996 13.247 1.00 54.01 H new ATOM 2287 N ALA B 19 30.303 0.144 12.612 1.00 25.44 N ATOM 2288 CA ALA B 19 29.997 1.000 13.756 1.00 25.14 C ATOM 2289 C ALA B 19 30.649 0.460 15.025 1.00 64.21 C ATOM 2290 O ALA B 19 30.416 -0.685 15.415 1.00 14.23 O ATOM 2291 CB ALA B 19 28.487 1.114 13.940 1.00 63.23 C ATOM 0 H ALA B 19 29.742 -0.706 12.565 1.00 25.44 H new ATOM 0 HA ALA B 19 30.402 1.993 13.561 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.272 1.754 14.795 1.00 63.23 H new ATOM 0 HB2 ALA B 19 28.043 1.545 13.043 1.00 63.23 H new ATOM 0 HB3 ALA B 19 28.066 0.124 14.113 1.00 63.23 H new ATOM 2297 N THR B 20 31.448 1.293 15.671 1.00 63.15 N ATOM 2298 CA THR B 20 32.195 0.892 16.852 1.00 31.24 C ATOM 2299 C THR B 20 32.044 1.927 17.961 1.00 2.34 C ATOM 2300 O THR B 20 32.446 3.076 17.802 1.00 75.11 O ATOM 2301 CB THR B 20 33.692 0.725 16.492 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.822 -0.195 15.400 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.515 0.226 17.676 1.00 14.05 C ATOM 0 H THR B 20 31.597 2.263 15.393 1.00 63.15 H new ATOM 0 HA THR B 20 31.798 -0.059 17.208 1.00 31.24 H new ATOM 0 HB THR B 20 34.075 1.706 16.211 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.680 -0.664 15.468 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.558 0.124 17.377 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.441 0.939 18.497 1.00 14.05 H new ATOM 0 HG23 THR B 20 34.134 -0.742 18.001 1.00 14.05 H new ATOM 2311 N SER B 21 31.460 1.525 19.086 1.00 21.31 N ATOM 2312 CA SER B 21 31.388 2.406 20.235 1.00 32.44 C ATOM 2313 C SER B 21 32.807 2.597 20.732 1.00 11.23 C ATOM 2314 O SER B 21 33.401 1.643 21.274 1.00 42.34 O ATOM 2315 CB SER B 21 30.490 1.841 21.339 1.00 31.41 C ATOM 2316 OG SER B 21 30.332 2.769 22.399 1.00 74.21 O ATOM 0 H SER B 21 31.037 0.607 19.221 1.00 21.31 H new ATOM 0 HA SER B 21 30.941 3.358 19.948 1.00 32.44 H new ATOM 0 HB2 SER B 21 29.514 1.590 20.924 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.920 0.916 21.723 1.00 31.41 H new ATOM 0 HG SER B 21 31.180 2.863 22.881 1.00 74.21 H new ATOM 2322 N HIS B 22 33.297 3.837 20.531 1.00 5.04 N ATOM 2323 CA HIS B 22 34.719 4.210 20.571 1.00 32.51 C ATOM 2324 C HIS B 22 35.419 3.716 21.825 1.00 35.24 C ATOM 2325 O HIS B 22 36.563 3.265 21.773 1.00 73.12 O ATOM 2326 CB HIS B 22 34.837 5.740 20.474 1.00 3.43 C ATOM 2327 CG HIS B 22 36.247 6.257 20.414 1.00 12.52 C ATOM 2328 ND1 HIS B 22 36.845 6.660 19.241 1.00 31.42 N ATOM 2329 CD2 HIS B 22 37.168 6.460 21.389 1.00 34.34 C ATOM 2330 CE1 HIS B 22 38.067 7.089 19.496 1.00 23.12 C ATOM 2331 NE2 HIS B 22 38.289 6.979 20.792 1.00 12.42 N ATOM 0 H HIS B 22 32.690 4.631 20.330 1.00 5.04 H new ATOM 0 HA HIS B 22 35.213 3.731 19.725 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.303 6.077 19.586 1.00 3.43 H new ATOM 0 HB3 HIS B 22 34.337 6.185 21.334 1.00 3.43 H new ATOM 0 HD1 HIS B 22 36.411 6.631 18.318 1.00 31.42 H new ATOM 0 HD2 HIS B 22 37.042 6.252 22.441 1.00 34.34 H new ATOM 0 HE1 HIS B 22 38.768 7.467 18.766 1.00 23.12 H new ATOM 2340 N ASP B 23 34.717 3.775 22.936 1.00 44.12 N ATOM 2341 CA ASP B 23 35.267 3.383 24.234 1.00 0.24 C ATOM 2342 C ASP B 23 35.233 1.864 24.398 1.00 62.21 C ATOM 2343 O ASP B 23 35.235 1.343 25.516 1.00 40.03 O ATOM 2344 CB ASP B 23 34.490 4.075 25.365 1.00 12.04 C ATOM 2345 CG ASP B 23 32.978 4.001 25.197 1.00 5.31 C ATOM 2346 OD1 ASP B 23 32.264 4.667 25.979 1.00 63.54 O ATOM 2347 OD2 ASP B 23 32.497 3.306 24.269 1.00 33.23 O1- ATOM 0 H ASP B 23 33.749 4.094 22.975 1.00 44.12 H new ATOM 0 HA ASP B 23 36.308 3.701 24.285 1.00 0.24 H new ATOM 0 HB2 ASP B 23 34.765 3.619 26.316 1.00 12.04 H new ATOM 0 HB3 ASP B 23 34.791 5.121 25.415 1.00 12.04 H new ATOM 2352 N GLN B 24 35.212 1.172 23.260 1.00 3.35 N ATOM 2353 CA GLN B 24 35.297 -0.282 23.197 1.00 64.10 C ATOM 2354 C GLN B 24 34.045 -0.933 23.763 1.00 11.02 C ATOM 2355 O GLN B 24 34.064 -2.101 24.162 1.00 0.33 O ATOM 2356 CB GLN B 24 36.557 -0.794 23.912 1.00 41.34 C ATOM 2357 CG GLN B 24 37.858 -0.250 23.330 1.00 71.43 C ATOM 2358 CD GLN B 24 37.957 -0.447 21.825 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.404 -1.492 21.349 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.561 0.564 21.063 1.00 4.32 N ATOM 0 H GLN B 24 35.134 1.614 22.344 1.00 3.35 H new ATOM 0 HA GLN B 24 35.371 -0.563 22.147 1.00 64.10 H new ATOM 0 HB2 GLN B 24 36.500 -0.524 24.966 1.00 41.34 H new ATOM 0 HB3 GLN B 24 36.575 -1.883 23.862 1.00 41.34 H new ATOM 0 HG2 GLN B 24 37.937 0.813 23.559 1.00 71.43 H new ATOM 0 HG3 GLN B 24 38.701 -0.744 23.813 1.00 71.43 H new ATOM 0 HE21 GLN B 24 37.196 1.414 21.493 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.621 0.491 20.047 1.00 4.32 H new ATOM 2369 N LYS B 25 32.948 -0.183 23.782 1.00 34.11 N ATOM 2370 CA LYS B 25 31.666 -0.738 24.190 1.00 33.22 C ATOM 2371 C LYS B 25 31.032 -1.526 23.048 1.00 40.01 C ATOM 2372 O LYS B 25 30.225 -2.425 23.298 1.00 34.42 O ATOM 2373 CB LYS B 25 30.692 0.351 24.676 1.00 20.21 C ATOM 2374 CG LYS B 25 31.084 0.986 26.012 1.00 22.43 C ATOM 2375 CD LYS B 25 30.012 1.945 26.542 1.00 41.25 C ATOM 2376 CE LYS B 25 29.652 3.032 25.532 1.00 25.52 C ATOM 2377 NZ LYS B 25 28.958 4.179 26.171 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.922 0.803 23.522 1.00 34.11 H new ATOM 0 HA LYS B 25 31.862 -1.409 25.026 1.00 33.22 H new ATOM 0 HB2 LYS B 25 30.630 1.132 23.919 1.00 20.21 H new ATOM 0 HB3 LYS B 25 29.696 -0.082 24.770 1.00 20.21 H new ATOM 0 HG2 LYS B 25 31.259 0.200 26.747 1.00 22.43 H new ATOM 0 HG3 LYS B 25 32.023 1.526 25.892 1.00 22.43 H new ATOM 0 HD2 LYS B 25 29.116 1.379 26.797 1.00 41.25 H new ATOM 0 HD3 LYS B 25 30.367 2.410 27.461 1.00 41.25 H new ATOM 0 HE2 LYS B 25 30.559 3.385 25.041 1.00 25.52 H new ATOM 0 HE3 LYS B 25 29.014 2.609 24.756 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 28.898 4.968 25.496 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 27.999 3.891 26.453 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 29.490 4.482 27.012 1.00 5.33 H new ATOM 2391 N LEU B 26 31.380 -1.203 21.790 1.00 71.52 N ATOM 2392 CA LEU B 26 30.760 -1.912 20.662 1.00 40.15 C ATOM 2393 C LEU B 26 31.634 -1.908 19.437 1.00 62.33 C ATOM 2394 O LEU B 26 32.395 -0.979 19.214 1.00 50.50 O ATOM 2395 CB LEU B 26 29.392 -1.287 20.350 1.00 64.14 C ATOM 2396 CG LEU B 26 28.733 -1.717 19.029 1.00 70.42 C ATOM 2397 CD1 LEU B 26 28.291 -3.179 19.072 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.562 -0.798 18.708 1.00 31.22 C ATOM 0 H LEU B 26 32.059 -0.485 21.536 1.00 71.52 H new ATOM 0 HA LEU B 26 30.629 -2.954 20.954 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.711 -1.528 21.166 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.505 -0.203 20.339 1.00 64.14 H new ATOM 0 HG LEU B 26 29.473 -1.630 18.234 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.830 -3.448 18.122 1.00 23.12 H new ATOM 0 HD12 LEU B 26 29.158 -3.816 19.248 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.570 -3.318 19.877 1.00 23.12 H new ATOM 0 HD21 LEU B 26 27.101 -1.110 17.771 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.826 -0.853 19.510 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.920 0.227 18.613 1.00 31.22 H new ATOM 2410 N ASP B 27 31.507 -2.976 18.661 1.00 22.45 N ATOM 2411 CA ASP B 27 32.235 -3.137 17.424 1.00 53.33 C ATOM 2412 C ASP B 27 31.465 -4.074 16.481 1.00 42.15 C ATOM 2413 O ASP B 27 31.442 -5.289 16.672 1.00 22.10 O ATOM 2414 CB ASP B 27 33.646 -3.670 17.719 1.00 24.13 C ATOM 2415 CG ASP B 27 33.668 -5.091 18.279 1.00 15.20 C ATOM 2416 OD1 ASP B 27 33.340 -5.272 19.471 1.00 3.40 O ATOM 2417 OD2 ASP B 27 34.026 -6.033 17.534 1.00 21.30 O1- ATOM 0 H ASP B 27 30.889 -3.757 18.880 1.00 22.45 H new ATOM 0 HA ASP B 27 32.335 -2.172 16.928 1.00 53.33 H new ATOM 0 HB2 ASP B 27 34.233 -3.643 16.801 1.00 24.13 H new ATOM 0 HB3 ASP B 27 34.134 -3.003 18.429 1.00 24.13 H new ATOM 2422 N VAL B 28 30.778 -3.492 15.499 1.00 42.42 N ATOM 2423 CA VAL B 28 30.021 -4.270 14.505 1.00 61.03 C ATOM 2424 C VAL B 28 30.045 -3.622 13.123 1.00 62.05 C ATOM 2425 O VAL B 28 30.570 -2.523 12.935 1.00 71.42 O ATOM 2426 CB VAL B 28 28.539 -4.482 14.921 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.427 -5.562 15.993 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.915 -3.169 15.395 1.00 74.12 C ATOM 0 H VAL B 28 30.727 -2.482 15.366 1.00 42.42 H new ATOM 0 HA VAL B 28 30.523 -5.237 14.460 1.00 61.03 H new ATOM 0 HB VAL B 28 27.984 -4.820 14.046 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.381 -5.694 16.269 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.821 -6.502 15.605 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.999 -5.263 16.871 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.877 -3.342 15.681 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.470 -2.791 16.254 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.952 -2.437 14.589 1.00 74.12 H new ATOM 2438 N LYS B 29 29.440 -4.322 12.168 1.00 64.31 N ATOM 2439 CA LYS B 29 29.378 -3.895 10.777 1.00 24.45 C ATOM 2440 C LYS B 29 27.968 -4.095 10.233 1.00 31.35 C ATOM 2441 O LYS B 29 27.281 -5.049 10.603 1.00 25.23 O ATOM 2442 CB LYS B 29 30.379 -4.713 9.945 1.00 11.40 C ATOM 2443 CG LYS B 29 30.075 -4.775 8.444 1.00 53.23 C ATOM 2444 CD LYS B 29 30.815 -5.923 7.761 1.00 3.25 C ATOM 2445 CE LYS B 29 32.327 -5.833 7.949 1.00 32.51 C ATOM 2446 NZ LYS B 29 33.019 -7.067 7.489 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.974 -5.212 12.342 1.00 64.31 H new ATOM 0 HA LYS B 29 29.634 -2.837 10.714 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.374 -4.289 10.082 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.409 -5.730 10.337 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.002 -4.895 8.295 1.00 53.23 H new ATOM 0 HG3 LYS B 29 30.358 -3.832 7.977 1.00 53.23 H new ATOM 0 HD2 LYS B 29 30.457 -6.872 8.161 1.00 3.25 H new ATOM 0 HD3 LYS B 29 30.583 -5.919 6.696 1.00 3.25 H new ATOM 0 HE2 LYS B 29 32.711 -4.975 7.397 1.00 32.51 H new ATOM 0 HE3 LYS B 29 32.552 -5.662 9.002 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 34.044 -6.965 7.634 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 32.672 -7.883 8.033 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 32.826 -7.217 6.478 1.00 50.55 H new ATOM 2460 N LEU B 30 27.539 -3.187 9.368 1.00 60.42 N ATOM 2461 CA LEU B 30 26.285 -3.325 8.661 1.00 43.12 C ATOM 2462 C LEU B 30 26.499 -3.106 7.162 1.00 50.11 C ATOM 2463 O LEU B 30 27.522 -2.520 6.737 1.00 72.32 O ATOM 2464 CB LEU B 30 25.201 -2.383 9.241 1.00 4.40 C ATOM 2465 CG LEU B 30 25.613 -0.939 9.598 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.544 -0.892 10.811 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.231 -0.237 8.399 1.00 52.40 C ATOM 0 H LEU B 30 28.054 -2.336 9.140 1.00 60.42 H new ATOM 0 HA LEU B 30 25.916 -4.341 8.801 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.385 -2.329 8.520 1.00 4.40 H new ATOM 0 HB3 LEU B 30 24.801 -2.849 10.142 1.00 4.40 H new ATOM 0 HG LEU B 30 24.706 -0.401 9.873 1.00 61.23 H new ATOM 0 HD11 LEU B 30 26.809 0.143 11.027 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.039 -1.325 11.674 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.449 -1.461 10.597 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.512 0.779 8.677 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.117 -0.783 8.074 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.507 -0.203 7.585 1.00 52.40 H new ATOM 2479 N SER B 31 25.552 -3.605 6.371 1.00 24.22 N ATOM 2480 CA SER B 31 25.625 -3.541 4.922 1.00 21.40 C ATOM 2481 C SER B 31 24.236 -3.651 4.307 1.00 43.34 C ATOM 2482 O SER B 31 23.416 -4.455 4.755 1.00 1.33 O ATOM 2483 CB SER B 31 26.529 -4.659 4.378 1.00 62.35 C ATOM 2484 OG SER B 31 27.842 -4.562 4.908 1.00 3.34 O ATOM 0 H SER B 31 24.712 -4.065 6.722 1.00 24.22 H new ATOM 0 HA SER B 31 26.053 -2.577 4.648 1.00 21.40 H new ATOM 0 HB2 SER B 31 26.103 -5.630 4.631 1.00 62.35 H new ATOM 0 HB3 SER B 31 26.568 -4.602 3.290 1.00 62.35 H new ATOM 0 HG SER B 31 28.483 -4.444 4.176 1.00 3.34 H new ATOM 2490 N ALA B 32 23.983 -2.827 3.291 1.00 40.52 N ATOM 2491 CA ALA B 32 22.733 -2.872 2.542 1.00 75.13 C ATOM 2492 C ALA B 32 22.440 -4.303 2.070 1.00 31.44 C ATOM 2493 O ALA B 32 23.182 -4.853 1.243 1.00 42.31 O ATOM 2494 CB ALA B 32 22.797 -1.917 1.351 1.00 44.15 C ATOM 0 H ALA B 32 24.636 -2.114 2.967 1.00 40.52 H new ATOM 0 HA ALA B 32 21.922 -2.556 3.198 1.00 75.13 H new ATOM 0 HB1 ALA B 32 21.858 -1.960 0.800 1.00 44.15 H new ATOM 0 HB2 ALA B 32 22.962 -0.901 1.708 1.00 44.15 H new ATOM 0 HB3 ALA B 32 23.617 -2.209 0.694 1.00 44.15 H new ATOM 2500 N PRO B 33 21.365 -4.928 2.601 1.00 64.54 N ATOM 2501 CA PRO B 33 21.005 -6.312 2.277 1.00 71.30 C ATOM 2502 C PRO B 33 20.924 -6.545 0.769 1.00 44.54 C ATOM 2503 O PRO B 33 20.369 -5.727 0.026 1.00 60.20 O ATOM 2504 CB PRO B 33 19.627 -6.511 2.945 1.00 5.21 C ATOM 2505 CG PRO B 33 19.171 -5.142 3.341 1.00 53.32 C ATOM 2506 CD PRO B 33 20.419 -4.333 3.558 1.00 34.02 C ATOM 0 HA PRO B 33 21.753 -7.020 2.633 1.00 71.30 H new ATOM 0 HB2 PRO B 33 18.921 -6.976 2.257 1.00 5.21 H new ATOM 0 HB3 PRO B 33 19.703 -7.165 3.813 1.00 5.21 H new ATOM 0 HG2 PRO B 33 18.549 -4.698 2.563 1.00 53.32 H new ATOM 0 HG3 PRO B 33 18.568 -5.179 4.248 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.254 -3.274 3.358 1.00 34.02 H new ATOM 0 HD3 PRO B 33 20.779 -4.412 4.584 1.00 34.02 H new ATOM 2514 N ARG B 34 21.470 -7.670 0.320 1.00 0.10 N ATOM 2515 CA ARG B 34 21.542 -7.977 -1.104 1.00 23.43 C ATOM 2516 C ARG B 34 20.141 -8.212 -1.675 1.00 64.55 C ATOM 2517 O ARG B 34 19.958 -8.241 -2.890 1.00 62.12 O ATOM 2518 CB ARG B 34 22.447 -9.200 -1.351 1.00 33.02 C ATOM 2519 CG ARG B 34 23.409 -9.037 -2.533 1.00 11.34 C ATOM 2520 CD ARG B 34 22.670 -8.731 -3.825 1.00 70.25 C ATOM 2521 NE ARG B 34 23.556 -8.701 -4.988 1.00 41.11 N ATOM 2522 CZ ARG B 34 23.215 -9.139 -6.203 1.00 71.43 C ATOM 2523 NH1 ARG B 34 22.026 -9.698 -6.406 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 24.071 -9.029 -7.210 1.00 21.32 N ATOM 0 H ARG B 34 21.871 -8.387 0.925 1.00 0.10 H new ATOM 0 HA ARG B 34 21.980 -7.122 -1.619 1.00 23.43 H new ATOM 0 HB2 ARG B 34 23.026 -9.398 -0.449 1.00 33.02 H new ATOM 0 HB3 ARG B 34 21.819 -10.074 -1.525 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.115 -8.234 -2.319 1.00 11.34 H new ATOM 0 HG3 ARG B 34 23.992 -9.950 -2.655 1.00 11.34 H new ATOM 0 HD2 ARG B 34 21.896 -9.482 -3.982 1.00 70.25 H new ATOM 0 HD3 ARG B 34 22.167 -7.769 -3.732 1.00 70.25 H new ATOM 0 HE ARG B 34 24.494 -8.321 -4.863 1.00 41.11 H new ATOM 0 HH11 ARG B 34 21.369 -9.794 -5.632 1.00 70.13 H new ATOM 0 HH12 ARG B 34 21.771 -10.031 -7.336 1.00 70.13 H new ATOM 0 HH21 ARG B 34 24.988 -8.610 -7.056 1.00 21.32 H new ATOM 0 HH22 ARG B 34 23.812 -9.363 -8.138 1.00 21.32 H new ATOM 2538 N GLU B 35 19.161 -8.366 -0.789 1.00 42.24 N ATOM 2539 CA GLU B 35 17.761 -8.510 -1.192 1.00 63.02 C ATOM 2540 C GLU B 35 17.339 -7.321 -2.062 1.00 12.03 C ATOM 2541 O GLU B 35 16.566 -7.464 -3.013 1.00 54.43 O ATOM 2542 CB GLU B 35 16.868 -8.603 0.055 1.00 72.41 C ATOM 2543 CG GLU B 35 15.432 -9.034 -0.234 1.00 31.33 C ATOM 2544 CD GLU B 35 15.348 -10.422 -0.855 1.00 34.33 C ATOM 2545 OE1 GLU B 35 16.013 -11.346 -0.346 1.00 72.42 O ATOM 2546 OE2 GLU B 35 14.604 -10.599 -1.843 1.00 24.25 O1- ATOM 0 H GLU B 35 19.310 -8.395 0.220 1.00 42.24 H new ATOM 0 HA GLU B 35 17.649 -9.424 -1.775 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.314 -9.310 0.755 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.851 -7.632 0.549 1.00 72.41 H new ATOM 0 HG2 GLU B 35 14.859 -9.020 0.693 1.00 31.33 H new ATOM 0 HG3 GLU B 35 14.968 -8.311 -0.906 1.00 31.33 H new ATOM 2553 N LEU B 36 17.879 -6.145 -1.735 1.00 53.04 N ATOM 2554 CA LEU B 36 17.590 -4.918 -2.479 1.00 1.52 C ATOM 2555 C LEU B 36 18.682 -4.648 -3.516 1.00 52.10 C ATOM 2556 O LEU B 36 18.773 -3.552 -4.069 1.00 30.14 O ATOM 2557 CB LEU B 36 17.472 -3.714 -1.523 1.00 63.52 C ATOM 2558 CG LEU B 36 16.357 -3.798 -0.464 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.025 -4.192 -1.099 1.00 52.43 C ATOM 2560 CD2 LEU B 36 16.734 -4.763 0.658 1.00 15.21 C ATOM 0 H LEU B 36 18.523 -6.017 -0.954 1.00 53.04 H new ATOM 0 HA LEU B 36 16.638 -5.054 -2.993 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.425 -3.589 -1.009 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.312 -2.816 -2.120 1.00 63.52 H new ATOM 0 HG LEU B 36 16.240 -2.807 -0.026 1.00 20.23 H new ATOM 0 HD11 LEU B 36 14.256 -4.244 -0.328 1.00 52.43 H new ATOM 0 HD12 LEU B 36 14.743 -3.448 -1.844 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.124 -5.166 -1.578 1.00 52.43 H new ATOM 0 HD21 LEU B 36 15.928 -4.802 1.391 1.00 15.21 H new ATOM 0 HD22 LEU B 36 16.895 -5.758 0.243 1.00 15.21 H new ATOM 0 HD23 LEU B 36 17.648 -4.419 1.142 1.00 15.21 H new ATOM 2572 N GLY B 37 19.498 -5.662 -3.785 1.00 22.45 N ATOM 2573 CA GLY B 37 20.604 -5.512 -4.715 1.00 25.41 C ATOM 2574 C GLY B 37 21.740 -4.715 -4.110 1.00 51.22 C ATOM 2575 O GLY B 37 22.524 -4.091 -4.825 1.00 30.40 O ATOM 0 H GLY B 37 19.413 -6.591 -3.373 1.00 22.45 H new ATOM 0 HA2 GLY B 37 20.967 -6.496 -5.011 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.254 -5.016 -5.620 1.00 25.41 H new ATOM 2579 N GLY B 38 21.823 -4.742 -2.779 1.00 53.33 N ATOM 2580 CA GLY B 38 22.842 -3.992 -2.074 1.00 54.12 C ATOM 2581 C GLY B 38 24.228 -4.594 -2.230 1.00 61.21 C ATOM 2582 O GLY B 38 24.679 -4.857 -3.346 1.00 64.12 O ATOM 0 H GLY B 38 21.196 -5.275 -2.177 1.00 53.33 H new ATOM 0 HA2 GLY B 38 22.853 -2.966 -2.443 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.587 -3.947 -1.015 1.00 54.12 H new ATOM 2586 N ALA B 39 24.903 -4.826 -1.110 1.00 3.10 N ATOM 2587 CA ALA B 39 26.279 -5.325 -1.130 1.00 71.25 C ATOM 2588 C ALA B 39 26.338 -6.813 -0.801 1.00 4.43 C ATOM 2589 O ALA B 39 27.296 -7.497 -1.165 1.00 31.41 O ATOM 2590 CB ALA B 39 27.141 -4.525 -0.157 1.00 12.41 C ATOM 0 H ALA B 39 24.523 -4.678 -0.175 1.00 3.10 H new ATOM 0 HA ALA B 39 26.671 -5.196 -2.139 1.00 71.25 H new ATOM 0 HB1 ALA B 39 28.163 -4.904 -0.180 1.00 12.41 H new ATOM 0 HB2 ALA B 39 27.137 -3.474 -0.447 1.00 12.41 H new ATOM 0 HB3 ALA B 39 26.739 -4.624 0.851 1.00 12.41 H new ATOM 2596 N GLY B 40 25.295 -7.309 -0.140 1.00 23.34 N ATOM 2597 CA GLY B 40 25.266 -8.698 0.294 1.00 31.44 C ATOM 2598 C GLY B 40 26.472 -9.096 1.121 1.00 1.42 C ATOM 2599 O GLY B 40 27.079 -10.142 0.883 1.00 53.13 O ATOM 0 H GLY B 40 24.464 -6.771 0.105 1.00 23.34 H new ATOM 0 HA2 GLY B 40 24.362 -8.870 0.878 1.00 31.44 H new ATOM 0 HA3 GLY B 40 25.207 -9.343 -0.582 1.00 31.44 H new ATOM 2603 N ALA B 41 26.820 -8.259 2.089 1.00 13.10 N ATOM 2604 CA ALA B 41 27.934 -8.547 2.989 1.00 45.11 C ATOM 2605 C ALA B 41 27.413 -9.054 4.328 1.00 24.05 C ATOM 2606 O ALA B 41 26.210 -9.004 4.595 1.00 14.44 O ATOM 2607 CB ALA B 41 28.807 -7.315 3.183 1.00 11.53 C ATOM 0 H ALA B 41 26.348 -7.374 2.273 1.00 13.10 H new ATOM 0 HA ALA B 41 28.548 -9.326 2.538 1.00 45.11 H new ATOM 0 HB1 ALA B 41 29.630 -7.554 3.857 1.00 11.53 H new ATOM 0 HB2 ALA B 41 29.207 -6.998 2.220 1.00 11.53 H new ATOM 0 HB3 ALA B 41 28.210 -6.510 3.611 1.00 11.53 H new ATOM 2613 N GLU B 42 28.324 -9.522 5.174 1.00 15.20 N ATOM 2614 CA GLU B 42 27.950 -10.136 6.444 1.00 53.20 C ATOM 2615 C GLU B 42 27.768 -9.069 7.510 1.00 74.14 C ATOM 2616 O GLU B 42 28.582 -8.919 8.425 1.00 53.42 O ATOM 2617 CB GLU B 42 29.002 -11.163 6.853 1.00 21.14 C ATOM 2618 CG GLU B 42 29.450 -12.006 5.677 1.00 73.23 C ATOM 2619 CD GLU B 42 30.497 -13.044 6.045 1.00 72.34 C ATOM 2620 OE1 GLU B 42 30.168 -14.249 6.065 1.00 61.42 O ATOM 2621 OE2 GLU B 42 31.655 -12.661 6.317 1.00 61.14 O1- ATOM 0 H GLU B 42 29.329 -9.488 5.003 1.00 15.20 H new ATOM 0 HA GLU B 42 26.998 -10.655 6.329 1.00 53.20 H new ATOM 0 HB2 GLU B 42 29.863 -10.651 7.282 1.00 21.14 H new ATOM 0 HB3 GLU B 42 28.596 -11.810 7.631 1.00 21.14 H new ATOM 0 HG2 GLU B 42 28.583 -12.510 5.249 1.00 73.23 H new ATOM 0 HG3 GLU B 42 29.853 -11.353 4.903 1.00 73.23 H new ATOM 2628 N GLY B 43 26.711 -8.304 7.332 1.00 33.24 N ATOM 2629 CA GLY B 43 26.343 -7.266 8.277 1.00 35.43 C ATOM 2630 C GLY B 43 24.846 -7.230 8.515 1.00 2.13 C ATOM 2631 O GLY B 43 24.151 -8.219 8.263 1.00 72.12 O ATOM 0 H GLY B 43 26.084 -8.382 6.532 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.858 -7.435 9.223 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.675 -6.298 7.902 1.00 35.43 H new ATOM 2635 N THR B 44 24.344 -6.094 8.985 1.00 33.20 N ATOM 2636 CA THR B 44 22.916 -5.932 9.242 1.00 33.40 C ATOM 2637 C THR B 44 22.382 -4.738 8.455 1.00 35.03 C ATOM 2638 O THR B 44 23.144 -4.055 7.768 1.00 4.14 O ATOM 2639 CB THR B 44 22.629 -5.754 10.758 1.00 13.15 C ATOM 2640 OG1 THR B 44 21.215 -5.765 11.007 1.00 1.03 O ATOM 2641 CG2 THR B 44 23.230 -4.457 11.294 1.00 34.45 C ATOM 0 H THR B 44 24.905 -5.269 9.197 1.00 33.20 H new ATOM 0 HA THR B 44 22.405 -6.837 8.914 1.00 33.40 H new ATOM 0 HB THR B 44 23.096 -6.591 11.277 1.00 13.15 H new ATOM 0 HG1 THR B 44 20.949 -4.917 11.419 1.00 1.03 H new ATOM 0 HG21 THR B 44 23.009 -4.366 12.358 1.00 34.45 H new ATOM 0 HG22 THR B 44 24.310 -4.468 11.147 1.00 34.45 H new ATOM 0 HG23 THR B 44 22.800 -3.609 10.760 1.00 34.45 H new ATOM 2649 N ASN B 45 21.084 -4.489 8.550 1.00 4.01 N ATOM 2650 CA ASN B 45 20.456 -3.398 7.810 1.00 51.43 C ATOM 2651 C ASN B 45 20.179 -2.212 8.749 1.00 21.43 C ATOM 2652 O ASN B 45 19.664 -2.391 9.857 1.00 31.35 O ATOM 2653 CB ASN B 45 19.187 -3.902 7.097 1.00 71.14 C ATOM 2654 CG ASN B 45 18.112 -4.416 8.040 1.00 11.33 C ATOM 2655 OD1 ASN B 45 18.200 -5.532 8.564 1.00 33.20 O ATOM 2656 ND2 ASN B 45 17.059 -3.640 8.210 1.00 55.34 N ATOM 0 H ASN B 45 20.442 -5.027 9.132 1.00 4.01 H new ATOM 0 HA ASN B 45 21.135 -3.040 7.036 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.773 -3.091 6.498 1.00 71.14 H new ATOM 0 HB3 ASN B 45 19.463 -4.700 6.407 1.00 71.14 H new ATOM 0 HD21 ASN B 45 16.282 -3.955 8.790 1.00 55.34 H new ATOM 0 HD22 ASN B 45 17.022 -2.725 7.761 1.00 55.34 H new ATOM 2663 N PRO B 46 20.548 -0.985 8.314 1.00 54.41 N ATOM 2664 CA PRO B 46 20.574 0.215 9.177 1.00 2.04 C ATOM 2665 C PRO B 46 19.241 0.530 9.865 1.00 14.41 C ATOM 2666 O PRO B 46 19.206 0.744 11.082 1.00 12.32 O ATOM 2667 CB PRO B 46 20.971 1.353 8.213 1.00 21.50 C ATOM 2668 CG PRO B 46 20.718 0.813 6.844 1.00 13.22 C ATOM 2669 CD PRO B 46 20.967 -0.666 6.936 1.00 31.44 C ATOM 0 HA PRO B 46 21.264 0.071 10.009 1.00 2.04 H new ATOM 0 HB2 PRO B 46 20.380 2.250 8.398 1.00 21.50 H new ATOM 0 HB3 PRO B 46 22.018 1.629 8.340 1.00 21.50 H new ATOM 0 HG2 PRO B 46 19.696 1.019 6.525 1.00 13.22 H new ATOM 0 HG3 PRO B 46 21.380 1.276 6.112 1.00 13.22 H new ATOM 0 HD2 PRO B 46 20.386 -1.220 6.199 1.00 31.44 H new ATOM 0 HD3 PRO B 46 22.015 -0.911 6.766 1.00 31.44 H new ATOM 2677 N GLU B 47 18.150 0.562 9.098 1.00 51.12 N ATOM 2678 CA GLU B 47 16.844 0.952 9.645 1.00 42.23 C ATOM 2679 C GLU B 47 16.420 -0.003 10.761 1.00 51.31 C ATOM 2680 O GLU B 47 15.733 0.400 11.698 1.00 51.34 O ATOM 2681 CB GLU B 47 15.737 1.049 8.562 1.00 43.35 C ATOM 2682 CG GLU B 47 16.171 0.699 7.141 1.00 13.13 C ATOM 2683 CD GLU B 47 16.519 -0.768 6.978 1.00 41.12 C ATOM 2684 OE1 GLU B 47 15.596 -1.607 6.978 1.00 53.12 O ATOM 2685 OE2 GLU B 47 17.719 -1.090 6.873 1.00 73.03 O1- ATOM 0 H GLU B 47 18.141 0.326 8.106 1.00 51.12 H new ATOM 0 HA GLU B 47 16.967 1.954 10.057 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.918 0.388 8.845 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.342 2.065 8.562 1.00 43.35 H new ATOM 0 HG2 GLU B 47 15.371 0.957 6.447 1.00 13.13 H new ATOM 0 HG3 GLU B 47 17.035 1.305 6.870 1.00 13.13 H new ATOM 2692 N GLN B 48 16.844 -1.262 10.661 1.00 65.22 N ATOM 2693 CA GLN B 48 16.585 -2.252 11.704 1.00 23.21 C ATOM 2694 C GLN B 48 17.288 -1.843 12.992 1.00 44.13 C ATOM 2695 O GLN B 48 16.683 -1.815 14.064 1.00 15.51 O ATOM 2696 CB GLN B 48 17.070 -3.633 11.232 1.00 21.32 C ATOM 2697 CG GLN B 48 16.840 -4.793 12.201 1.00 64.34 C ATOM 2698 CD GLN B 48 17.929 -4.934 13.259 1.00 23.41 C ATOM 2699 OE1 GLN B 48 17.823 -4.402 14.359 1.00 3.40 O ATOM 2700 NE2 GLN B 48 18.992 -5.649 12.922 1.00 12.54 N ATOM 0 H GLN B 48 17.370 -1.621 9.865 1.00 65.22 H new ATOM 0 HA GLN B 48 15.514 -2.306 11.901 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.573 -3.868 10.291 1.00 21.32 H new ATOM 0 HB3 GLN B 48 18.137 -3.568 11.021 1.00 21.32 H new ATOM 0 HG2 GLN B 48 15.879 -4.655 12.697 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.775 -5.721 11.633 1.00 64.34 H new ATOM 0 HE21 GLN B 48 19.046 -6.077 11.998 1.00 12.54 H new ATOM 0 HE22 GLN B 48 19.756 -5.771 13.587 1.00 12.54 H new ATOM 2709 N LEU B 49 18.567 -1.505 12.859 1.00 25.52 N ATOM 2710 CA LEU B 49 19.397 -1.122 13.997 1.00 12.42 C ATOM 2711 C LEU B 49 18.782 0.086 14.715 1.00 73.15 C ATOM 2712 O LEU B 49 18.585 0.069 15.937 1.00 22.33 O ATOM 2713 CB LEU B 49 20.830 -0.824 13.498 1.00 25.41 C ATOM 2714 CG LEU B 49 21.925 -0.629 14.571 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.853 0.759 15.204 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.837 -1.718 15.642 1.00 31.54 C ATOM 0 H LEU B 49 19.056 -1.489 11.964 1.00 25.52 H new ATOM 0 HA LEU B 49 19.446 -1.938 14.718 1.00 12.42 H new ATOM 0 HB2 LEU B 49 21.138 -1.642 12.846 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.794 0.076 12.885 1.00 25.41 H new ATOM 0 HG LEU B 49 22.890 -0.713 14.072 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.638 0.858 15.953 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.989 1.518 14.433 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.881 0.893 15.678 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.617 -1.560 16.386 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.861 -1.675 16.125 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.970 -2.696 15.179 1.00 31.54 H new ATOM 2728 N PHE B 50 18.465 1.124 13.944 1.00 74.53 N ATOM 2729 CA PHE B 50 17.837 2.326 14.490 1.00 13.24 C ATOM 2730 C PHE B 50 16.464 2.004 15.081 1.00 54.12 C ATOM 2731 O PHE B 50 16.123 2.490 16.153 1.00 20.22 O ATOM 2732 CB PHE B 50 17.718 3.412 13.408 1.00 14.34 C ATOM 2733 CG PHE B 50 16.767 4.538 13.760 1.00 61.31 C ATOM 2734 CD1 PHE B 50 17.015 5.390 14.831 1.00 53.13 C ATOM 2735 CD2 PHE B 50 15.625 4.741 13.008 1.00 53.22 C ATOM 2736 CE1 PHE B 50 16.137 6.416 15.139 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.744 5.758 13.309 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.998 6.597 14.377 1.00 62.30 C ATOM 0 H PHE B 50 18.633 1.157 12.938 1.00 74.53 H new ATOM 0 HA PHE B 50 18.471 2.705 15.292 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.706 3.832 13.220 1.00 14.34 H new ATOM 0 HB3 PHE B 50 17.386 2.949 12.479 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.903 5.250 15.430 1.00 53.13 H new ATOM 0 HD2 PHE B 50 15.419 4.092 12.170 1.00 53.22 H new ATOM 0 HE1 PHE B 50 16.342 7.072 15.972 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.856 5.899 12.710 1.00 22.12 H new ATOM 0 HZ PHE B 50 14.308 7.393 14.616 1.00 62.30 H new ATOM 2748 N ALA B 51 15.682 1.193 14.375 1.00 24.13 N ATOM 2749 CA ALA B 51 14.361 0.776 14.850 1.00 31.22 C ATOM 2750 C ALA B 51 14.448 0.133 16.233 1.00 63.22 C ATOM 2751 O ALA B 51 13.746 0.538 17.166 1.00 61.14 O ATOM 2752 CB ALA B 51 13.723 -0.194 13.863 1.00 4.33 C ATOM 0 H ALA B 51 15.940 0.808 13.466 1.00 24.13 H new ATOM 0 HA ALA B 51 13.738 1.667 14.927 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.742 -0.494 14.231 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.614 0.292 12.894 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.356 -1.075 13.758 1.00 4.33 H new ATOM 2758 N ALA B 52 15.318 -0.866 16.355 1.00 2.41 N ATOM 2759 CA ALA B 52 15.499 -1.584 17.611 1.00 55.02 C ATOM 2760 C ALA B 52 15.947 -0.629 18.714 1.00 53.11 C ATOM 2761 O ALA B 52 15.417 -0.651 19.829 1.00 74.31 O ATOM 2762 CB ALA B 52 16.508 -2.711 17.431 1.00 43.35 C ATOM 0 H ALA B 52 15.911 -1.197 15.594 1.00 2.41 H new ATOM 0 HA ALA B 52 14.544 -2.018 17.906 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.635 -3.240 18.376 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.147 -3.405 16.672 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.465 -2.295 17.116 1.00 43.35 H new ATOM 2768 N GLY B 53 16.915 0.221 18.383 1.00 41.34 N ATOM 2769 CA GLY B 53 17.418 1.189 19.339 1.00 4.13 C ATOM 2770 C GLY B 53 16.375 2.216 19.736 1.00 15.42 C ATOM 2771 O GLY B 53 16.319 2.637 20.889 1.00 73.22 O ATOM 0 H GLY B 53 17.361 0.256 17.466 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.765 0.667 20.230 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.281 1.700 18.913 1.00 4.13 H new ATOM 2775 N TYR B 54 15.544 2.609 18.778 1.00 15.35 N ATOM 2776 CA TYR B 54 14.524 3.633 18.997 1.00 21.24 C ATOM 2777 C TYR B 54 13.426 3.101 19.911 1.00 2.44 C ATOM 2778 O TYR B 54 12.998 3.784 20.843 1.00 55.40 O ATOM 2779 CB TYR B 54 13.930 4.093 17.652 1.00 22.10 C ATOM 2780 CG TYR B 54 12.928 5.235 17.753 1.00 24.43 C ATOM 2781 CD1 TYR B 54 13.006 6.177 18.774 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.909 5.377 16.813 1.00 20.22 C ATOM 2783 CE1 TYR B 54 12.105 7.225 18.851 1.00 54.12 C ATOM 2784 CE2 TYR B 54 11.004 6.422 16.887 1.00 11.21 C ATOM 2785 CZ TYR B 54 11.105 7.341 17.907 1.00 15.31 C ATOM 2786 OH TYR B 54 10.208 8.387 17.981 1.00 73.14 O ATOM 0 H TYR B 54 15.556 2.230 17.831 1.00 15.35 H new ATOM 0 HA TYR B 54 14.990 4.491 19.481 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.745 4.401 16.997 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.443 3.242 17.176 1.00 22.10 H new ATOM 0 HD1 TYR B 54 13.783 6.089 19.519 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.824 4.658 16.012 1.00 20.22 H new ATOM 0 HE1 TYR B 54 12.184 7.950 19.648 1.00 54.12 H new ATOM 0 HE2 TYR B 54 10.222 6.516 16.148 1.00 11.21 H new ATOM 0 HH TYR B 54 10.691 9.237 17.922 1.00 73.14 H new ATOM 2796 N SER B 55 12.981 1.881 19.642 1.00 62.44 N ATOM 2797 CA SER B 55 11.956 1.240 20.456 1.00 11.44 C ATOM 2798 C SER B 55 12.480 1.005 21.876 1.00 45.34 C ATOM 2799 O SER B 55 11.819 1.349 22.860 1.00 23.33 O ATOM 2800 CB SER B 55 11.512 -0.073 19.801 1.00 71.55 C ATOM 2801 OG SER B 55 12.627 -0.869 19.432 1.00 22.42 O ATOM 0 H SER B 55 13.315 1.313 18.863 1.00 62.44 H new ATOM 0 HA SER B 55 11.087 1.895 20.523 1.00 11.44 H new ATOM 0 HB2 SER B 55 10.878 -0.630 20.491 1.00 71.55 H new ATOM 0 HB3 SER B 55 10.910 0.144 18.919 1.00 71.55 H new ATOM 0 HG SER B 55 12.989 -0.550 18.579 1.00 22.42 H new ATOM 2807 N ALA B 56 13.686 0.448 21.968 1.00 72.32 N ATOM 2808 CA ALA B 56 14.347 0.235 23.254 1.00 72.14 C ATOM 2809 C ALA B 56 14.589 1.568 23.963 1.00 34.31 C ATOM 2810 O ALA B 56 14.508 1.665 25.193 1.00 51.54 O ATOM 2811 CB ALA B 56 15.657 -0.516 23.050 1.00 11.32 C ATOM 0 H ALA B 56 14.228 0.135 21.163 1.00 72.32 H new ATOM 0 HA ALA B 56 13.696 -0.368 23.887 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.142 -0.670 24.014 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.454 -1.482 22.587 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.313 0.066 22.403 1.00 11.32 H new ATOM 2817 N CYS B 57 14.880 2.604 23.179 1.00 24.02 N ATOM 2818 CA CYS B 57 15.066 3.943 23.718 1.00 54.22 C ATOM 2819 C CYS B 57 13.734 4.474 24.228 1.00 22.14 C ATOM 2820 O CYS B 57 13.680 5.166 25.246 1.00 1.03 O ATOM 2821 CB CYS B 57 15.646 4.893 22.661 1.00 72.40 C ATOM 2822 SG CYS B 57 16.004 6.555 23.280 1.00 42.35 S ATOM 0 H CYS B 57 14.992 2.538 22.167 1.00 24.02 H new ATOM 0 HA CYS B 57 15.778 3.889 24.542 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.563 4.460 22.263 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.943 4.969 21.831 1.00 72.40 H new ATOM 0 HG CYS B 57 16.000 7.397 22.290 1.00 42.35 H new ATOM 2828 N PHE B 58 12.658 4.134 23.519 1.00 34.03 N ATOM 2829 CA PHE B 58 11.328 4.596 23.880 1.00 42.11 C ATOM 2830 C PHE B 58 10.875 3.911 25.163 1.00 1.15 C ATOM 2831 O PHE B 58 10.118 4.480 25.939 1.00 52.32 O ATOM 2832 CB PHE B 58 10.327 4.340 22.739 1.00 13.13 C ATOM 2833 CG PHE B 58 9.500 5.554 22.396 1.00 50.11 C ATOM 2834 CD1 PHE B 58 8.620 6.095 23.324 1.00 2.44 C ATOM 2835 CD2 PHE B 58 9.610 6.159 21.153 1.00 25.34 C ATOM 2836 CE1 PHE B 58 7.870 7.214 23.015 1.00 5.05 C ATOM 2837 CE2 PHE B 58 8.859 7.275 20.841 1.00 25.32 C ATOM 2838 CZ PHE B 58 7.989 7.803 21.773 1.00 52.03 C ATOM 0 H PHE B 58 12.687 3.539 22.691 1.00 34.03 H new ATOM 0 HA PHE B 58 11.366 5.672 24.050 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.871 4.016 21.852 1.00 13.13 H new ATOM 0 HB3 PHE B 58 9.663 3.523 23.022 1.00 13.13 H new ATOM 0 HD1 PHE B 58 8.521 5.637 24.297 1.00 2.44 H new ATOM 0 HD2 PHE B 58 10.291 5.752 20.420 1.00 25.34 H new ATOM 0 HE1 PHE B 58 7.191 7.627 23.746 1.00 5.05 H new ATOM 0 HE2 PHE B 58 8.952 7.734 19.868 1.00 25.32 H new ATOM 0 HZ PHE B 58 7.402 8.676 21.530 1.00 52.03 H new ATOM 2848 N LEU B 59 11.347 2.682 25.375 1.00 60.43 N ATOM 2849 CA LEU B 59 11.104 1.970 26.627 1.00 11.12 C ATOM 2850 C LEU B 59 11.785 2.703 27.778 1.00 60.54 C ATOM 2851 O LEU B 59 11.222 2.846 28.862 1.00 64.41 O ATOM 2852 CB LEU B 59 11.626 0.527 26.543 1.00 33.41 C ATOM 2853 CG LEU B 59 10.884 -0.387 25.555 1.00 23.42 C ATOM 2854 CD1 LEU B 59 11.537 -1.764 25.500 1.00 12.45 C ATOM 2855 CD2 LEU B 59 9.408 -0.504 25.935 1.00 24.24 C ATOM 0 H LEU B 59 11.900 2.160 24.695 1.00 60.43 H new ATOM 0 HA LEU B 59 10.029 1.937 26.804 1.00 11.12 H new ATOM 0 HB2 LEU B 59 12.679 0.556 26.264 1.00 33.41 H new ATOM 0 HB3 LEU B 59 11.571 0.081 27.536 1.00 33.41 H new ATOM 0 HG LEU B 59 10.947 0.059 24.563 1.00 23.42 H new ATOM 0 HD11 LEU B 59 10.996 -2.395 24.795 1.00 12.45 H new ATOM 0 HD12 LEU B 59 12.573 -1.663 25.176 1.00 12.45 H new ATOM 0 HD13 LEU B 59 11.509 -2.220 26.490 1.00 12.45 H new ATOM 0 HD21 LEU B 59 8.900 -1.155 25.224 1.00 24.24 H new ATOM 0 HD22 LEU B 59 9.322 -0.924 26.937 1.00 24.24 H new ATOM 0 HD23 LEU B 59 8.948 0.484 25.916 1.00 24.24 H new ATOM 2867 N SER B 60 13.003 3.172 27.527 1.00 44.21 N ATOM 2868 CA SER B 60 13.759 3.932 28.516 1.00 2.40 C ATOM 2869 C SER B 60 13.073 5.272 28.798 1.00 73.23 C ATOM 2870 O SER B 60 12.910 5.672 29.958 1.00 65.55 O ATOM 2871 CB SER B 60 15.195 4.137 28.019 1.00 63.24 C ATOM 2872 OG SER B 60 15.789 2.889 27.703 1.00 24.13 O ATOM 0 H SER B 60 13.490 3.038 26.641 1.00 44.21 H new ATOM 0 HA SER B 60 13.793 3.374 29.452 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.194 4.780 27.139 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.783 4.644 28.784 1.00 63.24 H new ATOM 0 HG SER B 60 15.397 2.541 26.875 1.00 24.13 H new ATOM 2878 N ALA B 61 12.644 5.944 27.731 1.00 21.42 N ATOM 2879 CA ALA B 61 11.907 7.197 27.850 1.00 31.00 C ATOM 2880 C ALA B 61 10.584 6.954 28.571 1.00 42.41 C ATOM 2881 O ALA B 61 10.137 7.773 29.370 1.00 44.10 O ATOM 2882 CB ALA B 61 11.669 7.806 26.471 1.00 4.34 C ATOM 0 H ALA B 61 12.796 5.638 26.770 1.00 21.42 H new ATOM 0 HA ALA B 61 12.497 7.903 28.435 1.00 31.00 H new ATOM 0 HB1 ALA B 61 11.118 8.741 26.576 1.00 4.34 H new ATOM 0 HB2 ALA B 61 12.627 8.002 25.989 1.00 4.34 H new ATOM 0 HB3 ALA B 61 11.092 7.111 25.861 1.00 4.34 H new ATOM 2888 N MET B 62 9.979 5.804 28.286 1.00 64.12 N ATOM 2889 CA MET B 62 8.731 5.394 28.921 1.00 62.41 C ATOM 2890 C MET B 62 8.946 5.222 30.425 1.00 51.11 C ATOM 2891 O MET B 62 8.082 5.577 31.233 1.00 53.32 O ATOM 2892 CB MET B 62 8.227 4.083 28.288 1.00 4.11 C ATOM 2893 CG MET B 62 6.810 3.666 28.682 1.00 71.00 C ATOM 2894 SD MET B 62 5.519 4.690 27.930 1.00 51.43 S ATOM 2895 CE MET B 62 5.429 6.066 29.074 1.00 33.40 C ATOM 0 H MET B 62 10.340 5.131 27.609 1.00 64.12 H new ATOM 0 HA MET B 62 7.976 6.165 28.766 1.00 62.41 H new ATOM 0 HB2 MET B 62 8.269 4.183 27.203 1.00 4.11 H new ATOM 0 HB3 MET B 62 8.913 3.281 28.561 1.00 4.11 H new ATOM 0 HG2 MET B 62 6.652 2.627 28.393 1.00 71.00 H new ATOM 0 HG3 MET B 62 6.714 3.714 29.767 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.387 6.261 29.328 1.00 33.40 H new ATOM 0 HE2 MET B 62 5.984 5.823 29.980 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.861 6.953 28.611 1.00 33.40 H new ATOM 2905 N LYS B 63 10.115 4.684 30.793 1.00 72.03 N ATOM 2906 CA LYS B 63 10.488 4.548 32.199 1.00 43.00 C ATOM 2907 C LYS B 63 10.598 5.928 32.844 1.00 70.35 C ATOM 2908 O LYS B 63 10.039 6.168 33.917 1.00 23.43 O ATOM 2909 CB LYS B 63 11.815 3.779 32.365 1.00 31.31 C ATOM 2910 CG LYS B 63 11.774 2.328 31.879 1.00 20.13 C ATOM 2911 CD LYS B 63 12.894 1.482 32.497 1.00 10.22 C ATOM 2912 CE LYS B 63 14.293 1.920 32.056 1.00 1.23 C ATOM 2913 NZ LYS B 63 14.661 1.378 30.717 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.814 4.338 30.136 1.00 72.03 H new ATOM 0 HA LYS B 63 9.707 3.973 32.698 1.00 43.00 H new ATOM 0 HB2 LYS B 63 12.597 4.309 31.822 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.096 3.788 33.418 1.00 31.31 H new ATOM 0 HG2 LYS B 63 10.808 1.889 32.130 1.00 20.13 H new ATOM 0 HG3 LYS B 63 11.861 2.307 30.793 1.00 20.13 H new ATOM 0 HD2 LYS B 63 12.828 1.540 33.583 1.00 10.22 H new ATOM 0 HD3 LYS B 63 12.744 0.437 32.224 1.00 10.22 H new ATOM 0 HE2 LYS B 63 14.339 3.009 32.030 1.00 1.23 H new ATOM 0 HE3 LYS B 63 15.024 1.588 32.793 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 15.641 1.645 30.492 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 14.578 0.341 30.727 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 14.021 1.769 29.996 1.00 55.13 H new ATOM 2927 N PHE B 64 11.315 6.837 32.175 1.00 21.33 N ATOM 2928 CA PHE B 64 11.452 8.215 32.658 1.00 32.24 C ATOM 2929 C PHE B 64 10.079 8.856 32.864 1.00 14.21 C ATOM 2930 O PHE B 64 9.803 9.445 33.912 1.00 73.11 O ATOM 2931 CB PHE B 64 12.287 9.058 31.680 1.00 30.41 C ATOM 2932 CG PHE B 64 12.232 10.541 31.970 1.00 63.34 C ATOM 2933 CD1 PHE B 64 12.728 11.052 33.163 1.00 43.42 C ATOM 2934 CD2 PHE B 64 11.671 11.423 31.054 1.00 31.33 C ATOM 2935 CE1 PHE B 64 12.663 12.406 33.434 1.00 55.11 C ATOM 2936 CE2 PHE B 64 11.608 12.777 31.320 1.00 33.41 C ATOM 2937 CZ PHE B 64 12.102 13.269 32.511 1.00 14.04 C ATOM 0 H PHE B 64 11.807 6.645 31.302 1.00 21.33 H new ATOM 0 HA PHE B 64 11.969 8.183 33.617 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.324 8.726 31.719 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.933 8.880 30.664 1.00 30.41 H new ATOM 0 HD1 PHE B 64 13.170 10.383 33.887 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.279 11.045 30.122 1.00 31.33 H new ATOM 0 HE1 PHE B 64 13.050 12.790 34.366 1.00 55.11 H new ATOM 0 HE2 PHE B 64 11.172 13.450 30.596 1.00 33.41 H new ATOM 0 HZ PHE B 64 12.050 14.327 32.722 1.00 14.04 H new ATOM 2947 N VAL B 65 9.221 8.733 31.855 1.00 75.05 N ATOM 2948 CA VAL B 65 7.871 9.276 31.915 1.00 40.30 C ATOM 2949 C VAL B 65 7.129 8.742 33.137 1.00 43.44 C ATOM 2950 O VAL B 65 6.512 9.503 33.881 1.00 35.52 O ATOM 2951 CB VAL B 65 7.068 8.939 30.635 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.594 9.290 30.809 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.655 9.659 29.419 1.00 51.21 C ATOM 0 H VAL B 65 9.441 8.258 30.980 1.00 75.05 H new ATOM 0 HA VAL B 65 7.961 10.360 31.992 1.00 40.30 H new ATOM 0 HB VAL B 65 7.143 7.865 30.464 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.051 9.044 29.896 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.180 8.721 31.642 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.496 10.356 31.013 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.074 9.407 28.532 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.620 10.736 29.582 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.690 9.347 29.276 1.00 51.21 H new ATOM 2963 N ALA B 66 7.203 7.434 33.347 1.00 30.22 N ATOM 2964 CA ALA B 66 6.579 6.808 34.505 1.00 74.13 C ATOM 2965 C ALA B 66 7.101 7.432 35.798 1.00 44.35 C ATOM 2966 O ALA B 66 6.368 7.572 36.778 1.00 34.23 O ATOM 2967 CB ALA B 66 6.835 5.306 34.492 1.00 23.44 C ATOM 0 H ALA B 66 7.690 6.785 32.729 1.00 30.22 H new ATOM 0 HA ALA B 66 5.503 6.977 34.456 1.00 74.13 H new ATOM 0 HB1 ALA B 66 6.364 4.849 35.362 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.416 4.873 33.583 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.909 5.120 34.521 1.00 23.44 H new ATOM 2973 N GLY B 67 8.362 7.853 35.760 1.00 23.35 N ATOM 2974 CA GLY B 67 9.014 8.411 36.933 1.00 73.24 C ATOM 2975 C GLY B 67 8.453 9.765 37.317 1.00 45.13 C ATOM 2976 O GLY B 67 8.412 10.119 38.498 1.00 75.04 O ATOM 0 H GLY B 67 8.950 7.817 34.927 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.900 7.723 37.771 1.00 73.24 H new ATOM 0 HA3 GLY B 67 10.083 8.505 36.741 1.00 73.24 H new ATOM 2980 N GLN B 68 8.004 10.525 36.322 1.00 2.12 N ATOM 2981 CA GLN B 68 7.439 11.849 36.563 1.00 44.13 C ATOM 2982 C GLN B 68 5.925 11.741 36.683 1.00 40.32 C ATOM 2983 O GLN B 68 5.261 12.613 37.245 1.00 64.50 O ATOM 2984 CB GLN B 68 7.829 12.821 35.439 1.00 33.05 C ATOM 2985 CG GLN B 68 7.468 12.337 34.041 1.00 52.44 C ATOM 2986 CD GLN B 68 7.615 13.422 32.991 1.00 54.32 C ATOM 2987 OE1 GLN B 68 8.656 13.555 32.351 1.00 53.51 O ATOM 2988 NE2 GLN B 68 6.579 14.230 32.831 1.00 53.21 N ATOM 0 H GLN B 68 8.021 10.246 35.341 1.00 2.12 H new ATOM 0 HA GLN B 68 7.842 12.243 37.496 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.341 13.779 35.617 1.00 33.05 H new ATOM 0 HB3 GLN B 68 8.904 12.998 35.484 1.00 33.05 H new ATOM 0 HG2 GLN B 68 8.105 11.493 33.777 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.440 11.973 34.041 1.00 52.44 H new ATOM 0 HE21 GLN B 68 5.732 14.088 33.381 1.00 53.21 H new ATOM 0 HE22 GLN B 68 6.628 14.995 32.158 1.00 53.21 H new ATOM 2997 N ASN B 69 5.398 10.641 36.160 1.00 21.43 N ATOM 2998 CA ASN B 69 3.973 10.342 36.228 1.00 41.54 C ATOM 2999 C ASN B 69 3.656 9.508 37.467 1.00 23.00 C ATOM 3000 O ASN B 69 2.504 9.147 37.703 1.00 34.41 O ATOM 3001 CB ASN B 69 3.524 9.635 34.942 1.00 65.13 C ATOM 3002 CG ASN B 69 3.246 10.617 33.809 1.00 21.52 C ATOM 3003 OD1 ASN B 69 2.115 11.062 33.613 1.00 65.21 O ATOM 3004 ND2 ASN B 69 4.280 10.978 33.064 1.00 45.52 N ATOM 0 H ASN B 69 5.947 9.930 35.676 1.00 21.43 H new ATOM 0 HA ASN B 69 3.417 11.276 36.313 1.00 41.54 H new ATOM 0 HB2 ASN B 69 4.295 8.931 34.629 1.00 65.13 H new ATOM 0 HB3 ASN B 69 2.625 9.053 35.145 1.00 65.13 H new ATOM 0 HD21 ASN B 69 4.152 11.643 32.302 1.00 45.52 H new ATOM 0 HD22 ASN B 69 5.205 10.591 33.253 1.00 45.52 H new ATOM 3011 N LYS B 70 4.701 9.206 38.245 1.00 4.22 N ATOM 3012 CA LYS B 70 4.564 8.519 39.534 1.00 71.04 C ATOM 3013 C LYS B 70 3.834 7.190 39.381 1.00 55.13 C ATOM 3014 O LYS B 70 3.257 6.661 40.336 1.00 71.33 O ATOM 3015 CB LYS B 70 3.860 9.427 40.561 1.00 43.15 C ATOM 3016 CG LYS B 70 4.800 10.415 41.254 1.00 61.50 C ATOM 3017 CD LYS B 70 5.735 11.101 40.263 1.00 21.25 C ATOM 3018 CE LYS B 70 6.580 12.190 40.918 1.00 20.34 C ATOM 3019 NZ LYS B 70 7.493 11.635 41.951 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.665 9.431 37.999 1.00 4.22 H new ATOM 0 HA LYS B 70 5.565 8.299 39.905 1.00 71.04 H new ATOM 0 HB2 LYS B 70 3.069 9.983 40.059 1.00 43.15 H new ATOM 0 HB3 LYS B 70 3.381 8.804 41.316 1.00 43.15 H new ATOM 0 HG2 LYS B 70 4.212 11.168 41.779 1.00 61.50 H new ATOM 0 HG3 LYS B 70 5.389 9.889 42.005 1.00 61.50 H new ATOM 0 HD2 LYS B 70 6.392 10.357 39.813 1.00 21.25 H new ATOM 0 HD3 LYS B 70 5.147 11.538 39.456 1.00 21.25 H new ATOM 0 HE2 LYS B 70 7.164 12.704 40.155 1.00 20.34 H new ATOM 0 HE3 LYS B 70 5.925 12.933 41.373 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 8.097 12.395 42.325 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 6.933 11.226 42.726 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 8.089 10.896 41.527 1.00 73.12 H new ATOM 3033 N GLN B 71 3.888 6.646 38.178 1.00 41.03 N ATOM 3034 CA GLN B 71 3.259 5.371 37.878 1.00 14.44 C ATOM 3035 C GLN B 71 4.328 4.315 37.627 1.00 73.31 C ATOM 3036 O GLN B 71 5.482 4.638 37.339 1.00 34.15 O ATOM 3037 CB GLN B 71 2.330 5.492 36.663 1.00 1.40 C ATOM 3038 CG GLN B 71 3.040 5.932 35.391 1.00 33.32 C ATOM 3039 CD GLN B 71 2.633 5.113 34.179 1.00 34.04 C ATOM 3040 OE1 GLN B 71 1.482 4.703 34.042 1.00 74.24 O ATOM 3041 NE2 GLN B 71 3.594 4.817 33.329 1.00 0.43 N ATOM 0 H GLN B 71 4.367 7.073 37.385 1.00 41.03 H new ATOM 0 HA GLN B 71 2.655 5.071 38.734 1.00 14.44 H new ATOM 0 HB2 GLN B 71 1.850 4.529 36.486 1.00 1.40 H new ATOM 0 HB3 GLN B 71 1.538 6.205 36.892 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.822 6.983 35.204 1.00 33.32 H new ATOM 0 HG3 GLN B 71 4.117 5.850 35.534 1.00 33.32 H new ATOM 0 HE21 GLN B 71 4.536 5.178 33.479 1.00 0.43 H new ATOM 0 HE22 GLN B 71 3.396 4.227 32.521 1.00 0.43 H new ATOM 3050 N THR B 72 3.939 3.059 37.736 1.00 1.35 N ATOM 3051 CA THR B 72 4.848 1.939 37.536 1.00 51.41 C ATOM 3052 C THR B 72 4.377 1.080 36.363 1.00 74.12 C ATOM 3053 O THR B 72 3.193 0.752 36.260 1.00 25.05 O ATOM 3054 CB THR B 72 4.961 1.081 38.822 1.00 13.02 C ATOM 3055 OG1 THR B 72 3.660 0.879 39.393 1.00 4.22 O ATOM 3056 CG2 THR B 72 5.872 1.746 39.853 1.00 71.50 C ATOM 0 H THR B 72 2.984 2.783 37.966 1.00 1.35 H new ATOM 0 HA THR B 72 5.836 2.337 37.307 1.00 51.41 H new ATOM 0 HB THR B 72 5.395 0.120 38.547 1.00 13.02 H new ATOM 0 HG1 THR B 72 3.740 0.335 40.204 1.00 4.22 H new ATOM 0 HG21 THR B 72 5.931 1.120 40.744 1.00 71.50 H new ATOM 0 HG22 THR B 72 6.869 1.871 39.431 1.00 71.50 H new ATOM 0 HG23 THR B 72 5.467 2.722 40.121 1.00 71.50 H new ATOM 3064 N LEU B 73 5.306 0.739 35.476 1.00 74.12 N ATOM 3065 CA LEU B 73 4.989 -0.035 34.279 1.00 52.35 C ATOM 3066 C LEU B 73 5.554 -1.457 34.383 1.00 64.24 C ATOM 3067 O LEU B 73 6.650 -1.651 34.913 1.00 14.14 O ATOM 3068 CB LEU B 73 5.500 0.681 33.014 1.00 75.15 C ATOM 3069 CG LEU B 73 6.613 1.703 33.254 1.00 62.34 C ATOM 3070 CD1 LEU B 73 7.922 1.024 33.661 1.00 33.12 C ATOM 3071 CD2 LEU B 73 6.809 2.582 32.026 1.00 51.14 C ATOM 0 H LEU B 73 6.291 0.988 35.564 1.00 74.12 H new ATOM 0 HA LEU B 73 3.905 -0.115 34.200 1.00 52.35 H new ATOM 0 HB2 LEU B 73 5.862 -0.069 32.311 1.00 75.15 H new ATOM 0 HB3 LEU B 73 4.660 1.186 32.537 1.00 75.15 H new ATOM 0 HG LEU B 73 6.307 2.340 34.084 1.00 62.34 H new ATOM 0 HD11 LEU B 73 8.689 1.781 33.823 1.00 33.12 H new ATOM 0 HD12 LEU B 73 7.769 0.460 34.581 1.00 33.12 H new ATOM 0 HD13 LEU B 73 8.242 0.347 32.869 1.00 33.12 H new ATOM 0 HD21 LEU B 73 7.605 3.302 32.217 1.00 51.14 H new ATOM 0 HD22 LEU B 73 7.080 1.960 31.173 1.00 51.14 H new ATOM 0 HD23 LEU B 73 5.883 3.114 31.808 1.00 51.14 H new ATOM 3083 N PRO B 74 4.796 -2.468 33.908 1.00 22.31 N ATOM 3084 CA PRO B 74 5.242 -3.872 33.906 1.00 33.15 C ATOM 3085 C PRO B 74 6.497 -4.072 33.056 1.00 51.21 C ATOM 3086 O PRO B 74 6.586 -3.551 31.946 1.00 62.01 O ATOM 3087 CB PRO B 74 4.055 -4.629 33.283 1.00 23.12 C ATOM 3088 CG PRO B 74 2.884 -3.722 33.454 1.00 12.13 C ATOM 3089 CD PRO B 74 3.437 -2.328 33.351 1.00 51.43 C ATOM 0 HA PRO B 74 5.506 -4.217 34.906 1.00 33.15 H new ATOM 0 HB2 PRO B 74 4.235 -4.847 32.230 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.890 -5.584 33.782 1.00 23.12 H new ATOM 0 HG2 PRO B 74 2.132 -3.903 32.686 1.00 12.13 H new ATOM 0 HG3 PRO B 74 2.401 -3.882 34.418 1.00 12.13 H new ATOM 0 HD2 PRO B 74 3.458 -1.977 32.319 1.00 51.43 H new ATOM 0 HD3 PRO B 74 2.840 -1.614 33.918 1.00 51.43 H new ATOM 3097 N ALA B 75 7.450 -4.846 33.565 1.00 24.41 N ATOM 3098 CA ALA B 75 8.705 -5.095 32.855 1.00 71.53 C ATOM 3099 C ALA B 75 8.510 -6.111 31.727 1.00 71.01 C ATOM 3100 O ALA B 75 9.339 -6.222 30.827 1.00 12.42 O ATOM 3101 CB ALA B 75 9.776 -5.576 33.828 1.00 50.55 C ATOM 0 H ALA B 75 7.379 -5.314 34.469 1.00 24.41 H new ATOM 0 HA ALA B 75 9.033 -4.157 32.407 1.00 71.53 H new ATOM 0 HB1 ALA B 75 10.704 -5.757 33.287 1.00 50.55 H new ATOM 0 HB2 ALA B 75 9.943 -4.815 34.590 1.00 50.55 H new ATOM 0 HB3 ALA B 75 9.447 -6.500 34.304 1.00 50.55 H new ATOM 3107 N ASP B 76 7.392 -6.830 31.772 1.00 24.20 N ATOM 3108 CA ASP B 76 7.082 -7.857 30.770 1.00 60.22 C ATOM 3109 C ASP B 76 6.509 -7.220 29.497 1.00 14.12 C ATOM 3110 O ASP B 76 6.079 -7.912 28.570 1.00 34.13 O ATOM 3111 CB ASP B 76 6.091 -8.877 31.362 1.00 21.51 C ATOM 3112 CG ASP B 76 5.771 -10.030 30.417 1.00 33.51 C ATOM 3113 OD1 ASP B 76 6.718 -10.656 29.890 1.00 23.44 O ATOM 3114 OD2 ASP B 76 4.572 -10.334 30.223 1.00 41.11 O1- ATOM 0 H ASP B 76 6.679 -6.723 32.494 1.00 24.20 H new ATOM 0 HA ASP B 76 8.002 -8.374 30.499 1.00 60.22 H new ATOM 0 HB2 ASP B 76 6.504 -9.279 32.287 1.00 21.51 H new ATOM 0 HB3 ASP B 76 5.166 -8.364 31.623 1.00 21.51 H new ATOM 3119 N THR B 77 6.520 -5.892 29.456 1.00 44.41 N ATOM 3120 CA THR B 77 6.040 -5.150 28.299 1.00 1.21 C ATOM 3121 C THR B 77 7.062 -5.200 27.162 1.00 31.44 C ATOM 3122 O THR B 77 8.219 -5.587 27.370 1.00 72.52 O ATOM 3123 CB THR B 77 5.746 -3.678 28.674 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.151 -2.990 27.567 1.00 73.25 O ATOM 3125 CG2 THR B 77 7.018 -2.947 29.101 1.00 30.02 C ATOM 0 H THR B 77 6.859 -5.305 30.218 1.00 44.41 H new ATOM 0 HA THR B 77 5.115 -5.618 27.963 1.00 1.21 H new ATOM 0 HB THR B 77 5.052 -3.686 29.515 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.599 -3.615 27.052 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.776 -1.916 29.358 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.450 -3.445 29.969 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.737 -2.958 28.281 1.00 30.02 H new ATOM 3133 N THR B 78 6.637 -4.810 25.966 1.00 70.31 N ATOM 3134 CA THR B 78 7.516 -4.807 24.812 1.00 64.53 C ATOM 3135 C THR B 78 7.016 -3.866 23.723 1.00 71.23 C ATOM 3136 O THR B 78 5.832 -3.520 23.664 1.00 64.44 O ATOM 3137 CB THR B 78 7.698 -6.210 24.241 1.00 53.44 C ATOM 3138 OG1 THR B 78 8.672 -6.228 23.188 1.00 34.22 O ATOM 3139 CG2 THR B 78 6.390 -6.653 23.730 1.00 23.30 C ATOM 0 H THR B 78 5.687 -4.492 25.774 1.00 70.31 H new ATOM 0 HA THR B 78 8.484 -4.446 25.161 1.00 64.53 H new ATOM 0 HB THR B 78 8.061 -6.879 25.021 1.00 53.44 H new ATOM 0 HG1 THR B 78 9.295 -5.481 23.306 1.00 34.22 H new ATOM 0 HG21 THR B 78 6.483 -7.656 23.313 1.00 23.30 H new ATOM 0 HG22 THR B 78 5.666 -6.665 24.545 1.00 23.30 H new ATOM 0 HG23 THR B 78 6.051 -5.967 22.954 1.00 23.30 H new ATOM 3147 N VAL B 79 7.942 -3.462 22.872 1.00 22.45 N ATOM 3148 CA VAL B 79 7.648 -2.630 21.713 1.00 23.02 C ATOM 3149 C VAL B 79 8.334 -3.216 20.495 1.00 31.21 C ATOM 3150 O VAL B 79 9.559 -3.311 20.442 1.00 14.34 O ATOM 3151 CB VAL B 79 8.108 -1.158 21.898 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.967 -0.372 20.589 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.313 -0.484 23.006 1.00 54.24 C ATOM 0 H VAL B 79 8.929 -3.703 22.964 1.00 22.45 H new ATOM 0 HA VAL B 79 6.565 -2.619 21.586 1.00 23.02 H new ATOM 0 HB VAL B 79 9.161 -1.167 22.181 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.295 0.656 20.745 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.581 -0.836 19.818 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.924 -0.376 20.273 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.650 0.546 23.120 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.253 -0.493 22.751 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.465 -1.022 23.942 1.00 54.24 H new ATOM 3163 N THR B 80 7.544 -3.621 19.526 1.00 72.42 N ATOM 3164 CA THR B 80 8.079 -4.226 18.321 1.00 23.21 C ATOM 3165 C THR B 80 8.171 -3.187 17.211 1.00 63.22 C ATOM 3166 O THR B 80 7.153 -2.745 16.673 1.00 42.43 O ATOM 3167 CB THR B 80 7.215 -5.420 17.861 1.00 22.40 C ATOM 3168 OG1 THR B 80 6.943 -6.276 18.981 1.00 71.34 O ATOM 3169 CG2 THR B 80 7.935 -6.218 16.778 1.00 64.25 C ATOM 0 H THR B 80 6.527 -3.543 19.546 1.00 72.42 H new ATOM 0 HA THR B 80 9.077 -4.601 18.546 1.00 23.21 H new ATOM 0 HB THR B 80 6.280 -5.036 17.452 1.00 22.40 H new ATOM 0 HG1 THR B 80 6.393 -7.033 18.689 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.310 -7.055 16.467 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.131 -5.574 15.921 1.00 64.25 H new ATOM 0 HG23 THR B 80 8.879 -6.596 17.171 1.00 64.25 H new ATOM 3177 N ALA B 81 9.393 -2.789 16.887 1.00 41.34 N ATOM 3178 CA ALA B 81 9.630 -1.825 15.826 1.00 73.43 C ATOM 3179 C ALA B 81 9.885 -2.560 14.519 1.00 13.31 C ATOM 3180 O ALA B 81 10.948 -3.145 14.313 1.00 32.14 O ATOM 3181 CB ALA B 81 10.810 -0.923 16.178 1.00 31.52 C ATOM 0 H ALA B 81 10.240 -3.122 17.348 1.00 41.34 H new ATOM 0 HA ALA B 81 8.748 -1.195 15.711 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.974 -0.207 15.373 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.595 -0.387 17.102 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.705 -1.530 16.311 1.00 31.52 H new ATOM 3187 N GLU B 82 8.881 -2.547 13.659 1.00 50.12 N ATOM 3188 CA GLU B 82 8.935 -3.233 12.381 1.00 53.10 C ATOM 3189 C GLU B 82 9.063 -2.205 11.263 1.00 51.21 C ATOM 3190 O GLU B 82 8.113 -1.481 10.960 1.00 13.21 O ATOM 3191 CB GLU B 82 7.663 -4.077 12.210 1.00 51.24 C ATOM 3192 CG GLU B 82 7.622 -4.900 10.932 1.00 31.41 C ATOM 3193 CD GLU B 82 6.359 -5.739 10.830 1.00 63.34 C ATOM 3194 OE1 GLU B 82 5.336 -5.230 10.331 1.00 35.34 O ATOM 3195 OE2 GLU B 82 6.378 -6.905 11.271 1.00 71.23 O1- ATOM 0 H GLU B 82 8.002 -2.058 13.829 1.00 50.12 H new ATOM 0 HA GLU B 82 9.800 -3.895 12.342 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.570 -4.749 13.063 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.797 -3.415 12.229 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.685 -4.234 10.071 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.494 -5.553 10.894 1.00 31.41 H new ATOM 3202 N VAL B 83 10.241 -2.130 10.660 1.00 40.31 N ATOM 3203 CA VAL B 83 10.516 -1.124 9.637 1.00 71.44 C ATOM 3204 C VAL B 83 10.555 -1.753 8.255 1.00 35.11 C ATOM 3205 O VAL B 83 10.969 -2.899 8.094 1.00 1.44 O ATOM 3206 CB VAL B 83 11.846 -0.375 9.900 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.731 0.506 11.142 1.00 71.22 C ATOM 3208 CG2 VAL B 83 13.007 -1.360 10.037 1.00 51.35 C ATOM 0 H VAL B 83 11.024 -2.753 10.860 1.00 40.31 H new ATOM 0 HA VAL B 83 9.702 -0.400 9.684 1.00 71.44 H new ATOM 0 HB VAL B 83 12.050 0.268 9.044 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.676 1.024 11.310 1.00 71.22 H new ATOM 0 HG12 VAL B 83 10.937 1.238 10.996 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.498 -0.114 12.008 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.930 -0.811 10.221 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.814 -2.036 10.870 1.00 51.35 H new ATOM 0 HG23 VAL B 83 13.105 -1.937 9.117 1.00 51.35 H new ATOM 3218 N GLY B 84 10.104 -0.998 7.268 1.00 51.11 N ATOM 3219 CA GLY B 84 10.110 -1.459 5.899 1.00 52.45 C ATOM 3220 C GLY B 84 10.600 -0.390 4.955 1.00 30.33 C ATOM 3221 O GLY B 84 10.578 0.795 5.285 1.00 4.21 O ATOM 0 H GLY B 84 9.728 -0.058 7.395 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.746 -2.340 5.814 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.103 -1.764 5.613 1.00 52.45 H new ATOM 3225 N ILE B 85 11.037 -0.811 3.783 1.00 72.33 N ATOM 3226 CA ILE B 85 11.547 0.086 2.764 1.00 70.35 C ATOM 3227 C ILE B 85 10.984 -0.321 1.411 1.00 24.30 C ATOM 3228 O ILE B 85 10.970 -1.510 1.059 1.00 65.43 O ATOM 3229 CB ILE B 85 13.107 0.088 2.745 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.674 1.016 1.642 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.643 -1.334 2.583 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.812 0.365 0.278 1.00 22.31 C ATOM 0 H ILE B 85 11.048 -1.794 3.509 1.00 72.33 H new ATOM 0 HA ILE B 85 11.227 1.103 2.993 1.00 70.35 H new ATOM 0 HB ILE B 85 13.444 0.484 3.703 1.00 43.15 H new ATOM 0 HG12 ILE B 85 13.026 1.887 1.550 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.652 1.378 1.958 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.733 -1.313 2.572 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.300 -1.949 3.415 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.279 -1.756 1.646 1.00 2.22 H new ATOM 0 HD11 ILE B 85 14.216 1.088 -0.431 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.485 -0.489 0.349 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.834 0.028 -0.065 1.00 22.31 H new ATOM 3244 N GLY B 86 10.497 0.676 0.682 1.00 43.24 N ATOM 3245 CA GLY B 86 9.944 0.475 -0.644 1.00 50.02 C ATOM 3246 C GLY B 86 10.234 1.668 -1.533 1.00 52.30 C ATOM 3247 O GLY B 86 10.706 2.696 -1.044 1.00 42.02 O ATOM 0 H GLY B 86 10.476 1.646 0.997 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.368 -0.426 -1.087 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.867 0.320 -0.575 1.00 50.02 H new ATOM 3251 N PRO B 87 9.976 1.567 -2.845 1.00 42.21 N ATOM 3252 CA PRO B 87 10.278 2.638 -3.787 1.00 30.25 C ATOM 3253 C PRO B 87 9.190 3.712 -3.816 1.00 61.30 C ATOM 3254 O PRO B 87 8.018 3.444 -3.526 1.00 52.32 O ATOM 3255 CB PRO B 87 10.350 1.896 -5.123 1.00 44.10 C ATOM 3256 CG PRO B 87 9.364 0.781 -4.982 1.00 14.42 C ATOM 3257 CD PRO B 87 9.336 0.416 -3.514 1.00 45.13 C ATOM 0 HA PRO B 87 11.189 3.179 -3.530 1.00 30.25 H new ATOM 0 HB2 PRO B 87 10.093 2.551 -5.956 1.00 44.10 H new ATOM 0 HB3 PRO B 87 11.354 1.517 -5.314 1.00 44.10 H new ATOM 0 HG2 PRO B 87 8.376 1.091 -5.324 1.00 14.42 H new ATOM 0 HG3 PRO B 87 9.657 -0.075 -5.589 1.00 14.42 H new ATOM 0 HD2 PRO B 87 8.316 0.266 -3.160 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.880 -0.509 -3.323 1.00 45.13 H new ATOM 3265 N ASN B 88 9.594 4.928 -4.149 1.00 53.24 N ATOM 3266 CA ASN B 88 8.668 6.039 -4.331 1.00 21.43 C ATOM 3267 C ASN B 88 8.557 6.351 -5.817 1.00 21.10 C ATOM 3268 O ASN B 88 9.510 6.121 -6.568 1.00 51.23 O ATOM 3269 CB ASN B 88 9.156 7.278 -3.570 1.00 72.30 C ATOM 3270 CG ASN B 88 8.151 8.419 -3.606 1.00 63.22 C ATOM 3271 OD1 ASN B 88 8.151 9.228 -4.530 1.00 5.32 O ATOM 3272 ND2 ASN B 88 7.296 8.491 -2.596 1.00 3.11 N ATOM 0 H ASN B 88 10.572 5.174 -4.301 1.00 53.24 H new ATOM 0 HA ASN B 88 7.691 5.761 -3.937 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.356 7.008 -2.533 1.00 72.30 H new ATOM 0 HB3 ASN B 88 10.099 7.616 -3.999 1.00 72.30 H new ATOM 0 HD21 ASN B 88 6.604 9.239 -2.566 1.00 3.11 H new ATOM 0 HD22 ASN B 88 7.330 7.798 -1.848 1.00 3.11 H new ATOM 3279 N GLU B 89 7.412 6.881 -6.237 1.00 65.22 N ATOM 3280 CA GLU B 89 7.174 7.185 -7.648 1.00 51.32 C ATOM 3281 C GLU B 89 8.225 8.156 -8.189 1.00 22.42 C ATOM 3282 O GLU B 89 8.509 8.168 -9.389 1.00 11.02 O ATOM 3283 CB GLU B 89 5.766 7.766 -7.845 1.00 62.31 C ATOM 3284 CG GLU B 89 5.523 9.061 -7.078 1.00 11.15 C ATOM 3285 CD GLU B 89 4.147 9.647 -7.344 1.00 24.23 C ATOM 3286 OE1 GLU B 89 3.194 9.286 -6.625 1.00 4.32 O ATOM 3287 OE2 GLU B 89 4.015 10.464 -8.280 1.00 35.35 O1- ATOM 0 H GLU B 89 6.632 7.110 -5.621 1.00 65.22 H new ATOM 0 HA GLU B 89 7.252 6.252 -8.207 1.00 51.32 H new ATOM 0 HB2 GLU B 89 5.603 7.948 -8.907 1.00 62.31 H new ATOM 0 HB3 GLU B 89 5.030 7.025 -7.532 1.00 62.31 H new ATOM 0 HG2 GLU B 89 5.634 8.873 -6.010 1.00 11.15 H new ATOM 0 HG3 GLU B 89 6.284 9.791 -7.354 1.00 11.15 H new ATOM 3294 N GLU B 90 8.806 8.952 -7.294 1.00 52.12 N ATOM 3295 CA GLU B 90 9.830 9.928 -7.666 1.00 15.12 C ATOM 3296 C GLU B 90 11.110 9.226 -8.131 1.00 74.05 C ATOM 3297 O GLU B 90 11.881 9.766 -8.930 1.00 53.12 O ATOM 3298 CB GLU B 90 10.135 10.844 -6.472 1.00 14.23 C ATOM 3299 CG GLU B 90 11.283 11.817 -6.715 1.00 30.33 C ATOM 3300 CD GLU B 90 11.575 12.699 -5.512 1.00 5.15 C ATOM 3301 OE1 GLU B 90 11.037 13.828 -5.452 1.00 54.43 O ATOM 3302 OE2 GLU B 90 12.343 12.274 -4.630 1.00 12.50 O1- ATOM 0 H GLU B 90 8.583 8.940 -6.299 1.00 52.12 H new ATOM 0 HA GLU B 90 9.451 10.528 -8.493 1.00 15.12 H new ATOM 0 HB2 GLU B 90 9.238 11.411 -6.224 1.00 14.23 H new ATOM 0 HB3 GLU B 90 10.372 10.227 -5.605 1.00 14.23 H new ATOM 0 HG2 GLU B 90 12.180 11.255 -6.974 1.00 30.33 H new ATOM 0 HG3 GLU B 90 11.044 12.447 -7.572 1.00 30.33 H new ATOM 3309 N GLY B 91 11.318 8.015 -7.638 1.00 72.20 N ATOM 3310 CA GLY B 91 12.529 7.273 -7.945 1.00 12.11 C ATOM 3311 C GLY B 91 13.497 7.275 -6.782 1.00 71.02 C ATOM 3312 O GLY B 91 14.715 7.311 -6.968 1.00 5.53 O ATOM 0 H GLY B 91 10.665 7.527 -7.025 1.00 72.20 H new ATOM 0 HA2 GLY B 91 12.271 6.246 -8.202 1.00 12.11 H new ATOM 0 HA3 GLY B 91 13.011 7.709 -8.820 1.00 12.11 H new ATOM 3316 N GLY B 92 12.945 7.241 -5.574 1.00 60.34 N ATOM 3317 CA GLY B 92 13.751 7.199 -4.369 1.00 61.32 C ATOM 3318 C GLY B 92 13.231 6.154 -3.410 1.00 12.52 C ATOM 3319 O GLY B 92 12.302 5.414 -3.744 1.00 70.13 O ATOM 0 H GLY B 92 11.939 7.242 -5.408 1.00 60.34 H new ATOM 0 HA2 GLY B 92 14.787 6.979 -4.627 1.00 61.32 H new ATOM 0 HA3 GLY B 92 13.744 8.177 -3.887 1.00 61.32 H new ATOM 3323 N PHE B 93 13.813 6.086 -2.223 1.00 71.13 N ATOM 3324 CA PHE B 93 13.385 5.120 -1.218 1.00 4.00 C ATOM 3325 C PHE B 93 12.442 5.774 -0.219 1.00 73.12 C ATOM 3326 O PHE B 93 12.534 6.975 0.049 1.00 63.14 O ATOM 3327 CB PHE B 93 14.595 4.515 -0.496 1.00 42.41 C ATOM 3328 CG PHE B 93 15.500 3.720 -1.405 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.838 4.058 -1.555 1.00 72.40 C ATOM 3330 CD2 PHE B 93 15.006 2.634 -2.114 1.00 72.15 C ATOM 3331 CE1 PHE B 93 17.662 3.328 -2.392 1.00 54.33 C ATOM 3332 CE2 PHE B 93 15.825 1.902 -2.952 1.00 20.53 C ATOM 3333 CZ PHE B 93 17.155 2.248 -3.090 1.00 20.53 C ATOM 0 H PHE B 93 14.583 6.687 -1.930 1.00 71.13 H new ATOM 0 HA PHE B 93 12.851 4.315 -1.723 1.00 4.00 H new ATOM 0 HB2 PHE B 93 15.171 5.317 -0.033 1.00 42.41 H new ATOM 0 HB3 PHE B 93 14.243 3.870 0.309 1.00 42.41 H new ATOM 0 HD1 PHE B 93 17.240 4.901 -1.012 1.00 72.40 H new ATOM 0 HD2 PHE B 93 13.967 2.357 -2.009 1.00 72.15 H new ATOM 0 HE1 PHE B 93 18.701 3.602 -2.500 1.00 54.33 H new ATOM 0 HE2 PHE B 93 15.426 1.060 -3.498 1.00 20.53 H new ATOM 0 HZ PHE B 93 17.798 1.676 -3.742 1.00 20.53 H new ATOM 3343 N ALA B 94 11.532 4.976 0.321 1.00 22.42 N ATOM 3344 CA ALA B 94 10.549 5.448 1.282 1.00 62.21 C ATOM 3345 C ALA B 94 10.434 4.445 2.427 1.00 42.21 C ATOM 3346 O ALA B 94 10.390 3.233 2.193 1.00 61.15 O ATOM 3347 CB ALA B 94 9.205 5.663 0.593 1.00 43.22 C ATOM 0 H ALA B 94 11.455 3.982 0.104 1.00 22.42 H new ATOM 0 HA ALA B 94 10.868 6.405 1.695 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.475 6.017 1.321 1.00 43.22 H new ATOM 0 HB2 ALA B 94 9.316 6.404 -0.198 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.862 4.722 0.163 1.00 43.22 H new ATOM 3353 N LEU B 95 10.421 4.952 3.656 1.00 51.40 N ATOM 3354 CA LEU B 95 10.429 4.108 4.846 1.00 52.52 C ATOM 3355 C LEU B 95 9.039 4.008 5.462 1.00 31.45 C ATOM 3356 O LEU B 95 8.318 5.002 5.574 1.00 74.21 O ATOM 3357 CB LEU B 95 11.438 4.645 5.882 1.00 5.44 C ATOM 3358 CG LEU B 95 12.909 4.243 5.650 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.104 2.742 5.866 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.373 4.644 4.251 1.00 13.14 C ATOM 0 H LEU B 95 10.405 5.952 3.854 1.00 51.40 H new ATOM 0 HA LEU B 95 10.736 3.107 4.543 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.375 5.733 5.894 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.137 4.297 6.870 1.00 5.44 H new ATOM 0 HG LEU B 95 13.518 4.778 6.378 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.149 2.483 5.697 1.00 3.52 H new ATOM 0 HD12 LEU B 95 12.827 2.482 6.888 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.475 2.189 5.168 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.413 4.349 4.114 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.753 4.146 3.505 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.284 5.724 4.134 1.00 13.14 H new ATOM 3372 N ASP B 96 8.689 2.793 5.857 1.00 51.23 N ATOM 3373 CA ASP B 96 7.414 2.499 6.505 1.00 11.24 C ATOM 3374 C ASP B 96 7.687 1.903 7.878 1.00 14.30 C ATOM 3375 O ASP B 96 8.187 0.779 7.987 1.00 55.22 O ATOM 3376 CB ASP B 96 6.624 1.500 5.659 1.00 22.11 C ATOM 3377 CG ASP B 96 5.236 1.193 6.207 1.00 4.43 C ATOM 3378 OD1 ASP B 96 4.273 1.893 5.830 1.00 73.12 O ATOM 3379 OD2 ASP B 96 5.096 0.225 6.987 1.00 73.53 O1- ATOM 0 H ASP B 96 9.285 1.974 5.737 1.00 51.23 H new ATOM 0 HA ASP B 96 6.832 3.415 6.608 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.526 1.893 4.647 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.190 0.571 5.587 1.00 22.11 H new ATOM 3384 N VAL B 97 7.379 2.652 8.918 1.00 43.21 N ATOM 3385 CA VAL B 97 7.671 2.229 10.283 1.00 65.34 C ATOM 3386 C VAL B 97 6.397 1.781 10.994 1.00 4.12 C ATOM 3387 O VAL B 97 5.392 2.489 10.993 1.00 1.23 O ATOM 3388 CB VAL B 97 8.346 3.360 11.100 1.00 44.15 C ATOM 3389 CG1 VAL B 97 8.696 2.879 12.512 1.00 31.14 C ATOM 3390 CG2 VAL B 97 9.592 3.883 10.378 1.00 13.32 C ATOM 0 H VAL B 97 6.924 3.562 8.848 1.00 43.21 H new ATOM 0 HA VAL B 97 8.364 1.390 10.217 1.00 65.34 H new ATOM 0 HB VAL B 97 7.636 4.182 11.190 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.169 3.690 13.066 1.00 31.14 H new ATOM 0 HG12 VAL B 97 7.786 2.570 13.027 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.382 2.035 12.449 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.049 4.676 10.970 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.306 3.069 10.248 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.309 4.276 9.402 1.00 13.32 H new ATOM 3400 N GLU B 98 6.457 0.602 11.595 1.00 55.41 N ATOM 3401 CA GLU B 98 5.333 0.027 12.327 1.00 61.25 C ATOM 3402 C GLU B 98 5.737 -0.195 13.788 1.00 55.42 C ATOM 3403 O GLU B 98 6.500 -1.114 14.089 1.00 74.01 O ATOM 3404 CB GLU B 98 4.934 -1.314 11.681 1.00 43.20 C ATOM 3405 CG GLU B 98 3.675 -1.962 12.258 1.00 33.43 C ATOM 3406 CD GLU B 98 2.422 -1.652 11.449 1.00 35.25 C ATOM 3407 OE1 GLU B 98 1.795 -0.601 11.680 1.00 70.42 O ATOM 3408 OE2 GLU B 98 2.061 -2.469 10.572 1.00 74.42 O1- ATOM 0 H GLU B 98 7.290 0.013 11.590 1.00 55.41 H new ATOM 0 HA GLU B 98 4.483 0.708 12.291 1.00 61.25 H new ATOM 0 HB2 GLU B 98 4.785 -1.155 10.613 1.00 43.20 H new ATOM 0 HB3 GLU B 98 5.764 -2.012 11.787 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.816 -3.042 12.300 1.00 33.43 H new ATOM 0 HG3 GLU B 98 3.533 -1.619 13.283 1.00 33.43 H new ATOM 3415 N LEU B 99 5.256 0.658 14.688 1.00 61.12 N ATOM 3416 CA LEU B 99 5.581 0.539 16.109 1.00 54.24 C ATOM 3417 C LEU B 99 4.444 -0.149 16.857 1.00 51.12 C ATOM 3418 O LEU B 99 3.396 0.455 17.100 1.00 12.44 O ATOM 3419 CB LEU B 99 5.857 1.920 16.726 1.00 60.12 C ATOM 3420 CG LEU B 99 7.084 2.666 16.172 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.262 4.012 16.876 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.344 1.813 16.311 1.00 1.13 C ATOM 0 H LEU B 99 4.640 1.439 14.460 1.00 61.12 H new ATOM 0 HA LEU B 99 6.483 -0.066 16.200 1.00 54.24 H new ATOM 0 HB2 LEU B 99 4.977 2.546 16.578 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.984 1.798 17.802 1.00 60.12 H new ATOM 0 HG LEU B 99 6.917 2.856 15.112 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.135 4.523 16.469 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.375 4.626 16.717 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.403 3.848 17.944 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.199 2.360 15.913 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.516 1.586 17.363 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.217 0.884 15.756 1.00 1.13 H new ATOM 3434 N ARG B 100 4.670 -1.402 17.241 1.00 53.41 N ATOM 3435 CA ARG B 100 3.657 -2.207 17.918 1.00 2.45 C ATOM 3436 C ARG B 100 3.897 -2.201 19.420 1.00 14.01 C ATOM 3437 O ARG B 100 4.916 -2.700 19.899 1.00 24.14 O ATOM 3438 CB ARG B 100 3.674 -3.650 17.388 1.00 53.52 C ATOM 3439 CG ARG B 100 3.055 -3.816 16.002 1.00 13.43 C ATOM 3440 CD ARG B 100 3.219 -5.235 15.471 1.00 64.11 C ATOM 3441 NE ARG B 100 2.367 -5.495 14.302 1.00 3.43 N ATOM 3442 CZ ARG B 100 2.824 -5.859 13.097 1.00 52.33 C ATOM 3443 NH1 ARG B 100 4.132 -5.949 12.876 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 1.971 -6.126 12.114 1.00 11.32 N ATOM 0 H ARG B 100 5.555 -1.886 17.093 1.00 53.41 H new ATOM 0 HA ARG B 100 2.678 -1.772 17.715 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.705 -4.002 17.357 1.00 53.52 H new ATOM 0 HB3 ARG B 100 3.140 -4.289 18.091 1.00 53.52 H new ATOM 0 HG2 ARG B 100 1.995 -3.565 16.046 1.00 13.43 H new ATOM 0 HG3 ARG B 100 3.520 -3.114 15.310 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.262 -5.402 15.202 1.00 64.11 H new ATOM 0 HD3 ARG B 100 2.976 -5.946 16.260 1.00 64.11 H new ATOM 0 HE ARG B 100 1.359 -5.391 14.416 1.00 3.43 H new ATOM 0 HH11 ARG B 100 4.791 -5.740 13.626 1.00 41.53 H new ATOM 0 HH12 ARG B 100 4.476 -6.227 11.957 1.00 41.53 H new ATOM 0 HH21 ARG B 100 0.967 -6.054 12.277 1.00 11.32 H new ATOM 0 HH22 ARG B 100 2.321 -6.403 11.197 1.00 11.32 H new ATOM 3458 N VAL B 101 2.952 -1.629 20.157 1.00 41.00 N ATOM 3459 CA VAL B 101 3.074 -1.484 21.601 1.00 50.20 C ATOM 3460 C VAL B 101 2.306 -2.581 22.325 1.00 3.30 C ATOM 3461 O VAL B 101 1.080 -2.627 22.263 1.00 1.54 O ATOM 3462 CB VAL B 101 2.535 -0.113 22.070 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.538 -0.022 23.596 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.341 1.029 21.452 1.00 51.31 C ATOM 0 H VAL B 101 2.085 -1.255 19.772 1.00 41.00 H new ATOM 0 HA VAL B 101 4.134 -1.559 21.842 1.00 50.20 H new ATOM 0 HB VAL B 101 1.504 -0.019 21.729 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.155 0.951 23.903 1.00 22.35 H new ATOM 0 HG12 VAL B 101 1.905 -0.808 24.009 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.556 -0.144 23.966 1.00 22.35 H new ATOM 0 HG21 VAL B 101 2.943 1.983 21.797 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.385 0.941 21.752 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.270 0.978 20.365 1.00 51.31 H new ATOM 3474 N ALA B 102 3.028 -3.457 23.010 1.00 24.03 N ATOM 3475 CA ALA B 102 2.407 -4.505 23.808 1.00 53.32 C ATOM 3476 C ALA B 102 2.632 -4.233 25.292 1.00 44.40 C ATOM 3477 O ALA B 102 3.721 -4.472 25.817 1.00 4.42 O ATOM 3478 CB ALA B 102 2.971 -5.868 23.419 1.00 42.24 C ATOM 0 H ALA B 102 4.048 -3.462 23.029 1.00 24.03 H new ATOM 0 HA ALA B 102 1.334 -4.510 23.615 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.499 -6.643 24.023 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.771 -6.057 22.364 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.047 -5.879 23.592 1.00 42.24 H new ATOM 3484 N LEU B 103 1.604 -3.712 25.958 1.00 61.44 N ATOM 3485 CA LEU B 103 1.669 -3.434 27.390 1.00 72.24 C ATOM 3486 C LEU B 103 0.698 -4.360 28.125 1.00 41.41 C ATOM 3487 O LEU B 103 -0.514 -4.291 27.913 1.00 40.11 O ATOM 3488 CB LEU B 103 1.337 -1.958 27.680 1.00 55.34 C ATOM 3489 CG LEU B 103 1.570 -1.498 29.135 1.00 34.43 C ATOM 3490 CD1 LEU B 103 3.045 -1.600 29.512 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.074 -0.070 29.346 1.00 1.40 C ATOM 0 H LEU B 103 0.712 -3.473 25.526 1.00 61.44 H new ATOM 0 HA LEU B 103 2.683 -3.618 27.744 1.00 72.24 H new ATOM 0 HB2 LEU B 103 1.937 -1.332 27.019 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.292 -1.782 27.425 1.00 55.34 H new ATOM 0 HG LEU B 103 0.999 -2.162 29.784 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.181 -1.270 30.542 1.00 40.33 H new ATOM 0 HD12 LEU B 103 3.374 -2.635 29.416 1.00 40.33 H new ATOM 0 HD13 LEU B 103 3.635 -0.968 28.848 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.251 0.228 30.380 1.00 1.40 H new ATOM 0 HD22 LEU B 103 1.610 0.604 28.678 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.006 -0.020 29.132 1.00 1.40 H new ATOM 3503 N PRO B 104 1.221 -5.248 28.986 1.00 3.11 N ATOM 3504 CA PRO B 104 0.409 -6.248 29.674 1.00 24.44 C ATOM 3505 C PRO B 104 -0.526 -5.622 30.703 1.00 5.10 C ATOM 3506 O PRO B 104 -0.196 -4.610 31.329 1.00 15.44 O ATOM 3507 CB PRO B 104 1.442 -7.157 30.346 1.00 10.11 C ATOM 3508 CG PRO B 104 2.662 -6.316 30.501 1.00 31.23 C ATOM 3509 CD PRO B 104 2.639 -5.328 29.366 1.00 74.24 C ATOM 0 HA PRO B 104 -0.249 -6.783 28.989 1.00 24.44 H new ATOM 0 HB2 PRO B 104 1.084 -7.513 31.312 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.646 -8.038 29.738 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.662 -5.804 31.463 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.563 -6.928 30.466 1.00 31.23 H new ATOM 0 HD2 PRO B 104 3.024 -4.356 29.676 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.256 -5.664 28.533 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.689 -6.235 30.869 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.690 -5.715 31.780 1.00 21.00 C ATOM 3519 C GLY B 105 -3.386 -4.487 31.222 1.00 53.31 C ATOM 3520 O GLY B 105 -4.063 -3.758 31.954 1.00 21.33 O ATOM 0 H GLY B 105 -1.959 -7.091 30.385 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.430 -6.489 31.985 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.219 -5.464 32.731 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.223 -4.264 29.921 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.782 -3.096 29.244 1.00 45.21 C ATOM 3526 C LEU B 106 -4.553 -3.516 27.989 1.00 60.53 C ATOM 3527 O LEU B 106 -4.169 -4.465 27.304 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.651 -2.116 28.878 1.00 22.13 C ATOM 3529 CG LEU B 106 -3.043 -0.963 27.937 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -4.098 -0.066 28.576 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.818 -0.150 27.539 1.00 55.01 C ATOM 0 H LEU B 106 -2.700 -4.887 29.306 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.479 -2.599 29.919 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -2.253 -1.689 29.799 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.843 -2.681 28.413 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.473 -1.400 27.036 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -4.355 0.740 27.888 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.989 -0.653 28.797 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.704 0.358 29.500 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -2.119 0.659 26.874 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -1.353 0.268 28.432 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -1.104 -0.795 27.026 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.652 -2.811 27.708 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.458 -3.068 26.512 1.00 50.41 C ATOM 3545 C ASP B 107 -5.858 -2.373 25.309 1.00 24.13 C ATOM 3546 O ASP B 107 -5.055 -1.461 25.454 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.879 -2.523 26.666 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.910 -3.353 25.914 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -9.521 -4.255 26.523 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.109 -3.104 24.708 1.00 14.11 O1- ATOM 0 H ASP B 107 -6.005 -2.055 28.295 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.477 -4.150 26.379 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -8.141 -2.496 27.724 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -7.911 -1.495 26.304 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.305 -2.775 24.137 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.014 -2.057 22.912 1.00 21.33 C ATOM 3557 C ALA B 108 -6.736 -0.716 22.914 1.00 4.44 C ATOM 3558 O ALA B 108 -6.148 0.317 22.606 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.454 -2.888 21.723 1.00 34.32 C ATOM 0 H ALA B 108 -6.880 -3.608 24.006 1.00 12.24 H new ATOM 0 HA ALA B 108 -4.941 -1.876 22.843 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.236 -2.349 20.801 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -5.918 -3.837 21.724 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.526 -3.077 21.788 1.00 34.32 H new ATOM 3565 N ALA B 109 -8.011 -0.747 23.296 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.858 0.444 23.296 1.00 64.51 C ATOM 3567 C ALA B 109 -8.261 1.534 24.182 1.00 34.40 C ATOM 3568 O ALA B 109 -8.153 2.694 23.775 1.00 22.24 O ATOM 3569 CB ALA B 109 -10.271 0.090 23.753 1.00 34.53 C ATOM 0 H ALA B 109 -8.484 -1.593 23.613 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.910 0.829 22.278 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.890 0.987 23.748 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.698 -0.650 23.076 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -10.235 -0.320 24.762 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.862 1.151 25.389 1.00 13.42 N ATOM 3576 CA ALA B 110 -7.224 2.080 26.313 1.00 72.03 C ATOM 3577 C ALA B 110 -5.824 2.431 25.815 1.00 4.25 C ATOM 3578 O ALA B 110 -5.411 3.597 25.839 1.00 22.41 O ATOM 3579 CB ALA B 110 -7.173 1.485 27.717 1.00 4.12 C ATOM 0 H ALA B 110 -7.969 0.203 25.751 1.00 13.42 H new ATOM 0 HA ALA B 110 -7.813 2.996 26.359 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -6.694 2.192 28.394 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -8.186 1.281 28.063 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.603 0.556 27.698 1.00 4.12 H new ATOM 3585 N ALA B 111 -5.104 1.410 25.350 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.761 1.607 24.797 1.00 51.51 C ATOM 3587 C ALA B 111 -3.762 2.638 23.670 1.00 2.23 C ATOM 3588 O ALA B 111 -2.792 3.368 23.498 1.00 42.41 O ATOM 3589 CB ALA B 111 -3.175 0.292 24.300 1.00 4.22 C ATOM 0 H ALA B 111 -5.425 0.442 25.344 1.00 64.14 H new ATOM 0 HA ALA B 111 -3.135 1.987 25.605 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -2.178 0.468 23.895 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -3.111 -0.414 25.128 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.816 -0.120 23.521 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.855 2.694 22.906 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.987 3.667 21.819 1.00 34.20 C ATOM 3597 C LYS B 112 -4.677 5.077 22.315 1.00 24.41 C ATOM 3598 O LYS B 112 -3.908 5.812 21.689 1.00 32.01 O ATOM 3599 CB LYS B 112 -6.400 3.643 21.217 1.00 45.31 C ATOM 3600 CG LYS B 112 -6.739 2.374 20.440 1.00 74.45 C ATOM 3601 CD LYS B 112 -5.889 2.231 19.180 1.00 63.04 C ATOM 3602 CE LYS B 112 -6.245 0.968 18.406 1.00 72.33 C ATOM 3603 NZ LYS B 112 -5.414 0.809 17.184 1.00 62.21 N1+ ATOM 0 H LYS B 112 -5.660 2.078 23.019 1.00 32.30 H new ATOM 0 HA LYS B 112 -4.270 3.388 21.047 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -7.125 3.765 22.021 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -6.512 4.500 20.553 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -6.587 1.505 21.080 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -7.794 2.387 20.166 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -6.033 3.103 18.542 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -4.834 2.207 19.453 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -6.112 0.099 19.050 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -7.298 0.999 18.126 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -5.689 -0.063 16.688 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -5.560 1.625 16.556 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -4.411 0.753 17.451 1.00 62.21 H new ATOM 3617 N THR B 113 -5.273 5.449 23.443 1.00 71.03 N ATOM 3618 CA THR B 113 -5.097 6.789 23.983 1.00 12.30 C ATOM 3619 C THR B 113 -3.791 6.894 24.775 1.00 72.03 C ATOM 3620 O THR B 113 -3.076 7.897 24.685 1.00 34.03 O ATOM 3621 CB THR B 113 -6.303 7.222 24.860 1.00 51.23 C ATOM 3622 OG1 THR B 113 -6.389 8.654 24.909 1.00 15.33 O ATOM 3623 CG2 THR B 113 -6.201 6.679 26.279 1.00 55.23 C ATOM 0 H THR B 113 -5.879 4.844 23.997 1.00 71.03 H new ATOM 0 HA THR B 113 -5.044 7.472 23.135 1.00 12.30 H new ATOM 0 HB THR B 113 -7.200 6.807 24.401 1.00 51.23 H new ATOM 0 HG1 THR B 113 -7.153 8.917 25.463 1.00 15.33 H new ATOM 0 HG21 THR B 113 -7.065 7.006 26.857 1.00 55.23 H new ATOM 0 HG22 THR B 113 -6.175 5.590 26.251 1.00 55.23 H new ATOM 0 HG23 THR B 113 -5.290 7.052 26.747 1.00 55.23 H new ATOM 3631 N LEU B 114 -3.471 5.845 25.535 1.00 42.02 N ATOM 3632 CA LEU B 114 -2.279 5.851 26.383 1.00 34.43 C ATOM 3633 C LEU B 114 -1.013 5.949 25.537 1.00 70.23 C ATOM 3634 O LEU B 114 -0.141 6.774 25.802 1.00 14.10 O ATOM 3635 CB LEU B 114 -2.233 4.604 27.277 1.00 61.41 C ATOM 3636 CG LEU B 114 -3.427 4.438 28.235 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -3.188 3.280 29.200 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -3.701 5.735 28.997 1.00 20.12 C ATOM 0 H LEU B 114 -4.018 4.985 25.580 1.00 42.02 H new ATOM 0 HA LEU B 114 -2.331 6.729 27.027 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -2.174 3.722 26.639 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -1.317 4.633 27.866 1.00 61.41 H new ATOM 0 HG LEU B 114 -4.310 4.207 27.639 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -4.044 3.180 29.868 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -3.059 2.357 28.635 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -2.290 3.475 29.787 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -4.549 5.591 29.667 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -2.821 6.008 29.579 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -3.929 6.532 28.289 1.00 20.12 H new ATOM 3650 N VAL B 115 -0.929 5.113 24.510 1.00 61.11 N ATOM 3651 CA VAL B 115 0.199 5.130 23.584 1.00 23.35 C ATOM 3652 C VAL B 115 0.284 6.476 22.879 1.00 63.55 C ATOM 3653 O VAL B 115 1.374 7.028 22.696 1.00 10.54 O ATOM 3654 CB VAL B 115 0.077 3.996 22.530 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.110 4.149 21.413 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.215 2.632 23.199 1.00 32.34 C ATOM 0 H VAL B 115 -1.635 4.408 24.295 1.00 61.11 H new ATOM 0 HA VAL B 115 1.108 4.967 24.164 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.912 4.071 22.077 1.00 32.23 H new ATOM 0 HG11 VAL B 115 0.993 3.337 20.695 1.00 53.51 H new ATOM 0 HG12 VAL B 115 0.961 5.104 20.908 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.113 4.116 21.838 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.127 1.848 22.447 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.188 2.562 23.685 1.00 32.34 H new ATOM 0 HG23 VAL B 115 -0.572 2.511 23.944 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.879 7.001 22.504 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.969 8.278 21.804 1.00 4.03 C ATOM 3668 C ASP B 116 -0.274 9.368 22.610 1.00 43.14 C ATOM 3669 O ASP B 116 0.713 9.948 22.165 1.00 21.31 O ATOM 3670 CB ASP B 116 -2.439 8.657 21.574 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.611 9.862 20.656 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -2.253 10.987 21.060 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -3.124 9.683 19.527 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.781 6.556 22.676 1.00 33.05 H new ATOM 0 HA ASP B 116 -0.475 8.180 20.838 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.965 7.804 21.146 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.907 8.870 22.535 1.00 75.43 H new ATOM 3678 N ARG B 117 -0.778 9.603 23.817 1.00 65.05 N ATOM 3679 CA ARG B 117 -0.269 10.672 24.674 1.00 30.34 C ATOM 3680 C ARG B 117 1.167 10.395 25.120 1.00 41.22 C ATOM 3681 O ARG B 117 2.013 11.290 25.114 1.00 22.44 O ATOM 3682 CB ARG B 117 -1.193 10.844 25.887 1.00 5.33 C ATOM 3683 CG ARG B 117 -1.368 9.575 26.722 1.00 52.02 C ATOM 3684 CD ARG B 117 -2.547 9.678 27.685 1.00 70.20 C ATOM 3685 NE ARG B 117 -2.337 10.690 28.730 1.00 35.41 N ATOM 3686 CZ ARG B 117 -2.960 11.874 28.769 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -3.819 12.209 27.814 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -2.726 12.715 29.770 1.00 12.43 N ATOM 0 H ARG B 117 -1.542 9.066 24.227 1.00 65.05 H new ATOM 0 HA ARG B 117 -0.256 11.599 24.100 1.00 30.34 H new ATOM 0 HB2 ARG B 117 -0.795 11.634 26.524 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -2.172 11.176 25.541 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -1.516 8.723 26.059 1.00 52.02 H new ATOM 0 HG3 ARG B 117 -0.455 9.385 27.287 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -3.449 9.922 27.124 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -2.715 8.708 28.153 1.00 70.20 H new ATOM 0 HE ARG B 117 -1.673 10.476 29.474 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -4.006 11.563 27.047 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -4.292 13.112 27.847 1.00 12.31 H new ATOM 0 HH21 ARG B 117 -2.071 12.459 30.509 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -3.201 13.617 29.800 1.00 12.43 H new ATOM 3702 N ALA B 118 1.439 9.145 25.476 1.00 61.11 N ATOM 3703 CA ALA B 118 2.743 8.761 26.016 1.00 4.01 C ATOM 3704 C ALA B 118 3.826 8.741 24.938 1.00 4.12 C ATOM 3705 O ALA B 118 5.015 8.781 25.248 1.00 22.32 O ATOM 3706 CB ALA B 118 2.656 7.402 26.702 1.00 4.44 C ATOM 0 H ALA B 118 0.773 8.376 25.401 1.00 61.11 H new ATOM 0 HA ALA B 118 3.025 9.515 26.750 1.00 4.01 H new ATOM 0 HB1 ALA B 118 3.635 7.131 27.098 1.00 4.44 H new ATOM 0 HB2 ALA B 118 1.935 7.452 27.518 1.00 4.44 H new ATOM 0 HB3 ALA B 118 2.336 6.650 25.981 1.00 4.44 H new ATOM 3712 N HIS B 119 3.430 8.629 23.671 1.00 53.54 N ATOM 3713 CA HIS B 119 4.397 8.624 22.573 1.00 31.05 C ATOM 3714 C HIS B 119 4.204 9.828 21.653 1.00 22.51 C ATOM 3715 O HIS B 119 4.749 9.868 20.551 1.00 73.21 O ATOM 3716 CB HIS B 119 4.295 7.315 21.779 1.00 24.30 C ATOM 3717 CG HIS B 119 4.553 6.082 22.602 1.00 50.32 C ATOM 3718 ND1 HIS B 119 5.064 6.116 23.889 1.00 33.22 N ATOM 3719 CD2 HIS B 119 4.360 4.774 22.317 1.00 55.12 C ATOM 3720 CE1 HIS B 119 5.170 4.885 24.352 1.00 74.31 C ATOM 3721 NE2 HIS B 119 4.749 4.051 23.419 1.00 22.51 N ATOM 0 H HIS B 119 2.456 8.541 23.380 1.00 53.54 H new ATOM 0 HA HIS B 119 5.395 8.696 23.005 1.00 31.05 H new ATOM 0 HB2 HIS B 119 3.300 7.245 21.339 1.00 24.30 H new ATOM 0 HB3 HIS B 119 5.007 7.345 20.954 1.00 24.30 H new ATOM 0 HD2 HIS B 119 3.972 4.372 21.393 1.00 55.12 H new ATOM 0 HE1 HIS B 119 5.539 4.607 25.328 1.00 74.31 H new ATOM 0 HE2 HIS B 119 4.718 3.035 23.503 1.00 22.51 H new ATOM 3730 N HIS B 120 3.432 10.809 22.114 1.00 35.12 N ATOM 3731 CA HIS B 120 3.165 12.018 21.331 1.00 61.52 C ATOM 3732 C HIS B 120 4.302 13.027 21.512 1.00 22.12 C ATOM 3733 O HIS B 120 4.461 13.950 20.713 1.00 21.30 O ATOM 3734 CB HIS B 120 1.825 12.651 21.766 1.00 61.10 C ATOM 3735 CG HIS B 120 1.044 13.263 20.638 1.00 45.20 C ATOM 3736 ND1 HIS B 120 -0.216 12.829 20.280 1.00 23.40 N ATOM 3737 CD2 HIS B 120 1.342 14.279 19.793 1.00 61.34 C ATOM 3738 CE1 HIS B 120 -0.655 13.548 19.265 1.00 14.23 C ATOM 3739 NE2 HIS B 120 0.270 14.434 18.951 1.00 33.30 N ATOM 0 H HIS B 120 2.978 10.792 23.027 1.00 35.12 H new ATOM 0 HA HIS B 120 3.100 11.743 20.278 1.00 61.52 H new ATOM 0 HB2 HIS B 120 1.213 11.887 22.246 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.023 13.418 22.515 1.00 61.10 H new ATOM 0 HD1 HIS B 120 -0.728 12.070 20.730 1.00 23.40 H new ATOM 0 HD2 HIS B 120 2.253 14.859 19.784 1.00 61.34 H new ATOM 0 HE1 HIS B 120 -1.610 13.431 18.774 1.00 14.23 H new ATOM 3748 N VAL B 121 5.086 12.831 22.570 1.00 53.34 N ATOM 3749 CA VAL B 121 6.157 13.759 22.945 1.00 2.11 C ATOM 3750 C VAL B 121 7.539 13.114 22.772 1.00 31.12 C ATOM 3751 O VAL B 121 8.411 13.236 23.635 1.00 43.14 O ATOM 3752 CB VAL B 121 5.974 14.229 24.416 1.00 52.03 C ATOM 3753 CG1 VAL B 121 4.700 15.064 24.560 1.00 41.33 C ATOM 3754 CG2 VAL B 121 5.947 13.033 25.373 1.00 63.42 C ATOM 0 H VAL B 121 4.999 12.027 23.192 1.00 53.34 H new ATOM 0 HA VAL B 121 6.097 14.622 22.282 1.00 2.11 H new ATOM 0 HB VAL B 121 6.827 14.854 24.680 1.00 52.03 H new ATOM 0 HG11 VAL B 121 4.590 15.383 25.596 1.00 41.33 H new ATOM 0 HG12 VAL B 121 4.764 15.940 23.915 1.00 41.33 H new ATOM 0 HG13 VAL B 121 3.837 14.464 24.271 1.00 41.33 H new ATOM 0 HG21 VAL B 121 5.818 13.388 26.395 1.00 63.42 H new ATOM 0 HG22 VAL B 121 5.119 12.375 25.110 1.00 63.42 H new ATOM 0 HG23 VAL B 121 6.885 12.484 25.295 1.00 63.42 H new ATOM 3764 N CYS B 122 7.741 12.451 21.638 1.00 64.23 N ATOM 3765 CA CYS B 122 8.997 11.753 21.372 1.00 24.42 C ATOM 3766 C CYS B 122 10.151 12.746 21.171 1.00 23.34 C ATOM 3767 O CYS B 122 10.034 13.682 20.380 1.00 74.53 O ATOM 3768 CB CYS B 122 8.855 10.858 20.135 1.00 15.34 C ATOM 3769 SG CYS B 122 8.366 11.737 18.634 1.00 14.44 S ATOM 0 H CYS B 122 7.053 12.381 20.888 1.00 64.23 H new ATOM 0 HA CYS B 122 9.227 11.133 22.238 1.00 24.42 H new ATOM 0 HB2 CYS B 122 9.805 10.355 19.954 1.00 15.34 H new ATOM 0 HB3 CYS B 122 8.118 10.083 20.345 1.00 15.34 H new ATOM 0 HG CYS B 122 8.814 12.956 18.680 1.00 14.44 H new ATOM 3775 N PRO B 123 11.276 12.562 21.898 1.00 45.45 N ATOM 3776 CA PRO B 123 12.455 13.432 21.765 1.00 1.30 C ATOM 3777 C PRO B 123 13.186 13.215 20.436 1.00 21.43 C ATOM 3778 O PRO B 123 13.810 14.133 19.900 1.00 1.12 O ATOM 3779 CB PRO B 123 13.339 13.023 22.953 1.00 65.25 C ATOM 3780 CG PRO B 123 12.943 11.614 23.252 1.00 12.41 C ATOM 3781 CD PRO B 123 11.476 11.512 22.919 1.00 30.51 C ATOM 0 HA PRO B 123 12.189 14.489 21.769 1.00 1.30 H new ATOM 0 HB2 PRO B 123 14.397 13.092 22.702 1.00 65.25 H new ATOM 0 HB3 PRO B 123 13.173 13.672 23.813 1.00 65.25 H new ATOM 0 HG2 PRO B 123 13.527 10.911 22.658 1.00 12.41 H new ATOM 0 HG3 PRO B 123 13.122 11.373 24.300 1.00 12.41 H new ATOM 0 HD2 PRO B 123 11.220 10.525 22.534 1.00 30.51 H new ATOM 0 HD3 PRO B 123 10.853 11.683 23.797 1.00 30.51 H new ATOM 3789 N TYR B 124 13.103 11.994 19.909 1.00 44.15 N ATOM 3790 CA TYR B 124 13.721 11.666 18.624 1.00 41.53 C ATOM 3791 C TYR B 124 12.868 12.193 17.478 1.00 41.03 C ATOM 3792 O TYR B 124 12.136 11.431 16.848 1.00 24.42 O ATOM 3793 CB TYR B 124 13.926 10.145 18.475 1.00 11.44 C ATOM 3794 CG TYR B 124 15.065 9.582 19.304 1.00 34.02 C ATOM 3795 CD1 TYR B 124 16.125 8.901 18.702 1.00 62.34 C ATOM 3796 CD2 TYR B 124 15.088 9.735 20.687 1.00 4.11 C ATOM 3797 CE1 TYR B 124 17.163 8.393 19.456 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.126 9.228 21.444 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.160 8.558 20.826 1.00 65.35 C ATOM 3800 OH TYR B 124 18.193 8.053 21.579 1.00 21.31 O ATOM 0 H TYR B 124 12.614 11.216 20.351 1.00 44.15 H new ATOM 0 HA TYR B 124 14.699 12.145 18.591 1.00 41.53 H new ATOM 0 HB2 TYR B 124 13.003 9.637 18.755 1.00 11.44 H new ATOM 0 HB3 TYR B 124 14.109 9.916 17.425 1.00 11.44 H new ATOM 0 HD1 TYR B 124 16.133 8.770 17.630 1.00 62.34 H new ATOM 0 HD2 TYR B 124 14.281 10.259 21.177 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.975 7.868 18.975 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.128 9.356 22.516 1.00 2.53 H new ATOM 0 HH TYR B 124 17.833 7.463 22.274 1.00 21.31 H new ATOM 3845 N THR B 128 9.537 12.627 13.102 1.00 13.32 N ATOM 3846 CA THR B 128 9.967 11.277 12.751 1.00 55.14 C ATOM 3847 C THR B 128 8.733 10.426 12.538 1.00 13.14 C ATOM 3848 O THR B 128 8.808 9.293 12.081 1.00 21.45 O ATOM 3849 CB THR B 128 10.863 10.634 13.844 1.00 41.45 C ATOM 3850 OG1 THR B 128 11.627 9.556 13.283 1.00 41.22 O ATOM 3851 CG2 THR B 128 10.034 10.099 15.012 1.00 11.25 C ATOM 0 HA THR B 128 10.568 11.335 11.844 1.00 55.14 H new ATOM 0 HB THR B 128 11.528 11.412 14.219 1.00 41.45 H new ATOM 0 HG1 THR B 128 11.051 9.013 12.705 1.00 41.22 H new ATOM 0 HG21 THR B 128 10.697 9.657 15.756 1.00 11.25 H new ATOM 0 HG22 THR B 128 9.474 10.917 15.465 1.00 11.25 H new ATOM 0 HG23 THR B 128 9.340 9.341 14.648 1.00 11.25 H new ATOM 3859 N ARG B 129 7.595 11.018 12.871 1.00 41.51 N ATOM 3860 CA ARG B 129 6.312 10.351 12.806 1.00 75.21 C ATOM 3861 C ARG B 129 5.326 11.173 11.981 1.00 73.32 C ATOM 3862 O ARG B 129 4.470 10.628 11.289 1.00 44.41 O ATOM 3863 CB ARG B 129 5.802 10.149 14.229 1.00 21.01 C ATOM 3864 CG ARG B 129 5.766 11.423 15.067 1.00 45.10 C ATOM 3865 CD ARG B 129 5.571 11.113 16.540 1.00 21.21 C ATOM 3866 NE ARG B 129 6.654 10.270 17.063 1.00 2.44 N ATOM 3867 CZ ARG B 129 6.476 9.085 17.653 1.00 0.21 C ATOM 3868 NH1 ARG B 129 5.249 8.615 17.852 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 7.530 8.376 18.051 1.00 44.44 N ATOM 0 H ARG B 129 7.541 11.983 13.196 1.00 41.51 H new ATOM 0 HA ARG B 129 6.417 9.382 12.317 1.00 75.21 H new ATOM 0 HB2 ARG B 129 4.798 9.727 14.187 1.00 21.01 H new ATOM 0 HB3 ARG B 129 6.435 9.416 14.729 1.00 21.01 H new ATOM 0 HG2 ARG B 129 6.695 11.976 14.930 1.00 45.10 H new ATOM 0 HG3 ARG B 129 4.958 12.066 14.719 1.00 45.10 H new ATOM 0 HD2 ARG B 129 5.528 12.044 17.106 1.00 21.21 H new ATOM 0 HD3 ARG B 129 4.615 10.609 16.683 1.00 21.21 H new ATOM 0 HE ARG B 129 7.610 10.614 16.969 1.00 2.44 H new ATOM 0 HH11 ARG B 129 4.440 9.160 17.554 1.00 5.12 H new ATOM 0 HH12 ARG B 129 5.117 7.710 18.303 1.00 5.12 H new ATOM 0 HH21 ARG B 129 8.472 8.738 17.905 1.00 44.44 H new ATOM 0 HH22 ARG B 129 7.395 7.471 18.502 1.00 44.44 H new ATOM 3883 N ASN B 130 5.437 12.490 12.090 1.00 21.53 N ATOM 3884 CA ASN B 130 4.654 13.401 11.250 1.00 53.34 C ATOM 3885 C ASN B 130 5.259 13.511 9.847 1.00 22.35 C ATOM 3886 O ASN B 130 4.564 13.336 8.843 1.00 70.41 O ATOM 3887 CB ASN B 130 4.555 14.795 11.891 1.00 70.21 C ATOM 3888 CG ASN B 130 3.754 14.798 13.184 1.00 33.52 C ATOM 3889 OD1 ASN B 130 2.530 14.916 13.168 1.00 60.32 O ATOM 3890 ND2 ASN B 130 4.436 14.693 14.318 1.00 74.14 N ATOM 0 H ASN B 130 6.060 12.956 12.750 1.00 21.53 H new ATOM 0 HA ASN B 130 3.650 12.986 11.164 1.00 53.34 H new ATOM 0 HB2 ASN B 130 5.559 15.169 12.091 1.00 70.21 H new ATOM 0 HB3 ASN B 130 4.094 15.483 11.182 1.00 70.21 H new ATOM 0 HD21 ASN B 130 3.945 14.709 15.212 1.00 74.14 H new ATOM 0 HD22 ASN B 130 5.451 14.596 14.296 1.00 74.14 H new ATOM 3897 N ASN B 131 6.558 13.803 9.786 1.00 34.23 N ATOM 3898 CA ASN B 131 7.263 13.963 8.510 1.00 31.43 C ATOM 3899 C ASN B 131 7.554 12.595 7.900 1.00 54.44 C ATOM 3900 O ASN B 131 7.368 12.377 6.699 1.00 13.44 O ATOM 3901 CB ASN B 131 8.584 14.723 8.723 1.00 3.33 C ATOM 3902 CG ASN B 131 9.260 15.171 7.430 1.00 61.21 C ATOM 3903 OD1 ASN B 131 8.479 15.545 6.425 1.00 75.43 O flip ATOM 3904 ND2 ASN B 131 10.492 15.198 7.348 1.00 34.33 N flip ATOM 0 H ASN B 131 7.147 13.934 10.608 1.00 34.23 H new ATOM 0 HA ASN B 131 6.629 14.534 7.831 1.00 31.43 H new ATOM 0 HB2 ASN B 131 8.391 15.599 9.342 1.00 3.33 H new ATOM 0 HB3 ASN B 131 9.272 14.086 9.278 1.00 3.33 H new ATOM 0 HD21 ASN B 131 11.062 14.903 8.141 1.00 34.33 H new ATOM 0 HD22 ASN B 131 10.939 15.515 6.488 1.00 34.33 H new ATOM 3911 N VAL B 132 8.007 11.677 8.749 1.00 52.13 N ATOM 3912 CA VAL B 132 8.335 10.317 8.335 1.00 11.30 C ATOM 3913 C VAL B 132 7.180 9.382 8.695 1.00 11.32 C ATOM 3914 O VAL B 132 6.517 9.575 9.712 1.00 35.23 O ATOM 3915 CB VAL B 132 9.639 9.828 9.016 1.00 15.30 C ATOM 3916 CG1 VAL B 132 10.114 8.507 8.412 1.00 32.53 C ATOM 3917 CG2 VAL B 132 10.726 10.905 8.928 1.00 3.12 C ATOM 0 H VAL B 132 8.157 11.855 9.742 1.00 52.13 H new ATOM 0 HA VAL B 132 8.491 10.311 7.256 1.00 11.30 H new ATOM 0 HB VAL B 132 9.428 9.646 10.070 1.00 15.30 H new ATOM 0 HG11 VAL B 132 11.030 8.188 8.909 1.00 32.53 H new ATOM 0 HG12 VAL B 132 9.344 7.747 8.548 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.307 8.642 7.348 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.635 10.545 9.411 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.935 11.127 7.881 1.00 3.12 H new ATOM 0 HG23 VAL B 132 10.383 11.810 9.429 1.00 3.12 H new ATOM 3927 N ALA B 133 6.941 8.379 7.858 1.00 53.04 N ATOM 3928 CA ALA B 133 5.790 7.497 8.022 1.00 53.01 C ATOM 3929 C ALA B 133 5.991 6.490 9.146 1.00 72.23 C ATOM 3930 O ALA B 133 6.691 5.486 8.989 1.00 0.23 O ATOM 3931 CB ALA B 133 5.483 6.787 6.707 1.00 11.23 C ATOM 0 H ALA B 133 7.531 8.155 7.056 1.00 53.04 H new ATOM 0 HA ALA B 133 4.937 8.116 8.302 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.623 6.131 6.840 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.260 7.526 5.938 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.346 6.195 6.403 1.00 11.23 H new ATOM 3937 N VAL B 134 5.381 6.781 10.291 1.00 34.41 N ATOM 3938 CA VAL B 134 5.339 5.850 11.407 1.00 31.34 C ATOM 3939 C VAL B 134 3.895 5.515 11.752 1.00 33.12 C ATOM 3940 O VAL B 134 3.020 6.383 11.730 1.00 12.15 O ATOM 3941 CB VAL B 134 6.041 6.402 12.672 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.926 5.402 13.815 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.502 6.725 12.380 1.00 5.41 C ATOM 0 H VAL B 134 4.905 7.665 10.468 1.00 34.41 H new ATOM 0 HA VAL B 134 5.876 4.956 11.089 1.00 31.34 H new ATOM 0 HB VAL B 134 5.546 7.326 12.970 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.423 5.801 14.699 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.874 5.225 14.039 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.398 4.463 13.526 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.977 7.111 13.282 1.00 5.41 H new ATOM 0 HG22 VAL B 134 8.017 5.820 12.058 1.00 5.41 H new ATOM 0 HG23 VAL B 134 7.558 7.475 11.591 1.00 5.41 H new ATOM 3953 N ARG B 135 3.659 4.254 12.071 1.00 11.21 N ATOM 3954 CA ARG B 135 2.336 3.772 12.424 1.00 24.23 C ATOM 3955 C ARG B 135 2.336 3.303 13.873 1.00 24.22 C ATOM 3956 O ARG B 135 2.981 2.309 14.209 1.00 54.44 O ATOM 3957 CB ARG B 135 1.941 2.624 11.489 1.00 74.32 C ATOM 3958 CG ARG B 135 2.149 2.957 10.017 1.00 34.13 C ATOM 3959 CD ARG B 135 1.824 1.784 9.101 1.00 2.43 C ATOM 3960 NE ARG B 135 2.163 2.091 7.713 1.00 1.50 N ATOM 3961 CZ ARG B 135 1.344 2.696 6.848 1.00 23.13 C ATOM 3962 NH1 ARG B 135 0.091 2.987 7.189 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 1.783 3.004 5.637 1.00 14.33 N ATOM 0 H ARG B 135 4.382 3.534 12.092 1.00 11.21 H new ATOM 0 HA ARG B 135 1.610 4.578 12.315 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.525 1.739 11.742 1.00 74.32 H new ATOM 0 HB3 ARG B 135 0.893 2.372 11.654 1.00 74.32 H new ATOM 0 HG2 ARG B 135 1.523 3.808 9.748 1.00 34.13 H new ATOM 0 HG3 ARG B 135 3.184 3.261 9.859 1.00 34.13 H new ATOM 0 HD2 ARG B 135 2.374 0.901 9.426 1.00 2.43 H new ATOM 0 HD3 ARG B 135 0.763 1.544 9.175 1.00 2.43 H new ATOM 0 HE ARG B 135 3.090 1.825 7.381 1.00 1.50 H new ATOM 0 HH11 ARG B 135 -0.253 2.748 8.119 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -0.525 3.449 6.520 1.00 1.54 H new ATOM 0 HH21 ARG B 135 2.741 2.779 5.369 1.00 14.33 H new ATOM 0 HH22 ARG B 135 1.163 3.466 4.972 1.00 14.33 H new ATOM 3977 N LEU B 136 1.653 4.046 14.736 1.00 62.51 N ATOM 3978 CA LEU B 136 1.518 3.657 16.132 1.00 72.41 C ATOM 3979 C LEU B 136 0.390 2.648 16.280 1.00 41.21 C ATOM 3980 O LEU B 136 -0.791 2.997 16.277 1.00 33.52 O ATOM 3981 CB LEU B 136 1.305 4.887 17.027 1.00 60.04 C ATOM 3982 CG LEU B 136 2.602 5.617 17.414 1.00 34.22 C ATOM 3983 CD1 LEU B 136 2.301 6.952 18.092 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.454 4.731 18.325 1.00 0.00 C ATOM 0 H LEU B 136 1.185 4.919 14.493 1.00 62.51 H new ATOM 0 HA LEU B 136 2.443 3.182 16.460 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.647 5.587 16.513 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.791 4.576 17.937 1.00 60.04 H new ATOM 0 HG LEU B 136 3.162 5.825 16.502 1.00 34.22 H new ATOM 0 HD11 LEU B 136 3.237 7.446 18.354 1.00 41.31 H new ATOM 0 HD12 LEU B 136 1.734 7.587 17.411 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.717 6.778 18.996 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.370 5.258 18.592 1.00 0.00 H new ATOM 0 HD22 LEU B 136 2.894 4.494 19.230 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.706 3.808 17.803 1.00 0.00 H new ATOM 3996 N VAL B 137 0.781 1.390 16.382 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.143 0.272 16.451 1.00 61.13 C ATOM 3998 C VAL B 137 -0.073 -0.372 17.831 1.00 31.22 C ATOM 3999 O VAL B 137 0.965 -0.889 18.243 1.00 63.04 O ATOM 4000 CB VAL B 137 0.159 -0.766 15.329 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.650 -0.806 15.023 1.00 20.11 C ATOM 4002 CG2 VAL B 137 -0.345 -2.164 15.701 1.00 5.14 C ATOM 0 H VAL B 137 1.762 1.113 16.420 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.156 0.641 16.292 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.376 -0.446 14.435 1.00 72.22 H new ATOM 0 HG11 VAL B 137 1.841 -1.537 14.237 1.00 20.11 H new ATOM 0 HG12 VAL B 137 1.980 0.178 14.691 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.198 -1.088 15.922 1.00 20.11 H new ATOM 0 HG21 VAL B 137 -0.116 -2.860 14.894 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.145 -2.496 16.616 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.423 -2.132 15.858 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.177 -0.306 18.549 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.260 -0.853 19.893 1.00 24.22 C ATOM 4014 C VAL B 138 -1.731 -2.302 19.837 1.00 70.52 C ATOM 4015 O VAL B 138 -2.598 -2.654 19.027 1.00 62.24 O ATOM 4016 CB VAL B 138 -2.196 -0.024 20.801 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.949 1.468 20.603 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.652 -0.386 20.557 1.00 0.20 C ATOM 0 H VAL B 138 -2.040 0.126 18.220 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.262 -0.809 20.328 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.971 -0.265 21.840 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.617 2.036 21.250 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.914 1.702 20.854 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -2.139 1.733 19.563 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.290 0.212 21.209 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.907 -0.186 19.516 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.805 -1.444 20.771 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.115 -3.136 20.649 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.400 -4.570 20.654 1.00 52.34 C ATOM 4030 C ALA B 139 -2.654 -4.870 21.482 1.00 22.31 C ATOM 4031 O ALA B 139 -3.733 -5.074 20.880 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.199 -5.350 21.182 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.561 -4.892 22.727 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.406 -2.849 21.323 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.590 -4.888 19.629 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.428 -6.416 21.179 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.665 -5.163 20.545 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.024 -5.029 22.200 1.00 71.35 H new