USER MOD reduce.3.24.130724 H: found=0, std=0, add=1475, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1268 hydrogens (35 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 NoAdj-H: B 92 MK8 HNA : B 92 MK8 N : B 91 ALA C :(H bumps) USER MOD NoAdj-H: B 96 MK8 HNA : B 96 MK8 N : B 95 ASP C :(H bumps) USER MOD NoAdj-H: B 96 MK8 HN : B 96 MK8 N : B 95 ASP C :(H bumps) USER MOD NoAdj-H: B 97 NLE HN2 : B 97 NLE N : B 96 MK8 C :(H bumps) USER MOD NoAdj-H: B 97 NLE H : B 97 NLE N : B 96 MK8 C :(H bumps) USER MOD Set 1.1: A 31 THR OG1 : rot 84:sc= 1.36 USER MOD Set 1.2: A 162 MET CE :methyl 142:sc= -4.27! (180deg=-5.35!) USER MOD Set 2.1: A 116 THR OG1 : rot 93:sc= 1.25 USER MOD Set 2.2: A 165 HIS : no HE2:sc= 0.453 K(o=1.7,f=-0.28) USER MOD Set 3.1: A 103 THR OG1 : rot -153:sc= -0.392 USER MOD Set 3.2: A 106 ASN : amide:sc= -0.0129 X(o=-0.4,f=-0.42) USER MOD Set 3.3: A 110 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 98 GLN : amide:sc= 0 X(o=-0.23,f=-0.37) USER MOD Set 4.2: A 141 HIS :FLIP no HE2:sc= -0.227 F(o=-1.1,f=-0.23) USER MOD Set 5.1: A 66 GLN : amide:sc= -0.382 K(o=0.38,f=-0.22) USER MOD Set 5.2: A 68 SER OG : rot 180:sc= 0.00284 USER MOD Set 5.3: A 69 SER OG : rot 124:sc= 0.761 USER MOD Set 6.1: A 38 TYR OH : rot 130:sc= 0.102 USER MOD Set 6.2: A 86 ASN : amide:sc= -0.948 K(o=-0.85,f=-1.8) USER MOD Single : A 21 SER OG : rot 180:sc= 0.00144 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -1.92 K(o=-1.9,f=-2.4!) USER MOD Single : A 29 GLN : amide:sc=-0.00251 X(o=-0.0025,f=-0.081) USER MOD Single : A 37 SER OG : rot -47:sc= 0.195 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.489 K(o=-0.49,f=-2.2!) USER MOD Single : A 44 GLN : amide:sc= -0.281 X(o=-0.28,f=-0.042) USER MOD Single : A 45 GLN : amide:sc= -0.319 X(o=-0.32,f=-0.3) USER MOD Single : A 47 GLN : amide:sc= -0.174 X(o=-0.17,f=0) USER MOD Single : A 60 MET CE :methyl -169:sc= -0.0545 (180deg=-0.358) USER MOD Single : A 62 THR OG1 : rot 76:sc= -0.094 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl -128:sc= -0.518 (180deg=-1.75) USER MOD Single : A 73 GLN : amide:sc= -5.06! C(o=-5.1!,f=-5.5!) USER MOD Single : A 77 GLN : amide:sc= -2.78 K(o=-2.8,f=-9.8!) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -1.14 K(o=-1.1,f=-2.2) USER MOD Single : A 95 THR OG1 : rot 180:sc=-0.00751 USER MOD Single : A 96 MET CE :methyl -108:sc= -3.63 (180deg=-9.93!) USER MOD Single : A 99 HIS : no HD1:sc= -0.28 X(o=-0.28,f=-0.042) USER MOD Single : A 101 GLN : amide:sc= 1.07 K(o=1.1,f=-0.015) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot -92:sc= 1.28 USER MOD Single : A 113 LYS NZ :NH3+ -139:sc= -1.05 (180deg=-3.01!) USER MOD Single : A 117 SER OG : rot -80:sc= 1.12 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -5.17 K(o=-5.2,f=-8.1!) USER MOD Single : A 136 TYR OH : rot 130:sc= -0.612 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 144 GLN : amide:sc= -0.0456 X(o=-0.046,f=-0.41) USER MOD Single : A 145 HIS : no HE2:sc= 0.196 K(o=0.2,f=-0.83) USER MOD Single : A 148 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 GLN : amide:sc= -0.303 X(o=-0.3,f=-0.19) USER MOD Single : A 155 THR OG1 : rot 82:sc= 1.55 USER MOD Single : A 164 HIS : no HD1:sc= -1.73 X(o=-1.7,f=-1.6) USER MOD Single : A 166 CYS SG : rot 180:sc=-0.00761 USER MOD Single : A 173 GLN :FLIP amide:sc= -0.485 F(o=-1.2,f=-0.49) USER MOD Single : A 182 ASN : amide:sc= -0.134 K(o=-0.13,f=-1.3!) USER MOD Single : A 185 ASN : amide:sc= -0.374 X(o=-0.37,f=-0.39) USER MOD Single : B 85 ASN : amide:sc= -0.177 K(o=-0.18,f=-1.5!) USER MOD Single : B 89 HIS : no HD1:sc= 0 X(o=0,f=-0.0036) USER MOD Single : B 100 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 18 0.222 21.246 -1.360 1.00 42.32 N ATOM 2 CA ALA A 18 -0.549 22.083 -2.271 1.00 42.42 C ATOM 3 C ALA A 18 0.367 22.907 -3.169 1.00 23.23 C ATOM 4 O ALA A 18 0.053 24.046 -3.516 1.00 34.23 O ATOM 5 CB ALA A 18 -1.483 22.994 -1.488 1.00 24.20 C ATOM 0 HA ALA A 18 -1.146 21.430 -2.908 1.00 42.42 H new ATOM 0 HB1 ALA A 18 -2.053 23.613 -2.181 1.00 24.20 H new ATOM 0 HB2 ALA A 18 -2.168 22.389 -0.895 1.00 24.20 H new ATOM 0 HB3 ALA A 18 -0.898 23.633 -0.827 1.00 24.20 H new ATOM 11 N LEU A 19 1.502 22.324 -3.541 1.00 13.34 N ATOM 12 CA LEU A 19 2.467 23.006 -4.398 1.00 72.14 C ATOM 13 C LEU A 19 2.269 22.613 -5.858 1.00 41.33 C ATOM 14 O LEU A 19 1.684 21.577 -6.174 1.00 53.52 O ATOM 15 CB LEU A 19 3.893 22.676 -3.957 1.00 10.22 C ATOM 16 CG LEU A 19 4.450 23.512 -2.803 1.00 45.23 C ATOM 17 CD1 LEU A 19 4.563 24.973 -3.208 1.00 41.10 C ATOM 18 CD2 LEU A 19 3.573 23.364 -1.568 1.00 32.22 C ATOM 0 H LEU A 19 1.777 21.382 -3.263 1.00 13.34 H new ATOM 0 HA LEU A 19 2.305 24.080 -4.305 1.00 72.14 H new ATOM 0 HB2 LEU A 19 3.929 21.626 -3.668 1.00 10.22 H new ATOM 0 HB3 LEU A 19 4.554 22.793 -4.816 1.00 10.22 H new ATOM 0 HG LEU A 19 5.448 23.146 -2.562 1.00 45.23 H new ATOM 0 HD11 LEU A 19 4.961 25.552 -2.375 1.00 41.10 H new ATOM 0 HD12 LEU A 19 5.232 25.063 -4.064 1.00 41.10 H new ATOM 0 HD13 LEU A 19 3.577 25.353 -3.476 1.00 41.10 H new ATOM 0 HD21 LEU A 19 3.983 23.965 -0.756 1.00 32.22 H new ATOM 0 HD22 LEU A 19 2.563 23.704 -1.796 1.00 32.22 H new ATOM 0 HD23 LEU A 19 3.544 22.317 -1.266 1.00 32.22 H new ATOM 29 N PRO A 20 2.771 23.457 -6.772 1.00 35.20 N ATOM 30 CA PRO A 20 2.665 23.219 -8.214 1.00 45.23 C ATOM 31 C PRO A 20 3.532 22.052 -8.673 1.00 4.31 C ATOM 32 O PRO A 20 4.081 21.313 -7.855 1.00 14.34 O ATOM 33 CB PRO A 20 3.162 24.529 -8.829 1.00 23.24 C ATOM 34 CG PRO A 20 4.059 25.116 -7.794 1.00 21.01 C ATOM 35 CD PRO A 20 3.480 24.711 -6.467 1.00 12.44 C ATOM 0 HA PRO A 20 1.650 22.953 -8.509 1.00 45.23 H new ATOM 0 HB2 PRO A 20 3.697 24.351 -9.762 1.00 23.24 H new ATOM 0 HB3 PRO A 20 2.333 25.198 -9.060 1.00 23.24 H new ATOM 0 HG2 PRO A 20 5.078 24.745 -7.905 1.00 21.01 H new ATOM 0 HG3 PRO A 20 4.103 26.201 -7.886 1.00 21.01 H new ATOM 0 HD2 PRO A 20 4.258 24.561 -5.718 1.00 12.44 H new ATOM 0 HD3 PRO A 20 2.803 25.470 -6.075 1.00 12.44 H new ATOM 40 N SER A 21 3.652 21.890 -9.987 1.00 52.33 N ATOM 41 CA SER A 21 4.450 20.811 -10.555 1.00 2.24 C ATOM 42 C SER A 21 3.867 19.450 -10.184 1.00 33.35 C ATOM 43 O SER A 21 2.898 19.363 -9.431 1.00 32.45 O ATOM 44 CB SER A 21 5.898 20.908 -10.069 1.00 12.12 C ATOM 45 OG SER A 21 6.764 20.143 -10.890 1.00 71.54 O ATOM 0 H SER A 21 3.206 22.493 -10.678 1.00 52.33 H new ATOM 0 HA SER A 21 4.431 20.911 -11.640 1.00 2.24 H new ATOM 0 HB2 SER A 21 6.217 21.950 -10.071 1.00 12.12 H new ATOM 0 HB3 SER A 21 5.964 20.557 -9.039 1.00 12.12 H new ATOM 0 HG SER A 21 7.683 20.223 -10.560 1.00 71.54 H new ATOM 50 N ALA A 22 4.466 18.392 -10.719 1.00 64.34 N ATOM 51 CA ALA A 22 4.008 17.035 -10.443 1.00 14.42 C ATOM 52 C ALA A 22 2.608 16.804 -10.999 1.00 53.42 C ATOM 53 O ALA A 22 1.823 17.742 -11.140 1.00 42.43 O ATOM 54 CB ALA A 22 4.036 16.763 -8.947 1.00 60.13 C ATOM 0 H ALA A 22 5.269 18.447 -11.346 1.00 64.34 H new ATOM 0 HA ALA A 22 4.686 16.341 -10.940 1.00 14.42 H new ATOM 0 HB1 ALA A 22 3.692 15.747 -8.755 1.00 60.13 H new ATOM 0 HB2 ALA A 22 5.054 16.877 -8.575 1.00 60.13 H new ATOM 0 HB3 ALA A 22 3.382 17.470 -8.436 1.00 60.13 H new ATOM 60 N SER A 23 2.300 15.550 -11.315 1.00 60.42 N ATOM 61 CA SER A 23 0.995 15.197 -11.861 1.00 75.43 C ATOM 62 C SER A 23 0.766 13.690 -11.792 1.00 4.32 C ATOM 63 O SER A 23 1.684 12.927 -11.492 1.00 23.41 O ATOM 64 CB SER A 23 0.877 15.677 -13.308 1.00 62.31 C ATOM 65 OG SER A 23 -0.337 16.378 -13.516 1.00 35.13 O ATOM 0 H SER A 23 2.937 14.761 -11.202 1.00 60.42 H new ATOM 0 HA SER A 23 0.232 15.690 -11.259 1.00 75.43 H new ATOM 0 HB2 SER A 23 1.720 16.324 -13.550 1.00 62.31 H new ATOM 0 HB3 SER A 23 0.927 14.823 -13.983 1.00 62.31 H new ATOM 0 HG SER A 23 -0.387 16.676 -14.448 1.00 35.13 H new ATOM 70 N GLU A 24 -0.463 13.270 -12.072 1.00 54.43 N ATOM 71 CA GLU A 24 -0.813 11.855 -12.042 1.00 22.05 C ATOM 72 C GLU A 24 0.166 11.035 -12.878 1.00 0.41 C ATOM 73 O GLU A 24 0.399 9.859 -12.603 1.00 11.12 O ATOM 74 CB GLU A 24 -2.238 11.648 -12.556 1.00 44.32 C ATOM 75 CG GLU A 24 -2.514 12.339 -13.881 1.00 61.21 C ATOM 76 CD GLU A 24 -3.609 13.384 -13.775 1.00 4.53 C ATOM 77 OE1 GLU A 24 -4.767 13.003 -13.507 1.00 30.12 O ATOM 78 OE2 GLU A 24 -3.306 14.581 -13.963 1.00 44.23 O ATOM 0 H GLU A 24 -1.234 13.890 -12.322 1.00 54.43 H new ATOM 0 HA GLU A 24 -0.755 11.514 -11.008 1.00 22.05 H new ATOM 0 HB2 GLU A 24 -2.423 10.580 -12.668 1.00 44.32 H new ATOM 0 HB3 GLU A 24 -2.942 12.017 -11.810 1.00 44.32 H new ATOM 0 HG2 GLU A 24 -1.599 12.811 -14.238 1.00 61.21 H new ATOM 0 HG3 GLU A 24 -2.799 11.593 -14.623 1.00 61.21 H new ATOM 83 N GLU A 25 0.735 11.666 -13.901 1.00 73.13 N ATOM 84 CA GLU A 25 1.687 10.995 -14.778 1.00 73.21 C ATOM 85 C GLU A 25 2.909 10.524 -13.995 1.00 22.22 C ATOM 86 O GLU A 25 3.285 9.353 -14.058 1.00 42.04 O ATOM 87 CB GLU A 25 2.121 11.931 -15.908 1.00 20.40 C ATOM 88 CG GLU A 25 0.962 12.481 -16.722 1.00 63.04 C ATOM 89 CD GLU A 25 1.310 12.655 -18.188 1.00 15.04 C ATOM 90 OE1 GLU A 25 2.477 12.987 -18.486 1.00 70.31 O ATOM 91 OE2 GLU A 25 0.416 12.459 -19.037 1.00 42.13 O ATOM 0 H GLU A 25 0.553 12.640 -14.142 1.00 73.13 H new ATOM 0 HA GLU A 25 1.194 10.123 -15.208 1.00 73.21 H new ATOM 0 HB2 GLU A 25 2.683 12.763 -15.484 1.00 20.40 H new ATOM 0 HB3 GLU A 25 2.798 11.395 -16.573 1.00 20.40 H new ATOM 0 HG2 GLU A 25 0.109 11.809 -16.632 1.00 63.04 H new ATOM 0 HG3 GLU A 25 0.656 13.442 -16.308 1.00 63.04 H new ATOM 96 N GLN A 26 3.524 11.444 -13.259 1.00 63.21 N ATOM 97 CA GLN A 26 4.705 11.122 -12.466 1.00 72.13 C ATOM 98 C GLN A 26 4.323 10.335 -11.217 1.00 64.45 C ATOM 99 O GLN A 26 5.103 9.522 -10.720 1.00 64.20 O ATOM 100 CB GLN A 26 5.443 12.402 -12.070 1.00 34.13 C ATOM 101 CG GLN A 26 4.888 13.062 -10.818 1.00 10.15 C ATOM 102 CD GLN A 26 5.514 12.520 -9.547 1.00 54.40 C ATOM 103 OE1 GLN A 26 6.622 11.985 -9.567 1.00 24.43 O ATOM 104 NE2 GLN A 26 4.804 12.659 -8.433 1.00 21.24 N ATOM 0 H GLN A 26 3.225 12.417 -13.195 1.00 63.21 H new ATOM 0 HA GLN A 26 5.364 10.504 -13.076 1.00 72.13 H new ATOM 0 HB2 GLN A 26 6.496 12.170 -11.912 1.00 34.13 H new ATOM 0 HB3 GLN A 26 5.393 13.111 -12.897 1.00 34.13 H new ATOM 0 HG2 GLN A 26 5.058 14.137 -10.873 1.00 10.15 H new ATOM 0 HG3 GLN A 26 3.809 12.912 -10.780 1.00 10.15 H new ATOM 0 HE21 GLN A 26 3.889 13.109 -8.464 1.00 21.24 H new ATOM 0 HE22 GLN A 26 5.173 12.315 -7.547 1.00 21.24 H new ATOM 111 N VAL A 27 3.118 10.581 -10.713 1.00 41.30 N ATOM 112 CA VAL A 27 2.632 9.895 -9.522 1.00 72.44 C ATOM 113 C VAL A 27 2.543 8.390 -9.752 1.00 3.13 C ATOM 114 O VAL A 27 3.005 7.599 -8.932 1.00 64.51 O ATOM 115 CB VAL A 27 1.248 10.420 -9.097 1.00 62.40 C ATOM 116 CG1 VAL A 27 0.675 9.568 -7.974 1.00 33.32 C ATOM 117 CG2 VAL A 27 1.338 11.879 -8.677 1.00 44.13 C ATOM 0 H VAL A 27 2.460 11.251 -11.111 1.00 41.30 H new ATOM 0 HA VAL A 27 3.349 10.097 -8.726 1.00 72.44 H new ATOM 0 HB VAL A 27 0.575 10.352 -9.952 1.00 62.40 H new ATOM 0 HG11 VAL A 27 -0.303 9.954 -7.687 1.00 33.32 H new ATOM 0 HG12 VAL A 27 0.573 8.538 -8.315 1.00 33.32 H new ATOM 0 HG13 VAL A 27 1.344 9.601 -7.114 1.00 33.32 H new ATOM 0 HG21 VAL A 27 0.351 12.234 -8.380 1.00 44.13 H new ATOM 0 HG22 VAL A 27 2.026 11.974 -7.837 1.00 44.13 H new ATOM 0 HG23 VAL A 27 1.702 12.476 -9.513 1.00 44.13 H new ATOM 127 N ALA A 28 1.949 8.003 -10.876 1.00 22.51 N ATOM 128 CA ALA A 28 1.802 6.594 -11.217 1.00 24.22 C ATOM 129 C ALA A 28 3.151 5.883 -11.205 1.00 5.01 C ATOM 130 O ALA A 28 3.313 4.851 -10.556 1.00 25.50 O ATOM 131 CB ALA A 28 1.137 6.446 -12.576 1.00 44.24 C ATOM 0 H ALA A 28 1.562 8.646 -11.566 1.00 22.51 H new ATOM 0 HA ALA A 28 1.168 6.127 -10.463 1.00 24.22 H new ATOM 0 HB1 ALA A 28 1.034 5.388 -12.817 1.00 44.24 H new ATOM 0 HB2 ALA A 28 0.151 6.910 -12.551 1.00 44.24 H new ATOM 0 HB3 ALA A 28 1.749 6.933 -13.335 1.00 44.24 H new ATOM 137 N GLN A 29 4.116 6.443 -11.927 1.00 44.43 N ATOM 138 CA GLN A 29 5.451 5.861 -12.001 1.00 4.32 C ATOM 139 C GLN A 29 6.053 5.701 -10.609 1.00 55.23 C ATOM 140 O GLN A 29 6.604 4.653 -10.276 1.00 44.21 O ATOM 141 CB GLN A 29 6.363 6.731 -12.868 1.00 24.10 C ATOM 142 CG GLN A 29 6.288 6.404 -14.350 1.00 70.21 C ATOM 143 CD GLN A 29 7.591 6.676 -15.075 1.00 11.15 C ATOM 144 OE1 GLN A 29 8.641 6.146 -14.709 1.00 42.23 O ATOM 145 NE2 GLN A 29 7.531 7.506 -16.109 1.00 32.02 N ATOM 0 H GLN A 29 3.998 7.299 -12.469 1.00 44.43 H new ATOM 0 HA GLN A 29 5.365 4.874 -12.455 1.00 4.32 H new ATOM 0 HB2 GLN A 29 6.098 7.778 -12.722 1.00 24.10 H new ATOM 0 HB3 GLN A 29 7.393 6.612 -12.530 1.00 24.10 H new ATOM 0 HG2 GLN A 29 6.020 5.355 -14.473 1.00 70.21 H new ATOM 0 HG3 GLN A 29 5.492 6.992 -14.808 1.00 70.21 H new ATOM 0 HE21 GLN A 29 6.640 7.923 -16.377 1.00 32.02 H new ATOM 0 HE22 GLN A 29 8.376 7.727 -16.635 1.00 32.02 H new ATOM 152 N ASP A 30 5.944 6.749 -9.799 1.00 50.53 N ATOM 153 CA ASP A 30 6.476 6.726 -8.442 1.00 3.53 C ATOM 154 C ASP A 30 5.737 5.702 -7.586 1.00 61.41 C ATOM 155 O ASP A 30 6.319 5.087 -6.692 1.00 33.03 O ATOM 156 CB ASP A 30 6.371 8.112 -7.805 1.00 40.51 C ATOM 157 CG ASP A 30 7.327 9.110 -8.430 1.00 44.03 C ATOM 158 OD1 ASP A 30 7.925 8.784 -9.478 1.00 73.23 O ATOM 159 OD2 ASP A 30 7.476 10.217 -7.872 1.00 41.22 O ATOM 0 H ASP A 30 5.492 7.625 -10.059 1.00 50.53 H new ATOM 0 HA ASP A 30 7.526 6.439 -8.496 1.00 3.53 H new ATOM 0 HB2 ASP A 30 5.350 8.479 -7.906 1.00 40.51 H new ATOM 0 HB3 ASP A 30 6.577 8.035 -6.738 1.00 40.51 H new ATOM 163 N THR A 31 4.450 5.523 -7.865 1.00 74.32 N ATOM 164 CA THR A 31 3.630 4.577 -7.120 1.00 72.35 C ATOM 165 C THR A 31 4.137 3.150 -7.299 1.00 14.21 C ATOM 166 O THR A 31 4.408 2.452 -6.323 1.00 64.23 O ATOM 167 CB THR A 31 2.155 4.644 -7.557 1.00 1.31 C ATOM 168 OG1 THR A 31 1.672 5.987 -7.447 1.00 41.05 O ATOM 169 CG2 THR A 31 1.296 3.719 -6.709 1.00 64.13 C ATOM 0 H THR A 31 3.953 6.022 -8.603 1.00 74.32 H new ATOM 0 HA THR A 31 3.702 4.857 -6.069 1.00 72.35 H new ATOM 0 HB THR A 31 2.092 4.320 -8.596 1.00 1.31 H new ATOM 0 HG1 THR A 31 1.909 6.487 -8.256 1.00 41.05 H new ATOM 0 HG21 THR A 31 0.258 3.784 -7.037 1.00 64.13 H new ATOM 0 HG22 THR A 31 1.648 2.693 -6.819 1.00 64.13 H new ATOM 0 HG23 THR A 31 1.365 4.016 -5.663 1.00 64.13 H new ATOM 177 N GLU A 32 4.264 2.725 -8.552 1.00 12.40 N ATOM 178 CA GLU A 32 4.740 1.381 -8.857 1.00 53.32 C ATOM 179 C GLU A 32 6.141 1.159 -8.297 1.00 33.22 C ATOM 180 O GLU A 32 6.427 0.117 -7.709 1.00 43.41 O ATOM 181 CB GLU A 32 4.740 1.148 -10.370 1.00 3.13 C ATOM 182 CG GLU A 32 5.458 2.235 -11.153 1.00 71.01 C ATOM 183 CD GLU A 32 5.438 1.987 -12.648 1.00 45.42 C ATOM 184 OE1 GLU A 32 6.210 1.124 -13.116 1.00 14.44 O ATOM 185 OE2 GLU A 32 4.650 2.654 -13.350 1.00 31.11 O ATOM 0 H GLU A 32 4.044 3.291 -9.371 1.00 12.40 H new ATOM 0 HA GLU A 32 4.063 0.668 -8.386 1.00 53.32 H new ATOM 0 HB2 GLU A 32 5.211 0.188 -10.581 1.00 3.13 H new ATOM 0 HB3 GLU A 32 3.710 1.081 -10.719 1.00 3.13 H new ATOM 0 HG2 GLU A 32 4.992 3.198 -10.942 1.00 71.01 H new ATOM 0 HG3 GLU A 32 6.492 2.300 -10.813 1.00 71.01 H new ATOM 190 N GLU A 33 7.011 2.148 -8.483 1.00 65.24 N ATOM 191 CA GLU A 33 8.383 2.059 -7.998 1.00 71.53 C ATOM 192 C GLU A 33 8.416 1.963 -6.475 1.00 44.15 C ATOM 193 O GLU A 33 9.033 1.057 -5.913 1.00 75.42 O ATOM 194 CB GLU A 33 9.190 3.274 -8.460 1.00 21.24 C ATOM 195 CG GLU A 33 9.393 3.333 -9.965 1.00 35.31 C ATOM 196 CD GLU A 33 10.582 2.514 -10.426 1.00 34.04 C ATOM 197 OE1 GLU A 33 11.648 2.601 -9.780 1.00 51.30 O ATOM 198 OE2 GLU A 33 10.448 1.788 -11.432 1.00 44.42 O ATOM 0 H GLU A 33 6.790 3.019 -8.966 1.00 65.24 H new ATOM 0 HA GLU A 33 8.830 1.155 -8.412 1.00 71.53 H new ATOM 0 HB2 GLU A 33 8.682 4.182 -8.134 1.00 21.24 H new ATOM 0 HB3 GLU A 33 10.164 3.260 -7.971 1.00 21.24 H new ATOM 0 HG2 GLU A 33 8.493 2.973 -10.464 1.00 35.31 H new ATOM 0 HG3 GLU A 33 9.532 4.371 -10.269 1.00 35.31 H new ATOM 203 N VAL A 34 7.747 2.902 -5.813 1.00 41.01 N ATOM 204 CA VAL A 34 7.698 2.923 -4.357 1.00 31.34 C ATOM 205 C VAL A 34 7.006 1.679 -3.812 1.00 32.31 C ATOM 206 O VAL A 34 7.359 1.175 -2.745 1.00 33.30 O ATOM 207 CB VAL A 34 6.965 4.174 -3.838 1.00 12.14 C ATOM 208 CG1 VAL A 34 6.797 4.106 -2.328 1.00 35.31 C ATOM 209 CG2 VAL A 34 7.713 5.435 -4.243 1.00 71.00 C ATOM 0 H VAL A 34 7.231 3.658 -6.263 1.00 41.01 H new ATOM 0 HA VAL A 34 8.730 2.944 -4.006 1.00 31.34 H new ATOM 0 HB VAL A 34 5.973 4.206 -4.289 1.00 12.14 H new ATOM 0 HG11 VAL A 34 6.277 4.998 -1.979 1.00 35.31 H new ATOM 0 HG12 VAL A 34 6.216 3.222 -2.066 1.00 35.31 H new ATOM 0 HG13 VAL A 34 7.777 4.049 -1.855 1.00 35.31 H new ATOM 0 HG21 VAL A 34 7.181 6.310 -3.868 1.00 71.00 H new ATOM 0 HG22 VAL A 34 8.718 5.413 -3.822 1.00 71.00 H new ATOM 0 HG23 VAL A 34 7.776 5.487 -5.330 1.00 71.00 H new ATOM 219 N PHE A 35 6.018 1.186 -4.551 1.00 12.41 N ATOM 220 CA PHE A 35 5.274 0.000 -4.142 1.00 51.10 C ATOM 221 C PHE A 35 6.195 -1.213 -4.047 1.00 13.12 C ATOM 222 O PHE A 35 6.239 -1.894 -3.022 1.00 50.34 O ATOM 223 CB PHE A 35 4.140 -0.282 -5.129 1.00 53.23 C ATOM 224 CG PHE A 35 3.542 -1.652 -4.980 1.00 12.05 C ATOM 225 CD1 PHE A 35 2.836 -1.993 -3.839 1.00 24.32 C ATOM 226 CD2 PHE A 35 3.688 -2.599 -5.981 1.00 1.14 C ATOM 227 CE1 PHE A 35 2.285 -3.253 -3.698 1.00 64.35 C ATOM 228 CE2 PHE A 35 3.139 -3.859 -5.847 1.00 21.42 C ATOM 229 CZ PHE A 35 2.438 -4.188 -4.703 1.00 13.02 C ATOM 0 H PHE A 35 5.714 1.590 -5.437 1.00 12.41 H new ATOM 0 HA PHE A 35 4.849 0.190 -3.156 1.00 51.10 H new ATOM 0 HB2 PHE A 35 3.357 0.464 -4.993 1.00 53.23 H new ATOM 0 HB3 PHE A 35 4.517 -0.167 -6.145 1.00 53.23 H new ATOM 0 HD1 PHE A 35 2.714 -1.266 -3.050 1.00 24.32 H new ATOM 0 HD2 PHE A 35 4.238 -2.349 -6.876 1.00 1.14 H new ATOM 0 HE1 PHE A 35 1.736 -3.506 -2.803 1.00 64.35 H new ATOM 0 HE2 PHE A 35 3.258 -4.587 -6.636 1.00 21.42 H new ATOM 0 HZ PHE A 35 2.011 -5.174 -4.595 1.00 13.02 H new ATOM 238 N ARG A 36 6.930 -1.476 -5.124 1.00 60.44 N ATOM 239 CA ARG A 36 7.848 -2.607 -5.163 1.00 64.31 C ATOM 240 C ARG A 36 8.931 -2.467 -4.097 1.00 72.34 C ATOM 241 O ARG A 36 9.213 -3.409 -3.356 1.00 74.21 O ATOM 242 CB ARG A 36 8.491 -2.722 -6.546 1.00 54.32 C ATOM 243 CG ARG A 36 8.519 -4.141 -7.090 1.00 73.41 C ATOM 244 CD ARG A 36 7.751 -4.252 -8.398 1.00 14.21 C ATOM 245 NE ARG A 36 6.409 -4.791 -8.201 1.00 32.01 N ATOM 246 CZ ARG A 36 6.167 -6.042 -7.828 1.00 74.12 C ATOM 247 NH1 ARG A 36 7.172 -6.879 -7.611 1.00 44.22 N ATOM 248 NH2 ARG A 36 4.917 -6.459 -7.669 1.00 33.41 N ATOM 0 H ARG A 36 6.907 -0.921 -5.980 1.00 60.44 H new ATOM 0 HA ARG A 36 7.277 -3.513 -4.959 1.00 64.31 H new ATOM 0 HB2 ARG A 36 7.947 -2.085 -7.244 1.00 54.32 H new ATOM 0 HB3 ARG A 36 9.511 -2.341 -6.496 1.00 54.32 H new ATOM 0 HG2 ARG A 36 9.552 -4.452 -7.246 1.00 73.41 H new ATOM 0 HG3 ARG A 36 8.089 -4.822 -6.355 1.00 73.41 H new ATOM 0 HD2 ARG A 36 7.682 -3.268 -8.862 1.00 14.21 H new ATOM 0 HD3 ARG A 36 8.301 -4.892 -9.088 1.00 14.21 H new ATOM 0 HE ARG A 36 5.613 -4.173 -8.359 1.00 32.01 H new ATOM 0 HH11 ARG A 36 8.134 -6.562 -7.731 1.00 44.22 H new ATOM 0 HH12 ARG A 36 6.983 -7.840 -7.324 1.00 44.22 H new ATOM 0 HH21 ARG A 36 4.141 -5.818 -7.833 1.00 33.41 H new ATOM 0 HH22 ARG A 36 4.733 -7.420 -7.382 1.00 33.41 H new ATOM 259 N SER A 37 9.534 -1.285 -4.026 1.00 74.33 N ATOM 260 CA SER A 37 10.588 -1.021 -3.054 1.00 62.02 C ATOM 261 C SER A 37 10.044 -1.089 -1.630 1.00 52.12 C ATOM 262 O SER A 37 10.756 -1.465 -0.699 1.00 12.12 O ATOM 263 CB SER A 37 11.214 0.351 -3.308 1.00 14.44 C ATOM 264 OG SER A 37 10.469 1.377 -2.677 1.00 42.14 O ATOM 0 H SER A 37 9.310 -0.494 -4.630 1.00 74.33 H new ATOM 0 HA SER A 37 11.354 -1.788 -3.169 1.00 62.02 H new ATOM 0 HB2 SER A 37 12.239 0.361 -2.937 1.00 14.44 H new ATOM 0 HB3 SER A 37 11.262 0.539 -4.381 1.00 14.44 H new ATOM 0 HG SER A 37 9.516 1.254 -2.868 1.00 42.14 H new ATOM 269 N TYR A 38 8.778 -0.721 -1.471 1.00 72.54 N ATOM 270 CA TYR A 38 8.137 -0.737 -0.161 1.00 62.01 C ATOM 271 C TYR A 38 7.981 -2.165 0.353 1.00 12.03 C ATOM 272 O TYR A 38 8.513 -2.520 1.405 1.00 65.31 O ATOM 273 CB TYR A 38 6.769 -0.057 -0.231 1.00 70.11 C ATOM 274 CG TYR A 38 5.859 -0.406 0.925 1.00 51.01 C ATOM 275 CD1 TYR A 38 5.987 0.230 2.153 1.00 60.21 C ATOM 276 CD2 TYR A 38 4.869 -1.372 0.788 1.00 2.23 C ATOM 277 CE1 TYR A 38 5.159 -0.087 3.212 1.00 75.40 C ATOM 278 CE2 TYR A 38 4.035 -1.695 1.841 1.00 41.11 C ATOM 279 CZ TYR A 38 4.184 -1.049 3.051 1.00 43.13 C ATOM 280 OH TYR A 38 3.355 -1.367 4.103 1.00 1.44 O ATOM 0 H TYR A 38 8.175 -0.408 -2.232 1.00 72.54 H new ATOM 0 HA TYR A 38 8.774 -0.188 0.533 1.00 62.01 H new ATOM 0 HB2 TYR A 38 6.911 1.023 -0.257 1.00 70.11 H new ATOM 0 HB3 TYR A 38 6.281 -0.337 -1.164 1.00 70.11 H new ATOM 0 HD1 TYR A 38 6.748 0.986 2.282 1.00 60.21 H new ATOM 0 HD2 TYR A 38 4.750 -1.879 -0.158 1.00 2.23 H new ATOM 0 HE1 TYR A 38 5.274 0.416 4.161 1.00 75.40 H new ATOM 0 HE2 TYR A 38 3.271 -2.448 1.718 1.00 41.11 H new ATOM 0 HH TYR A 38 2.422 -1.343 3.803 1.00 1.44 H new ATOM 289 N VAL A 39 7.249 -2.981 -0.399 1.00 10.14 N ATOM 290 CA VAL A 39 7.023 -4.371 -0.022 1.00 4.24 C ATOM 291 C VAL A 39 8.343 -5.125 0.111 1.00 21.30 C ATOM 292 O VAL A 39 8.484 -6.005 0.960 1.00 33.33 O ATOM 293 CB VAL A 39 6.134 -5.094 -1.051 1.00 71.42 C ATOM 294 CG1 VAL A 39 4.848 -4.317 -1.284 1.00 72.54 C ATOM 295 CG2 VAL A 39 6.887 -5.298 -2.357 1.00 33.45 C ATOM 0 H VAL A 39 6.802 -2.703 -1.273 1.00 10.14 H new ATOM 0 HA VAL A 39 6.515 -4.359 0.942 1.00 4.24 H new ATOM 0 HB VAL A 39 5.872 -6.074 -0.653 1.00 71.42 H new ATOM 0 HG11 VAL A 39 4.232 -4.843 -2.014 1.00 72.54 H new ATOM 0 HG12 VAL A 39 4.301 -4.228 -0.345 1.00 72.54 H new ATOM 0 HG13 VAL A 39 5.087 -3.322 -1.660 1.00 72.54 H new ATOM 0 HG21 VAL A 39 6.243 -5.810 -3.072 1.00 33.45 H new ATOM 0 HG22 VAL A 39 7.181 -4.330 -2.762 1.00 33.45 H new ATOM 0 HG23 VAL A 39 7.777 -5.900 -2.174 1.00 33.45 H new ATOM 305 N PHE A 40 9.307 -4.774 -0.733 1.00 75.51 N ATOM 306 CA PHE A 40 10.616 -5.417 -0.710 1.00 75.14 C ATOM 307 C PHE A 40 11.406 -4.997 0.526 1.00 15.43 C ATOM 308 O PHE A 40 12.128 -5.799 1.117 1.00 62.15 O ATOM 309 CB PHE A 40 11.401 -5.067 -1.975 1.00 44.43 C ATOM 310 CG PHE A 40 12.856 -5.430 -1.896 1.00 1.40 C ATOM 311 CD1 PHE A 40 13.246 -6.739 -1.662 1.00 73.03 C ATOM 312 CD2 PHE A 40 13.834 -4.462 -2.057 1.00 21.12 C ATOM 313 CE1 PHE A 40 14.585 -7.076 -1.590 1.00 24.51 C ATOM 314 CE2 PHE A 40 15.175 -4.793 -1.985 1.00 72.35 C ATOM 315 CZ PHE A 40 15.550 -6.102 -1.750 1.00 51.34 C ATOM 0 H PHE A 40 9.207 -4.047 -1.442 1.00 75.51 H new ATOM 0 HA PHE A 40 10.464 -6.496 -0.672 1.00 75.14 H new ATOM 0 HB2 PHE A 40 10.952 -5.580 -2.825 1.00 44.43 H new ATOM 0 HB3 PHE A 40 11.311 -3.997 -2.165 1.00 44.43 H new ATOM 0 HD1 PHE A 40 12.495 -7.505 -1.534 1.00 73.03 H new ATOM 0 HD2 PHE A 40 13.546 -3.437 -2.241 1.00 21.12 H new ATOM 0 HE1 PHE A 40 14.876 -8.100 -1.409 1.00 24.51 H new ATOM 0 HE2 PHE A 40 15.928 -4.029 -2.112 1.00 72.35 H new ATOM 0 HZ PHE A 40 16.596 -6.363 -1.692 1.00 51.34 H new ATOM 324 N TYR A 41 11.266 -3.732 0.908 1.00 50.15 N ATOM 325 CA TYR A 41 11.970 -3.203 2.071 1.00 74.24 C ATOM 326 C TYR A 41 11.392 -3.774 3.363 1.00 5.22 C ATOM 327 O TYR A 41 12.131 -4.114 4.288 1.00 34.20 O ATOM 328 CB TYR A 41 11.884 -1.676 2.093 1.00 25.11 C ATOM 329 CG TYR A 41 13.053 -0.994 1.418 1.00 23.33 C ATOM 330 CD1 TYR A 41 13.632 -1.533 0.277 1.00 4.23 C ATOM 331 CD2 TYR A 41 13.578 0.189 1.923 1.00 34.31 C ATOM 332 CE1 TYR A 41 14.701 -0.915 -0.342 1.00 13.13 C ATOM 333 CE2 TYR A 41 14.645 0.815 1.310 1.00 0.14 C ATOM 334 CZ TYR A 41 15.204 0.259 0.178 1.00 74.10 C ATOM 335 OH TYR A 41 16.268 0.880 -0.436 1.00 5.12 O ATOM 0 H TYR A 41 10.672 -3.054 0.430 1.00 50.15 H new ATOM 0 HA TYR A 41 13.016 -3.501 1.998 1.00 74.24 H new ATOM 0 HB2 TYR A 41 10.961 -1.365 1.604 1.00 25.11 H new ATOM 0 HB3 TYR A 41 11.825 -1.339 3.128 1.00 25.11 H new ATOM 0 HD1 TYR A 41 13.240 -2.452 -0.134 1.00 4.23 H new ATOM 0 HD2 TYR A 41 13.144 0.626 2.810 1.00 34.31 H new ATOM 0 HE1 TYR A 41 15.140 -1.349 -1.228 1.00 13.13 H new ATOM 0 HE2 TYR A 41 15.040 1.735 1.715 1.00 0.14 H new ATOM 0 HH TYR A 41 16.499 1.696 0.056 1.00 5.12 H new ATOM 344 N ARG A 42 10.069 -3.879 3.417 1.00 34.21 N ATOM 345 CA ARG A 42 9.392 -4.409 4.595 1.00 13.42 C ATOM 346 C ARG A 42 9.716 -5.886 4.790 1.00 2.51 C ATOM 347 O ARG A 42 10.039 -6.322 5.895 1.00 63.31 O ATOM 348 CB ARG A 42 7.879 -4.219 4.468 1.00 31.21 C ATOM 349 CG ARG A 42 7.082 -4.951 5.536 1.00 43.22 C ATOM 350 CD ARG A 42 5.591 -4.686 5.397 1.00 62.12 C ATOM 351 NE ARG A 42 4.789 -5.785 5.927 1.00 51.42 N ATOM 352 CZ ARG A 42 4.715 -6.084 7.219 1.00 63.14 C ATOM 353 NH1 ARG A 42 5.391 -5.371 8.108 1.00 54.35 N ATOM 354 NH2 ARG A 42 3.963 -7.099 7.624 1.00 44.23 N ATOM 0 H ARG A 42 9.444 -3.604 2.659 1.00 34.21 H new ATOM 0 HA ARG A 42 9.748 -3.859 5.466 1.00 13.42 H new ATOM 0 HB2 ARG A 42 7.649 -3.155 4.520 1.00 31.21 H new ATOM 0 HB3 ARG A 42 7.559 -4.566 3.486 1.00 31.21 H new ATOM 0 HG2 ARG A 42 7.271 -6.022 5.463 1.00 43.22 H new ATOM 0 HG3 ARG A 42 7.418 -4.635 6.523 1.00 43.22 H new ATOM 0 HD2 ARG A 42 5.336 -3.765 5.921 1.00 62.12 H new ATOM 0 HD3 ARG A 42 5.346 -4.533 4.346 1.00 62.12 H new ATOM 0 HE ARG A 42 4.256 -6.354 5.269 1.00 51.42 H new ATOM 0 HH11 ARG A 42 5.970 -4.590 7.801 1.00 54.35 H new ATOM 0 HH12 ARG A 42 5.332 -5.603 9.099 1.00 54.35 H new ATOM 0 HH21 ARG A 42 3.441 -7.651 6.943 1.00 44.23 H new ATOM 0 HH22 ARG A 42 3.907 -7.328 8.616 1.00 44.23 H new ATOM 365 N HIS A 43 9.627 -6.653 3.708 1.00 4.21 N ATOM 366 CA HIS A 43 9.910 -8.084 3.759 1.00 20.13 C ATOM 367 C HIS A 43 11.406 -8.335 3.921 1.00 3.44 C ATOM 368 O HIS A 43 11.816 -9.327 4.523 1.00 32.04 O ATOM 369 CB HIS A 43 9.400 -8.772 2.493 1.00 22.01 C ATOM 370 CG HIS A 43 8.094 -9.481 2.681 1.00 11.33 C ATOM 371 ND1 HIS A 43 6.896 -8.819 2.850 1.00 2.41 N ATOM 372 CD2 HIS A 43 7.801 -10.801 2.726 1.00 3.35 C ATOM 373 CE1 HIS A 43 5.924 -9.702 2.992 1.00 11.21 C ATOM 374 NE2 HIS A 43 6.447 -10.912 2.919 1.00 61.41 N ATOM 0 H HIS A 43 9.361 -6.308 2.786 1.00 4.21 H new ATOM 0 HA HIS A 43 9.393 -8.501 4.623 1.00 20.13 H new ATOM 0 HB2 HIS A 43 9.290 -8.028 1.704 1.00 22.01 H new ATOM 0 HB3 HIS A 43 10.147 -9.489 2.153 1.00 22.01 H new ATOM 0 HD2 HIS A 43 8.503 -11.616 2.628 1.00 3.35 H new ATOM 0 HE1 HIS A 43 4.879 -9.473 3.142 1.00 11.21 H new ATOM 0 HE2 HIS A 43 5.929 -11.787 2.994 1.00 61.41 H new ATOM 381 N GLN A 44 12.216 -7.431 3.378 1.00 71.51 N ATOM 382 CA GLN A 44 13.666 -7.557 3.463 1.00 15.43 C ATOM 383 C GLN A 44 14.111 -7.786 4.903 1.00 45.14 C ATOM 384 O GLN A 44 14.805 -8.759 5.200 1.00 75.14 O ATOM 385 CB GLN A 44 14.342 -6.304 2.902 1.00 63.24 C ATOM 386 CG GLN A 44 15.822 -6.210 3.234 1.00 41.10 C ATOM 387 CD GLN A 44 16.109 -5.214 4.340 1.00 22.24 C ATOM 388 OE1 GLN A 44 16.750 -5.545 5.338 1.00 62.00 O ATOM 389 NE2 GLN A 44 15.636 -3.985 4.168 1.00 64.12 N ATOM 0 H GLN A 44 11.893 -6.604 2.875 1.00 71.51 H new ATOM 0 HA GLN A 44 13.964 -8.421 2.869 1.00 15.43 H new ATOM 0 HB2 GLN A 44 14.220 -6.290 1.819 1.00 63.24 H new ATOM 0 HB3 GLN A 44 13.834 -5.422 3.292 1.00 63.24 H new ATOM 0 HG2 GLN A 44 16.187 -7.193 3.532 1.00 41.10 H new ATOM 0 HG3 GLN A 44 16.374 -5.923 2.339 1.00 41.10 H new ATOM 0 HE21 GLN A 44 15.110 -3.754 3.325 1.00 64.12 H new ATOM 0 HE22 GLN A 44 15.799 -3.272 4.879 1.00 64.12 H new ATOM 396 N GLN A 45 13.706 -6.885 5.793 1.00 62.11 N ATOM 397 CA GLN A 45 14.064 -6.990 7.203 1.00 41.22 C ATOM 398 C GLN A 45 13.267 -8.097 7.885 1.00 65.20 C ATOM 399 O GLN A 45 13.803 -8.846 8.701 1.00 65.40 O ATOM 400 CB GLN A 45 13.820 -5.658 7.912 1.00 22.12 C ATOM 401 CG GLN A 45 12.378 -5.183 7.836 1.00 34.40 C ATOM 402 CD GLN A 45 12.180 -3.814 8.460 1.00 5.14 C ATOM 403 OE1 GLN A 45 12.807 -3.482 9.467 1.00 3.51 O ATOM 404 NE2 GLN A 45 11.306 -3.013 7.864 1.00 24.03 N ATOM 0 H GLN A 45 13.130 -6.075 5.563 1.00 62.11 H new ATOM 0 HA GLN A 45 15.123 -7.238 7.267 1.00 41.22 H new ATOM 0 HB2 GLN A 45 14.107 -5.755 8.959 1.00 22.12 H new ATOM 0 HB3 GLN A 45 14.467 -4.899 7.473 1.00 22.12 H new ATOM 0 HG2 GLN A 45 12.065 -5.151 6.793 1.00 34.40 H new ATOM 0 HG3 GLN A 45 11.735 -5.904 8.340 1.00 34.40 H new ATOM 0 HE21 GLN A 45 10.809 -3.330 7.032 1.00 24.03 H new ATOM 0 HE22 GLN A 45 11.131 -2.080 8.238 1.00 24.03 H new ATOM 411 N GLU A 46 11.985 -8.193 7.546 1.00 22.21 N ATOM 412 CA GLU A 46 11.115 -9.208 8.128 1.00 51.02 C ATOM 413 C GLU A 46 11.677 -10.607 7.891 1.00 53.41 C ATOM 414 O GLU A 46 11.454 -11.519 8.686 1.00 34.34 O ATOM 415 CB GLU A 46 9.708 -9.104 7.538 1.00 61.05 C ATOM 416 CG GLU A 46 8.741 -8.316 8.405 1.00 52.31 C ATOM 417 CD GLU A 46 7.486 -9.098 8.740 1.00 73.12 C ATOM 418 OE1 GLU A 46 6.564 -9.131 7.897 1.00 25.24 O ATOM 419 OE2 GLU A 46 7.425 -9.676 9.845 1.00 25.11 O ATOM 0 H GLU A 46 11.526 -7.580 6.872 1.00 22.21 H new ATOM 0 HA GLU A 46 11.064 -9.034 9.203 1.00 51.02 H new ATOM 0 HB2 GLU A 46 9.769 -8.634 6.556 1.00 61.05 H new ATOM 0 HB3 GLU A 46 9.312 -10.108 7.387 1.00 61.05 H new ATOM 0 HG2 GLU A 46 9.241 -8.026 9.329 1.00 52.31 H new ATOM 0 HG3 GLU A 46 8.464 -7.396 7.890 1.00 52.31 H new ATOM 424 N GLN A 47 12.404 -10.767 6.790 1.00 42.22 N ATOM 425 CA GLN A 47 12.997 -12.054 6.447 1.00 44.15 C ATOM 426 C GLN A 47 13.840 -12.589 7.598 1.00 23.54 C ATOM 427 O GLN A 47 13.984 -13.800 7.764 1.00 21.44 O ATOM 428 CB GLN A 47 13.854 -11.926 5.187 1.00 71.24 C ATOM 429 CG GLN A 47 13.442 -12.874 4.071 1.00 21.34 C ATOM 430 CD GLN A 47 12.417 -12.264 3.136 1.00 13.21 C ATOM 431 OE1 GLN A 47 12.693 -12.038 1.957 1.00 52.13 O ATOM 432 NE2 GLN A 47 11.226 -11.994 3.657 1.00 52.23 N ATOM 0 H GLN A 47 12.596 -10.022 6.121 1.00 42.22 H new ATOM 0 HA GLN A 47 12.188 -12.759 6.256 1.00 44.15 H new ATOM 0 HB2 GLN A 47 13.796 -10.901 4.821 1.00 71.24 H new ATOM 0 HB3 GLN A 47 14.896 -12.114 5.446 1.00 71.24 H new ATOM 0 HG2 GLN A 47 14.324 -13.161 3.499 1.00 21.34 H new ATOM 0 HG3 GLN A 47 13.034 -13.786 4.506 1.00 21.34 H new ATOM 0 HE21 GLN A 47 11.041 -12.198 4.639 1.00 52.23 H new ATOM 0 HE22 GLN A 47 10.496 -11.583 3.075 1.00 52.23 H new ATOM 439 N GLU A 48 14.397 -11.679 8.391 1.00 14.24 N ATOM 440 CA GLU A 48 15.229 -12.061 9.527 1.00 41.31 C ATOM 441 C GLU A 48 14.377 -12.636 10.655 1.00 12.15 C ATOM 442 O GLU A 48 14.648 -13.727 11.157 1.00 14.15 O ATOM 443 CB GLU A 48 16.021 -10.855 10.035 1.00 1.13 C ATOM 444 CG GLU A 48 16.745 -11.110 11.346 1.00 70.34 C ATOM 445 CD GLU A 48 17.820 -10.080 11.630 1.00 72.44 C ATOM 446 OE1 GLU A 48 18.642 -9.816 10.730 1.00 44.41 O ATOM 447 OE2 GLU A 48 17.838 -9.537 12.756 1.00 1.21 O ATOM 0 H GLU A 48 14.287 -10.672 8.268 1.00 14.24 H new ATOM 0 HA GLU A 48 15.926 -12.830 9.193 1.00 41.31 H new ATOM 0 HB2 GLU A 48 16.750 -10.565 9.278 1.00 1.13 H new ATOM 0 HB3 GLU A 48 15.341 -10.013 10.163 1.00 1.13 H new ATOM 0 HG2 GLU A 48 16.022 -11.109 12.162 1.00 70.34 H new ATOM 0 HG3 GLU A 48 17.196 -12.102 11.321 1.00 70.34 H new ATOM 452 N ALA A 49 13.348 -11.894 11.049 1.00 30.31 N ATOM 453 CA ALA A 49 12.456 -12.329 12.117 1.00 43.21 C ATOM 454 C ALA A 49 11.659 -13.560 11.698 1.00 12.31 C ATOM 455 O ALA A 49 11.733 -14.607 12.341 1.00 32.32 O ATOM 456 CB ALA A 49 11.517 -11.201 12.514 1.00 14.14 C ATOM 0 H ALA A 49 13.111 -10.988 10.645 1.00 30.31 H new ATOM 0 HA ALA A 49 13.066 -12.598 12.979 1.00 43.21 H new ATOM 0 HB1 ALA A 49 10.857 -11.541 13.312 1.00 14.14 H new ATOM 0 HB2 ALA A 49 12.100 -10.348 12.863 1.00 14.14 H new ATOM 0 HB3 ALA A 49 10.920 -10.904 11.652 1.00 14.14 H new ATOM 462 N GLU A 50 10.897 -13.427 10.617 1.00 55.43 N ATOM 463 CA GLU A 50 10.084 -14.528 10.114 1.00 5.23 C ATOM 464 C GLU A 50 10.221 -14.658 8.600 1.00 45.34 C ATOM 465 O GLU A 50 11.058 -14.001 7.983 1.00 44.44 O ATOM 466 CB GLU A 50 8.616 -14.321 10.489 1.00 72.25 C ATOM 467 CG GLU A 50 8.391 -14.114 11.978 1.00 23.12 C ATOM 468 CD GLU A 50 8.478 -15.407 12.766 1.00 13.31 C ATOM 469 OE1 GLU A 50 8.152 -16.471 12.199 1.00 75.42 O ATOM 470 OE2 GLU A 50 8.872 -15.353 13.949 1.00 21.51 O ATOM 0 H GLU A 50 10.826 -12.567 10.073 1.00 55.43 H new ATOM 0 HA GLU A 50 10.442 -15.449 10.574 1.00 5.23 H new ATOM 0 HB2 GLU A 50 8.230 -13.457 9.948 1.00 72.25 H new ATOM 0 HB3 GLU A 50 8.040 -15.186 10.160 1.00 72.25 H new ATOM 0 HG2 GLU A 50 9.131 -13.410 12.359 1.00 23.12 H new ATOM 0 HG3 GLU A 50 7.411 -13.663 12.134 1.00 23.12 H new ATOM 475 N GLY A 51 9.391 -15.512 8.008 1.00 11.40 N ATOM 476 CA GLY A 51 9.435 -15.714 6.571 1.00 11.32 C ATOM 477 C GLY A 51 8.066 -15.994 5.983 1.00 33.53 C ATOM 478 O GLY A 51 7.954 -16.522 4.877 1.00 1.00 O ATOM 0 H GLY A 51 8.689 -16.067 8.498 1.00 11.40 H new ATOM 0 HA2 GLY A 51 9.857 -14.829 6.095 1.00 11.32 H new ATOM 0 HA3 GLY A 51 10.102 -16.546 6.344 1.00 11.32 H new ATOM 482 N VAL A 52 7.021 -15.643 6.726 1.00 53.11 N ATOM 483 CA VAL A 52 5.652 -15.860 6.271 1.00 23.45 C ATOM 484 C VAL A 52 5.360 -15.062 5.007 1.00 34.11 C ATOM 485 O VAL A 52 5.659 -13.870 4.930 1.00 64.11 O ATOM 486 CB VAL A 52 4.632 -15.473 7.359 1.00 4.31 C ATOM 487 CG1 VAL A 52 4.842 -16.311 8.611 1.00 74.02 C ATOM 488 CG2 VAL A 52 4.733 -13.989 7.677 1.00 71.42 C ATOM 0 H VAL A 52 7.096 -15.207 7.645 1.00 53.11 H new ATOM 0 HA VAL A 52 5.555 -16.924 6.054 1.00 23.45 H new ATOM 0 HB VAL A 52 3.629 -15.674 6.982 1.00 4.31 H new ATOM 0 HG11 VAL A 52 4.112 -16.023 9.368 1.00 74.02 H new ATOM 0 HG12 VAL A 52 4.716 -17.366 8.368 1.00 74.02 H new ATOM 0 HG13 VAL A 52 5.848 -16.145 8.995 1.00 74.02 H new ATOM 0 HG21 VAL A 52 4.006 -13.732 8.447 1.00 71.42 H new ATOM 0 HG22 VAL A 52 5.737 -13.761 8.035 1.00 71.42 H new ATOM 0 HG23 VAL A 52 4.528 -13.409 6.777 1.00 71.42 H new ATOM 498 N ALA A 53 4.772 -15.726 4.017 1.00 31.13 N ATOM 499 CA ALA A 53 4.436 -15.077 2.756 1.00 61.43 C ATOM 500 C ALA A 53 5.672 -14.465 2.107 1.00 2.44 C ATOM 501 O ALA A 53 5.662 -13.303 1.700 1.00 61.41 O ATOM 502 CB ALA A 53 3.372 -14.012 2.978 1.00 11.22 C ATOM 0 H ALA A 53 4.519 -16.713 4.064 1.00 31.13 H new ATOM 0 HA ALA A 53 4.041 -15.835 2.080 1.00 61.43 H new ATOM 0 HB1 ALA A 53 3.131 -13.535 2.028 1.00 11.22 H new ATOM 0 HB2 ALA A 53 2.475 -14.474 3.390 1.00 11.22 H new ATOM 0 HB3 ALA A 53 3.747 -13.263 3.675 1.00 11.22 H new ATOM 508 N ALA A 54 6.738 -15.255 2.012 1.00 12.22 N ATOM 509 CA ALA A 54 7.982 -14.790 1.411 1.00 64.45 C ATOM 510 C ALA A 54 7.900 -14.821 -0.112 1.00 53.00 C ATOM 511 O ALA A 54 7.062 -15.505 -0.699 1.00 44.21 O ATOM 512 CB ALA A 54 9.150 -15.636 1.895 1.00 20.41 C ATOM 0 H ALA A 54 6.764 -16.219 2.344 1.00 12.22 H new ATOM 0 HA ALA A 54 8.143 -13.757 1.720 1.00 64.45 H new ATOM 0 HB1 ALA A 54 10.073 -15.278 1.438 1.00 20.41 H new ATOM 0 HB2 ALA A 54 9.229 -15.561 2.980 1.00 20.41 H new ATOM 0 HB3 ALA A 54 8.987 -16.677 1.614 1.00 20.41 H new ATOM 518 N PRO A 55 8.791 -14.062 -0.768 1.00 75.45 N ATOM 519 CA PRO A 55 8.839 -13.985 -2.231 1.00 50.31 C ATOM 520 C PRO A 55 9.332 -15.281 -2.864 1.00 64.22 C ATOM 521 O PRO A 55 9.597 -16.261 -2.167 1.00 1.42 O ATOM 522 CB PRO A 55 9.833 -12.851 -2.494 1.00 13.13 C ATOM 523 CG PRO A 55 10.699 -12.818 -1.282 1.00 61.21 C ATOM 524 CD PRO A 55 9.818 -13.221 -0.132 1.00 32.24 C ATOM 0 HA PRO A 55 7.852 -13.815 -2.662 1.00 50.31 H new ATOM 0 HB2 PRO A 55 10.419 -13.039 -3.394 1.00 13.13 H new ATOM 0 HB3 PRO A 55 9.320 -11.901 -2.640 1.00 13.13 H new ATOM 0 HG2 PRO A 55 11.542 -13.501 -1.386 1.00 61.21 H new ATOM 0 HG3 PRO A 55 11.114 -11.822 -1.126 1.00 61.21 H new ATOM 0 HD2 PRO A 55 10.374 -13.771 0.627 1.00 32.24 H new ATOM 0 HD3 PRO A 55 9.379 -12.354 0.361 1.00 32.24 H new ATOM 529 N ALA A 56 9.451 -15.281 -4.187 1.00 22.12 N ATOM 530 CA ALA A 56 9.914 -16.458 -4.913 1.00 15.52 C ATOM 531 C ALA A 56 11.424 -16.623 -4.782 1.00 23.22 C ATOM 532 O ALA A 56 12.157 -16.530 -5.767 1.00 52.15 O ATOM 533 CB ALA A 56 9.517 -16.363 -6.379 1.00 32.43 C ATOM 0 H ALA A 56 9.233 -14.479 -4.779 1.00 22.12 H new ATOM 0 HA ALA A 56 9.439 -17.336 -4.475 1.00 15.52 H new ATOM 0 HB1 ALA A 56 9.869 -17.248 -6.909 1.00 32.43 H new ATOM 0 HB2 ALA A 56 8.432 -16.300 -6.459 1.00 32.43 H new ATOM 0 HB3 ALA A 56 9.966 -15.473 -6.821 1.00 32.43 H new ATOM 539 N ASP A 57 11.884 -16.870 -3.560 1.00 74.14 N ATOM 540 CA ASP A 57 13.308 -17.050 -3.301 1.00 71.14 C ATOM 541 C ASP A 57 14.081 -15.770 -3.603 1.00 63.02 C ATOM 542 O ASP A 57 13.646 -14.923 -4.383 1.00 21.11 O ATOM 543 CB ASP A 57 13.858 -18.204 -4.139 1.00 3.21 C ATOM 544 CG ASP A 57 12.809 -19.257 -4.435 1.00 41.41 C ATOM 545 OD1 ASP A 57 12.066 -19.631 -3.505 1.00 62.50 O ATOM 546 OD2 ASP A 57 12.732 -19.708 -5.599 1.00 75.54 O ATOM 0 H ASP A 57 11.292 -16.950 -2.734 1.00 74.14 H new ATOM 0 HA ASP A 57 13.434 -17.287 -2.245 1.00 71.14 H new ATOM 0 HB2 ASP A 57 14.250 -17.813 -5.078 1.00 3.21 H new ATOM 0 HB3 ASP A 57 14.693 -18.666 -3.612 1.00 3.21 H new ATOM 550 N PRO A 58 15.255 -15.626 -2.971 1.00 13.31 N ATOM 551 CA PRO A 58 16.113 -14.452 -3.157 1.00 12.25 C ATOM 552 C PRO A 58 16.744 -14.407 -4.545 1.00 62.12 C ATOM 553 O PRO A 58 16.386 -15.192 -5.423 1.00 11.12 O ATOM 554 CB PRO A 58 17.193 -14.629 -2.086 1.00 15.32 C ATOM 555 CG PRO A 58 17.241 -16.097 -1.836 1.00 33.02 C ATOM 556 CD PRO A 58 15.836 -16.595 -2.028 1.00 43.34 C ATOM 0 HA PRO A 58 15.553 -13.521 -3.069 1.00 12.25 H new ATOM 0 HB2 PRO A 58 18.157 -14.254 -2.430 1.00 15.32 H new ATOM 0 HB3 PRO A 58 16.944 -14.081 -1.178 1.00 15.32 H new ATOM 0 HG2 PRO A 58 17.927 -16.588 -2.526 1.00 33.02 H new ATOM 0 HG3 PRO A 58 17.596 -16.310 -0.828 1.00 33.02 H new ATOM 0 HD2 PRO A 58 15.820 -17.607 -2.432 1.00 43.34 H new ATOM 0 HD3 PRO A 58 15.286 -16.619 -1.087 1.00 43.34 H new ATOM 561 N GLU A 59 17.682 -13.485 -4.735 1.00 23.52 N ATOM 562 CA GLU A 59 18.361 -13.340 -6.017 1.00 41.14 C ATOM 563 C GLU A 59 19.410 -12.233 -5.956 1.00 71.24 C ATOM 564 O GLU A 59 19.301 -11.305 -5.155 1.00 52.23 O ATOM 565 CB GLU A 59 17.349 -13.037 -7.124 1.00 64.14 C ATOM 566 CG GLU A 59 17.139 -14.192 -8.090 1.00 12.20 C ATOM 567 CD GLU A 59 15.746 -14.206 -8.688 1.00 44.15 C ATOM 568 OE1 GLU A 59 15.135 -13.123 -8.799 1.00 13.25 O ATOM 569 OE2 GLU A 59 15.266 -15.303 -9.046 1.00 21.30 O ATOM 0 H GLU A 59 17.989 -12.828 -4.018 1.00 23.52 H new ATOM 0 HA GLU A 59 18.863 -14.281 -6.241 1.00 41.14 H new ATOM 0 HB2 GLU A 59 16.393 -12.776 -6.669 1.00 64.14 H new ATOM 0 HB3 GLU A 59 17.685 -12.164 -7.683 1.00 64.14 H new ATOM 0 HG2 GLU A 59 17.874 -14.128 -8.892 1.00 12.20 H new ATOM 0 HG3 GLU A 59 17.316 -15.133 -7.569 1.00 12.20 H new ATOM 574 N MET A 60 20.425 -12.340 -6.807 1.00 55.34 N ATOM 575 CA MET A 60 21.493 -11.348 -6.850 1.00 41.24 C ATOM 576 C MET A 60 21.023 -10.074 -7.544 1.00 53.51 C ATOM 577 O MET A 60 21.103 -8.982 -6.981 1.00 3.21 O ATOM 578 CB MET A 60 22.716 -11.915 -7.572 1.00 44.24 C ATOM 579 CG MET A 60 22.879 -13.417 -7.404 1.00 70.24 C ATOM 580 SD MET A 60 24.506 -14.001 -7.915 1.00 4.23 S ATOM 581 CE MET A 60 24.573 -13.388 -9.597 1.00 20.45 C ATOM 0 H MET A 60 20.530 -13.103 -7.476 1.00 55.34 H new ATOM 0 HA MET A 60 21.768 -11.102 -5.824 1.00 41.24 H new ATOM 0 HB2 MET A 60 22.641 -11.683 -8.634 1.00 44.24 H new ATOM 0 HB3 MET A 60 23.611 -11.417 -7.199 1.00 44.24 H new ATOM 0 HG2 MET A 60 22.714 -13.682 -6.360 1.00 70.24 H new ATOM 0 HG3 MET A 60 22.114 -13.929 -7.987 1.00 70.24 H new ATOM 0 HE1 MET A 60 25.426 -13.830 -10.112 1.00 20.45 H new ATOM 0 HE2 MET A 60 23.655 -13.657 -10.119 1.00 20.45 H new ATOM 0 HE3 MET A 60 24.679 -12.303 -9.585 1.00 20.45 H new ATOM 589 N VAL A 61 20.534 -10.220 -8.772 1.00 30.32 N ATOM 590 CA VAL A 61 20.051 -9.080 -9.543 1.00 51.44 C ATOM 591 C VAL A 61 19.058 -8.251 -8.736 1.00 23.52 C ATOM 592 O VAL A 61 19.069 -7.021 -8.790 1.00 2.33 O ATOM 593 CB VAL A 61 19.379 -9.533 -10.853 1.00 4.23 C ATOM 594 CG1 VAL A 61 18.996 -8.330 -11.701 1.00 1.10 C ATOM 595 CG2 VAL A 61 20.297 -10.470 -11.625 1.00 62.34 C ATOM 0 H VAL A 61 20.462 -11.116 -9.254 1.00 30.32 H new ATOM 0 HA VAL A 61 20.921 -8.468 -9.782 1.00 51.44 H new ATOM 0 HB VAL A 61 18.467 -10.076 -10.605 1.00 4.23 H new ATOM 0 HG11 VAL A 61 18.523 -8.670 -12.622 1.00 1.10 H new ATOM 0 HG12 VAL A 61 18.300 -7.701 -11.146 1.00 1.10 H new ATOM 0 HG13 VAL A 61 19.890 -7.756 -11.943 1.00 1.10 H new ATOM 0 HG21 VAL A 61 19.807 -10.781 -12.548 1.00 62.34 H new ATOM 0 HG22 VAL A 61 21.227 -9.953 -11.864 1.00 62.34 H new ATOM 0 HG23 VAL A 61 20.516 -11.348 -11.017 1.00 62.34 H new ATOM 605 N THR A 62 18.199 -8.933 -7.985 1.00 65.24 N ATOM 606 CA THR A 62 17.198 -8.261 -7.166 1.00 50.13 C ATOM 607 C THR A 62 16.204 -7.494 -8.032 1.00 23.22 C ATOM 608 O THR A 62 16.503 -7.141 -9.173 1.00 51.14 O ATOM 609 CB THR A 62 17.851 -7.285 -6.169 1.00 23.22 C ATOM 610 OG1 THR A 62 19.136 -7.777 -5.774 1.00 21.11 O ATOM 611 CG2 THR A 62 16.974 -7.100 -4.940 1.00 24.11 C ATOM 0 H THR A 62 18.177 -9.951 -7.927 1.00 65.24 H new ATOM 0 HA THR A 62 16.671 -9.037 -6.612 1.00 50.13 H new ATOM 0 HB THR A 62 17.967 -6.320 -6.662 1.00 23.22 H new ATOM 0 HG1 THR A 62 19.780 -7.628 -6.498 1.00 21.11 H new ATOM 0 HG21 THR A 62 17.456 -6.407 -4.250 1.00 24.11 H new ATOM 0 HG22 THR A 62 16.006 -6.699 -5.241 1.00 24.11 H new ATOM 0 HG23 THR A 62 16.831 -8.062 -4.447 1.00 24.11 H new ATOM 619 N LEU A 63 15.022 -7.241 -7.482 1.00 51.44 N ATOM 620 CA LEU A 63 13.983 -6.514 -8.205 1.00 64.13 C ATOM 621 C LEU A 63 14.515 -5.188 -8.735 1.00 53.44 C ATOM 622 O LEU A 63 15.466 -4.615 -8.205 1.00 20.43 O ATOM 623 CB LEU A 63 12.779 -6.267 -7.295 1.00 60.30 C ATOM 624 CG LEU A 63 12.846 -5.017 -6.417 1.00 32.24 C ATOM 625 CD1 LEU A 63 12.266 -3.818 -7.150 1.00 34.30 C ATOM 626 CD2 LEU A 63 12.114 -5.247 -5.102 1.00 43.11 C ATOM 0 H LEU A 63 14.759 -7.528 -6.539 1.00 51.44 H new ATOM 0 HA LEU A 63 13.671 -7.123 -9.053 1.00 64.13 H new ATOM 0 HB2 LEU A 63 11.886 -6.202 -7.917 1.00 60.30 H new ATOM 0 HB3 LEU A 63 12.654 -7.135 -6.648 1.00 60.30 H new ATOM 0 HG LEU A 63 13.893 -4.809 -6.194 1.00 32.24 H new ATOM 0 HD11 LEU A 63 12.322 -2.938 -6.509 1.00 34.30 H new ATOM 0 HD12 LEU A 63 12.835 -3.640 -8.063 1.00 34.30 H new ATOM 0 HD13 LEU A 63 11.225 -4.016 -7.404 1.00 34.30 H new ATOM 0 HD21 LEU A 63 12.173 -4.347 -4.491 1.00 43.11 H new ATOM 0 HD22 LEU A 63 11.069 -5.481 -5.304 1.00 43.11 H new ATOM 0 HD23 LEU A 63 12.576 -6.078 -4.569 1.00 43.11 H new ATOM 637 N PRO A 64 13.885 -4.683 -9.807 1.00 42.13 N ATOM 638 CA PRO A 64 14.276 -3.416 -10.432 1.00 62.30 C ATOM 639 C PRO A 64 13.951 -2.213 -9.553 1.00 31.11 C ATOM 640 O PRO A 64 12.970 -1.505 -9.789 1.00 22.53 O ATOM 641 CB PRO A 64 13.443 -3.381 -11.716 1.00 33.43 C ATOM 642 CG PRO A 64 12.257 -4.233 -11.421 1.00 10.30 C ATOM 643 CD PRO A 64 12.743 -5.312 -10.492 1.00 13.43 C ATOM 0 HA PRO A 64 15.351 -3.361 -10.604 1.00 62.30 H new ATOM 0 HB2 PRO A 64 13.146 -2.363 -11.968 1.00 33.43 H new ATOM 0 HB3 PRO A 64 14.007 -3.768 -12.565 1.00 33.43 H new ATOM 0 HG2 PRO A 64 11.462 -3.648 -10.958 1.00 10.30 H new ATOM 0 HG3 PRO A 64 11.847 -4.661 -12.336 1.00 10.30 H new ATOM 0 HD2 PRO A 64 11.968 -5.614 -9.787 1.00 13.43 H new ATOM 0 HD3 PRO A 64 13.044 -6.206 -11.037 1.00 13.43 H new ATOM 648 N LEU A 65 14.780 -1.985 -8.540 1.00 13.01 N ATOM 649 CA LEU A 65 14.581 -0.866 -7.626 1.00 11.23 C ATOM 650 C LEU A 65 15.354 0.363 -8.094 1.00 32.03 C ATOM 651 O LEU A 65 16.257 0.261 -8.923 1.00 21.45 O ATOM 652 CB LEU A 65 15.022 -1.251 -6.213 1.00 70.14 C ATOM 653 CG LEU A 65 14.561 -0.322 -5.089 1.00 43.00 C ATOM 654 CD1 LEU A 65 14.124 -1.128 -3.876 1.00 60.01 C ATOM 655 CD2 LEU A 65 15.669 0.651 -4.714 1.00 14.11 C ATOM 0 H LEU A 65 15.596 -2.560 -8.331 1.00 13.01 H new ATOM 0 HA LEU A 65 13.519 -0.623 -7.615 1.00 11.23 H new ATOM 0 HB2 LEU A 65 14.655 -2.255 -6.001 1.00 70.14 H new ATOM 0 HB3 LEU A 65 16.111 -1.299 -6.194 1.00 70.14 H new ATOM 0 HG LEU A 65 13.706 0.252 -5.445 1.00 43.00 H new ATOM 0 HD11 LEU A 65 13.799 -0.450 -3.086 1.00 60.01 H new ATOM 0 HD12 LEU A 65 13.299 -1.784 -4.153 1.00 60.01 H new ATOM 0 HD13 LEU A 65 14.960 -1.728 -3.518 1.00 60.01 H new ATOM 0 HD21 LEU A 65 15.324 1.304 -3.913 1.00 14.11 H new ATOM 0 HD22 LEU A 65 16.543 0.094 -4.377 1.00 14.11 H new ATOM 0 HD23 LEU A 65 15.935 1.252 -5.583 1.00 14.11 H new ATOM 666 N GLN A 66 14.993 1.523 -7.555 1.00 73.21 N ATOM 667 CA GLN A 66 15.654 2.772 -7.917 1.00 42.24 C ATOM 668 C GLN A 66 16.453 3.325 -6.742 1.00 54.22 C ATOM 669 O GLN A 66 16.026 4.249 -6.048 1.00 42.53 O ATOM 670 CB GLN A 66 14.623 3.804 -8.379 1.00 61.12 C ATOM 671 CG GLN A 66 14.767 4.196 -9.841 1.00 2.32 C ATOM 672 CD GLN A 66 15.713 5.363 -10.042 1.00 34.24 C ATOM 673 OE1 GLN A 66 15.298 6.454 -10.434 1.00 61.51 O ATOM 674 NE2 GLN A 66 16.995 5.141 -9.771 1.00 44.14 N ATOM 0 H GLN A 66 14.247 1.624 -6.867 1.00 73.21 H new ATOM 0 HA GLN A 66 16.343 2.565 -8.736 1.00 42.24 H new ATOM 0 HB2 GLN A 66 13.622 3.404 -8.216 1.00 61.12 H new ATOM 0 HB3 GLN A 66 14.714 4.697 -7.761 1.00 61.12 H new ATOM 0 HG2 GLN A 66 15.128 3.339 -10.409 1.00 2.32 H new ATOM 0 HG3 GLN A 66 13.787 4.454 -10.242 1.00 2.32 H new ATOM 0 HE21 GLN A 66 17.296 4.221 -9.448 1.00 44.14 H new ATOM 0 HE22 GLN A 66 17.678 5.890 -9.886 1.00 44.14 H new ATOM 681 N PRO A 67 17.641 2.748 -6.510 1.00 14.43 N ATOM 682 CA PRO A 67 18.526 3.168 -5.419 1.00 2.10 C ATOM 683 C PRO A 67 19.131 4.546 -5.661 1.00 10.04 C ATOM 684 O PRO A 67 19.777 5.115 -4.780 1.00 42.32 O ATOM 685 CB PRO A 67 19.619 2.097 -5.416 1.00 50.10 C ATOM 686 CG PRO A 67 19.635 1.568 -6.808 1.00 64.12 C ATOM 687 CD PRO A 67 18.214 1.643 -7.296 1.00 21.44 C ATOM 0 HA PRO A 67 17.993 3.254 -4.472 1.00 2.10 H new ATOM 0 HB2 PRO A 67 20.586 2.519 -5.142 1.00 50.10 H new ATOM 0 HB3 PRO A 67 19.399 1.309 -4.696 1.00 50.10 H new ATOM 0 HG2 PRO A 67 20.297 2.158 -7.442 1.00 64.12 H new ATOM 0 HG3 PRO A 67 20.002 0.542 -6.831 1.00 64.12 H new ATOM 0 HD2 PRO A 67 18.167 1.845 -8.366 1.00 21.44 H new ATOM 0 HD3 PRO A 67 17.680 0.708 -7.124 1.00 21.44 H new ATOM 692 N SER A 68 18.920 5.079 -6.860 1.00 62.23 N ATOM 693 CA SER A 68 19.448 6.390 -7.220 1.00 22.33 C ATOM 694 C SER A 68 18.346 7.445 -7.195 1.00 1.31 C ATOM 695 O SER A 68 18.513 8.544 -7.724 1.00 34.51 O ATOM 696 CB SER A 68 20.093 6.340 -8.606 1.00 11.14 C ATOM 697 OG SER A 68 19.866 5.089 -9.230 1.00 51.33 O ATOM 0 H SER A 68 18.386 4.623 -7.600 1.00 62.23 H new ATOM 0 HA SER A 68 20.205 6.664 -6.485 1.00 22.33 H new ATOM 0 HB2 SER A 68 19.688 7.139 -9.228 1.00 11.14 H new ATOM 0 HB3 SER A 68 21.165 6.517 -8.518 1.00 11.14 H new ATOM 0 HG SER A 68 20.287 5.084 -10.115 1.00 51.33 H new ATOM 702 N SER A 69 17.219 7.101 -6.579 1.00 10.43 N ATOM 703 CA SER A 69 16.088 8.016 -6.489 1.00 61.01 C ATOM 704 C SER A 69 15.523 8.042 -5.072 1.00 52.42 C ATOM 705 O SER A 69 15.746 7.124 -4.284 1.00 71.51 O ATOM 706 CB SER A 69 14.995 7.608 -7.479 1.00 22.54 C ATOM 707 OG SER A 69 14.913 8.526 -8.555 1.00 32.14 O ATOM 0 H SER A 69 17.065 6.196 -6.135 1.00 10.43 H new ATOM 0 HA SER A 69 16.440 9.017 -6.740 1.00 61.01 H new ATOM 0 HB2 SER A 69 15.203 6.610 -7.864 1.00 22.54 H new ATOM 0 HB3 SER A 69 14.035 7.558 -6.965 1.00 22.54 H new ATOM 0 HG SER A 69 15.023 8.047 -9.403 1.00 32.14 H new ATOM 712 N THR A 70 14.787 9.104 -4.755 1.00 32.04 N ATOM 713 CA THR A 70 14.191 9.254 -3.434 1.00 63.23 C ATOM 714 C THR A 70 13.060 8.252 -3.225 1.00 22.32 C ATOM 715 O THR A 70 12.791 7.832 -2.100 1.00 44.12 O ATOM 716 CB THR A 70 13.643 10.678 -3.222 1.00 24.14 C ATOM 717 OG1 THR A 70 14.613 11.642 -3.646 1.00 31.32 O ATOM 718 CG2 THR A 70 13.295 10.911 -1.760 1.00 31.11 C ATOM 0 H THR A 70 14.590 9.872 -5.396 1.00 32.04 H new ATOM 0 HA THR A 70 14.982 9.065 -2.708 1.00 63.23 H new ATOM 0 HB THR A 70 12.736 10.788 -3.817 1.00 24.14 H new ATOM 0 HG1 THR A 70 14.258 12.545 -3.510 1.00 31.32 H new ATOM 0 HG21 THR A 70 12.910 11.923 -1.634 1.00 31.11 H new ATOM 0 HG22 THR A 70 12.537 10.193 -1.448 1.00 31.11 H new ATOM 0 HG23 THR A 70 14.188 10.784 -1.149 1.00 31.11 H new ATOM 726 N MET A 71 12.404 7.872 -4.316 1.00 62.32 N ATOM 727 CA MET A 71 11.303 6.916 -4.252 1.00 13.04 C ATOM 728 C MET A 71 11.724 5.651 -3.509 1.00 10.51 C ATOM 729 O MET A 71 10.900 4.980 -2.890 1.00 72.22 O ATOM 730 CB MET A 71 10.826 6.560 -5.660 1.00 14.42 C ATOM 731 CG MET A 71 10.447 7.771 -6.498 1.00 33.20 C ATOM 732 SD MET A 71 9.170 8.780 -5.721 1.00 43.13 S ATOM 733 CE MET A 71 10.135 10.186 -5.174 1.00 22.12 C ATOM 0 H MET A 71 12.615 8.211 -5.255 1.00 62.32 H new ATOM 0 HA MET A 71 10.482 7.381 -3.706 1.00 13.04 H new ATOM 0 HB2 MET A 71 11.613 6.006 -6.172 1.00 14.42 H new ATOM 0 HB3 MET A 71 9.965 5.896 -5.586 1.00 14.42 H new ATOM 0 HG2 MET A 71 11.333 8.382 -6.669 1.00 33.20 H new ATOM 0 HG3 MET A 71 10.097 7.437 -7.475 1.00 33.20 H new ATOM 0 HE1 MET A 71 9.947 10.367 -4.116 1.00 22.12 H new ATOM 0 HE2 MET A 71 11.195 9.981 -5.325 1.00 22.12 H new ATOM 0 HE3 MET A 71 9.851 11.068 -5.748 1.00 22.12 H new ATOM 741 N GLY A 72 13.013 5.332 -3.578 1.00 21.35 N ATOM 742 CA GLY A 72 13.520 4.148 -2.909 1.00 63.42 C ATOM 743 C GLY A 72 13.496 4.281 -1.399 1.00 21.12 C ATOM 744 O GLY A 72 13.123 3.343 -0.693 1.00 10.55 O ATOM 0 H GLY A 72 13.715 5.872 -4.085 1.00 21.35 H new ATOM 0 HA2 GLY A 72 12.924 3.284 -3.204 1.00 63.42 H new ATOM 0 HA3 GLY A 72 14.542 3.958 -3.238 1.00 63.42 H new ATOM 748 N GLN A 73 13.897 5.447 -0.902 1.00 4.31 N ATOM 749 CA GLN A 73 13.922 5.696 0.534 1.00 41.43 C ATOM 750 C GLN A 73 12.507 5.768 1.098 1.00 21.34 C ATOM 751 O GLN A 73 12.300 5.621 2.304 1.00 41.41 O ATOM 752 CB GLN A 73 14.670 6.997 0.834 1.00 41.32 C ATOM 753 CG GLN A 73 13.758 8.205 0.973 1.00 51.54 C ATOM 754 CD GLN A 73 14.525 9.511 1.039 1.00 24.31 C ATOM 755 OE1 GLN A 73 15.248 9.867 0.109 1.00 14.42 O ATOM 756 NE2 GLN A 73 14.373 10.231 2.144 1.00 53.22 N ATOM 0 H GLN A 73 14.209 6.233 -1.472 1.00 4.31 H new ATOM 0 HA GLN A 73 14.443 4.867 1.013 1.00 41.43 H new ATOM 0 HB2 GLN A 73 15.240 6.875 1.755 1.00 41.32 H new ATOM 0 HB3 GLN A 73 15.389 7.185 0.037 1.00 41.32 H new ATOM 0 HG2 GLN A 73 13.070 8.235 0.128 1.00 51.54 H new ATOM 0 HG3 GLN A 73 13.153 8.097 1.874 1.00 51.54 H new ATOM 0 HE21 GLN A 73 13.763 9.897 2.890 1.00 53.22 H new ATOM 0 HE22 GLN A 73 14.866 11.118 2.247 1.00 53.22 H new ATOM 763 N VAL A 74 11.535 5.995 0.220 1.00 32.22 N ATOM 764 CA VAL A 74 10.139 6.085 0.632 1.00 12.23 C ATOM 765 C VAL A 74 9.666 4.780 1.260 1.00 60.14 C ATOM 766 O VAL A 74 9.140 4.769 2.373 1.00 43.30 O ATOM 767 CB VAL A 74 9.225 6.430 -0.559 1.00 11.01 C ATOM 768 CG1 VAL A 74 7.764 6.388 -0.139 1.00 44.31 C ATOM 769 CG2 VAL A 74 9.585 7.795 -1.129 1.00 22.13 C ATOM 0 H VAL A 74 11.688 6.120 -0.781 1.00 32.22 H new ATOM 0 HA VAL A 74 10.078 6.883 1.372 1.00 12.23 H new ATOM 0 HB VAL A 74 9.376 5.684 -1.339 1.00 11.01 H new ATOM 0 HG11 VAL A 74 7.133 6.634 -0.993 1.00 44.31 H new ATOM 0 HG12 VAL A 74 7.517 5.388 0.219 1.00 44.31 H new ATOM 0 HG13 VAL A 74 7.594 7.111 0.659 1.00 44.31 H new ATOM 0 HG21 VAL A 74 8.929 8.023 -1.970 1.00 22.13 H new ATOM 0 HG22 VAL A 74 9.463 8.555 -0.357 1.00 22.13 H new ATOM 0 HG23 VAL A 74 10.621 7.786 -1.469 1.00 22.13 H new ATOM 779 N GLY A 75 9.857 3.679 0.540 1.00 3.10 N ATOM 780 CA GLY A 75 9.444 2.382 1.043 1.00 42.14 C ATOM 781 C GLY A 75 9.969 2.108 2.438 1.00 72.44 C ATOM 782 O GLY A 75 9.342 1.384 3.213 1.00 23.21 O ATOM 0 H GLY A 75 10.291 3.662 -0.383 1.00 3.10 H new ATOM 0 HA2 GLY A 75 8.355 2.328 1.051 1.00 42.14 H new ATOM 0 HA3 GLY A 75 9.797 1.604 0.366 1.00 42.14 H new ATOM 786 N ARG A 76 11.122 2.686 2.759 1.00 73.34 N ATOM 787 CA ARG A 76 11.732 2.498 4.071 1.00 45.44 C ATOM 788 C ARG A 76 10.850 3.082 5.169 1.00 63.51 C ATOM 789 O ARG A 76 10.479 2.387 6.116 1.00 12.32 O ATOM 790 CB ARG A 76 13.114 3.149 4.110 1.00 31.25 C ATOM 791 CG ARG A 76 13.822 2.995 5.447 1.00 75.34 C ATOM 792 CD ARG A 76 15.160 3.718 5.457 1.00 51.40 C ATOM 793 NE ARG A 76 15.261 4.667 6.562 1.00 2.21 N ATOM 794 CZ ARG A 76 14.742 5.889 6.531 1.00 71.12 C ATOM 795 NH1 ARG A 76 14.087 6.309 5.458 1.00 45.13 N ATOM 796 NH2 ARG A 76 14.877 6.695 7.577 1.00 62.22 N ATOM 0 H ARG A 76 11.653 3.288 2.129 1.00 73.34 H new ATOM 0 HA ARG A 76 11.837 1.427 4.246 1.00 45.44 H new ATOM 0 HB2 ARG A 76 13.734 2.712 3.327 1.00 31.25 H new ATOM 0 HB3 ARG A 76 13.013 4.210 3.882 1.00 31.25 H new ATOM 0 HG2 ARG A 76 13.189 3.388 6.242 1.00 75.34 H new ATOM 0 HG3 ARG A 76 13.978 1.937 5.657 1.00 75.34 H new ATOM 0 HD2 ARG A 76 15.966 2.988 5.531 1.00 51.40 H new ATOM 0 HD3 ARG A 76 15.294 4.246 4.513 1.00 51.40 H new ATOM 0 HE ARG A 76 15.757 4.375 7.404 1.00 2.21 H new ATOM 0 HH11 ARG A 76 13.980 5.693 4.652 1.00 45.13 H new ATOM 0 HH12 ARG A 76 13.690 7.248 5.438 1.00 45.13 H new ATOM 0 HH21 ARG A 76 15.380 6.376 8.405 1.00 62.22 H new ATOM 0 HH22 ARG A 76 14.478 7.633 7.553 1.00 62.22 H new ATOM 807 N GLN A 77 10.518 4.362 5.037 1.00 71.11 N ATOM 808 CA GLN A 77 9.680 5.039 6.020 1.00 1.33 C ATOM 809 C GLN A 77 8.291 4.411 6.076 1.00 34.25 C ATOM 810 O GLN A 77 7.804 4.055 7.150 1.00 60.34 O ATOM 811 CB GLN A 77 9.567 6.528 5.685 1.00 53.02 C ATOM 812 CG GLN A 77 9.327 7.409 6.900 1.00 25.34 C ATOM 813 CD GLN A 77 8.320 6.812 7.864 1.00 2.21 C ATOM 814 OE1 GLN A 77 7.110 6.919 7.661 1.00 21.33 O ATOM 815 NE2 GLN A 77 8.815 6.177 8.920 1.00 72.41 N ATOM 0 H GLN A 77 10.816 4.951 4.259 1.00 71.11 H new ATOM 0 HA GLN A 77 10.148 4.928 6.998 1.00 1.33 H new ATOM 0 HB2 GLN A 77 10.482 6.850 5.188 1.00 53.02 H new ATOM 0 HB3 GLN A 77 8.752 6.671 4.976 1.00 53.02 H new ATOM 0 HG2 GLN A 77 10.271 7.569 7.420 1.00 25.34 H new ATOM 0 HG3 GLN A 77 8.974 8.387 6.571 1.00 25.34 H new ATOM 0 HE21 GLN A 77 9.825 6.112 9.049 1.00 72.41 H new ATOM 0 HE22 GLN A 77 8.185 5.754 9.602 1.00 72.41 H new ATOM 822 N LEU A 78 7.659 4.280 4.916 1.00 4.40 N ATOM 823 CA LEU A 78 6.325 3.695 4.834 1.00 3.30 C ATOM 824 C LEU A 78 6.280 2.341 5.533 1.00 20.20 C ATOM 825 O LEU A 78 5.371 2.065 6.316 1.00 24.25 O ATOM 826 CB LEU A 78 5.904 3.541 3.371 1.00 21.33 C ATOM 827 CG LEU A 78 5.875 4.825 2.542 1.00 72.55 C ATOM 828 CD1 LEU A 78 5.269 4.562 1.171 1.00 21.41 C ATOM 829 CD2 LEU A 78 5.096 5.911 3.270 1.00 15.53 C ATOM 0 H LEU A 78 8.048 4.571 4.019 1.00 4.40 H new ATOM 0 HA LEU A 78 5.629 4.366 5.338 1.00 3.30 H new ATOM 0 HB2 LEU A 78 6.584 2.837 2.890 1.00 21.33 H new ATOM 0 HB3 LEU A 78 4.911 3.093 3.345 1.00 21.33 H new ATOM 0 HG LEU A 78 6.900 5.169 2.404 1.00 72.55 H new ATOM 0 HD11 LEU A 78 5.257 5.487 0.595 1.00 21.41 H new ATOM 0 HD12 LEU A 78 5.866 3.816 0.646 1.00 21.41 H new ATOM 0 HD13 LEU A 78 4.250 4.194 1.288 1.00 21.41 H new ATOM 0 HD21 LEU A 78 5.085 6.818 2.666 1.00 15.53 H new ATOM 0 HD22 LEU A 78 4.073 5.575 3.438 1.00 15.53 H new ATOM 0 HD23 LEU A 78 5.571 6.119 4.229 1.00 15.53 H new ATOM 840 N ALA A 79 7.269 1.499 5.248 1.00 32.11 N ATOM 841 CA ALA A 79 7.344 0.175 5.853 1.00 13.22 C ATOM 842 C ALA A 79 7.370 0.268 7.374 1.00 34.41 C ATOM 843 O ALA A 79 6.918 -0.643 8.069 1.00 42.10 O ATOM 844 CB ALA A 79 8.573 -0.566 5.347 1.00 60.21 C ATOM 0 H ALA A 79 8.029 1.711 4.602 1.00 32.11 H new ATOM 0 HA ALA A 79 6.452 -0.381 5.564 1.00 13.22 H new ATOM 0 HB1 ALA A 79 8.617 -1.553 5.806 1.00 60.21 H new ATOM 0 HB2 ALA A 79 8.514 -0.672 4.264 1.00 60.21 H new ATOM 0 HB3 ALA A 79 9.470 -0.004 5.608 1.00 60.21 H new ATOM 850 N ILE A 80 7.901 1.373 7.887 1.00 43.22 N ATOM 851 CA ILE A 80 7.984 1.583 9.327 1.00 15.30 C ATOM 852 C ILE A 80 6.628 1.973 9.904 1.00 73.44 C ATOM 853 O ILE A 80 6.145 1.354 10.853 1.00 4.32 O ATOM 854 CB ILE A 80 9.012 2.676 9.677 1.00 20.41 C ATOM 855 CG1 ILE A 80 10.401 2.281 9.174 1.00 42.43 C ATOM 856 CG2 ILE A 80 9.036 2.918 11.180 1.00 0.32 C ATOM 857 CD1 ILE A 80 11.273 3.463 8.815 1.00 0.14 C ATOM 0 H ILE A 80 8.280 2.136 7.327 1.00 43.22 H new ATOM 0 HA ILE A 80 8.305 0.639 9.767 1.00 15.30 H new ATOM 0 HB ILE A 80 8.718 3.602 9.183 1.00 20.41 H new ATOM 0 HG12 ILE A 80 10.902 1.690 9.941 1.00 42.43 H new ATOM 0 HG13 ILE A 80 10.293 1.641 8.299 1.00 42.43 H new ATOM 0 HG21 ILE A 80 9.767 3.693 11.412 1.00 0.32 H new ATOM 0 HG22 ILE A 80 8.049 3.239 11.513 1.00 0.32 H new ATOM 0 HG23 ILE A 80 9.309 1.996 11.693 1.00 0.32 H new ATOM 0 HD11 ILE A 80 12.243 3.107 8.466 1.00 0.14 H new ATOM 0 HD12 ILE A 80 10.794 4.042 8.026 1.00 0.14 H new ATOM 0 HD13 ILE A 80 11.412 4.093 9.694 1.00 0.14 H new ATOM 868 N ILE A 81 6.017 3.002 9.326 1.00 0.04 N ATOM 869 CA ILE A 81 4.716 3.472 9.782 1.00 54.23 C ATOM 870 C ILE A 81 3.628 2.443 9.494 1.00 64.43 C ATOM 871 O ILE A 81 2.533 2.509 10.051 1.00 64.45 O ATOM 872 CB ILE A 81 4.333 4.806 9.114 1.00 42.32 C ATOM 873 CG1 ILE A 81 4.447 4.691 7.593 1.00 4.43 C ATOM 874 CG2 ILE A 81 5.216 5.931 9.634 1.00 41.45 C ATOM 875 CD1 ILE A 81 3.955 5.916 6.855 1.00 34.04 C ATOM 0 H ILE A 81 6.403 3.526 8.541 1.00 0.04 H new ATOM 0 HA ILE A 81 4.795 3.623 10.859 1.00 54.23 H new ATOM 0 HB ILE A 81 3.298 5.037 9.365 1.00 42.32 H new ATOM 0 HG12 ILE A 81 5.489 4.511 7.328 1.00 4.43 H new ATOM 0 HG13 ILE A 81 3.879 3.823 7.259 1.00 4.43 H new ATOM 0 HG21 ILE A 81 4.933 6.867 9.153 1.00 41.45 H new ATOM 0 HG22 ILE A 81 5.089 6.024 10.713 1.00 41.45 H new ATOM 0 HG23 ILE A 81 6.259 5.708 9.410 1.00 41.45 H new ATOM 0 HD11 ILE A 81 4.066 5.763 5.782 1.00 34.04 H new ATOM 0 HD12 ILE A 81 2.904 6.085 7.091 1.00 34.04 H new ATOM 0 HD13 ILE A 81 4.540 6.784 7.160 1.00 34.04 H new ATOM 886 N GLY A 82 3.939 1.488 8.622 1.00 32.11 N ATOM 887 CA GLY A 82 2.980 0.456 8.277 1.00 55.25 C ATOM 888 C GLY A 82 3.404 -0.916 8.761 1.00 65.34 C ATOM 889 O GLY A 82 2.700 -1.903 8.546 1.00 11.13 O ATOM 0 H GLY A 82 4.839 1.411 8.148 1.00 32.11 H new ATOM 0 HA2 GLY A 82 2.011 0.706 8.708 1.00 55.25 H new ATOM 0 HA3 GLY A 82 2.851 0.432 7.195 1.00 55.25 H new ATOM 893 N ASP A 83 4.558 -0.980 9.414 1.00 4.44 N ATOM 894 CA ASP A 83 5.078 -2.243 9.929 1.00 53.23 C ATOM 895 C ASP A 83 4.117 -2.849 10.947 1.00 40.23 C ATOM 896 O ASP A 83 3.415 -3.818 10.653 1.00 14.32 O ATOM 897 CB ASP A 83 6.451 -2.031 10.567 1.00 63.33 C ATOM 898 CG ASP A 83 7.557 -2.738 9.808 1.00 34.20 C ATOM 899 OD1 ASP A 83 7.373 -3.922 9.456 1.00 73.32 O ATOM 900 OD2 ASP A 83 8.607 -2.105 9.566 1.00 63.23 O ATOM 0 H ASP A 83 5.153 -0.172 9.600 1.00 4.44 H new ATOM 0 HA ASP A 83 5.179 -2.936 9.093 1.00 53.23 H new ATOM 0 HB2 ASP A 83 6.668 -0.964 10.609 1.00 63.33 H new ATOM 0 HB3 ASP A 83 6.431 -2.393 11.595 1.00 63.33 H new ATOM 904 N ASP A 84 4.092 -2.276 12.144 1.00 34.35 N ATOM 905 CA ASP A 84 3.218 -2.760 13.207 1.00 11.24 C ATOM 906 C ASP A 84 1.761 -2.754 12.756 1.00 60.12 C ATOM 907 O ASP A 84 1.006 -3.682 13.049 1.00 1.22 O ATOM 908 CB ASP A 84 3.380 -1.901 14.461 1.00 11.32 C ATOM 909 CG ASP A 84 4.786 -1.960 15.026 1.00 74.35 C ATOM 910 OD1 ASP A 84 5.708 -1.425 14.378 1.00 35.25 O ATOM 911 OD2 ASP A 84 4.963 -2.543 16.117 1.00 43.43 O ATOM 0 H ASP A 84 4.667 -1.475 12.404 1.00 34.35 H new ATOM 0 HA ASP A 84 3.504 -3.786 13.440 1.00 11.24 H new ATOM 0 HB2 ASP A 84 3.130 -0.867 14.224 1.00 11.32 H new ATOM 0 HB3 ASP A 84 2.672 -2.234 15.220 1.00 11.32 H new ATOM 915 N ILE A 85 1.371 -1.702 12.042 1.00 21.24 N ATOM 916 CA ILE A 85 0.005 -1.576 11.552 1.00 23.40 C ATOM 917 C ILE A 85 -0.434 -2.839 10.817 1.00 4.02 C ATOM 918 O ILE A 85 -1.469 -3.425 11.132 1.00 33.22 O ATOM 919 CB ILE A 85 -0.145 -0.368 10.609 1.00 42.25 C ATOM 920 CG1 ILE A 85 0.258 0.920 11.327 1.00 0.32 C ATOM 921 CG2 ILE A 85 -1.575 -0.271 10.097 1.00 42.52 C ATOM 922 CD1 ILE A 85 -0.798 1.438 12.279 1.00 25.12 C ATOM 0 H ILE A 85 1.983 -0.925 11.791 1.00 21.24 H new ATOM 0 HA ILE A 85 -0.631 -1.427 12.424 1.00 23.40 H new ATOM 0 HB ILE A 85 0.518 -0.507 9.755 1.00 42.25 H new ATOM 0 HG12 ILE A 85 1.180 0.744 11.881 1.00 0.32 H new ATOM 0 HG13 ILE A 85 0.474 1.688 10.584 1.00 0.32 H new ATOM 0 HG21 ILE A 85 -1.666 0.588 9.432 1.00 42.52 H new ATOM 0 HG22 ILE A 85 -1.829 -1.180 9.553 1.00 42.52 H new ATOM 0 HG23 ILE A 85 -2.256 -0.151 10.940 1.00 42.52 H new ATOM 0 HD11 ILE A 85 -0.443 2.354 12.752 1.00 25.12 H new ATOM 0 HD12 ILE A 85 -1.715 1.646 11.727 1.00 25.12 H new ATOM 0 HD13 ILE A 85 -0.998 0.688 13.044 1.00 25.12 H new ATOM 933 N ASN A 86 0.362 -3.253 9.838 1.00 43.50 N ATOM 934 CA ASN A 86 0.057 -4.448 9.057 1.00 21.53 C ATOM 935 C ASN A 86 0.184 -5.704 9.914 1.00 71.24 C ATOM 936 O ASN A 86 -0.741 -6.514 9.987 1.00 15.21 O ATOM 937 CB ASN A 86 0.990 -4.545 7.849 1.00 41.23 C ATOM 938 CG ASN A 86 0.899 -3.329 6.949 1.00 54.43 C ATOM 939 OD1 ASN A 86 -0.077 -2.579 6.995 1.00 70.11 O ATOM 940 ND2 ASN A 86 1.919 -3.126 6.123 1.00 32.44 N ATOM 0 H ASN A 86 1.223 -2.780 9.565 1.00 43.50 H new ATOM 0 HA ASN A 86 -0.972 -4.370 8.707 1.00 21.53 H new ATOM 0 HB2 ASN A 86 2.017 -4.661 8.195 1.00 41.23 H new ATOM 0 HB3 ASN A 86 0.744 -5.438 7.274 1.00 41.23 H new ATOM 0 HD21 ASN A 86 1.914 -2.323 5.494 1.00 32.44 H new ATOM 0 HD22 ASN A 86 2.708 -3.773 6.118 1.00 32.44 H new ATOM 946 N ARG A 87 1.333 -5.858 10.563 1.00 11.34 N ATOM 947 CA ARG A 87 1.582 -7.015 11.414 1.00 43.42 C ATOM 948 C ARG A 87 0.442 -7.212 12.408 1.00 73.34 C ATOM 949 O ARG A 87 0.197 -8.326 12.874 1.00 73.33 O ATOM 950 CB ARG A 87 2.904 -6.848 12.164 1.00 24.54 C ATOM 951 CG ARG A 87 4.128 -6.909 11.264 1.00 53.32 C ATOM 952 CD ARG A 87 5.384 -7.246 12.051 1.00 74.51 C ATOM 953 NE ARG A 87 6.174 -6.057 12.356 1.00 12.32 N ATOM 954 CZ ARG A 87 5.969 -5.291 13.422 1.00 32.15 C ATOM 955 NH1 ARG A 87 5.004 -5.589 14.280 1.00 32.22 N ATOM 956 NH2 ARG A 87 6.731 -4.224 13.630 1.00 23.24 N ATOM 0 H ARG A 87 2.107 -5.195 10.516 1.00 11.34 H new ATOM 0 HA ARG A 87 1.643 -7.897 10.777 1.00 43.42 H new ATOM 0 HB2 ARG A 87 2.896 -5.892 12.688 1.00 24.54 H new ATOM 0 HB3 ARG A 87 2.982 -7.627 12.923 1.00 24.54 H new ATOM 0 HG2 ARG A 87 3.973 -7.658 10.487 1.00 53.32 H new ATOM 0 HG3 ARG A 87 4.259 -5.951 10.761 1.00 53.32 H new ATOM 0 HD2 ARG A 87 5.107 -7.745 12.980 1.00 74.51 H new ATOM 0 HD3 ARG A 87 5.992 -7.948 11.481 1.00 74.51 H new ATOM 0 HE ARG A 87 6.925 -5.800 11.715 1.00 12.32 H new ATOM 0 HH11 ARG A 87 4.417 -6.408 14.123 1.00 32.22 H new ATOM 0 HH12 ARG A 87 4.849 -4.999 15.098 1.00 32.22 H new ATOM 0 HH21 ARG A 87 7.474 -3.992 12.971 1.00 23.24 H new ATOM 0 HH22 ARG A 87 6.573 -3.636 14.449 1.00 23.24 H new ATOM 967 N ARG A 88 -0.251 -6.125 12.731 1.00 15.32 N ATOM 968 CA ARG A 88 -1.363 -6.177 13.671 1.00 25.20 C ATOM 969 C ARG A 88 -2.662 -6.538 12.957 1.00 62.13 C ATOM 970 O ARG A 88 -3.311 -7.531 13.289 1.00 32.24 O ATOM 971 CB ARG A 88 -1.518 -4.835 14.387 1.00 72.04 C ATOM 972 CG ARG A 88 -0.760 -4.754 15.702 1.00 62.21 C ATOM 973 CD ARG A 88 -0.472 -3.314 16.092 1.00 32.02 C ATOM 974 NE ARG A 88 -0.629 -3.093 17.527 1.00 11.15 N ATOM 975 CZ ARG A 88 0.295 -3.417 18.425 1.00 62.11 C ATOM 976 NH1 ARG A 88 1.434 -3.974 18.038 1.00 23.11 N ATOM 977 NH2 ARG A 88 0.080 -3.185 19.714 1.00 63.24 N ATOM 0 H ARG A 88 -0.061 -5.196 12.354 1.00 15.32 H new ATOM 0 HA ARG A 88 -1.146 -6.950 14.408 1.00 25.20 H new ATOM 0 HB2 ARG A 88 -1.171 -4.039 13.728 1.00 72.04 H new ATOM 0 HB3 ARG A 88 -2.576 -4.654 14.576 1.00 72.04 H new ATOM 0 HG2 ARG A 88 -1.341 -5.236 16.488 1.00 62.21 H new ATOM 0 HG3 ARG A 88 0.178 -5.303 15.617 1.00 62.21 H new ATOM 0 HD2 ARG A 88 0.544 -3.054 15.794 1.00 32.02 H new ATOM 0 HD3 ARG A 88 -1.143 -2.650 15.548 1.00 32.02 H new ATOM 0 HE ARG A 88 -1.495 -2.667 17.858 1.00 11.15 H new ATOM 0 HH11 ARG A 88 1.603 -4.155 17.048 1.00 23.11 H new ATOM 0 HH12 ARG A 88 2.142 -4.222 18.730 1.00 23.11 H new ATOM 0 HH21 ARG A 88 -0.795 -2.758 20.016 1.00 63.24 H new ATOM 0 HH22 ARG A 88 0.790 -3.434 20.402 1.00 63.24 H new ATOM 988 N TYR A 89 -3.036 -5.726 11.975 1.00 51.43 N ATOM 989 CA TYR A 89 -4.259 -5.958 11.216 1.00 3.40 C ATOM 990 C TYR A 89 -3.998 -6.883 10.030 1.00 12.32 C ATOM 991 O TYR A 89 -4.574 -7.966 9.936 1.00 4.22 O ATOM 992 CB TYR A 89 -4.838 -4.630 10.723 1.00 2.11 C ATOM 993 CG TYR A 89 -5.307 -3.723 11.837 1.00 70.34 C ATOM 994 CD1 TYR A 89 -4.399 -3.016 12.614 1.00 71.32 C ATOM 995 CD2 TYR A 89 -6.661 -3.575 12.113 1.00 55.21 C ATOM 996 CE1 TYR A 89 -4.824 -2.187 13.634 1.00 63.34 C ATOM 997 CE2 TYR A 89 -7.096 -2.747 13.131 1.00 14.10 C ATOM 998 CZ TYR A 89 -6.173 -2.056 13.888 1.00 71.35 C ATOM 999 OH TYR A 89 -6.602 -1.230 14.903 1.00 31.12 O ATOM 0 H TYR A 89 -2.510 -4.901 11.686 1.00 51.43 H new ATOM 0 HA TYR A 89 -4.980 -6.439 11.877 1.00 3.40 H new ATOM 0 HB2 TYR A 89 -4.081 -4.109 10.136 1.00 2.11 H new ATOM 0 HB3 TYR A 89 -5.675 -4.834 10.055 1.00 2.11 H new ATOM 0 HD1 TYR A 89 -3.342 -3.116 12.417 1.00 71.32 H new ATOM 0 HD2 TYR A 89 -7.386 -4.116 11.522 1.00 55.21 H new ATOM 0 HE1 TYR A 89 -4.104 -1.645 14.229 1.00 63.34 H new ATOM 0 HE2 TYR A 89 -8.152 -2.642 13.332 1.00 14.10 H new ATOM 0 HH TYR A 89 -7.581 -1.249 14.949 1.00 31.12 H new ATOM 1008 N ASP A 90 -3.126 -6.445 9.128 1.00 24.34 N ATOM 1009 CA ASP A 90 -2.785 -7.233 7.949 1.00 30.44 C ATOM 1010 C ASP A 90 -2.508 -8.684 8.328 1.00 44.05 C ATOM 1011 O ASP A 90 -2.710 -9.595 7.524 1.00 73.03 O ATOM 1012 CB ASP A 90 -1.566 -6.635 7.245 1.00 64.15 C ATOM 1013 CG ASP A 90 -1.470 -7.063 5.793 1.00 31.14 C ATOM 1014 OD1 ASP A 90 -2.431 -7.682 5.292 1.00 42.32 O ATOM 1015 OD2 ASP A 90 -0.433 -6.776 5.159 1.00 33.30 O ATOM 0 H ASP A 90 -2.643 -5.549 9.191 1.00 24.34 H new ATOM 0 HA ASP A 90 -3.636 -7.210 7.268 1.00 30.44 H new ATOM 0 HB2 ASP A 90 -1.616 -5.547 7.298 1.00 64.15 H new ATOM 0 HB3 ASP A 90 -0.661 -6.938 7.771 1.00 64.15 H new ATOM 1019 N SER A 91 -2.044 -8.893 9.555 1.00 63.41 N ATOM 1020 CA SER A 91 -1.734 -10.234 10.039 1.00 42.31 C ATOM 1021 C SER A 91 -2.924 -11.169 9.847 1.00 42.55 C ATOM 1022 O SER A 91 -2.799 -12.233 9.240 1.00 75.43 O ATOM 1023 CB SER A 91 -1.340 -10.189 11.516 1.00 53.31 C ATOM 1024 OG SER A 91 -1.878 -11.293 12.221 1.00 25.31 O ATOM 0 H SER A 91 -1.874 -8.151 10.233 1.00 63.41 H new ATOM 0 HA SER A 91 -0.895 -10.617 9.459 1.00 42.31 H new ATOM 0 HB2 SER A 91 -0.254 -10.190 11.606 1.00 53.31 H new ATOM 0 HB3 SER A 91 -1.696 -9.260 11.962 1.00 53.31 H new ATOM 0 HG SER A 91 -1.611 -11.242 13.162 1.00 25.31 H new ATOM 1029 N GLU A 92 -4.079 -10.763 10.367 1.00 11.14 N ATOM 1030 CA GLU A 92 -5.291 -11.564 10.254 1.00 21.05 C ATOM 1031 C GLU A 92 -5.894 -11.445 8.858 1.00 53.51 C ATOM 1032 O GLU A 92 -6.599 -12.342 8.394 1.00 32.22 O ATOM 1033 CB GLU A 92 -6.317 -11.129 11.303 1.00 34.12 C ATOM 1034 CG GLU A 92 -5.774 -11.131 12.722 1.00 34.21 C ATOM 1035 CD GLU A 92 -5.562 -12.530 13.264 1.00 62.11 C ATOM 1036 OE1 GLU A 92 -6.549 -13.146 13.718 1.00 64.11 O ATOM 1037 OE2 GLU A 92 -4.410 -13.011 13.234 1.00 21.12 O ATOM 0 H GLU A 92 -4.200 -9.884 10.870 1.00 11.14 H new ATOM 0 HA GLU A 92 -5.024 -12.606 10.428 1.00 21.05 H new ATOM 0 HB2 GLU A 92 -6.671 -10.127 11.060 1.00 34.12 H new ATOM 0 HB3 GLU A 92 -7.180 -11.793 11.252 1.00 34.12 H new ATOM 0 HG2 GLU A 92 -4.828 -10.589 12.746 1.00 34.21 H new ATOM 0 HG3 GLU A 92 -6.465 -10.595 13.372 1.00 34.21 H new ATOM 1042 N PHE A 93 -5.611 -10.331 8.191 1.00 75.05 N ATOM 1043 CA PHE A 93 -6.126 -10.091 6.848 1.00 45.31 C ATOM 1044 C PHE A 93 -5.835 -11.280 5.935 1.00 11.24 C ATOM 1045 O PHE A 93 -6.693 -11.705 5.161 1.00 12.43 O ATOM 1046 CB PHE A 93 -5.510 -8.820 6.261 1.00 43.32 C ATOM 1047 CG PHE A 93 -6.338 -8.200 5.172 1.00 41.22 C ATOM 1048 CD1 PHE A 93 -7.612 -7.724 5.439 1.00 44.31 C ATOM 1049 CD2 PHE A 93 -5.843 -8.092 3.882 1.00 23.33 C ATOM 1050 CE1 PHE A 93 -8.376 -7.154 4.438 1.00 20.10 C ATOM 1051 CE2 PHE A 93 -6.603 -7.522 2.878 1.00 23.20 C ATOM 1052 CZ PHE A 93 -7.870 -7.052 3.157 1.00 73.25 C ATOM 0 H PHE A 93 -5.027 -9.580 8.559 1.00 75.05 H new ATOM 0 HA PHE A 93 -7.206 -9.963 6.917 1.00 45.31 H new ATOM 0 HB2 PHE A 93 -5.370 -8.091 7.060 1.00 43.32 H new ATOM 0 HB3 PHE A 93 -4.521 -9.054 5.866 1.00 43.32 H new ATOM 0 HD1 PHE A 93 -8.012 -7.799 6.439 1.00 44.31 H new ATOM 0 HD2 PHE A 93 -4.852 -8.458 3.659 1.00 23.33 H new ATOM 0 HE1 PHE A 93 -9.368 -6.789 4.658 1.00 20.10 H new ATOM 0 HE2 PHE A 93 -6.206 -7.445 1.877 1.00 23.20 H new ATOM 0 HZ PHE A 93 -8.465 -6.605 2.375 1.00 73.25 H new ATOM 1061 N GLN A 94 -4.619 -11.809 6.031 1.00 54.43 N ATOM 1062 CA GLN A 94 -4.215 -12.946 5.213 1.00 14.54 C ATOM 1063 C GLN A 94 -5.056 -14.175 5.537 1.00 24.05 C ATOM 1064 O GLN A 94 -5.301 -15.019 4.674 1.00 2.34 O ATOM 1065 CB GLN A 94 -2.732 -13.255 5.430 1.00 31.32 C ATOM 1066 CG GLN A 94 -2.435 -13.893 6.777 1.00 74.33 C ATOM 1067 CD GLN A 94 -1.112 -13.436 7.361 1.00 62.12 C ATOM 1068 OE1 GLN A 94 -0.808 -12.244 7.380 1.00 34.20 O ATOM 1069 NE2 GLN A 94 -0.317 -14.385 7.840 1.00 71.42 N ATOM 0 H GLN A 94 -3.897 -11.469 6.667 1.00 54.43 H new ATOM 0 HA GLN A 94 -4.375 -12.685 4.167 1.00 14.54 H new ATOM 0 HB2 GLN A 94 -2.388 -13.921 4.638 1.00 31.32 H new ATOM 0 HB3 GLN A 94 -2.160 -12.331 5.341 1.00 31.32 H new ATOM 0 HG2 GLN A 94 -3.238 -13.652 7.474 1.00 74.33 H new ATOM 0 HG3 GLN A 94 -2.424 -14.977 6.666 1.00 74.33 H new ATOM 0 HE21 GLN A 94 -0.609 -15.362 7.804 1.00 71.42 H new ATOM 0 HE22 GLN A 94 0.586 -14.138 8.244 1.00 71.42 H new ATOM 1076 N THR A 95 -5.496 -14.273 6.787 1.00 72.52 N ATOM 1077 CA THR A 95 -6.308 -15.400 7.226 1.00 42.21 C ATOM 1078 C THR A 95 -7.578 -15.522 6.391 1.00 32.10 C ATOM 1079 O THR A 95 -7.849 -16.569 5.804 1.00 0.24 O ATOM 1080 CB THR A 95 -6.695 -15.271 8.711 1.00 35.40 C ATOM 1081 OG1 THR A 95 -5.548 -14.906 9.486 1.00 11.14 O ATOM 1082 CG2 THR A 95 -7.274 -16.575 9.237 1.00 45.52 C ATOM 0 H THR A 95 -5.303 -13.584 7.514 1.00 72.52 H new ATOM 0 HA THR A 95 -5.701 -16.296 7.093 1.00 42.21 H new ATOM 0 HB THR A 95 -7.455 -14.495 8.798 1.00 35.40 H new ATOM 0 HG1 THR A 95 -5.803 -14.824 10.429 1.00 11.14 H new ATOM 0 HG21 THR A 95 -7.539 -16.458 10.288 1.00 45.52 H new ATOM 0 HG22 THR A 95 -8.165 -16.835 8.665 1.00 45.52 H new ATOM 0 HG23 THR A 95 -6.534 -17.369 9.136 1.00 45.52 H new ATOM 1090 N MET A 96 -8.353 -14.443 6.342 1.00 65.33 N ATOM 1091 CA MET A 96 -9.594 -14.429 5.577 1.00 44.34 C ATOM 1092 C MET A 96 -9.308 -14.362 4.080 1.00 51.25 C ATOM 1093 O MET A 96 -10.086 -14.862 3.266 1.00 5.22 O ATOM 1094 CB MET A 96 -10.464 -13.242 5.996 1.00 44.34 C ATOM 1095 CG MET A 96 -9.746 -11.905 5.916 1.00 10.35 C ATOM 1096 SD MET A 96 -10.840 -10.557 5.427 1.00 31.13 S ATOM 1097 CE MET A 96 -11.356 -11.111 3.804 1.00 21.25 C ATOM 0 H MET A 96 -8.143 -13.568 6.823 1.00 65.33 H new ATOM 0 HA MET A 96 -10.131 -15.354 5.786 1.00 44.34 H new ATOM 0 HB2 MET A 96 -11.349 -13.209 5.361 1.00 44.34 H new ATOM 0 HB3 MET A 96 -10.811 -13.399 7.018 1.00 44.34 H new ATOM 0 HG2 MET A 96 -9.304 -11.676 6.886 1.00 10.35 H new ATOM 0 HG3 MET A 96 -8.926 -11.980 5.202 1.00 10.35 H new ATOM 0 HE1 MET A 96 -10.882 -10.494 3.041 1.00 21.25 H new ATOM 0 HE2 MET A 96 -11.062 -12.151 3.664 1.00 21.25 H new ATOM 0 HE3 MET A 96 -12.439 -11.026 3.718 1.00 21.25 H new ATOM 1105 N LEU A 97 -8.191 -13.740 3.723 1.00 0.32 N ATOM 1106 CA LEU A 97 -7.802 -13.607 2.322 1.00 33.23 C ATOM 1107 C LEU A 97 -7.591 -14.975 1.683 1.00 64.52 C ATOM 1108 O LEU A 97 -7.948 -15.191 0.526 1.00 23.31 O ATOM 1109 CB LEU A 97 -6.525 -12.773 2.204 1.00 31.13 C ATOM 1110 CG LEU A 97 -6.699 -11.351 1.667 1.00 25.23 C ATOM 1111 CD1 LEU A 97 -6.856 -11.369 0.155 1.00 54.51 C ATOM 1112 CD2 LEU A 97 -7.894 -10.676 2.323 1.00 10.30 C ATOM 0 H LEU A 97 -7.538 -13.319 4.384 1.00 0.32 H new ATOM 0 HA LEU A 97 -8.609 -13.101 1.793 1.00 33.23 H new ATOM 0 HB2 LEU A 97 -6.061 -12.714 3.189 1.00 31.13 H new ATOM 0 HB3 LEU A 97 -5.828 -13.302 1.555 1.00 31.13 H new ATOM 0 HG LEU A 97 -5.805 -10.777 1.912 1.00 25.23 H new ATOM 0 HD11 LEU A 97 -6.979 -10.349 -0.210 1.00 54.51 H new ATOM 0 HD12 LEU A 97 -5.969 -11.812 -0.298 1.00 54.51 H new ATOM 0 HD13 LEU A 97 -7.733 -11.958 -0.113 1.00 54.51 H new ATOM 0 HD21 LEU A 97 -8.003 -9.665 1.929 1.00 10.30 H new ATOM 0 HD22 LEU A 97 -8.797 -11.248 2.110 1.00 10.30 H new ATOM 0 HD23 LEU A 97 -7.740 -10.631 3.401 1.00 10.30 H new ATOM 1123 N GLN A 98 -7.010 -15.896 2.446 1.00 72.44 N ATOM 1124 CA GLN A 98 -6.753 -17.244 1.955 1.00 40.55 C ATOM 1125 C GLN A 98 -8.059 -17.958 1.616 1.00 14.24 C ATOM 1126 O GLN A 98 -8.086 -18.858 0.776 1.00 1.12 O ATOM 1127 CB GLN A 98 -5.973 -18.049 2.995 1.00 64.32 C ATOM 1128 CG GLN A 98 -4.829 -18.858 2.406 1.00 12.25 C ATOM 1129 CD GLN A 98 -3.755 -19.178 3.426 1.00 24.32 C ATOM 1130 OE1 GLN A 98 -4.046 -19.402 4.601 1.00 21.21 O ATOM 1131 NE2 GLN A 98 -2.503 -19.202 2.982 1.00 54.44 N ATOM 0 H GLN A 98 -6.709 -15.733 3.407 1.00 72.44 H new ATOM 0 HA GLN A 98 -6.157 -17.165 1.046 1.00 40.55 H new ATOM 0 HB2 GLN A 98 -5.575 -17.367 3.746 1.00 64.32 H new ATOM 0 HB3 GLN A 98 -6.658 -18.724 3.508 1.00 64.32 H new ATOM 0 HG2 GLN A 98 -5.221 -19.787 1.993 1.00 12.25 H new ATOM 0 HG3 GLN A 98 -4.385 -18.304 1.579 1.00 12.25 H new ATOM 0 HE21 GLN A 98 -2.307 -19.010 2.000 1.00 54.44 H new ATOM 0 HE22 GLN A 98 -1.738 -19.412 3.623 1.00 54.44 H new ATOM 1138 N HIS A 99 -9.139 -17.550 2.275 1.00 12.34 N ATOM 1139 CA HIS A 99 -10.448 -18.151 2.042 1.00 22.44 C ATOM 1140 C HIS A 99 -10.975 -17.785 0.659 1.00 51.42 C ATOM 1141 O HIS A 99 -11.448 -18.646 -0.084 1.00 72.25 O ATOM 1142 CB HIS A 99 -11.438 -17.697 3.116 1.00 10.44 C ATOM 1143 CG HIS A 99 -11.028 -18.074 4.506 1.00 34.31 C ATOM 1144 ND1 HIS A 99 -11.800 -17.807 5.617 1.00 61.24 N ATOM 1145 CD2 HIS A 99 -9.920 -18.704 4.963 1.00 35.24 C ATOM 1146 CE1 HIS A 99 -11.185 -18.254 6.696 1.00 33.22 C ATOM 1147 NE2 HIS A 99 -10.041 -18.803 6.328 1.00 55.15 N ATOM 0 H HIS A 99 -9.134 -16.807 2.974 1.00 12.34 H new ATOM 0 HA HIS A 99 -10.339 -19.234 2.094 1.00 22.44 H new ATOM 0 HB2 HIS A 99 -11.551 -16.614 3.060 1.00 10.44 H new ATOM 0 HB3 HIS A 99 -12.415 -18.130 2.904 1.00 10.44 H new ATOM 0 HD2 HIS A 99 -9.095 -19.062 4.366 1.00 35.24 H new ATOM 0 HE1 HIS A 99 -11.554 -18.183 7.708 1.00 33.22 H new ATOM 0 HE2 HIS A 99 -9.359 -19.230 6.955 1.00 55.15 H new ATOM 1154 N LEU A 100 -10.893 -16.504 0.320 1.00 12.42 N ATOM 1155 CA LEU A 100 -11.363 -16.023 -0.975 1.00 71.02 C ATOM 1156 C LEU A 100 -10.788 -16.864 -2.110 1.00 34.13 C ATOM 1157 O LEU A 100 -11.494 -17.214 -3.056 1.00 74.20 O ATOM 1158 CB LEU A 100 -10.977 -14.555 -1.167 1.00 70.23 C ATOM 1159 CG LEU A 100 -11.405 -13.916 -2.490 1.00 21.54 C ATOM 1160 CD1 LEU A 100 -12.477 -12.863 -2.251 1.00 44.11 C ATOM 1161 CD2 LEU A 100 -10.205 -13.308 -3.200 1.00 55.21 C ATOM 0 H LEU A 100 -10.505 -15.779 0.924 1.00 12.42 H new ATOM 0 HA LEU A 100 -12.449 -16.113 -0.995 1.00 71.02 H new ATOM 0 HB2 LEU A 100 -11.409 -13.977 -0.350 1.00 70.23 H new ATOM 0 HB3 LEU A 100 -9.894 -14.470 -1.079 1.00 70.23 H new ATOM 0 HG LEU A 100 -11.824 -14.693 -3.129 1.00 21.54 H new ATOM 0 HD11 LEU A 100 -12.769 -12.419 -3.203 1.00 44.11 H new ATOM 0 HD12 LEU A 100 -13.346 -13.328 -1.785 1.00 44.11 H new ATOM 0 HD13 LEU A 100 -12.085 -12.087 -1.594 1.00 44.11 H new ATOM 0 HD21 LEU A 100 -10.527 -12.858 -4.139 1.00 55.21 H new ATOM 0 HD22 LEU A 100 -9.756 -12.543 -2.566 1.00 55.21 H new ATOM 0 HD23 LEU A 100 -9.470 -14.087 -3.404 1.00 55.21 H new ATOM 1172 N GLN A 101 -9.503 -17.187 -2.007 1.00 50.00 N ATOM 1173 CA GLN A 101 -8.833 -17.989 -3.025 1.00 62.33 C ATOM 1174 C GLN A 101 -8.863 -17.287 -4.379 1.00 34.11 C ATOM 1175 O GLN A 101 -9.444 -17.778 -5.347 1.00 0.34 O ATOM 1176 CB GLN A 101 -9.494 -19.364 -3.136 1.00 65.12 C ATOM 1177 CG GLN A 101 -9.542 -20.124 -1.820 1.00 40.24 C ATOM 1178 CD GLN A 101 -8.467 -21.188 -1.721 1.00 32.14 C ATOM 1179 OE1 GLN A 101 -8.568 -22.249 -2.336 1.00 44.12 O ATOM 1180 NE2 GLN A 101 -7.427 -20.908 -0.943 1.00 62.44 N ATOM 0 H GLN A 101 -8.905 -16.906 -1.230 1.00 50.00 H new ATOM 0 HA GLN A 101 -7.793 -18.116 -2.725 1.00 62.33 H new ATOM 0 HB2 GLN A 101 -10.510 -19.240 -3.512 1.00 65.12 H new ATOM 0 HB3 GLN A 101 -8.953 -19.960 -3.871 1.00 65.12 H new ATOM 0 HG2 GLN A 101 -9.429 -19.421 -0.995 1.00 40.24 H new ATOM 0 HG3 GLN A 101 -10.521 -20.591 -1.710 1.00 40.24 H new ATOM 0 HE21 GLN A 101 -7.384 -20.016 -0.451 1.00 62.44 H new ATOM 0 HE22 GLN A 101 -6.672 -21.586 -0.838 1.00 62.44 H new ATOM 1187 N PRO A 102 -8.224 -16.110 -4.449 1.00 53.35 N ATOM 1188 CA PRO A 102 -8.164 -15.314 -5.679 1.00 31.51 C ATOM 1189 C PRO A 102 -7.290 -15.964 -6.746 1.00 14.21 C ATOM 1190 O PRO A 102 -6.640 -16.980 -6.498 1.00 64.04 O ATOM 1191 CB PRO A 102 -7.548 -13.992 -5.216 1.00 54.31 C ATOM 1192 CG PRO A 102 -6.763 -14.344 -4.000 1.00 11.54 C ATOM 1193 CD PRO A 102 -7.512 -15.464 -3.334 1.00 32.14 C ATOM 0 HA PRO A 102 -9.145 -15.204 -6.142 1.00 31.51 H new ATOM 0 HB2 PRO A 102 -6.910 -13.561 -5.988 1.00 54.31 H new ATOM 0 HB3 PRO A 102 -8.318 -13.254 -4.990 1.00 54.31 H new ATOM 0 HG2 PRO A 102 -5.752 -14.654 -4.264 1.00 11.54 H new ATOM 0 HG3 PRO A 102 -6.670 -13.486 -3.334 1.00 11.54 H new ATOM 0 HD2 PRO A 102 -6.836 -16.157 -2.834 1.00 32.14 H new ATOM 0 HD3 PRO A 102 -8.203 -15.091 -2.578 1.00 32.14 H new ATOM 1198 N THR A 103 -7.277 -15.370 -7.936 1.00 40.04 N ATOM 1199 CA THR A 103 -6.483 -15.891 -9.042 1.00 61.10 C ATOM 1200 C THR A 103 -5.813 -14.763 -9.817 1.00 55.12 C ATOM 1201 O THR A 103 -6.016 -13.586 -9.519 1.00 41.22 O ATOM 1202 CB THR A 103 -7.346 -16.723 -10.009 1.00 41.32 C ATOM 1203 OG1 THR A 103 -8.455 -15.944 -10.469 1.00 51.45 O ATOM 1204 CG2 THR A 103 -7.853 -17.987 -9.333 1.00 73.42 C ATOM 0 H THR A 103 -7.808 -14.528 -8.158 1.00 40.04 H new ATOM 0 HA THR A 103 -5.717 -16.533 -8.607 1.00 61.10 H new ATOM 0 HB THR A 103 -6.726 -17.009 -10.859 1.00 41.32 H new ATOM 0 HG1 THR A 103 -9.199 -16.539 -10.699 1.00 51.45 H new ATOM 0 HG21 THR A 103 -8.460 -18.557 -10.036 1.00 73.42 H new ATOM 0 HG22 THR A 103 -7.006 -18.592 -9.011 1.00 73.42 H new ATOM 0 HG23 THR A 103 -8.458 -17.719 -8.467 1.00 73.42 H new ATOM 1212 N ALA A 104 -5.015 -15.129 -10.814 1.00 2.23 N ATOM 1213 CA ALA A 104 -4.317 -14.147 -11.635 1.00 34.11 C ATOM 1214 C ALA A 104 -5.265 -13.495 -12.636 1.00 34.51 C ATOM 1215 O ALA A 104 -5.164 -12.300 -12.912 1.00 41.54 O ATOM 1216 CB ALA A 104 -3.148 -14.799 -12.360 1.00 60.15 C ATOM 0 H ALA A 104 -4.835 -16.099 -11.073 1.00 2.23 H new ATOM 0 HA ALA A 104 -3.933 -13.368 -10.977 1.00 34.11 H new ATOM 0 HB1 ALA A 104 -2.636 -14.054 -12.969 1.00 60.15 H new ATOM 0 HB2 ALA A 104 -2.451 -15.211 -11.630 1.00 60.15 H new ATOM 0 HB3 ALA A 104 -3.518 -15.599 -13.001 1.00 60.15 H new ATOM 1222 N GLU A 105 -6.186 -14.288 -13.175 1.00 24.33 N ATOM 1223 CA GLU A 105 -7.151 -13.786 -14.147 1.00 31.00 C ATOM 1224 C GLU A 105 -8.123 -12.808 -13.493 1.00 30.53 C ATOM 1225 O GLU A 105 -8.460 -11.774 -14.068 1.00 30.12 O ATOM 1226 CB GLU A 105 -7.924 -14.946 -14.776 1.00 43.12 C ATOM 1227 CG GLU A 105 -8.640 -15.823 -13.762 1.00 2.42 C ATOM 1228 CD GLU A 105 -8.712 -17.275 -14.193 1.00 3.22 C ATOM 1229 OE1 GLU A 105 -7.665 -17.831 -14.586 1.00 3.34 O ATOM 1230 OE2 GLU A 105 -9.816 -17.855 -14.138 1.00 24.13 O ATOM 0 H GLU A 105 -6.284 -15.279 -12.956 1.00 24.33 H new ATOM 0 HA GLU A 105 -6.602 -13.259 -14.927 1.00 31.00 H new ATOM 0 HB2 GLU A 105 -8.656 -14.546 -15.478 1.00 43.12 H new ATOM 0 HB3 GLU A 105 -7.233 -15.562 -15.352 1.00 43.12 H new ATOM 0 HG2 GLU A 105 -8.125 -15.758 -12.803 1.00 2.42 H new ATOM 0 HG3 GLU A 105 -9.650 -15.443 -13.608 1.00 2.42 H new ATOM 1235 N ASN A 106 -8.570 -13.144 -12.288 1.00 65.32 N ATOM 1236 CA ASN A 106 -9.505 -12.297 -11.555 1.00 21.22 C ATOM 1237 C ASN A 106 -8.775 -11.462 -10.507 1.00 2.23 C ATOM 1238 O ASN A 106 -9.401 -10.810 -9.673 1.00 1.03 O ATOM 1239 CB ASN A 106 -10.581 -13.151 -10.883 1.00 44.13 C ATOM 1240 CG ASN A 106 -11.361 -13.987 -11.879 1.00 3.21 C ATOM 1241 OD1 ASN A 106 -11.868 -13.472 -12.876 1.00 45.03 O ATOM 1242 ND2 ASN A 106 -11.461 -15.285 -11.612 1.00 53.23 N ATOM 0 H ASN A 106 -8.300 -13.997 -11.798 1.00 65.32 H new ATOM 0 HA ASN A 106 -9.979 -11.622 -12.267 1.00 21.22 H new ATOM 0 HB2 ASN A 106 -10.114 -13.807 -10.149 1.00 44.13 H new ATOM 0 HB3 ASN A 106 -11.269 -12.503 -10.340 1.00 44.13 H new ATOM 0 HD21 ASN A 106 -11.974 -15.898 -12.246 1.00 53.23 H new ATOM 0 HD22 ASN A 106 -11.025 -15.668 -10.774 1.00 53.23 H new ATOM 1248 N ALA A 107 -7.447 -11.486 -10.558 1.00 41.41 N ATOM 1249 CA ALA A 107 -6.632 -10.729 -9.617 1.00 64.12 C ATOM 1250 C ALA A 107 -7.111 -9.286 -9.512 1.00 43.04 C ATOM 1251 O ALA A 107 -7.375 -8.786 -8.418 1.00 5.43 O ATOM 1252 CB ALA A 107 -5.169 -10.774 -10.031 1.00 31.23 C ATOM 0 H ALA A 107 -6.913 -12.022 -11.242 1.00 41.41 H new ATOM 0 HA ALA A 107 -6.734 -11.189 -8.634 1.00 64.12 H new ATOM 0 HB1 ALA A 107 -4.572 -10.204 -9.319 1.00 31.23 H new ATOM 0 HB2 ALA A 107 -4.827 -11.809 -10.046 1.00 31.23 H new ATOM 0 HB3 ALA A 107 -5.059 -10.341 -11.025 1.00 31.23 H new ATOM 1258 N TYR A 108 -7.221 -8.620 -10.656 1.00 52.30 N ATOM 1259 CA TYR A 108 -7.666 -7.232 -10.694 1.00 30.24 C ATOM 1260 C TYR A 108 -9.150 -7.126 -10.355 1.00 2.31 C ATOM 1261 O TYR A 108 -9.581 -6.182 -9.694 1.00 52.22 O ATOM 1262 CB TYR A 108 -7.401 -6.626 -12.073 1.00 43.01 C ATOM 1263 CG TYR A 108 -8.181 -7.290 -13.185 1.00 54.21 C ATOM 1264 CD1 TYR A 108 -7.664 -8.385 -13.866 1.00 12.32 C ATOM 1265 CD2 TYR A 108 -9.435 -6.821 -13.556 1.00 55.42 C ATOM 1266 CE1 TYR A 108 -8.372 -8.993 -14.884 1.00 20.32 C ATOM 1267 CE2 TYR A 108 -10.152 -7.424 -14.572 1.00 64.22 C ATOM 1268 CZ TYR A 108 -9.616 -8.510 -15.233 1.00 32.53 C ATOM 1269 OH TYR A 108 -10.326 -9.113 -16.246 1.00 21.21 O ATOM 0 H TYR A 108 -7.008 -9.019 -11.570 1.00 52.30 H new ATOM 0 HA TYR A 108 -7.101 -6.676 -9.946 1.00 30.24 H new ATOM 0 HB2 TYR A 108 -7.650 -5.565 -12.049 1.00 43.01 H new ATOM 0 HB3 TYR A 108 -6.336 -6.698 -12.294 1.00 43.01 H new ATOM 0 HD1 TYR A 108 -6.691 -8.768 -13.594 1.00 12.32 H new ATOM 0 HD2 TYR A 108 -9.857 -5.970 -13.041 1.00 55.42 H new ATOM 0 HE1 TYR A 108 -7.954 -9.842 -15.404 1.00 20.32 H new ATOM 0 HE2 TYR A 108 -11.126 -7.047 -14.847 1.00 64.22 H new ATOM 0 HH TYR A 108 -11.182 -8.651 -16.365 1.00 21.21 H new ATOM 1278 N GLU A 109 -9.926 -8.104 -10.813 1.00 50.33 N ATOM 1279 CA GLU A 109 -11.362 -8.121 -10.560 1.00 73.11 C ATOM 1280 C GLU A 109 -11.652 -7.977 -9.069 1.00 64.35 C ATOM 1281 O GLU A 109 -12.537 -7.221 -8.667 1.00 42.32 O ATOM 1282 CB GLU A 109 -11.980 -9.416 -11.090 1.00 60.02 C ATOM 1283 CG GLU A 109 -13.449 -9.579 -10.735 1.00 12.22 C ATOM 1284 CD GLU A 109 -14.329 -8.541 -11.402 1.00 54.30 C ATOM 1285 OE1 GLU A 109 -13.859 -7.890 -12.359 1.00 14.43 O ATOM 1286 OE2 GLU A 109 -15.488 -8.379 -10.968 1.00 51.55 O ATOM 0 H GLU A 109 -9.584 -8.894 -11.361 1.00 50.33 H new ATOM 0 HA GLU A 109 -11.808 -7.275 -11.082 1.00 73.11 H new ATOM 0 HB2 GLU A 109 -11.872 -9.443 -12.174 1.00 60.02 H new ATOM 0 HB3 GLU A 109 -11.422 -10.264 -10.693 1.00 60.02 H new ATOM 0 HG2 GLU A 109 -13.782 -10.575 -11.029 1.00 12.22 H new ATOM 0 HG3 GLU A 109 -13.567 -9.510 -9.654 1.00 12.22 H new ATOM 1291 N TYR A 110 -10.903 -8.710 -8.253 1.00 51.24 N ATOM 1292 CA TYR A 110 -11.081 -8.667 -6.806 1.00 42.31 C ATOM 1293 C TYR A 110 -10.318 -7.496 -6.198 1.00 22.14 C ATOM 1294 O TYR A 110 -10.854 -6.746 -5.382 1.00 63.35 O ATOM 1295 CB TYR A 110 -10.613 -9.979 -6.176 1.00 64.54 C ATOM 1296 CG TYR A 110 -11.160 -11.210 -6.863 1.00 25.33 C ATOM 1297 CD1 TYR A 110 -12.481 -11.263 -7.290 1.00 23.10 C ATOM 1298 CD2 TYR A 110 -10.356 -12.322 -7.083 1.00 44.32 C ATOM 1299 CE1 TYR A 110 -12.985 -12.386 -7.917 1.00 44.44 C ATOM 1300 CE2 TYR A 110 -10.851 -13.449 -7.712 1.00 31.25 C ATOM 1301 CZ TYR A 110 -12.165 -13.475 -8.126 1.00 44.14 C ATOM 1302 OH TYR A 110 -12.663 -14.596 -8.751 1.00 62.54 O ATOM 0 H TYR A 110 -10.167 -9.341 -8.569 1.00 51.24 H new ATOM 0 HA TYR A 110 -12.142 -8.531 -6.599 1.00 42.31 H new ATOM 0 HB2 TYR A 110 -9.524 -10.015 -6.198 1.00 64.54 H new ATOM 0 HB3 TYR A 110 -10.911 -9.996 -5.128 1.00 64.54 H new ATOM 0 HD1 TYR A 110 -13.125 -10.411 -7.129 1.00 23.10 H new ATOM 0 HD2 TYR A 110 -9.327 -12.305 -6.757 1.00 44.32 H new ATOM 0 HE1 TYR A 110 -14.015 -12.411 -8.242 1.00 44.44 H new ATOM 0 HE2 TYR A 110 -10.212 -14.304 -7.878 1.00 31.25 H new ATOM 0 HH TYR A 110 -11.957 -15.272 -8.822 1.00 62.54 H new ATOM 1311 N PHE A 111 -9.060 -7.345 -6.601 1.00 32.33 N ATOM 1312 CA PHE A 111 -8.220 -6.265 -6.095 1.00 61.22 C ATOM 1313 C PHE A 111 -8.922 -4.918 -6.235 1.00 41.34 C ATOM 1314 O PHE A 111 -9.047 -4.164 -5.270 1.00 30.15 O ATOM 1315 CB PHE A 111 -6.885 -6.237 -6.841 1.00 31.11 C ATOM 1316 CG PHE A 111 -6.108 -4.968 -6.633 1.00 43.13 C ATOM 1317 CD1 PHE A 111 -5.488 -4.711 -5.421 1.00 31.02 C ATOM 1318 CD2 PHE A 111 -5.997 -4.033 -7.650 1.00 61.34 C ATOM 1319 CE1 PHE A 111 -4.774 -3.544 -5.227 1.00 2.10 C ATOM 1320 CE2 PHE A 111 -5.285 -2.865 -7.462 1.00 20.25 C ATOM 1321 CZ PHE A 111 -4.671 -2.620 -6.249 1.00 4.31 C ATOM 0 H PHE A 111 -8.600 -7.956 -7.276 1.00 32.33 H new ATOM 0 HA PHE A 111 -8.034 -6.449 -5.037 1.00 61.22 H new ATOM 0 HB2 PHE A 111 -6.279 -7.082 -6.516 1.00 31.11 H new ATOM 0 HB3 PHE A 111 -7.071 -6.369 -7.907 1.00 31.11 H new ATOM 0 HD1 PHE A 111 -5.564 -5.431 -4.619 1.00 31.02 H new ATOM 0 HD2 PHE A 111 -6.473 -4.220 -8.601 1.00 61.34 H new ATOM 0 HE1 PHE A 111 -4.297 -3.354 -4.277 1.00 2.10 H new ATOM 0 HE2 PHE A 111 -5.208 -2.144 -8.262 1.00 20.25 H new ATOM 0 HZ PHE A 111 -4.112 -1.708 -6.100 1.00 4.31 H new ATOM 1330 N THR A 112 -9.381 -4.620 -7.448 1.00 73.31 N ATOM 1331 CA THR A 112 -10.070 -3.364 -7.717 1.00 63.52 C ATOM 1332 C THR A 112 -11.164 -3.104 -6.687 1.00 25.10 C ATOM 1333 O THR A 112 -11.362 -1.972 -6.247 1.00 4.23 O ATOM 1334 CB THR A 112 -10.694 -3.356 -9.125 1.00 71.12 C ATOM 1335 OG1 THR A 112 -11.521 -4.512 -9.301 1.00 11.22 O ATOM 1336 CG2 THR A 112 -9.613 -3.333 -10.196 1.00 73.10 C ATOM 0 H THR A 112 -9.288 -5.232 -8.259 1.00 73.31 H new ATOM 0 HA THR A 112 -9.322 -2.574 -7.655 1.00 63.52 H new ATOM 0 HB THR A 112 -11.301 -2.456 -9.224 1.00 71.12 H new ATOM 0 HG1 THR A 112 -10.993 -5.234 -9.701 1.00 11.22 H new ATOM 0 HG21 THR A 112 -10.078 -3.328 -11.182 1.00 73.10 H new ATOM 0 HG22 THR A 112 -9.003 -2.438 -10.078 1.00 73.10 H new ATOM 0 HG23 THR A 112 -8.983 -4.217 -10.096 1.00 73.10 H new ATOM 1344 N LYS A 113 -11.873 -4.161 -6.305 1.00 4.32 N ATOM 1345 CA LYS A 113 -12.947 -4.049 -5.325 1.00 43.01 C ATOM 1346 C LYS A 113 -12.394 -3.674 -3.954 1.00 72.44 C ATOM 1347 O LYS A 113 -12.911 -2.773 -3.292 1.00 54.31 O ATOM 1348 CB LYS A 113 -13.719 -5.368 -5.232 1.00 75.22 C ATOM 1349 CG LYS A 113 -14.814 -5.357 -4.179 1.00 65.13 C ATOM 1350 CD LYS A 113 -14.324 -5.924 -2.858 1.00 30.15 C ATOM 1351 CE LYS A 113 -15.337 -5.702 -1.746 1.00 30.35 C ATOM 1352 NZ LYS A 113 -15.743 -4.272 -1.642 1.00 4.10 N ATOM 0 H LYS A 113 -11.723 -5.106 -6.660 1.00 4.32 H new ATOM 0 HA LYS A 113 -13.625 -3.260 -5.653 1.00 43.01 H new ATOM 0 HB2 LYS A 113 -14.162 -5.590 -6.203 1.00 75.22 H new ATOM 0 HB3 LYS A 113 -13.020 -6.174 -5.009 1.00 75.22 H new ATOM 0 HG2 LYS A 113 -15.166 -4.336 -4.029 1.00 65.13 H new ATOM 0 HG3 LYS A 113 -15.665 -5.939 -4.532 1.00 65.13 H new ATOM 0 HD2 LYS A 113 -14.131 -6.991 -2.968 1.00 30.15 H new ATOM 0 HD3 LYS A 113 -13.378 -5.455 -2.588 1.00 30.15 H new ATOM 0 HE2 LYS A 113 -16.218 -6.317 -1.929 1.00 30.35 H new ATOM 0 HE3 LYS A 113 -14.912 -6.029 -0.797 1.00 30.35 H new ATOM 0 HZ1 LYS A 113 -15.808 -4.002 -0.640 1.00 4.10 H new ATOM 0 HZ2 LYS A 113 -15.036 -3.675 -2.116 1.00 4.10 H new ATOM 0 HZ3 LYS A 113 -16.669 -4.140 -2.097 1.00 4.10 H new ATOM 1362 N ILE A 114 -11.342 -4.368 -3.534 1.00 51.34 N ATOM 1363 CA ILE A 114 -10.720 -4.105 -2.243 1.00 14.52 C ATOM 1364 C ILE A 114 -10.317 -2.640 -2.116 1.00 13.35 C ATOM 1365 O ILE A 114 -10.689 -1.964 -1.157 1.00 31.11 O ATOM 1366 CB ILE A 114 -9.476 -4.987 -2.027 1.00 22.22 C ATOM 1367 CG1 ILE A 114 -9.743 -6.412 -2.518 1.00 54.14 C ATOM 1368 CG2 ILE A 114 -9.079 -4.993 -0.558 1.00 65.54 C ATOM 1369 CD1 ILE A 114 -11.107 -6.939 -2.129 1.00 42.34 C ATOM 0 H ILE A 114 -10.903 -5.117 -4.069 1.00 51.34 H new ATOM 0 HA ILE A 114 -11.462 -4.344 -1.481 1.00 14.52 H new ATOM 0 HB ILE A 114 -8.650 -4.572 -2.605 1.00 22.22 H new ATOM 0 HG12 ILE A 114 -9.649 -6.437 -3.604 1.00 54.14 H new ATOM 0 HG13 ILE A 114 -8.978 -7.076 -2.116 1.00 54.14 H new ATOM 0 HG21 ILE A 114 -8.198 -5.621 -0.422 1.00 65.54 H new ATOM 0 HG22 ILE A 114 -8.853 -3.976 -0.238 1.00 65.54 H new ATOM 0 HG23 ILE A 114 -9.901 -5.387 0.039 1.00 65.54 H new ATOM 0 HD11 ILE A 114 -11.227 -7.953 -2.510 1.00 42.34 H new ATOM 0 HD12 ILE A 114 -11.198 -6.946 -1.043 1.00 42.34 H new ATOM 0 HD13 ILE A 114 -11.879 -6.298 -2.554 1.00 42.34 H new ATOM 1380 N ALA A 115 -9.556 -2.154 -3.091 1.00 14.53 N ATOM 1381 CA ALA A 115 -9.106 -0.767 -3.090 1.00 22.02 C ATOM 1382 C ALA A 115 -10.288 0.194 -3.049 1.00 45.54 C ATOM 1383 O ALA A 115 -10.392 1.031 -2.152 1.00 43.44 O ATOM 1384 CB ALA A 115 -8.241 -0.492 -4.312 1.00 3.01 C ATOM 0 H ALA A 115 -9.238 -2.700 -3.892 1.00 14.53 H new ATOM 0 HA ALA A 115 -8.509 -0.605 -2.192 1.00 22.02 H new ATOM 0 HB1 ALA A 115 -7.912 0.547 -4.299 1.00 3.01 H new ATOM 0 HB2 ALA A 115 -7.371 -1.148 -4.297 1.00 3.01 H new ATOM 0 HB3 ALA A 115 -8.820 -0.678 -5.217 1.00 3.01 H new ATOM 1390 N THR A 116 -11.180 0.069 -4.029 1.00 75.23 N ATOM 1391 CA THR A 116 -12.355 0.928 -4.105 1.00 4.23 C ATOM 1392 C THR A 116 -13.089 0.977 -2.771 1.00 3.12 C ATOM 1393 O THR A 116 -13.638 2.011 -2.391 1.00 42.12 O ATOM 1394 CB THR A 116 -13.330 0.449 -5.197 1.00 45.35 C ATOM 1395 OG1 THR A 116 -12.630 0.263 -6.433 1.00 72.13 O ATOM 1396 CG2 THR A 116 -14.458 1.451 -5.393 1.00 50.11 C ATOM 0 H THR A 116 -11.110 -0.618 -4.779 1.00 75.23 H new ATOM 0 HA THR A 116 -12.000 1.927 -4.357 1.00 4.23 H new ATOM 0 HB THR A 116 -13.760 -0.500 -4.877 1.00 45.35 H new ATOM 0 HG1 THR A 116 -12.332 -0.668 -6.503 1.00 72.13 H new ATOM 0 HG21 THR A 116 -15.134 1.091 -6.169 1.00 50.11 H new ATOM 0 HG22 THR A 116 -15.007 1.568 -4.459 1.00 50.11 H new ATOM 0 HG23 THR A 116 -14.042 2.413 -5.692 1.00 50.11 H new ATOM 1404 N SER A 117 -13.094 -0.148 -2.061 1.00 55.51 N ATOM 1405 CA SER A 117 -13.764 -0.233 -0.769 1.00 13.24 C ATOM 1406 C SER A 117 -12.970 0.506 0.304 1.00 44.23 C ATOM 1407 O SER A 117 -13.544 1.125 1.202 1.00 45.51 O ATOM 1408 CB SER A 117 -13.951 -1.696 -0.364 1.00 65.11 C ATOM 1409 OG SER A 117 -12.842 -2.164 0.384 1.00 1.01 O ATOM 0 H SER A 117 -12.642 -1.012 -2.359 1.00 55.51 H new ATOM 0 HA SER A 117 -14.742 0.239 -0.862 1.00 13.24 H new ATOM 0 HB2 SER A 117 -14.861 -1.800 0.226 1.00 65.11 H new ATOM 0 HB3 SER A 117 -14.077 -2.310 -1.256 1.00 65.11 H new ATOM 0 HG SER A 117 -12.109 -2.391 -0.225 1.00 1.01 H new ATOM 1414 N LEU A 118 -11.647 0.438 0.205 1.00 21.02 N ATOM 1415 CA LEU A 118 -10.772 1.100 1.166 1.00 31.21 C ATOM 1416 C LEU A 118 -10.793 2.613 0.970 1.00 44.32 C ATOM 1417 O LEU A 118 -10.968 3.371 1.924 1.00 61.24 O ATOM 1418 CB LEU A 118 -9.342 0.576 1.030 1.00 43.21 C ATOM 1419 CG LEU A 118 -8.359 1.017 2.115 1.00 40.24 C ATOM 1420 CD1 LEU A 118 -8.918 0.714 3.496 1.00 20.32 C ATOM 1421 CD2 LEU A 118 -7.011 0.336 1.923 1.00 50.53 C ATOM 0 H LEU A 118 -11.156 -0.069 -0.532 1.00 21.02 H new ATOM 0 HA LEU A 118 -11.140 0.877 2.168 1.00 31.21 H new ATOM 0 HB2 LEU A 118 -9.375 -0.513 1.019 1.00 43.21 H new ATOM 0 HB3 LEU A 118 -8.951 0.893 0.063 1.00 43.21 H new ATOM 0 HG LEU A 118 -8.215 2.094 2.031 1.00 40.24 H new ATOM 0 HD11 LEU A 118 -8.205 1.035 4.256 1.00 20.32 H new ATOM 0 HD12 LEU A 118 -9.859 1.248 3.633 1.00 20.32 H new ATOM 0 HD13 LEU A 118 -9.092 -0.358 3.591 1.00 20.32 H new ATOM 0 HD21 LEU A 118 -6.324 0.662 2.704 1.00 50.53 H new ATOM 0 HD22 LEU A 118 -7.138 -0.745 1.979 1.00 50.53 H new ATOM 0 HD23 LEU A 118 -6.604 0.603 0.948 1.00 50.53 H new ATOM 1432 N PHE A 119 -10.616 3.044 -0.274 1.00 52.24 N ATOM 1433 CA PHE A 119 -10.616 4.467 -0.597 1.00 70.00 C ATOM 1434 C PHE A 119 -12.017 4.940 -0.974 1.00 65.04 C ATOM 1435 O PHE A 119 -12.180 5.969 -1.627 1.00 74.13 O ATOM 1436 CB PHE A 119 -9.643 4.751 -1.743 1.00 12.02 C ATOM 1437 CG PHE A 119 -8.237 4.305 -1.461 1.00 51.32 C ATOM 1438 CD1 PHE A 119 -7.854 2.992 -1.686 1.00 14.10 C ATOM 1439 CD2 PHE A 119 -7.298 5.198 -0.972 1.00 15.22 C ATOM 1440 CE1 PHE A 119 -6.561 2.579 -1.425 1.00 42.32 C ATOM 1441 CE2 PHE A 119 -6.003 4.791 -0.711 1.00 74.11 C ATOM 1442 CZ PHE A 119 -5.635 3.480 -0.939 1.00 11.42 C ATOM 0 H PHE A 119 -10.471 2.429 -1.075 1.00 52.24 H new ATOM 0 HA PHE A 119 -10.294 5.015 0.288 1.00 70.00 H new ATOM 0 HB2 PHE A 119 -10.000 4.252 -2.644 1.00 12.02 H new ATOM 0 HB3 PHE A 119 -9.641 5.821 -1.951 1.00 12.02 H new ATOM 0 HD1 PHE A 119 -8.574 2.284 -2.069 1.00 14.10 H new ATOM 0 HD2 PHE A 119 -7.581 6.225 -0.792 1.00 15.22 H new ATOM 0 HE1 PHE A 119 -6.275 1.552 -1.601 1.00 42.32 H new ATOM 0 HE2 PHE A 119 -5.280 5.497 -0.329 1.00 74.11 H new ATOM 0 HZ PHE A 119 -4.624 3.160 -0.737 1.00 11.42 H new ATOM 1451 N GLU A 120 -13.024 4.177 -0.559 1.00 15.42 N ATOM 1452 CA GLU A 120 -14.410 4.517 -0.855 1.00 55.53 C ATOM 1453 C GLU A 120 -14.833 5.779 -0.109 1.00 21.42 C ATOM 1454 O GLU A 120 -15.385 6.707 -0.699 1.00 12.04 O ATOM 1455 CB GLU A 120 -15.335 3.356 -0.480 1.00 1.41 C ATOM 1456 CG GLU A 120 -16.268 2.935 -1.602 1.00 72.15 C ATOM 1457 CD GLU A 120 -17.482 3.838 -1.722 1.00 0.05 C ATOM 1458 OE1 GLU A 120 -17.318 5.069 -1.592 1.00 12.02 O ATOM 1459 OE2 GLU A 120 -18.592 3.314 -1.945 1.00 51.43 O ATOM 0 H GLU A 120 -12.905 3.321 -0.018 1.00 15.42 H new ATOM 0 HA GLU A 120 -14.490 4.705 -1.926 1.00 55.53 H new ATOM 0 HB2 GLU A 120 -14.728 2.501 -0.183 1.00 1.41 H new ATOM 0 HB3 GLU A 120 -15.930 3.642 0.388 1.00 1.41 H new ATOM 0 HG2 GLU A 120 -15.721 2.940 -2.545 1.00 72.15 H new ATOM 0 HG3 GLU A 120 -16.598 1.910 -1.430 1.00 72.15 H new ATOM 1464 N SER A 121 -14.569 5.806 1.194 1.00 24.35 N ATOM 1465 CA SER A 121 -14.925 6.951 2.024 1.00 41.44 C ATOM 1466 C SER A 121 -14.072 8.165 1.668 1.00 63.13 C ATOM 1467 O SER A 121 -14.582 9.175 1.183 1.00 24.03 O ATOM 1468 CB SER A 121 -14.752 6.608 3.504 1.00 35.23 C ATOM 1469 OG SER A 121 -15.987 6.236 4.090 1.00 74.12 O ATOM 0 H SER A 121 -14.109 5.047 1.698 1.00 24.35 H new ATOM 0 HA SER A 121 -15.970 7.195 1.835 1.00 41.44 H new ATOM 0 HB2 SER A 121 -14.036 5.793 3.610 1.00 35.23 H new ATOM 0 HB3 SER A 121 -14.339 7.467 4.033 1.00 35.23 H new ATOM 0 HG SER A 121 -15.848 6.020 5.036 1.00 74.12 H new ATOM 1474 N GLY A 122 -12.770 8.058 1.911 1.00 32.31 N ATOM 1475 CA GLY A 122 -11.867 9.154 1.611 1.00 24.21 C ATOM 1476 C GLY A 122 -10.433 8.692 1.436 1.00 44.05 C ATOM 1477 O GLY A 122 -10.125 7.516 1.634 1.00 2.30 O ATOM 0 H GLY A 122 -12.324 7.232 2.310 1.00 32.31 H new ATOM 0 HA2 GLY A 122 -12.198 9.655 0.701 1.00 24.21 H new ATOM 0 HA3 GLY A 122 -11.913 9.889 2.414 1.00 24.21 H new ATOM 1481 N ILE A 123 -9.557 9.617 1.062 1.00 12.31 N ATOM 1482 CA ILE A 123 -8.150 9.299 0.859 1.00 25.44 C ATOM 1483 C ILE A 123 -7.303 9.777 2.034 1.00 21.05 C ATOM 1484 O ILE A 123 -7.694 10.685 2.765 1.00 74.35 O ATOM 1485 CB ILE A 123 -7.610 9.929 -0.438 1.00 51.30 C ATOM 1486 CG1 ILE A 123 -8.639 9.792 -1.563 1.00 11.45 C ATOM 1487 CG2 ILE A 123 -6.293 9.280 -0.835 1.00 0.31 C ATOM 1488 CD1 ILE A 123 -8.193 10.414 -2.868 1.00 22.31 C ATOM 0 H ILE A 123 -9.797 10.594 0.893 1.00 12.31 H new ATOM 0 HA ILE A 123 -8.081 8.214 0.781 1.00 25.44 H new ATOM 0 HB ILE A 123 -7.430 10.990 -0.262 1.00 51.30 H new ATOM 0 HG12 ILE A 123 -8.848 8.735 -1.726 1.00 11.45 H new ATOM 0 HG13 ILE A 123 -9.573 10.257 -1.249 1.00 11.45 H new ATOM 0 HG21 ILE A 123 -5.925 9.737 -1.754 1.00 0.31 H new ATOM 0 HG22 ILE A 123 -5.562 9.424 -0.040 1.00 0.31 H new ATOM 0 HG23 ILE A 123 -6.447 8.213 -0.997 1.00 0.31 H new ATOM 0 HD11 ILE A 123 -8.971 10.279 -3.620 1.00 22.31 H new ATOM 0 HD12 ILE A 123 -8.011 11.479 -2.720 1.00 22.31 H new ATOM 0 HD13 ILE A 123 -7.275 9.933 -3.206 1.00 22.31 H new ATOM 1499 N ASN A 124 -6.138 9.160 2.207 1.00 21.35 N ATOM 1500 CA ASN A 124 -5.234 9.524 3.293 1.00 5.20 C ATOM 1501 C ASN A 124 -3.929 8.739 3.199 1.00 11.22 C ATOM 1502 O ASN A 124 -3.895 7.633 2.660 1.00 60.41 O ATOM 1503 CB ASN A 124 -5.900 9.267 4.645 1.00 34.51 C ATOM 1504 CG ASN A 124 -4.911 8.807 5.699 1.00 3.35 C ATOM 1505 OD1 ASN A 124 -4.084 9.587 6.172 1.00 30.41 O ATOM 1506 ND2 ASN A 124 -4.991 7.535 6.071 1.00 11.42 N ATOM 0 H ASN A 124 -5.798 8.406 1.610 1.00 21.35 H new ATOM 0 HA ASN A 124 -5.006 10.586 3.204 1.00 5.20 H new ATOM 0 HB2 ASN A 124 -6.390 10.179 4.985 1.00 34.51 H new ATOM 0 HB3 ASN A 124 -6.677 8.512 4.526 1.00 34.51 H new ATOM 0 HD21 ASN A 124 -4.351 7.169 6.776 1.00 11.42 H new ATOM 0 HD22 ASN A 124 -5.692 6.924 5.652 1.00 11.42 H new ATOM 1512 N TRP A 125 -2.858 9.319 3.727 1.00 32.44 N ATOM 1513 CA TRP A 125 -1.550 8.674 3.704 1.00 11.45 C ATOM 1514 C TRP A 125 -1.640 7.242 4.216 1.00 22.11 C ATOM 1515 O TRP A 125 -1.204 6.305 3.548 1.00 52.51 O ATOM 1516 CB TRP A 125 -0.552 9.469 4.549 1.00 64.12 C ATOM 1517 CG TRP A 125 0.186 10.515 3.769 1.00 13.11 C ATOM 1518 CD1 TRP A 125 0.248 11.851 4.045 1.00 30.24 C ATOM 1519 CD2 TRP A 125 0.963 10.312 2.585 1.00 2.34 C ATOM 1520 NE1 TRP A 125 1.018 12.491 3.105 1.00 44.41 N ATOM 1521 CE2 TRP A 125 1.470 11.568 2.198 1.00 53.05 C ATOM 1522 CE3 TRP A 125 1.284 9.191 1.815 1.00 41.21 C ATOM 1523 CZ2 TRP A 125 2.276 11.732 1.074 1.00 62.31 C ATOM 1524 CZ3 TRP A 125 2.084 9.355 0.700 1.00 32.12 C ATOM 1525 CH2 TRP A 125 2.573 10.618 0.339 1.00 62.10 C ATOM 0 H TRP A 125 -2.869 10.235 4.176 1.00 32.44 H new ATOM 0 HA TRP A 125 -1.203 8.649 2.671 1.00 11.45 H new ATOM 0 HB2 TRP A 125 -1.083 9.947 5.372 1.00 64.12 H new ATOM 0 HB3 TRP A 125 0.168 8.781 4.992 1.00 64.12 H new ATOM 0 HD1 TRP A 125 -0.237 12.334 4.880 1.00 30.24 H new ATOM 0 HE1 TRP A 125 1.221 13.490 3.085 1.00 44.41 H new ATOM 0 HE3 TRP A 125 0.913 8.214 2.086 1.00 41.21 H new ATOM 0 HZ2 TRP A 125 2.653 12.704 0.793 1.00 62.31 H new ATOM 0 HZ3 TRP A 125 2.337 8.496 0.097 1.00 32.12 H new ATOM 0 HH2 TRP A 125 3.197 10.713 -0.537 1.00 62.10 H new ATOM 1535 N GLY A 126 -2.209 7.077 5.406 1.00 52.24 N ATOM 1536 CA GLY A 126 -2.346 5.754 5.986 1.00 74.33 C ATOM 1537 C GLY A 126 -3.000 4.769 5.037 1.00 21.23 C ATOM 1538 O GLY A 126 -2.608 3.603 4.975 1.00 52.51 O ATOM 0 H GLY A 126 -2.578 7.836 5.979 1.00 52.24 H new ATOM 0 HA2 GLY A 126 -1.362 5.381 6.270 1.00 74.33 H new ATOM 0 HA3 GLY A 126 -2.937 5.821 6.899 1.00 74.33 H new ATOM 1542 N ARG A 127 -3.999 5.237 4.297 1.00 32.12 N ATOM 1543 CA ARG A 127 -4.710 4.389 3.349 1.00 40.33 C ATOM 1544 C ARG A 127 -3.793 3.963 2.206 1.00 24.21 C ATOM 1545 O ARG A 127 -3.840 2.819 1.751 1.00 32.12 O ATOM 1546 CB ARG A 127 -5.930 5.123 2.790 1.00 52.25 C ATOM 1547 CG ARG A 127 -7.079 5.236 3.778 1.00 23.00 C ATOM 1548 CD ARG A 127 -8.157 6.182 3.274 1.00 44.15 C ATOM 1549 NE ARG A 127 -9.117 6.526 4.320 1.00 11.14 N ATOM 1550 CZ ARG A 127 -10.009 5.672 4.809 1.00 22.55 C ATOM 1551 NH1 ARG A 127 -10.063 4.429 4.350 1.00 54.01 N ATOM 1552 NH2 ARG A 127 -10.848 6.060 5.761 1.00 62.54 N ATOM 0 H ARG A 127 -4.334 6.199 4.336 1.00 32.12 H new ATOM 0 HA ARG A 127 -5.042 3.496 3.878 1.00 40.33 H new ATOM 0 HB2 ARG A 127 -5.630 6.124 2.479 1.00 52.25 H new ATOM 0 HB3 ARG A 127 -6.279 4.603 1.898 1.00 52.25 H new ATOM 0 HG2 ARG A 127 -7.510 4.250 3.950 1.00 23.00 H new ATOM 0 HG3 ARG A 127 -6.702 5.591 4.737 1.00 23.00 H new ATOM 0 HD2 ARG A 127 -7.692 7.092 2.895 1.00 44.15 H new ATOM 0 HD3 ARG A 127 -8.682 5.720 2.438 1.00 44.15 H new ATOM 0 HE ARG A 127 -9.101 7.474 4.695 1.00 11.14 H new ATOM 0 HH11 ARG A 127 -9.418 4.127 3.620 1.00 54.01 H new ATOM 0 HH12 ARG A 127 -10.749 3.775 4.727 1.00 54.01 H new ATOM 0 HH21 ARG A 127 -10.808 7.015 6.118 1.00 62.54 H new ATOM 0 HH22 ARG A 127 -11.533 5.404 6.136 1.00 62.54 H new ATOM 1563 N VAL A 128 -2.957 4.889 1.747 1.00 52.14 N ATOM 1564 CA VAL A 128 -2.028 4.611 0.658 1.00 64.54 C ATOM 1565 C VAL A 128 -1.029 3.529 1.053 1.00 32.14 C ATOM 1566 O VAL A 128 -0.861 2.535 0.347 1.00 43.43 O ATOM 1567 CB VAL A 128 -1.259 5.877 0.238 1.00 70.21 C ATOM 1568 CG1 VAL A 128 -0.203 5.539 -0.803 1.00 60.34 C ATOM 1569 CG2 VAL A 128 -2.219 6.933 -0.287 1.00 51.24 C ATOM 0 H VAL A 128 -2.904 5.840 2.113 1.00 52.14 H new ATOM 0 HA VAL A 128 -2.624 4.262 -0.186 1.00 64.54 H new ATOM 0 HB VAL A 128 -0.754 6.282 1.115 1.00 70.21 H new ATOM 0 HG11 VAL A 128 0.330 6.446 -1.088 1.00 60.34 H new ATOM 0 HG12 VAL A 128 0.502 4.819 -0.386 1.00 60.34 H new ATOM 0 HG13 VAL A 128 -0.683 5.109 -1.682 1.00 60.34 H new ATOM 0 HG21 VAL A 128 -1.659 7.821 -0.579 1.00 51.24 H new ATOM 0 HG22 VAL A 128 -2.754 6.541 -1.152 1.00 51.24 H new ATOM 0 HG23 VAL A 128 -2.933 7.195 0.493 1.00 51.24 H new ATOM 1579 N VAL A 129 -0.367 3.729 2.189 1.00 53.33 N ATOM 1580 CA VAL A 129 0.616 2.770 2.679 1.00 13.14 C ATOM 1581 C VAL A 129 -0.022 1.408 2.927 1.00 22.33 C ATOM 1582 O VAL A 129 0.549 0.373 2.585 1.00 40.43 O ATOM 1583 CB VAL A 129 1.276 3.261 3.982 1.00 65.42 C ATOM 1584 CG1 VAL A 129 2.180 4.452 3.707 1.00 11.41 C ATOM 1585 CG2 VAL A 129 0.217 3.612 5.016 1.00 24.31 C ATOM 0 H VAL A 129 -0.494 4.546 2.786 1.00 53.33 H new ATOM 0 HA VAL A 129 1.379 2.675 1.907 1.00 13.14 H new ATOM 0 HB VAL A 129 1.890 2.455 4.384 1.00 65.42 H new ATOM 0 HG11 VAL A 129 2.637 4.785 4.639 1.00 11.41 H new ATOM 0 HG12 VAL A 129 2.960 4.162 3.003 1.00 11.41 H new ATOM 0 HG13 VAL A 129 1.592 5.265 3.281 1.00 11.41 H new ATOM 0 HG21 VAL A 129 0.701 3.957 5.930 1.00 24.31 H new ATOM 0 HG22 VAL A 129 -0.425 4.401 4.625 1.00 24.31 H new ATOM 0 HG23 VAL A 129 -0.385 2.730 5.235 1.00 24.31 H new ATOM 1595 N ALA A 130 -1.208 1.416 3.525 1.00 71.22 N ATOM 1596 CA ALA A 130 -1.925 0.181 3.817 1.00 73.23 C ATOM 1597 C ALA A 130 -2.211 -0.602 2.540 1.00 61.22 C ATOM 1598 O ALA A 130 -2.079 -1.827 2.507 1.00 32.43 O ATOM 1599 CB ALA A 130 -3.221 0.484 4.553 1.00 73.24 C ATOM 0 H ALA A 130 -1.693 2.264 3.817 1.00 71.22 H new ATOM 0 HA ALA A 130 -1.292 -0.435 4.457 1.00 73.23 H new ATOM 0 HB1 ALA A 130 -3.746 -0.448 4.764 1.00 73.24 H new ATOM 0 HB2 ALA A 130 -2.997 0.995 5.489 1.00 73.24 H new ATOM 0 HB3 ALA A 130 -3.851 1.122 3.933 1.00 73.24 H new ATOM 1605 N LEU A 131 -2.604 0.109 1.490 1.00 74.15 N ATOM 1606 CA LEU A 131 -2.910 -0.519 0.210 1.00 61.21 C ATOM 1607 C LEU A 131 -1.768 -1.426 -0.237 1.00 43.43 C ATOM 1608 O LEU A 131 -1.991 -2.564 -0.653 1.00 3.41 O ATOM 1609 CB LEU A 131 -3.177 0.547 -0.854 1.00 10.12 C ATOM 1610 CG LEU A 131 -4.039 0.112 -2.038 1.00 40.52 C ATOM 1611 CD1 LEU A 131 -4.180 1.247 -3.042 1.00 0.34 C ATOM 1612 CD2 LEU A 131 -3.448 -1.122 -2.705 1.00 54.24 C ATOM 0 H LEU A 131 -2.718 1.123 1.500 1.00 74.15 H new ATOM 0 HA LEU A 131 -3.805 -1.128 0.337 1.00 61.21 H new ATOM 0 HB2 LEU A 131 -3.658 1.399 -0.373 1.00 10.12 H new ATOM 0 HB3 LEU A 131 -2.219 0.897 -1.237 1.00 10.12 H new ATOM 0 HG LEU A 131 -5.031 -0.142 -1.665 1.00 40.52 H new ATOM 0 HD11 LEU A 131 -4.797 0.918 -3.878 1.00 0.34 H new ATOM 0 HD12 LEU A 131 -4.650 2.104 -2.559 1.00 0.34 H new ATOM 0 HD13 LEU A 131 -3.194 1.533 -3.409 1.00 0.34 H new ATOM 0 HD21 LEU A 131 -4.076 -1.417 -3.546 1.00 54.24 H new ATOM 0 HD22 LEU A 131 -2.444 -0.896 -3.063 1.00 54.24 H new ATOM 0 HD23 LEU A 131 -3.401 -1.938 -1.984 1.00 54.24 H new ATOM 1623 N LEU A 132 -0.545 -0.917 -0.148 1.00 12.41 N ATOM 1624 CA LEU A 132 0.633 -1.681 -0.542 1.00 32.21 C ATOM 1625 C LEU A 132 0.878 -2.839 0.421 1.00 61.12 C ATOM 1626 O LEU A 132 1.170 -3.958 0.001 1.00 52.12 O ATOM 1627 CB LEU A 132 1.863 -0.773 -0.587 1.00 20.04 C ATOM 1628 CG LEU A 132 1.677 0.576 -1.283 1.00 10.31 C ATOM 1629 CD1 LEU A 132 3.025 1.190 -1.628 1.00 44.41 C ATOM 1630 CD2 LEU A 132 0.824 0.418 -2.533 1.00 64.44 C ATOM 0 H LEU A 132 -0.343 0.022 0.194 1.00 12.41 H new ATOM 0 HA LEU A 132 0.454 -2.090 -1.536 1.00 32.21 H new ATOM 0 HB2 LEU A 132 2.192 -0.589 0.436 1.00 20.04 H new ATOM 0 HB3 LEU A 132 2.668 -1.310 -1.089 1.00 20.04 H new ATOM 0 HG LEU A 132 1.160 1.248 -0.598 1.00 10.31 H new ATOM 0 HD11 LEU A 132 2.872 2.149 -2.123 1.00 44.41 H new ATOM 0 HD12 LEU A 132 3.601 1.340 -0.715 1.00 44.41 H new ATOM 0 HD13 LEU A 132 3.570 0.521 -2.294 1.00 44.41 H new ATOM 0 HD21 LEU A 132 0.702 1.388 -3.015 1.00 64.44 H new ATOM 0 HD22 LEU A 132 1.312 -0.271 -3.222 1.00 64.44 H new ATOM 0 HD23 LEU A 132 -0.154 0.024 -2.258 1.00 64.44 H new ATOM 1641 N GLY A 133 0.753 -2.563 1.715 1.00 35.32 N ATOM 1642 CA GLY A 133 0.961 -3.592 2.718 1.00 13.32 C ATOM 1643 C GLY A 133 0.186 -4.859 2.416 1.00 12.15 C ATOM 1644 O GLY A 133 0.756 -5.950 2.386 1.00 44.44 O ATOM 0 H GLY A 133 0.511 -1.645 2.087 1.00 35.32 H new ATOM 0 HA2 GLY A 133 2.024 -3.826 2.780 1.00 13.32 H new ATOM 0 HA3 GLY A 133 0.661 -3.210 3.694 1.00 13.32 H new ATOM 1648 N PHE A 134 -1.116 -4.716 2.194 1.00 63.13 N ATOM 1649 CA PHE A 134 -1.970 -5.860 1.897 1.00 52.31 C ATOM 1650 C PHE A 134 -1.841 -6.269 0.432 1.00 22.04 C ATOM 1651 O PHE A 134 -2.070 -7.424 0.076 1.00 21.41 O ATOM 1652 CB PHE A 134 -3.429 -5.531 2.219 1.00 51.12 C ATOM 1653 CG PHE A 134 -4.219 -5.073 1.025 1.00 2.05 C ATOM 1654 CD1 PHE A 134 -4.859 -5.991 0.209 1.00 44.45 C ATOM 1655 CD2 PHE A 134 -4.317 -3.726 0.719 1.00 74.24 C ATOM 1656 CE1 PHE A 134 -5.586 -5.573 -0.891 1.00 22.52 C ATOM 1657 CE2 PHE A 134 -5.043 -3.303 -0.379 1.00 54.13 C ATOM 1658 CZ PHE A 134 -5.677 -4.227 -1.185 1.00 51.33 C ATOM 0 H PHE A 134 -1.603 -3.820 2.214 1.00 63.13 H new ATOM 0 HA PHE A 134 -1.647 -6.694 2.519 1.00 52.31 H new ATOM 0 HB2 PHE A 134 -3.907 -6.414 2.644 1.00 51.12 H new ATOM 0 HB3 PHE A 134 -3.458 -4.754 2.983 1.00 51.12 H new ATOM 0 HD1 PHE A 134 -4.790 -7.045 0.434 1.00 44.45 H new ATOM 0 HD2 PHE A 134 -3.821 -2.998 1.344 1.00 74.24 H new ATOM 0 HE1 PHE A 134 -6.082 -6.298 -1.519 1.00 22.52 H new ATOM 0 HE2 PHE A 134 -5.114 -2.250 -0.606 1.00 54.13 H new ATOM 0 HZ PHE A 134 -6.243 -3.898 -2.044 1.00 51.33 H new ATOM 1667 N GLY A 135 -1.471 -5.312 -0.413 1.00 40.23 N ATOM 1668 CA GLY A 135 -1.318 -5.591 -1.829 1.00 45.42 C ATOM 1669 C GLY A 135 -0.367 -6.741 -2.094 1.00 22.31 C ATOM 1670 O GLY A 135 -0.705 -7.683 -2.811 1.00 70.20 O ATOM 0 H GLY A 135 -1.274 -4.348 -0.142 1.00 40.23 H new ATOM 0 HA2 GLY A 135 -2.293 -5.824 -2.258 1.00 45.42 H new ATOM 0 HA3 GLY A 135 -0.952 -4.697 -2.335 1.00 45.42 H new ATOM 1674 N TYR A 136 0.826 -6.665 -1.515 1.00 25.32 N ATOM 1675 CA TYR A 136 1.831 -7.706 -1.695 1.00 51.32 C ATOM 1676 C TYR A 136 1.269 -9.076 -1.325 1.00 11.42 C ATOM 1677 O TYR A 136 1.555 -10.075 -1.985 1.00 61.44 O ATOM 1678 CB TYR A 136 3.067 -7.404 -0.846 1.00 53.52 C ATOM 1679 CG TYR A 136 4.221 -8.346 -1.100 1.00 24.44 C ATOM 1680 CD1 TYR A 136 4.504 -8.802 -2.382 1.00 31.35 C ATOM 1681 CD2 TYR A 136 5.030 -8.782 -0.057 1.00 61.32 C ATOM 1682 CE1 TYR A 136 5.557 -9.664 -2.618 1.00 33.31 C ATOM 1683 CE2 TYR A 136 6.086 -9.644 -0.283 1.00 64.03 C ATOM 1684 CZ TYR A 136 6.346 -10.082 -1.565 1.00 43.34 C ATOM 1685 OH TYR A 136 7.396 -10.940 -1.796 1.00 62.41 O ATOM 0 H TYR A 136 1.121 -5.893 -0.917 1.00 25.32 H new ATOM 0 HA TYR A 136 2.116 -7.722 -2.747 1.00 51.32 H new ATOM 0 HB2 TYR A 136 3.392 -6.383 -1.044 1.00 53.52 H new ATOM 0 HB3 TYR A 136 2.794 -7.453 0.208 1.00 53.52 H new ATOM 0 HD1 TYR A 136 3.890 -8.477 -3.208 1.00 31.35 H new ATOM 0 HD2 TYR A 136 4.830 -8.441 0.948 1.00 61.32 H new ATOM 0 HE1 TYR A 136 5.762 -10.009 -3.621 1.00 33.31 H new ATOM 0 HE2 TYR A 136 6.704 -9.973 0.539 1.00 64.03 H new ATOM 0 HH TYR A 136 8.207 -10.586 -1.375 1.00 62.41 H new ATOM 1694 N ARG A 137 0.467 -9.113 -0.265 1.00 12.43 N ATOM 1695 CA ARG A 137 -0.134 -10.358 0.194 1.00 51.54 C ATOM 1696 C ARG A 137 -1.084 -10.923 -0.858 1.00 2.42 C ATOM 1697 O ARG A 137 -0.992 -12.095 -1.228 1.00 15.13 O ATOM 1698 CB ARG A 137 -0.888 -10.132 1.506 1.00 54.02 C ATOM 1699 CG ARG A 137 -0.055 -9.442 2.575 1.00 65.22 C ATOM 1700 CD ARG A 137 0.188 -10.357 3.767 1.00 52.44 C ATOM 1701 NE ARG A 137 1.500 -10.135 4.367 1.00 2.32 N ATOM 1702 CZ ARG A 137 2.066 -10.976 5.226 1.00 41.02 C ATOM 1703 NH1 ARG A 137 1.438 -12.088 5.583 1.00 52.35 N ATOM 1704 NH2 ARG A 137 3.264 -10.705 5.729 1.00 63.52 N ATOM 0 H ARG A 137 0.219 -8.295 0.291 1.00 12.43 H new ATOM 0 HA ARG A 137 0.667 -11.078 0.362 1.00 51.54 H new ATOM 0 HB2 ARG A 137 -1.776 -9.533 1.306 1.00 54.02 H new ATOM 0 HB3 ARG A 137 -1.231 -11.093 1.889 1.00 54.02 H new ATOM 0 HG2 ARG A 137 0.900 -9.133 2.151 1.00 65.22 H new ATOM 0 HG3 ARG A 137 -0.564 -8.537 2.907 1.00 65.22 H new ATOM 0 HD2 ARG A 137 -0.586 -10.190 4.516 1.00 52.44 H new ATOM 0 HD3 ARG A 137 0.106 -11.396 3.449 1.00 52.44 H new ATOM 0 HE ARG A 137 2.010 -9.289 4.113 1.00 2.32 H new ATOM 0 HH11 ARG A 137 0.518 -12.300 5.198 1.00 52.35 H new ATOM 0 HH12 ARG A 137 1.875 -12.731 6.243 1.00 52.35 H new ATOM 0 HH21 ARG A 137 3.750 -9.851 5.456 1.00 63.52 H new ATOM 0 HH22 ARG A 137 3.698 -11.351 6.388 1.00 63.52 H new ATOM 1715 N LEU A 138 -1.995 -10.085 -1.338 1.00 75.31 N ATOM 1716 CA LEU A 138 -2.963 -10.500 -2.347 1.00 71.11 C ATOM 1717 C LEU A 138 -2.257 -11.028 -3.593 1.00 60.42 C ATOM 1718 O LEU A 138 -2.731 -11.963 -4.237 1.00 70.51 O ATOM 1719 CB LEU A 138 -3.874 -9.329 -2.722 1.00 63.42 C ATOM 1720 CG LEU A 138 -4.874 -9.592 -3.848 1.00 11.33 C ATOM 1721 CD1 LEU A 138 -5.982 -10.519 -3.374 1.00 32.51 C ATOM 1722 CD2 LEU A 138 -5.456 -8.282 -4.361 1.00 34.23 C ATOM 0 H LEU A 138 -2.084 -9.112 -1.044 1.00 75.31 H new ATOM 0 HA LEU A 138 -3.568 -11.303 -1.926 1.00 71.11 H new ATOM 0 HB2 LEU A 138 -4.429 -9.027 -1.834 1.00 63.42 H new ATOM 0 HB3 LEU A 138 -3.247 -8.485 -3.009 1.00 63.42 H new ATOM 0 HG LEU A 138 -4.347 -10.080 -4.668 1.00 11.33 H new ATOM 0 HD11 LEU A 138 -6.684 -10.694 -4.190 1.00 32.51 H new ATOM 0 HD12 LEU A 138 -5.551 -11.468 -3.056 1.00 32.51 H new ATOM 0 HD13 LEU A 138 -6.507 -10.060 -2.536 1.00 32.51 H new ATOM 0 HD21 LEU A 138 -6.166 -8.488 -5.162 1.00 34.23 H new ATOM 0 HD22 LEU A 138 -5.967 -7.767 -3.547 1.00 34.23 H new ATOM 0 HD23 LEU A 138 -4.653 -7.651 -4.742 1.00 34.23 H new ATOM 1733 N ALA A 139 -1.120 -10.424 -3.923 1.00 54.30 N ATOM 1734 CA ALA A 139 -0.347 -10.836 -5.087 1.00 52.23 C ATOM 1735 C ALA A 139 0.447 -12.105 -4.798 1.00 61.15 C ATOM 1736 O ALA A 139 0.597 -12.967 -5.666 1.00 63.41 O ATOM 1737 CB ALA A 139 0.586 -9.716 -5.525 1.00 65.15 C ATOM 0 H ALA A 139 -0.714 -9.648 -3.400 1.00 54.30 H new ATOM 0 HA ALA A 139 -1.044 -11.051 -5.897 1.00 52.23 H new ATOM 0 HB1 ALA A 139 1.157 -10.038 -6.396 1.00 65.15 H new ATOM 0 HB2 ALA A 139 -0.000 -8.834 -5.782 1.00 65.15 H new ATOM 0 HB3 ALA A 139 1.270 -9.473 -4.712 1.00 65.15 H new ATOM 1743 N LEU A 140 0.955 -12.214 -3.576 1.00 72.43 N ATOM 1744 CA LEU A 140 1.734 -13.379 -3.172 1.00 61.15 C ATOM 1745 C LEU A 140 0.824 -14.565 -2.868 1.00 63.02 C ATOM 1746 O LEU A 140 1.288 -15.699 -2.733 1.00 51.54 O ATOM 1747 CB LEU A 140 2.585 -13.048 -1.944 1.00 15.32 C ATOM 1748 CG LEU A 140 3.827 -13.914 -1.735 1.00 11.35 C ATOM 1749 CD1 LEU A 140 4.954 -13.093 -1.129 1.00 13.15 C ATOM 1750 CD2 LEU A 140 3.501 -15.109 -0.852 1.00 42.22 C ATOM 0 H LEU A 140 0.842 -11.510 -2.847 1.00 72.43 H new ATOM 0 HA LEU A 140 2.390 -13.650 -3.999 1.00 61.15 H new ATOM 0 HB2 LEU A 140 2.900 -12.007 -2.015 1.00 15.32 H new ATOM 0 HB3 LEU A 140 1.956 -13.131 -1.058 1.00 15.32 H new ATOM 0 HG LEU A 140 4.156 -14.284 -2.706 1.00 11.35 H new ATOM 0 HD11 LEU A 140 5.830 -13.726 -0.987 1.00 13.15 H new ATOM 0 HD12 LEU A 140 5.205 -12.270 -1.798 1.00 13.15 H new ATOM 0 HD13 LEU A 140 4.636 -12.693 -0.166 1.00 13.15 H new ATOM 0 HD21 LEU A 140 4.397 -15.714 -0.714 1.00 42.22 H new ATOM 0 HD22 LEU A 140 3.147 -14.759 0.118 1.00 42.22 H new ATOM 0 HD23 LEU A 140 2.726 -15.711 -1.326 1.00 42.22 H new ATOM 1761 N HIS A 141 -0.473 -14.297 -2.764 1.00 60.42 N ATOM 1762 CA HIS A 141 -1.450 -15.343 -2.479 1.00 11.11 C ATOM 1763 C HIS A 141 -2.078 -15.865 -3.768 1.00 64.51 C ATOM 1764 O HIS A 141 -2.937 -16.747 -3.739 1.00 1.21 O ATOM 1765 CB HIS A 141 -2.539 -14.814 -1.546 1.00 12.00 C ATOM 1766 CG HIS A 141 -2.336 -15.194 -0.111 1.00 43.34 C ATOM 1767 ND1 HIS A 141 -1.406 -14.796 0.788 1.00 15.41 N flip ATOM 1768 CD2 HIS A 141 -3.147 -16.093 0.550 1.00 71.15 C flip ATOM 1769 CE1 HIS A 141 -1.671 -15.452 1.964 1.00 41.22 C flip ATOM 1770 NE2 HIS A 141 -2.726 -16.228 1.795 1.00 21.33 N flip ATOM 0 H HIS A 141 -0.873 -13.365 -2.873 1.00 60.42 H new ATOM 0 HA HIS A 141 -0.931 -16.166 -1.988 1.00 11.11 H new ATOM 0 HB2 HIS A 141 -2.576 -13.727 -1.624 1.00 12.00 H new ATOM 0 HB3 HIS A 141 -3.506 -15.191 -1.880 1.00 12.00 H new ATOM 0 HD1 HIS A 141 -0.649 -14.132 0.622 1.00 15.41 H new ATOM 0 HD2 HIS A 141 -3.993 -16.606 0.118 1.00 71.15 H new ATOM 0 HE1 HIS A 141 -1.108 -15.350 2.880 1.00 41.22 H new ATOM 1777 N VAL A 142 -1.643 -15.316 -4.897 1.00 13.20 N ATOM 1778 CA VAL A 142 -2.162 -15.726 -6.197 1.00 60.42 C ATOM 1779 C VAL A 142 -1.050 -16.270 -7.086 1.00 51.30 C ATOM 1780 O VAL A 142 -1.241 -17.247 -7.810 1.00 61.11 O ATOM 1781 CB VAL A 142 -2.856 -14.557 -6.919 1.00 34.01 C ATOM 1782 CG1 VAL A 142 -4.189 -14.237 -6.259 1.00 41.20 C ATOM 1783 CG2 VAL A 142 -1.954 -13.332 -6.937 1.00 52.11 C ATOM 0 H VAL A 142 -0.932 -14.586 -4.938 1.00 13.20 H new ATOM 0 HA VAL A 142 -2.893 -16.513 -6.012 1.00 60.42 H new ATOM 0 HB VAL A 142 -3.050 -14.853 -7.950 1.00 34.01 H new ATOM 0 HG11 VAL A 142 -4.665 -13.408 -6.783 1.00 41.20 H new ATOM 0 HG12 VAL A 142 -4.836 -15.113 -6.302 1.00 41.20 H new ATOM 0 HG13 VAL A 142 -4.022 -13.960 -5.218 1.00 41.20 H new ATOM 0 HG21 VAL A 142 -2.460 -12.515 -7.451 1.00 52.11 H new ATOM 0 HG22 VAL A 142 -1.727 -13.032 -5.914 1.00 52.11 H new ATOM 0 HG23 VAL A 142 -1.027 -13.570 -7.459 1.00 52.11 H new ATOM 1793 N TYR A 143 0.114 -15.632 -7.026 1.00 75.21 N ATOM 1794 CA TYR A 143 1.257 -16.050 -7.827 1.00 22.12 C ATOM 1795 C TYR A 143 1.612 -17.508 -7.552 1.00 73.14 C ATOM 1796 O TYR A 143 2.185 -18.189 -8.401 1.00 31.32 O ATOM 1797 CB TYR A 143 2.465 -15.156 -7.537 1.00 53.11 C ATOM 1798 CG TYR A 143 3.408 -15.731 -6.505 1.00 11.42 C ATOM 1799 CD1 TYR A 143 3.032 -15.834 -5.172 1.00 23.21 C ATOM 1800 CD2 TYR A 143 4.677 -16.168 -6.863 1.00 22.31 C ATOM 1801 CE1 TYR A 143 3.892 -16.358 -4.225 1.00 14.21 C ATOM 1802 CE2 TYR A 143 5.543 -16.695 -5.924 1.00 50.22 C ATOM 1803 CZ TYR A 143 5.146 -16.787 -4.606 1.00 11.21 C ATOM 1804 OH TYR A 143 6.006 -17.310 -3.667 1.00 52.12 O ATOM 0 H TYR A 143 0.290 -14.823 -6.430 1.00 75.21 H new ATOM 0 HA TYR A 143 0.986 -15.953 -8.878 1.00 22.12 H new ATOM 0 HB2 TYR A 143 3.013 -14.987 -8.464 1.00 53.11 H new ATOM 0 HB3 TYR A 143 2.113 -14.183 -7.194 1.00 53.11 H new ATOM 0 HD1 TYR A 143 2.051 -15.499 -4.870 1.00 23.21 H new ATOM 0 HD2 TYR A 143 4.992 -16.095 -7.893 1.00 22.31 H new ATOM 0 HE1 TYR A 143 3.584 -16.431 -3.193 1.00 14.21 H new ATOM 0 HE2 TYR A 143 6.525 -17.033 -6.220 1.00 50.22 H new ATOM 0 HH TYR A 143 6.847 -17.565 -4.100 1.00 52.12 H new ATOM 1813 N GLN A 144 1.265 -17.979 -6.358 1.00 11.20 N ATOM 1814 CA GLN A 144 1.546 -19.356 -5.970 1.00 33.32 C ATOM 1815 C GLN A 144 0.628 -20.327 -6.704 1.00 51.40 C ATOM 1816 O GLN A 144 0.932 -21.515 -6.825 1.00 73.44 O ATOM 1817 CB GLN A 144 1.383 -19.525 -4.458 1.00 52.44 C ATOM 1818 CG GLN A 144 2.663 -19.275 -3.676 1.00 62.15 C ATOM 1819 CD GLN A 144 3.099 -20.482 -2.870 1.00 62.23 C ATOM 1820 OE1 GLN A 144 2.273 -21.188 -2.291 1.00 3.53 O ATOM 1821 NE2 GLN A 144 4.404 -20.727 -2.829 1.00 31.40 N ATOM 0 H GLN A 144 0.789 -17.428 -5.644 1.00 11.20 H new ATOM 0 HA GLN A 144 2.576 -19.581 -6.245 1.00 33.32 H new ATOM 0 HB2 GLN A 144 0.612 -18.840 -4.105 1.00 52.44 H new ATOM 0 HB3 GLN A 144 1.031 -20.535 -4.250 1.00 52.44 H new ATOM 0 HG2 GLN A 144 3.459 -18.998 -4.368 1.00 62.15 H new ATOM 0 HG3 GLN A 144 2.515 -18.429 -3.005 1.00 62.15 H new ATOM 0 HE21 GLN A 144 5.053 -20.116 -3.324 1.00 31.40 H new ATOM 0 HE22 GLN A 144 4.757 -21.526 -2.303 1.00 31.40 H new ATOM 1828 N HIS A 145 -0.497 -19.815 -7.194 1.00 2.13 N ATOM 1829 CA HIS A 145 -1.460 -20.637 -7.917 1.00 44.05 C ATOM 1830 C HIS A 145 -0.804 -21.314 -9.117 1.00 15.33 C ATOM 1831 O HIS A 145 -1.280 -22.339 -9.601 1.00 44.30 O ATOM 1832 CB HIS A 145 -2.643 -19.787 -8.381 1.00 13.44 C ATOM 1833 CG HIS A 145 -3.939 -20.537 -8.429 1.00 32.05 C ATOM 1834 ND1 HIS A 145 -4.118 -21.680 -9.178 1.00 40.33 N ATOM 1835 CD2 HIS A 145 -5.120 -20.302 -7.812 1.00 24.20 C ATOM 1836 CE1 HIS A 145 -5.356 -22.115 -9.023 1.00 22.33 C ATOM 1837 NE2 HIS A 145 -5.984 -21.297 -8.198 1.00 63.14 N ATOM 0 H HIS A 145 -0.764 -18.835 -7.103 1.00 2.13 H new ATOM 0 HA HIS A 145 -1.822 -21.409 -7.238 1.00 44.05 H new ATOM 0 HB2 HIS A 145 -2.751 -18.934 -7.711 1.00 13.44 H new ATOM 0 HB3 HIS A 145 -2.427 -19.389 -9.372 1.00 13.44 H new ATOM 0 HD1 HIS A 145 -3.406 -22.121 -9.761 1.00 40.33 H new ATOM 0 HD2 HIS A 145 -5.342 -19.485 -7.141 1.00 24.20 H new ATOM 0 HE1 HIS A 145 -5.782 -22.990 -9.491 1.00 22.33 H new ATOM 1844 N GLY A 146 0.293 -20.731 -9.592 1.00 43.53 N ATOM 1845 CA GLY A 146 0.996 -21.291 -10.732 1.00 42.42 C ATOM 1846 C GLY A 146 1.473 -20.226 -11.699 1.00 53.42 C ATOM 1847 O GLY A 146 1.117 -20.242 -12.878 1.00 54.21 O ATOM 0 H GLY A 146 0.707 -19.882 -9.208 1.00 43.53 H new ATOM 0 HA2 GLY A 146 1.852 -21.867 -10.380 1.00 42.42 H new ATOM 0 HA3 GLY A 146 0.338 -21.985 -11.256 1.00 42.42 H new ATOM 1851 N LEU A 147 2.281 -19.297 -11.201 1.00 33.02 N ATOM 1852 CA LEU A 147 2.808 -18.217 -12.029 1.00 30.40 C ATOM 1853 C LEU A 147 4.316 -18.080 -11.850 1.00 4.34 C ATOM 1854 O LEU A 147 4.901 -18.667 -10.940 1.00 64.30 O ATOM 1855 CB LEU A 147 2.120 -16.896 -11.678 1.00 70.45 C ATOM 1856 CG LEU A 147 0.607 -16.847 -11.901 1.00 22.42 C ATOM 1857 CD1 LEU A 147 -0.125 -17.503 -10.739 1.00 14.32 C ATOM 1858 CD2 LEU A 147 0.141 -15.411 -12.085 1.00 3.43 C ATOM 0 H LEU A 147 2.586 -19.269 -10.228 1.00 33.02 H new ATOM 0 HA LEU A 147 2.605 -18.460 -13.072 1.00 30.40 H new ATOM 0 HB2 LEU A 147 2.320 -16.672 -10.630 1.00 70.45 H new ATOM 0 HB3 LEU A 147 2.580 -16.102 -12.267 1.00 70.45 H new ATOM 0 HG LEU A 147 0.375 -17.402 -12.810 1.00 22.42 H new ATOM 0 HD11 LEU A 147 -1.200 -17.459 -10.915 1.00 14.32 H new ATOM 0 HD12 LEU A 147 0.186 -18.544 -10.654 1.00 14.32 H new ATOM 0 HD13 LEU A 147 0.113 -16.976 -9.815 1.00 14.32 H new ATOM 0 HD21 LEU A 147 -0.937 -15.396 -12.242 1.00 3.43 H new ATOM 0 HD22 LEU A 147 0.386 -14.832 -11.195 1.00 3.43 H new ATOM 0 HD23 LEU A 147 0.640 -14.975 -12.950 1.00 3.43 H new ATOM 1869 N THR A 148 4.942 -17.299 -12.726 1.00 61.21 N ATOM 1870 CA THR A 148 6.383 -17.084 -12.665 1.00 43.23 C ATOM 1871 C THR A 148 6.710 -15.606 -12.488 1.00 3.41 C ATOM 1872 O THR A 148 7.704 -15.252 -11.854 1.00 52.24 O ATOM 1873 CB THR A 148 7.083 -17.606 -13.934 1.00 42.22 C ATOM 1874 OG1 THR A 148 6.588 -16.915 -15.086 1.00 71.14 O ATOM 1875 CG2 THR A 148 6.860 -19.102 -14.098 1.00 41.45 C ATOM 0 H THR A 148 4.474 -16.805 -13.486 1.00 61.21 H new ATOM 0 HA THR A 148 6.750 -17.640 -11.803 1.00 43.23 H new ATOM 0 HB THR A 148 8.153 -17.423 -13.834 1.00 42.22 H new ATOM 0 HG1 THR A 148 7.039 -17.251 -15.888 1.00 71.14 H new ATOM 0 HG21 THR A 148 7.363 -19.448 -15.001 1.00 41.45 H new ATOM 0 HG22 THR A 148 7.265 -19.627 -13.233 1.00 41.45 H new ATOM 0 HG23 THR A 148 5.792 -19.304 -14.178 1.00 41.45 H new ATOM 1883 N GLY A 149 5.870 -14.746 -13.056 1.00 70.53 N ATOM 1884 CA GLY A 149 6.088 -13.315 -12.949 1.00 65.44 C ATOM 1885 C GLY A 149 4.793 -12.528 -12.974 1.00 71.21 C ATOM 1886 O GLY A 149 4.389 -12.015 -14.019 1.00 20.41 O ATOM 0 H GLY A 149 5.042 -15.015 -13.588 1.00 70.53 H new ATOM 0 HA2 GLY A 149 6.622 -13.100 -12.024 1.00 65.44 H new ATOM 0 HA3 GLY A 149 6.726 -12.985 -13.769 1.00 65.44 H new ATOM 1890 N PHE A 150 4.137 -12.431 -11.821 1.00 2.25 N ATOM 1891 CA PHE A 150 2.879 -11.703 -11.716 1.00 24.31 C ATOM 1892 C PHE A 150 3.105 -10.309 -11.138 1.00 55.25 C ATOM 1893 O PHE A 150 2.175 -9.507 -11.040 1.00 42.25 O ATOM 1894 CB PHE A 150 1.890 -12.476 -10.841 1.00 51.41 C ATOM 1895 CG PHE A 150 0.452 -12.171 -11.149 1.00 33.41 C ATOM 1896 CD1 PHE A 150 -0.024 -12.247 -12.448 1.00 55.40 C ATOM 1897 CD2 PHE A 150 -0.424 -11.807 -10.139 1.00 40.34 C ATOM 1898 CE1 PHE A 150 -1.347 -11.965 -12.734 1.00 10.15 C ATOM 1899 CE2 PHE A 150 -1.749 -11.525 -10.419 1.00 1.33 C ATOM 1900 CZ PHE A 150 -2.210 -11.605 -11.718 1.00 4.40 C ATOM 0 H PHE A 150 4.457 -12.848 -10.947 1.00 2.25 H new ATOM 0 HA PHE A 150 2.463 -11.599 -12.718 1.00 24.31 H new ATOM 0 HB2 PHE A 150 2.062 -13.545 -10.969 1.00 51.41 H new ATOM 0 HB3 PHE A 150 2.086 -12.245 -9.794 1.00 51.41 H new ATOM 0 HD1 PHE A 150 0.646 -12.530 -13.246 1.00 55.40 H new ATOM 0 HD2 PHE A 150 -0.068 -11.743 -9.121 1.00 40.34 H new ATOM 0 HE1 PHE A 150 -1.705 -12.026 -13.751 1.00 10.15 H new ATOM 0 HE2 PHE A 150 -2.422 -11.243 -9.623 1.00 1.33 H new ATOM 0 HZ PHE A 150 -3.244 -11.386 -11.939 1.00 4.40 H new ATOM 1909 N LEU A 151 4.345 -10.026 -10.757 1.00 24.22 N ATOM 1910 CA LEU A 151 4.694 -8.729 -10.188 1.00 64.51 C ATOM 1911 C LEU A 151 4.200 -7.593 -11.078 1.00 3.20 C ATOM 1912 O LEU A 151 3.525 -6.676 -10.614 1.00 71.30 O ATOM 1913 CB LEU A 151 6.209 -8.624 -10.000 1.00 23.31 C ATOM 1914 CG LEU A 151 7.067 -9.201 -11.126 1.00 70.03 C ATOM 1915 CD1 LEU A 151 7.958 -8.124 -11.724 1.00 22.23 C ATOM 1916 CD2 LEU A 151 7.903 -10.366 -10.617 1.00 31.41 C ATOM 0 H LEU A 151 5.126 -10.677 -10.832 1.00 24.22 H new ATOM 0 HA LEU A 151 4.207 -8.642 -9.217 1.00 64.51 H new ATOM 0 HB2 LEU A 151 6.467 -7.572 -9.876 1.00 23.31 H new ATOM 0 HB3 LEU A 151 6.476 -9.129 -9.072 1.00 23.31 H new ATOM 0 HG LEU A 151 6.404 -9.571 -11.908 1.00 70.03 H new ATOM 0 HD11 LEU A 151 8.561 -8.554 -12.524 1.00 22.23 H new ATOM 0 HD12 LEU A 151 7.339 -7.322 -12.127 1.00 22.23 H new ATOM 0 HD13 LEU A 151 8.613 -7.723 -10.951 1.00 22.23 H new ATOM 0 HD21 LEU A 151 8.507 -10.764 -11.432 1.00 31.41 H new ATOM 0 HD22 LEU A 151 8.557 -10.022 -9.815 1.00 31.41 H new ATOM 0 HD23 LEU A 151 7.245 -11.148 -10.238 1.00 31.41 H new ATOM 1927 N GLY A 152 4.541 -7.664 -12.361 1.00 53.01 N ATOM 1928 CA GLY A 152 4.122 -6.637 -13.297 1.00 31.03 C ATOM 1929 C GLY A 152 2.613 -6.504 -13.376 1.00 11.24 C ATOM 1930 O GLY A 152 2.087 -5.397 -13.474 1.00 35.31 O ATOM 0 H GLY A 152 5.100 -8.414 -12.769 1.00 53.01 H new ATOM 0 HA2 GLY A 152 4.553 -5.681 -12.999 1.00 31.03 H new ATOM 0 HA3 GLY A 152 4.515 -6.869 -14.287 1.00 31.03 H new ATOM 1934 N GLN A 153 1.920 -7.637 -13.335 1.00 74.34 N ATOM 1935 CA GLN A 153 0.463 -7.642 -13.405 1.00 53.21 C ATOM 1936 C GLN A 153 -0.141 -6.884 -12.228 1.00 74.31 C ATOM 1937 O GLN A 153 -0.930 -5.956 -12.411 1.00 22.03 O ATOM 1938 CB GLN A 153 -0.063 -9.078 -13.427 1.00 53.23 C ATOM 1939 CG GLN A 153 0.492 -9.911 -14.570 1.00 40.13 C ATOM 1940 CD GLN A 153 0.547 -9.146 -15.877 1.00 42.45 C ATOM 1941 OE1 GLN A 153 -0.444 -9.064 -16.604 1.00 41.44 O ATOM 1942 NE2 GLN A 153 1.708 -8.579 -16.184 1.00 55.12 N ATOM 0 H GLN A 153 2.342 -8.562 -13.254 1.00 74.34 H new ATOM 0 HA GLN A 153 0.167 -7.141 -14.326 1.00 53.21 H new ATOM 0 HB2 GLN A 153 0.185 -9.562 -12.482 1.00 53.23 H new ATOM 0 HB3 GLN A 153 -1.150 -9.057 -13.498 1.00 53.23 H new ATOM 0 HG2 GLN A 153 1.494 -10.254 -14.312 1.00 40.13 H new ATOM 0 HG3 GLN A 153 -0.125 -10.800 -14.700 1.00 40.13 H new ATOM 0 HE21 GLN A 153 2.504 -8.672 -15.553 1.00 55.12 H new ATOM 0 HE22 GLN A 153 1.804 -8.050 -17.051 1.00 55.12 H new ATOM 1949 N VAL A 154 0.233 -7.286 -11.017 1.00 73.33 N ATOM 1950 CA VAL A 154 -0.271 -6.644 -9.808 1.00 65.15 C ATOM 1951 C VAL A 154 0.009 -5.146 -9.823 1.00 2.33 C ATOM 1952 O VAL A 154 -0.904 -4.331 -9.689 1.00 14.10 O ATOM 1953 CB VAL A 154 0.354 -7.261 -8.543 1.00 2.13 C ATOM 1954 CG1 VAL A 154 -0.217 -6.610 -7.293 1.00 71.24 C ATOM 1955 CG2 VAL A 154 0.135 -8.766 -8.518 1.00 1.50 C ATOM 0 H VAL A 154 0.883 -8.053 -10.847 1.00 73.33 H new ATOM 0 HA VAL A 154 -1.348 -6.808 -9.788 1.00 65.15 H new ATOM 0 HB VAL A 154 1.428 -7.075 -8.563 1.00 2.13 H new ATOM 0 HG11 VAL A 154 0.237 -7.059 -6.409 1.00 71.24 H new ATOM 0 HG12 VAL A 154 -0.002 -5.542 -7.308 1.00 71.24 H new ATOM 0 HG13 VAL A 154 -1.296 -6.762 -7.264 1.00 71.24 H new ATOM 0 HG21 VAL A 154 0.584 -9.184 -7.617 1.00 1.50 H new ATOM 0 HG22 VAL A 154 -0.934 -8.978 -8.523 1.00 1.50 H new ATOM 0 HG23 VAL A 154 0.598 -9.216 -9.396 1.00 1.50 H new ATOM 1965 N THR A 155 1.279 -4.789 -9.987 1.00 0.40 N ATOM 1966 CA THR A 155 1.681 -3.389 -10.019 1.00 50.23 C ATOM 1967 C THR A 155 0.889 -2.613 -11.065 1.00 63.01 C ATOM 1968 O THR A 155 0.467 -1.482 -10.825 1.00 10.23 O ATOM 1969 CB THR A 155 3.185 -3.243 -10.319 1.00 54.10 C ATOM 1970 OG1 THR A 155 3.930 -4.203 -9.563 1.00 14.14 O ATOM 1971 CG2 THR A 155 3.670 -1.839 -9.985 1.00 45.42 C ATOM 0 H THR A 155 2.047 -5.451 -10.100 1.00 0.40 H new ATOM 0 HA THR A 155 1.473 -2.978 -9.031 1.00 50.23 H new ATOM 0 HB THR A 155 3.340 -3.420 -11.383 1.00 54.10 H new ATOM 0 HG1 THR A 155 3.916 -5.066 -10.027 1.00 14.14 H new ATOM 0 HG21 THR A 155 4.735 -1.760 -10.205 1.00 45.42 H new ATOM 0 HG22 THR A 155 3.121 -1.112 -10.584 1.00 45.42 H new ATOM 0 HG23 THR A 155 3.502 -1.638 -8.927 1.00 45.42 H new ATOM 1979 N ARG A 156 0.689 -3.228 -12.227 1.00 32.34 N ATOM 1980 CA ARG A 156 -0.053 -2.594 -13.310 1.00 61.22 C ATOM 1981 C ARG A 156 -1.489 -2.299 -12.885 1.00 41.03 C ATOM 1982 O ARG A 156 -2.027 -1.231 -13.178 1.00 44.44 O ATOM 1983 CB ARG A 156 -0.051 -3.489 -14.550 1.00 72.22 C ATOM 1984 CG ARG A 156 1.226 -3.393 -15.369 1.00 71.20 C ATOM 1985 CD ARG A 156 1.255 -2.125 -16.208 1.00 21.12 C ATOM 1986 NE ARG A 156 0.388 -2.224 -17.379 1.00 62.25 N ATOM 1987 CZ ARG A 156 0.683 -2.948 -18.453 1.00 62.41 C ATOM 1988 NH1 ARG A 156 1.817 -3.633 -18.503 1.00 40.21 N ATOM 1989 NH2 ARG A 156 -0.157 -2.988 -19.479 1.00 71.20 N ATOM 0 H ARG A 156 1.031 -4.165 -12.442 1.00 32.34 H new ATOM 0 HA ARG A 156 0.438 -1.651 -13.550 1.00 61.22 H new ATOM 0 HB2 ARG A 156 -0.197 -4.524 -14.241 1.00 72.22 H new ATOM 0 HB3 ARG A 156 -0.898 -3.222 -15.182 1.00 72.22 H new ATOM 0 HG2 ARG A 156 2.089 -3.410 -14.703 1.00 71.20 H new ATOM 0 HG3 ARG A 156 1.309 -4.263 -16.020 1.00 71.20 H new ATOM 0 HD2 ARG A 156 0.943 -1.278 -15.596 1.00 21.12 H new ATOM 0 HD3 ARG A 156 2.277 -1.926 -16.530 1.00 21.12 H new ATOM 0 HE ARG A 156 -0.492 -1.709 -17.372 1.00 62.25 H new ATOM 0 HH11 ARG A 156 2.465 -3.605 -17.716 1.00 40.21 H new ATOM 0 HH12 ARG A 156 2.041 -4.188 -19.329 1.00 40.21 H new ATOM 0 HH21 ARG A 156 -1.030 -2.462 -19.444 1.00 71.20 H new ATOM 0 HH22 ARG A 156 0.071 -3.544 -20.303 1.00 71.20 H new ATOM 2000 N PHE A 157 -2.103 -3.253 -12.193 1.00 75.01 N ATOM 2001 CA PHE A 157 -3.478 -3.096 -11.729 1.00 13.24 C ATOM 2002 C PHE A 157 -3.595 -1.920 -10.763 1.00 25.45 C ATOM 2003 O PHE A 157 -4.442 -1.044 -10.933 1.00 4.24 O ATOM 2004 CB PHE A 157 -3.958 -4.379 -11.049 1.00 22.25 C ATOM 2005 CG PHE A 157 -3.910 -5.585 -11.943 1.00 24.32 C ATOM 2006 CD1 PHE A 157 -4.256 -5.486 -13.280 1.00 3.22 C ATOM 2007 CD2 PHE A 157 -3.520 -6.818 -11.444 1.00 50.01 C ATOM 2008 CE1 PHE A 157 -4.212 -6.594 -14.105 1.00 43.21 C ATOM 2009 CE2 PHE A 157 -3.475 -7.929 -12.264 1.00 24.04 C ATOM 2010 CZ PHE A 157 -3.821 -7.817 -13.597 1.00 62.14 C ATOM 0 H PHE A 157 -1.671 -4.142 -11.941 1.00 75.01 H new ATOM 0 HA PHE A 157 -4.107 -2.895 -12.596 1.00 13.24 H new ATOM 0 HB2 PHE A 157 -3.344 -4.565 -10.168 1.00 22.25 H new ATOM 0 HB3 PHE A 157 -4.981 -4.235 -10.701 1.00 22.25 H new ATOM 0 HD1 PHE A 157 -4.564 -4.532 -13.683 1.00 3.22 H new ATOM 0 HD2 PHE A 157 -3.248 -6.911 -10.403 1.00 50.01 H new ATOM 0 HE1 PHE A 157 -4.483 -6.503 -15.146 1.00 43.21 H new ATOM 0 HE2 PHE A 157 -3.170 -8.884 -11.863 1.00 24.04 H new ATOM 0 HZ PHE A 157 -3.786 -8.684 -14.240 1.00 62.14 H new ATOM 2019 N VAL A 158 -2.737 -1.909 -9.747 1.00 4.41 N ATOM 2020 CA VAL A 158 -2.743 -0.842 -8.753 1.00 13.34 C ATOM 2021 C VAL A 158 -2.603 0.524 -9.414 1.00 13.13 C ATOM 2022 O VAL A 158 -3.422 1.417 -9.199 1.00 73.15 O ATOM 2023 CB VAL A 158 -1.606 -1.023 -7.729 1.00 71.03 C ATOM 2024 CG1 VAL A 158 -1.725 0.004 -6.614 1.00 31.45 C ATOM 2025 CG2 VAL A 158 -1.618 -2.437 -7.167 1.00 72.51 C ATOM 0 H VAL A 158 -2.029 -2.627 -9.591 1.00 4.41 H new ATOM 0 HA VAL A 158 -3.701 -0.896 -8.235 1.00 13.34 H new ATOM 0 HB VAL A 158 -0.654 -0.865 -8.235 1.00 71.03 H new ATOM 0 HG11 VAL A 158 -0.914 -0.139 -5.900 1.00 31.45 H new ATOM 0 HG12 VAL A 158 -1.665 1.007 -7.036 1.00 31.45 H new ATOM 0 HG13 VAL A 158 -2.681 -0.120 -6.106 1.00 31.45 H new ATOM 0 HG21 VAL A 158 -0.809 -2.549 -6.445 1.00 72.51 H new ATOM 0 HG22 VAL A 158 -2.572 -2.625 -6.674 1.00 72.51 H new ATOM 0 HG23 VAL A 158 -1.482 -3.152 -7.978 1.00 72.51 H new ATOM 2035 N VAL A 159 -1.557 0.683 -10.220 1.00 70.25 N ATOM 2036 CA VAL A 159 -1.310 1.940 -10.914 1.00 15.45 C ATOM 2037 C VAL A 159 -2.419 2.243 -11.915 1.00 63.14 C ATOM 2038 O VAL A 159 -2.730 3.404 -12.180 1.00 4.51 O ATOM 2039 CB VAL A 159 0.041 1.918 -11.653 1.00 51.10 C ATOM 2040 CG1 VAL A 159 0.354 3.287 -12.236 1.00 1.12 C ATOM 2041 CG2 VAL A 159 1.152 1.461 -10.718 1.00 40.03 C ATOM 0 H VAL A 159 -0.867 -0.044 -10.408 1.00 70.25 H new ATOM 0 HA VAL A 159 -1.287 2.721 -10.154 1.00 15.45 H new ATOM 0 HB VAL A 159 -0.027 1.206 -12.476 1.00 51.10 H new ATOM 0 HG11 VAL A 159 1.312 3.251 -12.754 1.00 1.12 H new ATOM 0 HG12 VAL A 159 -0.429 3.570 -12.940 1.00 1.12 H new ATOM 0 HG13 VAL A 159 0.403 4.022 -11.433 1.00 1.12 H new ATOM 0 HG21 VAL A 159 2.100 1.451 -11.256 1.00 40.03 H new ATOM 0 HG22 VAL A 159 1.222 2.146 -9.873 1.00 40.03 H new ATOM 0 HG23 VAL A 159 0.931 0.458 -10.354 1.00 40.03 H new ATOM 2051 N ASP A 160 -3.013 1.191 -12.468 1.00 31.22 N ATOM 2052 CA ASP A 160 -4.089 1.343 -13.439 1.00 41.04 C ATOM 2053 C ASP A 160 -5.313 1.993 -12.798 1.00 3.25 C ATOM 2054 O ASP A 160 -5.698 3.105 -13.158 1.00 21.32 O ATOM 2055 CB ASP A 160 -4.469 -0.016 -14.029 1.00 54.24 C ATOM 2056 CG ASP A 160 -5.671 0.067 -14.949 1.00 70.23 C ATOM 2057 OD1 ASP A 160 -5.518 0.568 -16.081 1.00 13.42 O ATOM 2058 OD2 ASP A 160 -6.767 -0.368 -14.535 1.00 63.51 O ATOM 0 H ASP A 160 -2.767 0.223 -12.260 1.00 31.22 H new ATOM 0 HA ASP A 160 -3.733 1.991 -14.240 1.00 41.04 H new ATOM 0 HB2 ASP A 160 -3.620 -0.419 -14.581 1.00 54.24 H new ATOM 0 HB3 ASP A 160 -4.683 -0.713 -13.219 1.00 54.24 H new ATOM 2062 N PHE A 161 -5.919 1.289 -11.848 1.00 32.21 N ATOM 2063 CA PHE A 161 -7.099 1.796 -11.157 1.00 55.21 C ATOM 2064 C PHE A 161 -6.789 3.107 -10.440 1.00 52.54 C ATOM 2065 O PHE A 161 -7.637 3.994 -10.352 1.00 54.34 O ATOM 2066 CB PHE A 161 -7.613 0.762 -10.154 1.00 33.41 C ATOM 2067 CG PHE A 161 -7.119 0.988 -8.754 1.00 1.34 C ATOM 2068 CD1 PHE A 161 -7.829 1.790 -7.875 1.00 21.55 C ATOM 2069 CD2 PHE A 161 -5.944 0.398 -8.316 1.00 2.10 C ATOM 2070 CE1 PHE A 161 -7.375 2.000 -6.587 1.00 23.51 C ATOM 2071 CE2 PHE A 161 -5.486 0.605 -7.029 1.00 23.34 C ATOM 2072 CZ PHE A 161 -6.203 1.406 -6.162 1.00 44.33 C ATOM 0 H PHE A 161 -5.613 0.366 -11.539 1.00 32.21 H new ATOM 0 HA PHE A 161 -7.872 1.984 -11.902 1.00 55.21 H new ATOM 0 HB2 PHE A 161 -8.703 0.779 -10.153 1.00 33.41 H new ATOM 0 HB3 PHE A 161 -7.310 -0.232 -10.482 1.00 33.41 H new ATOM 0 HD1 PHE A 161 -8.747 2.256 -8.200 1.00 21.55 H new ATOM 0 HD2 PHE A 161 -5.380 -0.231 -8.989 1.00 2.10 H new ATOM 0 HE1 PHE A 161 -7.937 2.629 -5.912 1.00 23.51 H new ATOM 0 HE2 PHE A 161 -4.568 0.141 -6.701 1.00 23.34 H new ATOM 0 HZ PHE A 161 -5.848 1.567 -5.155 1.00 44.33 H new ATOM 2081 N MET A 162 -5.568 3.220 -9.929 1.00 72.11 N ATOM 2082 CA MET A 162 -5.146 4.423 -9.220 1.00 25.35 C ATOM 2083 C MET A 162 -5.094 5.620 -10.163 1.00 75.41 C ATOM 2084 O MET A 162 -5.431 6.741 -9.777 1.00 1.32 O ATOM 2085 CB MET A 162 -3.773 4.206 -8.578 1.00 61.13 C ATOM 2086 CG MET A 162 -3.345 5.341 -7.662 1.00 62.44 C ATOM 2087 SD MET A 162 -1.560 5.397 -7.414 1.00 53.41 S ATOM 2088 CE MET A 162 -1.452 5.076 -5.655 1.00 4.42 C ATOM 0 H MET A 162 -4.854 2.495 -9.992 1.00 72.11 H new ATOM 0 HA MET A 162 -5.877 4.630 -8.439 1.00 25.35 H new ATOM 0 HB2 MET A 162 -3.790 3.277 -8.008 1.00 61.13 H new ATOM 0 HB3 MET A 162 -3.028 4.084 -9.365 1.00 61.13 H new ATOM 0 HG2 MET A 162 -3.679 6.289 -8.084 1.00 62.44 H new ATOM 0 HG3 MET A 162 -3.839 5.230 -6.697 1.00 62.44 H new ATOM 0 HE1 MET A 162 -0.588 4.443 -5.453 1.00 4.42 H new ATOM 0 HE2 MET A 162 -1.345 6.019 -5.119 1.00 4.42 H new ATOM 0 HE3 MET A 162 -2.358 4.570 -5.321 1.00 4.42 H new ATOM 2096 N LEU A 163 -4.674 5.377 -11.399 1.00 30.51 N ATOM 2097 CA LEU A 163 -4.579 6.436 -12.397 1.00 32.12 C ATOM 2098 C LEU A 163 -5.902 7.184 -12.526 1.00 62.24 C ATOM 2099 O LEU A 163 -5.932 8.355 -12.904 1.00 71.43 O ATOM 2100 CB LEU A 163 -4.176 5.853 -13.752 1.00 71.05 C ATOM 2101 CG LEU A 163 -3.103 6.623 -14.523 1.00 53.11 C ATOM 2102 CD1 LEU A 163 -3.615 8.000 -14.919 1.00 65.11 C ATOM 2103 CD2 LEU A 163 -1.833 6.743 -13.693 1.00 52.22 C ATOM 0 H LEU A 163 -4.394 4.455 -11.734 1.00 30.51 H new ATOM 0 HA LEU A 163 -3.815 7.141 -12.070 1.00 32.12 H new ATOM 0 HB2 LEU A 163 -3.821 4.834 -13.595 1.00 71.05 H new ATOM 0 HB3 LEU A 163 -5.067 5.788 -14.376 1.00 71.05 H new ATOM 0 HG LEU A 163 -2.868 6.070 -15.432 1.00 53.11 H new ATOM 0 HD11 LEU A 163 -2.838 8.533 -15.467 1.00 65.11 H new ATOM 0 HD12 LEU A 163 -4.496 7.892 -15.552 1.00 65.11 H new ATOM 0 HD13 LEU A 163 -3.878 8.562 -14.023 1.00 65.11 H new ATOM 0 HD21 LEU A 163 -1.080 7.294 -14.257 1.00 52.22 H new ATOM 0 HD22 LEU A 163 -2.053 7.274 -12.767 1.00 52.22 H new ATOM 0 HD23 LEU A 163 -1.455 5.747 -13.460 1.00 52.22 H new ATOM 2114 N HIS A 164 -6.996 6.498 -12.207 1.00 65.05 N ATOM 2115 CA HIS A 164 -8.324 7.097 -12.285 1.00 70.43 C ATOM 2116 C HIS A 164 -9.142 6.766 -11.040 1.00 73.23 C ATOM 2117 O HIS A 164 -10.137 6.044 -11.113 1.00 53.15 O ATOM 2118 CB HIS A 164 -9.055 6.610 -13.535 1.00 64.23 C ATOM 2119 CG HIS A 164 -8.980 5.127 -13.732 1.00 43.43 C ATOM 2120 ND1 HIS A 164 -8.044 4.521 -14.543 1.00 31.34 N ATOM 2121 CD2 HIS A 164 -9.732 4.126 -13.216 1.00 44.35 C ATOM 2122 CE1 HIS A 164 -8.224 3.212 -14.519 1.00 34.41 C ATOM 2123 NE2 HIS A 164 -9.242 2.946 -13.721 1.00 75.20 N ATOM 0 H HIS A 164 -6.989 5.528 -11.892 1.00 65.05 H new ATOM 0 HA HIS A 164 -8.205 8.179 -12.343 1.00 70.43 H new ATOM 0 HB2 HIS A 164 -10.102 6.908 -13.473 1.00 64.23 H new ATOM 0 HB3 HIS A 164 -8.634 7.106 -14.409 1.00 64.23 H new ATOM 0 HD2 HIS A 164 -10.563 4.235 -12.534 1.00 44.35 H new ATOM 0 HE1 HIS A 164 -7.638 2.484 -15.060 1.00 34.41 H new ATOM 0 HE2 HIS A 164 -9.605 2.016 -13.513 1.00 75.20 H new ATOM 2130 N HIS A 165 -8.716 7.297 -9.898 1.00 53.15 N ATOM 2131 CA HIS A 165 -9.411 7.058 -8.638 1.00 45.23 C ATOM 2132 C HIS A 165 -9.206 8.223 -7.675 1.00 52.31 C ATOM 2133 O HIS A 165 -9.408 8.086 -6.468 1.00 10.24 O ATOM 2134 CB HIS A 165 -8.916 5.760 -7.998 1.00 62.24 C ATOM 2135 CG HIS A 165 -9.986 4.723 -7.842 1.00 55.44 C ATOM 2136 ND1 HIS A 165 -10.714 4.226 -8.903 1.00 52.21 N ATOM 2137 CD2 HIS A 165 -10.451 4.089 -6.740 1.00 24.21 C ATOM 2138 CE1 HIS A 165 -11.579 3.332 -8.460 1.00 55.21 C ATOM 2139 NE2 HIS A 165 -11.440 3.230 -7.150 1.00 5.40 N ATOM 0 H HIS A 165 -7.894 7.895 -9.819 1.00 53.15 H new ATOM 0 HA HIS A 165 -10.476 6.968 -8.850 1.00 45.23 H new ATOM 0 HB2 HIS A 165 -8.109 5.350 -8.606 1.00 62.24 H new ATOM 0 HB3 HIS A 165 -8.494 5.985 -7.018 1.00 62.24 H new ATOM 0 HD1 HIS A 165 -10.602 4.505 -9.878 1.00 52.21 H new ATOM 0 HD2 HIS A 165 -10.107 4.232 -5.726 1.00 24.21 H new ATOM 0 HE1 HIS A 165 -12.281 2.778 -9.066 1.00 55.21 H new ATOM 2146 N CYS A 166 -8.806 9.368 -8.217 1.00 33.12 N ATOM 2147 CA CYS A 166 -8.572 10.558 -7.405 1.00 70.45 C ATOM 2148 C CYS A 166 -7.417 10.335 -6.436 1.00 35.04 C ATOM 2149 O CYS A 166 -7.220 11.113 -5.501 1.00 14.25 O ATOM 2150 CB CYS A 166 -9.839 10.929 -6.632 1.00 61.40 C ATOM 2151 SG CYS A 166 -11.339 10.954 -7.641 1.00 74.14 S ATOM 0 H CYS A 166 -8.637 9.498 -9.214 1.00 33.12 H new ATOM 0 HA CYS A 166 -8.309 11.379 -8.072 1.00 70.45 H new ATOM 0 HB2 CYS A 166 -9.975 10.219 -5.816 1.00 61.40 H new ATOM 0 HB3 CYS A 166 -9.701 11.911 -6.180 1.00 61.40 H new ATOM 0 HG CYS A 166 -12.356 11.276 -6.898 1.00 74.14 H new ATOM 2156 N ILE A 167 -6.657 9.270 -6.663 1.00 34.23 N ATOM 2157 CA ILE A 167 -5.521 8.947 -5.809 1.00 3.53 C ATOM 2158 C ILE A 167 -4.272 9.706 -6.244 1.00 54.01 C ATOM 2159 O ILE A 167 -3.617 10.359 -5.432 1.00 31.31 O ATOM 2160 CB ILE A 167 -5.219 7.436 -5.822 1.00 1.11 C ATOM 2161 CG1 ILE A 167 -6.425 6.649 -5.305 1.00 24.02 C ATOM 2162 CG2 ILE A 167 -3.986 7.135 -4.984 1.00 1.44 C ATOM 2163 CD1 ILE A 167 -6.668 6.819 -3.822 1.00 54.14 C ATOM 0 H ILE A 167 -6.807 8.616 -7.431 1.00 34.23 H new ATOM 0 HA ILE A 167 -5.792 9.248 -4.797 1.00 3.53 H new ATOM 0 HB ILE A 167 -5.020 7.129 -6.849 1.00 1.11 H new ATOM 0 HG12 ILE A 167 -7.315 6.965 -5.849 1.00 24.02 H new ATOM 0 HG13 ILE A 167 -6.278 5.591 -5.522 1.00 24.02 H new ATOM 0 HG21 ILE A 167 -3.786 6.064 -5.003 1.00 1.44 H new ATOM 0 HG22 ILE A 167 -3.129 7.672 -5.391 1.00 1.44 H new ATOM 0 HG23 ILE A 167 -4.158 7.454 -3.956 1.00 1.44 H new ATOM 0 HD11 ILE A 167 -7.538 6.233 -3.526 1.00 54.14 H new ATOM 0 HD12 ILE A 167 -5.794 6.476 -3.268 1.00 54.14 H new ATOM 0 HD13 ILE A 167 -6.847 7.871 -3.601 1.00 54.14 H new ATOM 2174 N ALA A 168 -3.949 9.617 -7.530 1.00 53.30 N ATOM 2175 CA ALA A 168 -2.781 10.300 -8.073 1.00 53.35 C ATOM 2176 C ALA A 168 -2.771 11.773 -7.675 1.00 65.11 C ATOM 2177 O ALA A 168 -1.829 12.246 -7.041 1.00 75.13 O ATOM 2178 CB ALA A 168 -2.747 10.161 -9.588 1.00 72.23 C ATOM 0 H ALA A 168 -4.480 9.079 -8.215 1.00 53.30 H new ATOM 0 HA ALA A 168 -1.890 9.832 -7.655 1.00 53.35 H new ATOM 0 HB1 ALA A 168 -1.870 10.675 -9.981 1.00 72.23 H new ATOM 0 HB2 ALA A 168 -2.699 9.105 -9.856 1.00 72.23 H new ATOM 0 HB3 ALA A 168 -3.648 10.602 -10.014 1.00 72.23 H new ATOM 2184 N ARG A 169 -3.824 12.490 -8.053 1.00 11.21 N ATOM 2185 CA ARG A 169 -3.934 13.909 -7.736 1.00 43.12 C ATOM 2186 C ARG A 169 -3.716 14.152 -6.246 1.00 54.05 C ATOM 2187 O ARG A 169 -3.008 15.080 -5.855 1.00 41.13 O ATOM 2188 CB ARG A 169 -5.306 14.442 -8.156 1.00 25.42 C ATOM 2189 CG ARG A 169 -5.507 14.487 -9.663 1.00 32.45 C ATOM 2190 CD ARG A 169 -4.599 15.519 -10.314 1.00 71.10 C ATOM 2191 NE ARG A 169 -4.963 15.767 -11.706 1.00 3.10 N ATOM 2192 CZ ARG A 169 -5.999 16.514 -12.074 1.00 21.14 C ATOM 2193 NH1 ARG A 169 -6.766 17.084 -11.156 1.00 55.14 N ATOM 2194 NH2 ARG A 169 -6.266 16.693 -13.360 1.00 44.50 N ATOM 0 H ARG A 169 -4.612 12.112 -8.579 1.00 11.21 H new ATOM 0 HA ARG A 169 -3.160 14.441 -8.290 1.00 43.12 H new ATOM 0 HB2 ARG A 169 -6.081 13.816 -7.713 1.00 25.42 H new ATOM 0 HB3 ARG A 169 -5.436 15.445 -7.750 1.00 25.42 H new ATOM 0 HG2 ARG A 169 -5.306 13.504 -10.088 1.00 32.45 H new ATOM 0 HG3 ARG A 169 -6.547 14.724 -9.886 1.00 32.45 H new ATOM 0 HD2 ARG A 169 -4.651 16.453 -9.754 1.00 71.10 H new ATOM 0 HD3 ARG A 169 -3.566 15.175 -10.265 1.00 71.10 H new ATOM 0 HE ARG A 169 -4.391 15.344 -12.436 1.00 3.10 H new ATOM 0 HH11 ARG A 169 -6.562 16.950 -10.166 1.00 55.14 H new ATOM 0 HH12 ARG A 169 -7.561 17.657 -11.440 1.00 55.14 H new ATOM 0 HH21 ARG A 169 -5.676 16.257 -14.069 1.00 44.50 H new ATOM 0 HH22 ARG A 169 -7.061 17.267 -13.641 1.00 44.50 H new ATOM 2205 N TRP A 170 -4.332 13.314 -5.419 1.00 2.03 N ATOM 2206 CA TRP A 170 -4.206 13.438 -3.972 1.00 23.40 C ATOM 2207 C TRP A 170 -2.740 13.419 -3.549 1.00 54.34 C ATOM 2208 O TRP A 170 -2.265 14.342 -2.887 1.00 15.34 O ATOM 2209 CB TRP A 170 -4.965 12.308 -3.274 1.00 70.42 C ATOM 2210 CG TRP A 170 -4.910 12.390 -1.778 1.00 15.34 C ATOM 2211 CD1 TRP A 170 -5.798 13.026 -0.959 1.00 11.32 C ATOM 2212 CD2 TRP A 170 -3.912 11.818 -0.925 1.00 44.40 C ATOM 2213 NE1 TRP A 170 -5.413 12.884 0.353 1.00 41.22 N ATOM 2214 CE2 TRP A 170 -4.259 12.146 0.400 1.00 53.04 C ATOM 2215 CE3 TRP A 170 -2.761 11.059 -1.151 1.00 42.35 C ATOM 2216 CZ2 TRP A 170 -3.496 11.742 1.491 1.00 1.10 C ATOM 2217 CZ3 TRP A 170 -2.003 10.659 -0.067 1.00 40.14 C ATOM 2218 CH2 TRP A 170 -2.373 11.000 1.241 1.00 64.32 C ATOM 0 H TRP A 170 -4.923 12.542 -5.726 1.00 2.03 H new ATOM 0 HA TRP A 170 -4.638 14.394 -3.676 1.00 23.40 H new ATOM 0 HB2 TRP A 170 -6.007 12.328 -3.594 1.00 70.42 H new ATOM 0 HB3 TRP A 170 -4.552 11.351 -3.594 1.00 70.42 H new ATOM 0 HD1 TRP A 170 -6.674 13.562 -1.293 1.00 11.32 H new ATOM 0 HE1 TRP A 170 -5.906 13.266 1.160 1.00 41.22 H new ATOM 0 HE3 TRP A 170 -2.469 10.790 -2.155 1.00 42.35 H new ATOM 0 HZ2 TRP A 170 -3.780 12.004 2.499 1.00 1.10 H new ATOM 0 HZ3 TRP A 170 -1.110 10.074 -0.231 1.00 40.14 H new ATOM 0 HH2 TRP A 170 -1.761 10.671 2.068 1.00 64.32 H new ATOM 2228 N ILE A 171 -2.032 12.365 -3.935 1.00 3.42 N ATOM 2229 CA ILE A 171 -0.621 12.228 -3.596 1.00 2.53 C ATOM 2230 C ILE A 171 0.175 13.446 -4.054 1.00 53.12 C ATOM 2231 O ILE A 171 1.054 13.930 -3.341 1.00 24.51 O ATOM 2232 CB ILE A 171 -0.010 10.963 -4.228 1.00 3.53 C ATOM 2233 CG1 ILE A 171 -0.564 9.709 -3.550 1.00 42.15 C ATOM 2234 CG2 ILE A 171 1.508 11.000 -4.127 1.00 60.02 C ATOM 2235 CD1 ILE A 171 0.056 8.425 -4.055 1.00 51.22 C ATOM 0 H ILE A 171 -2.411 11.593 -4.483 1.00 3.42 H new ATOM 0 HA ILE A 171 -0.564 12.146 -2.511 1.00 2.53 H new ATOM 0 HB ILE A 171 -0.284 10.934 -5.283 1.00 3.53 H new ATOM 0 HG12 ILE A 171 -0.399 9.784 -2.475 1.00 42.15 H new ATOM 0 HG13 ILE A 171 -1.642 9.668 -3.705 1.00 42.15 H new ATOM 0 HG21 ILE A 171 1.925 10.099 -4.578 1.00 60.02 H new ATOM 0 HG22 ILE A 171 1.886 11.877 -4.652 1.00 60.02 H new ATOM 0 HG23 ILE A 171 1.802 11.050 -3.079 1.00 60.02 H new ATOM 0 HD11 ILE A 171 -0.384 7.577 -3.530 1.00 51.22 H new ATOM 0 HD12 ILE A 171 -0.131 8.327 -5.124 1.00 51.22 H new ATOM 0 HD13 ILE A 171 1.131 8.445 -3.875 1.00 51.22 H new ATOM 2246 N ALA A 172 -0.141 13.938 -5.247 1.00 12.51 N ATOM 2247 CA ALA A 172 0.541 15.103 -5.798 1.00 60.13 C ATOM 2248 C ALA A 172 0.280 16.343 -4.951 1.00 15.30 C ATOM 2249 O ALA A 172 1.143 17.212 -4.825 1.00 2.21 O ATOM 2250 CB ALA A 172 0.102 15.340 -7.236 1.00 32.03 C ATOM 0 H ALA A 172 -0.865 13.548 -5.851 1.00 12.51 H new ATOM 0 HA ALA A 172 1.613 14.906 -5.785 1.00 60.13 H new ATOM 0 HB1 ALA A 172 0.619 16.213 -7.635 1.00 32.03 H new ATOM 0 HB2 ALA A 172 0.346 14.466 -7.840 1.00 32.03 H new ATOM 0 HB3 ALA A 172 -0.974 15.511 -7.264 1.00 32.03 H new ATOM 2256 N GLN A 173 -0.915 16.420 -4.374 1.00 33.01 N ATOM 2257 CA GLN A 173 -1.288 17.557 -3.541 1.00 63.04 C ATOM 2258 C GLN A 173 -0.565 17.508 -2.199 1.00 54.30 C ATOM 2259 O GLN A 173 -0.211 18.545 -1.637 1.00 11.44 O ATOM 2260 CB GLN A 173 -2.801 17.576 -3.317 1.00 65.03 C ATOM 2261 CG GLN A 173 -3.592 18.009 -4.541 1.00 34.32 C ATOM 2262 CD GLN A 173 -3.073 19.300 -5.143 1.00 4.32 C ATOM 2263 OE1 GLN A 173 -2.799 20.282 -4.293 1.00 14.31 O flip ATOM 2264 NE2 GLN A 173 -2.920 19.412 -6.360 1.00 15.43 N flip ATOM 0 H GLN A 173 -1.641 15.709 -4.468 1.00 33.01 H new ATOM 0 HA GLN A 173 -0.992 18.469 -4.060 1.00 63.04 H new ATOM 0 HB2 GLN A 173 -3.128 16.580 -3.017 1.00 65.03 H new ATOM 0 HB3 GLN A 173 -3.029 18.249 -2.491 1.00 65.03 H new ATOM 0 HG2 GLN A 173 -3.553 17.220 -5.292 1.00 34.32 H new ATOM 0 HG3 GLN A 173 -4.639 18.136 -4.266 1.00 34.32 H new ATOM 0 HE21 GLN A 173 -3.144 18.631 -6.976 1.00 15.43 H new ATOM 0 HE22 GLN A 173 -2.570 20.286 -6.752 1.00 15.43 H new ATOM 2271 N ARG A 174 -0.349 16.300 -1.691 1.00 44.22 N ATOM 2272 CA ARG A 174 0.332 16.118 -0.415 1.00 71.11 C ATOM 2273 C ARG A 174 1.837 16.314 -0.568 1.00 50.34 C ATOM 2274 O ARG A 174 2.580 16.286 0.412 1.00 5.41 O ATOM 2275 CB ARG A 174 0.043 14.725 0.147 1.00 61.34 C ATOM 2276 CG ARG A 174 -1.440 14.414 0.274 1.00 11.05 C ATOM 2277 CD ARG A 174 -1.975 14.807 1.643 1.00 63.25 C ATOM 2278 NE ARG A 174 -2.306 16.227 1.714 1.00 34.24 N ATOM 2279 CZ ARG A 174 -2.420 16.898 2.856 1.00 71.14 C ATOM 2280 NH1 ARG A 174 -2.233 16.280 4.013 1.00 33.20 N ATOM 2281 NH2 ARG A 174 -2.723 18.190 2.839 1.00 1.00 N ATOM 0 H ARG A 174 -0.636 15.432 -2.144 1.00 44.22 H new ATOM 0 HA ARG A 174 -0.045 16.869 0.279 1.00 71.11 H new ATOM 0 HB2 ARG A 174 0.508 13.979 -0.497 1.00 61.34 H new ATOM 0 HB3 ARG A 174 0.510 14.634 1.128 1.00 61.34 H new ATOM 0 HG2 ARG A 174 -1.992 14.946 -0.501 1.00 11.05 H new ATOM 0 HG3 ARG A 174 -1.605 13.349 0.109 1.00 11.05 H new ATOM 0 HD2 ARG A 174 -2.863 14.216 1.869 1.00 63.25 H new ATOM 0 HD3 ARG A 174 -1.232 14.569 2.404 1.00 63.25 H new ATOM 0 HE ARG A 174 -2.458 16.731 0.841 1.00 34.24 H new ATOM 0 HH11 ARG A 174 -2.001 15.287 4.029 1.00 33.20 H new ATOM 0 HH12 ARG A 174 -2.321 16.797 4.888 1.00 33.20 H new ATOM 0 HH21 ARG A 174 -2.868 18.668 1.950 1.00 1.00 H new ATOM 0 HH22 ARG A 174 -2.811 18.705 3.715 1.00 1.00 H new ATOM 2292 N GLY A 175 2.280 16.511 -1.807 1.00 35.41 N ATOM 2293 CA GLY A 175 3.695 16.708 -2.066 1.00 73.22 C ATOM 2294 C GLY A 175 4.342 15.493 -2.699 1.00 13.20 C ATOM 2295 O GLY A 175 5.492 15.169 -2.404 1.00 15.43 O ATOM 0 H GLY A 175 1.685 16.538 -2.635 1.00 35.41 H new ATOM 0 HA2 GLY A 175 3.825 17.569 -2.722 1.00 73.22 H new ATOM 0 HA3 GLY A 175 4.204 16.941 -1.131 1.00 73.22 H new ATOM 2299 N GLY A 176 3.602 14.818 -3.572 1.00 41.33 N ATOM 2300 CA GLY A 176 4.127 13.638 -4.235 1.00 31.24 C ATOM 2301 C GLY A 176 4.675 12.619 -3.255 1.00 32.44 C ATOM 2302 O GLY A 176 4.554 12.788 -2.042 1.00 31.51 O ATOM 0 H GLY A 176 2.648 15.067 -3.833 1.00 41.33 H new ATOM 0 HA2 GLY A 176 3.338 13.178 -4.830 1.00 31.24 H new ATOM 0 HA3 GLY A 176 4.916 13.934 -4.926 1.00 31.24 H new ATOM 2306 N TRP A 177 5.278 11.559 -3.781 1.00 12.03 N ATOM 2307 CA TRP A 177 5.845 10.509 -2.944 1.00 11.14 C ATOM 2308 C TRP A 177 7.088 11.007 -2.212 1.00 43.24 C ATOM 2309 O TRP A 177 7.608 10.333 -1.323 1.00 64.42 O ATOM 2310 CB TRP A 177 6.195 9.285 -3.792 1.00 72.12 C ATOM 2311 CG TRP A 177 4.994 8.489 -4.209 1.00 11.25 C ATOM 2312 CD1 TRP A 177 4.337 8.563 -5.404 1.00 22.55 C ATOM 2313 CD2 TRP A 177 4.308 7.503 -3.432 1.00 25.35 C ATOM 2314 NE1 TRP A 177 3.284 7.681 -5.415 1.00 40.14 N ATOM 2315 CE2 TRP A 177 3.245 7.018 -4.218 1.00 73.00 C ATOM 2316 CE3 TRP A 177 4.490 6.979 -2.148 1.00 32.04 C ATOM 2317 CZ2 TRP A 177 2.368 6.037 -3.761 1.00 12.31 C ATOM 2318 CZ3 TRP A 177 3.619 6.006 -1.696 1.00 32.10 C ATOM 2319 CH2 TRP A 177 2.569 5.543 -2.501 1.00 1.54 C ATOM 0 H TRP A 177 5.387 11.404 -4.783 1.00 12.03 H new ATOM 0 HA TRP A 177 5.097 10.227 -2.203 1.00 11.14 H new ATOM 0 HB2 TRP A 177 6.734 9.610 -4.682 1.00 72.12 H new ATOM 0 HB3 TRP A 177 6.871 8.642 -3.228 1.00 72.12 H new ATOM 0 HD1 TRP A 177 4.606 9.218 -6.220 1.00 22.55 H new ATOM 0 HE1 TRP A 177 2.636 7.542 -6.190 1.00 40.14 H new ATOM 0 HE3 TRP A 177 5.297 7.329 -1.521 1.00 32.04 H new ATOM 0 HZ2 TRP A 177 1.558 5.679 -4.379 1.00 12.31 H new ATOM 0 HZ3 TRP A 177 3.749 5.595 -0.706 1.00 32.10 H new ATOM 0 HH2 TRP A 177 1.906 4.781 -2.119 1.00 1.54 H new ATOM 2329 N VAL A 178 7.558 12.190 -2.592 1.00 1.34 N ATOM 2330 CA VAL A 178 8.740 12.778 -1.971 1.00 74.24 C ATOM 2331 C VAL A 178 8.446 13.220 -0.542 1.00 71.32 C ATOM 2332 O VAL A 178 9.352 13.596 0.201 1.00 31.33 O ATOM 2333 CB VAL A 178 9.252 13.988 -2.775 1.00 25.25 C ATOM 2334 CG1 VAL A 178 10.613 14.432 -2.260 1.00 13.02 C ATOM 2335 CG2 VAL A 178 9.318 13.653 -4.257 1.00 22.33 C ATOM 0 H VAL A 178 7.139 12.761 -3.326 1.00 1.34 H new ATOM 0 HA VAL A 178 9.510 12.006 -1.959 1.00 74.24 H new ATOM 0 HB VAL A 178 8.552 14.813 -2.643 1.00 25.25 H new ATOM 0 HG11 VAL A 178 10.960 15.288 -2.839 1.00 13.02 H new ATOM 0 HG12 VAL A 178 10.531 14.714 -1.210 1.00 13.02 H new ATOM 0 HG13 VAL A 178 11.325 13.613 -2.361 1.00 13.02 H new ATOM 0 HG21 VAL A 178 9.682 14.519 -4.810 1.00 22.33 H new ATOM 0 HG22 VAL A 178 9.996 12.814 -4.410 1.00 22.33 H new ATOM 0 HG23 VAL A 178 8.323 13.386 -4.614 1.00 22.33 H new ATOM 2345 N ALA A 179 7.173 13.170 -0.162 1.00 50.33 N ATOM 2346 CA ALA A 179 6.760 13.562 1.180 1.00 53.43 C ATOM 2347 C ALA A 179 6.432 12.341 2.032 1.00 62.02 C ATOM 2348 O ALA A 179 6.036 12.469 3.190 1.00 54.12 O ATOM 2349 CB ALA A 179 5.561 14.497 1.110 1.00 35.33 C ATOM 0 H ALA A 179 6.410 12.862 -0.765 1.00 50.33 H new ATOM 0 HA ALA A 179 7.591 14.088 1.651 1.00 53.43 H new ATOM 0 HB1 ALA A 179 5.263 14.782 2.119 1.00 35.33 H new ATOM 0 HB2 ALA A 179 5.828 15.390 0.545 1.00 35.33 H new ATOM 0 HB3 ALA A 179 4.732 13.990 0.616 1.00 35.33 H new ATOM 2355 N ALA A 180 6.599 11.158 1.451 1.00 3.34 N ATOM 2356 CA ALA A 180 6.322 9.914 2.159 1.00 62.10 C ATOM 2357 C ALA A 180 7.451 9.568 3.124 1.00 10.11 C ATOM 2358 O ALA A 180 7.230 8.918 4.147 1.00 4.15 O ATOM 2359 CB ALA A 180 6.107 8.780 1.168 1.00 42.41 C ATOM 0 H ALA A 180 6.925 11.035 0.492 1.00 3.34 H new ATOM 0 HA ALA A 180 5.411 10.051 2.741 1.00 62.10 H new ATOM 0 HB1 ALA A 180 5.901 7.857 1.710 1.00 42.41 H new ATOM 0 HB2 ALA A 180 5.262 9.017 0.521 1.00 42.41 H new ATOM 0 HB3 ALA A 180 7.003 8.652 0.561 1.00 42.41 H new ATOM 2365 N LEU A 181 8.661 10.006 2.793 1.00 41.43 N ATOM 2366 CA LEU A 181 9.825 9.741 3.630 1.00 35.33 C ATOM 2367 C LEU A 181 9.873 10.701 4.815 1.00 72.22 C ATOM 2368 O LEU A 181 10.763 10.616 5.660 1.00 33.14 O ATOM 2369 CB LEU A 181 11.109 9.866 2.808 1.00 42.42 C ATOM 2370 CG LEU A 181 11.182 11.058 1.853 1.00 21.31 C ATOM 2371 CD1 LEU A 181 10.494 10.730 0.537 1.00 1.44 C ATOM 2372 CD2 LEU A 181 10.556 12.291 2.491 1.00 5.53 C ATOM 0 H LEU A 181 8.861 10.546 1.951 1.00 41.43 H new ATOM 0 HA LEU A 181 9.742 8.723 4.012 1.00 35.33 H new ATOM 0 HB2 LEU A 181 11.953 9.925 3.496 1.00 42.42 H new ATOM 0 HB3 LEU A 181 11.235 8.952 2.227 1.00 42.42 H new ATOM 0 HG LEU A 181 12.231 11.272 1.648 1.00 21.31 H new ATOM 0 HD11 LEU A 181 10.556 11.590 -0.130 1.00 1.44 H new ATOM 0 HD12 LEU A 181 10.985 9.875 0.073 1.00 1.44 H new ATOM 0 HD13 LEU A 181 9.447 10.490 0.724 1.00 1.44 H new ATOM 0 HD21 LEU A 181 10.617 13.130 1.798 1.00 5.53 H new ATOM 0 HD22 LEU A 181 9.511 12.089 2.725 1.00 5.53 H new ATOM 0 HD23 LEU A 181 11.092 12.538 3.407 1.00 5.53 H new ATOM 2383 N ASN A 182 8.907 11.613 4.870 1.00 60.50 N ATOM 2384 CA ASN A 182 8.838 12.587 5.953 1.00 74.51 C ATOM 2385 C ASN A 182 7.665 12.287 6.883 1.00 5.43 C ATOM 2386 O ASN A 182 7.269 13.126 7.693 1.00 25.44 O ATOM 2387 CB ASN A 182 8.703 14.002 5.386 1.00 54.02 C ATOM 2388 CG ASN A 182 10.047 14.665 5.159 1.00 44.34 C ATOM 2389 OD1 ASN A 182 10.996 14.442 5.910 1.00 52.30 O ATOM 2390 ND2 ASN A 182 10.134 15.486 4.119 1.00 43.32 N ATOM 0 H ASN A 182 8.162 11.697 4.178 1.00 60.50 H new ATOM 0 HA ASN A 182 9.761 12.518 6.528 1.00 74.51 H new ATOM 0 HB2 ASN A 182 8.157 13.962 4.443 1.00 54.02 H new ATOM 0 HB3 ASN A 182 8.112 14.610 6.071 1.00 54.02 H new ATOM 0 HD21 ASN A 182 11.014 15.961 3.917 1.00 43.32 H new ATOM 0 HD22 ASN A 182 9.321 15.641 3.523 1.00 43.32 H new ATOM 2396 N LEU A 183 7.114 11.084 6.760 1.00 51.30 N ATOM 2397 CA LEU A 183 5.987 10.671 7.589 1.00 2.24 C ATOM 2398 C LEU A 183 6.472 9.995 8.867 1.00 32.30 C ATOM 2399 O LEU A 183 7.673 9.885 9.107 1.00 63.43 O ATOM 2400 CB LEU A 183 5.077 9.720 6.810 1.00 3.43 C ATOM 2401 CG LEU A 183 4.440 10.289 5.540 1.00 24.35 C ATOM 2402 CD1 LEU A 183 3.459 9.293 4.943 1.00 12.44 C ATOM 2403 CD2 LEU A 183 3.748 11.610 5.839 1.00 54.32 C ATOM 0 H LEU A 183 7.429 10.378 6.095 1.00 51.30 H new ATOM 0 HA LEU A 183 5.422 11.562 7.862 1.00 2.24 H new ATOM 0 HB2 LEU A 183 5.655 8.837 6.538 1.00 3.43 H new ATOM 0 HB3 LEU A 183 4.280 9.387 7.474 1.00 3.43 H new ATOM 0 HG LEU A 183 5.228 10.472 4.810 1.00 24.35 H new ATOM 0 HD11 LEU A 183 3.016 9.715 4.041 1.00 12.44 H new ATOM 0 HD12 LEU A 183 3.984 8.371 4.693 1.00 12.44 H new ATOM 0 HD13 LEU A 183 2.673 9.078 5.667 1.00 12.44 H new ATOM 0 HD21 LEU A 183 3.300 12.001 4.925 1.00 54.32 H new ATOM 0 HD22 LEU A 183 2.970 11.452 6.586 1.00 54.32 H new ATOM 0 HD23 LEU A 183 4.477 12.325 6.220 1.00 54.32 H new ATOM 2414 N GLY A 184 5.526 9.542 9.686 1.00 51.32 N ATOM 2415 CA GLY A 184 5.876 8.881 10.930 1.00 45.32 C ATOM 2416 C GLY A 184 6.736 9.750 11.826 1.00 1.10 C ATOM 2417 O GLY A 184 6.233 10.652 12.493 1.00 32.32 O ATOM 0 H GLY A 184 4.524 9.621 9.510 1.00 51.32 H new ATOM 0 HA2 GLY A 184 4.965 8.607 11.461 1.00 45.32 H new ATOM 0 HA3 GLY A 184 6.407 7.955 10.709 1.00 45.32 H new ATOM 2421 N ASN A 185 8.036 9.476 11.843 1.00 1.53 N ATOM 2422 CA ASN A 185 8.968 10.238 12.666 1.00 73.30 C ATOM 2423 C ASN A 185 9.699 11.285 11.832 1.00 20.43 C ATOM 2424 O ASN A 185 10.745 11.793 12.235 1.00 51.20 O ATOM 2425 CB ASN A 185 9.978 9.301 13.331 1.00 22.20 C ATOM 2426 CG ASN A 185 10.768 9.987 14.428 1.00 74.42 C ATOM 2427 OD1 ASN A 185 10.196 10.513 15.384 1.00 1.04 O ATOM 2428 ND2 ASN A 185 12.089 9.986 14.296 1.00 51.31 N ATOM 0 H ASN A 185 8.468 8.732 11.296 1.00 1.53 H new ATOM 0 HA ASN A 185 8.396 10.751 13.439 1.00 73.30 H new ATOM 0 HB2 ASN A 185 9.452 8.442 13.748 1.00 22.20 H new ATOM 0 HB3 ASN A 185 10.666 8.918 12.577 1.00 22.20 H new ATOM 0 HD21 ASN A 185 12.673 10.433 15.003 1.00 51.31 H new ATOM 0 HD22 ASN A 185 12.520 9.538 13.487 1.00 51.31 H new ATOM 2434 N GLY A 186 9.141 11.604 10.669 1.00 4.35 N ATOM 2435 CA GLY A 186 9.754 12.588 9.797 1.00 73.03 C ATOM 2436 C GLY A 186 10.760 11.973 8.844 1.00 30.13 C ATOM 2437 O GLY A 186 11.410 10.995 9.209 1.00 11.24 O ATOM 0 H GLY A 186 8.275 11.198 10.315 1.00 4.35 H new ATOM 0 HA2 GLY A 186 8.978 13.094 9.223 1.00 73.03 H new ATOM 0 HA3 GLY A 186 10.249 13.347 10.403 1.00 73.03 H new TER 2441 GLY A 186 ATOM 2442 N GLU B 80 -18.535 -14.783 -1.438 1.00 31.42 N ATOM 2443 CA GLU B 80 -19.461 -13.682 -1.206 1.00 14.44 C ATOM 2444 C GLU B 80 -19.223 -13.050 0.162 1.00 31.51 C ATOM 2445 O GLU B 80 -18.838 -11.885 0.262 1.00 21.11 O ATOM 2446 CB GLU B 80 -20.907 -14.170 -1.311 1.00 24.25 C ATOM 2447 CG GLU B 80 -21.798 -13.261 -2.140 1.00 71.33 C ATOM 2448 CD GLU B 80 -23.206 -13.804 -2.291 1.00 3.31 C ATOM 2449 OE1 GLU B 80 -23.349 -14.984 -2.673 1.00 11.10 O ATOM 2450 OE2 GLU B 80 -24.164 -13.049 -2.026 1.00 14.42 O ATOM 0 HA GLU B 80 -19.285 -12.926 -1.972 1.00 14.44 H new ATOM 0 HB2 GLU B 80 -20.914 -15.168 -1.748 1.00 24.25 H new ATOM 0 HB3 GLU B 80 -21.325 -14.259 -0.308 1.00 24.25 H new ATOM 0 HG2 GLU B 80 -21.840 -12.277 -1.674 1.00 71.33 H new ATOM 0 HG3 GLU B 80 -21.356 -13.128 -3.127 1.00 71.33 H new ATOM 2455 N ASP B 81 -19.457 -13.827 1.215 1.00 55.41 N ATOM 2456 CA ASP B 81 -19.269 -13.345 2.578 1.00 41.50 C ATOM 2457 C ASP B 81 -17.876 -12.747 2.756 1.00 41.31 C ATOM 2458 O ASP B 81 -17.678 -11.844 3.569 1.00 2.42 O ATOM 2459 CB ASP B 81 -19.479 -14.484 3.577 1.00 71.41 C ATOM 2460 CG ASP B 81 -20.175 -14.022 4.843 1.00 51.33 C ATOM 2461 OD1 ASP B 81 -19.757 -12.989 5.407 1.00 43.35 O ATOM 2462 OD2 ASP B 81 -21.138 -14.692 5.268 1.00 63.33 O ATOM 0 H ASP B 81 -19.777 -14.793 1.150 1.00 55.41 H new ATOM 0 HA ASP B 81 -20.007 -12.565 2.766 1.00 41.50 H new ATOM 0 HB2 ASP B 81 -20.069 -15.271 3.108 1.00 71.41 H new ATOM 0 HB3 ASP B 81 -18.514 -14.920 3.835 1.00 71.41 H new ATOM 2466 N ILE B 82 -16.917 -13.257 1.990 1.00 13.41 N ATOM 2467 CA ILE B 82 -15.544 -12.773 2.063 1.00 74.31 C ATOM 2468 C ILE B 82 -15.400 -11.422 1.371 1.00 3.44 C ATOM 2469 O ILE B 82 -14.609 -10.578 1.793 1.00 41.11 O ATOM 2470 CB ILE B 82 -14.561 -13.772 1.426 1.00 12.15 C ATOM 2471 CG1 ILE B 82 -14.843 -15.189 1.927 1.00 42.32 C ATOM 2472 CG2 ILE B 82 -13.125 -13.371 1.735 1.00 42.54 C ATOM 2473 CD1 ILE B 82 -13.946 -16.239 1.308 1.00 50.21 C ATOM 0 H ILE B 82 -17.066 -14.005 1.312 1.00 13.41 H new ATOM 0 HA ILE B 82 -15.303 -12.664 3.120 1.00 74.31 H new ATOM 0 HB ILE B 82 -14.699 -13.756 0.345 1.00 12.15 H new ATOM 0 HG12 ILE B 82 -14.723 -15.213 3.010 1.00 42.32 H new ATOM 0 HG13 ILE B 82 -15.882 -15.440 1.716 1.00 42.32 H new ATOM 0 HG21 ILE B 82 -12.441 -14.086 1.278 1.00 42.54 H new ATOM 0 HG22 ILE B 82 -12.931 -12.376 1.334 1.00 42.54 H new ATOM 0 HG23 ILE B 82 -12.974 -13.363 2.814 1.00 42.54 H new ATOM 0 HD11 ILE B 82 -14.203 -17.219 1.710 1.00 50.21 H new ATOM 0 HD12 ILE B 82 -14.083 -16.243 0.227 1.00 50.21 H new ATOM 0 HD13 ILE B 82 -12.906 -16.012 1.541 1.00 50.21 H new ATOM 2484 N ILE B 83 -16.171 -11.224 0.307 1.00 11.24 N ATOM 2485 CA ILE B 83 -16.131 -9.974 -0.443 1.00 4.02 C ATOM 2486 C ILE B 83 -16.500 -8.790 0.444 1.00 73.04 C ATOM 2487 O ILE B 83 -16.010 -7.678 0.248 1.00 13.44 O ATOM 2488 CB ILE B 83 -17.083 -10.012 -1.653 1.00 64.55 C ATOM 2489 CG1 ILE B 83 -16.801 -11.245 -2.513 1.00 23.44 C ATOM 2490 CG2 ILE B 83 -16.944 -8.741 -2.478 1.00 20.43 C ATOM 2491 CD1 ILE B 83 -15.380 -11.310 -3.029 1.00 21.32 C ATOM 0 H ILE B 83 -16.831 -11.913 -0.055 1.00 11.24 H new ATOM 0 HA ILE B 83 -15.108 -9.853 -0.801 1.00 4.02 H new ATOM 0 HB ILE B 83 -18.108 -10.074 -1.287 1.00 64.55 H new ATOM 0 HG12 ILE B 83 -17.008 -12.141 -1.928 1.00 23.44 H new ATOM 0 HG13 ILE B 83 -17.487 -11.252 -3.360 1.00 23.44 H new ATOM 0 HG21 ILE B 83 -17.623 -8.784 -3.329 1.00 20.43 H new ATOM 0 HG22 ILE B 83 -17.190 -7.877 -1.860 1.00 20.43 H new ATOM 0 HG23 ILE B 83 -15.919 -8.650 -2.836 1.00 20.43 H new ATOM 0 HD11 ILE B 83 -15.252 -12.210 -3.631 1.00 21.32 H new ATOM 0 HD12 ILE B 83 -15.175 -10.432 -3.641 1.00 21.32 H new ATOM 0 HD13 ILE B 83 -14.688 -11.335 -2.187 1.00 21.32 H new ATOM 2502 N ARG B 84 -17.368 -9.036 1.419 1.00 74.33 N ATOM 2503 CA ARG B 84 -17.804 -7.989 2.337 1.00 5.32 C ATOM 2504 C ARG B 84 -16.831 -7.852 3.505 1.00 53.33 C ATOM 2505 O ARG B 84 -16.603 -6.752 4.009 1.00 42.35 O ATOM 2506 CB ARG B 84 -19.208 -8.294 2.862 1.00 62.13 C ATOM 2507 CG ARG B 84 -20.157 -8.817 1.796 1.00 1.32 C ATOM 2508 CD ARG B 84 -21.604 -8.493 2.131 1.00 41.45 C ATOM 2509 NE ARG B 84 -21.928 -8.805 3.520 1.00 2.35 N ATOM 2510 CZ ARG B 84 -23.017 -8.361 4.139 1.00 62.21 C ATOM 2511 NH1 ARG B 84 -23.882 -7.592 3.494 1.00 73.31 N ATOM 2512 NH2 ARG B 84 -23.242 -8.689 5.405 1.00 2.41 N ATOM 0 H ARG B 84 -17.784 -9.951 1.594 1.00 74.33 H new ATOM 0 HA ARG B 84 -17.825 -7.046 1.791 1.00 5.32 H new ATOM 0 HB2 ARG B 84 -19.135 -9.029 3.664 1.00 62.13 H new ATOM 0 HB3 ARG B 84 -19.629 -7.388 3.298 1.00 62.13 H new ATOM 0 HG2 ARG B 84 -19.899 -8.380 0.831 1.00 1.32 H new ATOM 0 HG3 ARG B 84 -20.038 -9.896 1.699 1.00 1.32 H new ATOM 0 HD2 ARG B 84 -21.791 -7.436 1.944 1.00 41.45 H new ATOM 0 HD3 ARG B 84 -22.264 -9.055 1.470 1.00 41.45 H new ATOM 0 HE ARG B 84 -21.283 -9.396 4.044 1.00 2.35 H new ATOM 0 HH11 ARG B 84 -23.713 -7.340 2.520 1.00 73.31 H new ATOM 0 HH12 ARG B 84 -24.717 -7.252 3.971 1.00 73.31 H new ATOM 0 HH21 ARG B 84 -22.579 -9.282 5.904 1.00 2.41 H new ATOM 0 HH22 ARG B 84 -24.078 -8.348 5.879 1.00 2.41 H new ATOM 2523 N ASN B 85 -16.263 -8.974 3.930 1.00 5.43 N ATOM 2524 CA ASN B 85 -15.315 -8.979 5.039 1.00 34.22 C ATOM 2525 C ASN B 85 -14.005 -8.307 4.638 1.00 65.03 C ATOM 2526 O ASN B 85 -13.496 -7.441 5.350 1.00 75.03 O ATOM 2527 CB ASN B 85 -15.046 -10.412 5.502 1.00 53.21 C ATOM 2528 CG ASN B 85 -15.828 -10.772 6.750 1.00 34.53 C ATOM 2529 OD1 ASN B 85 -16.077 -9.923 7.607 1.00 72.44 O ATOM 2530 ND2 ASN B 85 -16.218 -12.037 6.861 1.00 11.51 N ATOM 0 H ASN B 85 -16.442 -9.892 3.524 1.00 5.43 H new ATOM 0 HA ASN B 85 -15.755 -8.416 5.862 1.00 34.22 H new ATOM 0 HB2 ASN B 85 -15.306 -11.105 4.701 1.00 53.21 H new ATOM 0 HB3 ASN B 85 -13.980 -10.534 5.696 1.00 53.21 H new ATOM 0 HD21 ASN B 85 -16.746 -12.338 7.680 1.00 11.51 H new ATOM 0 HD22 ASN B 85 -15.990 -12.707 6.127 1.00 11.51 H new ATOM 2536 N ILE B 86 -13.464 -8.714 3.495 1.00 44.32 N ATOM 2537 CA ILE B 86 -12.214 -8.152 2.998 1.00 33.11 C ATOM 2538 C ILE B 86 -12.258 -6.628 3.003 1.00 1.40 C ATOM 2539 O ILE B 86 -11.246 -5.968 3.237 1.00 2.42 O ATOM 2540 CB ILE B 86 -11.904 -8.642 1.572 1.00 11.43 C ATOM 2541 CG1 ILE B 86 -10.451 -8.329 1.206 1.00 70.22 C ATOM 2542 CG2 ILE B 86 -12.856 -8.001 0.573 1.00 53.24 C ATOM 2543 CD1 ILE B 86 -9.976 -9.036 -0.044 1.00 72.21 C ATOM 0 H ILE B 86 -13.872 -9.431 2.895 1.00 44.32 H new ATOM 0 HA ILE B 86 -11.425 -8.493 3.669 1.00 33.11 H new ATOM 0 HB ILE B 86 -12.044 -9.722 1.537 1.00 11.43 H new ATOM 0 HG12 ILE B 86 -10.343 -7.253 1.068 1.00 70.22 H new ATOM 0 HG13 ILE B 86 -9.807 -8.609 2.039 1.00 70.22 H new ATOM 0 HG21 ILE B 86 -12.624 -8.357 -0.431 1.00 53.24 H new ATOM 0 HG22 ILE B 86 -13.882 -8.269 0.825 1.00 53.24 H new ATOM 0 HG23 ILE B 86 -12.745 -6.917 0.608 1.00 53.24 H new ATOM 0 HD11 ILE B 86 -8.938 -8.767 -0.242 1.00 72.21 H new ATOM 0 HD12 ILE B 86 -10.051 -10.114 0.097 1.00 72.21 H new ATOM 0 HD13 ILE B 86 -10.596 -8.737 -0.889 1.00 72.21 H new ATOM 2554 N ALA B 87 -13.438 -6.074 2.745 1.00 3.50 N ATOM 2555 CA ALA B 87 -13.615 -4.627 2.722 1.00 71.04 C ATOM 2556 C ALA B 87 -14.058 -4.107 4.086 1.00 23.02 C ATOM 2557 O ALA B 87 -13.810 -2.951 4.430 1.00 72.24 O ATOM 2558 CB ALA B 87 -14.624 -4.235 1.654 1.00 4.53 C ATOM 0 H ALA B 87 -14.286 -6.606 2.549 1.00 3.50 H new ATOM 0 HA ALA B 87 -12.654 -4.172 2.482 1.00 71.04 H new ATOM 0 HB1 ALA B 87 -14.746 -3.152 1.649 1.00 4.53 H new ATOM 0 HB2 ALA B 87 -14.268 -4.565 0.678 1.00 4.53 H new ATOM 0 HB3 ALA B 87 -15.583 -4.707 1.869 1.00 4.53 H new ATOM 2564 N ARG B 88 -14.712 -4.969 4.858 1.00 55.34 N ATOM 2565 CA ARG B 88 -15.191 -4.594 6.184 1.00 2.43 C ATOM 2566 C ARG B 88 -14.027 -4.434 7.156 1.00 32.14 C ATOM 2567 O ARG B 88 -13.906 -3.412 7.834 1.00 73.24 O ATOM 2568 CB ARG B 88 -16.169 -5.646 6.711 1.00 12.11 C ATOM 2569 CG ARG B 88 -16.693 -5.345 8.106 1.00 21.14 C ATOM 2570 CD ARG B 88 -16.228 -6.386 9.112 1.00 3.43 C ATOM 2571 NE ARG B 88 -15.004 -5.979 9.796 1.00 12.33 N ATOM 2572 CZ ARG B 88 -14.958 -5.016 10.710 1.00 3.34 C ATOM 2573 NH1 ARG B 88 -16.063 -4.365 11.048 1.00 20.44 N ATOM 2574 NH2 ARG B 88 -13.805 -4.703 11.288 1.00 11.42 N ATOM 0 H ARG B 88 -14.922 -5.930 4.589 1.00 55.34 H new ATOM 0 HA ARG B 88 -15.707 -3.637 6.101 1.00 2.43 H new ATOM 0 HB2 ARG B 88 -17.012 -5.723 6.024 1.00 12.11 H new ATOM 0 HB3 ARG B 88 -15.675 -6.618 6.719 1.00 12.11 H new ATOM 0 HG2 ARG B 88 -16.353 -4.358 8.419 1.00 21.14 H new ATOM 0 HG3 ARG B 88 -17.782 -5.316 8.088 1.00 21.14 H new ATOM 0 HD2 ARG B 88 -17.015 -6.556 9.847 1.00 3.43 H new ATOM 0 HD3 ARG B 88 -16.059 -7.334 8.601 1.00 3.43 H new ATOM 0 HE ARG B 88 -14.137 -6.460 9.559 1.00 12.33 H new ATOM 0 HH11 ARG B 88 -16.951 -4.603 10.606 1.00 20.44 H new ATOM 0 HH12 ARG B 88 -16.025 -3.626 11.750 1.00 20.44 H new ATOM 0 HH21 ARG B 88 -12.953 -5.202 11.031 1.00 11.42 H new ATOM 0 HH22 ARG B 88 -13.770 -3.963 11.990 1.00 11.42 H new ATOM 2585 N HIS B 89 -13.172 -5.450 7.221 1.00 34.34 N ATOM 2586 CA HIS B 89 -12.016 -5.421 8.112 1.00 42.22 C ATOM 2587 C HIS B 89 -11.050 -4.311 7.711 1.00 25.14 C ATOM 2588 O HIS B 89 -10.165 -3.935 8.482 1.00 71.44 O ATOM 2589 CB HIS B 89 -11.298 -6.770 8.093 1.00 43.11 C ATOM 2590 CG HIS B 89 -11.067 -7.346 9.456 1.00 41.43 C ATOM 2591 ND1 HIS B 89 -11.878 -8.312 10.012 1.00 72.43 N ATOM 2592 CD2 HIS B 89 -10.108 -7.086 10.376 1.00 63.05 C ATOM 2593 CE1 HIS B 89 -11.430 -8.621 11.216 1.00 1.30 C ATOM 2594 NE2 HIS B 89 -10.356 -7.892 11.460 1.00 60.24 N ATOM 0 H HIS B 89 -13.257 -6.303 6.668 1.00 34.34 H new ATOM 0 HA HIS B 89 -12.371 -5.222 9.123 1.00 42.22 H new ATOM 0 HB2 HIS B 89 -11.884 -7.476 7.504 1.00 43.11 H new ATOM 0 HB3 HIS B 89 -10.338 -6.654 7.589 1.00 43.11 H new ATOM 0 HD2 HIS B 89 -9.299 -6.377 10.276 1.00 63.05 H new ATOM 0 HE1 HIS B 89 -11.867 -9.346 11.886 1.00 1.30 H new ATOM 0 HE2 HIS B 89 -9.801 -7.923 12.315 1.00 60.24 H new ATOM 2601 N LEU B 90 -11.222 -3.790 6.502 1.00 43.34 N ATOM 2602 CA LEU B 90 -10.364 -2.723 5.998 1.00 40.32 C ATOM 2603 C LEU B 90 -10.901 -1.356 6.406 1.00 15.24 C ATOM 2604 O LEU B 90 -10.751 -0.376 5.676 1.00 11.11 O ATOM 2605 CB LEU B 90 -10.253 -2.807 4.475 1.00 53.25 C ATOM 2606 CG LEU B 90 -9.294 -3.864 3.928 1.00 63.41 C ATOM 2607 CD1 LEU B 90 -9.370 -3.921 2.410 1.00 14.32 C ATOM 2608 CD2 LEU B 90 -7.870 -3.577 4.383 1.00 52.45 C ATOM 0 H LEU B 90 -11.948 -4.089 5.851 1.00 43.34 H new ATOM 0 HA LEU B 90 -9.373 -2.849 6.435 1.00 40.32 H new ATOM 0 HB2 LEU B 90 -11.246 -3.001 4.069 1.00 53.25 H new ATOM 0 HB3 LEU B 90 -9.940 -1.833 4.100 1.00 53.25 H new ATOM 0 HG LEU B 90 -9.592 -4.836 4.322 1.00 63.41 H new ATOM 0 HD11 LEU B 90 -8.680 -4.679 2.039 1.00 14.32 H new ATOM 0 HD12 LEU B 90 -10.386 -4.175 2.106 1.00 14.32 H new ATOM 0 HD13 LEU B 90 -9.099 -2.950 1.995 1.00 14.32 H new ATOM 0 HD21 LEU B 90 -7.200 -4.339 3.985 1.00 52.45 H new ATOM 0 HD22 LEU B 90 -7.562 -2.597 4.019 1.00 52.45 H new ATOM 0 HD23 LEU B 90 -7.827 -3.589 5.472 1.00 52.45 H new ATOM 2619 N ALA B 91 -11.524 -1.295 7.579 1.00 43.35 N ATOM 2620 CA ALA B 91 -12.079 -0.046 8.086 1.00 62.43 C ATOM 2621 C ALA B 91 -11.107 0.637 9.041 1.00 32.22 C ATOM 2622 O ALA B 91 -11.413 1.479 9.868 1.00 15.10 O ATOM 2623 CB ALA B 91 -13.410 -0.303 8.778 1.00 41.40 C ATOM 0 H ALA B 91 -11.657 -2.096 8.196 1.00 43.35 H new ATOM 0 HA ALA B 91 -12.245 0.620 7.240 1.00 62.43 H new ATOM 0 HB1 ALA B 91 -13.813 0.638 9.152 1.00 41.40 H new ATOM 0 HB2 ALA B 91 -14.111 -0.741 8.068 1.00 41.40 H new ATOM 0 HB3 ALA B 91 -13.260 -0.990 9.611 1.00 41.40 H new HETATM 2629 C MK8 B 92 -7.650 -0.091 9.785 1.00 21.33 C HETATM 2630 N MK8 B 92 -9.829 0.268 8.947 1.00 4.53 N HETATM 2631 O MK8 B 92 -6.855 -0.067 10.725 1.00 75.22 O HETATM 2632 CA MK8 B 92 -9.114 -0.086 10.206 1.00 52.42 C HETATM 2633 CB MK8 B 92 -9.505 -1.506 10.738 1.00 51.13 C HETATM 2634 CD MK8 B 92 -11.595 -0.806 12.072 1.00 72.32 C HETATM 2635 CE MK8 B 92 -10.531 -0.418 13.071 1.00 61.53 C HETATM 2636 CG MK8 B 92 -11.027 -1.736 10.966 1.00 61.43 C HETATM 2637 CB1 MK8 B 92 -9.101 0.988 11.338 1.00 41.32 C HETATM 0 HB1B MK8 B 92 -8.423 0.672 12.131 1.00 41.32 H new HETATM 0 HB1A MK8 B 92 -8.764 1.941 10.931 1.00 41.32 H new HETATM 0 HN MK8 B 92 -9.301 0.435 8.090 1.00 4.53 H new HETATM 0 HGA MK8 B 92 -11.564 -1.561 10.034 1.00 61.43 H new HETATM 0 HG MK8 B 92 -11.199 -2.776 11.243 1.00 61.43 H new HETATM 0 HEB MK8 B 92 -10.134 -1.315 13.546 1.00 61.53 H new HETATM 0 HEA MK8 B 92 -9.726 0.108 12.559 1.00 61.53 H new HETATM 0 HE MK8 B 92 -10.965 0.233 13.830 1.00 61.53 H new HETATM 0 HDA MK8 B 92 -12.413 -1.310 12.587 1.00 72.32 H new HETATM 0 HD MK8 B 92 -12.011 0.092 11.615 1.00 72.32 H new HETATM 0 HBA MK8 B 92 -9.144 -2.253 10.031 1.00 51.13 H new HETATM 0 HB1 MK8 B 92 -10.106 1.101 11.743 1.00 41.32 H new HETATM 0 HB MK8 B 92 -8.983 -1.679 11.679 1.00 51.13 H new ATOM 2649 N VAL B 93 -7.265 -0.112 8.513 1.00 31.33 N ATOM 2650 CA VAL B 93 -5.855 -0.107 8.141 1.00 63.12 C ATOM 2651 C VAL B 93 -5.446 1.239 7.556 1.00 54.33 C ATOM 2652 O VAL B 93 -4.289 1.644 7.653 1.00 4.30 O ATOM 2653 CB VAL B 93 -5.541 -1.216 7.119 1.00 61.12 C ATOM 2654 CG1 VAL B 93 -4.068 -1.592 7.175 1.00 70.24 C ATOM 2655 CG2 VAL B 93 -6.421 -2.432 7.365 1.00 30.21 C ATOM 0 H VAL B 93 -7.910 -0.133 7.723 1.00 31.33 H new ATOM 0 HA VAL B 93 -5.286 -0.291 9.052 1.00 63.12 H new ATOM 0 HB VAL B 93 -5.756 -0.837 6.120 1.00 61.12 H new ATOM 0 HG11 VAL B 93 -3.865 -2.377 6.446 1.00 70.24 H new ATOM 0 HG12 VAL B 93 -3.460 -0.717 6.945 1.00 70.24 H new ATOM 0 HG13 VAL B 93 -3.822 -1.952 8.174 1.00 70.24 H new ATOM 0 HG21 VAL B 93 -6.186 -3.205 6.634 1.00 30.21 H new ATOM 0 HG22 VAL B 93 -6.240 -2.815 8.369 1.00 30.21 H new ATOM 0 HG23 VAL B 93 -7.469 -2.148 7.268 1.00 30.21 H new ATOM 2665 N GLY B 94 -6.405 1.930 6.948 1.00 1.21 N ATOM 2666 CA GLY B 94 -6.125 3.226 6.355 1.00 24.20 C ATOM 2667 C GLY B 94 -6.030 4.328 7.391 1.00 32.02 C ATOM 2668 O GLY B 94 -5.087 5.120 7.380 1.00 30.10 O ATOM 0 H GLY B 94 -7.371 1.616 6.855 1.00 1.21 H new ATOM 0 HA2 GLY B 94 -5.189 3.173 5.798 1.00 24.20 H new ATOM 0 HA3 GLY B 94 -6.909 3.471 5.638 1.00 24.20 H new ATOM 2672 N ASP B 95 -7.009 4.381 8.288 1.00 52.11 N ATOM 2673 CA ASP B 95 -7.032 5.395 9.335 1.00 54.01 C ATOM 2674 C ASP B 95 -5.755 5.346 10.168 1.00 63.33 C ATOM 2675 O ASP B 95 -4.916 6.228 10.219 1.00 34.42 O ATOM 2676 CB ASP B 95 -8.252 5.201 10.236 1.00 32.24 C ATOM 2677 CG ASP B 95 -9.545 5.606 9.556 1.00 61.20 C ATOM 2678 OD1 ASP B 95 -9.499 5.964 8.360 1.00 64.24 O ATOM 2679 OD2 ASP B 95 -10.603 5.566 10.219 1.00 43.13 O ATOM 0 H ASP B 95 -7.797 3.733 8.311 1.00 52.11 H new ATOM 0 HA ASP B 95 -7.095 6.373 8.858 1.00 54.01 H new ATOM 0 HB2 ASP B 95 -8.315 4.155 10.537 1.00 32.24 H new ATOM 0 HB3 ASP B 95 -8.125 5.787 11.146 1.00 32.24 H new HETATM 2683 C MK8 B 96 -3.724 4.775 12.268 1.00 74.42 C HETATM 2684 N MK8 B 96 -5.566 4.239 10.890 1.00 72.12 N HETATM 2685 O MK8 B 96 -3.324 5.290 13.311 1.00 73.41 O HETATM 2686 CA MK8 B 96 -5.200 4.403 12.326 1.00 32.14 C HETATM 2687 CB MK8 B 96 -5.369 3.078 13.143 1.00 41.33 C HETATM 2688 CD MK8 B 96 -7.455 2.097 14.293 1.00 55.44 C HETATM 2689 CE MK8 B 96 -8.869 1.612 14.078 1.00 42.23 C HETATM 2690 CG MK8 B 96 -6.724 2.339 12.944 1.00 34.12 C HETATM 2691 CB1 MK8 B 96 -5.944 5.604 12.987 1.00 53.33 C HETATM 0 HB1B MK8 B 96 -5.548 5.770 13.989 1.00 53.33 H new HETATM 0 HB1A MK8 B 96 -5.795 6.500 12.385 1.00 53.33 H new HETATM 0 HGA MK8 B 96 -7.364 2.925 12.284 1.00 34.12 H new HETATM 0 HG MK8 B 96 -6.547 1.383 12.450 1.00 34.12 H new HETATM 0 HEB MK8 B 96 -9.428 2.358 13.513 1.00 42.23 H new HETATM 0 HEA MK8 B 96 -8.852 0.674 13.523 1.00 42.23 H new HETATM 0 HE MK8 B 96 -9.350 1.453 15.043 1.00 42.23 H new HETATM 0 HDA MK8 B 96 -7.470 3.021 14.870 1.00 55.44 H new HETATM 0 HD MK8 B 96 -6.903 1.363 14.880 1.00 55.44 H new HETATM 0 HBA MK8 B 96 -4.561 2.399 12.872 1.00 41.33 H new HETATM 0 HB1 MK8 B 96 -7.009 5.382 13.050 1.00 53.33 H new HETATM 0 HB MK8 B 96 -5.252 3.307 14.202 1.00 41.33 H new HETATM 2703 N NLE B 97 -2.971 4.564 11.198 1.00 72.10 N HETATM 2704 CA NLE B 97 -1.568 4.943 11.185 1.00 72.41 C HETATM 2705 C NLE B 97 -1.407 6.441 10.920 1.00 44.43 C HETATM 2706 O NLE B 97 -0.477 7.090 11.397 1.00 74.04 O HETATM 2707 CB NLE B 97 -0.826 4.142 10.101 1.00 64.21 C HETATM 2708 CG NLE B 97 -1.490 4.391 8.736 1.00 41.02 C HETATM 2709 CD NLE B 97 -1.745 3.043 8.038 1.00 10.54 C HETATM 2710 CE NLE B 97 -0.409 2.298 7.864 1.00 43.21 C HETATM 0 HG3 NLE B 97 -2.429 4.928 8.869 1.00 41.02 H new HETATM 0 HG2 NLE B 97 -0.849 5.018 8.116 1.00 41.02 H new HETATM 0 HE3 NLE B 97 0.267 2.900 7.257 1.00 43.21 H new HETATM 0 HE2 NLE B 97 0.040 2.123 8.842 1.00 43.21 H new HETATM 0 HE1 NLE B 97 -0.587 1.343 7.370 1.00 43.21 H new HETATM 0 HD3 NLE B 97 -2.436 2.441 8.627 1.00 10.54 H new HETATM 0 HD2 NLE B 97 -2.213 3.206 7.067 1.00 10.54 H new HETATM 0 HB3 NLE B 97 0.222 4.439 10.067 1.00 64.21 H new HETATM 0 HB2 NLE B 97 -0.848 3.079 10.340 1.00 64.21 H new HETATM 0 HA NLE B 97 -1.142 4.720 12.163 1.00 72.41 H new ATOM 2722 N ASP B 98 -2.340 6.977 10.141 1.00 70.54 N ATOM 2723 CA ASP B 98 -2.327 8.394 9.796 1.00 24.33 C ATOM 2724 C ASP B 98 -2.209 9.257 11.048 1.00 30.41 C ATOM 2725 O ASP B 98 -1.695 10.375 10.998 1.00 42.35 O ATOM 2726 CB ASP B 98 -3.593 8.765 9.023 1.00 41.01 C ATOM 2727 CG ASP B 98 -3.810 10.263 8.953 1.00 60.33 C ATOM 2728 OD1 ASP B 98 -2.983 10.954 8.322 1.00 71.33 O ATOM 2729 OD2 ASP B 98 -4.808 10.745 9.530 1.00 15.13 O ATOM 0 H ASP B 98 -3.115 6.452 9.736 1.00 70.54 H new ATOM 0 HA ASP B 98 -1.458 8.581 9.165 1.00 24.33 H new ATOM 0 HB2 ASP B 98 -3.529 8.362 8.012 1.00 41.01 H new ATOM 0 HB3 ASP B 98 -4.455 8.298 9.498 1.00 41.01 H new ATOM 2733 N ARG B 99 -2.690 8.731 12.170 1.00 32.33 N ATOM 2734 CA ARG B 99 -2.641 9.455 13.435 1.00 10.01 C ATOM 2735 C ARG B 99 -1.202 9.604 13.921 1.00 71.13 C ATOM 2736 O ARG B 99 -0.859 10.584 14.581 1.00 4.54 O ATOM 2737 CB ARG B 99 -3.476 8.732 14.493 1.00 64.21 C ATOM 2738 CG ARG B 99 -4.946 8.609 14.130 1.00 61.44 C ATOM 2739 CD ARG B 99 -5.618 9.972 14.057 1.00 42.32 C ATOM 2740 NE ARG B 99 -6.224 10.213 12.750 1.00 12.12 N ATOM 2741 CZ ARG B 99 -6.782 11.367 12.401 1.00 64.14 C ATOM 2742 NH1 ARG B 99 -6.812 12.379 13.257 1.00 2.35 N ATOM 2743 NH2 ARG B 99 -7.312 11.510 11.193 1.00 41.23 N ATOM 0 H ARG B 99 -3.118 7.807 12.229 1.00 32.33 H new ATOM 0 HA ARG B 99 -3.056 10.450 13.272 1.00 10.01 H new ATOM 0 HB2 ARG B 99 -3.065 7.735 14.649 1.00 64.21 H new ATOM 0 HB3 ARG B 99 -3.388 9.265 15.440 1.00 64.21 H new ATOM 0 HG2 ARG B 99 -5.044 8.102 13.170 1.00 61.44 H new ATOM 0 HG3 ARG B 99 -5.454 7.991 14.870 1.00 61.44 H new ATOM 0 HD2 ARG B 99 -6.383 10.041 14.830 1.00 42.32 H new ATOM 0 HD3 ARG B 99 -4.884 10.750 14.265 1.00 42.32 H new ATOM 0 HE ARG B 99 -6.218 9.454 12.068 1.00 12.12 H new ATOM 0 HH11 ARG B 99 -6.406 12.273 14.187 1.00 2.35 H new ATOM 0 HH12 ARG B 99 -7.241 13.264 12.986 1.00 2.35 H new ATOM 0 HH21 ARG B 99 -7.291 10.734 10.532 1.00 41.23 H new ATOM 0 HH22 ARG B 99 -7.740 12.396 10.926 1.00 41.23 H new ATOM 2754 N SER B 100 -0.367 8.625 13.590 1.00 61.44 N ATOM 2755 CA SER B 100 1.033 8.644 13.997 1.00 4.25 C ATOM 2756 C SER B 100 1.939 8.957 12.809 1.00 40.24 C ATOM 2757 O SER B 100 3.130 8.647 12.825 1.00 22.11 O ATOM 2758 CB SER B 100 1.427 7.300 14.612 1.00 72.42 C ATOM 2759 OG SER B 100 1.261 7.316 16.019 1.00 70.24 O ATOM 0 H SER B 100 -0.635 7.808 13.041 1.00 61.44 H new ATOM 0 HA SER B 100 1.157 9.427 14.745 1.00 4.25 H new ATOM 0 HB2 SER B 100 0.818 6.506 14.180 1.00 72.42 H new ATOM 0 HB3 SER B 100 2.465 7.075 14.367 1.00 72.42 H new ATOM 0 HG SER B 100 1.518 6.445 16.389 1.00 70.24 H new ATOM 2764 N ILE B 101 1.364 9.573 11.781 1.00 21.00 N ATOM 2765 CA ILE B 101 2.119 9.929 10.586 1.00 42.23 C ATOM 2766 C ILE B 101 2.416 11.424 10.548 1.00 32.01 C ATOM 2767 O ILE B 101 3.510 11.811 10.139 1.00 52.33 O ATOM 2768 CB ILE B 101 1.361 9.535 9.304 1.00 20.14 C ATOM 2769 CG1 ILE B 101 1.447 8.025 9.079 1.00 5.01 C ATOM 2770 CG2 ILE B 101 1.922 10.287 8.106 1.00 33.01 C ATOM 2771 CD1 ILE B 101 0.565 7.530 7.954 1.00 72.25 C ATOM 0 H ILE B 101 0.379 9.836 11.752 1.00 21.00 H new ATOM 0 HA ILE B 101 3.057 9.376 10.629 1.00 42.23 H new ATOM 0 HB ILE B 101 0.312 9.807 9.421 1.00 20.14 H new ATOM 0 HG12 ILE B 101 2.481 7.756 8.864 1.00 5.01 H new ATOM 0 HG13 ILE B 101 1.169 7.512 10.000 1.00 5.01 H new ATOM 0 HG21 ILE B 101 1.377 9.998 7.207 1.00 33.01 H new ATOM 0 HG22 ILE B 101 1.815 11.360 8.267 1.00 33.01 H new ATOM 0 HG23 ILE B 101 2.977 10.042 7.984 1.00 33.01 H new ATOM 0 HD11 ILE B 101 0.677 6.451 7.852 1.00 72.25 H new ATOM 0 HD12 ILE B 101 -0.475 7.767 8.176 1.00 72.25 H new ATOM 0 HD13 ILE B 101 0.857 8.015 7.023 1.00 72.25 H new HETATM 2782 N NH2 B 102 1.449 12.223 10.974 1.00 53.25 N TER 2785 NH2 B 102