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 125 SER OG : rot 180:sc= 0.00937 USER MOD Set 1.2: A 126 ASN :FLIP amide:sc= 1.26 F(o=-0.24,f=2.7) USER MOD Set 1.3: A 130 ASN :FLIP amide:sc= 0.374 F(o=1.2,f=2.7) USER MOD Set 1.4: B 131 ASN : amide:sc= 1.04 K(o=2.7,f=-1.9!) USER MOD Set 2.1: B 54 TYR OH : rot -111:sc= 0.416 USER MOD Set 2.2: B 119 HIS : no HE2:sc= 0.549 K(o=0.96,f=-7.9!) USER MOD Set 3.1: A 12 THR OG1 : rot -81:sc= 0.107 USER MOD Set 3.2: B 78 THR OG1 : rot 180:sc= -0.828 USER MOD Set 4.1: B 60 SER OG : rot 124:sc= 1.15 USER MOD Set 4.2: B 63 LYS NZ :NH3+ -163:sc= -1.99! (180deg=-3.58!) USER MOD Set 5.1: A 57 CYS SG : rot 77:sc= 0.441 USER MOD Set 5.2: A 124 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 54 TYR OH : rot 27:sc= 0.776 USER MOD Set 6.2: A 119 HIS : no HE2:sc= -1.82 K(o=1.4,f=-7.3!) USER MOD Set 6.3: A 122 CYS SG : rot -78:sc= 1.24 USER MOD Set 6.4: A 128 THR OG1 : rot -154:sc= 1.24 USER MOD Set 7.1: A 55 SER OG : rot -79:sc= 1.29 USER MOD Set 7.2: B 11 SER OG : rot 155:sc= 0.892 USER MOD Set 8.1: A 45 ASN : amide:sc= -1.53! X(o=0.033!,f=0.14) USER MOD Set 8.2: B 5 TYR OH : rot -150:sc= 0.758 USER MOD Set 8.3: B 7 THR OG1 : rot 180:sc= 0 USER MOD Set 8.4: B 25 LYS NZ :NH3+ 132:sc= 0.807 (180deg=0.592) USER MOD Set 9.1: A 29 LYS NZ :NH3+ 140:sc= 1.13 (180deg=-1.14) USER MOD Set 9.2: A 31 SER OG : rot -103:sc= 0.406 USER MOD Set10.1: A 21 SER OG : rot 152:sc= -1.27! USER MOD Set10.2: B 48 GLN : amide:sc= -1.43 K(o=-2.7,f=-3.7) USER MOD Set11.1: A 10 THR OG1 : rot 180:sc= 0 USER MOD Set11.2: B 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 159:sc= -4.92! (180deg=-6.22!) USER MOD Single : A 1 MET N :NH3+ -119:sc= 0.135 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 5 TYR OH : rot 180:sc= -0.0484 USER MOD Single : A 6 LYS NZ :NH3+ 161:sc= 1.14 (180deg=0.983) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0212 USER MOD Single : A 11 SER OG : rot -5:sc= -0.167 USER MOD Single : A 20 THR OG1 : rot -99:sc= 1.74 USER MOD Single : A 22 HIS : no HE2:sc= 0.547 K(o=0.55,f=-2!) USER MOD Single : A 24 GLN : amide:sc= -0.0353 X(o=-0.035,f=-0.13) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -4.11! C(o=-4.1!,f=-5.6!) USER MOD Single : A 60 SER OG : rot -93:sc= 0.54 USER MOD Single : A 62 MET CE :methyl -142:sc= -0.672 (180deg=-3.16!) USER MOD Single : A 63 LYS NZ :NH3+ 164:sc= -0.691! (180deg=-1.63!) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0.046) USER MOD Single : A 69 ASN :FLIP amide:sc= -0.0192 F(o=-2.3,f=-0.019) USER MOD Single : A 70 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0327) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 43:sc= 0.693 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 ASN : amide:sc= -1.22 K(o=-1.2,f=-12!) 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 HD1:sc= 0 X(o=0,f=-0.0084) USER MOD Single : A 131 ASN : amide:sc= -2.4! X(o=-2.4!,f=-2.1) USER MOD Single : B 1 MET CE :methyl -139:sc= -0.449 (180deg=-2.24) USER MOD Single : B 1 MET N :NH3+ 129:sc= 0.0764 (180deg=-0.13) USER MOD Single : B 2 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : B 6 LYS NZ :NH3+ 174:sc= 1.21 (180deg=0.946) USER MOD Single : B 10 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 THR OG1 : rot 180:sc= 0 USER MOD Single : B 21 SER OG : rot 160:sc= -0.31 USER MOD Single : B 22 HIS : no HD1:sc= -0.16 X(o=-0.16,f=-0.16) USER MOD Single : B 24 GLN : amide:sc= -0.312 X(o=-0.31,f=-0.19) USER MOD Single : B 29 LYS NZ :NH3+ -138:sc= -1.94! (180deg=-4.37!) USER MOD Single : B 31 SER OG : rot -3:sc= 0.185 USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= -6.35! C(o=-6.3!,f=-12!) USER MOD Single : B 55 SER OG : rot 80:sc= -1.08! USER MOD Single : B 57 CYS SG : rot -173:sc= 1.43 USER MOD Single : B 62 MET CE :methyl -142:sc= -0.818 (180deg=-3.22!) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0.35) USER MOD Single : B 69 ASN : amide:sc= 0.76 K(o=0.76,f=0) USER MOD Single : B 70 LYS NZ :NH3+ -164:sc= -0.0215 (180deg=-0.28) USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 43:sc= 0.0499! USER MOD Single : B 88 ASN : amide:sc= -0.519 K(o=-0.52,f=-12!) USER MOD Single : B 112 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0233) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= -0.167 X(o=-0.17,f=-0.013) USER MOD Single : B 122 CYS SG : rot 180:sc= -0.184 USER MOD Single : B 124 TYR OH : rot -156:sc= -0.619 USER MOD Single : B 128 THR OG1 : rot 173:sc= -0.317 USER MOD Single : B 130 ASN : amide:sc= -0.468 X(o=-0.47,f=-0.048) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.190 -0.193 3.134 1.00 60.05 N ATOM 2 CA MET A 1 2.206 -0.017 1.660 1.00 3.23 C ATOM 3 C MET A 1 2.915 -1.191 0.985 1.00 42.13 C ATOM 4 O MET A 1 3.287 -2.163 1.647 1.00 30.31 O ATOM 5 CB MET A 1 2.915 1.280 1.275 1.00 13.52 C ATOM 6 CG MET A 1 4.391 1.242 1.592 1.00 60.32 C ATOM 7 SD MET A 1 5.311 2.604 0.857 1.00 71.43 S ATOM 8 CE MET A 1 6.980 1.979 1.022 1.00 20.11 C ATOM 0 H1 MET A 1 1.206 -0.241 3.467 1.00 60.05 H new ATOM 0 H2 MET A 1 2.683 -1.074 3.384 1.00 60.05 H new ATOM 0 H3 MET A 1 2.670 0.612 3.585 1.00 60.05 H new ATOM 0 HA MET A 1 1.171 0.025 1.322 1.00 3.23 H new ATOM 0 HB2 MET A 1 2.779 1.463 0.209 1.00 13.52 H new ATOM 0 HB3 MET A 1 2.454 2.114 1.803 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.524 1.264 2.674 1.00 60.32 H new ATOM 0 HG3 MET A 1 4.807 0.299 1.239 1.00 60.32 H new ATOM 0 HE1 MET A 1 7.631 2.488 0.312 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.337 2.159 2.036 1.00 20.11 H new ATOM 0 HE3 MET A 1 6.989 0.908 0.819 1.00 20.11 H new ATOM 20 N ASN A 2 3.111 -1.085 -0.333 1.00 22.52 N ATOM 21 CA ASN A 2 3.835 -2.097 -1.102 1.00 14.33 C ATOM 22 C ASN A 2 5.336 -2.024 -0.812 1.00 22.14 C ATOM 23 O ASN A 2 6.105 -1.407 -1.552 1.00 72.55 O ATOM 24 CB ASN A 2 3.582 -1.923 -2.607 1.00 31.34 C ATOM 25 CG ASN A 2 4.220 -3.026 -3.436 1.00 75.52 C ATOM 26 OD1 ASN A 2 4.312 -4.172 -2.999 1.00 52.13 O ATOM 27 ND2 ASN A 2 4.676 -2.686 -4.630 1.00 35.23 N ATOM 0 H ASN A 2 2.774 -0.301 -0.892 1.00 22.52 H new ATOM 0 HA ASN A 2 3.466 -3.077 -0.798 1.00 14.33 H new ATOM 0 HB2 ASN A 2 2.508 -1.909 -2.792 1.00 31.34 H new ATOM 0 HB3 ASN A 2 3.974 -0.958 -2.929 1.00 31.34 H new ATOM 0 HD21 ASN A 2 5.123 -3.385 -5.223 1.00 35.23 H new ATOM 0 HD22 ASN A 2 4.581 -1.725 -4.957 1.00 35.23 H new ATOM 34 N ILE A 3 5.723 -2.605 0.309 1.00 0.23 N ATOM 35 CA ILE A 3 7.118 -2.693 0.711 1.00 51.02 C ATOM 36 C ILE A 3 7.885 -3.713 -0.131 1.00 3.13 C ATOM 37 O ILE A 3 7.393 -4.811 -0.393 1.00 22.24 O ATOM 38 CB ILE A 3 7.219 -3.091 2.200 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.500 -2.056 3.069 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.675 -3.236 2.625 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.170 -0.704 3.076 1.00 23.10 C ATOM 0 H ILE A 3 5.075 -3.032 0.971 1.00 0.23 H new ATOM 0 HA ILE A 3 7.564 -1.711 0.555 1.00 51.02 H new ATOM 0 HB ILE A 3 6.734 -4.058 2.335 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.476 -1.943 2.713 1.00 25.54 H new ATOM 0 HG13 ILE A 3 6.443 -2.429 4.092 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.721 -3.517 3.677 1.00 24.42 H new ATOM 0 HG22 ILE A 3 9.155 -4.007 2.023 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.193 -2.288 2.480 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.606 -0.022 3.712 1.00 23.10 H new ATOM 0 HD12 ILE A 3 8.185 -0.803 3.461 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.204 -0.309 2.061 1.00 23.10 H new ATOM 53 N LEU A 4 9.096 -3.340 -0.536 1.00 41.13 N ATOM 54 CA LEU A 4 9.978 -4.237 -1.276 1.00 42.04 C ATOM 55 C LEU A 4 10.768 -5.115 -0.311 1.00 41.22 C ATOM 56 O LEU A 4 10.849 -6.331 -0.488 1.00 74.21 O ATOM 57 CB LEU A 4 10.944 -3.441 -2.163 1.00 22.30 C ATOM 58 CG LEU A 4 10.284 -2.532 -3.205 1.00 5.11 C ATOM 59 CD1 LEU A 4 11.343 -1.774 -4.000 1.00 73.22 C ATOM 60 CD2 LEU A 4 9.371 -3.334 -4.134 1.00 52.13 C ATOM 0 H LEU A 4 9.491 -2.416 -0.362 1.00 41.13 H new ATOM 0 HA LEU A 4 9.361 -4.870 -1.914 1.00 42.04 H new ATOM 0 HB2 LEU A 4 11.578 -2.829 -1.522 1.00 22.30 H new ATOM 0 HB3 LEU A 4 11.597 -4.143 -2.681 1.00 22.30 H new ATOM 0 HG LEU A 4 9.665 -1.804 -2.680 1.00 5.11 H new ATOM 0 HD11 LEU A 4 10.857 -1.133 -4.735 1.00 73.22 H new ATOM 0 HD12 LEU A 4 11.938 -1.162 -3.322 1.00 73.22 H new ATOM 0 HD13 LEU A 4 11.992 -2.485 -4.511 1.00 73.22 H new ATOM 0 HD21 LEU A 4 8.916 -2.664 -4.864 1.00 52.13 H new ATOM 0 HD22 LEU A 4 9.956 -4.093 -4.654 1.00 52.13 H new ATOM 0 HD23 LEU A 4 8.589 -3.817 -3.548 1.00 52.13 H new ATOM 72 N TYR A 5 11.339 -4.497 0.722 1.00 24.01 N ATOM 73 CA TYR A 5 12.123 -5.236 1.715 1.00 4.44 C ATOM 74 C TYR A 5 11.695 -4.840 3.117 1.00 12.52 C ATOM 75 O TYR A 5 11.652 -3.662 3.438 1.00 21.34 O ATOM 76 CB TYR A 5 13.628 -4.975 1.543 1.00 54.43 C ATOM 77 CG TYR A 5 14.497 -5.817 2.468 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.750 -5.420 3.781 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.043 -7.017 2.032 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.515 -6.198 4.628 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.816 -7.799 2.873 1.00 4.33 C ATOM 82 CZ TYR A 5 16.045 -7.387 4.170 1.00 33.20 C ATOM 83 OH TYR A 5 16.801 -8.172 5.018 1.00 31.30 O ATOM 0 H TYR A 5 11.275 -3.494 0.894 1.00 24.01 H new ATOM 0 HA TYR A 5 11.939 -6.299 1.563 1.00 4.44 H new ATOM 0 HB2 TYR A 5 13.909 -5.177 0.509 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.830 -3.920 1.728 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.341 -4.488 4.142 1.00 4.50 H new ATOM 0 HD2 TYR A 5 14.861 -7.346 1.019 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.697 -5.878 5.643 1.00 2.54 H new ATOM 0 HE2 TYR A 5 16.238 -8.727 2.516 1.00 4.33 H new ATOM 0 HH TYR A 5 17.099 -8.975 4.542 1.00 31.30 H new ATOM 93 N LYS A 6 11.387 -5.818 3.949 1.00 51.40 N ATOM 94 CA LYS A 6 10.969 -5.555 5.324 1.00 43.32 C ATOM 95 C LYS A 6 11.619 -6.535 6.300 1.00 62.42 C ATOM 96 O LYS A 6 11.885 -7.690 5.960 1.00 13.53 O ATOM 97 CB LYS A 6 9.434 -5.597 5.431 1.00 1.54 C ATOM 98 CG LYS A 6 8.894 -5.432 6.853 1.00 51.03 C ATOM 99 CD LYS A 6 7.429 -4.988 6.875 1.00 30.33 C ATOM 100 CE LYS A 6 7.267 -3.547 6.395 1.00 61.32 C ATOM 101 NZ LYS A 6 5.873 -3.050 6.556 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.417 -6.807 3.700 1.00 51.40 H new ATOM 0 HA LYS A 6 11.306 -4.555 5.598 1.00 43.32 H new ATOM 0 HB2 LYS A 6 9.017 -4.810 4.803 1.00 1.54 H new ATOM 0 HB3 LYS A 6 9.080 -6.546 5.029 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.992 -6.377 7.388 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.500 -4.700 7.386 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.839 -5.651 6.242 1.00 30.33 H new ATOM 0 HD3 LYS A 6 7.036 -5.080 7.888 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.947 -2.902 6.952 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.555 -3.482 5.346 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.870 -2.010 6.530 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 5.282 -3.417 5.783 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.492 -3.375 7.468 1.00 4.41 H new ATOM 115 N THR A 7 11.896 -6.039 7.502 1.00 30.21 N ATOM 116 CA THR A 7 12.484 -6.828 8.578 1.00 33.22 C ATOM 117 C THR A 7 11.894 -6.376 9.919 1.00 54.23 C ATOM 118 O THR A 7 11.372 -5.262 10.024 1.00 73.02 O ATOM 119 CB THR A 7 14.029 -6.687 8.595 1.00 43.13 C ATOM 120 OG1 THR A 7 14.591 -7.383 9.719 1.00 11.53 O ATOM 121 CG2 THR A 7 14.447 -5.218 8.630 1.00 62.33 C ATOM 0 H THR A 7 11.717 -5.068 7.758 1.00 30.21 H new ATOM 0 HA THR A 7 12.248 -7.879 8.411 1.00 33.22 H new ATOM 0 HB THR A 7 14.411 -7.133 7.677 1.00 43.13 H new ATOM 0 HG1 THR A 7 15.566 -7.284 9.711 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.535 -5.149 8.641 1.00 62.33 H new ATOM 0 HG22 THR A 7 14.060 -4.709 7.747 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.044 -4.746 9.526 1.00 62.33 H new ATOM 129 N ALA A 8 11.968 -7.231 10.937 1.00 51.42 N ATOM 130 CA ALA A 8 11.350 -6.936 12.231 1.00 62.45 C ATOM 131 C ALA A 8 12.366 -6.986 13.371 1.00 64.34 C ATOM 132 O ALA A 8 13.337 -7.744 13.325 1.00 4.53 O ATOM 133 CB ALA A 8 10.210 -7.913 12.494 1.00 11.23 C ATOM 0 H ALA A 8 12.447 -8.130 10.893 1.00 51.42 H new ATOM 0 HA ALA A 8 10.956 -5.920 12.191 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.754 -7.689 13.458 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.461 -7.819 11.708 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.599 -8.931 12.505 1.00 11.23 H new ATOM 139 N ALA A 9 12.129 -6.171 14.396 1.00 62.04 N ATOM 140 CA ALA A 9 12.967 -6.149 15.592 1.00 13.24 C ATOM 141 C ALA A 9 12.100 -6.038 16.844 1.00 53.42 C ATOM 142 O ALA A 9 11.316 -5.101 16.983 1.00 45.34 O ATOM 143 CB ALA A 9 13.966 -4.999 15.525 1.00 65.14 C ATOM 0 H ALA A 9 11.353 -5.509 14.421 1.00 62.04 H new ATOM 0 HA ALA A 9 13.527 -7.083 15.641 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.581 -4.999 16.425 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.603 -5.121 14.649 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.428 -4.054 15.453 1.00 65.14 H new ATOM 149 N THR A 10 12.239 -7.003 17.743 1.00 61.23 N ATOM 150 CA THR A 10 11.460 -7.043 18.973 1.00 51.35 C ATOM 151 C THR A 10 12.298 -6.548 20.156 1.00 43.21 C ATOM 152 O THR A 10 13.346 -7.116 20.465 1.00 73.43 O ATOM 153 CB THR A 10 10.964 -8.482 19.244 1.00 34.35 C ATOM 154 OG1 THR A 10 10.245 -8.967 18.100 1.00 3.15 O ATOM 155 CG2 THR A 10 10.063 -8.537 20.472 1.00 70.40 C ATOM 0 H THR A 10 12.894 -7.779 17.641 1.00 61.23 H new ATOM 0 HA THR A 10 10.598 -6.386 18.856 1.00 51.35 H new ATOM 0 HB THR A 10 11.834 -9.111 19.432 1.00 34.35 H new ATOM 0 HG1 THR A 10 9.933 -9.880 18.273 1.00 3.15 H new ATOM 0 HG21 THR A 10 9.732 -9.563 20.635 1.00 70.40 H new ATOM 0 HG22 THR A 10 10.617 -8.192 21.345 1.00 70.40 H new ATOM 0 HG23 THR A 10 9.195 -7.896 20.316 1.00 70.40 H new ATOM 163 N SER A 11 11.845 -5.478 20.801 1.00 71.32 N ATOM 164 CA SER A 11 12.553 -4.909 21.945 1.00 2.43 C ATOM 165 C SER A 11 11.666 -4.897 23.193 1.00 11.12 C ATOM 166 O SER A 11 10.632 -4.225 23.226 1.00 53.54 O ATOM 167 CB SER A 11 13.030 -3.491 21.610 1.00 22.21 C ATOM 168 OG SER A 11 11.963 -2.689 21.138 1.00 52.01 O ATOM 0 H SER A 11 10.988 -4.985 20.551 1.00 71.32 H new ATOM 0 HA SER A 11 13.420 -5.534 22.160 1.00 2.43 H new ATOM 0 HB2 SER A 11 13.468 -3.033 22.497 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.815 -3.538 20.855 1.00 22.21 H new ATOM 0 HG SER A 11 11.155 -3.237 21.051 1.00 52.01 H new ATOM 174 N THR A 12 12.067 -5.660 24.205 1.00 54.12 N ATOM 175 CA THR A 12 11.355 -5.717 25.472 1.00 52.53 C ATOM 176 C THR A 12 12.032 -4.810 26.500 1.00 72.12 C ATOM 177 O THR A 12 13.204 -4.455 26.353 1.00 13.04 O ATOM 178 CB THR A 12 11.333 -7.164 26.012 1.00 35.03 C ATOM 179 OG1 THR A 12 10.923 -8.063 24.972 1.00 61.53 O ATOM 180 CG2 THR A 12 10.393 -7.310 27.203 1.00 33.34 C ATOM 0 H THR A 12 12.895 -6.255 24.167 1.00 54.12 H new ATOM 0 HA THR A 12 10.333 -5.378 25.304 1.00 52.53 H new ATOM 0 HB THR A 12 12.342 -7.407 26.345 1.00 35.03 H new ATOM 0 HG1 THR A 12 9.946 -8.047 24.892 1.00 61.53 H new ATOM 0 HG21 THR A 12 10.407 -8.342 27.553 1.00 33.34 H new ATOM 0 HG22 THR A 12 10.719 -6.650 28.007 1.00 33.34 H new ATOM 0 HG23 THR A 12 9.380 -7.042 26.902 1.00 33.34 H new ATOM 188 N GLY A 13 11.297 -4.445 27.538 1.00 62.44 N ATOM 189 CA GLY A 13 11.847 -3.630 28.605 1.00 34.44 C ATOM 190 C GLY A 13 12.174 -4.460 29.829 1.00 13.14 C ATOM 191 O GLY A 13 11.581 -4.265 30.887 1.00 50.55 O ATOM 0 H GLY A 13 10.318 -4.701 27.663 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.749 -3.129 28.253 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.133 -2.851 28.873 1.00 34.44 H new ATOM 195 N GLY A 14 13.115 -5.399 29.672 1.00 62.02 N ATOM 196 CA GLY A 14 13.472 -6.306 30.756 1.00 43.32 C ATOM 197 C GLY A 14 13.884 -5.583 32.029 1.00 33.13 C ATOM 198 O GLY A 14 13.047 -5.297 32.885 1.00 44.52 O ATOM 0 H GLY A 14 13.637 -5.546 28.808 1.00 62.02 H new ATOM 0 HA2 GLY A 14 12.624 -6.955 30.973 1.00 43.32 H new ATOM 0 HA3 GLY A 14 14.290 -6.948 30.429 1.00 43.32 H new ATOM 202 N ARG A 15 15.177 -5.300 32.173 1.00 24.13 N ATOM 203 CA ARG A 15 15.654 -4.564 33.339 1.00 34.21 C ATOM 204 C ARG A 15 15.609 -3.061 33.071 1.00 4.22 C ATOM 205 O ARG A 15 15.012 -2.311 33.849 1.00 73.04 O ATOM 206 CB ARG A 15 17.073 -5.000 33.724 1.00 34.44 C ATOM 207 CG ARG A 15 17.606 -4.346 35.003 1.00 1.44 C ATOM 208 CD ARG A 15 16.726 -4.631 36.225 1.00 44.04 C ATOM 209 NE ARG A 15 15.470 -3.862 36.211 1.00 64.51 N ATOM 210 CZ ARG A 15 14.409 -4.133 36.980 1.00 22.54 C ATOM 211 NH1 ARG A 15 14.421 -5.176 37.802 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 13.326 -3.369 36.912 1.00 44.23 N ATOM 0 H ARG A 15 15.903 -5.565 31.507 1.00 24.13 H new ATOM 0 HA ARG A 15 14.995 -4.790 34.177 1.00 34.21 H new ATOM 0 HB2 ARG A 15 17.087 -6.083 33.850 1.00 34.44 H new ATOM 0 HB3 ARG A 15 17.749 -4.766 32.901 1.00 34.44 H new ATOM 0 HG2 ARG A 15 18.616 -4.706 35.196 1.00 1.44 H new ATOM 0 HG3 ARG A 15 17.675 -3.268 34.854 1.00 1.44 H new ATOM 0 HD2 ARG A 15 16.495 -5.696 36.261 1.00 44.04 H new ATOM 0 HD3 ARG A 15 17.282 -4.394 37.132 1.00 44.04 H new ATOM 0 HE ARG A 15 15.405 -3.070 35.572 1.00 64.51 H new ATOM 0 HH11 ARG A 15 15.243 -5.778 37.851 1.00 12.40 H new ATOM 0 HH12 ARG A 15 13.608 -5.375 38.385 1.00 12.40 H new ATOM 0 HH21 ARG A 15 13.302 -2.574 36.273 1.00 44.23 H new ATOM 0 HH22 ARG A 15 12.518 -3.577 37.499 1.00 44.23 H new ATOM 226 N ASP A 16 16.255 -2.614 31.991 1.00 4.14 N ATOM 227 CA ASP A 16 16.105 -1.227 31.544 1.00 22.02 C ATOM 228 C ASP A 16 15.687 -1.188 30.081 1.00 52.02 C ATOM 229 O ASP A 16 14.801 -0.420 29.700 1.00 74.22 O ATOM 230 CB ASP A 16 17.411 -0.456 31.740 1.00 50.13 C ATOM 231 CG ASP A 16 17.263 1.024 31.427 1.00 53.42 C ATOM 232 OD1 ASP A 16 17.466 1.413 30.263 1.00 45.04 O ATOM 233 OD2 ASP A 16 16.943 1.804 32.344 1.00 61.02 O1- ATOM 0 H ASP A 16 16.878 -3.182 31.417 1.00 4.14 H new ATOM 0 HA ASP A 16 15.329 -0.752 32.145 1.00 22.02 H new ATOM 0 HB2 ASP A 16 17.749 -0.575 32.770 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.182 -0.885 31.100 1.00 50.13 H new ATOM 238 N GLY A 17 16.326 -2.033 29.263 1.00 73.12 N ATOM 239 CA GLY A 17 15.782 -2.355 27.961 1.00 31.14 C ATOM 240 C GLY A 17 16.516 -3.517 27.319 1.00 63.12 C ATOM 241 O GLY A 17 17.636 -3.851 27.720 1.00 34.35 O ATOM 0 H GLY A 17 17.208 -2.495 29.485 1.00 73.12 H new ATOM 0 HA2 GLY A 17 14.725 -2.602 28.059 1.00 31.14 H new ATOM 0 HA3 GLY A 17 15.847 -1.481 27.313 1.00 31.14 H new ATOM 245 N ARG A 18 15.892 -4.134 26.329 1.00 71.41 N ATOM 246 CA ARG A 18 16.470 -5.281 25.635 1.00 64.41 C ATOM 247 C ARG A 18 15.984 -5.302 24.186 1.00 2.04 C ATOM 248 O ARG A 18 14.781 -5.331 23.938 1.00 73.24 O ATOM 249 CB ARG A 18 16.084 -6.574 26.377 1.00 30.54 C ATOM 250 CG ARG A 18 16.753 -7.847 25.852 1.00 21.30 C ATOM 251 CD ARG A 18 15.959 -8.511 24.729 1.00 2.42 C ATOM 252 NE ARG A 18 14.665 -9.009 25.202 1.00 61.43 N ATOM 253 CZ ARG A 18 13.911 -9.892 24.544 1.00 42.21 C ATOM 254 NH1 ARG A 18 14.296 -10.363 23.363 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 12.765 -10.295 25.069 1.00 11.32 N ATOM 0 H ARG A 18 14.973 -3.858 25.982 1.00 71.41 H new ATOM 0 HA ARG A 18 17.557 -5.205 25.625 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.335 -6.458 27.431 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.003 -6.699 26.318 1.00 30.54 H new ATOM 0 HG2 ARG A 18 17.752 -7.605 25.490 1.00 21.30 H new ATOM 0 HG3 ARG A 18 16.874 -8.554 26.673 1.00 21.30 H new ATOM 0 HD2 ARG A 18 15.801 -7.795 23.923 1.00 2.42 H new ATOM 0 HD3 ARG A 18 16.537 -9.337 24.313 1.00 2.42 H new ATOM 0 HE ARG A 18 14.317 -8.657 26.094 1.00 61.43 H new ATOM 0 HH11 ARG A 18 15.175 -10.050 22.951 1.00 65.11 H new ATOM 0 HH12 ARG A 18 13.713 -11.038 22.868 1.00 65.11 H new ATOM 0 HH21 ARG A 18 12.462 -9.931 25.972 1.00 11.32 H new ATOM 0 HH22 ARG A 18 12.185 -10.970 24.570 1.00 11.32 H new ATOM 269 N ALA A 19 16.918 -5.289 23.239 1.00 71.12 N ATOM 270 CA ALA A 19 16.578 -5.229 21.820 1.00 34.25 C ATOM 271 C ALA A 19 17.066 -6.479 21.089 1.00 41.03 C ATOM 272 O ALA A 19 18.253 -6.804 21.116 1.00 12.34 O ATOM 273 CB ALA A 19 17.180 -3.978 21.189 1.00 5.35 C ATOM 0 H ALA A 19 17.920 -5.319 23.429 1.00 71.12 H new ATOM 0 HA ALA A 19 15.493 -5.185 21.729 1.00 34.25 H new ATOM 0 HB1 ALA A 19 16.920 -3.943 20.131 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.786 -3.093 21.689 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.264 -4.002 21.296 1.00 5.35 H new ATOM 279 N THR A 20 16.143 -7.158 20.428 1.00 63.53 N ATOM 280 CA THR A 20 16.448 -8.357 19.665 1.00 0.02 C ATOM 281 C THR A 20 15.839 -8.245 18.274 1.00 61.21 C ATOM 282 O THR A 20 14.617 -8.245 18.121 1.00 50.32 O ATOM 283 CB THR A 20 15.893 -9.618 20.374 1.00 22.13 C ATOM 284 OG1 THR A 20 16.343 -9.650 21.741 1.00 4.20 O ATOM 285 CG2 THR A 20 16.332 -10.898 19.660 1.00 30.30 C ATOM 0 H THR A 20 15.158 -6.892 20.405 1.00 63.53 H new ATOM 0 HA THR A 20 17.531 -8.452 19.588 1.00 0.02 H new ATOM 0 HB THR A 20 14.805 -9.567 20.345 1.00 22.13 H new ATOM 0 HG1 THR A 20 17.110 -10.255 21.819 1.00 4.20 H new ATOM 0 HG21 THR A 20 15.926 -11.764 20.183 1.00 30.30 H new ATOM 0 HG22 THR A 20 15.963 -10.887 18.634 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.420 -10.956 19.653 1.00 30.30 H new ATOM 293 N SER A 21 16.684 -8.128 17.259 1.00 52.22 N ATOM 294 CA SER A 21 16.205 -8.073 15.893 1.00 61.23 C ATOM 295 C SER A 21 15.621 -9.432 15.545 1.00 4.01 C ATOM 296 O SER A 21 16.368 -10.421 15.407 1.00 53.51 O ATOM 297 CB SER A 21 17.313 -7.677 14.921 1.00 62.30 C ATOM 298 OG SER A 21 16.827 -7.615 13.595 1.00 0.33 O ATOM 0 H SER A 21 17.697 -8.070 17.359 1.00 52.22 H new ATOM 0 HA SER A 21 15.437 -7.304 15.805 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.723 -6.709 15.207 1.00 62.30 H new ATOM 0 HB3 SER A 21 18.128 -8.398 14.980 1.00 62.30 H new ATOM 0 HG SER A 21 17.355 -6.967 13.083 1.00 0.33 H new ATOM 304 N HIS A 22 14.286 -9.424 15.398 1.00 22.03 N ATOM 305 CA HIS A 22 13.417 -10.607 15.379 1.00 2.11 C ATOM 306 C HIS A 22 13.908 -11.702 14.455 1.00 71.44 C ATOM 307 O HIS A 22 13.861 -12.884 14.805 1.00 63.31 O ATOM 308 CB HIS A 22 11.999 -10.174 14.964 1.00 42.33 C ATOM 309 CG HIS A 22 11.118 -11.290 14.488 1.00 64.41 C ATOM 310 ND1 HIS A 22 10.967 -11.612 13.155 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.318 -12.146 15.167 1.00 33.23 C ATOM 312 CE1 HIS A 22 10.118 -12.610 13.039 1.00 21.33 C ATOM 313 NE2 HIS A 22 9.706 -12.955 14.243 1.00 41.54 N ATOM 0 H HIS A 22 13.763 -8.556 15.285 1.00 22.03 H new ATOM 0 HA HIS A 22 13.423 -11.029 16.384 1.00 2.11 H new ATOM 0 HB2 HIS A 22 11.519 -9.687 15.813 1.00 42.33 H new ATOM 0 HB3 HIS A 22 12.078 -9.429 14.172 1.00 42.33 H new ATOM 0 HD1 HIS A 22 11.440 -11.148 12.380 1.00 70.44 H new ATOM 0 HD2 HIS A 22 10.186 -12.185 16.238 1.00 33.23 H new ATOM 0 HE1 HIS A 22 9.810 -13.070 12.112 1.00 21.33 H new ATOM 322 N ASP A 23 14.409 -11.314 13.299 1.00 65.30 N ATOM 323 CA ASP A 23 14.817 -12.274 12.277 1.00 52.23 C ATOM 324 C ASP A 23 16.198 -12.841 12.598 1.00 2.53 C ATOM 325 O ASP A 23 16.930 -13.278 11.707 1.00 21.54 O ATOM 326 CB ASP A 23 14.794 -11.605 10.893 1.00 41.44 C ATOM 327 CG ASP A 23 13.380 -11.263 10.437 1.00 73.43 C ATOM 328 OD1 ASP A 23 12.732 -10.391 11.066 1.00 71.33 O ATOM 329 OD2 ASP A 23 12.900 -11.862 9.451 1.00 13.13 O1- ATOM 0 H ASP A 23 14.546 -10.338 13.038 1.00 65.30 H new ATOM 0 HA ASP A 23 14.113 -13.106 12.266 1.00 52.23 H new ATOM 0 HB2 ASP A 23 15.394 -10.695 10.922 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.258 -12.269 10.164 1.00 41.44 H new ATOM 334 N GLN A 24 16.531 -12.836 13.897 1.00 30.45 N ATOM 335 CA GLN A 24 17.773 -13.398 14.411 1.00 23.53 C ATOM 336 C GLN A 24 18.956 -12.584 13.911 1.00 71.34 C ATOM 337 O GLN A 24 20.074 -13.087 13.772 1.00 22.01 O ATOM 338 CB GLN A 24 17.909 -14.883 14.024 1.00 42.54 C ATOM 339 CG GLN A 24 16.784 -15.763 14.564 1.00 72.53 C ATOM 340 CD GLN A 24 16.640 -15.672 16.075 1.00 14.50 C ATOM 341 OE1 GLN A 24 17.282 -16.416 16.817 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.785 -14.769 16.540 1.00 4.22 N ATOM 0 H GLN A 24 15.935 -12.436 14.621 1.00 30.45 H new ATOM 0 HA GLN A 24 17.757 -13.348 15.500 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.933 -14.965 12.937 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.863 -15.260 14.394 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.844 -15.472 14.096 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.972 -16.799 14.283 1.00 72.53 H new ATOM 0 HE21 GLN A 24 15.272 -14.171 15.892 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.641 -14.673 17.545 1.00 4.22 H new ATOM 351 N LYS A 25 18.694 -11.309 13.660 1.00 22.35 N ATOM 352 CA LYS A 25 19.721 -10.400 13.189 1.00 24.04 C ATOM 353 C LYS A 25 20.478 -9.809 14.374 1.00 45.31 C ATOM 354 O LYS A 25 21.668 -9.512 14.262 1.00 73.44 O ATOM 355 CB LYS A 25 19.111 -9.275 12.336 1.00 30.31 C ATOM 356 CG LYS A 25 18.195 -9.756 11.211 1.00 12.14 C ATOM 357 CD LYS A 25 18.933 -10.619 10.190 1.00 61.23 C ATOM 358 CE LYS A 25 18.003 -11.079 9.068 1.00 52.51 C ATOM 359 NZ LYS A 25 18.694 -11.971 8.100 1.00 22.01 N1+ ATOM 0 H LYS A 25 17.775 -10.883 13.776 1.00 22.35 H new ATOM 0 HA LYS A 25 20.416 -10.962 12.565 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.546 -8.609 12.987 1.00 30.31 H new ATOM 0 HB3 LYS A 25 19.919 -8.686 11.902 1.00 30.31 H new ATOM 0 HG2 LYS A 25 17.370 -10.327 11.637 1.00 12.14 H new ATOM 0 HG3 LYS A 25 17.759 -8.893 10.707 1.00 12.14 H new ATOM 0 HD2 LYS A 25 19.763 -10.054 9.767 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.361 -11.489 10.689 1.00 61.23 H new ATOM 0 HE2 LYS A 25 17.149 -11.603 9.497 1.00 52.51 H new ATOM 0 HE3 LYS A 25 17.611 -10.208 8.542 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 18.027 -12.259 7.356 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 19.494 -11.464 7.670 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 19.046 -12.815 8.596 1.00 22.01 H new ATOM 373 N LEU A 26 19.799 -9.642 15.523 1.00 32.33 N ATOM 374 CA LEU A 26 20.450 -9.027 16.685 1.00 24.31 C ATOM 375 C LEU A 26 19.813 -9.486 17.992 1.00 21.31 C ATOM 376 O LEU A 26 18.632 -9.802 18.026 1.00 11.34 O ATOM 377 CB LEU A 26 20.363 -7.499 16.561 1.00 35.55 C ATOM 378 CG LEU A 26 20.777 -6.689 17.800 1.00 2.25 C ATOM 379 CD1 LEU A 26 22.267 -6.847 18.097 1.00 31.22 C ATOM 380 CD2 LEU A 26 20.401 -5.224 17.609 1.00 74.42 C ATOM 0 H LEU A 26 18.827 -9.917 15.667 1.00 32.33 H new ATOM 0 HA LEU A 26 21.494 -9.340 16.703 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.989 -7.188 15.724 1.00 35.55 H new ATOM 0 HB3 LEU A 26 19.337 -7.235 16.307 1.00 35.55 H new ATOM 0 HG LEU A 26 20.238 -7.077 18.664 1.00 2.25 H new ATOM 0 HD11 LEU A 26 22.526 -6.261 18.979 1.00 31.22 H new ATOM 0 HD12 LEU A 26 22.492 -7.898 18.280 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.847 -6.495 17.244 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.697 -4.655 18.490 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.914 -4.828 16.732 1.00 74.42 H new ATOM 0 HD23 LEU A 26 19.323 -5.140 17.468 1.00 74.42 H new ATOM 392 N ASP A 27 20.614 -9.517 19.059 1.00 3.11 N ATOM 393 CA ASP A 27 20.118 -9.794 20.408 1.00 12.11 C ATOM 394 C ASP A 27 21.047 -9.180 21.453 1.00 11.44 C ATOM 395 O ASP A 27 22.116 -9.723 21.745 1.00 42.31 O ATOM 396 CB ASP A 27 19.983 -11.303 20.663 1.00 5.04 C ATOM 397 CG ASP A 27 19.666 -11.615 22.122 1.00 74.13 C ATOM 398 OD1 ASP A 27 20.505 -12.246 22.802 1.00 54.23 O ATOM 399 OD2 ASP A 27 18.590 -11.205 22.605 1.00 11.42 O1- ATOM 0 H ASP A 27 21.619 -9.352 19.013 1.00 3.11 H new ATOM 0 HA ASP A 27 19.129 -9.344 20.490 1.00 12.11 H new ATOM 0 HB2 ASP A 27 19.196 -11.708 20.027 1.00 5.04 H new ATOM 0 HB3 ASP A 27 20.910 -11.802 20.380 1.00 5.04 H new ATOM 404 N VAL A 28 20.643 -8.032 21.990 1.00 5.03 N ATOM 405 CA VAL A 28 21.397 -7.341 23.038 1.00 42.02 C ATOM 406 C VAL A 28 20.465 -6.651 24.030 1.00 62.12 C ATOM 407 O VAL A 28 19.243 -6.642 23.864 1.00 32.30 O ATOM 408 CB VAL A 28 22.378 -6.285 22.462 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.604 -6.956 21.849 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.671 -5.394 21.441 1.00 1.00 C ATOM 0 H VAL A 28 19.786 -7.553 21.713 1.00 5.03 H new ATOM 0 HA VAL A 28 21.974 -8.113 23.548 1.00 42.02 H new ATOM 0 HB VAL A 28 22.720 -5.654 23.282 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.276 -6.194 21.453 1.00 34.22 H new ATOM 0 HG12 VAL A 28 24.122 -7.535 22.614 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.291 -7.619 21.042 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.375 -4.660 21.049 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.293 -6.007 20.623 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.840 -4.878 21.922 1.00 1.00 H new ATOM 420 N LYS A 29 21.066 -6.065 25.055 1.00 24.10 N ATOM 421 CA LYS A 29 20.343 -5.365 26.107 1.00 44.35 C ATOM 422 C LYS A 29 20.976 -4.003 26.348 1.00 43.02 C ATOM 423 O LYS A 29 22.199 -3.854 26.272 1.00 12.55 O ATOM 424 CB LYS A 29 20.361 -6.209 27.393 1.00 13.02 C ATOM 425 CG LYS A 29 20.592 -5.418 28.686 1.00 22.53 C ATOM 426 CD LYS A 29 20.716 -6.351 29.893 1.00 24.23 C ATOM 427 CE LYS A 29 21.275 -5.650 31.128 1.00 1.41 C ATOM 428 NZ LYS A 29 20.420 -4.522 31.586 1.00 62.42 N1+ ATOM 0 H LYS A 29 22.078 -6.062 25.181 1.00 24.10 H new ATOM 0 HA LYS A 29 19.307 -5.215 25.802 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.412 -6.740 27.474 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.142 -6.964 27.303 1.00 13.02 H new ATOM 0 HG2 LYS A 29 21.498 -4.819 28.592 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.766 -4.724 28.843 1.00 22.53 H new ATOM 0 HD2 LYS A 29 19.736 -6.765 30.129 1.00 24.23 H new ATOM 0 HD3 LYS A 29 21.362 -7.190 29.633 1.00 24.23 H new ATOM 0 HE2 LYS A 29 21.377 -6.374 31.936 1.00 1.41 H new ATOM 0 HE3 LYS A 29 22.275 -5.276 30.907 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 20.377 -4.518 32.625 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 20.823 -3.623 31.253 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 19.461 -4.635 31.200 1.00 62.42 H new ATOM 442 N LEU A 30 20.147 -3.010 26.632 1.00 2.53 N ATOM 443 CA LEU A 30 20.632 -1.678 26.933 1.00 41.03 C ATOM 444 C LEU A 30 20.061 -1.175 28.261 1.00 64.12 C ATOM 445 O LEU A 30 19.044 -1.704 28.781 1.00 54.30 O ATOM 446 CB LEU A 30 20.367 -0.693 25.764 1.00 11.12 C ATOM 447 CG LEU A 30 19.012 -0.800 25.035 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.928 -2.066 24.179 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.865 -0.739 26.027 1.00 54.12 C ATOM 0 H LEU A 30 19.132 -3.105 26.660 1.00 2.53 H new ATOM 0 HA LEU A 30 21.715 -1.733 27.048 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.461 0.322 26.151 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.158 -0.827 25.026 1.00 11.12 H new ATOM 0 HG LEU A 30 18.931 0.053 24.361 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.959 -2.105 23.682 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.720 -2.052 23.430 1.00 21.32 H new ATOM 0 HD13 LEU A 30 19.045 -2.944 24.815 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.918 -0.816 25.493 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.951 -1.564 26.734 1.00 54.12 H new ATOM 0 HD23 LEU A 30 17.901 0.207 26.567 1.00 54.12 H new ATOM 461 N SER A 31 20.742 -0.173 28.814 1.00 75.34 N ATOM 462 CA SER A 31 20.432 0.344 30.133 1.00 34.22 C ATOM 463 C SER A 31 20.953 1.773 30.293 1.00 62.41 C ATOM 464 O SER A 31 22.131 2.041 30.045 1.00 64.13 O ATOM 465 CB SER A 31 21.035 -0.571 31.206 1.00 52.23 C ATOM 466 OG SER A 31 20.497 -1.885 31.115 1.00 11.31 O ATOM 0 H SER A 31 21.522 0.298 28.356 1.00 75.34 H new ATOM 0 HA SER A 31 19.349 0.365 30.253 1.00 34.22 H new ATOM 0 HB2 SER A 31 22.118 -0.609 31.090 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.834 -0.159 32.195 1.00 52.23 H new ATOM 0 HG SER A 31 19.833 -2.016 31.823 1.00 11.31 H new ATOM 472 N ALA A 32 20.063 2.677 30.698 1.00 52.21 N ATOM 473 CA ALA A 32 20.412 4.075 30.927 1.00 43.51 C ATOM 474 C ALA A 32 21.465 4.207 32.034 1.00 25.12 C ATOM 475 O ALA A 32 21.417 3.485 33.038 1.00 4.30 O ATOM 476 CB ALA A 32 19.161 4.876 31.281 1.00 22.44 C ATOM 0 H ALA A 32 19.082 2.460 30.876 1.00 52.21 H new ATOM 0 HA ALA A 32 20.841 4.476 30.008 1.00 43.51 H new ATOM 0 HB1 ALA A 32 19.432 5.918 31.450 1.00 22.44 H new ATOM 0 HB2 ALA A 32 18.446 4.815 30.461 1.00 22.44 H new ATOM 0 HB3 ALA A 32 18.711 4.467 32.185 1.00 22.44 H new ATOM 482 N PRO A 33 22.425 5.137 31.869 1.00 32.33 N ATOM 483 CA PRO A 33 23.508 5.341 32.839 1.00 35.40 C ATOM 484 C PRO A 33 22.981 5.798 34.201 1.00 50.42 C ATOM 485 O PRO A 33 22.232 6.774 34.300 1.00 70.53 O ATOM 486 CB PRO A 33 24.376 6.432 32.192 1.00 73.33 C ATOM 487 CG PRO A 33 23.467 7.125 31.232 1.00 10.15 C ATOM 488 CD PRO A 33 22.528 6.064 30.726 1.00 32.53 C ATOM 0 HA PRO A 33 24.056 4.421 33.042 1.00 35.40 H new ATOM 0 HB2 PRO A 33 24.763 7.124 32.940 1.00 73.33 H new ATOM 0 HB3 PRO A 33 25.237 6.001 31.681 1.00 73.33 H new ATOM 0 HG2 PRO A 33 22.920 7.931 31.722 1.00 10.15 H new ATOM 0 HG3 PRO A 33 24.030 7.573 30.413 1.00 10.15 H new ATOM 0 HD2 PRO A 33 21.558 6.480 30.455 1.00 32.53 H new ATOM 0 HD3 PRO A 33 22.921 5.568 29.838 1.00 32.53 H new ATOM 496 N ARG A 34 23.395 5.095 35.251 1.00 10.53 N ATOM 497 CA ARG A 34 22.964 5.400 36.618 1.00 33.33 C ATOM 498 C ARG A 34 23.506 6.756 37.055 1.00 40.12 C ATOM 499 O ARG A 34 23.022 7.346 38.021 1.00 0.24 O ATOM 500 CB ARG A 34 23.465 4.313 37.578 1.00 35.21 C ATOM 501 CG ARG A 34 22.825 4.346 38.959 1.00 34.41 C ATOM 502 CD ARG A 34 21.394 3.821 38.941 1.00 50.12 C ATOM 503 NE ARG A 34 20.790 3.826 40.276 1.00 3.50 N ATOM 504 CZ ARG A 34 20.109 2.803 40.800 1.00 2.33 C ATOM 505 NH1 ARG A 34 19.984 1.661 40.131 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 19.575 2.917 42.008 1.00 21.42 N ATOM 0 H ARG A 34 24.034 4.303 35.183 1.00 10.53 H new ATOM 0 HA ARG A 34 21.875 5.430 36.641 1.00 33.33 H new ATOM 0 HB2 ARG A 34 23.281 3.337 37.129 1.00 35.21 H new ATOM 0 HB3 ARG A 34 24.545 4.414 37.689 1.00 35.21 H new ATOM 0 HG2 ARG A 34 23.421 3.748 39.649 1.00 34.41 H new ATOM 0 HG3 ARG A 34 22.831 5.369 39.336 1.00 34.41 H new ATOM 0 HD2 ARG A 34 20.792 4.432 38.269 1.00 50.12 H new ATOM 0 HD3 ARG A 34 21.385 2.806 38.543 1.00 50.12 H new ATOM 0 HE ARG A 34 20.897 4.667 40.843 1.00 3.50 H new ATOM 0 HH11 ARG A 34 20.410 1.560 39.210 1.00 23.02 H new ATOM 0 HH12 ARG A 34 19.462 0.885 40.539 1.00 23.02 H new ATOM 0 HH21 ARG A 34 19.685 3.784 42.534 1.00 21.42 H new ATOM 0 HH22 ARG A 34 19.054 2.138 42.411 1.00 21.42 H new ATOM 520 N GLU A 35 24.505 7.237 36.314 1.00 72.31 N ATOM 521 CA GLU A 35 25.218 8.476 36.628 1.00 75.14 C ATOM 522 C GLU A 35 24.265 9.594 37.033 1.00 65.21 C ATOM 523 O GLU A 35 24.441 10.236 38.069 1.00 33.12 O ATOM 524 CB GLU A 35 26.041 8.935 35.415 1.00 20.34 C ATOM 525 CG GLU A 35 26.910 7.846 34.794 1.00 71.30 C ATOM 526 CD GLU A 35 27.736 7.082 35.815 1.00 31.03 C ATOM 527 OE1 GLU A 35 28.794 7.591 36.239 1.00 31.45 O ATOM 528 OE2 GLU A 35 27.335 5.961 36.185 1.00 43.03 O1- ATOM 0 H GLU A 35 24.845 6.773 35.471 1.00 72.31 H new ATOM 0 HA GLU A 35 25.876 8.264 37.471 1.00 75.14 H new ATOM 0 HB2 GLU A 35 25.361 9.318 34.654 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.680 9.764 35.718 1.00 20.34 H new ATOM 0 HG2 GLU A 35 26.272 7.145 34.255 1.00 71.30 H new ATOM 0 HG3 GLU A 35 27.578 8.298 34.061 1.00 71.30 H new ATOM 535 N LEU A 36 23.256 9.814 36.204 1.00 33.22 N ATOM 536 CA LEU A 36 22.322 10.915 36.395 1.00 32.24 C ATOM 537 C LEU A 36 21.056 10.420 37.086 1.00 55.25 C ATOM 538 O LEU A 36 20.528 11.073 37.988 1.00 40.24 O ATOM 539 CB LEU A 36 21.997 11.540 35.035 1.00 11.21 C ATOM 540 CG LEU A 36 23.234 11.877 34.183 1.00 24.22 C ATOM 541 CD1 LEU A 36 22.832 12.434 32.823 1.00 52.21 C ATOM 542 CD2 LEU A 36 24.150 12.854 34.919 1.00 63.44 C ATOM 0 H LEU A 36 23.061 9.239 35.384 1.00 33.22 H new ATOM 0 HA LEU A 36 22.775 11.674 37.033 1.00 32.24 H new ATOM 0 HB2 LEU A 36 21.360 10.854 34.476 1.00 11.21 H new ATOM 0 HB3 LEU A 36 21.421 12.451 35.195 1.00 11.21 H new ATOM 0 HG LEU A 36 23.785 10.952 34.015 1.00 24.22 H new ATOM 0 HD11 LEU A 36 23.727 12.662 32.244 1.00 52.21 H new ATOM 0 HD12 LEU A 36 22.234 11.695 32.290 1.00 52.21 H new ATOM 0 HD13 LEU A 36 22.247 13.343 32.961 1.00 52.21 H new ATOM 0 HD21 LEU A 36 25.017 13.078 34.298 1.00 63.44 H new ATOM 0 HD22 LEU A 36 23.606 13.775 35.128 1.00 63.44 H new ATOM 0 HD23 LEU A 36 24.481 12.407 35.856 1.00 63.44 H new ATOM 554 N GLY A 37 20.590 9.253 36.663 1.00 72.22 N ATOM 555 CA GLY A 37 19.414 8.651 37.262 1.00 12.23 C ATOM 556 C GLY A 37 18.879 7.515 36.419 1.00 31.23 C ATOM 557 O GLY A 37 17.678 7.431 36.173 1.00 41.24 O ATOM 0 H GLY A 37 21.009 8.708 35.909 1.00 72.22 H new ATOM 0 HA2 GLY A 37 19.661 8.281 38.257 1.00 12.23 H new ATOM 0 HA3 GLY A 37 18.640 9.408 37.386 1.00 12.23 H new ATOM 561 N GLY A 38 19.781 6.651 35.958 1.00 73.44 N ATOM 562 CA GLY A 38 19.380 5.519 35.141 1.00 31.42 C ATOM 563 C GLY A 38 19.320 4.233 35.941 1.00 22.15 C ATOM 564 O GLY A 38 18.796 4.212 37.055 1.00 21.21 O ATOM 0 H GLY A 38 20.783 6.716 36.136 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.403 5.718 34.701 1.00 31.42 H new ATOM 0 HA3 GLY A 38 20.083 5.400 34.316 1.00 31.42 H new ATOM 568 N ALA A 39 19.882 3.165 35.387 1.00 14.21 N ATOM 569 CA ALA A 39 19.848 1.851 36.029 1.00 43.43 C ATOM 570 C ALA A 39 21.248 1.391 36.434 1.00 63.22 C ATOM 571 O ALA A 39 21.405 0.652 37.405 1.00 3.43 O ATOM 572 CB ALA A 39 19.197 0.828 35.102 1.00 5.43 C ATOM 0 H ALA A 39 20.369 3.181 34.491 1.00 14.21 H new ATOM 0 HA ALA A 39 19.252 1.936 36.937 1.00 43.43 H new ATOM 0 HB1 ALA A 39 19.178 -0.146 35.591 1.00 5.43 H new ATOM 0 HB2 ALA A 39 18.178 1.140 34.874 1.00 5.43 H new ATOM 0 HB3 ALA A 39 19.770 0.758 34.177 1.00 5.43 H new ATOM 578 N GLY A 40 22.260 1.865 35.708 1.00 15.31 N ATOM 579 CA GLY A 40 23.631 1.423 35.939 1.00 42.15 C ATOM 580 C GLY A 40 23.812 -0.066 35.734 1.00 45.53 C ATOM 581 O GLY A 40 24.608 -0.704 36.421 1.00 15.12 O ATOM 0 H GLY A 40 22.156 2.551 34.960 1.00 15.31 H new ATOM 0 HA2 GLY A 40 24.299 1.961 35.267 1.00 42.15 H new ATOM 0 HA3 GLY A 40 23.925 1.683 36.956 1.00 42.15 H new ATOM 585 N ALA A 41 23.070 -0.617 34.786 1.00 5.32 N ATOM 586 CA ALA A 41 23.135 -2.041 34.481 1.00 5.21 C ATOM 587 C ALA A 41 24.076 -2.291 33.308 1.00 44.21 C ATOM 588 O ALA A 41 24.350 -1.378 32.523 1.00 13.22 O ATOM 589 CB ALA A 41 21.742 -2.574 34.172 1.00 40.21 C ATOM 0 H ALA A 41 22.410 -0.096 34.209 1.00 5.32 H new ATOM 0 HA ALA A 41 23.525 -2.569 35.351 1.00 5.21 H new ATOM 0 HB1 ALA A 41 21.802 -3.639 33.945 1.00 40.21 H new ATOM 0 HB2 ALA A 41 21.095 -2.423 35.036 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.331 -2.043 33.313 1.00 40.21 H new ATOM 595 N GLU A 42 24.570 -3.522 33.197 1.00 32.32 N ATOM 596 CA GLU A 42 25.449 -3.911 32.096 1.00 71.23 C ATOM 597 C GLU A 42 24.696 -3.875 30.762 1.00 1.12 C ATOM 598 O GLU A 42 24.223 -4.894 30.255 1.00 55.43 O ATOM 599 CB GLU A 42 26.048 -5.300 32.357 1.00 42.31 C ATOM 600 CG GLU A 42 25.004 -6.373 32.626 1.00 52.14 C ATOM 601 CD GLU A 42 25.617 -7.688 33.077 1.00 31.41 C ATOM 602 OE1 GLU A 42 25.901 -8.550 32.214 1.00 24.22 O ATOM 603 OE2 GLU A 42 25.833 -7.863 34.294 1.00 54.53 O1- ATOM 0 H GLU A 42 24.375 -4.272 33.861 1.00 32.32 H new ATOM 0 HA GLU A 42 26.268 -3.194 32.035 1.00 71.23 H new ATOM 0 HB2 GLU A 42 26.647 -5.596 31.496 1.00 42.31 H new ATOM 0 HB3 GLU A 42 26.724 -5.241 33.210 1.00 42.31 H new ATOM 0 HG2 GLU A 42 24.313 -6.018 33.390 1.00 52.14 H new ATOM 0 HG3 GLU A 42 24.420 -6.541 31.721 1.00 52.14 H new ATOM 610 N GLY A 43 24.550 -2.676 30.233 1.00 3.30 N ATOM 611 CA GLY A 43 23.883 -2.480 28.961 1.00 20.41 C ATOM 612 C GLY A 43 24.505 -1.352 28.166 1.00 55.55 C ATOM 613 O GLY A 43 25.532 -0.800 28.562 1.00 25.21 O ATOM 0 H GLY A 43 24.887 -1.817 30.668 1.00 3.30 H new ATOM 0 HA2 GLY A 43 23.929 -3.402 28.381 1.00 20.41 H new ATOM 0 HA3 GLY A 43 22.829 -2.264 29.133 1.00 20.41 H new ATOM 617 N THR A 44 23.885 -1.013 27.044 1.00 1.14 N ATOM 618 CA THR A 44 24.379 0.047 26.177 1.00 0.00 C ATOM 619 C THR A 44 23.521 1.307 26.333 1.00 54.32 C ATOM 620 O THR A 44 22.388 1.234 26.813 1.00 53.24 O ATOM 621 CB THR A 44 24.361 -0.423 24.701 1.00 74.01 C ATOM 622 OG1 THR A 44 25.030 -1.687 24.589 1.00 60.01 O ATOM 623 CG2 THR A 44 25.037 0.588 23.778 1.00 54.14 C ATOM 0 H THR A 44 23.032 -1.462 26.711 1.00 1.14 H new ATOM 0 HA THR A 44 25.404 0.282 26.464 1.00 0.00 H new ATOM 0 HB THR A 44 23.319 -0.519 24.395 1.00 74.01 H new ATOM 0 HG1 THR A 44 25.016 -1.983 23.655 1.00 60.01 H new ATOM 0 HG21 THR A 44 25.004 0.222 22.752 1.00 54.14 H new ATOM 0 HG22 THR A 44 24.515 1.543 23.840 1.00 54.14 H new ATOM 0 HG23 THR A 44 26.075 0.721 24.083 1.00 54.14 H new ATOM 631 N ASN A 45 24.077 2.458 25.953 1.00 72.33 N ATOM 632 CA ASN A 45 23.322 3.710 25.920 1.00 33.43 C ATOM 633 C ASN A 45 22.479 3.772 24.643 1.00 24.30 C ATOM 634 O ASN A 45 23.025 3.689 23.536 1.00 63.01 O ATOM 635 CB ASN A 45 24.267 4.926 25.972 1.00 4.20 C ATOM 636 CG ASN A 45 24.986 5.080 27.302 1.00 5.33 C ATOM 637 OD1 ASN A 45 24.474 4.704 28.350 1.00 50.31 O ATOM 638 ND2 ASN A 45 26.185 5.644 27.267 1.00 41.45 N ATOM 0 H ASN A 45 25.051 2.549 25.663 1.00 72.33 H new ATOM 0 HA ASN A 45 22.671 3.740 26.794 1.00 33.43 H new ATOM 0 HB2 ASN A 45 25.007 4.835 25.177 1.00 4.20 H new ATOM 0 HB3 ASN A 45 23.693 5.831 25.772 1.00 4.20 H new ATOM 0 HD21 ASN A 45 26.712 5.777 28.130 1.00 41.45 H new ATOM 0 HD22 ASN A 45 26.581 5.945 26.377 1.00 41.45 H new ATOM 645 N PRO A 46 21.145 3.908 24.769 1.00 63.04 N ATOM 646 CA PRO A 46 20.240 3.990 23.609 1.00 61.02 C ATOM 647 C PRO A 46 20.607 5.153 22.683 1.00 4.44 C ATOM 648 O PRO A 46 20.695 4.994 21.461 1.00 23.02 O ATOM 649 CB PRO A 46 18.854 4.205 24.244 1.00 23.35 C ATOM 650 CG PRO A 46 18.991 3.692 25.640 1.00 42.23 C ATOM 651 CD PRO A 46 20.407 3.991 26.047 1.00 1.14 C ATOM 0 HA PRO A 46 20.289 3.100 22.981 1.00 61.02 H new ATOM 0 HB2 PRO A 46 18.574 5.258 24.235 1.00 23.35 H new ATOM 0 HB3 PRO A 46 18.081 3.665 23.698 1.00 23.35 H new ATOM 0 HG2 PRO A 46 18.281 4.180 26.308 1.00 42.23 H new ATOM 0 HG3 PRO A 46 18.788 2.622 25.685 1.00 42.23 H new ATOM 0 HD2 PRO A 46 20.497 4.978 26.501 1.00 1.14 H new ATOM 0 HD3 PRO A 46 20.778 3.270 26.775 1.00 1.14 H new ATOM 659 N GLU A 47 20.848 6.311 23.289 1.00 25.31 N ATOM 660 CA GLU A 47 21.229 7.518 22.557 1.00 53.11 C ATOM 661 C GLU A 47 22.505 7.271 21.759 1.00 42.42 C ATOM 662 O GLU A 47 22.664 7.766 20.641 1.00 0.52 O ATOM 663 CB GLU A 47 21.424 8.690 23.534 1.00 52.55 C ATOM 664 CG GLU A 47 20.133 9.184 24.190 1.00 35.10 C ATOM 665 CD GLU A 47 19.317 8.064 24.819 1.00 32.04 C ATOM 666 OE1 GLU A 47 18.217 7.761 24.308 1.00 53.13 O ATOM 667 OE2 GLU A 47 19.795 7.453 25.801 1.00 62.13 O1- ATOM 0 H GLU A 47 20.785 6.441 24.299 1.00 25.31 H new ATOM 0 HA GLU A 47 20.430 7.774 21.861 1.00 53.11 H new ATOM 0 HB2 GLU A 47 22.121 8.385 24.315 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.887 9.520 23.000 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.380 9.920 24.955 1.00 35.10 H new ATOM 0 HG3 GLU A 47 19.525 9.693 23.443 1.00 35.10 H new ATOM 674 N GLN A 48 23.404 6.482 22.338 1.00 41.14 N ATOM 675 CA GLN A 48 24.643 6.108 21.675 1.00 71.11 C ATOM 676 C GLN A 48 24.333 5.240 20.461 1.00 34.04 C ATOM 677 O GLN A 48 24.961 5.378 19.414 1.00 32.22 O ATOM 678 CB GLN A 48 25.557 5.371 22.668 1.00 12.45 C ATOM 679 CG GLN A 48 26.929 4.981 22.120 1.00 72.35 C ATOM 680 CD GLN A 48 26.907 3.760 21.208 1.00 3.55 C ATOM 681 OE1 GLN A 48 27.710 3.649 20.284 1.00 43.42 O ATOM 682 NE2 GLN A 48 25.999 2.827 21.468 1.00 72.04 N ATOM 0 H GLN A 48 23.294 6.088 23.272 1.00 41.14 H new ATOM 0 HA GLN A 48 25.163 7.002 21.330 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.699 6.003 23.545 1.00 12.45 H new ATOM 0 HB3 GLN A 48 25.048 4.468 23.005 1.00 12.45 H new ATOM 0 HG2 GLN A 48 27.343 5.826 21.569 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.601 4.786 22.956 1.00 72.35 H new ATOM 0 HE21 GLN A 48 25.348 2.951 22.243 1.00 72.04 H new ATOM 0 HE22 GLN A 48 25.953 1.986 20.893 1.00 72.04 H new ATOM 691 N LEU A 49 23.352 4.357 20.610 1.00 51.33 N ATOM 692 CA LEU A 49 22.964 3.447 19.539 1.00 61.13 C ATOM 693 C LEU A 49 22.409 4.253 18.360 1.00 21.55 C ATOM 694 O LEU A 49 22.734 3.981 17.203 1.00 71.11 O ATOM 695 CB LEU A 49 21.933 2.424 20.065 1.00 4.20 C ATOM 696 CG LEU A 49 21.769 1.125 19.243 1.00 31.10 C ATOM 697 CD1 LEU A 49 21.074 1.384 17.910 1.00 0.52 C ATOM 698 CD2 LEU A 49 23.126 0.458 19.019 1.00 52.41 C ATOM 0 H LEU A 49 22.809 4.252 21.467 1.00 51.33 H new ATOM 0 HA LEU A 49 23.834 2.891 19.191 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.212 2.151 21.083 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.962 2.916 20.122 1.00 4.20 H new ATOM 0 HG LEU A 49 21.135 0.450 19.818 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.978 0.447 17.362 1.00 0.52 H new ATOM 0 HD12 LEU A 49 20.084 1.802 18.091 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.663 2.089 17.323 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.991 -0.455 18.439 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.781 1.140 18.477 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.574 0.213 19.982 1.00 52.41 H new ATOM 710 N PHE A 50 21.584 5.256 18.663 1.00 3.42 N ATOM 711 CA PHE A 50 21.044 6.145 17.632 1.00 25.51 C ATOM 712 C PHE A 50 22.158 6.964 16.983 1.00 64.45 C ATOM 713 O PHE A 50 22.199 7.102 15.764 1.00 15.22 O ATOM 714 CB PHE A 50 19.978 7.080 18.218 1.00 52.14 C ATOM 715 CG PHE A 50 19.554 8.200 17.287 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.775 7.944 16.163 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.930 9.511 17.543 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.382 8.963 15.326 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.538 10.535 16.702 1.00 34.34 C ATOM 720 CZ PHE A 50 18.761 10.257 15.592 1.00 61.21 C ATOM 0 H PHE A 50 21.276 5.473 19.611 1.00 3.42 H new ATOM 0 HA PHE A 50 20.578 5.523 16.868 1.00 25.51 H new ATOM 0 HB2 PHE A 50 19.100 6.491 18.483 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.360 7.515 19.141 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.474 6.930 15.944 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.536 9.733 18.409 1.00 31.01 H new ATOM 0 HE1 PHE A 50 17.775 8.746 14.459 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.838 11.551 16.911 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.452 11.056 14.935 1.00 61.21 H new ATOM 730 N ALA A 51 23.044 7.518 17.805 1.00 33.43 N ATOM 731 CA ALA A 51 24.167 8.311 17.308 1.00 33.33 C ATOM 732 C ALA A 51 25.049 7.481 16.375 1.00 4.13 C ATOM 733 O ALA A 51 25.371 7.904 15.261 1.00 52.03 O ATOM 734 CB ALA A 51 24.988 8.858 18.470 1.00 51.41 C ATOM 0 H ALA A 51 23.007 7.433 18.821 1.00 33.43 H new ATOM 0 HA ALA A 51 23.766 9.150 16.740 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.820 9.446 18.083 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.357 9.490 19.095 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.374 8.030 19.064 1.00 51.41 H new ATOM 740 N ALA A 52 25.424 6.293 16.836 1.00 32.43 N ATOM 741 CA ALA A 52 26.259 5.384 16.058 1.00 41.10 C ATOM 742 C ALA A 52 25.524 4.926 14.803 1.00 30.53 C ATOM 743 O ALA A 52 26.106 4.843 13.721 1.00 13.40 O ATOM 744 CB ALA A 52 26.672 4.187 16.908 1.00 51.43 C ATOM 0 H ALA A 52 25.160 5.934 17.754 1.00 32.43 H new ATOM 0 HA ALA A 52 27.160 5.915 15.750 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.295 3.517 16.315 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.235 4.533 17.775 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.782 3.654 17.243 1.00 51.43 H new ATOM 750 N GLY A 53 24.236 4.645 14.958 1.00 32.23 N ATOM 751 CA GLY A 53 23.416 4.232 13.836 1.00 45.35 C ATOM 752 C GLY A 53 23.262 5.328 12.798 1.00 24.44 C ATOM 753 O GLY A 53 23.327 5.066 11.601 1.00 23.31 O ATOM 0 H GLY A 53 23.742 4.697 15.849 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.860 3.353 13.369 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.431 3.937 14.198 1.00 45.35 H new ATOM 757 N TYR A 54 23.068 6.557 13.263 1.00 20.42 N ATOM 758 CA TYR A 54 22.886 7.712 12.385 1.00 1.52 C ATOM 759 C TYR A 54 24.174 7.987 11.609 1.00 10.14 C ATOM 760 O TYR A 54 24.146 8.201 10.395 1.00 3.35 O ATOM 761 CB TYR A 54 22.472 8.940 13.223 1.00 4.31 C ATOM 762 CG TYR A 54 22.165 10.217 12.441 1.00 71.40 C ATOM 763 CD1 TYR A 54 21.999 10.219 11.055 1.00 61.33 C ATOM 764 CD2 TYR A 54 22.035 11.432 13.112 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.720 11.391 10.370 1.00 65.13 C ATOM 766 CE2 TYR A 54 21.755 12.602 12.433 1.00 14.31 C ATOM 767 CZ TYR A 54 21.599 12.579 11.064 1.00 61.32 C ATOM 768 OH TYR A 54 21.326 13.747 10.386 1.00 14.13 O ATOM 0 H TYR A 54 23.032 6.783 14.257 1.00 20.42 H new ATOM 0 HA TYR A 54 22.095 7.502 11.665 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.590 8.675 13.807 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.271 9.156 13.932 1.00 4.31 H new ATOM 0 HD1 TYR A 54 22.089 9.292 10.508 1.00 61.33 H new ATOM 0 HD2 TYR A 54 22.156 11.459 14.185 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.598 11.375 9.297 1.00 65.13 H new ATOM 0 HE2 TYR A 54 21.659 13.532 12.973 1.00 14.31 H new ATOM 0 HH TYR A 54 20.840 13.540 9.561 1.00 14.13 H new ATOM 778 N SER A 55 25.303 7.959 12.312 1.00 11.10 N ATOM 779 CA SER A 55 26.599 8.173 11.683 1.00 22.53 C ATOM 780 C SER A 55 26.887 7.065 10.670 1.00 50.31 C ATOM 781 O SER A 55 27.285 7.335 9.540 1.00 23.31 O ATOM 782 CB SER A 55 27.703 8.242 12.746 1.00 0.44 C ATOM 783 OG SER A 55 27.618 7.150 13.645 1.00 35.10 O ATOM 0 H SER A 55 25.345 7.790 13.317 1.00 11.10 H new ATOM 0 HA SER A 55 26.578 9.124 11.151 1.00 22.53 H new ATOM 0 HB2 SER A 55 28.679 8.242 12.261 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.622 9.178 13.298 1.00 0.44 H new ATOM 0 HG SER A 55 26.913 7.323 14.304 1.00 35.10 H new ATOM 789 N ALA A 56 26.656 5.819 11.078 1.00 25.24 N ATOM 790 CA ALA A 56 26.841 4.670 10.193 1.00 63.14 C ATOM 791 C ALA A 56 25.933 4.783 8.965 1.00 34.41 C ATOM 792 O ALA A 56 26.374 4.577 7.832 1.00 72.41 O ATOM 793 CB ALA A 56 26.570 3.375 10.949 1.00 2.41 C ATOM 0 H ALA A 56 26.340 5.579 12.017 1.00 25.24 H new ATOM 0 HA ALA A 56 27.875 4.659 9.848 1.00 63.14 H new ATOM 0 HB1 ALA A 56 26.711 2.527 10.279 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.260 3.293 11.789 1.00 2.41 H new ATOM 0 HB3 ALA A 56 25.545 3.378 11.320 1.00 2.41 H new ATOM 799 N CYS A 57 24.669 5.130 9.205 1.00 43.11 N ATOM 800 CA CYS A 57 23.697 5.337 8.133 1.00 65.50 C ATOM 801 C CYS A 57 24.177 6.432 7.186 1.00 1.30 C ATOM 802 O CYS A 57 23.956 6.362 5.978 1.00 31.43 O ATOM 803 CB CYS A 57 22.315 5.699 8.701 1.00 74.40 C ATOM 804 SG CYS A 57 21.510 4.358 9.613 1.00 3.24 S ATOM 0 H CYS A 57 24.292 5.275 10.142 1.00 43.11 H new ATOM 0 HA CYS A 57 23.604 4.403 7.579 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.421 6.560 9.361 1.00 74.40 H new ATOM 0 HB3 CYS A 57 21.666 6.005 7.880 1.00 74.40 H new ATOM 0 HG CYS A 57 22.044 4.254 10.794 1.00 3.24 H new ATOM 810 N PHE A 58 24.824 7.449 7.750 1.00 12.51 N ATOM 811 CA PHE A 58 25.345 8.565 6.972 1.00 55.51 C ATOM 812 C PHE A 58 26.308 8.048 5.897 1.00 60.31 C ATOM 813 O PHE A 58 26.314 8.539 4.770 1.00 54.45 O ATOM 814 CB PHE A 58 26.050 9.569 7.902 1.00 64.12 C ATOM 815 CG PHE A 58 26.066 10.989 7.390 1.00 32.51 C ATOM 816 CD1 PHE A 58 27.143 11.479 6.663 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.996 11.838 7.647 1.00 40.52 C ATOM 818 CE1 PHE A 58 27.149 12.785 6.206 1.00 60.42 C ATOM 819 CE2 PHE A 58 25.000 13.141 7.191 1.00 51.42 C ATOM 820 CZ PHE A 58 26.076 13.615 6.470 1.00 5.31 C ATOM 0 H PHE A 58 25.000 7.521 8.752 1.00 12.51 H new ATOM 0 HA PHE A 58 24.519 9.076 6.477 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.558 9.552 8.875 1.00 64.12 H new ATOM 0 HB3 PHE A 58 27.077 9.241 8.059 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.984 10.835 6.452 1.00 53.31 H new ATOM 0 HD2 PHE A 58 24.150 11.473 8.211 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.993 13.156 5.643 1.00 60.42 H new ATOM 0 HE2 PHE A 58 24.161 13.789 7.399 1.00 51.42 H new ATOM 0 HZ PHE A 58 26.080 14.634 6.112 1.00 5.31 H new ATOM 830 N LEU A 59 27.100 7.032 6.253 1.00 64.51 N ATOM 831 CA LEU A 59 28.031 6.407 5.310 1.00 63.33 C ATOM 832 C LEU A 59 27.276 5.631 4.231 1.00 14.15 C ATOM 833 O LEU A 59 27.697 5.595 3.073 1.00 3.51 O ATOM 834 CB LEU A 59 29.016 5.465 6.032 1.00 74.12 C ATOM 835 CG LEU A 59 30.207 6.140 6.744 1.00 31.41 C ATOM 836 CD1 LEU A 59 31.026 6.977 5.764 1.00 61.22 C ATOM 837 CD2 LEU A 59 29.737 6.992 7.918 1.00 2.33 C ATOM 0 H LEU A 59 27.115 6.625 7.188 1.00 64.51 H new ATOM 0 HA LEU A 59 28.600 7.209 4.840 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.459 4.887 6.769 1.00 74.12 H new ATOM 0 HB3 LEU A 59 29.409 4.757 5.303 1.00 74.12 H new ATOM 0 HG LEU A 59 30.848 5.351 7.137 1.00 31.41 H new ATOM 0 HD11 LEU A 59 31.859 7.442 6.291 1.00 61.22 H new ATOM 0 HD12 LEU A 59 31.411 6.336 4.971 1.00 61.22 H new ATOM 0 HD13 LEU A 59 30.394 7.751 5.330 1.00 61.22 H new ATOM 0 HD21 LEU A 59 30.598 7.455 8.400 1.00 2.33 H new ATOM 0 HD22 LEU A 59 29.063 7.769 7.557 1.00 2.33 H new ATOM 0 HD23 LEU A 59 29.213 6.363 8.638 1.00 2.33 H new ATOM 849 N SER A 60 26.176 4.992 4.617 1.00 34.05 N ATOM 850 CA SER A 60 25.352 4.240 3.674 1.00 74.40 C ATOM 851 C SER A 60 24.663 5.190 2.688 1.00 42.34 C ATOM 852 O SER A 60 24.678 4.963 1.476 1.00 41.15 O ATOM 853 CB SER A 60 24.315 3.403 4.434 1.00 52.34 C ATOM 854 OG SER A 60 24.943 2.588 5.409 1.00 74.20 O ATOM 0 H SER A 60 25.833 4.979 5.578 1.00 34.05 H new ATOM 0 HA SER A 60 25.994 3.567 3.105 1.00 74.40 H new ATOM 0 HB2 SER A 60 23.592 4.061 4.915 1.00 52.34 H new ATOM 0 HB3 SER A 60 23.761 2.778 3.733 1.00 52.34 H new ATOM 0 HG SER A 60 25.126 1.704 5.028 1.00 74.20 H new ATOM 860 N ALA A 61 24.093 6.269 3.217 1.00 5.22 N ATOM 861 CA ALA A 61 23.390 7.256 2.404 1.00 61.10 C ATOM 862 C ALA A 61 24.364 7.975 1.474 1.00 23.52 C ATOM 863 O ALA A 61 24.142 8.052 0.265 1.00 64.15 O ATOM 864 CB ALA A 61 22.663 8.256 3.296 1.00 23.00 C ATOM 0 H ALA A 61 24.105 6.483 4.214 1.00 5.22 H new ATOM 0 HA ALA A 61 22.652 6.738 1.792 1.00 61.10 H new ATOM 0 HB1 ALA A 61 22.143 8.986 2.676 1.00 23.00 H new ATOM 0 HB2 ALA A 61 21.940 7.729 3.919 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.385 8.769 3.932 1.00 23.00 H new ATOM 870 N MET A 62 25.450 8.485 2.051 1.00 1.42 N ATOM 871 CA MET A 62 26.495 9.172 1.292 1.00 22.23 C ATOM 872 C MET A 62 27.050 8.246 0.206 1.00 52.25 C ATOM 873 O MET A 62 27.435 8.692 -0.877 1.00 52.11 O ATOM 874 CB MET A 62 27.617 9.617 2.246 1.00 12.31 C ATOM 875 CG MET A 62 28.710 10.483 1.619 1.00 13.45 C ATOM 876 SD MET A 62 28.173 12.166 1.231 1.00 13.34 S ATOM 877 CE MET A 62 27.496 11.972 -0.415 1.00 61.32 C ATOM 0 H MET A 62 25.631 8.435 3.054 1.00 1.42 H new ATOM 0 HA MET A 62 26.072 10.053 0.810 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.170 10.169 3.072 1.00 12.31 H new ATOM 0 HB3 MET A 62 28.082 8.728 2.672 1.00 12.31 H new ATOM 0 HG2 MET A 62 29.559 10.530 2.301 1.00 13.45 H new ATOM 0 HG3 MET A 62 29.061 10.004 0.705 1.00 13.45 H new ATOM 0 HE1 MET A 62 27.746 12.846 -1.017 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.916 11.080 -0.879 1.00 61.32 H new ATOM 0 HE3 MET A 62 26.412 11.872 -0.353 1.00 61.32 H new ATOM 887 N LYS A 63 27.068 6.947 0.506 1.00 50.31 N ATOM 888 CA LYS A 63 27.540 5.937 -0.436 1.00 32.21 C ATOM 889 C LYS A 63 26.571 5.812 -1.612 1.00 55.33 C ATOM 890 O LYS A 63 26.985 5.836 -2.771 1.00 31.21 O ATOM 891 CB LYS A 63 27.690 4.582 0.272 1.00 32.54 C ATOM 892 CG LYS A 63 28.395 3.515 -0.559 1.00 62.32 C ATOM 893 CD LYS A 63 28.464 2.161 0.158 1.00 52.53 C ATOM 894 CE LYS A 63 29.178 2.234 1.513 1.00 52.13 C ATOM 895 NZ LYS A 63 28.307 2.787 2.592 1.00 51.23 N1+ ATOM 0 H LYS A 63 26.758 6.570 1.402 1.00 50.31 H new ATOM 0 HA LYS A 63 28.513 6.245 -0.818 1.00 32.21 H new ATOM 0 HB2 LYS A 63 28.244 4.729 1.199 1.00 32.54 H new ATOM 0 HB3 LYS A 63 26.700 4.217 0.547 1.00 32.54 H new ATOM 0 HG2 LYS A 63 27.872 3.394 -1.508 1.00 62.32 H new ATOM 0 HG3 LYS A 63 29.405 3.850 -0.793 1.00 62.32 H new ATOM 0 HD2 LYS A 63 27.452 1.783 0.307 1.00 52.53 H new ATOM 0 HD3 LYS A 63 28.981 1.444 -0.480 1.00 52.53 H new ATOM 0 HE2 LYS A 63 29.513 1.236 1.797 1.00 52.13 H new ATOM 0 HE3 LYS A 63 30.069 2.854 1.417 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 28.723 2.569 3.520 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 28.229 3.818 2.481 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 27.361 2.359 2.528 1.00 51.23 H new ATOM 909 N PHE A 64 25.279 5.687 -1.301 1.00 54.13 N ATOM 910 CA PHE A 64 24.248 5.576 -2.331 1.00 15.41 C ATOM 911 C PHE A 64 24.249 6.824 -3.209 1.00 43.31 C ATOM 912 O PHE A 64 24.120 6.738 -4.433 1.00 31.42 O ATOM 913 CB PHE A 64 22.863 5.364 -1.702 1.00 54.23 C ATOM 914 CG PHE A 64 21.757 5.211 -2.720 1.00 22.52 C ATOM 915 CD1 PHE A 64 21.764 4.148 -3.614 1.00 70.34 C ATOM 916 CD2 PHE A 64 20.715 6.129 -2.791 1.00 44.41 C ATOM 917 CE1 PHE A 64 20.762 4.005 -4.554 1.00 70.35 C ATOM 918 CE2 PHE A 64 19.710 5.988 -3.728 1.00 31.33 C ATOM 919 CZ PHE A 64 19.733 4.926 -4.610 1.00 62.32 C ATOM 0 H PHE A 64 24.924 5.660 -0.345 1.00 54.13 H new ATOM 0 HA PHE A 64 24.473 4.708 -2.950 1.00 15.41 H new ATOM 0 HB2 PHE A 64 22.891 4.476 -1.071 1.00 54.23 H new ATOM 0 HB3 PHE A 64 22.634 6.209 -1.053 1.00 54.23 H new ATOM 0 HD1 PHE A 64 22.564 3.423 -3.574 1.00 70.34 H new ATOM 0 HD2 PHE A 64 20.691 6.963 -2.105 1.00 44.41 H new ATOM 0 HE1 PHE A 64 20.783 3.175 -5.244 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.906 6.708 -3.771 1.00 31.33 H new ATOM 0 HZ PHE A 64 18.948 4.815 -5.343 1.00 62.32 H new ATOM 929 N VAL A 65 24.405 7.983 -2.573 1.00 22.12 N ATOM 930 CA VAL A 65 24.533 9.242 -3.295 1.00 1.13 C ATOM 931 C VAL A 65 25.694 9.165 -4.277 1.00 2.04 C ATOM 932 O VAL A 65 25.535 9.441 -5.467 1.00 1.42 O ATOM 933 CB VAL A 65 24.755 10.437 -2.339 1.00 51.41 C ATOM 934 CG1 VAL A 65 25.150 11.688 -3.123 1.00 35.23 C ATOM 935 CG2 VAL A 65 23.506 10.695 -1.494 1.00 41.32 C ATOM 0 H VAL A 65 24.446 8.074 -1.558 1.00 22.12 H new ATOM 0 HA VAL A 65 23.598 9.404 -3.831 1.00 1.13 H new ATOM 0 HB VAL A 65 25.573 10.187 -1.664 1.00 51.41 H new ATOM 0 HG11 VAL A 65 25.302 12.517 -2.432 1.00 35.23 H new ATOM 0 HG12 VAL A 65 26.073 11.498 -3.670 1.00 35.23 H new ATOM 0 HG13 VAL A 65 24.357 11.942 -3.826 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.685 11.540 -0.829 1.00 41.32 H new ATOM 0 HG22 VAL A 65 22.664 10.920 -2.149 1.00 41.32 H new ATOM 0 HG23 VAL A 65 23.278 9.809 -0.902 1.00 41.32 H new ATOM 945 N ALA A 66 26.856 8.768 -3.773 1.00 10.53 N ATOM 946 CA ALA A 66 28.035 8.594 -4.609 1.00 34.24 C ATOM 947 C ALA A 66 27.727 7.647 -5.766 1.00 52.01 C ATOM 948 O ALA A 66 28.183 7.846 -6.894 1.00 55.45 O ATOM 949 CB ALA A 66 29.199 8.066 -3.779 1.00 2.15 C ATOM 0 H ALA A 66 27.006 8.560 -2.786 1.00 10.53 H new ATOM 0 HA ALA A 66 28.318 9.562 -5.022 1.00 34.24 H new ATOM 0 HB1 ALA A 66 30.074 7.941 -4.417 1.00 2.15 H new ATOM 0 HB2 ALA A 66 29.429 8.774 -2.983 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.928 7.105 -3.342 1.00 2.15 H new ATOM 955 N GLY A 67 26.894 6.653 -5.477 1.00 41.30 N ATOM 956 CA GLY A 67 26.550 5.640 -6.454 1.00 41.44 C ATOM 957 C GLY A 67 25.711 6.197 -7.584 1.00 65.01 C ATOM 958 O GLY A 67 25.854 5.787 -8.737 1.00 24.21 O ATOM 0 H GLY A 67 26.446 6.532 -4.569 1.00 41.30 H new ATOM 0 HA2 GLY A 67 27.463 5.206 -6.862 1.00 41.44 H new ATOM 0 HA3 GLY A 67 26.005 4.834 -5.963 1.00 41.44 H new ATOM 962 N GLN A 68 24.853 7.165 -7.265 1.00 2.22 N ATOM 963 CA GLN A 68 23.976 7.773 -8.264 1.00 3.22 C ATOM 964 C GLN A 68 24.655 9.011 -8.830 1.00 13.50 C ATOM 965 O GLN A 68 24.214 9.589 -9.821 1.00 73.33 O ATOM 966 CB GLN A 68 22.613 8.134 -7.655 1.00 70.02 C ATOM 967 CG GLN A 68 22.712 9.005 -6.409 1.00 23.14 C ATOM 968 CD GLN A 68 21.371 9.545 -5.953 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.679 8.930 -5.145 1.00 54.51 O ATOM 970 NE2 GLN A 68 20.994 10.703 -6.471 1.00 55.13 N ATOM 0 H GLN A 68 24.747 7.544 -6.324 1.00 2.22 H new ATOM 0 HA GLN A 68 23.796 7.056 -9.065 1.00 3.22 H new ATOM 0 HB2 GLN A 68 22.016 8.653 -8.404 1.00 70.02 H new ATOM 0 HB3 GLN A 68 22.082 7.216 -7.405 1.00 70.02 H new ATOM 0 HG2 GLN A 68 23.157 8.424 -5.601 1.00 23.14 H new ATOM 0 HG3 GLN A 68 23.384 9.840 -6.609 1.00 23.14 H new ATOM 0 HE21 GLN A 68 21.597 11.183 -7.139 1.00 55.13 H new ATOM 0 HE22 GLN A 68 20.101 11.115 -6.202 1.00 55.13 H new ATOM 979 N ASN A 69 25.735 9.410 -8.171 1.00 45.10 N ATOM 980 CA ASN A 69 26.557 10.529 -8.611 1.00 61.12 C ATOM 981 C ASN A 69 27.726 10.039 -9.463 1.00 41.24 C ATOM 982 O ASN A 69 28.536 10.841 -9.934 1.00 42.44 O ATOM 983 CB ASN A 69 27.076 11.314 -7.398 1.00 43.31 C ATOM 984 CG ASN A 69 26.059 12.291 -6.822 1.00 21.20 C ATOM 985 OD1 ASN A 69 24.786 11.925 -6.839 1.00 73.01 O flip ATOM 986 ND2 ASN A 69 26.423 13.368 -6.344 1.00 73.35 N flip ATOM 0 H ASN A 69 26.066 8.966 -7.315 1.00 45.10 H new ATOM 0 HA ASN A 69 25.941 11.189 -9.222 1.00 61.12 H new ATOM 0 HB2 ASN A 69 27.372 10.610 -6.620 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.971 11.864 -7.688 1.00 43.31 H new ATOM 0 HD21 ASN A 69 27.412 13.619 -6.347 1.00 73.35 H new ATOM 0 HD22 ASN A 69 25.735 14.008 -5.946 1.00 73.35 H new ATOM 993 N LYS A 70 27.807 8.715 -9.646 1.00 63.25 N ATOM 994 CA LYS A 70 28.840 8.091 -10.476 1.00 32.31 C ATOM 995 C LYS A 70 30.240 8.393 -9.944 1.00 12.34 C ATOM 996 O LYS A 70 31.218 8.419 -10.695 1.00 70.50 O ATOM 997 CB LYS A 70 28.690 8.542 -11.936 1.00 4.35 C ATOM 998 CG LYS A 70 27.649 7.749 -12.724 1.00 13.20 C ATOM 999 CD LYS A 70 26.342 7.576 -11.959 1.00 32.43 C ATOM 1000 CE LYS A 70 25.239 7.008 -12.848 1.00 4.32 C ATOM 1001 NZ LYS A 70 25.595 5.676 -13.409 1.00 52.12 N1+ ATOM 0 H LYS A 70 27.159 8.050 -9.223 1.00 63.25 H new ATOM 0 HA LYS A 70 28.706 7.010 -10.434 1.00 32.31 H new ATOM 0 HB2 LYS A 70 28.419 9.598 -11.954 1.00 4.35 H new ATOM 0 HB3 LYS A 70 29.655 8.452 -12.435 1.00 4.35 H new ATOM 0 HG2 LYS A 70 27.449 8.256 -13.668 1.00 13.20 H new ATOM 0 HG3 LYS A 70 28.055 6.768 -12.970 1.00 13.20 H new ATOM 0 HD2 LYS A 70 26.503 6.912 -11.109 1.00 32.43 H new ATOM 0 HD3 LYS A 70 26.026 8.538 -11.556 1.00 32.43 H new ATOM 0 HE2 LYS A 70 24.318 6.922 -12.271 1.00 4.32 H new ATOM 0 HE3 LYS A 70 25.040 7.702 -13.664 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 24.784 5.293 -13.936 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 26.408 5.775 -14.050 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 25.842 5.028 -12.634 1.00 52.12 H new ATOM 1015 N GLN A 71 30.323 8.593 -8.637 1.00 41.25 N ATOM 1016 CA GLN A 71 31.588 8.872 -7.965 1.00 41.44 C ATOM 1017 C GLN A 71 31.843 7.843 -6.868 1.00 11.15 C ATOM 1018 O GLN A 71 30.924 7.158 -6.418 1.00 3.32 O ATOM 1019 CB GLN A 71 31.583 10.279 -7.351 1.00 65.11 C ATOM 1020 CG GLN A 71 30.378 10.537 -6.456 1.00 11.32 C ATOM 1021 CD GLN A 71 30.633 11.570 -5.376 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.516 12.774 -5.602 1.00 4.02 O ATOM 1023 NE2 GLN A 71 30.920 11.093 -4.178 1.00 60.02 N ATOM 0 H GLN A 71 29.518 8.567 -8.011 1.00 41.25 H new ATOM 0 HA GLN A 71 32.382 8.815 -8.709 1.00 41.44 H new ATOM 0 HB2 GLN A 71 32.495 10.419 -6.771 1.00 65.11 H new ATOM 0 HB3 GLN A 71 31.598 11.018 -8.152 1.00 65.11 H new ATOM 0 HG2 GLN A 71 29.542 10.867 -7.073 1.00 11.32 H new ATOM 0 HG3 GLN A 71 30.077 9.600 -5.987 1.00 11.32 H new ATOM 0 HE21 GLN A 71 31.007 10.087 -4.037 1.00 60.02 H new ATOM 0 HE22 GLN A 71 31.054 11.731 -3.394 1.00 60.02 H new ATOM 1032 N THR A 72 33.088 7.758 -6.434 1.00 0.13 N ATOM 1033 CA THR A 72 33.479 6.868 -5.351 1.00 33.54 C ATOM 1034 C THR A 72 34.207 7.662 -4.269 1.00 64.51 C ATOM 1035 O THR A 72 35.017 8.542 -4.574 1.00 2.32 O ATOM 1036 CB THR A 72 34.383 5.723 -5.869 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.414 6.259 -6.715 1.00 1.42 O ATOM 1038 CG2 THR A 72 33.572 4.686 -6.641 1.00 71.13 C ATOM 0 H THR A 72 33.858 8.303 -6.821 1.00 0.13 H new ATOM 0 HA THR A 72 32.578 6.422 -4.930 1.00 33.54 H new ATOM 0 HB THR A 72 34.835 5.232 -5.007 1.00 55.21 H new ATOM 0 HG1 THR A 72 35.984 5.530 -7.038 1.00 1.42 H new ATOM 0 HG21 THR A 72 34.234 3.894 -6.992 1.00 71.13 H new ATOM 0 HG22 THR A 72 32.811 4.259 -5.988 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.091 5.163 -7.495 1.00 71.13 H new ATOM 1046 N LEU A 73 33.900 7.370 -3.012 1.00 24.22 N ATOM 1047 CA LEU A 73 34.513 8.062 -1.882 1.00 2.33 C ATOM 1048 C LEU A 73 35.475 7.131 -1.142 1.00 44.11 C ATOM 1049 O LEU A 73 35.252 5.920 -1.092 1.00 52.40 O ATOM 1050 CB LEU A 73 33.431 8.628 -0.936 1.00 54.54 C ATOM 1051 CG LEU A 73 32.016 8.066 -1.138 1.00 53.14 C ATOM 1052 CD1 LEU A 73 31.925 6.606 -0.692 1.00 63.13 C ATOM 1053 CD2 LEU A 73 30.987 8.921 -0.406 1.00 44.41 C ATOM 0 H LEU A 73 33.225 6.653 -2.746 1.00 24.22 H new ATOM 0 HA LEU A 73 35.091 8.905 -2.261 1.00 2.33 H new ATOM 0 HB2 LEU A 73 33.736 8.436 0.093 1.00 54.54 H new ATOM 0 HB3 LEU A 73 33.394 9.710 -1.061 1.00 54.54 H new ATOM 0 HG LEU A 73 31.795 8.099 -2.205 1.00 53.14 H new ATOM 0 HD11 LEU A 73 30.910 6.240 -0.849 1.00 63.13 H new ATOM 0 HD12 LEU A 73 32.622 6.004 -1.274 1.00 63.13 H new ATOM 0 HD13 LEU A 73 32.178 6.532 0.366 1.00 63.13 H new ATOM 0 HD21 LEU A 73 29.991 8.506 -0.562 1.00 44.41 H new ATOM 0 HD22 LEU A 73 31.213 8.930 0.660 1.00 44.41 H new ATOM 0 HD23 LEU A 73 31.020 9.940 -0.792 1.00 44.41 H new ATOM 1065 N PRO A 74 36.565 7.689 -0.573 1.00 14.33 N ATOM 1066 CA PRO A 74 37.592 6.908 0.135 1.00 71.54 C ATOM 1067 C PRO A 74 37.014 6.065 1.272 1.00 22.35 C ATOM 1068 O PRO A 74 36.342 6.586 2.163 1.00 71.04 O ATOM 1069 CB PRO A 74 38.554 7.975 0.695 1.00 0.31 C ATOM 1070 CG PRO A 74 37.817 9.269 0.589 1.00 75.32 C ATOM 1071 CD PRO A 74 36.890 9.126 -0.582 1.00 21.31 C ATOM 0 HA PRO A 74 38.074 6.193 -0.532 1.00 71.54 H new ATOM 0 HB2 PRO A 74 38.821 7.759 1.729 1.00 0.31 H new ATOM 0 HB3 PRO A 74 39.483 8.004 0.125 1.00 0.31 H new ATOM 0 HG2 PRO A 74 37.261 9.477 1.503 1.00 75.32 H new ATOM 0 HG3 PRO A 74 38.507 10.099 0.440 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.998 9.742 -0.468 1.00 21.31 H new ATOM 0 HD3 PRO A 74 37.368 9.426 -1.514 1.00 21.31 H new ATOM 1079 N ALA A 75 37.310 4.768 1.249 1.00 74.43 N ATOM 1080 CA ALA A 75 36.839 3.841 2.279 1.00 72.21 C ATOM 1081 C ALA A 75 37.656 3.981 3.558 1.00 34.41 C ATOM 1082 O ALA A 75 37.393 3.318 4.561 1.00 42.34 O ATOM 1083 CB ALA A 75 36.889 2.406 1.763 1.00 2.05 C ATOM 0 H ALA A 75 37.878 4.331 0.523 1.00 74.43 H new ATOM 0 HA ALA A 75 35.805 4.091 2.515 1.00 72.21 H new ATOM 0 HB1 ALA A 75 36.536 1.728 2.540 1.00 2.05 H new ATOM 0 HB2 ALA A 75 36.252 2.313 0.883 1.00 2.05 H new ATOM 0 HB3 ALA A 75 37.915 2.151 1.497 1.00 2.05 H new ATOM 1089 N ASP A 76 38.642 4.859 3.512 1.00 35.21 N ATOM 1090 CA ASP A 76 39.525 5.112 4.645 1.00 24.42 C ATOM 1091 C ASP A 76 38.898 6.135 5.598 1.00 33.35 C ATOM 1092 O ASP A 76 39.497 6.534 6.596 1.00 61.01 O ATOM 1093 CB ASP A 76 40.864 5.616 4.106 1.00 72.44 C ATOM 1094 CG ASP A 76 41.942 5.731 5.174 1.00 23.12 C ATOM 1095 OD1 ASP A 76 42.250 6.865 5.607 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.491 4.687 5.587 1.00 42.23 O1- ATOM 0 H ASP A 76 38.856 5.420 2.687 1.00 35.21 H new ATOM 0 HA ASP A 76 39.680 4.193 5.211 1.00 24.42 H new ATOM 0 HB2 ASP A 76 41.209 4.941 3.323 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.717 6.592 3.643 1.00 72.44 H new ATOM 1101 N THR A 77 37.670 6.527 5.290 1.00 11.55 N ATOM 1102 CA THR A 77 36.972 7.574 6.022 1.00 12.43 C ATOM 1103 C THR A 77 36.374 7.062 7.334 1.00 50.31 C ATOM 1104 O THR A 77 36.292 5.851 7.568 1.00 30.02 O ATOM 1105 CB THR A 77 35.851 8.171 5.147 1.00 41.10 C ATOM 1106 OG1 THR A 77 35.174 9.226 5.839 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.838 7.105 4.739 1.00 73.22 C ATOM 0 H THR A 77 37.128 6.127 4.524 1.00 11.55 H new ATOM 0 HA THR A 77 37.706 8.341 6.267 1.00 12.43 H new ATOM 0 HB THR A 77 36.321 8.571 4.249 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.831 9.792 6.296 1.00 73.42 H new ATOM 0 HG21 THR A 77 34.061 7.558 4.123 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.342 6.323 4.171 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.387 6.671 5.631 1.00 73.22 H new ATOM 1115 N THR A 78 35.952 8.006 8.176 1.00 13.54 N ATOM 1116 CA THR A 78 35.314 7.707 9.451 1.00 2.03 C ATOM 1117 C THR A 78 34.435 8.874 9.893 1.00 41.21 C ATOM 1118 O THR A 78 34.728 10.033 9.595 1.00 33.42 O ATOM 1119 CB THR A 78 36.358 7.420 10.563 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.536 8.214 10.352 1.00 41.13 O ATOM 1121 CG2 THR A 78 36.734 5.948 10.616 1.00 52.04 C ATOM 0 H THR A 78 36.045 9.004 7.988 1.00 13.54 H new ATOM 0 HA THR A 78 34.706 6.815 9.302 1.00 2.03 H new ATOM 0 HB THR A 78 35.903 7.686 11.517 1.00 65.01 H new ATOM 0 HG1 THR A 78 38.188 8.027 11.060 1.00 41.13 H new ATOM 0 HG21 THR A 78 37.467 5.788 11.407 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.844 5.352 10.820 1.00 52.04 H new ATOM 0 HG23 THR A 78 37.161 5.647 9.659 1.00 52.04 H new ATOM 1129 N VAL A 79 33.368 8.559 10.611 1.00 13.33 N ATOM 1130 CA VAL A 79 32.502 9.563 11.214 1.00 51.35 C ATOM 1131 C VAL A 79 32.350 9.266 12.696 1.00 40.33 C ATOM 1132 O VAL A 79 31.904 8.187 13.081 1.00 15.54 O ATOM 1133 CB VAL A 79 31.104 9.616 10.545 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.175 10.577 11.292 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.234 10.028 9.085 1.00 4.51 C ATOM 0 H VAL A 79 33.077 7.599 10.793 1.00 13.33 H new ATOM 0 HA VAL A 79 32.968 10.537 11.065 1.00 51.35 H new ATOM 0 HB VAL A 79 30.665 8.619 10.591 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.201 10.596 10.803 1.00 32.33 H new ATOM 0 HG12 VAL A 79 30.057 10.242 12.322 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.605 11.579 11.284 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.245 10.061 8.627 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.695 11.014 9.025 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.854 9.304 8.557 1.00 4.51 H new ATOM 1145 N THR A 80 32.749 10.217 13.518 1.00 3.21 N ATOM 1146 CA THR A 80 32.677 10.059 14.961 1.00 52.54 C ATOM 1147 C THR A 80 31.424 10.739 15.502 1.00 43.34 C ATOM 1148 O THR A 80 31.282 11.959 15.411 1.00 4.30 O ATOM 1149 CB THR A 80 33.931 10.647 15.645 1.00 61.00 C ATOM 1150 OG1 THR A 80 35.108 10.141 14.998 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.968 10.285 17.128 1.00 20.33 C ATOM 0 H THR A 80 33.129 11.113 13.211 1.00 3.21 H new ATOM 0 HA THR A 80 32.632 8.993 15.184 1.00 52.54 H new ATOM 0 HB THR A 80 33.895 11.733 15.558 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.905 10.514 15.430 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.861 10.712 17.585 1.00 20.33 H new ATOM 0 HG22 THR A 80 33.082 10.684 17.622 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.987 9.201 17.237 1.00 20.33 H new ATOM 1159 N ALA A 81 30.507 9.939 16.028 1.00 63.21 N ATOM 1160 CA ALA A 81 29.266 10.444 16.595 1.00 75.00 C ATOM 1161 C ALA A 81 29.360 10.470 18.115 1.00 14.40 C ATOM 1162 O ALA A 81 29.335 9.424 18.766 1.00 73.21 O ATOM 1163 CB ALA A 81 28.090 9.588 16.142 1.00 42.42 C ATOM 0 H ALA A 81 30.603 8.924 16.073 1.00 63.21 H new ATOM 0 HA ALA A 81 29.103 11.462 16.240 1.00 75.00 H new ATOM 0 HB1 ALA A 81 27.168 9.978 16.574 1.00 42.42 H new ATOM 0 HB2 ALA A 81 28.020 9.613 15.055 1.00 42.42 H new ATOM 0 HB3 ALA A 81 28.239 8.560 16.473 1.00 42.42 H new ATOM 1169 N GLU A 82 29.495 11.663 18.671 1.00 71.31 N ATOM 1170 CA GLU A 82 29.617 11.833 20.113 1.00 72.51 C ATOM 1171 C GLU A 82 28.317 12.416 20.670 1.00 53.13 C ATOM 1172 O GLU A 82 28.014 13.588 20.458 1.00 25.01 O ATOM 1173 CB GLU A 82 30.810 12.749 20.419 1.00 74.00 C ATOM 1174 CG GLU A 82 31.145 12.873 21.897 1.00 3.23 C ATOM 1175 CD GLU A 82 32.316 13.808 22.154 1.00 23.22 C ATOM 1176 OE1 GLU A 82 32.107 15.043 22.186 1.00 3.55 O ATOM 1177 OE2 GLU A 82 33.453 13.319 22.320 1.00 51.44 O1- ATOM 0 H GLU A 82 29.523 12.535 18.143 1.00 71.31 H new ATOM 0 HA GLU A 82 29.792 10.869 20.590 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.686 12.373 19.891 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.601 13.742 20.022 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.270 13.237 22.435 1.00 3.23 H new ATOM 0 HG3 GLU A 82 31.378 11.886 22.297 1.00 3.23 H new ATOM 1184 N VAL A 83 27.548 11.592 21.376 1.00 31.40 N ATOM 1185 CA VAL A 83 26.215 11.986 21.841 1.00 74.25 C ATOM 1186 C VAL A 83 26.222 12.274 23.339 1.00 12.15 C ATOM 1187 O VAL A 83 26.856 11.562 24.115 1.00 3.30 O ATOM 1188 CB VAL A 83 25.161 10.890 21.520 1.00 22.15 C ATOM 1189 CG1 VAL A 83 25.526 9.565 22.180 1.00 60.03 C ATOM 1190 CG2 VAL A 83 23.756 11.334 21.933 1.00 42.03 C ATOM 0 H VAL A 83 27.822 10.646 21.641 1.00 31.40 H new ATOM 0 HA VAL A 83 25.941 12.897 21.309 1.00 74.25 H new ATOM 0 HB VAL A 83 25.162 10.740 20.440 1.00 22.15 H new ATOM 0 HG11 VAL A 83 24.771 8.818 21.938 1.00 60.03 H new ATOM 0 HG12 VAL A 83 26.497 9.231 21.814 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.572 9.697 23.261 1.00 60.03 H new ATOM 0 HG21 VAL A 83 23.041 10.546 21.696 1.00 42.03 H new ATOM 0 HG22 VAL A 83 23.737 11.530 23.005 1.00 42.03 H new ATOM 0 HG23 VAL A 83 23.488 12.242 21.393 1.00 42.03 H new ATOM 1200 N GLY A 84 25.518 13.325 23.738 1.00 33.12 N ATOM 1201 CA GLY A 84 25.472 13.719 25.129 1.00 23.12 C ATOM 1202 C GLY A 84 24.094 14.172 25.562 1.00 64.22 C ATOM 1203 O GLY A 84 23.174 14.272 24.748 1.00 21.33 O ATOM 0 H GLY A 84 24.972 13.917 23.112 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.786 12.881 25.751 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.185 14.526 25.298 1.00 23.12 H new ATOM 1207 N ILE A 85 23.964 14.454 26.850 1.00 23.52 N ATOM 1208 CA ILE A 85 22.711 14.879 27.445 1.00 1.40 C ATOM 1209 C ILE A 85 23.001 15.838 28.593 1.00 61.15 C ATOM 1210 O ILE A 85 23.913 15.599 29.400 1.00 10.52 O ATOM 1211 CB ILE A 85 21.879 13.657 27.944 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.543 14.089 28.601 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.705 12.802 28.907 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.643 14.408 30.083 1.00 71.32 C ATOM 0 H ILE A 85 24.734 14.393 27.516 1.00 23.52 H new ATOM 0 HA ILE A 85 22.116 15.389 26.688 1.00 1.40 H new ATOM 0 HB ILE A 85 21.627 13.057 27.069 1.00 52.02 H new ATOM 0 HG12 ILE A 85 20.163 14.967 28.078 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.811 13.294 28.462 1.00 53.33 H new ATOM 0 HG21 ILE A 85 22.108 11.955 29.244 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.597 12.438 28.397 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.999 13.404 29.767 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.663 14.701 30.459 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.990 13.527 30.622 1.00 71.32 H new ATOM 0 HD13 ILE A 85 21.348 15.226 30.232 1.00 71.32 H new ATOM 1226 N GLY A 86 22.238 16.922 28.637 1.00 43.44 N ATOM 1227 CA GLY A 86 22.376 17.927 29.679 1.00 64.20 C ATOM 1228 C GLY A 86 21.037 18.566 29.990 1.00 43.21 C ATOM 1229 O GLY A 86 20.073 18.336 29.264 1.00 31.32 O ATOM 0 H GLY A 86 21.509 17.128 27.954 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.784 17.469 30.580 1.00 64.20 H new ATOM 0 HA3 GLY A 86 23.084 18.692 29.361 1.00 64.20 H new ATOM 1233 N PRO A 87 20.932 19.363 31.062 1.00 20.43 N ATOM 1234 CA PRO A 87 19.665 19.970 31.456 1.00 73.43 C ATOM 1235 C PRO A 87 19.328 21.202 30.619 1.00 33.24 C ATOM 1236 O PRO A 87 20.205 22.000 30.273 1.00 11.41 O ATOM 1237 CB PRO A 87 19.905 20.348 32.917 1.00 75.13 C ATOM 1238 CG PRO A 87 21.368 20.638 32.994 1.00 24.22 C ATOM 1239 CD PRO A 87 22.034 19.761 31.959 1.00 44.21 C ATOM 0 HA PRO A 87 18.819 19.299 31.311 1.00 73.43 H new ATOM 0 HB2 PRO A 87 19.313 21.217 33.204 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.626 19.536 33.588 1.00 75.13 H new ATOM 0 HG2 PRO A 87 21.566 21.691 32.795 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.754 20.424 33.991 1.00 24.22 H new ATOM 0 HD2 PRO A 87 22.812 20.301 31.419 1.00 44.21 H new ATOM 0 HD3 PRO A 87 22.508 18.893 32.417 1.00 44.21 H new ATOM 1247 N ASN A 88 18.055 21.337 30.288 1.00 50.13 N ATOM 1248 CA ASN A 88 17.554 22.500 29.564 1.00 62.23 C ATOM 1249 C ASN A 88 17.149 23.561 30.577 1.00 31.22 C ATOM 1250 O ASN A 88 16.706 23.225 31.675 1.00 11.01 O ATOM 1251 CB ASN A 88 16.351 22.097 28.688 1.00 63.43 C ATOM 1252 CG ASN A 88 15.838 23.219 27.788 1.00 21.32 C ATOM 1253 OD1 ASN A 88 15.892 24.397 28.133 1.00 63.22 O ATOM 1254 ND2 ASN A 88 15.325 22.856 26.621 1.00 22.41 N ATOM 0 H ASN A 88 17.338 20.647 30.512 1.00 50.13 H new ATOM 0 HA ASN A 88 18.329 22.899 28.909 1.00 62.23 H new ATOM 0 HB2 ASN A 88 16.635 21.247 28.067 1.00 63.43 H new ATOM 0 HB3 ASN A 88 15.539 21.763 29.334 1.00 63.43 H new ATOM 0 HD21 ASN A 88 14.961 23.563 25.982 1.00 22.41 H new ATOM 0 HD22 ASN A 88 15.294 21.870 26.362 1.00 22.41 H new ATOM 1261 N GLU A 89 17.292 24.833 30.213 1.00 43.32 N ATOM 1262 CA GLU A 89 16.955 25.937 31.110 1.00 2.23 C ATOM 1263 C GLU A 89 15.471 25.909 31.484 1.00 10.40 C ATOM 1264 O GLU A 89 15.040 26.582 32.422 1.00 74.31 O ATOM 1265 CB GLU A 89 17.323 27.280 30.469 1.00 13.04 C ATOM 1266 CG GLU A 89 16.584 27.581 29.169 1.00 64.14 C ATOM 1267 CD GLU A 89 16.968 28.931 28.588 1.00 35.31 C ATOM 1268 OE1 GLU A 89 16.460 29.964 29.077 1.00 70.11 O ATOM 1269 OE2 GLU A 89 17.785 28.970 27.643 1.00 74.23 O1- ATOM 0 H GLU A 89 17.640 25.126 29.300 1.00 43.32 H new ATOM 0 HA GLU A 89 17.535 25.818 32.025 1.00 2.23 H new ATOM 0 HB2 GLU A 89 17.118 28.078 31.183 1.00 13.04 H new ATOM 0 HB3 GLU A 89 18.395 27.294 30.275 1.00 13.04 H new ATOM 0 HG2 GLU A 89 16.801 26.799 28.441 1.00 64.14 H new ATOM 0 HG3 GLU A 89 15.509 27.558 29.351 1.00 64.14 H new ATOM 1276 N GLU A 90 14.698 25.129 30.733 1.00 62.24 N ATOM 1277 CA GLU A 90 13.282 24.908 31.021 1.00 33.11 C ATOM 1278 C GLU A 90 13.112 24.122 32.326 1.00 41.22 C ATOM 1279 O GLU A 90 12.066 24.182 32.980 1.00 23.51 O ATOM 1280 CB GLU A 90 12.635 24.152 29.851 1.00 62.35 C ATOM 1281 CG GLU A 90 11.210 23.685 30.122 1.00 2.12 C ATOM 1282 CD GLU A 90 10.589 22.976 28.932 1.00 32.41 C ATOM 1283 OE1 GLU A 90 9.776 23.597 28.220 1.00 34.55 O ATOM 1284 OE2 GLU A 90 10.918 21.796 28.694 1.00 15.02 O1- ATOM 0 H GLU A 90 15.034 24.632 29.908 1.00 62.24 H new ATOM 0 HA GLU A 90 12.789 25.872 31.142 1.00 33.11 H new ATOM 0 HB2 GLU A 90 12.633 24.797 28.973 1.00 62.35 H new ATOM 0 HB3 GLU A 90 13.250 23.285 29.609 1.00 62.35 H new ATOM 0 HG2 GLU A 90 11.209 23.013 30.981 1.00 2.12 H new ATOM 0 HG3 GLU A 90 10.595 24.544 30.389 1.00 2.12 H new ATOM 1291 N GLY A 91 14.158 23.399 32.702 1.00 4.53 N ATOM 1292 CA GLY A 91 14.130 22.589 33.909 1.00 50.31 C ATOM 1293 C GLY A 91 13.970 21.115 33.600 1.00 52.42 C ATOM 1294 O GLY A 91 13.529 20.336 34.447 1.00 50.31 O ATOM 0 H GLY A 91 15.037 23.358 32.187 1.00 4.53 H new ATOM 0 HA2 GLY A 91 15.051 22.744 34.471 1.00 50.31 H new ATOM 0 HA3 GLY A 91 13.309 22.917 34.547 1.00 50.31 H new ATOM 1298 N GLY A 92 14.326 20.731 32.378 1.00 31.10 N ATOM 1299 CA GLY A 92 14.243 19.343 31.965 1.00 44.24 C ATOM 1300 C GLY A 92 15.538 18.881 31.341 1.00 74.12 C ATOM 1301 O GLY A 92 16.603 19.394 31.681 1.00 42.22 O ATOM 0 H GLY A 92 14.674 21.366 31.659 1.00 31.10 H new ATOM 0 HA2 GLY A 92 14.008 18.718 32.826 1.00 44.24 H new ATOM 0 HA3 GLY A 92 13.428 19.221 31.251 1.00 44.24 H new ATOM 1305 N PHE A 93 15.461 17.932 30.420 1.00 65.13 N ATOM 1306 CA PHE A 93 16.650 17.432 29.738 1.00 72.25 C ATOM 1307 C PHE A 93 16.698 17.918 28.295 1.00 30.35 C ATOM 1308 O PHE A 93 15.677 18.298 27.714 1.00 35.35 O ATOM 1309 CB PHE A 93 16.714 15.897 29.782 1.00 70.53 C ATOM 1310 CG PHE A 93 17.041 15.335 31.144 1.00 33.33 C ATOM 1311 CD1 PHE A 93 16.441 14.168 31.591 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.957 15.973 31.972 1.00 64.21 C ATOM 1313 CE1 PHE A 93 16.747 13.649 32.834 1.00 2.11 C ATOM 1314 CE2 PHE A 93 18.264 15.459 33.217 1.00 3.04 C ATOM 1315 CZ PHE A 93 17.658 14.295 33.648 1.00 12.34 C ATOM 0 H PHE A 93 14.589 17.492 30.126 1.00 65.13 H new ATOM 0 HA PHE A 93 17.518 17.826 30.266 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.756 15.494 29.455 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.464 15.554 29.069 1.00 70.53 H new ATOM 0 HD1 PHE A 93 15.727 13.659 30.961 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.435 16.882 31.638 1.00 64.21 H new ATOM 0 HE1 PHE A 93 16.274 12.738 33.170 1.00 2.11 H new ATOM 0 HE2 PHE A 93 18.976 15.966 33.852 1.00 3.04 H new ATOM 0 HZ PHE A 93 17.896 13.890 34.620 1.00 12.34 H new ATOM 1325 N ALA A 94 17.896 17.903 27.735 1.00 73.43 N ATOM 1326 CA ALA A 94 18.137 18.307 26.362 1.00 60.33 C ATOM 1327 C ALA A 94 19.233 17.426 25.776 1.00 65.32 C ATOM 1328 O ALA A 94 20.289 17.248 26.394 1.00 32.10 O ATOM 1329 CB ALA A 94 18.523 19.783 26.304 1.00 64.21 C ATOM 0 H ALA A 94 18.738 17.606 28.228 1.00 73.43 H new ATOM 0 HA ALA A 94 17.229 18.183 25.772 1.00 60.33 H new ATOM 0 HB1 ALA A 94 18.701 20.072 25.268 1.00 64.21 H new ATOM 0 HB2 ALA A 94 17.714 20.387 26.716 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.430 19.945 26.887 1.00 64.21 H new ATOM 1335 N LEU A 95 18.964 16.849 24.609 1.00 31.23 N ATOM 1336 CA LEU A 95 19.882 15.905 23.977 1.00 75.45 C ATOM 1337 C LEU A 95 20.750 16.590 22.926 1.00 41.42 C ATOM 1338 O LEU A 95 20.280 17.446 22.168 1.00 2.34 O ATOM 1339 CB LEU A 95 19.106 14.728 23.354 1.00 51.22 C ATOM 1340 CG LEU A 95 18.721 13.593 24.324 1.00 42.15 C ATOM 1341 CD1 LEU A 95 19.968 12.860 24.813 1.00 64.34 C ATOM 1342 CD2 LEU A 95 17.920 14.132 25.508 1.00 71.23 C ATOM 0 H LEU A 95 18.110 17.020 24.077 1.00 31.23 H new ATOM 0 HA LEU A 95 20.543 15.516 24.752 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.195 15.117 22.900 1.00 51.22 H new ATOM 0 HB3 LEU A 95 19.708 14.305 22.550 1.00 51.22 H new ATOM 0 HG LEU A 95 18.092 12.886 23.783 1.00 42.15 H new ATOM 0 HD11 LEU A 95 19.677 12.062 25.497 1.00 64.34 H new ATOM 0 HD12 LEU A 95 20.496 12.433 23.961 1.00 64.34 H new ATOM 0 HD13 LEU A 95 20.622 13.561 25.331 1.00 64.34 H new ATOM 0 HD21 LEU A 95 17.661 13.311 26.176 1.00 71.23 H new ATOM 0 HD22 LEU A 95 18.519 14.865 26.049 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.008 14.605 25.145 1.00 71.23 H new ATOM 1354 N ASP A 96 22.006 16.175 22.884 1.00 51.32 N ATOM 1355 CA ASP A 96 23.018 16.743 22.001 1.00 15.24 C ATOM 1356 C ASP A 96 23.775 15.611 21.319 1.00 33.43 C ATOM 1357 O ASP A 96 23.874 14.519 21.869 1.00 1.11 O ATOM 1358 CB ASP A 96 23.989 17.609 22.827 1.00 62.10 C ATOM 1359 CG ASP A 96 25.256 17.994 22.070 1.00 42.14 C ATOM 1360 OD1 ASP A 96 25.196 18.886 21.199 1.00 0.44 O ATOM 1361 OD2 ASP A 96 26.331 17.416 22.363 1.00 11.32 O1- ATOM 0 H ASP A 96 22.359 15.420 23.472 1.00 51.32 H new ATOM 0 HA ASP A 96 22.545 17.367 21.243 1.00 15.24 H new ATOM 0 HB2 ASP A 96 23.475 18.516 23.143 1.00 62.10 H new ATOM 0 HB3 ASP A 96 24.266 17.068 23.732 1.00 62.10 H new ATOM 1366 N VAL A 97 24.275 15.854 20.117 1.00 3.45 N ATOM 1367 CA VAL A 97 25.121 14.879 19.434 1.00 33.41 C ATOM 1368 C VAL A 97 25.966 15.551 18.355 1.00 35.23 C ATOM 1369 O VAL A 97 25.467 16.329 17.543 1.00 5.33 O ATOM 1370 CB VAL A 97 24.300 13.703 18.834 1.00 12.11 C ATOM 1371 CG1 VAL A 97 23.185 14.209 17.931 1.00 31.40 C ATOM 1372 CG2 VAL A 97 25.210 12.725 18.085 1.00 41.42 C ATOM 0 H VAL A 97 24.112 16.714 19.593 1.00 3.45 H new ATOM 0 HA VAL A 97 25.787 14.456 20.186 1.00 33.41 H new ATOM 0 HB VAL A 97 23.837 13.167 19.663 1.00 12.11 H new ATOM 0 HG11 VAL A 97 22.630 13.362 17.528 1.00 31.40 H new ATOM 0 HG12 VAL A 97 22.511 14.843 18.506 1.00 31.40 H new ATOM 0 HG13 VAL A 97 23.614 14.785 17.111 1.00 31.40 H new ATOM 0 HG21 VAL A 97 24.611 11.912 17.675 1.00 41.42 H new ATOM 0 HG22 VAL A 97 25.716 13.248 17.273 1.00 41.42 H new ATOM 0 HG23 VAL A 97 25.951 12.318 18.773 1.00 41.42 H new ATOM 1382 N GLU A 98 27.250 15.238 18.370 1.00 23.12 N ATOM 1383 CA GLU A 98 28.231 15.835 17.478 1.00 44.32 C ATOM 1384 C GLU A 98 28.592 14.851 16.369 1.00 21.31 C ATOM 1385 O GLU A 98 29.034 13.732 16.649 1.00 34.12 O ATOM 1386 CB GLU A 98 29.484 16.211 18.290 1.00 13.10 C ATOM 1387 CG GLU A 98 30.576 16.899 17.482 1.00 35.31 C ATOM 1388 CD GLU A 98 31.807 17.245 18.312 1.00 11.53 C ATOM 1389 OE1 GLU A 98 31.651 17.896 19.367 1.00 51.52 O ATOM 1390 OE2 GLU A 98 32.939 16.891 17.903 1.00 21.24 O1- ATOM 0 H GLU A 98 27.647 14.552 19.012 1.00 23.12 H new ATOM 0 HA GLU A 98 27.815 16.732 17.020 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.188 16.866 19.109 1.00 13.10 H new ATOM 0 HB3 GLU A 98 29.896 15.307 18.738 1.00 13.10 H new ATOM 0 HG2 GLU A 98 30.872 16.251 16.657 1.00 35.31 H new ATOM 0 HG3 GLU A 98 30.174 17.812 17.042 1.00 35.31 H new ATOM 1397 N LEU A 99 28.378 15.248 15.117 1.00 4.53 N ATOM 1398 CA LEU A 99 28.764 14.426 13.976 1.00 32.31 C ATOM 1399 C LEU A 99 30.066 14.949 13.383 1.00 52.01 C ATOM 1400 O LEU A 99 30.087 15.990 12.724 1.00 21.43 O ATOM 1401 CB LEU A 99 27.662 14.415 12.906 1.00 42.25 C ATOM 1402 CG LEU A 99 26.324 13.791 13.342 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.322 13.797 12.190 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.535 12.369 13.868 1.00 23.33 C ATOM 0 H LEU A 99 27.939 16.134 14.868 1.00 4.53 H new ATOM 0 HA LEU A 99 28.909 13.402 14.321 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.478 15.441 12.588 1.00 42.25 H new ATOM 0 HB3 LEU A 99 28.030 13.872 12.035 1.00 42.25 H new ATOM 0 HG LEU A 99 25.915 14.397 14.151 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.384 13.351 12.521 1.00 73.33 H new ATOM 0 HD12 LEU A 99 25.143 14.823 11.869 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.723 13.221 11.356 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.577 11.947 14.171 1.00 23.33 H new ATOM 0 HD22 LEU A 99 26.972 11.752 13.083 1.00 23.33 H new ATOM 0 HD23 LEU A 99 27.207 12.394 14.726 1.00 23.33 H new ATOM 1416 N ARG A 100 31.140 14.209 13.625 1.00 15.15 N ATOM 1417 CA ARG A 100 32.483 14.582 13.193 1.00 11.05 C ATOM 1418 C ARG A 100 32.859 13.771 11.957 1.00 44.33 C ATOM 1419 O ARG A 100 33.177 12.585 12.061 1.00 60.34 O ATOM 1420 CB ARG A 100 33.452 14.307 14.351 1.00 62.13 C ATOM 1421 CG ARG A 100 34.783 15.047 14.285 1.00 11.51 C ATOM 1422 CD ARG A 100 35.598 14.785 15.549 1.00 61.51 C ATOM 1423 NE ARG A 100 36.788 15.633 15.648 1.00 42.53 N ATOM 1424 CZ ARG A 100 37.040 16.438 16.686 1.00 32.53 C ATOM 1425 NH1 ARG A 100 36.127 16.605 17.641 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 38.193 17.094 16.755 1.00 1.52 N ATOM 0 H ARG A 100 31.104 13.324 14.131 1.00 15.15 H new ATOM 0 HA ARG A 100 32.529 15.639 12.930 1.00 11.05 H new ATOM 0 HB2 ARG A 100 32.957 14.569 15.286 1.00 62.13 H new ATOM 0 HB3 ARG A 100 33.653 13.236 14.386 1.00 62.13 H new ATOM 0 HG2 ARG A 100 35.344 14.723 13.409 1.00 11.51 H new ATOM 0 HG3 ARG A 100 34.607 16.117 14.173 1.00 11.51 H new ATOM 0 HD2 ARG A 100 34.967 14.950 16.422 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.902 13.738 15.569 1.00 61.51 H new ATOM 0 HE ARG A 100 37.462 15.608 14.883 1.00 42.53 H new ATOM 0 HH11 ARG A 100 35.233 16.118 17.582 1.00 73.43 H new ATOM 0 HH12 ARG A 100 36.322 17.220 18.431 1.00 73.43 H new ATOM 0 HH21 ARG A 100 38.887 16.984 16.016 1.00 1.52 H new ATOM 0 HH22 ARG A 100 38.384 17.708 17.547 1.00 1.52 H new ATOM 1440 N VAL A 101 32.817 14.405 10.789 1.00 42.14 N ATOM 1441 CA VAL A 101 32.943 13.683 9.525 1.00 72.23 C ATOM 1442 C VAL A 101 34.361 13.786 8.981 1.00 42.25 C ATOM 1443 O VAL A 101 34.721 14.783 8.355 1.00 41.22 O ATOM 1444 CB VAL A 101 31.943 14.215 8.464 1.00 14.41 C ATOM 1445 CG1 VAL A 101 32.047 13.420 7.160 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.511 14.183 9.006 1.00 42.30 C ATOM 0 H VAL A 101 32.697 15.413 10.690 1.00 42.14 H new ATOM 0 HA VAL A 101 32.711 12.638 9.728 1.00 72.23 H new ATOM 0 HB VAL A 101 32.204 15.251 8.246 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.335 13.815 6.435 1.00 25.41 H new ATOM 0 HG12 VAL A 101 33.057 13.507 6.760 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.823 12.371 7.354 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.826 14.560 8.247 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.241 13.158 9.261 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.445 14.808 9.897 1.00 42.30 H new ATOM 1456 N ALA A 102 35.167 12.765 9.240 1.00 43.12 N ATOM 1457 CA ALA A 102 36.542 12.742 8.767 1.00 40.03 C ATOM 1458 C ALA A 102 36.626 12.026 7.426 1.00 12.52 C ATOM 1459 O ALA A 102 36.611 10.794 7.365 1.00 73.10 O ATOM 1460 CB ALA A 102 37.446 12.067 9.796 1.00 44.05 C ATOM 0 H ALA A 102 34.891 11.942 9.776 1.00 43.12 H new ATOM 0 HA ALA A 102 36.883 13.768 8.632 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.472 12.057 9.428 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.403 12.618 10.735 1.00 44.05 H new ATOM 0 HB3 ALA A 102 37.110 11.043 9.960 1.00 44.05 H new ATOM 1466 N LEU A 103 36.717 12.806 6.354 1.00 73.31 N ATOM 1467 CA LEU A 103 36.827 12.259 5.004 1.00 63.24 C ATOM 1468 C LEU A 103 38.204 12.618 4.441 1.00 11.33 C ATOM 1469 O LEU A 103 38.539 13.800 4.310 1.00 24.41 O ATOM 1470 CB LEU A 103 35.693 12.801 4.104 1.00 41.13 C ATOM 1471 CG LEU A 103 35.536 12.120 2.722 1.00 32.24 C ATOM 1472 CD1 LEU A 103 35.237 10.636 2.876 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.432 12.786 1.900 1.00 41.41 C ATOM 0 H LEU A 103 36.717 13.825 6.394 1.00 73.31 H new ATOM 0 HA LEU A 103 36.724 11.174 5.033 1.00 63.24 H new ATOM 0 HB2 LEU A 103 34.751 12.704 4.643 1.00 41.13 H new ATOM 0 HB3 LEU A 103 35.861 13.866 3.945 1.00 41.13 H new ATOM 0 HG LEU A 103 36.482 12.236 2.194 1.00 32.24 H new ATOM 0 HD11 LEU A 103 35.131 10.182 1.891 1.00 55.32 H new ATOM 0 HD12 LEU A 103 36.054 10.154 3.412 1.00 55.32 H new ATOM 0 HD13 LEU A 103 34.311 10.508 3.436 1.00 55.32 H new ATOM 0 HD21 LEU A 103 34.345 12.286 0.935 1.00 41.41 H new ATOM 0 HD22 LEU A 103 33.485 12.711 2.434 1.00 41.41 H new ATOM 0 HD23 LEU A 103 34.678 13.836 1.744 1.00 41.41 H new ATOM 1485 N PRO A 104 39.036 11.606 4.132 1.00 73.52 N ATOM 1486 CA PRO A 104 40.408 11.823 3.675 1.00 62.42 C ATOM 1487 C PRO A 104 40.467 12.324 2.235 1.00 45.15 C ATOM 1488 O PRO A 104 39.585 12.027 1.425 1.00 0.45 O ATOM 1489 CB PRO A 104 41.046 10.439 3.809 1.00 24.31 C ATOM 1490 CG PRO A 104 39.921 9.476 3.659 1.00 63.40 C ATOM 1491 CD PRO A 104 38.694 10.172 4.187 1.00 45.41 C ATOM 0 HA PRO A 104 40.920 12.593 4.252 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.806 10.280 3.044 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.537 10.323 4.775 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.788 9.193 2.615 1.00 63.40 H new ATOM 0 HG3 PRO A 104 40.117 8.559 4.215 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.817 9.949 3.579 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.465 9.857 5.205 1.00 45.41 H new ATOM 1499 N GLY A 105 41.511 13.087 1.931 1.00 54.45 N ATOM 1500 CA GLY A 105 41.673 13.645 0.598 1.00 13.33 C ATOM 1501 C GLY A 105 40.652 14.729 0.290 1.00 43.42 C ATOM 1502 O GLY A 105 40.468 15.104 -0.868 1.00 1.41 O ATOM 0 H GLY A 105 42.253 13.331 2.587 1.00 54.45 H new ATOM 0 HA2 GLY A 105 42.677 14.058 0.501 1.00 13.33 H new ATOM 0 HA3 GLY A 105 41.584 12.847 -0.139 1.00 13.33 H new ATOM 1506 N LEU A 106 39.994 15.231 1.332 1.00 4.51 N ATOM 1507 CA LEU A 106 38.927 16.225 1.190 1.00 40.14 C ATOM 1508 C LEU A 106 39.272 17.522 1.934 1.00 43.11 C ATOM 1509 O LEU A 106 39.861 17.489 3.019 1.00 42.33 O ATOM 1510 CB LEU A 106 37.610 15.640 1.723 1.00 65.03 C ATOM 1511 CG LEU A 106 36.459 16.644 1.905 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.044 17.255 0.576 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.265 15.986 2.585 1.00 41.21 C ATOM 0 H LEU A 106 40.183 14.963 2.298 1.00 4.51 H new ATOM 0 HA LEU A 106 38.818 16.468 0.133 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.280 14.856 1.041 1.00 65.03 H new ATOM 0 HB3 LEU A 106 37.808 15.164 2.683 1.00 65.03 H new ATOM 0 HG LEU A 106 36.822 17.447 2.547 1.00 43.51 H new ATOM 0 HD11 LEU A 106 35.229 17.960 0.738 1.00 44.14 H new ATOM 0 HD12 LEU A 106 36.893 17.777 0.135 1.00 44.14 H new ATOM 0 HD13 LEU A 106 35.712 16.466 -0.099 1.00 44.14 H new ATOM 0 HD21 LEU A 106 34.465 16.717 2.702 1.00 41.21 H new ATOM 0 HD22 LEU A 106 34.911 15.155 1.975 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.564 15.615 3.565 1.00 41.21 H new ATOM 1525 N ASP A 107 38.896 18.658 1.340 1.00 72.42 N ATOM 1526 CA ASP A 107 39.120 19.976 1.944 1.00 14.02 C ATOM 1527 C ASP A 107 38.101 20.251 3.028 1.00 1.12 C ATOM 1528 O ASP A 107 37.055 19.612 3.087 1.00 10.24 O ATOM 1529 CB ASP A 107 38.975 21.101 0.914 1.00 13.35 C ATOM 1530 CG ASP A 107 39.894 22.281 1.198 1.00 12.43 C ATOM 1531 OD1 ASP A 107 39.611 23.047 2.144 1.00 14.01 O ATOM 1532 OD2 ASP A 107 40.893 22.456 0.468 1.00 2.52 O1- ATOM 0 H ASP A 107 38.431 18.691 0.433 1.00 72.42 H new ATOM 0 HA ASP A 107 40.132 19.957 2.348 1.00 14.02 H new ATOM 0 HB2 ASP A 107 39.191 20.708 -0.079 1.00 13.35 H new ATOM 0 HB3 ASP A 107 37.941 21.446 0.902 1.00 13.35 H new ATOM 1537 N ALA A 108 38.391 21.251 3.834 1.00 41.30 N ATOM 1538 CA ALA A 108 37.434 21.779 4.787 1.00 54.32 C ATOM 1539 C ALA A 108 36.306 22.488 4.043 1.00 74.35 C ATOM 1540 O ALA A 108 35.127 22.281 4.330 1.00 33.14 O ATOM 1541 CB ALA A 108 38.134 22.747 5.721 1.00 73.33 C ATOM 0 H ALA A 108 39.296 21.721 3.848 1.00 41.30 H new ATOM 0 HA ALA A 108 37.011 20.962 5.372 1.00 54.32 H new ATOM 0 HB1 ALA A 108 37.416 23.145 6.438 1.00 73.33 H new ATOM 0 HB2 ALA A 108 38.929 22.227 6.255 1.00 73.33 H new ATOM 0 HB3 ALA A 108 38.561 23.566 5.143 1.00 73.33 H new ATOM 1547 N ALA A 109 36.690 23.307 3.063 1.00 23.13 N ATOM 1548 CA ALA A 109 35.738 24.105 2.293 1.00 64.13 C ATOM 1549 C ALA A 109 34.746 23.213 1.556 1.00 31.24 C ATOM 1550 O ALA A 109 33.535 23.454 1.571 1.00 41.21 O ATOM 1551 CB ALA A 109 36.481 25.005 1.309 1.00 33.23 C ATOM 0 H ALA A 109 37.662 23.435 2.783 1.00 23.13 H new ATOM 0 HA ALA A 109 35.176 24.730 2.987 1.00 64.13 H new ATOM 0 HB1 ALA A 109 35.762 25.595 0.741 1.00 33.23 H new ATOM 0 HB2 ALA A 109 37.146 25.673 1.857 1.00 33.23 H new ATOM 0 HB3 ALA A 109 37.067 24.391 0.625 1.00 33.23 H new ATOM 1557 N ALA A 110 35.269 22.179 0.908 1.00 73.25 N ATOM 1558 CA ALA A 110 34.435 21.230 0.186 1.00 12.34 C ATOM 1559 C ALA A 110 33.652 20.361 1.165 1.00 44.05 C ATOM 1560 O ALA A 110 32.456 20.118 0.981 1.00 34.04 O ATOM 1561 CB ALA A 110 35.288 20.377 -0.745 1.00 53.00 C ATOM 0 H ALA A 110 36.268 21.977 0.869 1.00 73.25 H new ATOM 0 HA ALA A 110 33.719 21.782 -0.423 1.00 12.34 H new ATOM 0 HB1 ALA A 110 34.651 19.672 -1.278 1.00 53.00 H new ATOM 0 HB2 ALA A 110 35.798 21.020 -1.463 1.00 53.00 H new ATOM 0 HB3 ALA A 110 36.027 19.828 -0.161 1.00 53.00 H new ATOM 1567 N ALA A 111 34.320 19.924 2.227 1.00 5.14 N ATOM 1568 CA ALA A 111 33.670 19.101 3.249 1.00 43.54 C ATOM 1569 C ALA A 111 32.419 19.781 3.799 1.00 4.44 C ATOM 1570 O ALA A 111 31.378 19.139 3.968 1.00 54.13 O ATOM 1571 CB ALA A 111 34.639 18.793 4.382 1.00 13.31 C ATOM 0 H ALA A 111 35.305 20.122 2.405 1.00 5.14 H new ATOM 0 HA ALA A 111 33.367 18.166 2.777 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.139 18.181 5.132 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.500 18.253 3.988 1.00 13.31 H new ATOM 0 HB3 ALA A 111 34.973 19.725 4.838 1.00 13.31 H new ATOM 1577 N LYS A 112 32.516 21.082 4.057 1.00 1.14 N ATOM 1578 CA LYS A 112 31.395 21.842 4.608 1.00 13.13 C ATOM 1579 C LYS A 112 30.148 21.741 3.724 1.00 74.23 C ATOM 1580 O LYS A 112 29.028 21.690 4.234 1.00 4.50 O ATOM 1581 CB LYS A 112 31.775 23.314 4.809 1.00 13.05 C ATOM 1582 CG LYS A 112 32.783 23.533 5.934 1.00 32.13 C ATOM 1583 CD LYS A 112 33.042 25.015 6.185 1.00 10.41 C ATOM 1584 CE LYS A 112 31.783 25.747 6.646 1.00 22.11 C ATOM 1585 NZ LYS A 112 32.050 27.181 6.932 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.359 21.633 3.894 1.00 1.14 H new ATOM 0 HA LYS A 112 31.159 21.401 5.577 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.189 23.705 3.879 1.00 13.05 H new ATOM 0 HB3 LYS A 112 30.873 23.888 5.022 1.00 13.05 H new ATOM 0 HG2 LYS A 112 32.413 23.069 6.848 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.721 23.038 5.682 1.00 32.13 H new ATOM 0 HD2 LYS A 112 33.821 25.124 6.939 1.00 10.41 H new ATOM 0 HD3 LYS A 112 33.416 25.477 5.271 1.00 10.41 H new ATOM 0 HE2 LYS A 112 31.014 25.667 5.877 1.00 22.11 H new ATOM 0 HE3 LYS A 112 31.390 25.265 7.541 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 31.171 27.643 7.242 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 32.765 27.258 7.683 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 32.401 27.647 6.071 1.00 2.23 H new ATOM 1599 N THR A 113 30.336 21.712 2.407 1.00 31.43 N ATOM 1600 CA THR A 113 29.202 21.638 1.488 1.00 60.21 C ATOM 1601 C THR A 113 28.714 20.194 1.364 1.00 74.22 C ATOM 1602 O THR A 113 27.509 19.944 1.297 1.00 73.22 O ATOM 1603 CB THR A 113 29.547 22.209 0.085 1.00 31.33 C ATOM 1604 OG1 THR A 113 28.351 22.618 -0.601 1.00 10.35 O ATOM 1605 CG2 THR A 113 30.275 21.186 -0.776 1.00 32.43 C ATOM 0 H THR A 113 31.250 21.738 1.956 1.00 31.43 H new ATOM 0 HA THR A 113 28.406 22.255 1.905 1.00 60.21 H new ATOM 0 HB THR A 113 30.201 23.067 0.243 1.00 31.33 H new ATOM 0 HG1 THR A 113 28.586 22.977 -1.482 1.00 10.35 H new ATOM 0 HG21 THR A 113 30.499 21.623 -1.749 1.00 32.43 H new ATOM 0 HG22 THR A 113 31.204 20.894 -0.287 1.00 32.43 H new ATOM 0 HG23 THR A 113 29.644 20.307 -0.909 1.00 32.43 H new ATOM 1613 N LEU A 114 29.655 19.249 1.353 1.00 23.12 N ATOM 1614 CA LEU A 114 29.319 17.835 1.194 1.00 20.51 C ATOM 1615 C LEU A 114 28.482 17.344 2.372 1.00 41.04 C ATOM 1616 O LEU A 114 27.431 16.731 2.184 1.00 13.34 O ATOM 1617 CB LEU A 114 30.589 16.984 1.044 1.00 61.01 C ATOM 1618 CG LEU A 114 31.490 17.350 -0.149 1.00 11.45 C ATOM 1619 CD1 LEU A 114 32.637 16.352 -0.293 1.00 1.51 C ATOM 1620 CD2 LEU A 114 30.676 17.442 -1.441 1.00 50.51 C ATOM 0 H LEU A 114 30.653 19.437 1.452 1.00 23.12 H new ATOM 0 HA LEU A 114 28.728 17.729 0.284 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.174 17.070 1.960 1.00 61.01 H new ATOM 0 HB3 LEU A 114 30.297 15.938 0.950 1.00 61.01 H new ATOM 0 HG LEU A 114 31.923 18.332 0.044 1.00 11.45 H new ATOM 0 HD11 LEU A 114 33.259 16.633 -1.143 1.00 1.51 H new ATOM 0 HD12 LEU A 114 33.240 16.357 0.615 1.00 1.51 H new ATOM 0 HD13 LEU A 114 32.232 15.353 -0.454 1.00 1.51 H new ATOM 0 HD21 LEU A 114 31.336 17.702 -2.269 1.00 50.51 H new ATOM 0 HD22 LEU A 114 30.203 16.481 -1.642 1.00 50.51 H new ATOM 0 HD23 LEU A 114 29.909 18.209 -1.334 1.00 50.51 H new ATOM 1632 N VAL A 115 28.943 17.639 3.582 1.00 72.22 N ATOM 1633 CA VAL A 115 28.215 17.263 4.787 1.00 32.34 C ATOM 1634 C VAL A 115 26.878 17.995 4.846 1.00 1.13 C ATOM 1635 O VAL A 115 25.874 17.438 5.281 1.00 25.22 O ATOM 1636 CB VAL A 115 29.033 17.571 6.068 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.237 17.233 7.329 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.362 16.819 6.055 1.00 35.24 C ATOM 0 H VAL A 115 29.816 18.137 3.754 1.00 72.22 H new ATOM 0 HA VAL A 115 28.042 16.188 4.744 1.00 32.34 H new ATOM 0 HB VAL A 115 29.241 18.641 6.080 1.00 63.01 H new ATOM 0 HG11 VAL A 115 28.837 17.460 8.210 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.322 17.825 7.351 1.00 14.41 H new ATOM 0 HG13 VAL A 115 27.983 16.173 7.326 1.00 14.41 H new ATOM 0 HG21 VAL A 115 30.919 17.050 6.963 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.173 15.747 6.008 1.00 35.24 H new ATOM 0 HG23 VAL A 115 30.944 17.123 5.185 1.00 35.24 H new ATOM 1648 N ASP A 116 26.873 19.244 4.386 1.00 34.11 N ATOM 1649 CA ASP A 116 25.668 20.073 4.400 1.00 22.44 C ATOM 1650 C ASP A 116 24.561 19.437 3.565 1.00 4.20 C ATOM 1651 O ASP A 116 23.439 19.244 4.040 1.00 63.50 O ATOM 1652 CB ASP A 116 25.978 21.472 3.859 1.00 1.42 C ATOM 1653 CG ASP A 116 24.808 22.432 4.015 1.00 43.12 C ATOM 1654 OD1 ASP A 116 24.041 22.610 3.043 1.00 62.34 O ATOM 1655 OD2 ASP A 116 24.641 23.006 5.115 1.00 50.12 O1- ATOM 0 H ASP A 116 27.694 19.707 3.997 1.00 34.11 H new ATOM 0 HA ASP A 116 25.327 20.153 5.432 1.00 22.44 H new ATOM 0 HB2 ASP A 116 26.846 21.875 4.381 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.245 21.399 2.805 1.00 1.42 H new ATOM 1660 N ARG A 117 24.890 19.109 2.317 1.00 43.12 N ATOM 1661 CA ARG A 117 23.914 18.549 1.386 1.00 25.23 C ATOM 1662 C ARG A 117 23.520 17.128 1.801 1.00 51.42 C ATOM 1663 O ARG A 117 22.338 16.765 1.779 1.00 42.42 O ATOM 1664 CB ARG A 117 24.468 18.579 -0.049 1.00 4.30 C ATOM 1665 CG ARG A 117 25.816 17.882 -0.206 1.00 3.24 C ATOM 1666 CD ARG A 117 26.462 18.167 -1.557 1.00 12.41 C ATOM 1667 NE ARG A 117 25.744 17.531 -2.666 1.00 15.40 N ATOM 1668 CZ ARG A 117 26.158 17.555 -3.937 1.00 54.12 C ATOM 1669 NH1 ARG A 117 27.240 18.243 -4.285 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 25.476 16.905 -4.867 1.00 65.24 N ATOM 0 H ARG A 117 25.826 19.222 1.927 1.00 43.12 H new ATOM 0 HA ARG A 117 23.013 19.162 1.414 1.00 25.23 H new ATOM 0 HB2 ARG A 117 23.746 18.108 -0.716 1.00 4.30 H new ATOM 0 HB3 ARG A 117 24.567 19.617 -0.368 1.00 4.30 H new ATOM 0 HG2 ARG A 117 26.486 18.208 0.590 1.00 3.24 H new ATOM 0 HG3 ARG A 117 25.682 16.807 -0.090 1.00 3.24 H new ATOM 0 HD2 ARG A 117 26.496 19.244 -1.720 1.00 12.41 H new ATOM 0 HD3 ARG A 117 27.493 17.814 -1.545 1.00 12.41 H new ATOM 0 HE ARG A 117 24.875 17.040 -2.455 1.00 15.40 H new ATOM 0 HH11 ARG A 117 27.764 18.760 -3.579 1.00 44.31 H new ATOM 0 HH12 ARG A 117 27.546 18.254 -5.258 1.00 44.31 H new ATOM 0 HH21 ARG A 117 24.635 16.386 -4.614 1.00 65.24 H new ATOM 0 HH22 ARG A 117 25.791 16.923 -5.837 1.00 65.24 H new ATOM 1684 N ALA A 118 24.510 16.338 2.206 1.00 40.10 N ATOM 1685 CA ALA A 118 24.262 14.984 2.696 1.00 45.33 C ATOM 1686 C ALA A 118 23.347 15.025 3.921 1.00 63.41 C ATOM 1687 O ALA A 118 22.460 14.186 4.085 1.00 0.11 O ATOM 1688 CB ALA A 118 25.578 14.291 3.028 1.00 44.02 C ATOM 0 H ALA A 118 25.493 16.612 2.205 1.00 40.10 H new ATOM 0 HA ALA A 118 23.764 14.413 1.913 1.00 45.33 H new ATOM 0 HB1 ALA A 118 25.377 13.283 3.392 1.00 44.02 H new ATOM 0 HB2 ALA A 118 26.197 14.237 2.132 1.00 44.02 H new ATOM 0 HB3 ALA A 118 26.103 14.857 3.798 1.00 44.02 H new ATOM 1694 N HIS A 119 23.563 16.027 4.767 1.00 52.13 N ATOM 1695 CA HIS A 119 22.735 16.245 5.951 1.00 15.33 C ATOM 1696 C HIS A 119 21.369 16.803 5.547 1.00 0.40 C ATOM 1697 O HIS A 119 20.382 16.644 6.264 1.00 63.33 O ATOM 1698 CB HIS A 119 23.447 17.210 6.907 1.00 54.45 C ATOM 1699 CG HIS A 119 22.779 17.373 8.233 1.00 21.21 C ATOM 1700 ND1 HIS A 119 22.124 18.525 8.608 1.00 2.34 N ATOM 1701 CD2 HIS A 119 22.707 16.538 9.295 1.00 20.34 C ATOM 1702 CE1 HIS A 119 21.687 18.394 9.843 1.00 52.23 C ATOM 1703 NE2 HIS A 119 22.026 17.197 10.282 1.00 74.13 N ATOM 0 H HIS A 119 24.313 16.709 4.653 1.00 52.13 H new ATOM 0 HA HIS A 119 22.579 15.293 6.459 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.465 16.856 7.068 1.00 54.45 H new ATOM 0 HB3 HIS A 119 23.521 18.187 6.429 1.00 54.45 H new ATOM 0 HD1 HIS A 119 21.997 19.350 8.021 1.00 2.34 H new ATOM 0 HD2 HIS A 119 23.111 15.538 9.353 1.00 20.34 H new ATOM 0 HE1 HIS A 119 21.143 19.141 10.402 1.00 52.23 H new ATOM 1712 N HIS A 120 21.324 17.455 4.391 1.00 43.52 N ATOM 1713 CA HIS A 120 20.078 18.006 3.860 1.00 31.45 C ATOM 1714 C HIS A 120 19.175 16.880 3.363 1.00 61.14 C ATOM 1715 O HIS A 120 17.951 16.938 3.511 1.00 43.11 O ATOM 1716 CB HIS A 120 20.379 18.986 2.717 1.00 2.24 C ATOM 1717 CG HIS A 120 19.172 19.718 2.203 1.00 45.12 C ATOM 1718 ND1 HIS A 120 18.667 19.553 0.930 1.00 44.32 N ATOM 1719 CD2 HIS A 120 18.385 20.645 2.797 1.00 50.50 C ATOM 1720 CE1 HIS A 120 17.625 20.346 0.767 1.00 65.24 C ATOM 1721 NE2 HIS A 120 17.433 21.019 1.885 1.00 75.14 N ATOM 0 H HIS A 120 22.139 17.617 3.799 1.00 43.52 H new ATOM 0 HA HIS A 120 19.563 18.543 4.657 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.113 19.714 3.061 1.00 2.24 H new ATOM 0 HB3 HIS A 120 20.836 18.438 1.893 1.00 2.24 H new ATOM 0 HD2 HIS A 120 18.488 21.021 3.804 1.00 50.50 H new ATOM 0 HE1 HIS A 120 17.030 20.430 -0.130 1.00 65.24 H new ATOM 0 HE2 HIS A 120 16.696 21.706 2.045 1.00 75.14 H new ATOM 1730 N VAL A 121 19.790 15.855 2.774 1.00 33.11 N ATOM 1731 CA VAL A 121 19.045 14.716 2.228 1.00 23.21 C ATOM 1732 C VAL A 121 18.888 13.576 3.245 1.00 3.02 C ATOM 1733 O VAL A 121 18.311 12.533 2.922 1.00 30.52 O ATOM 1734 CB VAL A 121 19.716 14.165 0.941 1.00 61.42 C ATOM 1735 CG1 VAL A 121 19.813 15.254 -0.125 1.00 74.54 C ATOM 1736 CG2 VAL A 121 21.092 13.573 1.246 1.00 44.31 C ATOM 0 H VAL A 121 20.802 15.788 2.662 1.00 33.11 H new ATOM 0 HA VAL A 121 18.053 15.096 1.985 1.00 23.21 H new ATOM 0 HB VAL A 121 19.090 13.362 0.552 1.00 61.42 H new ATOM 0 HG11 VAL A 121 20.286 14.847 -1.019 1.00 74.54 H new ATOM 0 HG12 VAL A 121 18.813 15.610 -0.374 1.00 74.54 H new ATOM 0 HG13 VAL A 121 20.409 16.084 0.255 1.00 74.54 H new ATOM 0 HG21 VAL A 121 21.538 13.195 0.326 1.00 44.31 H new ATOM 0 HG22 VAL A 121 21.734 14.345 1.670 1.00 44.31 H new ATOM 0 HG23 VAL A 121 20.987 12.756 1.960 1.00 44.31 H new ATOM 1746 N CYS A 122 19.392 13.764 4.466 1.00 31.44 N ATOM 1747 CA CYS A 122 19.297 12.723 5.492 1.00 53.14 C ATOM 1748 C CYS A 122 17.852 12.599 5.996 1.00 23.34 C ATOM 1749 O CYS A 122 17.223 13.601 6.336 1.00 24.32 O ATOM 1750 CB CYS A 122 20.245 13.014 6.664 1.00 50.43 C ATOM 1751 SG CYS A 122 19.779 14.438 7.675 1.00 72.12 S ATOM 0 H CYS A 122 19.865 14.616 4.767 1.00 31.44 H new ATOM 0 HA CYS A 122 19.596 11.777 5.040 1.00 53.14 H new ATOM 0 HB2 CYS A 122 20.293 12.132 7.303 1.00 50.43 H new ATOM 0 HB3 CYS A 122 21.248 13.177 6.270 1.00 50.43 H new ATOM 0 HG CYS A 122 20.111 15.534 7.060 1.00 72.12 H new ATOM 1757 N PRO A 123 17.311 11.361 6.063 1.00 50.40 N ATOM 1758 CA PRO A 123 15.911 11.112 6.458 1.00 60.03 C ATOM 1759 C PRO A 123 15.641 11.353 7.952 1.00 74.45 C ATOM 1760 O PRO A 123 14.557 11.043 8.444 1.00 30.15 O ATOM 1761 CB PRO A 123 15.690 9.623 6.103 1.00 24.23 C ATOM 1762 CG PRO A 123 16.876 9.225 5.284 1.00 34.14 C ATOM 1763 CD PRO A 123 18.004 10.107 5.737 1.00 45.03 C ATOM 0 HA PRO A 123 15.234 11.797 5.948 1.00 60.03 H new ATOM 0 HB2 PRO A 123 15.612 9.013 7.003 1.00 24.23 H new ATOM 0 HB3 PRO A 123 14.764 9.486 5.544 1.00 24.23 H new ATOM 0 HG2 PRO A 123 17.119 8.173 5.434 1.00 34.14 H new ATOM 0 HG3 PRO A 123 16.679 9.359 4.220 1.00 34.14 H new ATOM 0 HD2 PRO A 123 18.522 9.692 6.602 1.00 45.03 H new ATOM 0 HD3 PRO A 123 18.750 10.246 4.955 1.00 45.03 H new ATOM 1771 N TYR A 124 16.622 11.897 8.666 1.00 53.44 N ATOM 1772 CA TYR A 124 16.472 12.201 10.094 1.00 1.24 C ATOM 1773 C TYR A 124 16.517 13.723 10.294 1.00 42.34 C ATOM 1774 O TYR A 124 16.980 14.215 11.323 1.00 23.13 O ATOM 1775 CB TYR A 124 17.584 11.506 10.916 1.00 65.44 C ATOM 1776 CG TYR A 124 17.681 9.993 10.702 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.212 9.076 11.654 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.244 9.481 9.534 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.304 7.713 11.437 1.00 14.31 C ATOM 1780 CE2 TYR A 124 18.337 8.118 9.318 1.00 12.12 C ATOM 1781 CZ TYR A 124 17.868 7.240 10.272 1.00 5.42 C ATOM 1782 OH TYR A 124 17.961 5.883 10.059 1.00 60.35 O ATOM 0 H TYR A 124 17.535 12.139 8.281 1.00 53.44 H new ATOM 0 HA TYR A 124 15.512 11.823 10.446 1.00 1.24 H new ATOM 0 HB2 TYR A 124 18.543 11.958 10.662 1.00 65.44 H new ATOM 0 HB3 TYR A 124 17.411 11.700 11.975 1.00 65.44 H new ATOM 0 HD1 TYR A 124 16.772 9.440 12.571 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.615 10.162 8.783 1.00 13.25 H new ATOM 0 HE1 TYR A 124 16.935 7.021 12.179 1.00 14.31 H new ATOM 0 HE2 TYR A 124 18.776 7.743 8.405 1.00 12.12 H new ATOM 0 HH TYR A 124 18.382 5.716 9.190 1.00 60.35 H new ATOM 1792 N SER A 125 15.995 14.456 9.306 1.00 23.21 N ATOM 1793 CA SER A 125 16.058 15.921 9.274 1.00 62.44 C ATOM 1794 C SER A 125 15.430 16.565 10.518 1.00 2.13 C ATOM 1795 O SER A 125 16.110 17.264 11.271 1.00 5.11 O ATOM 1796 CB SER A 125 15.379 16.431 7.998 1.00 61.32 C ATOM 1797 OG SER A 125 14.146 15.764 7.785 1.00 44.54 O ATOM 0 H SER A 125 15.515 14.049 8.503 1.00 23.21 H new ATOM 0 HA SER A 125 17.109 16.211 9.274 1.00 62.44 H new ATOM 0 HB2 SER A 125 15.209 17.505 8.075 1.00 61.32 H new ATOM 0 HB3 SER A 125 16.036 16.273 7.143 1.00 61.32 H new ATOM 0 HG SER A 125 13.727 16.104 6.967 1.00 44.54 H new ATOM 1803 N ASN A 126 14.137 16.336 10.744 1.00 23.44 N ATOM 1804 CA ASN A 126 13.466 16.893 11.926 1.00 73.42 C ATOM 1805 C ASN A 126 14.161 16.407 13.196 1.00 24.25 C ATOM 1806 O ASN A 126 14.245 17.125 14.196 1.00 64.13 O ATOM 1807 CB ASN A 126 11.972 16.516 11.973 1.00 54.23 C ATOM 1808 CG ASN A 126 11.136 17.213 10.907 1.00 23.41 C ATOM 1809 OD1 ASN A 126 10.643 18.402 11.220 1.00 4.50 O flip ATOM 1810 ND2 ASN A 126 10.937 16.691 9.812 1.00 5.31 N flip ATOM 0 H ASN A 126 13.537 15.778 10.136 1.00 23.44 H new ATOM 0 HA ASN A 126 13.532 17.979 11.860 1.00 73.42 H new ATOM 0 HB2 ASN A 126 11.874 15.437 11.853 1.00 54.23 H new ATOM 0 HB3 ASN A 126 11.573 16.765 12.956 1.00 54.23 H new ATOM 0 HD21 ASN A 126 11.332 15.774 9.605 1.00 5.31 H new ATOM 0 HD22 ASN A 126 10.377 17.175 9.111 1.00 5.31 H new ATOM 1817 N ALA A 127 14.698 15.194 13.122 1.00 54.04 N ATOM 1818 CA ALA A 127 15.345 14.548 14.259 1.00 54.10 C ATOM 1819 C ALA A 127 16.770 15.039 14.459 1.00 52.15 C ATOM 1820 O ALA A 127 17.494 14.512 15.298 1.00 1.24 O ATOM 1821 CB ALA A 127 15.351 13.041 14.060 1.00 41.33 C ATOM 0 H ALA A 127 14.697 14.630 12.272 1.00 54.04 H new ATOM 0 HA ALA A 127 14.775 14.807 15.151 1.00 54.10 H new ATOM 0 HB1 ALA A 127 15.835 12.563 14.912 1.00 41.33 H new ATOM 0 HB2 ALA A 127 14.326 12.681 13.977 1.00 41.33 H new ATOM 0 HB3 ALA A 127 15.897 12.797 13.149 1.00 41.33 H new ATOM 1827 N THR A 128 17.178 16.037 13.691 1.00 1.20 N ATOM 1828 CA THR A 128 18.542 16.537 13.769 1.00 2.03 C ATOM 1829 C THR A 128 18.556 17.927 14.397 1.00 41.31 C ATOM 1830 O THR A 128 19.585 18.401 14.880 1.00 64.41 O ATOM 1831 CB THR A 128 19.197 16.569 12.360 1.00 53.22 C ATOM 1832 OG1 THR A 128 20.611 16.362 12.466 1.00 44.43 O ATOM 1833 CG2 THR A 128 18.940 17.896 11.644 1.00 73.21 C ATOM 0 H THR A 128 16.588 16.515 13.010 1.00 1.20 H new ATOM 0 HA THR A 128 19.123 15.863 14.398 1.00 2.03 H new ATOM 0 HB THR A 128 18.744 15.768 11.776 1.00 53.22 H new ATOM 0 HG1 THR A 128 21.061 16.782 11.703 1.00 44.43 H new ATOM 0 HG21 THR A 128 19.414 17.878 10.663 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.867 18.044 11.525 1.00 73.21 H new ATOM 0 HG23 THR A 128 19.356 18.714 12.233 1.00 73.21 H new ATOM 1841 N ARG A 129 17.395 18.575 14.390 1.00 15.30 N ATOM 1842 CA ARG A 129 17.280 19.940 14.882 1.00 1.24 C ATOM 1843 C ARG A 129 16.050 20.130 15.765 1.00 21.22 C ATOM 1844 O ARG A 129 16.136 20.695 16.854 1.00 60.25 O ATOM 1845 CB ARG A 129 17.215 20.883 13.687 1.00 61.34 C ATOM 1846 CG ARG A 129 16.249 20.420 12.600 1.00 45.30 C ATOM 1847 CD ARG A 129 16.187 21.424 11.469 1.00 1.10 C ATOM 1848 NE ARG A 129 15.378 20.962 10.340 1.00 10.14 N ATOM 1849 CZ ARG A 129 15.419 21.509 9.122 1.00 72.04 C ATOM 1850 NH1 ARG A 129 16.206 22.550 8.883 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 14.665 21.018 8.148 1.00 55.55 N ATOM 0 H ARG A 129 16.521 18.175 14.048 1.00 15.30 H new ATOM 0 HA ARG A 129 18.152 20.160 15.498 1.00 1.24 H new ATOM 0 HB2 ARG A 129 16.915 21.873 14.031 1.00 61.34 H new ATOM 0 HB3 ARG A 129 18.212 20.983 13.258 1.00 61.34 H new ATOM 0 HG2 ARG A 129 16.566 19.451 12.214 1.00 45.30 H new ATOM 0 HG3 ARG A 129 15.255 20.284 13.025 1.00 45.30 H new ATOM 0 HD2 ARG A 129 15.776 22.361 11.844 1.00 1.10 H new ATOM 0 HD3 ARG A 129 17.198 21.636 11.122 1.00 1.10 H new ATOM 0 HE ARG A 129 14.746 20.176 10.492 1.00 10.14 H new ATOM 0 HH11 ARG A 129 16.783 22.936 9.631 1.00 12.15 H new ATOM 0 HH12 ARG A 129 16.234 22.965 7.952 1.00 12.15 H new ATOM 0 HH21 ARG A 129 14.053 20.222 8.329 1.00 55.55 H new ATOM 0 HH22 ARG A 129 14.697 21.436 7.218 1.00 55.55 H new ATOM 1865 N ASN A 130 14.907 19.664 15.284 1.00 53.23 N ATOM 1866 CA ASN A 130 13.636 19.904 15.964 1.00 71.44 C ATOM 1867 C ASN A 130 13.496 19.056 17.222 1.00 71.52 C ATOM 1868 O ASN A 130 12.967 19.521 18.233 1.00 41.25 O ATOM 1869 CB ASN A 130 12.462 19.633 15.012 1.00 51.21 C ATOM 1870 CG ASN A 130 12.456 20.553 13.798 1.00 65.44 C ATOM 1871 OD1 ASN A 130 12.865 21.801 13.981 1.00 64.05 O flip ATOM 1872 ND2 ASN A 130 12.078 20.141 12.705 1.00 32.23 N flip ATOM 0 H ASN A 130 14.830 19.117 14.426 1.00 53.23 H new ATOM 0 HA ASN A 130 13.620 20.951 16.267 1.00 71.44 H new ATOM 0 HB2 ASN A 130 12.506 18.597 14.676 1.00 51.21 H new ATOM 0 HB3 ASN A 130 11.525 19.752 15.556 1.00 51.21 H new ATOM 0 HD21 ASN A 130 11.770 19.174 12.603 1.00 32.23 H new ATOM 0 HD22 ASN A 130 12.072 20.766 11.899 1.00 32.23 H new ATOM 1879 N ASN A 131 13.959 17.811 17.166 1.00 23.53 N ATOM 1880 CA ASN A 131 13.835 16.916 18.315 1.00 43.51 C ATOM 1881 C ASN A 131 15.065 17.021 19.218 1.00 71.03 C ATOM 1882 O ASN A 131 14.942 17.016 20.444 1.00 72.12 O ATOM 1883 CB ASN A 131 13.636 15.459 17.861 1.00 43.33 C ATOM 1884 CG ASN A 131 12.883 14.605 18.884 1.00 4.41 C ATOM 1885 OD1 ASN A 131 12.204 13.646 18.519 1.00 52.34 O ATOM 1886 ND2 ASN A 131 12.988 14.936 20.167 1.00 53.22 N ATOM 0 H ASN A 131 14.417 17.402 16.351 1.00 23.53 H new ATOM 0 HA ASN A 131 12.957 17.223 18.882 1.00 43.51 H new ATOM 0 HB2 ASN A 131 13.089 15.451 16.918 1.00 43.33 H new ATOM 0 HB3 ASN A 131 14.610 15.009 17.669 1.00 43.33 H new ATOM 0 HD21 ASN A 131 12.499 14.390 20.876 1.00 53.22 H new ATOM 0 HD22 ASN A 131 13.558 15.736 20.442 1.00 53.22 H new ATOM 1893 N VAL A 132 16.246 17.113 18.607 1.00 22.24 N ATOM 1894 CA VAL A 132 17.508 17.149 19.346 1.00 51.15 C ATOM 1895 C VAL A 132 18.471 18.156 18.731 1.00 30.12 C ATOM 1896 O VAL A 132 18.181 18.752 17.693 1.00 33.10 O ATOM 1897 CB VAL A 132 18.188 15.758 19.383 1.00 54.43 C ATOM 1898 CG1 VAL A 132 17.347 14.753 20.168 1.00 31.31 C ATOM 1899 CG2 VAL A 132 18.451 15.257 17.968 1.00 70.22 C ATOM 0 H VAL A 132 16.355 17.164 17.594 1.00 22.24 H new ATOM 0 HA VAL A 132 17.268 17.450 20.366 1.00 51.15 H new ATOM 0 HB VAL A 132 19.144 15.862 19.896 1.00 54.43 H new ATOM 0 HG11 VAL A 132 17.850 13.786 20.177 1.00 31.31 H new ATOM 0 HG12 VAL A 132 17.221 15.105 21.192 1.00 31.31 H new ATOM 0 HG13 VAL A 132 16.370 14.650 19.697 1.00 31.31 H new ATOM 0 HG21 VAL A 132 18.929 14.278 18.011 1.00 70.22 H new ATOM 0 HG22 VAL A 132 17.507 15.176 17.429 1.00 70.22 H new ATOM 0 HG23 VAL A 132 19.105 15.958 17.450 1.00 70.22 H new ATOM 1909 N ALA A 133 19.613 18.340 19.382 1.00 44.32 N ATOM 1910 CA ALA A 133 20.630 19.270 18.919 1.00 45.42 C ATOM 1911 C ALA A 133 21.828 18.522 18.360 1.00 30.31 C ATOM 1912 O ALA A 133 22.690 18.048 19.102 1.00 14.22 O ATOM 1913 CB ALA A 133 21.050 20.192 20.054 1.00 22.23 C ATOM 0 H ALA A 133 19.858 17.850 20.242 1.00 44.32 H new ATOM 0 HA ALA A 133 20.209 19.876 18.117 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.812 20.885 19.697 1.00 22.23 H new ATOM 0 HB2 ALA A 133 20.185 20.754 20.405 1.00 22.23 H new ATOM 0 HB3 ALA A 133 21.455 19.599 20.874 1.00 22.23 H new ATOM 1919 N VAL A 134 21.848 18.378 17.047 1.00 55.21 N ATOM 1920 CA VAL A 134 22.983 17.779 16.365 1.00 14.23 C ATOM 1921 C VAL A 134 23.945 18.860 15.876 1.00 75.02 C ATOM 1922 O VAL A 134 23.568 19.734 15.093 1.00 44.45 O ATOM 1923 CB VAL A 134 22.549 16.910 15.165 1.00 13.33 C ATOM 1924 CG1 VAL A 134 23.754 16.182 14.581 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.458 15.924 15.578 1.00 40.12 C ATOM 0 H VAL A 134 21.090 18.668 16.430 1.00 55.21 H new ATOM 0 HA VAL A 134 23.482 17.136 17.090 1.00 14.23 H new ATOM 0 HB VAL A 134 22.134 17.560 14.394 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.436 15.572 13.735 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.492 16.911 14.246 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.197 15.542 15.344 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.167 15.322 14.717 1.00 40.12 H new ATOM 0 HG22 VAL A 134 21.836 15.272 16.366 1.00 40.12 H new ATOM 0 HG23 VAL A 134 20.591 16.473 15.946 1.00 40.12 H new ATOM 1935 N ARG A 135 25.182 18.803 16.353 1.00 5.32 N ATOM 1936 CA ARG A 135 26.218 19.740 15.937 1.00 35.41 C ATOM 1937 C ARG A 135 27.043 19.121 14.805 1.00 62.34 C ATOM 1938 O ARG A 135 27.534 17.997 14.934 1.00 24.24 O ATOM 1939 CB ARG A 135 27.128 20.093 17.124 1.00 72.41 C ATOM 1940 CG ARG A 135 26.379 20.534 18.382 1.00 24.53 C ATOM 1941 CD ARG A 135 25.486 21.750 18.140 1.00 72.30 C ATOM 1942 NE ARG A 135 24.850 22.211 19.379 1.00 54.11 N ATOM 1943 CZ ARG A 135 23.816 23.060 19.437 1.00 2.05 C ATOM 1944 NH1 ARG A 135 23.287 23.557 18.324 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 23.322 23.420 20.617 1.00 32.21 N ATOM 0 H ARG A 135 25.494 18.111 17.034 1.00 5.32 H new ATOM 0 HA ARG A 135 25.747 20.656 15.580 1.00 35.41 H new ATOM 0 HB2 ARG A 135 27.742 19.226 17.366 1.00 72.41 H new ATOM 0 HB3 ARG A 135 27.807 20.890 16.822 1.00 72.41 H new ATOM 0 HG2 ARG A 135 25.769 19.707 18.746 1.00 24.53 H new ATOM 0 HG3 ARG A 135 27.099 20.768 19.166 1.00 24.53 H new ATOM 0 HD2 ARG A 135 26.080 22.558 17.713 1.00 72.30 H new ATOM 0 HD3 ARG A 135 24.718 21.498 17.409 1.00 72.30 H new ATOM 0 HE ARG A 135 25.223 21.859 20.261 1.00 54.11 H new ATOM 0 HH11 ARG A 135 23.668 23.292 17.416 1.00 12.22 H new ATOM 0 HH12 ARG A 135 22.500 24.203 18.378 1.00 12.22 H new ATOM 0 HH21 ARG A 135 23.730 23.050 21.475 1.00 32.21 H new ATOM 0 HH22 ARG A 135 22.534 24.067 20.664 1.00 32.21 H new ATOM 1959 N LEU A 136 27.177 19.844 13.697 1.00 14.32 N ATOM 1960 CA LEU A 136 27.914 19.355 12.537 1.00 2.32 C ATOM 1961 C LEU A 136 29.356 19.855 12.542 1.00 50.04 C ATOM 1962 O LEU A 136 29.608 21.059 12.605 1.00 1.31 O ATOM 1963 CB LEU A 136 27.209 19.781 11.243 1.00 33.50 C ATOM 1964 CG LEU A 136 25.949 18.975 10.897 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.276 19.536 9.649 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.302 17.497 10.708 1.00 32.41 C ATOM 0 H LEU A 136 26.782 20.777 13.578 1.00 14.32 H new ATOM 0 HA LEU A 136 27.937 18.266 12.589 1.00 2.32 H new ATOM 0 HB2 LEU A 136 26.938 20.834 11.324 1.00 33.50 H new ATOM 0 HB3 LEU A 136 27.915 19.696 10.417 1.00 33.50 H new ATOM 0 HG LEU A 136 25.245 19.059 11.725 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.385 18.950 9.421 1.00 3.54 H new ATOM 0 HD12 LEU A 136 24.993 20.574 9.824 1.00 3.54 H new ATOM 0 HD13 LEU A 136 25.968 19.485 8.808 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.400 16.936 10.463 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.024 17.396 9.897 1.00 32.41 H new ATOM 0 HD23 LEU A 136 26.734 17.105 11.629 1.00 32.41 H new ATOM 1978 N VAL A 137 30.290 18.912 12.488 1.00 24.14 N ATOM 1979 CA VAL A 137 31.714 19.215 12.429 1.00 11.21 C ATOM 1980 C VAL A 137 32.386 18.363 11.352 1.00 22.22 C ATOM 1981 O VAL A 137 32.225 17.143 11.313 1.00 60.11 O ATOM 1982 CB VAL A 137 32.394 18.990 13.808 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.713 17.855 14.559 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.892 18.712 13.658 1.00 51.44 C ATOM 0 H VAL A 137 30.080 17.914 12.484 1.00 24.14 H new ATOM 0 HA VAL A 137 31.830 20.268 12.171 1.00 11.21 H new ATOM 0 HB VAL A 137 32.284 19.908 14.385 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.202 17.711 15.522 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.663 18.102 14.718 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.785 16.937 13.975 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.334 18.560 14.643 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.037 17.817 13.053 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.373 19.561 13.172 1.00 51.44 H new ATOM 1994 N VAL A 138 33.124 19.019 10.467 1.00 43.23 N ATOM 1995 CA VAL A 138 33.822 18.342 9.380 1.00 53.11 C ATOM 1996 C VAL A 138 35.303 18.203 9.720 1.00 13.33 C ATOM 1997 O VAL A 138 35.906 19.105 10.308 1.00 44.02 O ATOM 1998 CB VAL A 138 33.662 19.071 8.026 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.206 19.446 7.778 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.572 20.284 7.959 1.00 13.44 C ATOM 0 H VAL A 138 33.256 20.030 10.481 1.00 43.23 H new ATOM 0 HA VAL A 138 33.369 17.357 9.272 1.00 53.11 H new ATOM 0 HB VAL A 138 33.962 18.389 7.231 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.120 19.958 6.819 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.595 18.543 7.764 1.00 20.25 H new ATOM 0 HG13 VAL A 138 31.860 20.106 8.574 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.444 20.782 6.998 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.317 20.975 8.763 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.609 19.967 8.068 1.00 13.44 H new ATOM 2010 N ALA A 139 35.863 17.055 9.400 1.00 53.03 N ATOM 2011 CA ALA A 139 37.248 16.739 9.742 1.00 12.31 C ATOM 2012 C ALA A 139 38.021 16.275 8.510 1.00 73.13 C ATOM 2013 O ALA A 139 37.460 15.640 7.613 1.00 43.50 O ATOM 2014 CB ALA A 139 37.292 15.679 10.836 1.00 22.50 C ATOM 0 H ALA A 139 35.379 16.312 8.897 1.00 53.03 H new ATOM 0 HA ALA A 139 37.725 17.645 10.116 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.330 15.452 11.082 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.782 16.052 11.724 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.796 14.774 10.486 1.00 22.50 H new ATOM 2021 N MET B 1 26.234 23.911 25.643 1.00 72.34 N ATOM 2022 CA MET B 1 25.354 23.625 26.770 1.00 63.32 C ATOM 2023 C MET B 1 26.113 22.904 27.881 1.00 71.35 C ATOM 2024 O MET B 1 27.290 22.569 27.737 1.00 2.40 O ATOM 2025 CB MET B 1 24.169 22.764 26.320 1.00 41.04 C ATOM 2026 CG MET B 1 24.581 21.381 25.846 1.00 5.33 C ATOM 2027 SD MET B 1 23.190 20.363 25.316 1.00 24.33 S ATOM 2028 CE MET B 1 22.471 19.904 26.891 1.00 72.42 C ATOM 0 H1 MET B 1 25.793 23.574 24.764 1.00 72.34 H new ATOM 0 H2 MET B 1 26.394 24.937 25.579 1.00 72.34 H new ATOM 0 H3 MET B 1 27.144 23.427 25.782 1.00 72.34 H new ATOM 0 HA MET B 1 24.983 24.575 27.154 1.00 63.32 H new ATOM 0 HB2 MET B 1 23.466 22.663 27.147 1.00 41.04 H new ATOM 0 HB3 MET B 1 23.642 23.275 25.514 1.00 41.04 H new ATOM 0 HG2 MET B 1 25.283 21.483 25.019 1.00 5.33 H new ATOM 0 HG3 MET B 1 25.109 20.871 26.652 1.00 5.33 H new ATOM 0 HE1 MET B 1 22.170 18.857 26.862 1.00 72.42 H new ATOM 0 HE2 MET B 1 23.206 20.049 27.683 1.00 72.42 H new ATOM 0 HE3 MET B 1 21.598 20.527 27.088 1.00 72.42 H new ATOM 2038 N ASN B 2 25.413 22.643 28.975 1.00 33.33 N ATOM 2039 CA ASN B 2 25.997 21.965 30.131 1.00 51.30 C ATOM 2040 C ASN B 2 25.684 20.475 30.068 1.00 60.31 C ATOM 2041 O ASN B 2 24.683 20.016 30.615 1.00 61.35 O ATOM 2042 CB ASN B 2 25.465 22.571 31.442 1.00 21.53 C ATOM 2043 CG ASN B 2 25.995 21.866 32.687 1.00 32.42 C ATOM 2044 OD1 ASN B 2 27.098 21.317 32.690 1.00 51.33 O ATOM 2045 ND2 ASN B 2 25.211 21.881 33.756 1.00 42.33 N ATOM 0 H ASN B 2 24.431 22.892 29.090 1.00 33.33 H new ATOM 0 HA ASN B 2 27.078 22.102 30.109 1.00 51.30 H new ATOM 0 HB2 ASN B 2 25.738 23.625 31.485 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.376 22.524 31.441 1.00 21.53 H new ATOM 0 HD21 ASN B 2 25.515 21.428 34.618 1.00 42.33 H new ATOM 0 HD22 ASN B 2 24.304 22.346 33.717 1.00 42.33 H new ATOM 2052 N ILE B 3 26.511 19.737 29.345 1.00 21.23 N ATOM 2053 CA ILE B 3 26.339 18.300 29.210 1.00 72.42 C ATOM 2054 C ILE B 3 26.667 17.576 30.511 1.00 64.03 C ATOM 2055 O ILE B 3 27.770 17.703 31.046 1.00 40.30 O ATOM 2056 CB ILE B 3 27.231 17.758 28.074 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.812 18.385 26.738 1.00 50.54 C ATOM 2058 CG2 ILE B 3 27.158 16.238 28.003 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.463 17.903 26.241 1.00 13.01 C ATOM 0 H ILE B 3 27.313 20.113 28.840 1.00 21.23 H new ATOM 0 HA ILE B 3 25.292 18.114 28.969 1.00 72.42 H new ATOM 0 HB ILE B 3 28.265 18.031 28.282 1.00 60.30 H new ATOM 0 HG12 ILE B 3 26.784 19.469 26.847 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.569 18.160 25.987 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.795 15.881 27.194 1.00 62.10 H new ATOM 0 HG22 ILE B 3 27.497 15.813 28.948 1.00 62.10 H new ATOM 0 HG23 ILE B 3 26.129 15.931 27.816 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.231 18.387 25.292 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.492 16.823 26.099 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.695 18.152 26.973 1.00 13.01 H new ATOM 2071 N LEU B 4 25.695 16.822 31.007 1.00 23.11 N ATOM 2072 CA LEU B 4 25.857 16.029 32.223 1.00 23.43 C ATOM 2073 C LEU B 4 26.520 14.696 31.900 1.00 41.14 C ATOM 2074 O LEU B 4 27.391 14.226 32.638 1.00 62.34 O ATOM 2075 CB LEU B 4 24.495 15.780 32.881 1.00 50.44 C ATOM 2076 CG LEU B 4 23.731 17.037 33.307 1.00 31.23 C ATOM 2077 CD1 LEU B 4 22.362 16.670 33.878 1.00 75.25 C ATOM 2078 CD2 LEU B 4 24.540 17.847 34.319 1.00 11.04 C ATOM 0 H LEU B 4 24.772 16.741 30.580 1.00 23.11 H new ATOM 0 HA LEU B 4 26.491 16.585 32.914 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.873 15.215 32.187 1.00 50.44 H new ATOM 0 HB3 LEU B 4 24.644 15.151 33.759 1.00 50.44 H new ATOM 0 HG LEU B 4 23.577 17.656 32.423 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.836 17.578 34.174 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.781 16.145 33.120 1.00 75.25 H new ATOM 0 HD13 LEU B 4 22.491 16.025 34.747 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.978 18.735 34.607 1.00 11.04 H new ATOM 0 HD22 LEU B 4 24.733 17.238 35.202 1.00 11.04 H new ATOM 0 HD23 LEU B 4 25.487 18.147 33.871 1.00 11.04 H new ATOM 2090 N TYR B 5 26.102 14.087 30.792 1.00 23.42 N ATOM 2091 CA TYR B 5 26.654 12.793 30.381 1.00 44.15 C ATOM 2092 C TYR B 5 26.835 12.755 28.872 1.00 24.15 C ATOM 2093 O TYR B 5 25.940 13.146 28.131 1.00 75.34 O ATOM 2094 CB TYR B 5 25.733 11.646 30.830 1.00 21.21 C ATOM 2095 CG TYR B 5 26.253 10.255 30.489 1.00 10.12 C ATOM 2096 CD1 TYR B 5 26.019 9.681 29.241 1.00 52.12 C ATOM 2097 CD2 TYR B 5 26.981 9.519 31.418 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.491 8.418 28.934 1.00 75.45 C ATOM 2099 CE2 TYR B 5 27.457 8.253 31.117 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.212 7.709 29.872 1.00 52.51 C ATOM 2101 OH TYR B 5 27.685 6.446 29.563 1.00 25.44 O ATOM 0 H TYR B 5 25.390 14.463 30.166 1.00 23.42 H new ATOM 0 HA TYR B 5 27.626 12.666 30.858 1.00 44.15 H new ATOM 0 HB2 TYR B 5 25.588 11.713 31.908 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.755 11.779 30.368 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.459 10.232 28.500 1.00 52.12 H new ATOM 0 HD2 TYR B 5 27.179 9.942 32.392 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.296 7.988 27.963 1.00 75.45 H new ATOM 0 HE2 TYR B 5 28.017 7.695 31.853 1.00 10.31 H new ATOM 0 HH TYR B 5 27.728 5.904 30.378 1.00 25.44 H new ATOM 2111 N LYS B 6 27.994 12.298 28.423 1.00 30.03 N ATOM 2112 CA LYS B 6 28.268 12.166 27.000 1.00 63.12 C ATOM 2113 C LYS B 6 29.079 10.905 26.717 1.00 12.41 C ATOM 2114 O LYS B 6 30.012 10.572 27.446 1.00 54.02 O ATOM 2115 CB LYS B 6 28.992 13.419 26.488 1.00 22.40 C ATOM 2116 CG LYS B 6 29.403 13.358 25.021 1.00 43.31 C ATOM 2117 CD LYS B 6 29.686 14.748 24.452 1.00 65.01 C ATOM 2118 CE LYS B 6 28.410 15.567 24.287 1.00 23.11 C ATOM 2119 NZ LYS B 6 28.655 16.855 23.588 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.764 12.011 29.027 1.00 30.03 H new ATOM 0 HA LYS B 6 27.322 12.073 26.467 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.344 14.283 26.635 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.883 13.582 27.095 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.292 12.735 24.918 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.612 12.882 24.441 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.374 15.277 25.112 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.182 14.651 23.486 1.00 65.01 H new ATOM 0 HE2 LYS B 6 27.677 14.986 23.727 1.00 23.11 H new ATOM 0 HE3 LYS B 6 27.978 15.765 25.268 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 27.748 17.330 23.408 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.253 17.464 24.182 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.136 16.673 22.684 1.00 52.41 H new ATOM 2133 N THR B 7 28.691 10.205 25.660 1.00 10.14 N ATOM 2134 CA THR B 7 29.338 8.976 25.236 1.00 42.05 C ATOM 2135 C THR B 7 29.660 9.070 23.743 1.00 63.52 C ATOM 2136 O THR B 7 28.850 9.573 22.956 1.00 72.52 O ATOM 2137 CB THR B 7 28.432 7.751 25.532 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.044 6.533 25.085 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.057 7.904 24.884 1.00 24.11 C ATOM 0 H THR B 7 27.908 10.480 25.067 1.00 10.14 H new ATOM 0 HA THR B 7 30.265 8.842 25.794 1.00 42.05 H new ATOM 0 HB THR B 7 28.303 7.704 26.613 1.00 0.35 H new ATOM 0 HG1 THR B 7 28.453 5.777 25.285 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.448 7.029 25.111 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.568 8.797 25.274 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.172 7.995 23.804 1.00 24.11 H new ATOM 2147 N ALA B 8 30.847 8.617 23.358 1.00 4.15 N ATOM 2148 CA ALA B 8 31.324 8.786 21.990 1.00 51.31 C ATOM 2149 C ALA B 8 31.262 7.480 21.211 1.00 33.43 C ATOM 2150 O ALA B 8 31.366 6.391 21.781 1.00 64.22 O ATOM 2151 CB ALA B 8 32.749 9.330 21.996 1.00 24.44 C ATOM 0 H ALA B 8 31.498 8.129 23.974 1.00 4.15 H new ATOM 0 HA ALA B 8 30.668 9.501 21.492 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.096 9.453 20.970 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.768 10.295 22.503 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.403 8.632 22.519 1.00 24.44 H new ATOM 2157 N ALA B 9 31.089 7.600 19.903 1.00 21.22 N ATOM 2158 CA ALA B 9 31.100 6.453 19.011 1.00 20.22 C ATOM 2159 C ALA B 9 31.884 6.785 17.747 1.00 31.45 C ATOM 2160 O ALA B 9 31.855 7.916 17.264 1.00 1.21 O ATOM 2161 CB ALA B 9 29.678 6.023 18.673 1.00 3.15 C ATOM 0 H ALA B 9 30.938 8.492 19.433 1.00 21.22 H new ATOM 0 HA ALA B 9 31.590 5.619 19.514 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.707 5.163 18.004 1.00 3.15 H new ATOM 0 HB2 ALA B 9 29.152 5.753 19.589 1.00 3.15 H new ATOM 0 HB3 ALA B 9 29.156 6.845 18.184 1.00 3.15 H new ATOM 2167 N THR B 10 32.586 5.792 17.230 1.00 33.23 N ATOM 2168 CA THR B 10 33.414 5.935 16.062 1.00 64.31 C ATOM 2169 C THR B 10 32.914 4.976 14.994 1.00 63.33 C ATOM 2170 O THR B 10 32.909 3.757 15.189 1.00 30.04 O ATOM 2171 CB THR B 10 34.887 5.631 16.403 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.324 6.485 17.473 1.00 21.44 O ATOM 2173 CG2 THR B 10 35.777 5.831 15.185 1.00 23.24 C ATOM 0 H THR B 10 32.592 4.850 17.622 1.00 33.23 H new ATOM 0 HA THR B 10 33.358 6.960 15.697 1.00 64.31 H new ATOM 0 HB THR B 10 34.962 4.589 16.716 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.260 6.288 17.688 1.00 21.44 H new ATOM 0 HG21 THR B 10 36.811 5.611 15.450 1.00 23.24 H new ATOM 0 HG22 THR B 10 35.457 5.162 14.386 1.00 23.24 H new ATOM 0 HG23 THR B 10 35.702 6.864 14.845 1.00 23.24 H new ATOM 2181 N SER B 11 32.469 5.532 13.889 1.00 64.42 N ATOM 2182 CA SER B 11 31.835 4.755 12.844 1.00 20.54 C ATOM 2183 C SER B 11 32.660 4.795 11.554 1.00 44.42 C ATOM 2184 O SER B 11 32.837 5.851 10.947 1.00 74.01 O ATOM 2185 CB SER B 11 30.422 5.299 12.635 1.00 74.14 C ATOM 2186 OG SER B 11 29.643 5.141 13.811 1.00 11.25 O ATOM 0 H SER B 11 32.535 6.530 13.689 1.00 64.42 H new ATOM 0 HA SER B 11 31.776 3.707 13.138 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.470 6.354 12.364 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.946 4.778 11.805 1.00 74.14 H new ATOM 0 HG SER B 11 28.924 5.807 13.819 1.00 11.25 H new ATOM 2192 N THR B 12 33.183 3.637 11.160 1.00 44.31 N ATOM 2193 CA THR B 12 34.054 3.524 9.994 1.00 14.13 C ATOM 2194 C THR B 12 33.275 3.033 8.770 1.00 53.42 C ATOM 2195 O THR B 12 32.162 2.527 8.894 1.00 32.44 O ATOM 2196 CB THR B 12 35.200 2.533 10.294 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.798 2.846 11.563 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.272 2.566 9.210 1.00 31.31 C ATOM 0 H THR B 12 33.015 2.752 11.639 1.00 44.31 H new ATOM 0 HA THR B 12 34.460 4.512 9.777 1.00 14.13 H new ATOM 0 HB THR B 12 34.771 1.531 10.319 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.523 2.213 11.748 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.061 1.856 9.457 1.00 31.31 H new ATOM 0 HG22 THR B 12 35.828 2.297 8.251 1.00 31.31 H new ATOM 0 HG23 THR B 12 36.694 3.569 9.146 1.00 31.31 H new ATOM 2206 N GLY B 13 33.865 3.194 7.592 1.00 25.11 N ATOM 2207 CA GLY B 13 33.309 2.613 6.384 1.00 71.12 C ATOM 2208 C GLY B 13 33.931 1.260 6.083 1.00 70.11 C ATOM 2209 O GLY B 13 34.776 1.145 5.195 1.00 42.34 O ATOM 0 H GLY B 13 34.727 3.722 7.451 1.00 25.11 H new ATOM 0 HA2 GLY B 13 32.230 2.503 6.495 1.00 71.12 H new ATOM 0 HA3 GLY B 13 33.476 3.287 5.544 1.00 71.12 H new ATOM 2213 N GLY B 14 33.539 0.242 6.852 1.00 21.54 N ATOM 2214 CA GLY B 14 34.057 -1.104 6.640 1.00 31.21 C ATOM 2215 C GLY B 14 33.605 -1.697 5.314 1.00 73.40 C ATOM 2216 O GLY B 14 34.227 -1.462 4.281 1.00 13.01 O ATOM 0 H GLY B 14 32.871 0.326 7.619 1.00 21.54 H new ATOM 0 HA2 GLY B 14 35.146 -1.080 6.672 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.728 -1.749 7.454 1.00 31.21 H new ATOM 2220 N ARG B 15 32.530 -2.483 5.348 1.00 12.42 N ATOM 2221 CA ARG B 15 31.934 -3.024 4.123 1.00 62.32 C ATOM 2222 C ARG B 15 30.912 -2.033 3.579 1.00 53.41 C ATOM 2223 O ARG B 15 30.984 -1.615 2.423 1.00 34.04 O ATOM 2224 CB ARG B 15 31.274 -4.390 4.391 1.00 22.32 C ATOM 2225 CG ARG B 15 32.244 -5.574 4.397 1.00 23.03 C ATOM 2226 CD ARG B 15 33.386 -5.392 5.391 1.00 52.22 C ATOM 2227 NE ARG B 15 34.215 -6.595 5.493 1.00 65.14 N ATOM 2228 CZ ARG B 15 35.528 -6.590 5.733 1.00 55.23 C ATOM 2229 NH1 ARG B 15 36.185 -5.443 5.860 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 36.182 -7.736 5.842 1.00 51.30 N ATOM 0 H ARG B 15 32.054 -2.760 6.206 1.00 12.42 H new ATOM 0 HA ARG B 15 32.720 -3.175 3.382 1.00 62.32 H new ATOM 0 HB2 ARG B 15 30.764 -4.350 5.353 1.00 22.32 H new ATOM 0 HB3 ARG B 15 30.511 -4.566 3.633 1.00 22.32 H new ATOM 0 HG2 ARG B 15 31.698 -6.485 4.640 1.00 23.03 H new ATOM 0 HG3 ARG B 15 32.656 -5.707 3.397 1.00 23.03 H new ATOM 0 HD2 ARG B 15 34.005 -4.549 5.083 1.00 52.22 H new ATOM 0 HD3 ARG B 15 32.979 -5.147 6.372 1.00 52.22 H new ATOM 0 HE ARG B 15 33.758 -7.499 5.372 1.00 65.14 H new ATOM 0 HH11 ARG B 15 35.686 -4.557 5.774 1.00 21.14 H new ATOM 0 HH12 ARG B 15 37.188 -5.448 6.043 1.00 21.14 H new ATOM 0 HH21 ARG B 15 35.682 -8.620 5.743 1.00 51.30 H new ATOM 0 HH22 ARG B 15 37.185 -7.735 6.025 1.00 51.30 H new ATOM 2244 N ASP B 16 29.956 -1.665 4.427 1.00 43.23 N ATOM 2245 CA ASP B 16 29.000 -0.606 4.108 1.00 64.45 C ATOM 2246 C ASP B 16 29.020 0.439 5.204 1.00 45.23 C ATOM 2247 O ASP B 16 29.030 1.645 4.936 1.00 44.01 O ATOM 2248 CB ASP B 16 27.595 -1.190 3.987 1.00 65.33 C ATOM 2249 CG ASP B 16 26.518 -0.140 3.729 1.00 54.31 C ATOM 2250 OD1 ASP B 16 26.706 0.703 2.826 1.00 24.34 O ATOM 2251 OD2 ASP B 16 25.478 -0.167 4.419 1.00 12.23 O1- ATOM 0 H ASP B 16 29.821 -2.087 5.346 1.00 43.23 H new ATOM 0 HA ASP B 16 29.279 -0.147 3.159 1.00 64.45 H new ATOM 0 HB2 ASP B 16 27.582 -1.919 3.177 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.354 -1.728 4.904 1.00 65.33 H new ATOM 2256 N GLY B 17 29.058 -0.039 6.444 1.00 22.41 N ATOM 2257 CA GLY B 17 29.254 0.842 7.573 1.00 74.22 C ATOM 2258 C GLY B 17 29.711 0.085 8.797 1.00 32.04 C ATOM 2259 O GLY B 17 29.561 -1.136 8.875 1.00 11.23 O ATOM 0 H GLY B 17 28.956 -1.025 6.684 1.00 22.41 H new ATOM 0 HA2 GLY B 17 29.992 1.602 7.318 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.323 1.364 7.794 1.00 74.22 H new ATOM 2263 N ARG B 18 30.288 0.801 9.739 1.00 41.41 N ATOM 2264 CA ARG B 18 30.726 0.229 10.999 1.00 45.30 C ATOM 2265 C ARG B 18 30.385 1.198 12.118 1.00 1.35 C ATOM 2266 O ARG B 18 30.321 2.400 11.886 1.00 0.54 O ATOM 2267 CB ARG B 18 32.242 -0.037 10.968 1.00 74.40 C ATOM 2268 CG ARG B 18 32.730 -0.906 12.122 1.00 53.04 C ATOM 2269 CD ARG B 18 34.247 -1.051 12.142 1.00 43.11 C ATOM 2270 NE ARG B 18 34.679 -2.108 13.064 1.00 64.22 N ATOM 2271 CZ ARG B 18 35.893 -2.663 13.054 1.00 63.34 C ATOM 2272 NH1 ARG B 18 36.853 -2.167 12.282 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 36.158 -3.684 13.857 1.00 54.01 N ATOM 0 H ARG B 18 30.468 1.801 9.654 1.00 41.41 H new ATOM 0 HA ARG B 18 30.219 -0.721 11.167 1.00 45.30 H new ATOM 0 HB2 ARG B 18 32.499 -0.520 10.025 1.00 74.40 H new ATOM 0 HB3 ARG B 18 32.771 0.916 10.992 1.00 74.40 H new ATOM 0 HG2 ARG B 18 32.397 -0.473 13.065 1.00 53.04 H new ATOM 0 HG3 ARG B 18 32.275 -1.894 12.047 1.00 53.04 H new ATOM 0 HD2 ARG B 18 34.604 -1.276 11.137 1.00 43.11 H new ATOM 0 HD3 ARG B 18 34.699 -0.104 12.436 1.00 43.11 H new ATOM 0 HE ARG B 18 34.008 -2.440 13.757 1.00 64.22 H new ATOM 0 HH11 ARG B 18 36.665 -1.357 11.692 1.00 23.22 H new ATOM 0 HH12 ARG B 18 37.778 -2.596 12.280 1.00 23.22 H new ATOM 0 HH21 ARG B 18 35.435 -4.044 14.480 1.00 54.01 H new ATOM 0 HH22 ARG B 18 37.085 -4.110 13.851 1.00 54.01 H new ATOM 2287 N ALA B 19 30.161 0.681 13.315 1.00 25.44 N ATOM 2288 CA ALA B 19 29.853 1.511 14.470 1.00 25.14 C ATOM 2289 C ALA B 19 30.515 0.931 15.713 1.00 64.21 C ATOM 2290 O ALA B 19 30.310 -0.237 16.046 1.00 14.23 O ATOM 2291 CB ALA B 19 28.343 1.614 14.662 1.00 63.23 C ATOM 0 H ALA B 19 30.187 -0.319 13.514 1.00 25.44 H new ATOM 0 HA ALA B 19 30.243 2.515 14.302 1.00 25.14 H new ATOM 0 HB1 ALA B 19 28.128 2.238 15.530 1.00 63.23 H new ATOM 0 HB2 ALA B 19 27.893 2.059 13.775 1.00 63.23 H new ATOM 0 HB3 ALA B 19 27.927 0.619 14.819 1.00 63.23 H new ATOM 2297 N THR B 20 31.323 1.736 16.382 1.00 63.15 N ATOM 2298 CA THR B 20 32.021 1.298 17.583 1.00 31.24 C ATOM 2299 C THR B 20 31.881 2.332 18.688 1.00 2.34 C ATOM 2300 O THR B 20 32.451 3.417 18.605 1.00 75.11 O ATOM 2301 CB THR B 20 33.520 1.049 17.276 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.637 0.109 16.198 1.00 53.32 O ATOM 2303 CG2 THR B 20 34.270 0.519 18.493 1.00 14.05 C ATOM 0 H THR B 20 31.514 2.701 16.114 1.00 63.15 H new ATOM 0 HA THR B 20 31.571 0.364 17.919 1.00 31.24 H new ATOM 0 HB THR B 20 33.966 2.004 16.998 1.00 15.15 H new ATOM 0 HG1 THR B 20 34.584 -0.048 16.002 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.317 0.358 18.234 1.00 14.05 H new ATOM 0 HG22 THR B 20 34.204 1.243 19.305 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.826 -0.424 18.812 1.00 14.05 H new ATOM 2311 N SER B 21 31.129 1.995 19.732 1.00 21.31 N ATOM 2312 CA SER B 21 30.979 2.888 20.862 1.00 32.44 C ATOM 2313 C SER B 21 32.343 3.035 21.500 1.00 11.23 C ATOM 2314 O SER B 21 32.827 2.085 22.146 1.00 42.34 O ATOM 2315 CB SER B 21 29.960 2.358 21.878 1.00 31.41 C ATOM 2316 OG SER B 21 29.808 3.254 22.969 1.00 74.21 O ATOM 0 H SER B 21 30.620 1.115 19.813 1.00 21.31 H new ATOM 0 HA SER B 21 30.599 3.852 20.523 1.00 32.44 H new ATOM 0 HB2 SER B 21 28.997 2.211 21.388 1.00 31.41 H new ATOM 0 HB3 SER B 21 30.283 1.384 22.246 1.00 31.41 H new ATOM 0 HG SER B 21 28.958 3.076 23.423 1.00 74.21 H new ATOM 2322 N HIS B 22 32.932 4.226 21.289 1.00 5.04 N ATOM 2323 CA HIS B 22 34.338 4.523 21.579 1.00 32.51 C ATOM 2324 C HIS B 22 34.651 4.378 23.062 1.00 35.24 C ATOM 2325 O HIS B 22 35.813 4.353 23.467 1.00 73.12 O ATOM 2326 CB HIS B 22 34.678 5.944 21.093 1.00 3.43 C ATOM 2327 CG HIS B 22 36.088 6.385 21.378 1.00 12.52 C ATOM 2328 ND1 HIS B 22 37.189 5.877 20.719 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.570 7.300 22.254 1.00 34.34 C ATOM 2330 CE1 HIS B 22 38.282 6.462 21.177 1.00 23.12 C ATOM 2331 NE2 HIS B 22 37.934 7.328 22.107 1.00 12.42 N ATOM 0 H HIS B 22 32.428 5.024 20.903 1.00 5.04 H new ATOM 0 HA HIS B 22 34.955 3.799 21.046 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.505 5.997 20.018 1.00 3.43 H new ATOM 0 HB3 HIS B 22 33.990 6.648 21.561 1.00 3.43 H new ATOM 0 HD2 HIS B 22 35.988 7.897 22.941 1.00 34.34 H new ATOM 0 HE1 HIS B 22 39.290 6.264 20.845 1.00 23.12 H new ATOM 0 HE2 HIS B 22 38.575 7.923 22.633 1.00 12.42 H new ATOM 2340 N ASP B 23 33.604 4.242 23.862 1.00 44.12 N ATOM 2341 CA ASP B 23 33.751 4.004 25.293 1.00 0.24 C ATOM 2342 C ASP B 23 34.049 2.526 25.528 1.00 62.21 C ATOM 2343 O ASP B 23 34.024 2.045 26.662 1.00 40.03 O ATOM 2344 CB ASP B 23 32.455 4.366 26.033 1.00 12.04 C ATOM 2345 CG ASP B 23 31.993 5.807 25.856 1.00 5.31 C ATOM 2346 OD1 ASP B 23 32.237 6.403 24.788 1.00 63.54 O ATOM 2347 OD2 ASP B 23 31.326 6.327 26.774 1.00 33.23 O1- ATOM 0 H ASP B 23 32.636 4.293 23.543 1.00 44.12 H new ATOM 0 HA ASP B 23 34.566 4.623 25.669 1.00 0.24 H new ATOM 0 HB2 ASP B 23 31.662 3.701 25.691 1.00 12.04 H new ATOM 0 HB3 ASP B 23 32.596 4.174 27.097 1.00 12.04 H new ATOM 2352 N GLN B 24 34.303 1.817 24.425 1.00 3.35 N ATOM 2353 CA GLN B 24 34.611 0.389 24.435 1.00 64.10 C ATOM 2354 C GLN B 24 33.362 -0.407 24.770 1.00 11.02 C ATOM 2355 O GLN B 24 33.430 -1.584 25.126 1.00 0.33 O ATOM 2356 CB GLN B 24 35.753 0.075 25.415 1.00 41.34 C ATOM 2357 CG GLN B 24 37.088 0.689 25.013 1.00 71.43 C ATOM 2358 CD GLN B 24 37.562 0.206 23.650 1.00 54.02 C ATOM 2359 OE1 GLN B 24 38.231 -0.821 23.545 1.00 54.01 O ATOM 2360 NE2 GLN B 24 37.230 0.943 22.600 1.00 4.32 N ATOM 0 H GLN B 24 34.300 2.225 23.490 1.00 3.35 H new ATOM 0 HA GLN B 24 34.950 0.098 23.441 1.00 64.10 H new ATOM 0 HB2 GLN B 24 35.480 0.437 26.406 1.00 41.34 H new ATOM 0 HB3 GLN B 24 35.868 -1.006 25.491 1.00 41.34 H new ATOM 0 HG2 GLN B 24 36.996 1.775 24.999 1.00 71.43 H new ATOM 0 HG3 GLN B 24 37.839 0.443 25.764 1.00 71.43 H new ATOM 0 HE21 GLN B 24 36.674 1.789 22.726 1.00 4.32 H new ATOM 0 HE22 GLN B 24 37.531 0.665 21.666 1.00 4.32 H new ATOM 2369 N LYS B 25 32.218 0.252 24.627 1.00 34.11 N ATOM 2370 CA LYS B 25 30.932 -0.356 24.915 1.00 33.22 C ATOM 2371 C LYS B 25 30.395 -1.138 23.718 1.00 40.01 C ATOM 2372 O LYS B 25 29.646 -2.099 23.904 1.00 34.42 O ATOM 2373 CB LYS B 25 29.933 0.726 25.347 1.00 20.21 C ATOM 2374 CG LYS B 25 30.336 1.400 26.652 1.00 22.43 C ATOM 2375 CD LYS B 25 29.533 2.666 26.942 1.00 41.25 C ATOM 2376 CE LYS B 25 30.101 3.391 28.157 1.00 25.52 C ATOM 2377 NZ LYS B 25 29.549 4.766 28.320 1.00 5.33 N1+ ATOM 0 H LYS B 25 32.160 1.219 24.309 1.00 34.11 H new ATOM 0 HA LYS B 25 31.067 -1.067 25.730 1.00 33.22 H new ATOM 0 HB2 LYS B 25 29.854 1.478 24.562 1.00 20.21 H new ATOM 0 HB3 LYS B 25 28.945 0.280 25.462 1.00 20.21 H new ATOM 0 HG2 LYS B 25 30.204 0.696 27.474 1.00 22.43 H new ATOM 0 HG3 LYS B 25 31.396 1.650 26.613 1.00 22.43 H new ATOM 0 HD2 LYS B 25 29.556 3.325 26.074 1.00 41.25 H new ATOM 0 HD3 LYS B 25 28.489 2.409 27.120 1.00 41.25 H new ATOM 0 HE2 LYS B 25 29.887 2.810 29.054 1.00 25.52 H new ATOM 0 HE3 LYS B 25 31.186 3.448 28.066 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 29.248 4.905 29.306 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 30.281 5.465 28.080 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 28.732 4.889 27.688 1.00 5.33 H new ATOM 2391 N LEU B 26 30.763 -0.755 22.484 1.00 71.52 N ATOM 2392 CA LEU B 26 30.195 -1.445 21.318 1.00 40.15 C ATOM 2393 C LEU B 26 31.144 -1.464 20.151 1.00 62.33 C ATOM 2394 O LEU B 26 31.923 -0.542 19.963 1.00 50.50 O ATOM 2395 CB LEU B 26 28.868 -0.778 20.925 1.00 64.14 C ATOM 2396 CG LEU B 26 28.249 -1.218 19.588 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.808 -2.678 19.634 1.00 23.12 C ATOM 2398 CD2 LEU B 26 27.083 -0.307 19.227 1.00 31.22 C ATOM 0 H LEU B 26 31.422 -0.005 22.273 1.00 71.52 H new ATOM 0 HA LEU B 26 30.016 -2.484 21.595 1.00 40.15 H new ATOM 0 HB2 LEU B 26 28.143 -0.969 21.716 1.00 64.14 H new ATOM 0 HB3 LEU B 26 29.025 0.300 20.890 1.00 64.14 H new ATOM 0 HG LEU B 26 29.011 -1.133 18.813 1.00 70.42 H new ATOM 0 HD11 LEU B 26 27.375 -2.958 18.674 1.00 23.12 H new ATOM 0 HD12 LEU B 26 28.670 -3.312 19.842 1.00 23.12 H new ATOM 0 HD13 LEU B 26 27.064 -2.809 20.420 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.651 -0.627 18.279 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.324 -0.361 20.008 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.438 0.720 19.136 1.00 31.22 H new ATOM 2410 N ASP B 27 31.062 -2.536 19.378 1.00 22.45 N ATOM 2411 CA ASP B 27 31.858 -2.690 18.185 1.00 53.33 C ATOM 2412 C ASP B 27 31.154 -3.641 17.206 1.00 42.15 C ATOM 2413 O ASP B 27 31.149 -4.861 17.380 1.00 22.10 O ATOM 2414 CB ASP B 27 33.270 -3.175 18.559 1.00 24.13 C ATOM 2415 CG ASP B 27 33.375 -4.664 18.876 1.00 15.20 C ATOM 2416 OD1 ASP B 27 32.903 -5.089 19.951 1.00 3.40 O ATOM 2417 OD2 ASP B 27 33.952 -5.417 18.053 1.00 21.30 O1- ATOM 0 H ASP B 27 30.439 -3.321 19.566 1.00 22.45 H new ATOM 0 HA ASP B 27 31.966 -1.729 17.683 1.00 53.33 H new ATOM 0 HB2 ASP B 27 33.947 -2.945 17.736 1.00 24.13 H new ATOM 0 HB3 ASP B 27 33.616 -2.609 19.424 1.00 24.13 H new ATOM 2422 N VAL B 28 30.501 -3.062 16.203 1.00 42.42 N ATOM 2423 CA VAL B 28 29.793 -3.829 15.172 1.00 61.03 C ATOM 2424 C VAL B 28 29.885 -3.150 13.814 1.00 62.05 C ATOM 2425 O VAL B 28 30.463 -2.073 13.680 1.00 71.42 O ATOM 2426 CB VAL B 28 28.295 -4.049 15.512 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.133 -5.160 16.541 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.650 -2.747 15.989 1.00 74.12 C ATOM 0 H VAL B 28 30.445 -2.051 16.078 1.00 42.42 H new ATOM 0 HA VAL B 28 30.288 -4.799 15.138 1.00 61.03 H new ATOM 0 HB VAL B 28 27.778 -4.360 14.604 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.075 -5.297 16.765 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.543 -6.088 16.142 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.665 -4.891 17.454 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.600 -2.925 16.222 1.00 74.12 H new ATOM 0 HG22 VAL B 28 28.164 -2.392 16.882 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.725 -1.995 15.204 1.00 74.12 H new ATOM 2438 N LYS B 29 29.305 -3.799 12.815 1.00 64.31 N ATOM 2439 CA LYS B 29 29.294 -3.306 11.444 1.00 24.45 C ATOM 2440 C LYS B 29 27.947 -3.604 10.799 1.00 31.35 C ATOM 2441 O LYS B 29 27.351 -4.652 11.058 1.00 25.23 O ATOM 2442 CB LYS B 29 30.439 -3.962 10.653 1.00 11.40 C ATOM 2443 CG LYS B 29 30.139 -4.210 9.175 1.00 53.23 C ATOM 2444 CD LYS B 29 31.304 -4.881 8.447 1.00 3.25 C ATOM 2445 CE LYS B 29 31.464 -6.358 8.814 1.00 32.51 C ATOM 2446 NZ LYS B 29 31.945 -6.569 10.207 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.824 -4.691 12.934 1.00 64.31 H new ATOM 0 HA LYS B 29 29.443 -2.226 11.440 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.323 -3.329 10.728 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.688 -4.913 11.123 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.251 -4.836 9.088 1.00 53.23 H new ATOM 0 HG3 LYS B 29 29.909 -3.261 8.690 1.00 53.23 H new ATOM 0 HD2 LYS B 29 31.152 -4.794 7.371 1.00 3.25 H new ATOM 0 HD3 LYS B 29 32.227 -4.351 8.683 1.00 3.25 H new ATOM 0 HE2 LYS B 29 30.506 -6.863 8.687 1.00 32.51 H new ATOM 0 HE3 LYS B 29 32.164 -6.824 8.121 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 32.660 -7.325 10.217 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 32.367 -5.689 10.566 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 31.145 -6.841 10.813 1.00 50.55 H new ATOM 2460 N LEU B 30 27.465 -2.686 9.969 1.00 60.42 N ATOM 2461 CA LEU B 30 26.204 -2.868 9.282 1.00 43.12 C ATOM 2462 C LEU B 30 26.389 -2.754 7.770 1.00 50.11 C ATOM 2463 O LEU B 30 27.343 -2.119 7.282 1.00 72.32 O ATOM 2464 CB LEU B 30 25.111 -1.905 9.812 1.00 4.40 C ATOM 2465 CG LEU B 30 25.495 -0.429 10.076 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.424 -0.284 11.286 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.096 0.224 8.835 1.00 52.40 C ATOM 0 H LEU B 30 27.936 -1.806 9.759 1.00 60.42 H new ATOM 0 HA LEU B 30 25.851 -3.877 9.495 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.288 -1.911 9.097 1.00 4.40 H new ATOM 0 HB3 LEU B 30 24.727 -2.320 10.744 1.00 4.40 H new ATOM 0 HG LEU B 30 24.572 0.100 10.314 1.00 61.23 H new ATOM 0 HD11 LEU B 30 26.667 0.768 11.434 1.00 42.23 H new ATOM 0 HD12 LEU B 30 25.926 -0.670 12.175 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.341 -0.847 11.111 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.354 1.260 9.057 1.00 52.40 H new ATOM 0 HD22 LEU B 30 26.994 -0.318 8.538 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.370 0.197 8.022 1.00 52.40 H new ATOM 2479 N SER B 31 25.485 -3.407 7.049 1.00 24.22 N ATOM 2480 CA SER B 31 25.537 -3.493 5.600 1.00 21.40 C ATOM 2481 C SER B 31 24.181 -3.922 5.061 1.00 43.34 C ATOM 2482 O SER B 31 23.692 -5.007 5.382 1.00 1.33 O ATOM 2483 CB SER B 31 26.621 -4.492 5.155 1.00 62.35 C ATOM 2484 OG SER B 31 27.912 -4.084 5.585 1.00 3.34 O ATOM 0 H SER B 31 24.689 -3.895 7.460 1.00 24.22 H new ATOM 0 HA SER B 31 25.789 -2.511 5.201 1.00 21.40 H new ATOM 0 HB2 SER B 31 26.396 -5.479 5.560 1.00 62.35 H new ATOM 0 HB3 SER B 31 26.610 -4.583 4.069 1.00 62.35 H new ATOM 0 HG SER B 31 27.847 -3.220 6.042 1.00 3.34 H new ATOM 2490 N ALA B 32 23.571 -3.057 4.258 1.00 40.52 N ATOM 2491 CA ALA B 32 22.286 -3.356 3.642 1.00 75.13 C ATOM 2492 C ALA B 32 22.396 -4.599 2.753 1.00 31.44 C ATOM 2493 O ALA B 32 23.329 -4.710 1.950 1.00 42.31 O ATOM 2494 CB ALA B 32 21.796 -2.158 2.832 1.00 44.15 C ATOM 0 H ALA B 32 23.949 -2.140 4.019 1.00 40.52 H new ATOM 0 HA ALA B 32 21.561 -3.561 4.429 1.00 75.13 H new ATOM 0 HB1 ALA B 32 20.834 -2.395 2.377 1.00 44.15 H new ATOM 0 HB2 ALA B 32 21.684 -1.296 3.489 1.00 44.15 H new ATOM 0 HB3 ALA B 32 22.520 -1.926 2.051 1.00 44.15 H new ATOM 2500 N PRO B 33 21.463 -5.564 2.895 1.00 64.54 N ATOM 2501 CA PRO B 33 21.430 -6.760 2.048 1.00 71.30 C ATOM 2502 C PRO B 33 21.380 -6.385 0.564 1.00 44.54 C ATOM 2503 O PRO B 33 20.864 -5.330 0.196 1.00 60.20 O ATOM 2504 CB PRO B 33 20.140 -7.490 2.478 1.00 5.21 C ATOM 2505 CG PRO B 33 19.362 -6.484 3.261 1.00 53.32 C ATOM 2506 CD PRO B 33 20.383 -5.580 3.893 1.00 34.02 C ATOM 0 HA PRO B 33 22.320 -7.378 2.166 1.00 71.30 H new ATOM 0 HB2 PRO B 33 19.576 -7.836 1.612 1.00 5.21 H new ATOM 0 HB3 PRO B 33 20.367 -8.368 3.082 1.00 5.21 H new ATOM 0 HG2 PRO B 33 18.688 -5.922 2.615 1.00 53.32 H new ATOM 0 HG3 PRO B 33 18.746 -6.969 4.019 1.00 53.32 H new ATOM 0 HD2 PRO B 33 19.984 -4.582 4.073 1.00 34.02 H new ATOM 0 HD3 PRO B 33 20.725 -5.965 4.854 1.00 34.02 H new ATOM 2514 N ARG B 34 21.914 -7.255 -0.281 1.00 0.10 N ATOM 2515 CA ARG B 34 22.017 -6.983 -1.716 1.00 23.43 C ATOM 2516 C ARG B 34 20.681 -7.250 -2.417 1.00 64.55 C ATOM 2517 O ARG B 34 20.547 -7.027 -3.619 1.00 62.12 O ATOM 2518 CB ARG B 34 23.133 -7.847 -2.326 1.00 33.02 C ATOM 2519 CG ARG B 34 23.500 -7.488 -3.762 1.00 11.34 C ATOM 2520 CD ARG B 34 23.975 -6.045 -3.882 1.00 70.25 C ATOM 2521 NE ARG B 34 24.425 -5.712 -5.236 1.00 41.11 N ATOM 2522 CZ ARG B 34 23.614 -5.401 -6.249 1.00 71.43 C ATOM 2523 NH1 ARG B 34 22.294 -5.510 -6.119 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 24.131 -5.017 -7.410 1.00 21.32 N ATOM 0 H ARG B 34 22.286 -8.162 0.000 1.00 0.10 H new ATOM 0 HA ARG B 34 22.264 -5.931 -1.860 1.00 23.43 H new ATOM 0 HB2 ARG B 34 24.024 -7.759 -1.704 1.00 33.02 H new ATOM 0 HB3 ARG B 34 22.824 -8.892 -2.294 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.283 -8.159 -4.115 1.00 11.34 H new ATOM 0 HG3 ARG B 34 22.635 -7.640 -4.407 1.00 11.34 H new ATOM 0 HD2 ARG B 34 23.164 -5.374 -3.597 1.00 70.25 H new ATOM 0 HD3 ARG B 34 24.791 -5.875 -3.180 1.00 70.25 H new ATOM 0 HE ARG B 34 25.429 -5.718 -5.417 1.00 41.11 H new ATOM 0 HH11 ARG B 34 21.893 -5.834 -5.239 1.00 70.13 H new ATOM 0 HH12 ARG B 34 21.683 -5.270 -6.900 1.00 70.13 H new ATOM 0 HH21 ARG B 34 25.143 -4.961 -7.524 1.00 21.32 H new ATOM 0 HH22 ARG B 34 23.516 -4.778 -8.188 1.00 21.32 H new ATOM 2538 N GLU B 35 19.699 -7.692 -1.629 1.00 42.24 N ATOM 2539 CA GLU B 35 18.371 -8.068 -2.120 1.00 63.02 C ATOM 2540 C GLU B 35 17.825 -7.096 -3.169 1.00 12.03 C ATOM 2541 O GLU B 35 17.429 -7.506 -4.260 1.00 54.43 O ATOM 2542 CB GLU B 35 17.391 -8.148 -0.941 1.00 72.41 C ATOM 2543 CG GLU B 35 17.696 -9.262 0.053 1.00 31.33 C ATOM 2544 CD GLU B 35 17.526 -10.645 -0.552 1.00 34.33 C ATOM 2545 OE1 GLU B 35 18.543 -11.337 -0.778 1.00 72.42 O ATOM 2546 OE2 GLU B 35 16.369 -11.044 -0.810 1.00 24.25 O1- ATOM 0 H GLU B 35 19.804 -7.800 -0.620 1.00 42.24 H new ATOM 0 HA GLU B 35 18.473 -9.039 -2.604 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.397 -7.194 -0.413 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.383 -8.290 -1.331 1.00 72.41 H new ATOM 0 HG2 GLU B 35 18.718 -9.151 0.416 1.00 31.33 H new ATOM 0 HG3 GLU B 35 17.039 -9.164 0.917 1.00 31.33 H new ATOM 2553 N LEU B 36 17.776 -5.818 -2.817 1.00 53.04 N ATOM 2554 CA LEU B 36 17.248 -4.791 -3.713 1.00 1.52 C ATOM 2555 C LEU B 36 18.395 -4.128 -4.466 1.00 52.10 C ATOM 2556 O LEU B 36 18.378 -4.022 -5.692 1.00 30.14 O ATOM 2557 CB LEU B 36 16.448 -3.743 -2.914 1.00 63.52 C ATOM 2558 CG LEU B 36 15.032 -4.163 -2.466 1.00 20.23 C ATOM 2559 CD1 LEU B 36 15.032 -5.534 -1.792 1.00 52.43 C ATOM 2560 CD2 LEU B 36 14.441 -3.117 -1.523 1.00 15.21 C ATOM 0 H LEU B 36 18.096 -5.465 -1.915 1.00 53.04 H new ATOM 0 HA LEU B 36 16.575 -5.257 -4.433 1.00 1.52 H new ATOM 0 HB2 LEU B 36 17.023 -3.476 -2.027 1.00 63.52 H new ATOM 0 HB3 LEU B 36 16.362 -2.842 -3.521 1.00 63.52 H new ATOM 0 HG LEU B 36 14.414 -4.232 -3.361 1.00 20.23 H new ATOM 0 HD11 LEU B 36 14.016 -5.792 -1.492 1.00 52.43 H new ATOM 0 HD12 LEU B 36 15.405 -6.283 -2.491 1.00 52.43 H new ATOM 0 HD13 LEU B 36 15.674 -5.507 -0.912 1.00 52.43 H new ATOM 0 HD21 LEU B 36 13.442 -3.427 -1.216 1.00 15.21 H new ATOM 0 HD22 LEU B 36 15.077 -3.019 -0.643 1.00 15.21 H new ATOM 0 HD23 LEU B 36 14.381 -2.157 -2.036 1.00 15.21 H new ATOM 2572 N GLY B 37 19.394 -3.689 -3.713 1.00 22.45 N ATOM 2573 CA GLY B 37 20.562 -3.068 -4.301 1.00 25.41 C ATOM 2574 C GLY B 37 21.544 -2.613 -3.247 1.00 51.22 C ATOM 2575 O GLY B 37 22.124 -1.534 -3.352 1.00 30.40 O ATOM 0 H GLY B 37 19.415 -3.753 -2.695 1.00 22.45 H new ATOM 0 HA2 GLY B 37 21.050 -3.774 -4.972 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.255 -2.214 -4.905 1.00 25.41 H new ATOM 2579 N GLY B 38 21.718 -3.436 -2.213 1.00 53.33 N ATOM 2580 CA GLY B 38 22.643 -3.098 -1.146 1.00 54.12 C ATOM 2581 C GLY B 38 24.047 -3.591 -1.435 1.00 61.21 C ATOM 2582 O GLY B 38 24.574 -3.383 -2.526 1.00 64.12 O ATOM 0 H GLY B 38 21.236 -4.327 -2.097 1.00 53.33 H new ATOM 0 HA2 GLY B 38 22.659 -2.017 -1.009 1.00 54.12 H new ATOM 0 HA3 GLY B 38 22.292 -3.532 -0.210 1.00 54.12 H new ATOM 2586 N ALA B 39 24.644 -4.267 -0.463 1.00 3.10 N ATOM 2587 CA ALA B 39 25.997 -4.805 -0.609 1.00 71.25 C ATOM 2588 C ALA B 39 26.023 -6.312 -0.358 1.00 4.43 C ATOM 2589 O ALA B 39 26.993 -6.987 -0.707 1.00 31.41 O ATOM 2590 CB ALA B 39 26.951 -4.091 0.345 1.00 12.41 C ATOM 0 H ALA B 39 24.213 -4.459 0.441 1.00 3.10 H new ATOM 0 HA ALA B 39 26.323 -4.631 -1.634 1.00 71.25 H new ATOM 0 HB1 ALA B 39 27.955 -4.499 0.228 1.00 12.41 H new ATOM 0 HB2 ALA B 39 26.964 -3.025 0.117 1.00 12.41 H new ATOM 0 HB3 ALA B 39 26.617 -4.238 1.372 1.00 12.41 H new ATOM 2596 N GLY B 40 24.944 -6.834 0.227 1.00 23.34 N ATOM 2597 CA GLY B 40 24.887 -8.244 0.593 1.00 31.44 C ATOM 2598 C GLY B 40 26.084 -8.684 1.412 1.00 1.42 C ATOM 2599 O GLY B 40 26.623 -9.774 1.205 1.00 53.13 O ATOM 0 H GLY B 40 24.104 -6.303 0.455 1.00 23.34 H new ATOM 0 HA2 GLY B 40 23.975 -8.431 1.160 1.00 31.44 H new ATOM 0 HA3 GLY B 40 24.829 -8.848 -0.312 1.00 31.44 H new ATOM 2603 N ALA B 41 26.503 -7.830 2.335 1.00 13.10 N ATOM 2604 CA ALA B 41 27.681 -8.095 3.155 1.00 45.11 C ATOM 2605 C ALA B 41 27.284 -8.507 4.571 1.00 24.05 C ATOM 2606 O ALA B 41 26.112 -8.447 4.945 1.00 14.44 O ATOM 2607 CB ALA B 41 28.585 -6.868 3.188 1.00 11.53 C ATOM 0 H ALA B 41 26.043 -6.942 2.537 1.00 13.10 H new ATOM 0 HA ALA B 41 28.229 -8.924 2.707 1.00 45.11 H new ATOM 0 HB1 ALA B 41 29.460 -7.077 3.803 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.903 -6.623 2.175 1.00 11.53 H new ATOM 0 HB3 ALA B 41 28.039 -6.025 3.610 1.00 11.53 H new ATOM 2613 N GLU B 42 28.279 -8.925 5.343 1.00 15.20 N ATOM 2614 CA GLU B 42 28.082 -9.345 6.728 1.00 53.20 C ATOM 2615 C GLU B 42 27.761 -8.145 7.631 1.00 74.14 C ATOM 2616 O GLU B 42 28.621 -7.635 8.352 1.00 53.42 O ATOM 2617 CB GLU B 42 29.338 -10.079 7.220 1.00 21.14 C ATOM 2618 CG GLU B 42 30.617 -9.277 7.007 1.00 73.23 C ATOM 2619 CD GLU B 42 31.879 -10.039 7.376 1.00 72.34 C ATOM 2620 OE1 GLU B 42 32.559 -10.562 6.468 1.00 61.42 O ATOM 2621 OE2 GLU B 42 32.203 -10.111 8.575 1.00 61.14 O1- ATOM 0 H GLU B 42 29.247 -8.983 5.028 1.00 15.20 H new ATOM 0 HA GLU B 42 27.229 -10.023 6.774 1.00 53.20 H new ATOM 0 HB2 GLU B 42 29.229 -10.304 8.281 1.00 21.14 H new ATOM 0 HB3 GLU B 42 29.422 -11.033 6.699 1.00 21.14 H new ATOM 0 HG2 GLU B 42 30.677 -8.975 5.961 1.00 73.23 H new ATOM 0 HG3 GLU B 42 30.567 -8.364 7.600 1.00 73.23 H new ATOM 2628 N GLY B 43 26.525 -7.673 7.554 1.00 33.24 N ATOM 2629 CA GLY B 43 26.092 -6.566 8.395 1.00 35.43 C ATOM 2630 C GLY B 43 24.589 -6.538 8.624 1.00 2.13 C ATOM 2631 O GLY B 43 23.870 -7.449 8.208 1.00 72.12 O ATOM 0 H GLY B 43 25.810 -8.035 6.924 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.598 -6.631 9.358 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.400 -5.627 7.935 1.00 35.43 H new ATOM 2635 N THR B 44 24.126 -5.495 9.310 1.00 33.20 N ATOM 2636 CA THR B 44 22.705 -5.289 9.591 1.00 33.40 C ATOM 2637 C THR B 44 22.144 -4.167 8.701 1.00 35.03 C ATOM 2638 O THR B 44 22.911 -3.384 8.137 1.00 4.14 O ATOM 2639 CB THR B 44 22.512 -4.928 11.085 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.206 -5.880 11.901 1.00 1.03 O ATOM 2641 CG2 THR B 44 21.037 -4.910 11.476 1.00 34.45 C ATOM 0 H THR B 44 24.729 -4.765 9.689 1.00 33.20 H new ATOM 0 HA THR B 44 22.165 -6.210 9.374 1.00 33.40 H new ATOM 0 HB THR B 44 22.916 -3.928 11.242 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.085 -5.650 12.846 1.00 1.03 H new ATOM 0 HG21 THR B 44 20.943 -4.653 12.531 1.00 34.45 H new ATOM 0 HG22 THR B 44 20.510 -4.170 10.874 1.00 34.45 H new ATOM 0 HG23 THR B 44 20.603 -5.895 11.303 1.00 34.45 H new ATOM 2649 N ASN B 45 20.817 -4.094 8.579 1.00 4.01 N ATOM 2650 CA ASN B 45 20.167 -3.087 7.735 1.00 51.43 C ATOM 2651 C ASN B 45 19.976 -1.781 8.530 1.00 21.43 C ATOM 2652 O ASN B 45 19.619 -1.823 9.713 1.00 31.35 O ATOM 2653 CB ASN B 45 18.816 -3.629 7.228 1.00 71.14 C ATOM 2654 CG ASN B 45 18.470 -3.156 5.823 1.00 11.33 C ATOM 2655 OD1 ASN B 45 19.351 -2.940 4.992 1.00 33.20 O ATOM 2656 ND2 ASN B 45 17.190 -2.994 5.546 1.00 55.34 N ATOM 0 H ASN B 45 20.169 -4.722 9.055 1.00 4.01 H new ATOM 0 HA ASN B 45 20.797 -2.871 6.872 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.841 -4.719 7.242 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.027 -3.319 7.913 1.00 71.14 H new ATOM 0 HD21 ASN B 45 16.905 -2.680 4.618 1.00 55.34 H new ATOM 0 HD22 ASN B 45 16.486 -3.183 6.260 1.00 55.34 H new ATOM 2663 N PRO B 46 20.223 -0.610 7.900 1.00 54.41 N ATOM 2664 CA PRO B 46 20.232 0.699 8.588 1.00 2.04 C ATOM 2665 C PRO B 46 18.929 1.032 9.333 1.00 14.41 C ATOM 2666 O PRO B 46 18.948 1.286 10.545 1.00 12.32 O ATOM 2667 CB PRO B 46 20.482 1.711 7.451 1.00 21.50 C ATOM 2668 CG PRO B 46 20.171 0.972 6.192 1.00 13.22 C ATOM 2669 CD PRO B 46 20.525 -0.462 6.464 1.00 31.44 C ATOM 0 HA PRO B 46 20.988 0.713 9.373 1.00 2.04 H new ATOM 0 HB2 PRO B 46 19.846 2.589 7.559 1.00 21.50 H new ATOM 0 HB3 PRO B 46 21.514 2.062 7.457 1.00 21.50 H new ATOM 0 HG2 PRO B 46 19.118 1.072 5.929 1.00 13.22 H new ATOM 0 HG3 PRO B 46 20.747 1.365 5.355 1.00 13.22 H new ATOM 0 HD2 PRO B 46 19.935 -1.146 5.855 1.00 31.44 H new ATOM 0 HD3 PRO B 46 21.574 -0.667 6.249 1.00 31.44 H new ATOM 2677 N GLU B 47 17.801 1.034 8.622 1.00 51.12 N ATOM 2678 CA GLU B 47 16.532 1.461 9.219 1.00 42.23 C ATOM 2679 C GLU B 47 16.117 0.498 10.331 1.00 51.31 C ATOM 2680 O GLU B 47 15.475 0.895 11.305 1.00 51.34 O ATOM 2681 CB GLU B 47 15.425 1.593 8.152 1.00 43.35 C ATOM 2682 CG GLU B 47 14.878 0.272 7.611 1.00 13.13 C ATOM 2683 CD GLU B 47 15.964 -0.657 7.100 1.00 41.12 C ATOM 2684 OE1 GLU B 47 16.688 -0.270 6.161 1.00 53.12 O ATOM 2685 OE2 GLU B 47 16.104 -1.771 7.651 1.00 73.03 O1- ATOM 0 H GLU B 47 17.738 0.749 7.645 1.00 51.12 H new ATOM 0 HA GLU B 47 16.678 2.448 9.657 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.599 2.162 8.578 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.816 2.175 7.317 1.00 43.35 H new ATOM 0 HG2 GLU B 47 14.318 -0.232 8.398 1.00 13.13 H new ATOM 0 HG3 GLU B 47 14.176 0.480 6.803 1.00 13.13 H new ATOM 2692 N GLN B 48 16.506 -0.766 10.180 1.00 65.22 N ATOM 2693 CA GLN B 48 16.278 -1.775 11.203 1.00 23.21 C ATOM 2694 C GLN B 48 17.084 -1.421 12.445 1.00 44.13 C ATOM 2695 O GLN B 48 16.591 -1.524 13.569 1.00 15.51 O ATOM 2696 CB GLN B 48 16.672 -3.168 10.669 1.00 21.32 C ATOM 2697 CG GLN B 48 16.246 -4.344 11.554 1.00 64.34 C ATOM 2698 CD GLN B 48 17.216 -4.649 12.687 1.00 23.41 C ATOM 2699 OE1 GLN B 48 18.153 -5.428 12.523 1.00 3.40 O ATOM 2700 NE2 GLN B 48 16.990 -4.059 13.848 1.00 12.54 N ATOM 0 H GLN B 48 16.985 -1.115 9.350 1.00 65.22 H new ATOM 0 HA GLN B 48 15.220 -1.801 11.465 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.233 -3.299 9.680 1.00 21.32 H new ATOM 0 HB3 GLN B 48 17.754 -3.200 10.544 1.00 21.32 H new ATOM 0 HG2 GLN B 48 15.265 -4.130 11.977 1.00 64.34 H new ATOM 0 HG3 GLN B 48 16.138 -5.233 10.932 1.00 64.34 H new ATOM 0 HE21 GLN B 48 16.203 -3.418 13.950 1.00 12.54 H new ATOM 0 HE22 GLN B 48 17.602 -4.245 14.642 1.00 12.54 H new ATOM 2709 N LEU B 49 18.321 -0.983 12.223 1.00 25.52 N ATOM 2710 CA LEU B 49 19.216 -0.593 13.306 1.00 12.42 C ATOM 2711 C LEU B 49 18.589 0.558 14.103 1.00 73.15 C ATOM 2712 O LEU B 49 18.466 0.481 15.333 1.00 22.33 O ATOM 2713 CB LEU B 49 20.594 -0.207 12.722 1.00 25.41 C ATOM 2714 CG LEU B 49 21.761 -0.046 13.722 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.648 1.256 14.512 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.840 -1.249 14.664 1.00 31.54 C ATOM 0 H LEU B 49 18.728 -0.889 11.292 1.00 25.52 H new ATOM 0 HA LEU B 49 19.365 -1.428 13.991 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.876 -0.965 11.991 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.481 0.732 12.180 1.00 25.41 H new ATOM 0 HG LEU B 49 22.685 -0.001 13.145 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.486 1.335 15.205 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.665 2.102 13.824 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.712 1.262 15.071 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.669 -1.113 15.359 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.908 -1.335 15.223 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.999 -2.157 14.082 1.00 31.54 H new ATOM 2728 N PHE B 50 18.167 1.612 13.395 1.00 74.53 N ATOM 2729 CA PHE B 50 17.498 2.747 14.041 1.00 13.24 C ATOM 2730 C PHE B 50 16.220 2.289 14.745 1.00 54.12 C ATOM 2731 O PHE B 50 15.958 2.681 15.878 1.00 20.22 O ATOM 2732 CB PHE B 50 17.174 3.862 13.026 1.00 14.34 C ATOM 2733 CG PHE B 50 16.211 4.908 13.561 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.579 5.769 14.588 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.931 5.019 13.038 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.686 6.706 15.087 1.00 14.14 C ATOM 2737 CE2 PHE B 50 14.038 5.952 13.526 1.00 22.12 C ATOM 2738 CZ PHE B 50 14.410 6.795 14.554 1.00 62.30 C ATOM 0 H PHE B 50 18.275 1.703 12.385 1.00 74.53 H new ATOM 0 HA PHE B 50 18.184 3.154 14.783 1.00 13.24 H new ATOM 0 HB2 PHE B 50 18.101 4.352 12.728 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.748 3.413 12.129 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.574 5.708 15.003 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.628 4.364 12.235 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.985 7.365 15.889 1.00 14.14 H new ATOM 0 HE2 PHE B 50 13.047 6.022 13.103 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.710 7.520 14.941 1.00 62.30 H new ATOM 2748 N ALA B 51 15.435 1.459 14.065 1.00 24.13 N ATOM 2749 CA ALA B 51 14.185 0.932 14.620 1.00 31.22 C ATOM 2750 C ALA B 51 14.428 0.215 15.946 1.00 63.22 C ATOM 2751 O ALA B 51 13.751 0.481 16.935 1.00 61.14 O ATOM 2752 CB ALA B 51 13.530 -0.014 13.624 1.00 4.33 C ATOM 0 H ALA B 51 15.642 1.133 13.121 1.00 24.13 H new ATOM 0 HA ALA B 51 13.517 1.772 14.809 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.602 -0.400 14.045 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.313 0.523 12.701 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.205 -0.843 13.412 1.00 4.33 H new ATOM 2758 N ALA B 52 15.400 -0.690 15.951 1.00 2.41 N ATOM 2759 CA ALA B 52 15.745 -1.460 17.145 1.00 55.02 C ATOM 2760 C ALA B 52 16.180 -0.541 18.285 1.00 53.11 C ATOM 2761 O ALA B 52 15.671 -0.644 19.404 1.00 74.31 O ATOM 2762 CB ALA B 52 16.841 -2.474 16.825 1.00 43.35 C ATOM 0 H ALA B 52 15.969 -0.911 15.134 1.00 2.41 H new ATOM 0 HA ALA B 52 14.855 -1.999 17.470 1.00 55.02 H new ATOM 0 HB1 ALA B 52 17.087 -3.040 17.724 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.490 -3.157 16.051 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.729 -1.950 16.471 1.00 43.35 H new ATOM 2768 N GLY B 53 17.115 0.361 17.990 1.00 41.34 N ATOM 2769 CA GLY B 53 17.605 1.288 18.999 1.00 4.13 C ATOM 2770 C GLY B 53 16.509 2.192 19.532 1.00 15.42 C ATOM 2771 O GLY B 53 16.386 2.392 20.740 1.00 73.22 O ATOM 0 H GLY B 53 17.542 0.466 17.070 1.00 41.34 H new ATOM 0 HA2 GLY B 53 18.042 0.726 19.824 1.00 4.13 H new ATOM 0 HA3 GLY B 53 18.401 1.898 18.572 1.00 4.13 H new ATOM 2775 N TYR B 54 15.710 2.726 18.617 1.00 15.35 N ATOM 2776 CA TYR B 54 14.586 3.593 18.957 1.00 21.24 C ATOM 2777 C TYR B 54 13.575 2.845 19.824 1.00 2.44 C ATOM 2778 O TYR B 54 13.219 3.316 20.900 1.00 55.40 O ATOM 2779 CB TYR B 54 13.939 4.126 17.663 1.00 22.10 C ATOM 2780 CG TYR B 54 12.591 4.811 17.839 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.202 5.363 19.056 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.699 4.885 16.777 1.00 20.22 C ATOM 2783 CE1 TYR B 54 10.970 5.951 19.212 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.468 5.484 16.922 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.103 6.014 18.143 1.00 15.31 C ATOM 2786 OH TYR B 54 8.860 6.586 18.304 1.00 73.14 O ATOM 0 H TYR B 54 15.822 2.570 17.615 1.00 15.35 H new ATOM 0 HA TYR B 54 14.945 4.443 19.538 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.627 4.831 17.197 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.817 3.294 16.969 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.882 5.328 19.894 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.976 4.465 15.821 1.00 20.22 H new ATOM 0 HE1 TYR B 54 10.682 6.362 20.168 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.790 5.539 16.083 1.00 11.21 H new ATOM 0 HH TYR B 54 8.170 5.893 18.241 1.00 73.14 H new ATOM 2796 N SER B 55 13.125 1.687 19.366 1.00 62.44 N ATOM 2797 CA SER B 55 12.131 0.913 20.099 1.00 11.44 C ATOM 2798 C SER B 55 12.636 0.586 21.507 1.00 45.34 C ATOM 2799 O SER B 55 11.935 0.811 22.494 1.00 23.33 O ATOM 2800 CB SER B 55 11.783 -0.363 19.329 1.00 71.55 C ATOM 2801 OG SER B 55 11.252 -0.047 18.053 1.00 22.42 O ATOM 0 H SER B 55 13.431 1.261 18.491 1.00 62.44 H new ATOM 0 HA SER B 55 11.224 1.510 20.199 1.00 11.44 H new ATOM 0 HB2 SER B 55 12.674 -0.980 19.215 1.00 71.55 H new ATOM 0 HB3 SER B 55 11.059 -0.950 19.895 1.00 71.55 H new ATOM 0 HG SER B 55 11.984 0.174 17.440 1.00 22.42 H new ATOM 2807 N ALA B 56 13.867 0.090 21.595 1.00 72.32 N ATOM 2808 CA ALA B 56 14.484 -0.216 22.884 1.00 72.14 C ATOM 2809 C ALA B 56 14.566 1.038 23.753 1.00 34.31 C ATOM 2810 O ALA B 56 14.308 0.993 24.961 1.00 51.54 O ATOM 2811 CB ALA B 56 15.866 -0.819 22.678 1.00 11.32 C ATOM 0 H ALA B 56 14.458 -0.109 20.788 1.00 72.32 H new ATOM 0 HA ALA B 56 13.862 -0.947 23.401 1.00 72.14 H new ATOM 0 HB1 ALA B 56 16.314 -1.042 23.646 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.779 -1.738 22.098 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.496 -0.110 22.142 1.00 11.32 H new ATOM 2817 N CYS B 57 14.920 2.155 23.123 1.00 24.02 N ATOM 2818 CA CYS B 57 14.976 3.446 23.801 1.00 54.22 C ATOM 2819 C CYS B 57 13.589 3.842 24.296 1.00 22.14 C ATOM 2820 O CYS B 57 13.446 4.403 25.377 1.00 1.03 O ATOM 2821 CB CYS B 57 15.522 4.524 22.854 1.00 72.40 C ATOM 2822 SG CYS B 57 15.509 6.198 23.542 1.00 42.35 S ATOM 0 H CYS B 57 15.174 2.191 22.136 1.00 24.02 H new ATOM 0 HA CYS B 57 15.646 3.359 24.657 1.00 54.22 H new ATOM 0 HB2 CYS B 57 16.544 4.265 22.579 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.934 4.517 21.937 1.00 72.40 H new ATOM 0 HG CYS B 57 15.846 7.049 22.619 1.00 42.35 H new ATOM 2828 N PHE B 58 12.570 3.512 23.506 1.00 34.03 N ATOM 2829 CA PHE B 58 11.197 3.892 23.809 1.00 42.11 C ATOM 2830 C PHE B 58 10.764 3.293 25.143 1.00 1.15 C ATOM 2831 O PHE B 58 10.099 3.954 25.939 1.00 52.32 O ATOM 2832 CB PHE B 58 10.257 3.439 22.680 1.00 13.13 C ATOM 2833 CG PHE B 58 8.867 4.024 22.771 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.826 3.310 23.350 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.610 5.294 22.279 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.557 3.853 23.434 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.343 5.842 22.360 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.316 5.120 22.938 1.00 52.03 C ATOM 0 H PHE B 58 12.674 2.977 22.644 1.00 34.03 H new ATOM 0 HA PHE B 58 11.143 4.978 23.887 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.696 3.717 21.722 1.00 13.13 H new ATOM 0 HB3 PHE B 58 10.185 2.351 22.695 1.00 13.13 H new ATOM 0 HD1 PHE B 58 8.010 2.319 23.739 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.409 5.863 21.827 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.756 3.288 23.886 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.156 6.833 21.972 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.326 5.546 23.002 1.00 52.03 H new ATOM 2848 N LEU B 59 11.162 2.045 25.389 1.00 60.43 N ATOM 2849 CA LEU B 59 10.852 1.376 26.651 1.00 11.12 C ATOM 2850 C LEU B 59 11.508 2.107 27.824 1.00 60.54 C ATOM 2851 O LEU B 59 10.866 2.371 28.842 1.00 64.41 O ATOM 2852 CB LEU B 59 11.300 -0.100 26.636 1.00 33.41 C ATOM 2853 CG LEU B 59 10.378 -1.086 25.890 1.00 23.42 C ATOM 2854 CD1 LEU B 59 8.951 -1.019 26.435 1.00 12.45 C ATOM 2855 CD2 LEU B 59 10.401 -0.834 24.386 1.00 24.24 C ATOM 0 H LEU B 59 11.699 1.478 24.732 1.00 60.43 H new ATOM 0 HA LEU B 59 9.769 1.401 26.775 1.00 11.12 H new ATOM 0 HB2 LEU B 59 12.292 -0.152 26.187 1.00 33.41 H new ATOM 0 HB3 LEU B 59 11.399 -0.438 27.668 1.00 33.41 H new ATOM 0 HG LEU B 59 10.758 -2.093 26.063 1.00 23.42 H new ATOM 0 HD11 LEU B 59 8.321 -1.724 25.892 1.00 12.45 H new ATOM 0 HD12 LEU B 59 8.954 -1.276 27.494 1.00 12.45 H new ATOM 0 HD13 LEU B 59 8.560 -0.010 26.307 1.00 12.45 H new ATOM 0 HD21 LEU B 59 9.741 -1.545 23.888 1.00 24.24 H new ATOM 0 HD22 LEU B 59 10.061 0.181 24.182 1.00 24.24 H new ATOM 0 HD23 LEU B 59 11.417 -0.958 24.012 1.00 24.24 H new ATOM 2867 N SER B 60 12.786 2.448 27.673 1.00 44.21 N ATOM 2868 CA SER B 60 13.534 3.087 28.751 1.00 2.40 C ATOM 2869 C SER B 60 13.046 4.519 28.981 1.00 73.23 C ATOM 2870 O SER B 60 12.887 4.951 30.126 1.00 65.55 O ATOM 2871 CB SER B 60 15.038 3.072 28.459 1.00 63.24 C ATOM 2872 OG SER B 60 15.771 3.486 29.598 1.00 24.13 O ATOM 0 H SER B 60 13.322 2.293 26.819 1.00 44.21 H new ATOM 0 HA SER B 60 13.358 2.516 29.663 1.00 2.40 H new ATOM 0 HB2 SER B 60 15.347 2.069 28.166 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.258 3.731 27.619 1.00 63.24 H new ATOM 0 HG SER B 60 16.420 2.792 29.839 1.00 24.13 H new ATOM 2878 N ALA B 61 12.794 5.239 27.891 1.00 21.42 N ATOM 2879 CA ALA B 61 12.292 6.608 27.959 1.00 31.00 C ATOM 2880 C ALA B 61 10.913 6.629 28.605 1.00 42.41 C ATOM 2881 O ALA B 61 10.652 7.425 29.500 1.00 44.10 O ATOM 2882 CB ALA B 61 12.247 7.230 26.565 1.00 4.34 C ATOM 0 H ALA B 61 12.931 4.893 26.941 1.00 21.42 H new ATOM 0 HA ALA B 61 12.970 7.201 28.573 1.00 31.00 H new ATOM 0 HB1 ALA B 61 11.870 8.251 26.634 1.00 4.34 H new ATOM 0 HB2 ALA B 61 13.250 7.241 26.139 1.00 4.34 H new ATOM 0 HB3 ALA B 61 11.588 6.643 25.926 1.00 4.34 H new ATOM 2888 N MET B 62 10.046 5.728 28.151 1.00 64.12 N ATOM 2889 CA MET B 62 8.713 5.565 28.732 1.00 62.41 C ATOM 2890 C MET B 62 8.837 5.247 30.221 1.00 51.11 C ATOM 2891 O MET B 62 8.051 5.722 31.047 1.00 53.32 O ATOM 2892 CB MET B 62 7.962 4.439 28.001 1.00 4.11 C ATOM 2893 CG MET B 62 6.523 4.201 28.461 1.00 71.00 C ATOM 2894 SD MET B 62 5.366 5.492 27.939 1.00 51.43 S ATOM 2895 CE MET B 62 5.521 6.692 29.260 1.00 33.40 C ATOM 0 H MET B 62 10.243 5.094 27.377 1.00 64.12 H new ATOM 0 HA MET B 62 8.150 6.491 28.618 1.00 62.41 H new ATOM 0 HB2 MET B 62 7.951 4.666 26.935 1.00 4.11 H new ATOM 0 HB3 MET B 62 8.522 3.512 28.124 1.00 4.11 H new ATOM 0 HG2 MET B 62 6.181 3.241 28.073 1.00 71.00 H new ATOM 0 HG3 MET B 62 6.506 4.129 29.549 1.00 71.00 H new ATOM 0 HE1 MET B 62 4.543 7.121 29.478 1.00 33.40 H new ATOM 0 HE2 MET B 62 5.910 6.202 30.153 1.00 33.40 H new ATOM 0 HE3 MET B 62 6.204 7.484 28.954 1.00 33.40 H new ATOM 2905 N LYS B 63 9.851 4.452 30.551 1.00 72.03 N ATOM 2906 CA LYS B 63 10.133 4.084 31.935 1.00 43.00 C ATOM 2907 C LYS B 63 10.522 5.318 32.748 1.00 70.35 C ATOM 2908 O LYS B 63 10.034 5.520 33.859 1.00 23.43 O ATOM 2909 CB LYS B 63 11.260 3.039 31.994 1.00 31.31 C ATOM 2910 CG LYS B 63 11.537 2.509 33.399 1.00 20.13 C ATOM 2911 CD LYS B 63 12.642 1.449 33.425 1.00 10.22 C ATOM 2912 CE LYS B 63 14.045 2.044 33.264 1.00 1.23 C ATOM 2913 NZ LYS B 63 14.359 2.442 31.860 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.496 4.047 29.872 1.00 72.03 H new ATOM 0 HA LYS B 63 9.230 3.651 32.365 1.00 43.00 H new ATOM 0 HB2 LYS B 63 11.001 2.202 31.345 1.00 31.31 H new ATOM 0 HB3 LYS B 63 12.173 3.481 31.596 1.00 31.31 H new ATOM 0 HG2 LYS B 63 11.820 3.339 34.046 1.00 20.13 H new ATOM 0 HG3 LYS B 63 10.621 2.083 33.809 1.00 20.13 H new ATOM 0 HD2 LYS B 63 12.591 0.902 34.366 1.00 10.22 H new ATOM 0 HD3 LYS B 63 12.465 0.728 32.627 1.00 10.22 H new ATOM 0 HE2 LYS B 63 14.139 2.916 33.911 1.00 1.23 H new ATOM 0 HE3 LYS B 63 14.782 1.315 33.602 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 15.387 2.561 31.755 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 14.028 1.703 31.207 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 13.882 3.339 31.638 1.00 55.13 H new ATOM 2927 N PHE B 64 11.397 6.148 32.181 1.00 21.33 N ATOM 2928 CA PHE B 64 11.852 7.357 32.859 1.00 32.24 C ATOM 2929 C PHE B 64 10.699 8.347 33.005 1.00 14.21 C ATOM 2930 O PHE B 64 10.553 8.995 34.045 1.00 73.11 O ATOM 2931 CB PHE B 64 13.022 8.009 32.111 1.00 30.41 C ATOM 2932 CG PHE B 64 13.533 9.253 32.793 1.00 63.34 C ATOM 2933 CD1 PHE B 64 14.226 9.163 33.994 1.00 43.42 C ATOM 2934 CD2 PHE B 64 13.309 10.509 32.249 1.00 31.33 C ATOM 2935 CE1 PHE B 64 14.682 10.298 34.635 1.00 55.11 C ATOM 2936 CE2 PHE B 64 13.766 11.647 32.885 1.00 33.41 C ATOM 2937 CZ PHE B 64 14.450 11.540 34.080 1.00 14.04 C ATOM 0 H PHE B 64 11.803 6.004 31.256 1.00 21.33 H new ATOM 0 HA PHE B 64 12.204 7.074 33.851 1.00 32.24 H new ATOM 0 HB2 PHE B 64 13.836 7.289 32.021 1.00 30.41 H new ATOM 0 HB3 PHE B 64 12.705 8.260 31.099 1.00 30.41 H new ATOM 0 HD1 PHE B 64 14.410 8.193 34.432 1.00 43.42 H new ATOM 0 HD2 PHE B 64 12.771 10.598 31.317 1.00 31.33 H new ATOM 0 HE1 PHE B 64 15.219 10.214 35.568 1.00 55.11 H new ATOM 0 HE2 PHE B 64 13.589 12.619 32.448 1.00 33.41 H new ATOM 0 HZ PHE B 64 14.804 12.429 34.581 1.00 14.04 H new ATOM 2947 N VAL B 65 9.875 8.449 31.965 1.00 75.05 N ATOM 2948 CA VAL B 65 8.675 9.273 32.020 1.00 40.30 C ATOM 2949 C VAL B 65 7.817 8.848 33.203 1.00 43.44 C ATOM 2950 O VAL B 65 7.364 9.684 33.987 1.00 35.52 O ATOM 2951 CB VAL B 65 7.838 9.174 30.722 1.00 54.45 C ATOM 2952 CG1 VAL B 65 6.462 9.804 30.927 1.00 70.43 C ATOM 2953 CG2 VAL B 65 8.570 9.832 29.552 1.00 51.21 C ATOM 0 H VAL B 65 10.018 7.971 31.075 1.00 75.05 H new ATOM 0 HA VAL B 65 8.995 10.309 32.133 1.00 40.30 H new ATOM 0 HB VAL B 65 7.700 8.120 30.481 1.00 54.45 H new ATOM 0 HG11 VAL B 65 5.885 9.727 30.005 1.00 70.43 H new ATOM 0 HG12 VAL B 65 5.938 9.282 31.728 1.00 70.43 H new ATOM 0 HG13 VAL B 65 6.579 10.854 31.195 1.00 70.43 H new ATOM 0 HG21 VAL B 65 7.963 9.750 28.651 1.00 51.21 H new ATOM 0 HG22 VAL B 65 8.745 10.884 29.778 1.00 51.21 H new ATOM 0 HG23 VAL B 65 9.525 9.332 29.393 1.00 51.21 H new ATOM 2963 N ALA B 66 7.615 7.543 33.332 1.00 30.22 N ATOM 2964 CA ALA B 66 6.895 6.989 34.470 1.00 74.13 C ATOM 2965 C ALA B 66 7.570 7.412 35.772 1.00 44.35 C ATOM 2966 O ALA B 66 6.908 7.682 36.773 1.00 34.23 O ATOM 2967 CB ALA B 66 6.828 5.470 34.367 1.00 23.44 C ATOM 0 H ALA B 66 7.941 6.848 32.661 1.00 30.22 H new ATOM 0 HA ALA B 66 5.876 7.376 34.466 1.00 74.13 H new ATOM 0 HB1 ALA B 66 6.287 5.071 35.225 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.311 5.190 33.449 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.838 5.061 34.353 1.00 23.44 H new ATOM 2973 N GLY B 67 8.892 7.522 35.718 1.00 23.35 N ATOM 2974 CA GLY B 67 9.674 7.853 36.894 1.00 73.24 C ATOM 2975 C GLY B 67 9.470 9.288 37.333 1.00 45.13 C ATOM 2976 O GLY B 67 9.440 9.582 38.529 1.00 75.04 O ATOM 0 H GLY B 67 9.442 7.386 34.870 1.00 23.35 H new ATOM 0 HA2 GLY B 67 9.401 7.183 37.710 1.00 73.24 H new ATOM 0 HA3 GLY B 67 10.731 7.686 36.684 1.00 73.24 H new ATOM 2980 N GLN B 68 9.294 10.186 36.365 1.00 2.12 N ATOM 2981 CA GLN B 68 9.110 11.602 36.658 1.00 44.13 C ATOM 2982 C GLN B 68 7.623 11.887 36.817 1.00 40.32 C ATOM 2983 O GLN B 68 7.219 12.939 37.311 1.00 64.50 O ATOM 2984 CB GLN B 68 9.722 12.465 35.547 1.00 33.05 C ATOM 2985 CG GLN B 68 9.231 12.105 34.154 1.00 52.44 C ATOM 2986 CD GLN B 68 9.737 13.053 33.085 1.00 54.32 C ATOM 2987 OE1 GLN B 68 10.765 12.814 32.459 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.032 14.151 32.893 1.00 53.21 N ATOM 0 H GLN B 68 9.275 9.956 35.372 1.00 2.12 H new ATOM 0 HA GLN B 68 9.621 11.853 37.587 1.00 44.13 H new ATOM 0 HB2 GLN B 68 9.493 13.512 35.744 1.00 33.05 H new ATOM 0 HB3 GLN B 68 10.807 12.365 35.577 1.00 33.05 H new ATOM 0 HG2 GLN B 68 9.550 11.091 33.913 1.00 52.44 H new ATOM 0 HG3 GLN B 68 8.141 12.107 34.147 1.00 52.44 H new ATOM 0 HE21 GLN B 68 8.183 14.313 33.434 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.336 14.838 32.203 1.00 53.21 H new ATOM 2997 N ASN B 69 6.817 10.925 36.387 1.00 21.43 N ATOM 2998 CA ASN B 69 5.370 10.971 36.562 1.00 41.54 C ATOM 2999 C ASN B 69 4.966 10.248 37.846 1.00 23.00 C ATOM 3000 O ASN B 69 3.782 10.156 38.169 1.00 34.41 O ATOM 3001 CB ASN B 69 4.675 10.343 35.346 1.00 65.13 C ATOM 3002 CG ASN B 69 4.378 11.347 34.244 1.00 21.52 C ATOM 3003 OD1 ASN B 69 3.281 11.904 34.174 1.00 65.21 O ATOM 3004 ND2 ASN B 69 5.354 11.604 33.386 1.00 45.52 N ATOM 0 H ASN B 69 7.148 10.089 35.906 1.00 21.43 H new ATOM 0 HA ASN B 69 5.057 12.012 36.644 1.00 41.54 H new ATOM 0 HB2 ASN B 69 5.305 9.549 34.945 1.00 65.13 H new ATOM 0 HB3 ASN B 69 3.743 9.879 35.668 1.00 65.13 H new ATOM 0 HD21 ASN B 69 5.210 12.282 32.638 1.00 45.52 H new ATOM 0 HD22 ASN B 69 6.250 11.124 33.474 1.00 45.52 H new ATOM 3011 N LYS B 70 5.966 9.720 38.561 1.00 4.22 N ATOM 3012 CA LYS B 70 5.762 9.076 39.862 1.00 71.04 C ATOM 3013 C LYS B 70 4.822 7.872 39.749 1.00 55.13 C ATOM 3014 O LYS B 70 4.163 7.486 40.716 1.00 71.33 O ATOM 3015 CB LYS B 70 5.232 10.094 40.887 1.00 43.15 C ATOM 3016 CG LYS B 70 6.314 10.991 41.494 1.00 61.50 C ATOM 3017 CD LYS B 70 7.279 11.529 40.441 1.00 21.25 C ATOM 3018 CE LYS B 70 8.199 12.606 41.003 1.00 20.34 C ATOM 3019 NZ LYS B 70 7.450 13.828 41.399 1.00 73.12 N1+ ATOM 0 H LYS B 70 6.939 9.727 38.254 1.00 4.22 H new ATOM 0 HA LYS B 70 6.726 8.705 40.210 1.00 71.04 H new ATOM 0 HB2 LYS B 70 4.483 10.722 40.405 1.00 43.15 H new ATOM 0 HB3 LYS B 70 4.728 9.556 41.690 1.00 43.15 H new ATOM 0 HG2 LYS B 70 5.842 11.826 42.011 1.00 61.50 H new ATOM 0 HG3 LYS B 70 6.873 10.428 42.241 1.00 61.50 H new ATOM 0 HD2 LYS B 70 7.880 10.709 40.048 1.00 21.25 H new ATOM 0 HD3 LYS B 70 6.711 11.938 39.605 1.00 21.25 H new ATOM 0 HE2 LYS B 70 8.733 12.212 41.868 1.00 20.34 H new ATOM 0 HE3 LYS B 70 8.950 12.867 40.257 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 8.114 14.620 41.516 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 6.756 14.065 40.661 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 6.955 13.656 42.297 1.00 73.12 H new ATOM 3033 N GLN B 71 4.796 7.273 38.564 1.00 41.03 N ATOM 3034 CA GLN B 71 3.956 6.109 38.281 1.00 14.44 C ATOM 3035 C GLN B 71 4.824 4.922 37.877 1.00 73.31 C ATOM 3036 O GLN B 71 5.999 5.086 37.549 1.00 34.15 O ATOM 3037 CB GLN B 71 2.963 6.429 37.154 1.00 1.40 C ATOM 3038 CG GLN B 71 3.631 7.037 35.929 1.00 33.32 C ATOM 3039 CD GLN B 71 2.857 6.829 34.641 1.00 34.04 C ATOM 3040 OE1 GLN B 71 1.955 7.596 34.305 1.00 74.24 O ATOM 3041 NE2 GLN B 71 3.258 5.822 33.886 1.00 0.43 N ATOM 0 H GLN B 71 5.357 7.579 37.769 1.00 41.03 H new ATOM 0 HA GLN B 71 3.399 5.856 39.183 1.00 14.44 H new ATOM 0 HB2 GLN B 71 2.445 5.515 36.863 1.00 1.40 H new ATOM 0 HB3 GLN B 71 2.206 7.119 37.529 1.00 1.40 H new ATOM 0 HG2 GLN B 71 3.764 8.106 36.093 1.00 33.32 H new ATOM 0 HG3 GLN B 71 4.626 6.605 35.818 1.00 33.32 H new ATOM 0 HE21 GLN B 71 4.010 5.212 34.207 1.00 0.43 H new ATOM 0 HE22 GLN B 71 2.816 5.654 32.982 1.00 0.43 H new ATOM 3050 N THR B 72 4.238 3.733 37.892 1.00 1.35 N ATOM 3051 CA THR B 72 4.939 2.520 37.492 1.00 51.41 C ATOM 3052 C THR B 72 4.136 1.761 36.441 1.00 74.12 C ATOM 3053 O THR B 72 2.928 1.560 36.587 1.00 25.05 O ATOM 3054 CB THR B 72 5.211 1.599 38.704 1.00 13.02 C ATOM 3055 OG1 THR B 72 4.007 1.430 39.469 1.00 4.22 O ATOM 3056 CG2 THR B 72 6.314 2.170 39.590 1.00 71.50 C ATOM 0 H THR B 72 3.271 3.582 38.179 1.00 1.35 H new ATOM 0 HA THR B 72 5.897 2.820 37.067 1.00 51.41 H new ATOM 0 HB THR B 72 5.542 0.630 38.329 1.00 13.02 H new ATOM 0 HG1 THR B 72 4.185 0.844 40.234 1.00 4.22 H new ATOM 0 HG21 THR B 72 6.485 1.502 40.434 1.00 71.50 H new ATOM 0 HG22 THR B 72 7.233 2.265 39.011 1.00 71.50 H new ATOM 0 HG23 THR B 72 6.014 3.151 39.958 1.00 71.50 H new ATOM 3064 N LEU B 73 4.811 1.371 35.371 1.00 74.12 N ATOM 3065 CA LEU B 73 4.194 0.595 34.298 1.00 52.35 C ATOM 3066 C LEU B 73 4.732 -0.839 34.315 1.00 64.24 C ATOM 3067 O LEU B 73 5.827 -1.080 34.831 1.00 14.14 O ATOM 3068 CB LEU B 73 4.419 1.279 32.934 1.00 75.15 C ATOM 3069 CG LEU B 73 5.573 2.282 32.897 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.928 1.582 32.998 1.00 33.12 C ATOM 3071 CD2 LEU B 73 5.499 3.152 31.647 1.00 51.14 C ATOM 0 H LEU B 73 5.798 1.580 35.219 1.00 74.12 H new ATOM 0 HA LEU B 73 3.117 0.550 34.461 1.00 52.35 H new ATOM 0 HB2 LEU B 73 4.602 0.509 32.184 1.00 75.15 H new ATOM 0 HB3 LEU B 73 3.502 1.793 32.646 1.00 75.15 H new ATOM 0 HG LEU B 73 5.473 2.930 33.768 1.00 62.34 H new ATOM 0 HD11 LEU B 73 7.725 2.325 32.969 1.00 33.12 H new ATOM 0 HD12 LEU B 73 6.983 1.029 33.935 1.00 33.12 H new ATOM 0 HD13 LEU B 73 7.044 0.892 32.162 1.00 33.12 H new ATOM 0 HD21 LEU B 73 6.331 3.857 31.644 1.00 51.14 H new ATOM 0 HD22 LEU B 73 5.556 2.521 30.760 1.00 51.14 H new ATOM 0 HD23 LEU B 73 4.558 3.702 31.641 1.00 51.14 H new ATOM 3083 N PRO B 74 3.962 -1.813 33.786 1.00 22.31 N ATOM 3084 CA PRO B 74 4.382 -3.221 33.751 1.00 33.15 C ATOM 3085 C PRO B 74 5.701 -3.415 33.006 1.00 51.21 C ATOM 3086 O PRO B 74 5.881 -2.896 31.907 1.00 62.01 O ATOM 3087 CB PRO B 74 3.256 -3.925 32.991 1.00 23.12 C ATOM 3088 CG PRO B 74 2.073 -3.028 33.130 1.00 12.13 C ATOM 3089 CD PRO B 74 2.622 -1.627 33.193 1.00 51.43 C ATOM 0 HA PRO B 74 4.547 -3.609 34.756 1.00 33.15 H new ATOM 0 HB2 PRO B 74 3.519 -4.071 31.943 1.00 23.12 H new ATOM 0 HB3 PRO B 74 3.054 -4.911 33.410 1.00 23.12 H new ATOM 0 HG2 PRO B 74 1.394 -3.144 32.285 1.00 12.13 H new ATOM 0 HG3 PRO B 74 1.506 -3.266 34.030 1.00 12.13 H new ATOM 0 HD2 PRO B 74 2.679 -1.173 32.204 1.00 51.43 H new ATOM 0 HD3 PRO B 74 1.997 -0.977 33.806 1.00 51.43 H new ATOM 3097 N ALA B 75 6.602 -4.177 33.608 1.00 24.41 N ATOM 3098 CA ALA B 75 7.892 -4.493 32.997 1.00 71.53 C ATOM 3099 C ALA B 75 7.729 -5.477 31.848 1.00 71.01 C ATOM 3100 O ALA B 75 8.606 -5.623 30.998 1.00 12.42 O ATOM 3101 CB ALA B 75 8.817 -5.091 34.045 1.00 50.55 C ATOM 0 H ALA B 75 6.464 -4.594 34.529 1.00 24.41 H new ATOM 0 HA ALA B 75 8.319 -3.571 32.603 1.00 71.53 H new ATOM 0 HB1 ALA B 75 9.779 -5.327 33.589 1.00 50.55 H new ATOM 0 HB2 ALA B 75 8.964 -4.374 34.852 1.00 50.55 H new ATOM 0 HB3 ALA B 75 8.372 -6.002 34.445 1.00 50.55 H new ATOM 3107 N ASP B 76 6.584 -6.134 31.825 1.00 24.20 N ATOM 3108 CA ASP B 76 6.333 -7.239 30.913 1.00 60.22 C ATOM 3109 C ASP B 76 5.788 -6.729 29.581 1.00 14.12 C ATOM 3110 O ASP B 76 5.102 -7.449 28.856 1.00 34.13 O ATOM 3111 CB ASP B 76 5.353 -8.214 31.572 1.00 21.51 C ATOM 3112 CG ASP B 76 5.947 -8.909 32.789 1.00 33.51 C ATOM 3113 OD1 ASP B 76 6.621 -9.948 32.623 1.00 23.44 O ATOM 3114 OD2 ASP B 76 5.740 -8.423 33.922 1.00 41.11 O1- ATOM 0 H ASP B 76 5.799 -5.917 32.439 1.00 24.20 H new ATOM 0 HA ASP B 76 7.268 -7.758 30.703 1.00 60.22 H new ATOM 0 HB2 ASP B 76 4.454 -7.674 31.869 1.00 21.51 H new ATOM 0 HB3 ASP B 76 5.047 -8.964 30.843 1.00 21.51 H new ATOM 3119 N THR B 77 6.110 -5.482 29.264 1.00 44.41 N ATOM 3120 CA THR B 77 5.698 -4.870 28.013 1.00 1.21 C ATOM 3121 C THR B 77 6.798 -5.013 26.963 1.00 31.44 C ATOM 3122 O THR B 77 7.974 -5.197 27.296 1.00 72.52 O ATOM 3123 CB THR B 77 5.349 -3.375 28.208 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.081 -2.766 26.939 1.00 73.25 O ATOM 3125 CG2 THR B 77 6.483 -2.623 28.903 1.00 30.02 C ATOM 0 H THR B 77 6.662 -4.870 29.866 1.00 44.41 H new ATOM 0 HA THR B 77 4.803 -5.388 27.668 1.00 1.21 H new ATOM 0 HB THR B 77 4.463 -3.320 28.840 1.00 44.03 H new ATOM 0 HG1 THR B 77 4.533 -3.370 26.395 1.00 73.25 H new ATOM 0 HG21 THR B 77 6.205 -1.576 29.024 1.00 30.02 H new ATOM 0 HG22 THR B 77 6.666 -3.065 29.882 1.00 30.02 H new ATOM 0 HG23 THR B 77 7.388 -2.690 28.299 1.00 30.02 H new ATOM 3133 N THR B 78 6.413 -4.949 25.693 1.00 70.31 N ATOM 3134 CA THR B 78 7.351 -5.080 24.588 1.00 64.53 C ATOM 3135 C THR B 78 6.892 -4.244 23.393 1.00 71.23 C ATOM 3136 O THR B 78 5.696 -4.033 23.189 1.00 64.44 O ATOM 3137 CB THR B 78 7.494 -6.559 24.149 1.00 53.44 C ATOM 3138 OG1 THR B 78 7.885 -7.374 25.264 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.520 -6.718 23.033 1.00 23.30 C ATOM 0 H THR B 78 5.446 -4.805 25.403 1.00 70.31 H new ATOM 0 HA THR B 78 8.319 -4.719 24.935 1.00 64.53 H new ATOM 0 HB THR B 78 6.522 -6.881 23.775 1.00 53.44 H new ATOM 0 HG1 THR B 78 7.970 -8.306 24.974 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.592 -7.769 22.752 1.00 23.30 H new ATOM 0 HG22 THR B 78 8.210 -6.132 22.168 1.00 23.30 H new ATOM 0 HG23 THR B 78 9.492 -6.367 23.380 1.00 23.30 H new ATOM 3147 N VAL B 79 7.854 -3.781 22.614 1.00 22.45 N ATOM 3148 CA VAL B 79 7.591 -3.012 21.403 1.00 23.02 C ATOM 3149 C VAL B 79 8.338 -3.646 20.236 1.00 31.21 C ATOM 3150 O VAL B 79 9.539 -3.901 20.329 1.00 14.34 O ATOM 3151 CB VAL B 79 8.017 -1.528 21.560 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.883 -0.770 20.237 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.193 -0.846 22.650 1.00 54.24 C ATOM 0 H VAL B 79 8.846 -3.927 22.802 1.00 22.45 H new ATOM 0 HA VAL B 79 6.517 -3.027 21.215 1.00 23.02 H new ATOM 0 HB VAL B 79 9.067 -1.511 21.853 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.189 0.267 20.379 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.519 -1.236 19.485 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.846 -0.800 19.904 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.506 0.194 22.746 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.136 -0.884 22.385 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.348 -1.360 23.599 1.00 54.24 H new ATOM 3163 N THR B 80 7.623 -3.930 19.157 1.00 72.42 N ATOM 3164 CA THR B 80 8.215 -4.563 17.984 1.00 23.21 C ATOM 3165 C THR B 80 8.192 -3.615 16.789 1.00 63.22 C ATOM 3166 O THR B 80 7.122 -3.236 16.305 1.00 42.43 O ATOM 3167 CB THR B 80 7.474 -5.872 17.624 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.472 -6.754 18.754 1.00 71.34 O ATOM 3169 CG2 THR B 80 8.125 -6.575 16.434 1.00 64.25 C ATOM 0 H THR B 80 6.626 -3.731 19.068 1.00 72.42 H new ATOM 0 HA THR B 80 9.250 -4.803 18.228 1.00 23.21 H new ATOM 0 HB THR B 80 6.451 -5.613 17.350 1.00 22.40 H new ATOM 0 HG1 THR B 80 7.000 -7.581 18.522 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.578 -7.491 16.209 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.103 -5.916 15.566 1.00 64.25 H new ATOM 0 HG23 THR B 80 9.159 -6.820 16.677 1.00 64.25 H new ATOM 3177 N ALA B 81 9.376 -3.225 16.332 1.00 41.34 N ATOM 3178 CA ALA B 81 9.514 -2.351 15.178 1.00 73.43 C ATOM 3179 C ALA B 81 9.690 -3.176 13.911 1.00 13.31 C ATOM 3180 O ALA B 81 10.752 -3.768 13.693 1.00 32.14 O ATOM 3181 CB ALA B 81 10.699 -1.409 15.366 1.00 31.52 C ATOM 0 H ALA B 81 10.263 -3.505 16.750 1.00 41.34 H new ATOM 0 HA ALA B 81 8.607 -1.754 15.082 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.790 -0.761 14.495 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.542 -0.800 16.256 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.613 -1.992 15.482 1.00 31.52 H new ATOM 3187 N GLU B 82 8.646 -3.245 13.095 1.00 50.12 N ATOM 3188 CA GLU B 82 8.725 -3.938 11.817 1.00 53.10 C ATOM 3189 C GLU B 82 8.851 -2.897 10.708 1.00 51.21 C ATOM 3190 O GLU B 82 7.892 -2.193 10.389 1.00 13.21 O ATOM 3191 CB GLU B 82 7.488 -4.827 11.617 1.00 51.24 C ATOM 3192 CG GLU B 82 7.628 -5.840 10.486 1.00 31.41 C ATOM 3193 CD GLU B 82 6.437 -6.784 10.388 1.00 63.34 C ATOM 3194 OE1 GLU B 82 6.257 -7.622 11.298 1.00 35.34 O ATOM 3195 OE2 GLU B 82 5.679 -6.697 9.396 1.00 71.23 O1- ATOM 0 H GLU B 82 7.736 -2.830 13.296 1.00 50.12 H new ATOM 0 HA GLU B 82 9.599 -4.590 11.793 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.283 -5.360 12.545 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.625 -4.192 11.417 1.00 51.24 H new ATOM 0 HG2 GLU B 82 7.744 -5.309 9.541 1.00 31.41 H new ATOM 0 HG3 GLU B 82 8.536 -6.423 10.637 1.00 31.41 H new ATOM 3202 N VAL B 83 10.042 -2.802 10.135 1.00 40.31 N ATOM 3203 CA VAL B 83 10.376 -1.729 9.199 1.00 71.44 C ATOM 3204 C VAL B 83 10.540 -2.259 7.785 1.00 35.11 C ATOM 3205 O VAL B 83 11.034 -3.367 7.582 1.00 1.44 O ATOM 3206 CB VAL B 83 11.675 -1.002 9.625 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.466 -0.284 10.951 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.844 -1.984 9.720 1.00 51.35 C ATOM 0 H VAL B 83 10.803 -3.461 10.302 1.00 40.31 H new ATOM 0 HA VAL B 83 9.547 -1.022 9.217 1.00 71.44 H new ATOM 0 HB VAL B 83 11.920 -0.262 8.864 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.387 0.223 11.239 1.00 71.22 H new ATOM 0 HG12 VAL B 83 10.666 0.449 10.846 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.195 -1.009 11.719 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.745 -1.449 10.021 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.615 -2.752 10.458 1.00 51.35 H new ATOM 0 HG23 VAL B 83 13.007 -2.451 8.749 1.00 51.35 H new ATOM 3218 N GLY B 84 10.120 -1.463 6.812 1.00 51.11 N ATOM 3219 CA GLY B 84 10.222 -1.851 5.428 1.00 52.45 C ATOM 3220 C GLY B 84 10.539 -0.680 4.524 1.00 30.33 C ATOM 3221 O GLY B 84 10.267 0.473 4.860 1.00 4.21 O ATOM 0 H GLY B 84 9.705 -0.544 6.965 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.998 -2.609 5.322 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.284 -2.308 5.111 1.00 52.45 H new ATOM 3225 N ILE B 85 11.111 -0.986 3.373 1.00 72.33 N ATOM 3226 CA ILE B 85 11.420 -0.003 2.354 1.00 70.35 C ATOM 3227 C ILE B 85 10.710 -0.394 1.061 1.00 24.30 C ATOM 3228 O ILE B 85 10.746 -1.565 0.649 1.00 65.43 O ATOM 3229 CB ILE B 85 12.958 0.108 2.137 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.318 1.126 1.029 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.554 -1.266 1.826 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.328 0.553 -0.376 1.00 22.31 C ATOM 0 H ILE B 85 11.377 -1.937 3.118 1.00 72.33 H new ATOM 0 HA ILE B 85 11.069 0.977 2.676 1.00 70.35 H new ATOM 0 HB ILE B 85 13.393 0.479 3.065 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.606 1.950 1.066 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.301 1.544 1.244 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.630 -1.171 1.677 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.361 -1.943 2.658 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.096 -1.665 0.921 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.590 1.337 -1.087 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.061 -0.251 -0.436 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.340 0.161 -0.616 1.00 22.31 H new ATOM 3244 N GLY B 86 10.048 0.583 0.451 1.00 43.24 N ATOM 3245 CA GLY B 86 9.311 0.373 -0.784 1.00 50.02 C ATOM 3246 C GLY B 86 9.511 1.531 -1.740 1.00 52.30 C ATOM 3247 O GLY B 86 10.091 2.549 -1.355 1.00 42.02 O ATOM 0 H GLY B 86 10.009 1.541 0.800 1.00 43.24 H new ATOM 0 HA2 GLY B 86 9.640 -0.553 -1.255 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.250 0.258 -0.563 1.00 50.02 H new ATOM 3251 N PRO B 87 9.064 1.409 -2.999 1.00 42.21 N ATOM 3252 CA PRO B 87 9.271 2.438 -4.003 1.00 30.25 C ATOM 3253 C PRO B 87 8.196 3.521 -3.953 1.00 61.30 C ATOM 3254 O PRO B 87 6.998 3.232 -3.908 1.00 52.32 O ATOM 3255 CB PRO B 87 9.214 1.664 -5.322 1.00 44.10 C ATOM 3256 CG PRO B 87 8.436 0.409 -5.036 1.00 14.42 C ATOM 3257 CD PRO B 87 8.274 0.290 -3.533 1.00 45.13 C ATOM 0 HA PRO B 87 10.209 2.974 -3.857 1.00 30.25 H new ATOM 0 HB2 PRO B 87 8.729 2.254 -6.100 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.216 1.428 -5.679 1.00 44.10 H new ATOM 0 HG2 PRO B 87 7.461 0.446 -5.523 1.00 14.42 H new ATOM 0 HG3 PRO B 87 8.958 -0.462 -5.433 1.00 14.42 H new ATOM 0 HD2 PRO B 87 7.227 0.364 -3.238 1.00 45.13 H new ATOM 0 HD3 PRO B 87 8.642 -0.669 -3.167 1.00 45.13 H new ATOM 3265 N ASN B 88 8.644 4.765 -3.960 1.00 53.24 N ATOM 3266 CA ASN B 88 7.750 5.918 -3.946 1.00 21.43 C ATOM 3267 C ASN B 88 7.205 6.150 -5.349 1.00 21.10 C ATOM 3268 O ASN B 88 7.934 5.994 -6.331 1.00 51.23 O ATOM 3269 CB ASN B 88 8.507 7.165 -3.455 1.00 72.30 C ATOM 3270 CG ASN B 88 7.613 8.380 -3.232 1.00 63.22 C ATOM 3271 OD1 ASN B 88 6.588 8.551 -3.890 1.00 5.32 O ATOM 3272 ND2 ASN B 88 8.008 9.237 -2.303 1.00 3.11 N ATOM 0 H ASN B 88 9.635 5.007 -3.976 1.00 53.24 H new ATOM 0 HA ASN B 88 6.920 5.727 -3.266 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.017 6.925 -2.522 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.277 7.421 -4.183 1.00 72.30 H new ATOM 0 HD21 ASN B 88 7.456 10.073 -2.113 1.00 3.11 H new ATOM 0 HD22 ASN B 88 8.864 9.061 -1.778 1.00 3.11 H new ATOM 3279 N GLU B 89 5.936 6.531 -5.439 1.00 65.22 N ATOM 3280 CA GLU B 89 5.286 6.760 -6.728 1.00 51.32 C ATOM 3281 C GLU B 89 5.973 7.894 -7.495 1.00 22.42 C ATOM 3282 O GLU B 89 5.850 7.999 -8.717 1.00 11.02 O ATOM 3283 CB GLU B 89 3.796 7.068 -6.525 1.00 62.31 C ATOM 3284 CG GLU B 89 3.527 8.255 -5.606 1.00 11.15 C ATOM 3285 CD GLU B 89 2.044 8.515 -5.419 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.468 8.040 -4.414 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.443 9.181 -6.285 1.00 35.35 O1- ATOM 0 H GLU B 89 5.333 6.689 -4.632 1.00 65.22 H new ATOM 0 HA GLU B 89 5.376 5.851 -7.323 1.00 51.32 H new ATOM 0 HB2 GLU B 89 3.340 7.263 -7.496 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.306 6.185 -6.114 1.00 62.31 H new ATOM 0 HG2 GLU B 89 3.986 8.071 -4.635 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.000 9.146 -6.019 1.00 11.15 H new ATOM 3294 N GLU B 90 6.716 8.725 -6.767 1.00 52.12 N ATOM 3295 CA GLU B 90 7.495 9.806 -7.369 1.00 15.12 C ATOM 3296 C GLU B 90 8.642 9.239 -8.214 1.00 74.05 C ATOM 3297 O GLU B 90 9.163 9.904 -9.114 1.00 53.12 O ATOM 3298 CB GLU B 90 8.046 10.721 -6.264 1.00 14.23 C ATOM 3299 CG GLU B 90 9.073 11.733 -6.752 1.00 30.33 C ATOM 3300 CD GLU B 90 9.545 12.670 -5.651 1.00 5.15 C ATOM 3301 OE1 GLU B 90 10.350 12.239 -4.800 1.00 54.43 O ATOM 3302 OE2 GLU B 90 9.114 13.842 -5.635 1.00 12.50 O1- ATOM 0 H GLU B 90 6.795 8.670 -5.752 1.00 52.12 H new ATOM 0 HA GLU B 90 6.846 10.387 -8.024 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.216 11.255 -5.802 1.00 14.23 H new ATOM 0 HB3 GLU B 90 8.499 10.104 -5.488 1.00 14.23 H new ATOM 0 HG2 GLU B 90 9.931 11.203 -7.165 1.00 30.33 H new ATOM 0 HG3 GLU B 90 8.641 12.320 -7.563 1.00 30.33 H new ATOM 3309 N GLY B 91 9.009 7.997 -7.931 1.00 72.20 N ATOM 3310 CA GLY B 91 10.119 7.357 -8.613 1.00 12.11 C ATOM 3311 C GLY B 91 11.352 7.292 -7.738 1.00 71.02 C ATOM 3312 O GLY B 91 12.478 7.425 -8.220 1.00 5.53 O ATOM 0 H GLY B 91 8.551 7.413 -7.231 1.00 72.20 H new ATOM 0 HA2 GLY B 91 9.831 6.349 -8.911 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.350 7.905 -9.526 1.00 12.11 H new ATOM 3316 N GLY B 92 11.135 7.097 -6.440 1.00 60.34 N ATOM 3317 CA GLY B 92 12.231 7.009 -5.493 1.00 61.32 C ATOM 3318 C GLY B 92 11.966 5.952 -4.447 1.00 12.52 C ATOM 3319 O GLY B 92 11.342 4.931 -4.739 1.00 70.13 O ATOM 0 H GLY B 92 10.209 6.998 -6.025 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.155 6.777 -6.023 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.375 7.975 -5.009 1.00 61.32 H new ATOM 3323 N PHE B 93 12.413 6.195 -3.225 1.00 71.13 N ATOM 3324 CA PHE B 93 12.194 5.261 -2.128 1.00 4.00 C ATOM 3325 C PHE B 93 11.235 5.852 -1.110 1.00 73.12 C ATOM 3326 O PHE B 93 10.988 7.061 -1.100 1.00 63.14 O ATOM 3327 CB PHE B 93 13.516 4.889 -1.450 1.00 42.41 C ATOM 3328 CG PHE B 93 14.432 4.080 -2.330 1.00 52.32 C ATOM 3329 CD1 PHE B 93 15.716 4.520 -2.619 1.00 72.40 C ATOM 3330 CD2 PHE B 93 13.999 2.876 -2.872 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.549 3.776 -3.430 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.832 2.128 -3.683 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.108 2.580 -3.963 1.00 20.53 C ATOM 0 H PHE B 93 12.932 7.034 -2.966 1.00 71.13 H new ATOM 0 HA PHE B 93 11.754 4.354 -2.543 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.029 5.801 -1.145 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.304 4.324 -0.542 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.067 5.454 -2.205 1.00 72.40 H new ATOM 0 HD2 PHE B 93 13.002 2.521 -2.658 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.546 4.129 -3.648 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.487 1.192 -4.097 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.760 1.999 -4.598 1.00 20.53 H new ATOM 3343 N ALA B 94 10.700 4.986 -0.263 1.00 22.42 N ATOM 3344 CA ALA B 94 9.790 5.384 0.797 1.00 62.21 C ATOM 3345 C ALA B 94 9.968 4.449 1.988 1.00 42.21 C ATOM 3346 O ALA B 94 9.929 3.222 1.833 1.00 61.15 O ATOM 3347 CB ALA B 94 8.351 5.365 0.287 1.00 43.22 C ATOM 0 H ALA B 94 10.886 3.984 -0.293 1.00 22.42 H new ATOM 0 HA ALA B 94 10.015 6.401 1.117 1.00 62.21 H new ATOM 0 HB1 ALA B 94 7.677 5.665 1.089 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.252 6.058 -0.548 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.096 4.358 -0.044 1.00 43.22 H new ATOM 3353 N LEU B 95 10.201 5.026 3.165 1.00 51.40 N ATOM 3354 CA LEU B 95 10.457 4.246 4.374 1.00 52.52 C ATOM 3355 C LEU B 95 9.192 4.109 5.213 1.00 31.45 C ATOM 3356 O LEU B 95 8.522 5.096 5.520 1.00 74.21 O ATOM 3357 CB LEU B 95 11.592 4.881 5.201 1.00 5.44 C ATOM 3358 CG LEU B 95 13.019 4.430 4.829 1.00 70.54 C ATOM 3359 CD1 LEU B 95 13.212 2.947 5.136 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.322 4.712 3.359 1.00 13.14 C ATOM 0 H LEU B 95 10.218 6.036 3.307 1.00 51.40 H new ATOM 0 HA LEU B 95 10.771 3.247 4.071 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.533 5.964 5.094 1.00 5.44 H new ATOM 0 HB3 LEU B 95 11.421 4.655 6.253 1.00 5.44 H new ATOM 0 HG LEU B 95 13.719 5.006 5.435 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.225 2.648 4.866 1.00 3.52 H new ATOM 0 HD12 LEU B 95 13.053 2.772 6.200 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.496 2.360 4.561 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.335 4.383 3.127 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.613 4.173 2.731 1.00 13.14 H new ATOM 0 HD23 LEU B 95 13.235 5.782 3.168 1.00 13.14 H new ATOM 3372 N ASP B 96 8.895 2.873 5.581 1.00 51.23 N ATOM 3373 CA ASP B 96 7.705 2.531 6.353 1.00 11.24 C ATOM 3374 C ASP B 96 8.107 1.836 7.641 1.00 14.30 C ATOM 3375 O ASP B 96 8.882 0.884 7.618 1.00 55.22 O ATOM 3376 CB ASP B 96 6.812 1.602 5.525 1.00 22.11 C ATOM 3377 CG ASP B 96 5.690 0.950 6.327 1.00 4.43 C ATOM 3378 OD1 ASP B 96 5.766 -0.282 6.570 1.00 73.12 O ATOM 3379 OD2 ASP B 96 4.717 1.642 6.688 1.00 73.53 O1- ATOM 0 H ASP B 96 9.478 2.068 5.351 1.00 51.23 H new ATOM 0 HA ASP B 96 7.159 3.442 6.596 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.376 2.170 4.703 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.429 0.821 5.080 1.00 22.11 H new ATOM 3384 N VAL B 97 7.598 2.316 8.761 1.00 43.21 N ATOM 3385 CA VAL B 97 7.872 1.692 10.051 1.00 65.34 C ATOM 3386 C VAL B 97 6.568 1.346 10.754 1.00 4.12 C ATOM 3387 O VAL B 97 5.845 2.229 11.198 1.00 1.23 O ATOM 3388 CB VAL B 97 8.717 2.617 10.966 1.00 44.15 C ATOM 3389 CG1 VAL B 97 8.975 1.961 12.325 1.00 31.14 C ATOM 3390 CG2 VAL B 97 10.031 3.007 10.286 1.00 13.32 C ATOM 0 H VAL B 97 6.992 3.135 8.808 1.00 43.21 H new ATOM 0 HA VAL B 97 8.443 0.783 9.860 1.00 65.34 H new ATOM 0 HB VAL B 97 8.145 3.529 11.140 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.569 2.631 12.946 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.024 1.758 12.818 1.00 31.14 H new ATOM 0 HG13 VAL B 97 9.516 1.026 12.181 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.605 3.655 10.948 1.00 13.32 H new ATOM 0 HG22 VAL B 97 10.608 2.109 10.068 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.817 3.535 9.357 1.00 13.32 H new ATOM 3400 N GLU B 98 6.278 0.061 10.862 1.00 55.41 N ATOM 3401 CA GLU B 98 5.092 -0.403 11.567 1.00 61.25 C ATOM 3402 C GLU B 98 5.474 -0.724 13.008 1.00 55.42 C ATOM 3403 O GLU B 98 6.091 -1.759 13.288 1.00 74.01 O ATOM 3404 CB GLU B 98 4.494 -1.625 10.852 1.00 43.20 C ATOM 3405 CG GLU B 98 3.166 -2.100 11.433 1.00 33.43 C ATOM 3406 CD GLU B 98 2.468 -3.126 10.551 1.00 35.25 C ATOM 3407 OE1 GLU B 98 2.932 -4.285 10.488 1.00 70.42 O ATOM 3408 OE2 GLU B 98 1.447 -2.785 9.918 1.00 74.42 O1- ATOM 0 H GLU B 98 6.851 -0.685 10.468 1.00 55.41 H new ATOM 0 HA GLU B 98 4.327 0.374 11.572 1.00 61.25 H new ATOM 0 HB2 GLU B 98 4.351 -1.382 9.799 1.00 43.20 H new ATOM 0 HB3 GLU B 98 5.211 -2.445 10.896 1.00 43.20 H new ATOM 0 HG2 GLU B 98 3.340 -2.533 12.418 1.00 33.43 H new ATOM 0 HG3 GLU B 98 2.509 -1.242 11.574 1.00 33.43 H new ATOM 3415 N LEU B 99 5.139 0.188 13.916 1.00 61.12 N ATOM 3416 CA LEU B 99 5.598 0.099 15.298 1.00 54.24 C ATOM 3417 C LEU B 99 4.494 -0.465 16.189 1.00 51.12 C ATOM 3418 O LEU B 99 3.472 0.191 16.416 1.00 12.44 O ATOM 3419 CB LEU B 99 6.040 1.489 15.793 1.00 60.12 C ATOM 3420 CG LEU B 99 6.901 1.499 17.070 1.00 42.10 C ATOM 3421 CD1 LEU B 99 8.240 0.801 16.827 1.00 24.34 C ATOM 3422 CD2 LEU B 99 7.122 2.929 17.559 1.00 1.13 C ATOM 0 H LEU B 99 4.551 0.998 13.719 1.00 61.12 H new ATOM 0 HA LEU B 99 6.452 -0.577 15.346 1.00 54.24 H new ATOM 0 HB2 LEU B 99 6.600 1.978 14.995 1.00 60.12 H new ATOM 0 HB3 LEU B 99 5.149 2.091 15.972 1.00 60.12 H new ATOM 0 HG LEU B 99 6.366 0.950 17.845 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.832 0.820 17.742 1.00 24.34 H new ATOM 0 HD12 LEU B 99 8.063 -0.233 16.531 1.00 24.34 H new ATOM 0 HD13 LEU B 99 8.781 1.318 16.034 1.00 24.34 H new ATOM 0 HD21 LEU B 99 7.732 2.915 18.462 1.00 1.13 H new ATOM 0 HD22 LEU B 99 7.632 3.503 16.785 1.00 1.13 H new ATOM 0 HD23 LEU B 99 6.160 3.391 17.779 1.00 1.13 H new ATOM 3434 N ARG B 100 4.711 -1.680 16.696 1.00 53.41 N ATOM 3435 CA ARG B 100 3.721 -2.382 17.508 1.00 2.45 C ATOM 3436 C ARG B 100 4.022 -2.239 18.991 1.00 14.01 C ATOM 3437 O ARG B 100 5.102 -2.610 19.455 1.00 24.14 O ATOM 3438 CB ARG B 100 3.672 -3.873 17.141 1.00 53.52 C ATOM 3439 CG ARG B 100 2.894 -4.169 15.869 1.00 13.43 C ATOM 3440 CD ARG B 100 2.811 -5.662 15.583 1.00 64.11 C ATOM 3441 NE ARG B 100 1.816 -5.950 14.552 1.00 3.43 N ATOM 3442 CZ ARG B 100 2.037 -5.831 13.246 1.00 52.33 C ATOM 3443 NH1 ARG B 100 3.250 -5.528 12.797 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 1.046 -6.028 12.389 1.00 11.32 N ATOM 0 H ARG B 100 5.576 -2.202 16.555 1.00 53.41 H new ATOM 0 HA ARG B 100 2.752 -1.928 17.301 1.00 2.45 H new ATOM 0 HB2 ARG B 100 4.691 -4.243 17.026 1.00 53.52 H new ATOM 0 HB3 ARG B 100 3.224 -4.426 17.966 1.00 53.52 H new ATOM 0 HG2 ARG B 100 1.887 -3.761 15.957 1.00 13.43 H new ATOM 0 HG3 ARG B 100 3.370 -3.665 15.028 1.00 13.43 H new ATOM 0 HD2 ARG B 100 3.786 -6.028 15.263 1.00 64.11 H new ATOM 0 HD3 ARG B 100 2.555 -6.196 16.498 1.00 64.11 H new ATOM 0 HE ARG B 100 0.893 -6.262 14.853 1.00 3.43 H new ATOM 0 HH11 ARG B 100 4.016 -5.386 13.455 1.00 41.53 H new ATOM 0 HH12 ARG B 100 3.415 -5.438 11.794 1.00 41.53 H new ATOM 0 HH21 ARG B 100 0.116 -6.270 12.731 1.00 11.32 H new ATOM 0 HH22 ARG B 100 1.213 -5.937 11.387 1.00 11.32 H new ATOM 3458 N VAL B 101 3.049 -1.715 19.723 1.00 41.00 N ATOM 3459 CA VAL B 101 3.168 -1.509 21.160 1.00 50.20 C ATOM 3460 C VAL B 101 2.336 -2.535 21.919 1.00 3.30 C ATOM 3461 O VAL B 101 1.106 -2.466 21.911 1.00 1.54 O ATOM 3462 CB VAL B 101 2.687 -0.093 21.552 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.688 0.083 23.071 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.547 0.977 20.876 1.00 51.31 C ATOM 0 H VAL B 101 2.152 -1.420 19.336 1.00 41.00 H new ATOM 0 HA VAL B 101 4.220 -1.622 21.423 1.00 50.20 H new ATOM 0 HB VAL B 101 1.662 0.026 21.202 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.346 1.087 23.321 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.021 -0.651 23.523 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.698 -0.062 23.453 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.191 1.966 21.165 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.585 0.859 21.187 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.478 0.869 19.794 1.00 51.31 H new ATOM 3474 N ALA B 102 2.997 -3.484 22.568 1.00 24.03 N ATOM 3475 CA ALA B 102 2.303 -4.469 23.387 1.00 53.32 C ATOM 3476 C ALA B 102 2.478 -4.135 24.862 1.00 44.40 C ATOM 3477 O ALA B 102 3.526 -4.410 25.451 1.00 4.42 O ATOM 3478 CB ALA B 102 2.826 -5.869 23.085 1.00 42.24 C ATOM 0 H ALA B 102 4.011 -3.593 22.544 1.00 24.03 H new ATOM 0 HA ALA B 102 1.239 -4.443 23.150 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.299 -6.596 23.704 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.660 -6.100 22.033 1.00 42.24 H new ATOM 0 HB3 ALA B 102 3.893 -5.913 23.302 1.00 42.24 H new ATOM 3484 N LEU B 103 1.452 -3.536 25.454 1.00 61.44 N ATOM 3485 CA LEU B 103 1.470 -3.159 26.859 1.00 72.24 C ATOM 3486 C LEU B 103 0.421 -3.987 27.605 1.00 41.41 C ATOM 3487 O LEU B 103 -0.774 -3.858 27.341 1.00 40.11 O ATOM 3488 CB LEU B 103 1.170 -1.656 26.987 1.00 55.34 C ATOM 3489 CG LEU B 103 1.690 -0.943 28.255 1.00 34.43 C ATOM 3490 CD1 LEU B 103 1.215 -1.614 29.541 1.00 40.33 C ATOM 3491 CD2 LEU B 103 3.204 -0.810 28.231 1.00 1.40 C ATOM 0 H LEU B 103 0.585 -3.299 24.972 1.00 61.44 H new ATOM 0 HA LEU B 103 2.451 -3.354 27.293 1.00 72.24 H new ATOM 0 HB2 LEU B 103 1.591 -1.151 26.118 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.089 -1.521 26.941 1.00 55.34 H new ATOM 0 HG LEU B 103 1.261 0.059 28.248 1.00 34.43 H new ATOM 0 HD11 LEU B 103 1.609 -1.073 30.401 1.00 40.33 H new ATOM 0 HD12 LEU B 103 0.126 -1.605 29.575 1.00 40.33 H new ATOM 0 HD13 LEU B 103 1.570 -2.644 29.567 1.00 40.33 H new ATOM 0 HD21 LEU B 103 3.539 -0.304 29.137 1.00 1.40 H new ATOM 0 HD22 LEU B 103 3.656 -1.801 28.180 1.00 1.40 H new ATOM 0 HD23 LEU B 103 3.504 -0.229 27.359 1.00 1.40 H new ATOM 3503 N PRO B 104 0.854 -4.859 28.528 1.00 3.11 N ATOM 3504 CA PRO B 104 -0.058 -5.714 29.292 1.00 24.44 C ATOM 3505 C PRO B 104 -0.889 -4.924 30.303 1.00 5.10 C ATOM 3506 O PRO B 104 -0.436 -3.912 30.844 1.00 15.44 O ATOM 3507 CB PRO B 104 0.883 -6.684 30.008 1.00 10.11 C ATOM 3508 CG PRO B 104 2.170 -5.944 30.130 1.00 31.23 C ATOM 3509 CD PRO B 104 2.263 -5.078 28.906 1.00 74.24 C ATOM 0 HA PRO B 104 -0.790 -6.205 28.651 1.00 24.44 H new ATOM 0 HB2 PRO B 104 0.493 -6.964 30.987 1.00 10.11 H new ATOM 0 HB3 PRO B 104 1.009 -7.606 29.440 1.00 10.11 H new ATOM 0 HG2 PRO B 104 2.190 -5.341 31.038 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.013 -6.633 30.187 1.00 31.23 H new ATOM 0 HD2 PRO B 104 2.772 -4.138 29.118 1.00 74.24 H new ATOM 0 HD3 PRO B 104 2.820 -5.569 28.109 1.00 74.24 H new ATOM 3517 N GLY B 105 -2.098 -5.409 30.552 1.00 72.34 N ATOM 3518 CA GLY B 105 -3.003 -4.749 31.479 1.00 21.00 C ATOM 3519 C GLY B 105 -3.543 -3.438 30.939 1.00 53.31 C ATOM 3520 O GLY B 105 -4.100 -2.631 31.689 1.00 21.33 O ATOM 0 H GLY B 105 -2.473 -6.256 30.125 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.836 -5.415 31.703 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -2.482 -4.563 32.418 1.00 21.00 H new ATOM 3524 N LEU B 106 -3.384 -3.225 29.635 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.806 -1.986 28.985 1.00 45.21 C ATOM 3526 C LEU B 106 -4.757 -2.276 27.822 1.00 60.53 C ATOM 3527 O LEU B 106 -4.549 -3.220 27.049 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.575 -1.199 28.495 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.854 -0.037 27.523 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.766 1.012 28.149 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.544 0.599 27.064 1.00 55.01 C ATOM 0 H LEU B 106 -2.961 -3.903 29.001 1.00 45.40 H new ATOM 0 HA LEU B 106 -4.343 -1.379 29.714 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -2.055 -0.800 29.366 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.894 -1.897 28.008 1.00 22.13 H new ATOM 0 HG LEU B 106 -3.370 -0.447 26.655 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.940 1.816 27.434 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.717 0.553 28.418 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -3.293 1.418 29.043 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.758 1.418 26.378 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -1.003 0.982 27.929 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.934 -0.149 26.557 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.807 -1.464 27.720 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.772 -1.550 26.630 1.00 50.41 C ATOM 3545 C ASP B 107 -6.162 -1.003 25.351 1.00 24.13 C ATOM 3546 O ASP B 107 -5.422 -0.021 25.385 1.00 45.41 O ATOM 3547 CB ASP B 107 -8.035 -0.742 26.961 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.867 -1.344 28.083 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -8.432 -1.284 29.252 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -9.976 -1.855 27.802 1.00 14.11 O1- ATOM 0 H ASP B 107 -6.012 -0.726 28.394 1.00 0.12 H new ATOM 0 HA ASP B 107 -7.039 -2.598 26.496 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -7.745 0.272 27.238 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.651 -0.663 26.065 1.00 1.44 H new ATOM 3555 N ALA B 108 -6.490 -1.621 24.225 1.00 12.24 N ATOM 3556 CA ALA B 108 -6.024 -1.153 22.925 1.00 21.33 C ATOM 3557 C ALA B 108 -6.560 0.247 22.633 1.00 4.44 C ATOM 3558 O ALA B 108 -5.864 1.085 22.057 1.00 12.01 O ATOM 3559 CB ALA B 108 -6.447 -2.129 21.834 1.00 34.32 C ATOM 0 H ALA B 108 -7.080 -2.452 24.185 1.00 12.24 H new ATOM 0 HA ALA B 108 -4.935 -1.102 22.943 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -6.094 -1.770 20.867 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -6.016 -3.110 22.036 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.534 -2.207 21.817 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.802 0.491 23.046 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.440 1.793 22.867 1.00 64.51 C ATOM 3567 C ALA B 109 -7.644 2.884 23.575 1.00 34.40 C ATOM 3568 O ALA B 109 -7.325 3.921 22.987 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.872 1.759 23.387 1.00 34.53 C ATOM 0 H ALA B 109 -8.390 -0.201 23.510 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.462 2.020 21.801 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.333 2.736 23.246 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.440 1.007 22.839 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.868 1.509 24.448 1.00 34.53 H new ATOM 3575 N ALA B 110 -7.318 2.634 24.838 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.525 3.568 25.625 1.00 72.03 C ATOM 3577 C ALA B 110 -5.113 3.658 25.061 1.00 4.25 C ATOM 3578 O ALA B 110 -4.552 4.744 24.927 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.499 3.138 27.087 1.00 4.12 C ATOM 0 H ALA B 110 -7.592 1.789 25.339 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.982 4.556 25.570 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.903 3.845 27.664 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.516 3.117 27.478 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -6.060 2.144 27.166 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.558 2.504 24.709 1.00 64.14 N ATOM 3586 CA ALA B 111 -3.211 2.421 24.159 1.00 51.51 C ATOM 3587 C ALA B 111 -3.066 3.315 22.932 1.00 2.23 C ATOM 3588 O ALA B 111 -2.026 3.941 22.735 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.870 0.976 23.818 1.00 4.22 C ATOM 0 H ALA B 111 -5.027 1.603 24.797 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.509 2.775 24.914 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.861 0.927 23.408 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -2.925 0.367 24.720 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.580 0.599 23.082 1.00 4.22 H new ATOM 3595 N LYS B 112 -4.122 3.381 22.120 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.131 4.239 20.933 1.00 34.20 C ATOM 3597 C LYS B 112 -3.740 5.673 21.290 1.00 24.41 C ATOM 3598 O LYS B 112 -2.932 6.294 20.599 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.511 4.226 20.258 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.853 2.908 19.567 1.00 74.45 C ATOM 3601 CD LYS B 112 -7.231 2.957 18.912 1.00 63.04 C ATOM 3602 CE LYS B 112 -7.524 1.695 18.106 1.00 72.33 C ATOM 3603 NZ LYS B 112 -7.584 0.478 18.964 1.00 62.21 N1+ ATOM 0 H LYS B 112 -4.982 2.851 22.262 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.395 3.841 20.234 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.273 4.439 21.008 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.552 5.031 19.524 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -5.099 2.686 18.812 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -5.824 2.097 20.295 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -7.994 3.082 19.680 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -7.291 3.827 18.258 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -8.472 1.814 17.581 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -6.753 1.564 17.347 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -7.835 -0.346 18.381 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -6.656 0.319 19.406 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -8.302 0.610 19.704 1.00 62.21 H new ATOM 3617 N THR B 113 -4.293 6.190 22.383 1.00 71.03 N ATOM 3618 CA THR B 113 -4.032 7.569 22.774 1.00 12.30 C ATOM 3619 C THR B 113 -2.705 7.676 23.527 1.00 72.03 C ATOM 3620 O THR B 113 -1.960 8.644 23.359 1.00 34.03 O ATOM 3621 CB THR B 113 -5.180 8.154 23.637 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.179 9.585 23.553 1.00 15.33 O ATOM 3623 CG2 THR B 113 -5.057 7.746 25.099 1.00 55.23 C ATOM 0 H THR B 113 -4.918 5.680 23.007 1.00 71.03 H new ATOM 0 HA THR B 113 -3.971 8.156 21.857 1.00 12.30 H new ATOM 0 HB THR B 113 -6.114 7.752 23.245 1.00 51.23 H new ATOM 0 HG1 THR B 113 -5.908 9.945 24.100 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.881 8.177 25.668 1.00 55.23 H new ATOM 0 HG22 THR B 113 -5.091 6.659 25.178 1.00 55.23 H new ATOM 0 HG23 THR B 113 -4.111 8.109 25.500 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.406 6.664 24.341 1.00 42.02 N ATOM 3632 CA LEU B 114 -1.187 6.658 25.147 1.00 34.43 C ATOM 3633 C LEU B 114 0.047 6.683 24.250 1.00 70.23 C ATOM 3634 O LEU B 114 0.961 7.481 24.454 1.00 14.10 O ATOM 3635 CB LEU B 114 -1.146 5.431 26.075 1.00 61.41 C ATOM 3636 CG LEU B 114 -2.321 5.310 27.064 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -2.089 4.166 28.049 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -2.551 6.628 27.804 1.00 20.12 C ATOM 0 H LEU B 114 -2.992 5.838 24.459 1.00 42.02 H new ATOM 0 HA LEU B 114 -1.188 7.555 25.766 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -1.118 4.532 25.459 1.00 61.41 H new ATOM 0 HB3 LEU B 114 -0.216 5.458 26.643 1.00 61.41 H new ATOM 0 HG LEU B 114 -3.220 5.085 26.491 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.932 4.101 28.737 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.994 3.228 27.502 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -1.175 4.351 28.613 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -3.386 6.516 28.496 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -1.652 6.895 28.360 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.779 7.414 27.084 1.00 20.12 H new ATOM 3650 N VAL B 115 0.049 5.823 23.240 1.00 61.11 N ATOM 3651 CA VAL B 115 1.156 5.742 22.295 1.00 23.35 C ATOM 3652 C VAL B 115 1.255 7.029 21.478 1.00 63.55 C ATOM 3653 O VAL B 115 2.356 7.471 21.127 1.00 10.54 O ATOM 3654 CB VAL B 115 0.994 4.530 21.342 1.00 32.23 C ATOM 3655 CG1 VAL B 115 2.144 4.457 20.338 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.894 3.232 22.140 1.00 32.34 C ATOM 0 H VAL B 115 -0.709 5.167 23.053 1.00 61.11 H new ATOM 0 HA VAL B 115 2.072 5.609 22.870 1.00 23.35 H new ATOM 0 HB VAL B 115 0.069 4.666 20.781 1.00 32.23 H new ATOM 0 HG11 VAL B 115 2.002 3.597 19.684 1.00 53.51 H new ATOM 0 HG12 VAL B 115 2.163 5.368 19.740 1.00 53.51 H new ATOM 0 HG13 VAL B 115 3.088 4.354 20.873 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.781 2.392 21.455 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.799 3.098 22.732 1.00 32.34 H new ATOM 0 HG23 VAL B 115 0.030 3.278 22.803 1.00 32.34 H new ATOM 3666 N ASP B 116 0.100 7.627 21.192 1.00 33.05 N ATOM 3667 CA ASP B 116 0.040 8.861 20.412 1.00 4.03 C ATOM 3668 C ASP B 116 0.732 9.996 21.157 1.00 43.14 C ATOM 3669 O ASP B 116 1.691 10.590 20.655 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.415 9.253 20.119 1.00 75.43 C ATOM 3671 CG ASP B 116 -1.517 10.387 19.104 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -1.710 10.101 17.902 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -1.389 11.568 19.495 1.00 32.45 O1- ATOM 0 H ASP B 116 -0.810 7.275 21.490 1.00 33.05 H new ATOM 0 HA ASP B 116 0.554 8.684 19.467 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -1.955 8.383 19.744 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -1.901 9.554 21.047 1.00 75.43 H new ATOM 3678 N ARG B 117 0.256 10.273 22.371 1.00 65.05 N ATOM 3679 CA ARG B 117 0.794 11.362 23.177 1.00 30.34 C ATOM 3680 C ARG B 117 2.244 11.078 23.552 1.00 41.22 C ATOM 3681 O ARG B 117 3.072 11.990 23.614 1.00 22.44 O ATOM 3682 CB ARG B 117 -0.063 11.558 24.431 1.00 5.33 C ATOM 3683 CG ARG B 117 -0.142 10.320 25.313 1.00 52.02 C ATOM 3684 CD ARG B 117 -1.259 10.423 26.338 1.00 70.20 C ATOM 3685 NE ARG B 117 -1.009 11.466 27.339 1.00 35.41 N ATOM 3686 CZ ARG B 117 -1.966 12.079 28.039 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -3.248 11.828 27.787 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 -1.640 12.968 28.965 1.00 12.43 N ATOM 0 H ARG B 117 -0.502 9.756 22.816 1.00 65.05 H new ATOM 0 HA ARG B 117 0.768 12.282 22.592 1.00 30.34 H new ATOM 0 HB2 ARG B 117 0.344 12.384 25.014 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -1.071 11.846 24.131 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.302 9.440 24.690 1.00 52.02 H new ATOM 0 HG3 ARG B 117 0.809 10.179 25.826 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -2.199 10.632 25.827 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -1.377 9.463 26.840 1.00 70.20 H new ATOM 0 HE ARG B 117 -0.042 11.740 27.511 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -3.504 11.164 27.056 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -3.975 12.299 28.325 1.00 12.31 H new ATOM 0 HH21 ARG B 117 -0.659 13.183 29.142 1.00 12.43 H new ATOM 0 HH22 ARG B 117 -2.370 13.437 29.501 1.00 12.43 H new ATOM 3702 N ALA B 118 2.548 9.803 23.789 1.00 61.11 N ATOM 3703 CA ALA B 118 3.918 9.378 24.046 1.00 4.01 C ATOM 3704 C ALA B 118 4.797 9.735 22.856 1.00 4.12 C ATOM 3705 O ALA B 118 5.922 10.206 23.014 1.00 22.32 O ATOM 3706 CB ALA B 118 3.978 7.880 24.331 1.00 4.44 C ATOM 0 H ALA B 118 1.862 9.048 23.808 1.00 61.11 H new ATOM 0 HA ALA B 118 4.288 9.899 24.929 1.00 4.01 H new ATOM 0 HB1 ALA B 118 5.011 7.587 24.520 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.370 7.652 25.206 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.596 7.330 23.471 1.00 4.44 H new ATOM 3712 N HIS B 119 4.257 9.539 21.654 1.00 53.54 N ATOM 3713 CA HIS B 119 4.972 9.878 20.433 1.00 31.05 C ATOM 3714 C HIS B 119 5.035 11.387 20.197 1.00 22.51 C ATOM 3715 O HIS B 119 5.593 11.834 19.197 1.00 73.21 O ATOM 3716 CB HIS B 119 4.361 9.152 19.221 1.00 24.30 C ATOM 3717 CG HIS B 119 4.971 7.807 18.992 1.00 50.32 C ATOM 3718 ND1 HIS B 119 4.673 6.703 19.756 1.00 33.22 N ATOM 3719 CD2 HIS B 119 5.917 7.408 18.112 1.00 55.12 C ATOM 3720 CE1 HIS B 119 5.416 5.686 19.361 1.00 74.31 C ATOM 3721 NE2 HIS B 119 6.182 6.087 18.362 1.00 22.51 N ATOM 0 H HIS B 119 3.327 9.147 21.504 1.00 53.54 H new ATOM 0 HA HIS B 119 5.999 9.535 20.557 1.00 31.05 H new ATOM 0 HB2 HIS B 119 3.287 9.039 19.372 1.00 24.30 H new ATOM 0 HB3 HIS B 119 4.495 9.765 18.329 1.00 24.30 H new ATOM 0 HD1 HIS B 119 3.986 6.675 20.509 1.00 33.22 H new ATOM 0 HD2 HIS B 119 6.379 8.019 17.351 1.00 55.12 H new ATOM 0 HE1 HIS B 119 5.400 4.692 19.784 1.00 74.31 H new ATOM 3730 N HIS B 120 4.474 12.168 21.114 1.00 35.12 N ATOM 3731 CA HIS B 120 4.537 13.627 21.020 1.00 61.52 C ATOM 3732 C HIS B 120 5.480 14.192 22.085 1.00 22.12 C ATOM 3733 O HIS B 120 6.148 15.206 21.865 1.00 21.30 O ATOM 3734 CB HIS B 120 3.136 14.231 21.184 1.00 61.10 C ATOM 3735 CG HIS B 120 3.019 15.655 20.713 1.00 45.20 C ATOM 3736 ND1 HIS B 120 2.124 16.050 19.740 1.00 23.40 N ATOM 3737 CD2 HIS B 120 3.680 16.780 21.087 1.00 61.34 C ATOM 3738 CE1 HIS B 120 2.242 17.350 19.538 1.00 14.23 C ATOM 3739 NE2 HIS B 120 3.178 17.816 20.342 1.00 33.30 N ATOM 0 H HIS B 120 3.971 11.819 21.930 1.00 35.12 H new ATOM 0 HA HIS B 120 4.923 13.893 20.036 1.00 61.52 H new ATOM 0 HB2 HIS B 120 2.422 13.618 20.634 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.853 14.184 22.236 1.00 61.10 H new ATOM 0 HD2 HIS B 120 4.458 16.847 21.833 1.00 61.34 H new ATOM 0 HE1 HIS B 120 1.668 17.933 18.833 1.00 14.23 H new ATOM 0 HE2 HIS B 120 3.479 18.789 20.400 1.00 33.30 H new ATOM 3748 N VAL B 121 5.524 13.539 23.244 1.00 53.34 N ATOM 3749 CA VAL B 121 6.321 14.026 24.370 1.00 2.11 C ATOM 3750 C VAL B 121 7.712 13.386 24.410 1.00 31.12 C ATOM 3751 O VAL B 121 8.703 14.059 24.708 1.00 43.14 O ATOM 3752 CB VAL B 121 5.598 13.793 25.724 1.00 52.03 C ATOM 3753 CG1 VAL B 121 4.273 14.555 25.766 1.00 41.33 C ATOM 3754 CG2 VAL B 121 5.374 12.302 25.988 1.00 63.42 C ATOM 0 H VAL B 121 5.018 12.673 23.429 1.00 53.34 H new ATOM 0 HA VAL B 121 6.443 15.098 24.217 1.00 2.11 H new ATOM 0 HB VAL B 121 6.242 14.176 26.515 1.00 52.03 H new ATOM 0 HG11 VAL B 121 3.782 14.379 26.723 1.00 41.33 H new ATOM 0 HG12 VAL B 121 4.463 15.622 25.647 1.00 41.33 H new ATOM 0 HG13 VAL B 121 3.628 14.209 24.958 1.00 41.33 H new ATOM 0 HG21 VAL B 121 4.866 12.174 26.944 1.00 63.42 H new ATOM 0 HG22 VAL B 121 4.761 11.880 25.192 1.00 63.42 H new ATOM 0 HG23 VAL B 121 6.335 11.789 26.017 1.00 63.42 H new ATOM 3764 N CYS B 122 7.790 12.095 24.104 1.00 64.23 N ATOM 3765 CA CYS B 122 9.051 11.363 24.181 1.00 24.42 C ATOM 3766 C CYS B 122 9.949 11.687 22.983 1.00 23.34 C ATOM 3767 O CYS B 122 9.460 11.836 21.856 1.00 74.53 O ATOM 3768 CB CYS B 122 8.781 9.854 24.253 1.00 15.34 C ATOM 3769 SG CYS B 122 7.752 9.359 25.658 1.00 14.44 S ATOM 0 H CYS B 122 6.995 11.533 23.800 1.00 64.23 H new ATOM 0 HA CYS B 122 9.572 11.674 25.087 1.00 24.42 H new ATOM 0 HB2 CYS B 122 8.295 9.537 23.330 1.00 15.34 H new ATOM 0 HB3 CYS B 122 9.733 9.327 24.309 1.00 15.34 H new ATOM 0 HG CYS B 122 7.576 8.071 25.635 1.00 14.44 H new ATOM 3775 N PRO B 123 11.276 11.819 23.214 1.00 45.45 N ATOM 3776 CA PRO B 123 12.252 12.055 22.140 1.00 1.30 C ATOM 3777 C PRO B 123 12.192 10.965 21.072 1.00 21.43 C ATOM 3778 O PRO B 123 11.639 9.888 21.317 1.00 1.12 O ATOM 3779 CB PRO B 123 13.608 12.035 22.865 1.00 65.25 C ATOM 3780 CG PRO B 123 13.284 12.360 24.285 1.00 12.41 C ATOM 3781 CD PRO B 123 11.926 11.760 24.540 1.00 30.51 C ATOM 0 HA PRO B 123 12.064 12.989 21.611 1.00 1.30 H new ATOM 0 HB2 PRO B 123 14.087 11.060 22.782 1.00 65.25 H new ATOM 0 HB3 PRO B 123 14.296 12.765 22.439 1.00 65.25 H new ATOM 0 HG2 PRO B 123 14.030 11.943 24.962 1.00 12.41 H new ATOM 0 HG3 PRO B 123 13.273 13.438 24.447 1.00 12.41 H new ATOM 0 HD2 PRO B 123 12.001 10.736 24.907 1.00 30.51 H new ATOM 0 HD3 PRO B 123 11.369 12.326 25.287 1.00 30.51 H new ATOM 3789 N TYR B 124 12.758 11.258 19.893 1.00 44.15 N ATOM 3790 CA TYR B 124 12.744 10.346 18.737 1.00 41.53 C ATOM 3791 C TYR B 124 11.353 10.304 18.104 1.00 41.03 C ATOM 3792 O TYR B 124 11.188 10.535 16.908 1.00 24.42 O ATOM 3793 CB TYR B 124 13.169 8.914 19.123 1.00 11.44 C ATOM 3794 CG TYR B 124 14.561 8.797 19.718 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.652 8.462 18.925 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.783 9.009 21.076 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.915 8.343 19.466 1.00 22.14 C ATOM 3798 CE2 TYR B 124 16.044 8.894 21.622 1.00 2.53 C ATOM 3799 CZ TYR B 124 17.107 8.560 20.814 1.00 65.35 C ATOM 3800 OH TYR B 124 18.365 8.447 21.356 1.00 21.31 O ATOM 0 H TYR B 124 13.241 12.138 19.712 1.00 44.15 H new ATOM 0 HA TYR B 124 13.466 10.735 18.019 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.449 8.518 19.840 1.00 11.44 H new ATOM 0 HB3 TYR B 124 13.115 8.283 18.236 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.508 8.292 17.868 1.00 62.34 H new ATOM 0 HD2 TYR B 124 13.951 9.269 21.714 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.752 8.081 18.835 1.00 22.14 H new ATOM 0 HE2 TYR B 124 16.197 9.065 22.677 1.00 2.53 H new ATOM 0 HH TYR B 124 18.292 8.250 22.313 1.00 21.31 H new ATOM 3845 N THR B 128 9.777 10.902 14.495 1.00 13.32 N ATOM 3846 CA THR B 128 9.583 9.641 13.790 1.00 55.14 C ATOM 3847 C THR B 128 8.193 9.610 13.162 1.00 13.14 C ATOM 3848 O THR B 128 7.929 8.821 12.265 1.00 21.45 O ATOM 3849 CB THR B 128 9.772 8.409 14.722 1.00 41.45 C ATOM 3850 OG1 THR B 128 10.228 7.282 13.960 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.472 8.026 15.431 1.00 11.25 C ATOM 0 HA THR B 128 10.344 9.579 13.012 1.00 55.14 H new ATOM 0 HB THR B 128 10.510 8.685 15.475 1.00 41.45 H new ATOM 0 HG1 THR B 128 10.450 6.545 14.567 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.648 7.162 16.071 1.00 11.25 H new ATOM 0 HG22 THR B 128 8.128 8.864 16.038 1.00 11.25 H new ATOM 0 HG23 THR B 128 7.712 7.779 14.689 1.00 11.25 H new ATOM 3859 N ARG B 129 7.315 10.500 13.621 1.00 41.51 N ATOM 3860 CA ARG B 129 5.933 10.513 13.166 1.00 75.21 C ATOM 3861 C ARG B 129 5.722 11.682 12.215 1.00 73.32 C ATOM 3862 O ARG B 129 5.159 11.524 11.132 1.00 44.41 O ATOM 3863 CB ARG B 129 4.976 10.594 14.372 1.00 21.01 C ATOM 3864 CG ARG B 129 5.099 11.879 15.186 1.00 45.10 C ATOM 3865 CD ARG B 129 4.299 11.827 16.483 1.00 21.21 C ATOM 3866 NE ARG B 129 2.870 11.579 16.269 1.00 2.44 N ATOM 3867 CZ ARG B 129 1.932 11.786 17.199 1.00 0.21 C ATOM 3868 NH1 ARG B 129 2.255 12.351 18.357 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 0.671 11.454 16.956 1.00 44.44 N ATOM 0 H ARG B 129 7.540 11.220 14.308 1.00 41.51 H new ATOM 0 HA ARG B 129 5.716 9.589 12.631 1.00 75.21 H new ATOM 0 HB2 ARG B 129 3.951 10.501 14.014 1.00 21.01 H new ATOM 0 HB3 ARG B 129 5.163 9.743 15.027 1.00 21.01 H new ATOM 0 HG2 ARG B 129 6.149 12.060 15.417 1.00 45.10 H new ATOM 0 HG3 ARG B 129 4.756 12.721 14.585 1.00 45.10 H new ATOM 0 HD2 ARG B 129 4.706 11.043 17.122 1.00 21.21 H new ATOM 0 HD3 ARG B 129 4.422 12.770 17.017 1.00 21.21 H new ATOM 0 HE ARG B 129 2.574 11.228 15.358 1.00 2.44 H new ATOM 0 HH11 ARG B 129 3.220 12.628 18.538 1.00 5.12 H new ATOM 0 HH12 ARG B 129 1.538 12.508 19.065 1.00 5.12 H new ATOM 0 HH21 ARG B 129 0.416 11.040 16.059 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -0.044 11.612 17.666 1.00 44.44 H new ATOM 3883 N ASN B 130 6.188 12.863 12.624 1.00 21.53 N ATOM 3884 CA ASN B 130 6.082 14.048 11.786 1.00 53.34 C ATOM 3885 C ASN B 130 7.159 14.055 10.708 1.00 22.35 C ATOM 3886 O ASN B 130 7.027 14.736 9.691 1.00 70.41 O ATOM 3887 CB ASN B 130 6.145 15.339 12.621 1.00 70.21 C ATOM 3888 CG ASN B 130 4.897 15.541 13.470 1.00 33.52 C ATOM 3889 OD1 ASN B 130 3.876 16.033 12.983 1.00 60.32 O ATOM 3890 ND2 ASN B 130 4.973 15.201 14.747 1.00 74.14 N ATOM 0 H ASN B 130 6.639 13.020 13.525 1.00 21.53 H new ATOM 0 HA ASN B 130 5.108 14.013 11.298 1.00 53.34 H new ATOM 0 HB2 ASN B 130 7.021 15.307 13.269 1.00 70.21 H new ATOM 0 HB3 ASN B 130 6.271 16.193 11.956 1.00 70.21 H new ATOM 0 HD21 ASN B 130 4.171 15.344 15.361 1.00 74.14 H new ATOM 0 HD22 ASN B 130 5.833 14.796 15.117 1.00 74.14 H new ATOM 3897 N ASN B 131 8.230 13.304 10.943 1.00 34.23 N ATOM 3898 CA ASN B 131 9.357 13.256 10.010 1.00 31.43 C ATOM 3899 C ASN B 131 9.301 11.989 9.151 1.00 54.44 C ATOM 3900 O ASN B 131 9.489 12.039 7.937 1.00 13.44 O ATOM 3901 CB ASN B 131 10.673 13.282 10.795 1.00 3.33 C ATOM 3902 CG ASN B 131 11.902 13.367 9.901 1.00 61.21 C ATOM 3903 OD1 ASN B 131 12.378 14.449 9.571 1.00 75.43 O ATOM 3904 ND2 ASN B 131 12.434 12.221 9.520 1.00 34.33 N ATOM 0 H ASN B 131 8.344 12.719 11.771 1.00 34.23 H new ATOM 0 HA ASN B 131 9.299 14.124 9.353 1.00 31.43 H new ATOM 0 HB2 ASN B 131 10.666 14.134 11.475 1.00 3.33 H new ATOM 0 HB3 ASN B 131 10.740 12.384 11.410 1.00 3.33 H new ATOM 0 HD21 ASN B 131 13.268 12.216 8.932 1.00 34.33 H new ATOM 0 HD22 ASN B 131 12.012 11.340 9.813 1.00 34.33 H new ATOM 3911 N VAL B 132 9.011 10.859 9.793 1.00 52.13 N ATOM 3912 CA VAL B 132 9.044 9.553 9.131 1.00 11.30 C ATOM 3913 C VAL B 132 7.634 8.984 9.019 1.00 11.32 C ATOM 3914 O VAL B 132 6.718 9.431 9.712 1.00 35.23 O ATOM 3915 CB VAL B 132 9.944 8.551 9.912 1.00 15.30 C ATOM 3916 CG1 VAL B 132 10.207 7.283 9.099 1.00 32.53 C ATOM 3917 CG2 VAL B 132 11.258 9.211 10.329 1.00 3.12 C ATOM 0 H VAL B 132 8.749 10.820 10.778 1.00 52.13 H new ATOM 0 HA VAL B 132 9.462 9.695 8.134 1.00 11.30 H new ATOM 0 HB VAL B 132 9.406 8.259 10.814 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.838 6.606 9.675 1.00 32.53 H new ATOM 0 HG12 VAL B 132 9.260 6.792 8.874 1.00 32.53 H new ATOM 0 HG13 VAL B 132 10.710 7.545 8.168 1.00 32.53 H new ATOM 0 HG21 VAL B 132 11.870 8.492 10.873 1.00 3.12 H new ATOM 0 HG22 VAL B 132 11.795 9.546 9.441 1.00 3.12 H new ATOM 0 HG23 VAL B 132 11.048 10.067 10.970 1.00 3.12 H new ATOM 3927 N ALA B 133 7.463 8.014 8.132 1.00 53.04 N ATOM 3928 CA ALA B 133 6.186 7.347 7.958 1.00 53.01 C ATOM 3929 C ALA B 133 6.110 6.119 8.847 1.00 72.23 C ATOM 3930 O ALA B 133 6.385 4.991 8.427 1.00 0.23 O ATOM 3931 CB ALA B 133 5.967 7.001 6.492 1.00 11.23 C ATOM 0 H ALA B 133 8.202 7.671 7.518 1.00 53.04 H new ATOM 0 HA ALA B 133 5.384 8.021 8.259 1.00 53.01 H new ATOM 0 HB1 ALA B 133 5.005 6.501 6.376 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.975 7.914 5.897 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.763 6.339 6.151 1.00 11.23 H new ATOM 3937 N VAL B 134 5.786 6.367 10.102 1.00 34.41 N ATOM 3938 CA VAL B 134 5.646 5.315 11.082 1.00 31.34 C ATOM 3939 C VAL B 134 4.173 5.034 11.354 1.00 33.12 C ATOM 3940 O VAL B 134 3.453 5.877 11.896 1.00 12.15 O ATOM 3941 CB VAL B 134 6.361 5.680 12.403 1.00 33.43 C ATOM 3942 CG1 VAL B 134 6.124 4.605 13.452 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.857 5.887 12.169 1.00 5.41 C ATOM 0 H VAL B 134 5.613 7.304 10.467 1.00 34.41 H new ATOM 0 HA VAL B 134 6.114 4.419 10.675 1.00 31.34 H new ATOM 0 HB VAL B 134 5.943 6.617 12.772 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.635 4.879 14.375 1.00 61.10 H new ATOM 0 HG12 VAL B 134 5.055 4.512 13.643 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.512 3.653 13.091 1.00 61.10 H new ATOM 0 HG21 VAL B 134 8.341 6.143 13.112 1.00 5.41 H new ATOM 0 HG22 VAL B 134 8.294 4.970 11.774 1.00 5.41 H new ATOM 0 HG23 VAL B 134 8.005 6.696 11.454 1.00 5.41 H new ATOM 3953 N ARG B 135 3.727 3.857 10.944 1.00 11.21 N ATOM 3954 CA ARG B 135 2.381 3.398 11.223 1.00 24.23 C ATOM 3955 C ARG B 135 2.308 2.893 12.660 1.00 24.22 C ATOM 3956 O ARG B 135 2.886 1.855 12.999 1.00 54.44 O ATOM 3957 CB ARG B 135 1.984 2.290 10.238 1.00 74.32 C ATOM 3958 CG ARG B 135 2.070 2.712 8.772 1.00 34.13 C ATOM 3959 CD ARG B 135 1.157 3.897 8.471 1.00 2.43 C ATOM 3960 NE ARG B 135 -0.250 3.572 8.705 1.00 1.50 N ATOM 3961 CZ ARG B 135 -1.149 4.415 9.213 1.00 23.13 C ATOM 3962 NH1 ARG B 135 -0.794 5.641 9.583 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -2.405 4.020 9.364 1.00 14.33 N ATOM 0 H ARG B 135 4.290 3.196 10.409 1.00 11.21 H new ATOM 0 HA ARG B 135 1.682 4.225 11.102 1.00 24.23 H new ATOM 0 HB2 ARG B 135 2.630 1.426 10.397 1.00 74.32 H new ATOM 0 HB3 ARG B 135 0.965 1.970 10.456 1.00 74.32 H new ATOM 0 HG2 ARG B 135 3.099 2.975 8.529 1.00 34.13 H new ATOM 0 HG3 ARG B 135 1.797 1.871 8.135 1.00 34.13 H new ATOM 0 HD2 ARG B 135 1.443 4.744 9.095 1.00 2.43 H new ATOM 0 HD3 ARG B 135 1.291 4.205 7.434 1.00 2.43 H new ATOM 0 HE ARG B 135 -0.566 2.633 8.462 1.00 1.50 H new ATOM 0 HH11 ARG B 135 0.174 5.945 9.479 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -1.490 6.278 9.971 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -2.679 3.076 9.092 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -3.098 4.660 9.752 1.00 14.33 H new ATOM 3977 N LEU B 136 1.639 3.660 13.509 1.00 62.51 N ATOM 3978 CA LEU B 136 1.476 3.297 14.908 1.00 72.41 C ATOM 3979 C LEU B 136 0.394 2.242 15.060 1.00 41.21 C ATOM 3980 O LEU B 136 -0.751 2.440 14.644 1.00 33.52 O ATOM 3981 CB LEU B 136 1.153 4.538 15.749 1.00 60.04 C ATOM 3982 CG LEU B 136 2.341 5.487 15.966 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.895 6.782 16.640 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.419 4.796 16.797 1.00 0.00 C ATOM 0 H LEU B 136 1.198 4.543 13.250 1.00 62.51 H new ATOM 0 HA LEU B 136 2.414 2.876 15.270 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.347 5.090 15.265 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.780 4.216 16.721 1.00 60.04 H new ATOM 0 HG LEU B 136 2.756 5.743 14.991 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.757 7.434 16.781 1.00 41.31 H new ATOM 0 HD12 LEU B 136 1.159 7.284 16.012 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.451 6.554 17.609 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.257 5.477 16.945 1.00 0.00 H new ATOM 0 HD22 LEU B 136 3.006 4.513 17.765 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.765 3.904 16.275 1.00 0.00 H new ATOM 3996 N VAL B 137 0.776 1.115 15.639 1.00 22.01 N ATOM 3997 CA VAL B 137 -0.129 0.001 15.853 1.00 61.13 C ATOM 3998 C VAL B 137 -0.009 -0.505 17.288 1.00 31.22 C ATOM 3999 O VAL B 137 1.052 -0.956 17.724 1.00 63.04 O ATOM 4000 CB VAL B 137 0.140 -1.138 14.829 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.629 -1.227 14.508 1.00 20.11 C ATOM 4002 CG2 VAL B 137 -0.381 -2.482 15.338 1.00 5.14 C ATOM 0 H VAL B 137 1.725 0.948 15.974 1.00 22.01 H new ATOM 0 HA VAL B 137 -1.151 0.347 15.696 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.401 -0.898 13.914 1.00 72.22 H new ATOM 0 HG11 VAL B 137 1.799 -2.029 13.790 1.00 20.11 H new ATOM 0 HG12 VAL B 137 1.967 -0.282 14.083 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.186 -1.434 15.422 1.00 20.11 H new ATOM 0 HG21 VAL B 137 -0.176 -3.255 14.598 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.117 -2.735 16.274 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -1.456 -2.416 15.506 1.00 5.14 H new ATOM 4012 N VAL B 138 -1.101 -0.392 18.027 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.154 -0.832 19.413 1.00 24.22 C ATOM 4014 C VAL B 138 -1.705 -2.246 19.478 1.00 70.52 C ATOM 4015 O VAL B 138 -2.620 -2.605 18.729 1.00 62.24 O ATOM 4016 CB VAL B 138 -1.998 0.106 20.308 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.636 1.563 20.052 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.487 -0.145 20.115 1.00 0.20 C ATOM 0 H VAL B 138 -1.975 0.007 17.684 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.135 -0.806 19.800 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.766 -0.115 21.350 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.241 2.206 20.691 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.580 1.720 20.274 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.827 1.807 19.007 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -4.056 0.528 20.756 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.754 0.034 19.074 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.719 -1.177 20.377 1.00 0.20 H new ATOM 4028 N ALA B 139 -1.103 -3.050 20.323 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.458 -4.462 20.431 1.00 52.34 C ATOM 4030 C ALA B 139 -2.804 -4.631 21.144 1.00 22.31 C ATOM 4031 O ALA B 139 -3.836 -4.756 20.448 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.356 -5.233 21.150 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.826 -4.625 22.396 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.358 -2.755 20.954 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.560 -4.871 19.426 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.635 -6.284 21.223 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.575 -5.143 20.591 1.00 71.35 H new ATOM 0 HB3 ALA B 139 -0.219 -4.824 22.151 1.00 71.35 H new