USER MOD reduce.3.24.130724 H: found=0, std=0, add=1029, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1036 hydrogens (94 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: A 78 ASNHD21 : A 78 ASN ND2 : A 136 NAG C1 :(H bumps) USER MOD NoAdj-H: A 111 ASNHD22 : A 111 ASN ND2 : A 132 NAG C1 :(H bumps) USER MOD Set 1.1: A 137 NAG O6 : rot 102:sc= 0.373 USER MOD Set 1.2: A 139 BMA O2 : rot 144:sc= 0.335 USER MOD Set 2.1: A 132 NAG O3 : rot -175:sc= 0.445 USER MOD Set 2.2: A 133 NAG O6 : rot 180:sc= 0 USER MOD Set 3.1: A 99 MET CE :methyl -163:sc= -3.27 (180deg=-3.51!) USER MOD Set 3.2: A 104 TYR OH : rot -71:sc= -2.12 USER MOD Set 4.1: A 30 THR OG1 : rot 180:sc= -1.84 USER MOD Set 4.2: A 53 MET CE :methyl -179:sc= -8.43! (180deg=-8.21!) USER MOD Set 5.1: A 18 SER OG : rot 73:sc= 1.86 USER MOD Set 5.2: A 80 THR OG1 : rot 170:sc= 1.09 USER MOD Single : A 1 MET CE :methyl -154:sc= -0.128 (180deg=-0.971) USER MOD Single : A 1AALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= -0.0246 X(o=-0.025,f=-0.28) USER MOD Single : A 5 GLN : amide:sc= -6.44! C(o=-6.4!,f=-9.3!) USER MOD Single : A 12 SER OG : rot 180:sc= -0.0802 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 23 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -118:sc= -0.302 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 39 GLN :FLIP amide:sc= -7.59! C(o=-10!,f=-7.6!) USER MOD Single : A 42 SER OG : rot 180:sc= -0.356 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.82) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot -176:sc= 0.887! USER MOD Single : A 52 TYR OH : rot -30:sc= -1.42 USER MOD Single : A 54 MET CE :methyl 138:sc= -11.9! (180deg=-21.2!) USER MOD Single : A 56 ASN : amide:sc= 0.376 K(o=0.38,f=-4.8!) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.00241 USER MOD Single : A 64 SER OG : rot -44:sc= 0.991 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 THR OG1 : rot -43:sc= 0.712 USER MOD Single : A 72 SER OG : rot -125:sc= 1.03 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.365 X(o=-0.37,f=-0.27) USER MOD Single : A 76 GLN : amide:sc= -0.493 X(o=-0.49,f=-0.23) USER MOD Single : A 82 GLN : amide:sc= -0.229 K(o=-0.23,f=-2.6!) USER MOD Single : A 87 MET CE :methyl -150:sc= -0.0489 (180deg=-0.739) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0.0333 USER MOD Single : A 92 TYR OH : rot -52:sc= 1.03 USER MOD Single : A 95 LYS NZ :NH3+ -151:sc= -0.138 (180deg=-0.573) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 150:sc= 0 USER MOD Single : A 113 THR OG1 : rot -48:sc= 0.162 USER MOD Single : A 114 GLN : amide:sc= -2.34 X(o=-2.3,f=-2.6!) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 CYS SG : rot -65:sc= -3.43! USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 GLN : amide:sc=-0.00773 K(o=-0.0077,f=-1.4!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 NAG O3 : rot 180:sc= 0 USER MOD Single : A 134 FUL O2 : rot 148:sc= 0.00373 USER MOD Single : A 134 FUL O3 : rot -94:sc= 0.0658 USER MOD Single : A 134 FUL O4 : rot 150:sc= 0.0672 USER MOD Single : A 135 BMA O2 : rot 146:sc= -0.499 USER MOD Single : A 135 BMA O3 : rot 180:sc= 0.0576 USER MOD Single : A 135 BMA O4 : rot -149:sc= 0.631 USER MOD Single : A 135 BMA O6 : rot 180:sc= 0.582 USER MOD Single : A 136 NAG O3 : rot 6:sc= 1.13 USER MOD Single : A 137 NAG O3 : rot -160:sc= 0 USER MOD Single : A 138 FUC O2 : rot 31:sc=0.000536 USER MOD Single : A 138 FUC O3 : rot -94:sc= 0.129 USER MOD Single : A 138 FUC O4 : rot 150:sc= 0.131 USER MOD Single : A 139 BMA O3 : rot 180:sc= 0 USER MOD Single : A 139 BMA O4 : rot 160:sc= 0 USER MOD Single : A 139 BMA O6 : rot 180:sc= -0.0552 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1A -13.847 1.568 4.109 1.00 0.00 N ATOM 2 CA ALA A 1A -13.588 1.754 5.566 1.00 0.00 C ATOM 3 C ALA A 1A -12.483 2.793 5.778 1.00 0.00 C ATOM 4 O ALA A 1A -12.667 3.773 6.475 1.00 0.00 O ATOM 5 CB ALA A 1A -13.137 0.382 6.067 1.00 0.00 C ATOM 0 H1 ALA A 1A -14.598 0.861 3.977 1.00 0.00 H new ATOM 0 H2 ALA A 1A -14.146 2.472 3.691 1.00 0.00 H new ATOM 0 H3 ALA A 1A -12.978 1.241 3.641 1.00 0.00 H new ATOM 0 HA ALA A 1A -14.468 2.113 6.099 1.00 0.00 H new ATOM 0 HB1 ALA A 1A -12.926 0.436 7.135 1.00 0.00 H new ATOM 0 HB2 ALA A 1A -13.927 -0.348 5.889 1.00 0.00 H new ATOM 0 HB3 ALA A 1A -12.236 0.078 5.534 1.00 0.00 H new ATOM 13 N MET A 1 -11.339 2.583 5.177 1.00 0.00 N ATOM 14 CA MET A 1 -10.213 3.554 5.335 1.00 0.00 C ATOM 15 C MET A 1 -9.775 4.071 3.961 1.00 0.00 C ATOM 16 O MET A 1 -10.484 3.925 2.983 1.00 0.00 O ATOM 17 CB MET A 1 -9.091 2.746 5.988 1.00 0.00 C ATOM 18 CG MET A 1 -9.531 2.296 7.382 1.00 0.00 C ATOM 19 SD MET A 1 -9.793 3.745 8.433 1.00 0.00 S ATOM 20 CE MET A 1 -8.053 4.207 8.616 1.00 0.00 C ATOM 0 H MET A 1 -11.136 1.779 4.583 1.00 0.00 H new ATOM 0 HA MET A 1 -10.489 4.424 5.931 1.00 0.00 H new ATOM 0 HB2 MET A 1 -8.848 1.879 5.374 1.00 0.00 H new ATOM 0 HB3 MET A 1 -8.187 3.350 6.058 1.00 0.00 H new ATOM 0 HG2 MET A 1 -10.449 1.713 7.314 1.00 0.00 H new ATOM 0 HG3 MET A 1 -8.773 1.647 7.822 1.00 0.00 H new ATOM 0 HE1 MET A 1 -7.918 4.756 9.548 1.00 0.00 H new ATOM 0 HE2 MET A 1 -7.437 3.308 8.632 1.00 0.00 H new ATOM 0 HE3 MET A 1 -7.754 4.837 7.778 1.00 0.00 H new ATOM 30 N HIS A 2 -8.613 4.671 3.881 1.00 0.00 N ATOM 31 CA HIS A 2 -8.128 5.195 2.567 1.00 0.00 C ATOM 32 C HIS A 2 -7.190 4.191 1.894 1.00 0.00 C ATOM 33 O HIS A 2 -6.384 4.541 1.054 1.00 0.00 O ATOM 34 CB HIS A 2 -7.394 6.497 2.893 1.00 0.00 C ATOM 35 CG HIS A 2 -8.356 7.478 3.504 1.00 0.00 C ATOM 36 ND1 HIS A 2 -8.576 7.544 4.871 1.00 0.00 N ATOM 37 CD2 HIS A 2 -9.164 8.439 2.948 1.00 0.00 C ATOM 38 CE1 HIS A 2 -9.483 8.514 5.090 1.00 0.00 C ATOM 39 NE2 HIS A 2 -9.875 9.091 3.951 1.00 0.00 N ATOM 0 H HIS A 2 -7.981 4.820 4.667 1.00 0.00 H new ATOM 0 HA HIS A 2 -8.950 5.361 1.870 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -6.572 6.301 3.582 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -6.957 6.917 1.987 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -9.237 8.656 1.893 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -9.849 8.792 6.067 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -10.550 9.847 3.840 1.00 0.00 H new ATOM 47 N VAL A 3 -7.306 2.946 2.256 1.00 0.00 N ATOM 48 CA VAL A 3 -6.446 1.886 1.648 1.00 0.00 C ATOM 49 C VAL A 3 -7.220 0.561 1.634 1.00 0.00 C ATOM 50 O VAL A 3 -7.801 0.171 2.630 1.00 0.00 O ATOM 51 CB VAL A 3 -5.216 1.788 2.561 1.00 0.00 C ATOM 52 CG1 VAL A 3 -4.261 0.722 2.020 1.00 0.00 C ATOM 53 CG2 VAL A 3 -4.489 3.136 2.606 1.00 0.00 C ATOM 0 H VAL A 3 -7.967 2.610 2.956 1.00 0.00 H new ATOM 0 HA VAL A 3 -6.158 2.111 0.621 1.00 0.00 H new ATOM 0 HB VAL A 3 -5.541 1.518 3.566 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -3.388 0.653 2.669 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -4.770 -0.242 1.992 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.944 0.994 1.013 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.618 3.058 3.256 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.169 3.410 1.601 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.163 3.900 2.993 1.00 0.00 H new ATOM 63 N ALA A 4 -7.237 -0.129 0.520 1.00 0.00 N ATOM 64 CA ALA A 4 -7.985 -1.428 0.456 1.00 0.00 C ATOM 65 C ALA A 4 -7.014 -2.603 0.350 1.00 0.00 C ATOM 66 O ALA A 4 -6.090 -2.588 -0.440 1.00 0.00 O ATOM 67 CB ALA A 4 -8.858 -1.341 -0.794 1.00 0.00 C ATOM 0 H ALA A 4 -6.769 0.147 -0.344 1.00 0.00 H new ATOM 0 HA ALA A 4 -8.582 -1.591 1.353 1.00 0.00 H new ATOM 0 HB1 ALA A 4 -9.433 -2.261 -0.901 1.00 0.00 H new ATOM 0 HB2 ALA A 4 -9.540 -0.495 -0.704 1.00 0.00 H new ATOM 0 HB3 ALA A 4 -8.225 -1.205 -1.671 1.00 0.00 H new ATOM 73 N GLN A 5 -7.223 -3.619 1.148 1.00 0.00 N ATOM 74 CA GLN A 5 -6.318 -4.806 1.114 1.00 0.00 C ATOM 75 C GLN A 5 -7.132 -6.108 1.224 1.00 0.00 C ATOM 76 O GLN A 5 -8.051 -6.183 2.015 1.00 0.00 O ATOM 77 CB GLN A 5 -5.418 -4.659 2.349 1.00 0.00 C ATOM 78 CG GLN A 5 -4.640 -3.338 2.279 1.00 0.00 C ATOM 79 CD GLN A 5 -5.190 -2.315 3.292 1.00 0.00 C ATOM 80 OE1 GLN A 5 -4.477 -1.425 3.699 1.00 0.00 O ATOM 81 NE2 GLN A 5 -6.428 -2.384 3.716 1.00 0.00 N ATOM 0 H GLN A 5 -7.985 -3.677 1.824 1.00 0.00 H new ATOM 0 HA GLN A 5 -5.751 -4.853 0.185 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -6.023 -4.686 3.255 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -4.723 -5.497 2.404 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -3.585 -3.523 2.481 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -4.705 -2.927 1.271 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -7.041 -3.128 3.382 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -6.779 -1.694 4.380 1.00 0.00 H new ATOM 90 N PRO A 6 -6.762 -7.107 0.450 1.00 0.00 N ATOM 91 CA PRO A 6 -7.468 -8.413 0.524 1.00 0.00 C ATOM 92 C PRO A 6 -7.150 -9.090 1.853 1.00 0.00 C ATOM 93 O PRO A 6 -6.010 -9.145 2.267 1.00 0.00 O ATOM 94 CB PRO A 6 -6.900 -9.199 -0.655 1.00 0.00 C ATOM 95 CG PRO A 6 -5.562 -8.586 -0.916 1.00 0.00 C ATOM 96 CD PRO A 6 -5.670 -7.135 -0.539 1.00 0.00 C ATOM 0 HA PRO A 6 -8.554 -8.331 0.473 1.00 0.00 H new ATOM 0 HB2 PRO A 6 -6.809 -10.259 -0.417 1.00 0.00 H new ATOM 0 HB3 PRO A 6 -7.547 -9.123 -1.529 1.00 0.00 H new ATOM 0 HG2 PRO A 6 -4.788 -9.082 -0.329 1.00 0.00 H new ATOM 0 HG3 PRO A 6 -5.285 -8.694 -1.965 1.00 0.00 H new ATOM 0 HD2 PRO A 6 -4.738 -6.762 -0.116 1.00 0.00 H new ATOM 0 HD3 PRO A 6 -5.899 -6.513 -1.405 1.00 0.00 H new ATOM 104 N ALA A 7 -8.142 -9.605 2.525 1.00 0.00 N ATOM 105 CA ALA A 7 -7.880 -10.275 3.831 1.00 0.00 C ATOM 106 C ALA A 7 -7.096 -11.556 3.601 1.00 0.00 C ATOM 107 O ALA A 7 -6.255 -11.918 4.406 1.00 0.00 O ATOM 108 CB ALA A 7 -9.256 -10.572 4.429 1.00 0.00 C ATOM 0 H ALA A 7 -9.118 -9.592 2.229 1.00 0.00 H new ATOM 0 HA ALA A 7 -7.289 -9.654 4.504 1.00 0.00 H new ATOM 0 HB1 ALA A 7 -9.135 -11.066 5.393 1.00 0.00 H new ATOM 0 HB2 ALA A 7 -9.802 -9.639 4.566 1.00 0.00 H new ATOM 0 HB3 ALA A 7 -9.813 -11.223 3.755 1.00 0.00 H new ATOM 114 N VAL A 8 -7.341 -12.241 2.511 1.00 0.00 N ATOM 115 CA VAL A 8 -6.580 -13.476 2.259 1.00 0.00 C ATOM 116 C VAL A 8 -6.400 -13.714 0.768 1.00 0.00 C ATOM 117 O VAL A 8 -7.177 -13.261 -0.051 1.00 0.00 O ATOM 118 CB VAL A 8 -7.383 -14.606 2.927 1.00 0.00 C ATOM 119 CG1 VAL A 8 -8.579 -15.109 2.091 1.00 0.00 C ATOM 120 CG2 VAL A 8 -6.456 -15.774 3.200 1.00 0.00 C ATOM 0 H VAL A 8 -8.029 -11.992 1.800 1.00 0.00 H new ATOM 0 HA VAL A 8 -5.572 -13.419 2.670 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.797 -14.188 3.845 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.092 -15.904 2.632 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.271 -14.286 1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -8.220 -15.493 1.136 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -7.016 -16.580 3.674 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -6.032 -16.130 2.261 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -5.652 -15.453 3.862 1.00 0.00 H new ATOM 130 N VAL A 9 -5.390 -14.445 0.437 1.00 0.00 N ATOM 131 CA VAL A 9 -5.123 -14.769 -0.983 1.00 0.00 C ATOM 132 C VAL A 9 -4.724 -16.242 -1.118 1.00 0.00 C ATOM 133 O VAL A 9 -4.235 -16.855 -0.188 1.00 0.00 O ATOM 134 CB VAL A 9 -3.998 -13.810 -1.388 1.00 0.00 C ATOM 135 CG1 VAL A 9 -3.250 -14.303 -2.634 1.00 0.00 C ATOM 136 CG2 VAL A 9 -4.607 -12.445 -1.695 1.00 0.00 C ATOM 0 H VAL A 9 -4.723 -14.841 1.100 1.00 0.00 H new ATOM 0 HA VAL A 9 -5.991 -14.644 -1.630 1.00 0.00 H new ATOM 0 HB VAL A 9 -3.287 -13.752 -0.564 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.461 -13.596 -2.888 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.810 -15.280 -2.432 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -3.947 -14.384 -3.468 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -3.818 -11.751 -1.985 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.323 -12.541 -2.511 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.116 -12.066 -0.809 1.00 0.00 H new ATOM 146 N LEU A 10 -4.931 -16.801 -2.279 1.00 0.00 N ATOM 147 CA LEU A 10 -4.569 -18.231 -2.504 1.00 0.00 C ATOM 148 C LEU A 10 -3.464 -18.308 -3.566 1.00 0.00 C ATOM 149 O LEU A 10 -3.544 -17.670 -4.599 1.00 0.00 O ATOM 150 CB LEU A 10 -5.859 -18.898 -3.000 1.00 0.00 C ATOM 151 CG LEU A 10 -6.989 -18.695 -1.977 1.00 0.00 C ATOM 152 CD1 LEU A 10 -8.279 -19.317 -2.515 1.00 0.00 C ATOM 153 CD2 LEU A 10 -6.620 -19.351 -0.637 1.00 0.00 C ATOM 0 H LEU A 10 -5.337 -16.327 -3.086 1.00 0.00 H new ATOM 0 HA LEU A 10 -4.192 -18.722 -1.607 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -6.149 -18.475 -3.962 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -5.689 -19.963 -3.158 1.00 0.00 H new ATOM 0 HG LEU A 10 -7.135 -17.627 -1.816 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -9.081 -19.174 -1.791 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -8.549 -18.837 -3.456 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -8.127 -20.383 -2.682 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -7.429 -19.199 0.077 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -6.463 -20.419 -0.786 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -5.706 -18.900 -0.251 1.00 0.00 H new ATOM 165 N ALA A 11 -2.429 -19.069 -3.313 1.00 0.00 N ATOM 166 CA ALA A 11 -1.306 -19.173 -4.297 1.00 0.00 C ATOM 167 C ALA A 11 -1.562 -20.300 -5.305 1.00 0.00 C ATOM 168 O ALA A 11 -1.901 -21.408 -4.942 1.00 0.00 O ATOM 169 CB ALA A 11 -0.069 -19.473 -3.449 1.00 0.00 C ATOM 0 H ALA A 11 -2.312 -19.624 -2.466 1.00 0.00 H new ATOM 0 HA ALA A 11 -1.191 -18.262 -4.884 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.803 -19.565 -4.097 1.00 0.00 H new ATOM 0 HB2 ALA A 11 0.091 -18.662 -2.739 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -0.218 -20.406 -2.906 1.00 0.00 H new ATOM 175 N SER A 12 -1.395 -20.014 -6.571 1.00 0.00 N ATOM 176 CA SER A 12 -1.624 -21.053 -7.627 1.00 0.00 C ATOM 177 C SER A 12 -0.677 -22.243 -7.433 1.00 0.00 C ATOM 178 O SER A 12 0.210 -22.215 -6.602 1.00 0.00 O ATOM 179 CB SER A 12 -1.329 -20.350 -8.953 1.00 0.00 C ATOM 180 OG SER A 12 -1.611 -21.238 -10.028 1.00 0.00 O ATOM 0 H SER A 12 -1.108 -19.101 -6.923 1.00 0.00 H new ATOM 0 HA SER A 12 -2.639 -21.450 -7.589 1.00 0.00 H new ATOM 0 HB2 SER A 12 -1.935 -19.448 -9.042 1.00 0.00 H new ATOM 0 HB3 SER A 12 -0.285 -20.038 -8.988 1.00 0.00 H new ATOM 0 HG SER A 12 -1.425 -20.790 -10.880 1.00 0.00 H new ATOM 186 N SER A 13 -0.868 -23.291 -8.199 1.00 0.00 N ATOM 187 CA SER A 13 0.012 -24.497 -8.071 1.00 0.00 C ATOM 188 C SER A 13 1.470 -24.116 -8.346 1.00 0.00 C ATOM 189 O SER A 13 2.381 -24.625 -7.723 1.00 0.00 O ATOM 190 CB SER A 13 -0.492 -25.478 -9.131 1.00 0.00 C ATOM 191 OG SER A 13 0.231 -26.698 -9.023 1.00 0.00 O ATOM 0 H SER A 13 -1.597 -23.363 -8.909 1.00 0.00 H new ATOM 0 HA SER A 13 -0.025 -24.928 -7.070 1.00 0.00 H new ATOM 0 HB2 SER A 13 -1.558 -25.661 -8.997 1.00 0.00 H new ATOM 0 HB3 SER A 13 -0.364 -25.053 -10.127 1.00 0.00 H new ATOM 0 HG SER A 13 -0.090 -27.330 -9.700 1.00 0.00 H new ATOM 197 N ARG A 14 1.691 -23.209 -9.265 1.00 0.00 N ATOM 198 CA ARG A 14 3.089 -22.766 -9.583 1.00 0.00 C ATOM 199 C ARG A 14 3.812 -22.315 -8.307 1.00 0.00 C ATOM 200 O ARG A 14 5.026 -22.329 -8.232 1.00 0.00 O ATOM 201 CB ARG A 14 2.925 -21.585 -10.547 1.00 0.00 C ATOM 202 CG ARG A 14 4.304 -21.055 -10.967 1.00 0.00 C ATOM 203 CD ARG A 14 4.629 -21.505 -12.396 1.00 0.00 C ATOM 204 NE ARG A 14 4.919 -20.244 -13.149 1.00 0.00 N ATOM 205 CZ ARG A 14 3.952 -19.470 -13.602 1.00 0.00 C ATOM 206 NH1 ARG A 14 2.686 -19.762 -13.406 1.00 0.00 N ATOM 207 NH2 ARG A 14 4.260 -18.388 -14.263 1.00 0.00 N ATOM 0 H ARG A 14 0.961 -22.753 -9.813 1.00 0.00 H new ATOM 0 HA ARG A 14 3.683 -23.571 -10.017 1.00 0.00 H new ATOM 0 HB2 ARG A 14 2.363 -21.898 -11.427 1.00 0.00 H new ATOM 0 HB3 ARG A 14 2.351 -20.791 -10.069 1.00 0.00 H new ATOM 0 HG2 ARG A 14 4.317 -19.967 -10.908 1.00 0.00 H new ATOM 0 HG3 ARG A 14 5.067 -21.420 -10.280 1.00 0.00 H new ATOM 0 HD2 ARG A 14 5.486 -22.179 -12.411 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.792 -22.044 -12.839 1.00 0.00 H new ATOM 0 HE ARG A 14 5.889 -19.977 -13.316 1.00 0.00 H new ATOM 0 HH11 ARG A 14 2.431 -20.605 -12.892 1.00 0.00 H new ATOM 0 HH12 ARG A 14 1.958 -19.145 -13.768 1.00 0.00 H new ATOM 0 HH21 ARG A 14 5.239 -18.150 -14.424 1.00 0.00 H new ATOM 0 HH22 ARG A 14 3.522 -17.780 -14.619 1.00 0.00 H new ATOM 221 N GLY A 15 3.068 -21.898 -7.315 1.00 0.00 N ATOM 222 CA GLY A 15 3.694 -21.423 -6.049 1.00 0.00 C ATOM 223 C GLY A 15 3.815 -19.900 -6.095 1.00 0.00 C ATOM 224 O GLY A 15 4.651 -19.315 -5.433 1.00 0.00 O ATOM 0 H GLY A 15 2.049 -21.867 -7.330 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.091 -21.727 -5.193 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.678 -21.875 -5.922 1.00 0.00 H new ATOM 228 N ILE A 16 2.976 -19.255 -6.869 1.00 0.00 N ATOM 229 CA ILE A 16 3.017 -17.779 -6.964 1.00 0.00 C ATOM 230 C ILE A 16 1.755 -17.171 -6.352 1.00 0.00 C ATOM 231 O ILE A 16 0.668 -17.277 -6.888 1.00 0.00 O ATOM 232 CB ILE A 16 3.154 -17.462 -8.472 1.00 0.00 C ATOM 233 CG1 ILE A 16 4.615 -17.625 -8.898 1.00 0.00 C ATOM 234 CG2 ILE A 16 2.724 -16.018 -8.783 1.00 0.00 C ATOM 235 CD1 ILE A 16 5.097 -19.063 -8.736 1.00 0.00 C ATOM 0 H ILE A 16 2.260 -19.702 -7.442 1.00 0.00 H new ATOM 0 HA ILE A 16 3.850 -17.349 -6.408 1.00 0.00 H new ATOM 0 HB ILE A 16 2.509 -18.152 -9.016 1.00 0.00 H new ATOM 0 HG12 ILE A 16 4.726 -17.320 -9.938 1.00 0.00 H new ATOM 0 HG13 ILE A 16 5.243 -16.962 -8.303 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.833 -15.828 -9.851 1.00 0.00 H new ATOM 0 HG22 ILE A 16 1.682 -15.878 -8.494 1.00 0.00 H new ATOM 0 HG23 ILE A 16 3.352 -15.323 -8.225 1.00 0.00 H new ATOM 0 HD11 ILE A 16 6.138 -19.135 -9.049 1.00 0.00 H new ATOM 0 HD12 ILE A 16 5.011 -19.360 -7.691 1.00 0.00 H new ATOM 0 HD13 ILE A 16 4.486 -19.723 -9.352 1.00 0.00 H new ATOM 247 N ALA A 17 1.921 -16.501 -5.251 1.00 0.00 N ATOM 248 CA ALA A 17 0.768 -15.827 -4.593 1.00 0.00 C ATOM 249 C ALA A 17 0.793 -14.358 -4.985 1.00 0.00 C ATOM 250 O ALA A 17 1.755 -13.657 -4.725 1.00 0.00 O ATOM 251 CB ALA A 17 0.989 -15.977 -3.092 1.00 0.00 C ATOM 0 H ALA A 17 2.815 -16.389 -4.772 1.00 0.00 H new ATOM 0 HA ALA A 17 -0.192 -16.253 -4.885 1.00 0.00 H new ATOM 0 HB1 ALA A 17 0.170 -15.499 -2.554 1.00 0.00 H new ATOM 0 HB2 ALA A 17 1.024 -17.035 -2.833 1.00 0.00 H new ATOM 0 HB3 ALA A 17 1.931 -15.504 -2.814 1.00 0.00 H new ATOM 257 N SER A 18 -0.240 -13.891 -5.622 1.00 0.00 N ATOM 258 CA SER A 18 -0.262 -12.467 -6.051 1.00 0.00 C ATOM 259 C SER A 18 -1.463 -11.735 -5.469 1.00 0.00 C ATOM 260 O SER A 18 -2.590 -12.186 -5.557 1.00 0.00 O ATOM 261 CB SER A 18 -0.351 -12.508 -7.572 1.00 0.00 C ATOM 262 OG SER A 18 -0.365 -11.179 -8.073 1.00 0.00 O ATOM 0 H SER A 18 -1.070 -14.432 -5.865 1.00 0.00 H new ATOM 0 HA SER A 18 0.622 -11.932 -5.704 1.00 0.00 H new ATOM 0 HB2 SER A 18 0.497 -13.056 -7.984 1.00 0.00 H new ATOM 0 HB3 SER A 18 -1.253 -13.036 -7.882 1.00 0.00 H new ATOM 0 HG SER A 18 0.529 -10.787 -7.985 1.00 0.00 H new ATOM 268 N PHE A 19 -1.218 -10.595 -4.895 1.00 0.00 N ATOM 269 CA PHE A 19 -2.317 -9.783 -4.315 1.00 0.00 C ATOM 270 C PHE A 19 -2.066 -8.314 -4.623 1.00 0.00 C ATOM 271 O PHE A 19 -0.976 -7.934 -5.013 1.00 0.00 O ATOM 272 CB PHE A 19 -2.294 -10.061 -2.812 1.00 0.00 C ATOM 273 CG PHE A 19 -0.960 -9.675 -2.217 1.00 0.00 C ATOM 274 CD1 PHE A 19 0.122 -10.593 -2.258 1.00 0.00 C ATOM 275 CD2 PHE A 19 -0.793 -8.405 -1.601 1.00 0.00 C ATOM 276 CE1 PHE A 19 1.375 -10.240 -1.691 1.00 0.00 C ATOM 277 CE2 PHE A 19 0.460 -8.051 -1.032 1.00 0.00 C ATOM 278 CZ PHE A 19 1.544 -8.970 -1.075 1.00 0.00 C ATOM 0 H PHE A 19 -0.289 -10.185 -4.802 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.294 -10.034 -4.729 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.091 -9.503 -2.322 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.487 -11.118 -2.630 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -0.008 -11.560 -2.721 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.618 -7.709 -1.565 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.200 -10.936 -1.728 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.589 -7.085 -0.567 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.496 -8.703 -0.640 1.00 0.00 H new ATOM 288 N VAL A 20 -3.064 -7.494 -4.478 1.00 0.00 N ATOM 289 CA VAL A 20 -2.883 -6.049 -4.796 1.00 0.00 C ATOM 290 C VAL A 20 -3.422 -5.168 -3.666 1.00 0.00 C ATOM 291 O VAL A 20 -4.534 -5.337 -3.204 1.00 0.00 O ATOM 292 CB VAL A 20 -3.672 -5.833 -6.089 1.00 0.00 C ATOM 293 CG1 VAL A 20 -3.522 -4.386 -6.550 1.00 0.00 C ATOM 294 CG2 VAL A 20 -3.136 -6.763 -7.184 1.00 0.00 C ATOM 0 H VAL A 20 -3.995 -7.757 -4.155 1.00 0.00 H new ATOM 0 HA VAL A 20 -1.833 -5.781 -4.909 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.723 -6.052 -5.902 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -4.086 -4.237 -7.471 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.904 -3.717 -5.779 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -2.469 -4.169 -6.730 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -3.701 -6.606 -8.103 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -2.083 -6.545 -7.363 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -3.243 -7.800 -6.865 1.00 0.00 H new ATOM 304 N CYS A 21 -2.632 -4.221 -3.234 1.00 0.00 N ATOM 305 CA CYS A 21 -3.068 -3.298 -2.148 1.00 0.00 C ATOM 306 C CYS A 21 -3.218 -1.896 -2.736 1.00 0.00 C ATOM 307 O CYS A 21 -2.244 -1.272 -3.114 1.00 0.00 O ATOM 308 CB CYS A 21 -1.925 -3.346 -1.131 1.00 0.00 C ATOM 309 SG CYS A 21 -2.406 -2.509 0.402 1.00 0.00 S ATOM 0 H CYS A 21 -1.693 -4.047 -3.592 1.00 0.00 H new ATOM 0 HA CYS A 21 -4.021 -3.568 -1.693 1.00 0.00 H new ATOM 0 HB2 CYS A 21 -1.662 -4.382 -0.919 1.00 0.00 H new ATOM 0 HB3 CYS A 21 -1.038 -2.871 -1.549 1.00 0.00 H new ATOM 314 N GLU A 22 -4.424 -1.400 -2.842 1.00 0.00 N ATOM 315 CA GLU A 22 -4.608 -0.047 -3.439 1.00 0.00 C ATOM 316 C GLU A 22 -4.352 1.044 -2.397 1.00 0.00 C ATOM 317 O GLU A 22 -4.551 0.843 -1.213 1.00 0.00 O ATOM 318 CB GLU A 22 -6.050 -0.028 -3.973 1.00 0.00 C ATOM 319 CG GLU A 22 -7.047 0.170 -2.838 1.00 0.00 C ATOM 320 CD GLU A 22 -8.471 0.084 -3.391 1.00 0.00 C ATOM 321 OE1 GLU A 22 -8.696 -0.732 -4.270 1.00 0.00 O ATOM 322 OE2 GLU A 22 -9.312 0.836 -2.926 1.00 0.00 O ATOM 0 H GLU A 22 -5.280 -1.869 -2.544 1.00 0.00 H new ATOM 0 HA GLU A 22 -3.900 0.153 -4.243 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -6.161 0.773 -4.704 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -6.263 -0.963 -4.490 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -6.897 -0.589 -2.071 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -6.887 1.138 -2.364 1.00 0.00 H new ATOM 329 N TYR A 23 -3.920 2.197 -2.836 1.00 0.00 N ATOM 330 CA TYR A 23 -3.659 3.300 -1.892 1.00 0.00 C ATOM 331 C TYR A 23 -4.270 4.585 -2.464 1.00 0.00 C ATOM 332 O TYR A 23 -4.695 4.622 -3.604 1.00 0.00 O ATOM 333 CB TYR A 23 -2.122 3.364 -1.765 1.00 0.00 C ATOM 334 CG TYR A 23 -1.479 3.981 -2.991 1.00 0.00 C ATOM 335 CD1 TYR A 23 -1.411 5.394 -3.116 1.00 0.00 C ATOM 336 CD2 TYR A 23 -0.930 3.151 -4.003 1.00 0.00 C ATOM 337 CE1 TYR A 23 -0.798 5.978 -4.256 1.00 0.00 C ATOM 338 CE2 TYR A 23 -0.317 3.734 -5.145 1.00 0.00 C ATOM 339 CZ TYR A 23 -0.252 5.148 -5.272 1.00 0.00 C ATOM 340 OH TYR A 23 0.343 5.715 -6.380 1.00 0.00 O ATOM 0 H TYR A 23 -3.738 2.414 -3.816 1.00 0.00 H new ATOM 0 HA TYR A 23 -4.104 3.161 -0.907 1.00 0.00 H new ATOM 0 HB2 TYR A 23 -1.854 3.946 -0.883 1.00 0.00 H new ATOM 0 HB3 TYR A 23 -1.728 2.359 -1.615 1.00 0.00 H new ATOM 0 HD1 TYR A 23 -1.826 6.025 -2.344 1.00 0.00 H new ATOM 0 HD2 TYR A 23 -0.978 2.077 -3.905 1.00 0.00 H new ATOM 0 HE1 TYR A 23 -0.747 7.053 -4.351 1.00 0.00 H new ATOM 0 HE2 TYR A 23 0.099 3.103 -5.916 1.00 0.00 H new ATOM 0 HH TYR A 23 0.665 5.007 -6.977 1.00 0.00 H new ATOM 350 N ALA A 24 -4.328 5.620 -1.683 1.00 0.00 N ATOM 351 CA ALA A 24 -4.928 6.899 -2.173 1.00 0.00 C ATOM 352 C ALA A 24 -4.040 8.090 -1.815 1.00 0.00 C ATOM 353 O ALA A 24 -3.569 8.213 -0.699 1.00 0.00 O ATOM 354 CB ALA A 24 -6.274 7.001 -1.457 1.00 0.00 C ATOM 0 H ALA A 24 -3.986 5.642 -0.722 1.00 0.00 H new ATOM 0 HA ALA A 24 -5.035 6.909 -3.258 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -6.780 7.916 -1.763 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -6.891 6.141 -1.717 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -6.112 7.019 -0.379 1.00 0.00 H new ATOM 360 N SER A 25 -3.824 8.975 -2.753 1.00 0.00 N ATOM 361 CA SER A 25 -2.980 10.173 -2.482 1.00 0.00 C ATOM 362 C SER A 25 -3.577 11.420 -3.154 1.00 0.00 C ATOM 363 O SER A 25 -4.227 11.317 -4.176 1.00 0.00 O ATOM 364 CB SER A 25 -1.610 9.856 -3.073 1.00 0.00 C ATOM 365 OG SER A 25 -0.783 11.008 -2.997 1.00 0.00 O ATOM 0 H SER A 25 -4.199 8.918 -3.700 1.00 0.00 H new ATOM 0 HA SER A 25 -2.920 10.386 -1.415 1.00 0.00 H new ATOM 0 HB2 SER A 25 -1.151 9.029 -2.531 1.00 0.00 H new ATOM 0 HB3 SER A 25 -1.714 9.538 -4.110 1.00 0.00 H new ATOM 0 HG SER A 25 -0.526 11.286 -3.901 1.00 0.00 H new ATOM 371 N PRO A 26 -3.354 12.562 -2.543 1.00 0.00 N ATOM 372 CA PRO A 26 -3.866 13.842 -3.103 1.00 0.00 C ATOM 373 C PRO A 26 -3.180 14.191 -4.424 1.00 0.00 C ATOM 374 O PRO A 26 -3.687 14.972 -5.207 1.00 0.00 O ATOM 375 CB PRO A 26 -3.530 14.865 -2.019 1.00 0.00 C ATOM 376 CG PRO A 26 -2.370 14.271 -1.287 1.00 0.00 C ATOM 377 CD PRO A 26 -2.572 12.782 -1.317 1.00 0.00 C ATOM 0 HA PRO A 26 -4.930 13.802 -3.336 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -3.273 15.832 -2.452 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -4.377 15.030 -1.353 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -1.428 14.546 -1.762 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -2.328 14.637 -0.261 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -1.622 12.249 -1.347 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -3.106 12.432 -0.433 1.00 0.00 H new ATOM 385 N GLY A 27 -2.024 13.624 -4.678 1.00 0.00 N ATOM 386 CA GLY A 27 -1.299 13.925 -5.947 1.00 0.00 C ATOM 387 C GLY A 27 -0.674 12.642 -6.495 1.00 0.00 C ATOM 388 O GLY A 27 -0.585 11.643 -5.805 1.00 0.00 O ATOM 0 H GLY A 27 -1.553 12.965 -4.058 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.987 14.349 -6.679 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -0.525 14.671 -5.768 1.00 0.00 H new ATOM 392 N LYS A 28 -0.246 12.661 -7.732 1.00 0.00 N ATOM 393 CA LYS A 28 0.371 11.441 -8.334 1.00 0.00 C ATOM 394 C LYS A 28 1.857 11.679 -8.629 1.00 0.00 C ATOM 395 O LYS A 28 2.235 12.691 -9.188 1.00 0.00 O ATOM 396 CB LYS A 28 -0.404 11.208 -9.631 1.00 0.00 C ATOM 397 CG LYS A 28 -1.865 10.895 -9.301 1.00 0.00 C ATOM 398 CD LYS A 28 -2.621 10.563 -10.589 1.00 0.00 C ATOM 399 CE LYS A 28 -4.058 10.163 -10.248 1.00 0.00 C ATOM 400 NZ LYS A 28 -4.724 9.960 -11.564 1.00 0.00 N ATOM 0 H LYS A 28 -0.297 13.470 -8.351 1.00 0.00 H new ATOM 0 HA LYS A 28 0.320 10.582 -7.665 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.345 12.091 -10.267 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.039 10.383 -10.189 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.920 10.055 -8.608 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -2.328 11.748 -8.805 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.621 11.425 -11.256 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.122 9.751 -11.117 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.083 9.253 -9.649 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.557 10.940 -9.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -5.715 9.683 -11.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -4.691 10.845 -12.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -4.232 9.210 -12.090 1.00 0.00 H new ATOM 414 N ALA A 29 2.695 10.745 -8.260 1.00 0.00 N ATOM 415 CA ALA A 29 4.161 10.891 -8.515 1.00 0.00 C ATOM 416 C ALA A 29 4.703 9.602 -9.141 1.00 0.00 C ATOM 417 O ALA A 29 4.067 8.567 -9.081 1.00 0.00 O ATOM 418 CB ALA A 29 4.782 11.127 -7.139 1.00 0.00 C ATOM 0 H ALA A 29 2.425 9.881 -7.790 1.00 0.00 H new ATOM 0 HA ALA A 29 4.390 11.705 -9.203 1.00 0.00 H new ATOM 0 HB1 ALA A 29 5.861 11.244 -7.242 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.359 12.030 -6.699 1.00 0.00 H new ATOM 0 HB3 ALA A 29 4.570 10.275 -6.493 1.00 0.00 H new ATOM 424 N THR A 30 5.869 9.654 -9.741 1.00 0.00 N ATOM 425 CA THR A 30 6.434 8.419 -10.377 1.00 0.00 C ATOM 426 C THR A 30 7.068 7.532 -9.325 1.00 0.00 C ATOM 427 O THR A 30 7.041 6.325 -9.411 1.00 0.00 O ATOM 428 CB THR A 30 7.572 8.871 -11.313 1.00 0.00 C ATOM 429 OG1 THR A 30 8.685 9.299 -10.540 1.00 0.00 O ATOM 430 CG2 THR A 30 7.144 10.024 -12.192 1.00 0.00 C ATOM 0 H THR A 30 6.450 10.489 -9.818 1.00 0.00 H new ATOM 0 HA THR A 30 5.642 7.879 -10.896 1.00 0.00 H new ATOM 0 HB THR A 30 7.835 8.020 -11.942 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.408 9.584 -11.137 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.972 10.316 -12.838 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.295 9.719 -12.804 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.856 10.870 -11.568 1.00 0.00 H new ATOM 438 N GLU A 31 7.707 8.135 -8.374 1.00 0.00 N ATOM 439 CA GLU A 31 8.439 7.337 -7.366 1.00 0.00 C ATOM 440 C GLU A 31 7.513 6.764 -6.302 1.00 0.00 C ATOM 441 O GLU A 31 7.260 7.386 -5.287 1.00 0.00 O ATOM 442 CB GLU A 31 9.418 8.320 -6.713 1.00 0.00 C ATOM 443 CG GLU A 31 10.339 8.962 -7.769 1.00 0.00 C ATOM 444 CD GLU A 31 11.730 8.305 -7.757 1.00 0.00 C ATOM 445 OE1 GLU A 31 11.944 7.396 -6.969 1.00 0.00 O ATOM 446 OE2 GLU A 31 12.560 8.724 -8.548 1.00 0.00 O ATOM 0 H GLU A 31 7.755 9.146 -8.250 1.00 0.00 H new ATOM 0 HA GLU A 31 8.931 6.485 -7.836 1.00 0.00 H new ATOM 0 HB2 GLU A 31 8.863 9.097 -6.188 1.00 0.00 H new ATOM 0 HB3 GLU A 31 10.020 7.799 -5.968 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.892 8.859 -8.758 1.00 0.00 H new ATOM 0 HG3 GLU A 31 10.435 10.030 -7.573 1.00 0.00 H new ATOM 453 N VAL A 32 7.053 5.562 -6.507 1.00 0.00 N ATOM 454 CA VAL A 32 6.191 4.912 -5.487 1.00 0.00 C ATOM 455 C VAL A 32 7.003 3.782 -4.854 1.00 0.00 C ATOM 456 O VAL A 32 7.184 2.729 -5.444 1.00 0.00 O ATOM 457 CB VAL A 32 4.978 4.370 -6.254 1.00 0.00 C ATOM 458 CG1 VAL A 32 4.065 3.589 -5.302 1.00 0.00 C ATOM 459 CG2 VAL A 32 4.196 5.540 -6.854 1.00 0.00 C ATOM 0 H VAL A 32 7.238 5.002 -7.339 1.00 0.00 H new ATOM 0 HA VAL A 32 5.862 5.584 -4.694 1.00 0.00 H new ATOM 0 HB VAL A 32 5.322 3.707 -7.048 1.00 0.00 H new ATOM 0 HG11 VAL A 32 3.206 3.207 -5.853 1.00 0.00 H new ATOM 0 HG12 VAL A 32 4.618 2.755 -4.869 1.00 0.00 H new ATOM 0 HG13 VAL A 32 3.721 4.248 -4.505 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.333 5.159 -7.400 1.00 0.00 H new ATOM 0 HG22 VAL A 32 3.858 6.199 -6.055 1.00 0.00 H new ATOM 0 HG23 VAL A 32 4.840 6.097 -7.535 1.00 0.00 H new ATOM 469 N ARG A 33 7.512 4.004 -3.669 1.00 0.00 N ATOM 470 CA ARG A 33 8.330 2.956 -2.999 1.00 0.00 C ATOM 471 C ARG A 33 7.410 1.964 -2.310 1.00 0.00 C ATOM 472 O ARG A 33 6.819 2.264 -1.288 1.00 0.00 O ATOM 473 CB ARG A 33 9.183 3.700 -1.971 1.00 0.00 C ATOM 474 CG ARG A 33 10.236 2.743 -1.408 1.00 0.00 C ATOM 475 CD ARG A 33 11.047 3.445 -0.315 1.00 0.00 C ATOM 476 NE ARG A 33 12.099 2.456 0.086 1.00 0.00 N ATOM 477 CZ ARG A 33 12.832 2.633 1.167 1.00 0.00 C ATOM 478 NH1 ARG A 33 12.670 3.679 1.945 1.00 0.00 N ATOM 479 NH2 ARG A 33 13.739 1.746 1.473 1.00 0.00 N ATOM 0 H ARG A 33 7.395 4.867 -3.138 1.00 0.00 H new ATOM 0 HA ARG A 33 8.950 2.398 -3.701 1.00 0.00 H new ATOM 0 HB2 ARG A 33 9.666 4.560 -2.435 1.00 0.00 H new ATOM 0 HB3 ARG A 33 8.554 4.083 -1.167 1.00 0.00 H new ATOM 0 HG2 ARG A 33 9.752 1.855 -1.001 1.00 0.00 H new ATOM 0 HG3 ARG A 33 10.899 2.407 -2.206 1.00 0.00 H new ATOM 0 HD2 ARG A 33 11.494 4.367 -0.686 1.00 0.00 H new ATOM 0 HD3 ARG A 33 10.416 3.715 0.532 1.00 0.00 H new ATOM 0 HE ARG A 33 12.251 1.628 -0.490 1.00 0.00 H new ATOM 0 HH11 ARG A 33 11.963 4.379 1.718 1.00 0.00 H new ATOM 0 HH12 ARG A 33 13.251 3.792 2.776 1.00 0.00 H new ATOM 0 HH21 ARG A 33 13.874 0.928 0.878 1.00 0.00 H new ATOM 0 HH22 ARG A 33 14.313 1.871 2.307 1.00 0.00 H new ATOM 493 N VAL A 34 7.277 0.786 -2.862 1.00 0.00 N ATOM 494 CA VAL A 34 6.386 -0.216 -2.231 1.00 0.00 C ATOM 495 C VAL A 34 7.206 -1.302 -1.545 1.00 0.00 C ATOM 496 O VAL A 34 8.232 -1.725 -2.040 1.00 0.00 O ATOM 497 CB VAL A 34 5.532 -0.803 -3.356 1.00 0.00 C ATOM 498 CG1 VAL A 34 4.708 0.312 -4.001 1.00 0.00 C ATOM 499 CG2 VAL A 34 6.426 -1.461 -4.414 1.00 0.00 C ATOM 0 H VAL A 34 7.745 0.482 -3.716 1.00 0.00 H new ATOM 0 HA VAL A 34 5.759 0.238 -1.463 1.00 0.00 H new ATOM 0 HB VAL A 34 4.866 -1.559 -2.940 1.00 0.00 H new ATOM 0 HG11 VAL A 34 4.098 -0.104 -4.803 1.00 0.00 H new ATOM 0 HG12 VAL A 34 4.060 0.766 -3.251 1.00 0.00 H new ATOM 0 HG13 VAL A 34 5.377 1.069 -4.409 1.00 0.00 H new ATOM 0 HG21 VAL A 34 5.805 -1.875 -5.209 1.00 0.00 H new ATOM 0 HG22 VAL A 34 7.103 -0.716 -4.833 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.006 -2.261 -3.954 1.00 0.00 H new ATOM 509 N THR A 35 6.755 -1.746 -0.406 1.00 0.00 N ATOM 510 CA THR A 35 7.494 -2.805 0.334 1.00 0.00 C ATOM 511 C THR A 35 6.530 -3.911 0.777 1.00 0.00 C ATOM 512 O THR A 35 5.337 -3.702 0.922 1.00 0.00 O ATOM 513 CB THR A 35 8.107 -2.097 1.551 1.00 0.00 C ATOM 514 OG1 THR A 35 8.976 -1.066 1.105 1.00 0.00 O ATOM 515 CG2 THR A 35 8.904 -3.103 2.389 1.00 0.00 C ATOM 0 H THR A 35 5.901 -1.419 0.047 1.00 0.00 H new ATOM 0 HA THR A 35 8.259 -3.280 -0.281 1.00 0.00 H new ATOM 0 HB THR A 35 7.310 -1.671 2.160 1.00 0.00 H new ATOM 0 HG1 THR A 35 9.368 -0.611 1.879 1.00 0.00 H new ATOM 0 HG21 THR A 35 9.337 -2.596 3.251 1.00 0.00 H new ATOM 0 HG22 THR A 35 8.241 -3.898 2.731 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.701 -3.531 1.782 1.00 0.00 H new ATOM 523 N VAL A 36 7.054 -5.081 1.006 1.00 0.00 N ATOM 524 CA VAL A 36 6.212 -6.216 1.468 1.00 0.00 C ATOM 525 C VAL A 36 6.837 -6.759 2.757 1.00 0.00 C ATOM 526 O VAL A 36 8.044 -6.877 2.855 1.00 0.00 O ATOM 527 CB VAL A 36 6.268 -7.248 0.333 1.00 0.00 C ATOM 528 CG1 VAL A 36 5.503 -8.509 0.741 1.00 0.00 C ATOM 529 CG2 VAL A 36 5.630 -6.654 -0.932 1.00 0.00 C ATOM 0 H VAL A 36 8.043 -5.301 0.891 1.00 0.00 H new ATOM 0 HA VAL A 36 5.178 -5.947 1.682 1.00 0.00 H new ATOM 0 HB VAL A 36 7.308 -7.505 0.133 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.546 -9.238 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL A 36 5.954 -8.934 1.637 1.00 0.00 H new ATOM 0 HG13 VAL A 36 4.463 -8.254 0.945 1.00 0.00 H new ATOM 0 HG21 VAL A 36 5.670 -7.387 -1.738 1.00 0.00 H new ATOM 0 HG22 VAL A 36 4.591 -6.395 -0.728 1.00 0.00 H new ATOM 0 HG23 VAL A 36 6.176 -5.758 -1.229 1.00 0.00 H new ATOM 539 N LEU A 37 6.046 -7.049 3.760 1.00 0.00 N ATOM 540 CA LEU A 37 6.636 -7.551 5.041 1.00 0.00 C ATOM 541 C LEU A 37 5.903 -8.790 5.537 1.00 0.00 C ATOM 542 O LEU A 37 4.767 -9.030 5.193 1.00 0.00 O ATOM 543 CB LEU A 37 6.418 -6.429 6.059 1.00 0.00 C ATOM 544 CG LEU A 37 7.170 -5.163 5.652 1.00 0.00 C ATOM 545 CD1 LEU A 37 6.386 -3.935 6.140 1.00 0.00 C ATOM 546 CD2 LEU A 37 8.564 -5.174 6.291 1.00 0.00 C ATOM 0 H LEU A 37 5.030 -6.962 3.750 1.00 0.00 H new ATOM 0 HA LEU A 37 7.685 -7.813 4.902 1.00 0.00 H new ATOM 0 HB2 LEU A 37 5.353 -6.212 6.143 1.00 0.00 H new ATOM 0 HB3 LEU A 37 6.755 -6.756 7.043 1.00 0.00 H new ATOM 0 HG LEU A 37 7.271 -5.123 4.567 1.00 0.00 H new ATOM 0 HD11 LEU A 37 6.917 -3.027 5.853 1.00 0.00 H new ATOM 0 HD12 LEU A 37 5.394 -3.934 5.688 1.00 0.00 H new ATOM 0 HD13 LEU A 37 6.290 -3.972 7.225 1.00 0.00 H new ATOM 0 HD21 LEU A 37 9.104 -4.272 6.003 1.00 0.00 H new ATOM 0 HD22 LEU A 37 8.467 -5.207 7.376 1.00 0.00 H new ATOM 0 HD23 LEU A 37 9.114 -6.051 5.949 1.00 0.00 H new ATOM 558 N ARG A 38 6.541 -9.543 6.390 1.00 0.00 N ATOM 559 CA ARG A 38 5.883 -10.749 6.974 1.00 0.00 C ATOM 560 C ARG A 38 5.663 -10.502 8.467 1.00 0.00 C ATOM 561 O ARG A 38 6.611 -10.397 9.223 1.00 0.00 O ATOM 562 CB ARG A 38 6.872 -11.895 6.763 1.00 0.00 C ATOM 563 CG ARG A 38 6.947 -12.241 5.275 1.00 0.00 C ATOM 564 CD ARG A 38 7.970 -13.361 5.065 1.00 0.00 C ATOM 565 NE ARG A 38 8.351 -13.281 3.619 1.00 0.00 N ATOM 566 CZ ARG A 38 9.036 -14.245 3.036 1.00 0.00 C ATOM 567 NH1 ARG A 38 9.413 -15.318 3.694 1.00 0.00 N ATOM 568 NH2 ARG A 38 9.351 -14.129 1.774 1.00 0.00 N ATOM 0 H ARG A 38 7.495 -9.375 6.710 1.00 0.00 H new ATOM 0 HA ARG A 38 4.919 -10.973 6.517 1.00 0.00 H new ATOM 0 HB2 ARG A 38 7.858 -11.610 7.131 1.00 0.00 H new ATOM 0 HB3 ARG A 38 6.559 -12.769 7.334 1.00 0.00 H new ATOM 0 HG2 ARG A 38 5.968 -12.555 4.913 1.00 0.00 H new ATOM 0 HG3 ARG A 38 7.232 -11.360 4.699 1.00 0.00 H new ATOM 0 HD2 ARG A 38 8.839 -13.226 5.709 1.00 0.00 H new ATOM 0 HD3 ARG A 38 7.543 -14.334 5.306 1.00 0.00 H new ATOM 0 HE ARG A 38 8.075 -12.464 3.074 1.00 0.00 H new ATOM 0 HH11 ARG A 38 9.176 -15.420 4.681 1.00 0.00 H new ATOM 0 HH12 ARG A 38 9.942 -16.049 3.218 1.00 0.00 H new ATOM 0 HH21 ARG A 38 9.067 -13.300 1.252 1.00 0.00 H new ATOM 0 HH22 ARG A 38 9.881 -14.867 1.311 1.00 0.00 H new ATOM 582 N GLN A 39 4.430 -10.407 8.904 1.00 0.00 N ATOM 583 CA GLN A 39 4.182 -10.157 10.354 1.00 0.00 C ATOM 584 C GLN A 39 3.978 -11.471 11.104 1.00 0.00 C ATOM 585 O GLN A 39 3.217 -12.327 10.696 1.00 0.00 O ATOM 586 CB GLN A 39 2.925 -9.292 10.419 1.00 0.00 C ATOM 587 CG GLN A 39 3.242 -7.875 9.941 1.00 0.00 C ATOM 588 CD GLN A 39 2.037 -6.961 10.201 1.00 0.00 C ATOM 589 OE1 GLN A 39 0.824 -7.449 10.127 1.00 0.00 O flip ATOM 590 NE2 GLN A 39 2.201 -5.789 10.478 1.00 0.00 N flip ATOM 0 H GLN A 39 3.595 -10.491 8.325 1.00 0.00 H new ATOM 0 HA GLN A 39 5.031 -9.661 10.824 1.00 0.00 H new ATOM 0 HB2 GLN A 39 2.141 -9.727 9.799 1.00 0.00 H new ATOM 0 HB3 GLN A 39 2.545 -9.264 11.440 1.00 0.00 H new ATOM 0 HG2 GLN A 39 4.120 -7.493 10.462 1.00 0.00 H new ATOM 0 HG3 GLN A 39 3.481 -7.884 8.878 1.00 0.00 H new ATOM 0 HE21 GLN A 39 3.145 -5.406 10.536 1.00 0.00 H new ATOM 0 HE22 GLN A 39 1.395 -5.188 10.652 1.00 0.00 H new ATOM 599 N ALA A 40 4.658 -11.620 12.208 1.00 0.00 N ATOM 600 CA ALA A 40 4.528 -12.859 13.021 1.00 0.00 C ATOM 601 C ALA A 40 4.291 -12.477 14.482 1.00 0.00 C ATOM 602 O ALA A 40 4.592 -11.371 14.893 1.00 0.00 O ATOM 603 CB ALA A 40 5.869 -13.580 12.859 1.00 0.00 C ATOM 0 H ALA A 40 5.305 -10.927 12.584 1.00 0.00 H new ATOM 0 HA ALA A 40 3.695 -13.489 12.708 1.00 0.00 H new ATOM 0 HB1 ALA A 40 5.855 -14.508 13.431 1.00 0.00 H new ATOM 0 HB2 ALA A 40 6.036 -13.805 11.806 1.00 0.00 H new ATOM 0 HB3 ALA A 40 6.672 -12.941 13.225 1.00 0.00 H new ATOM 609 N ASP A 41 3.740 -13.368 15.264 1.00 0.00 N ATOM 610 CA ASP A 41 3.487 -13.046 16.703 1.00 0.00 C ATOM 611 C ASP A 41 4.794 -12.689 17.411 1.00 0.00 C ATOM 612 O ASP A 41 4.845 -11.782 18.219 1.00 0.00 O ATOM 613 CB ASP A 41 2.873 -14.305 17.300 1.00 0.00 C ATOM 614 CG ASP A 41 1.445 -14.493 16.779 1.00 0.00 C ATOM 615 OD1 ASP A 41 0.812 -13.499 16.459 1.00 0.00 O ATOM 616 OD2 ASP A 41 1.007 -15.629 16.710 1.00 0.00 O ATOM 0 H ASP A 41 3.454 -14.302 14.971 1.00 0.00 H new ATOM 0 HA ASP A 41 2.827 -12.186 16.816 1.00 0.00 H new ATOM 0 HB2 ASP A 41 3.480 -15.173 17.041 1.00 0.00 H new ATOM 0 HB3 ASP A 41 2.865 -14.234 18.388 1.00 0.00 H new ATOM 621 N SER A 42 5.850 -13.405 17.115 1.00 0.00 N ATOM 622 CA SER A 42 7.162 -13.114 17.769 1.00 0.00 C ATOM 623 C SER A 42 7.784 -11.832 17.204 1.00 0.00 C ATOM 624 O SER A 42 8.097 -10.913 17.939 1.00 0.00 O ATOM 625 CB SER A 42 8.044 -14.321 17.448 1.00 0.00 C ATOM 626 OG SER A 42 8.253 -14.389 16.043 1.00 0.00 O ATOM 0 H SER A 42 5.860 -14.178 16.449 1.00 0.00 H new ATOM 0 HA SER A 42 7.051 -12.958 18.842 1.00 0.00 H new ATOM 0 HB2 SER A 42 8.999 -14.236 17.966 1.00 0.00 H new ATOM 0 HB3 SER A 42 7.570 -15.237 17.802 1.00 0.00 H new ATOM 0 HG SER A 42 8.820 -15.161 15.834 1.00 0.00 H new ATOM 632 N GLN A 43 7.976 -11.764 15.908 1.00 0.00 N ATOM 633 CA GLN A 43 8.594 -10.545 15.294 1.00 0.00 C ATOM 634 C GLN A 43 8.165 -10.378 13.831 1.00 0.00 C ATOM 635 O GLN A 43 7.547 -11.248 13.247 1.00 0.00 O ATOM 636 CB GLN A 43 10.106 -10.775 15.372 1.00 0.00 C ATOM 637 CG GLN A 43 10.583 -10.654 16.821 1.00 0.00 C ATOM 638 CD GLN A 43 12.113 -10.622 16.853 1.00 0.00 C ATOM 639 OE1 GLN A 43 12.763 -11.109 15.949 1.00 0.00 O ATOM 640 NE2 GLN A 43 12.721 -10.069 17.867 1.00 0.00 N ATOM 0 H GLN A 43 7.731 -12.502 15.247 1.00 0.00 H new ATOM 0 HA GLN A 43 8.282 -9.640 15.816 1.00 0.00 H new ATOM 0 HB2 GLN A 43 10.352 -11.762 14.981 1.00 0.00 H new ATOM 0 HB3 GLN A 43 10.625 -10.047 14.748 1.00 0.00 H new ATOM 0 HG2 GLN A 43 10.180 -9.748 17.273 1.00 0.00 H new ATOM 0 HG3 GLN A 43 10.214 -11.495 17.408 1.00 0.00 H new ATOM 0 HE21 GLN A 43 12.177 -9.660 18.627 1.00 0.00 H new ATOM 0 HE22 GLN A 43 13.740 -10.046 17.900 1.00 0.00 H new ATOM 649 N VAL A 44 8.511 -9.262 13.236 1.00 0.00 N ATOM 650 CA VAL A 44 8.158 -9.013 11.804 1.00 0.00 C ATOM 651 C VAL A 44 9.448 -8.751 11.012 1.00 0.00 C ATOM 652 O VAL A 44 10.367 -8.129 11.513 1.00 0.00 O ATOM 653 CB VAL A 44 7.265 -7.766 11.822 1.00 0.00 C ATOM 654 CG1 VAL A 44 6.841 -7.413 10.392 1.00 0.00 C ATOM 655 CG2 VAL A 44 6.016 -8.030 12.681 1.00 0.00 C ATOM 0 H VAL A 44 9.028 -8.506 13.686 1.00 0.00 H new ATOM 0 HA VAL A 44 7.649 -9.856 11.336 1.00 0.00 H new ATOM 0 HB VAL A 44 7.824 -6.933 12.249 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.207 -6.527 10.409 1.00 0.00 H new ATOM 0 HG12 VAL A 44 7.727 -7.214 9.789 1.00 0.00 H new ATOM 0 HG13 VAL A 44 6.288 -8.247 9.960 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.386 -7.141 12.690 1.00 0.00 H new ATOM 0 HG22 VAL A 44 5.457 -8.867 12.262 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.319 -8.270 13.700 1.00 0.00 H new ATOM 665 N THR A 45 9.537 -9.233 9.794 1.00 0.00 N ATOM 666 CA THR A 45 10.790 -9.019 8.994 1.00 0.00 C ATOM 667 C THR A 45 10.483 -8.430 7.609 1.00 0.00 C ATOM 668 O THR A 45 9.377 -8.520 7.113 1.00 0.00 O ATOM 669 CB THR A 45 11.411 -10.412 8.850 1.00 0.00 C ATOM 670 OG1 THR A 45 10.506 -11.263 8.160 1.00 0.00 O ATOM 671 CG2 THR A 45 11.710 -10.993 10.234 1.00 0.00 C ATOM 0 H THR A 45 8.804 -9.761 9.321 1.00 0.00 H new ATOM 0 HA THR A 45 11.457 -8.310 9.485 1.00 0.00 H new ATOM 0 HB THR A 45 12.341 -10.336 8.287 1.00 0.00 H new ATOM 0 HG1 THR A 45 10.902 -12.154 8.065 1.00 0.00 H new ATOM 0 HG21 THR A 45 12.151 -11.984 10.125 1.00 0.00 H new ATOM 0 HG22 THR A 45 12.407 -10.341 10.760 1.00 0.00 H new ATOM 0 HG23 THR A 45 10.784 -11.069 10.804 1.00 0.00 H new ATOM 679 N GLU A 46 11.473 -7.833 6.984 1.00 0.00 N ATOM 680 CA GLU A 46 11.271 -7.232 5.627 1.00 0.00 C ATOM 681 C GLU A 46 11.329 -8.312 4.547 1.00 0.00 C ATOM 682 O GLU A 46 11.810 -9.406 4.775 1.00 0.00 O ATOM 683 CB GLU A 46 12.416 -6.234 5.451 1.00 0.00 C ATOM 684 CG GLU A 46 12.174 -5.018 6.349 1.00 0.00 C ATOM 685 CD GLU A 46 13.412 -4.118 6.340 1.00 0.00 C ATOM 686 OE1 GLU A 46 14.075 -4.063 5.317 1.00 0.00 O ATOM 687 OE2 GLU A 46 13.675 -3.497 7.357 1.00 0.00 O ATOM 0 H GLU A 46 12.417 -7.737 7.359 1.00 0.00 H new ATOM 0 HA GLU A 46 10.297 -6.751 5.538 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.366 -6.705 5.706 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.484 -5.922 4.409 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.305 -4.461 5.998 1.00 0.00 H new ATOM 0 HG3 GLU A 46 11.955 -5.342 7.366 1.00 0.00 H new ATOM 694 N VAL A 47 10.821 -8.014 3.376 1.00 0.00 N ATOM 695 CA VAL A 47 10.824 -9.028 2.279 1.00 0.00 C ATOM 696 C VAL A 47 11.390 -8.416 0.987 1.00 0.00 C ATOM 697 O VAL A 47 12.427 -8.827 0.502 1.00 0.00 O ATOM 698 CB VAL A 47 9.348 -9.413 2.095 1.00 0.00 C ATOM 699 CG1 VAL A 47 9.227 -10.546 1.086 1.00 0.00 C ATOM 700 CG2 VAL A 47 8.750 -9.875 3.430 1.00 0.00 C ATOM 0 H VAL A 47 10.406 -7.114 3.134 1.00 0.00 H new ATOM 0 HA VAL A 47 11.446 -9.892 2.515 1.00 0.00 H new ATOM 0 HB VAL A 47 8.807 -8.538 1.735 1.00 0.00 H new ATOM 0 HG11 VAL A 47 8.177 -10.812 0.962 1.00 0.00 H new ATOM 0 HG12 VAL A 47 9.636 -10.225 0.128 1.00 0.00 H new ATOM 0 HG13 VAL A 47 9.781 -11.413 1.445 1.00 0.00 H new ATOM 0 HG21 VAL A 47 7.704 -10.145 3.286 1.00 0.00 H new ATOM 0 HG22 VAL A 47 9.301 -10.741 3.795 1.00 0.00 H new ATOM 0 HG23 VAL A 47 8.819 -9.067 4.159 1.00 0.00 H new ATOM 710 N CYS A 48 10.711 -7.443 0.427 1.00 0.00 N ATOM 711 CA CYS A 48 11.200 -6.806 -0.839 1.00 0.00 C ATOM 712 C CYS A 48 10.765 -5.334 -0.893 1.00 0.00 C ATOM 713 O CYS A 48 9.763 -4.965 -0.310 1.00 0.00 O ATOM 714 CB CYS A 48 10.539 -7.626 -1.944 1.00 0.00 C ATOM 715 SG CYS A 48 10.938 -9.378 -1.698 1.00 0.00 S ATOM 0 H CYS A 48 9.838 -7.062 0.792 1.00 0.00 H new ATOM 0 HA CYS A 48 12.286 -6.802 -0.928 1.00 0.00 H new ATOM 0 HB2 CYS A 48 9.459 -7.480 -1.927 1.00 0.00 H new ATOM 0 HB3 CYS A 48 10.890 -7.293 -2.921 1.00 0.00 H new ATOM 720 N ALA A 49 11.514 -4.482 -1.572 1.00 0.00 N ATOM 721 CA ALA A 49 11.119 -3.033 -1.624 1.00 0.00 C ATOM 722 C ALA A 49 11.909 -2.247 -2.689 1.00 0.00 C ATOM 723 O ALA A 49 13.108 -2.397 -2.826 1.00 0.00 O ATOM 724 CB ALA A 49 11.448 -2.506 -0.228 1.00 0.00 C ATOM 0 H ALA A 49 12.364 -4.724 -2.081 1.00 0.00 H new ATOM 0 HA ALA A 49 10.070 -2.917 -1.896 1.00 0.00 H new ATOM 0 HB1 ALA A 49 11.192 -1.448 -0.169 1.00 0.00 H new ATOM 0 HB2 ALA A 49 10.874 -3.060 0.515 1.00 0.00 H new ATOM 0 HB3 ALA A 49 12.513 -2.633 -0.033 1.00 0.00 H new ATOM 730 N ALA A 50 11.235 -1.387 -3.422 1.00 0.00 N ATOM 731 CA ALA A 50 11.925 -0.556 -4.467 1.00 0.00 C ATOM 732 C ALA A 50 10.973 0.542 -4.977 1.00 0.00 C ATOM 733 O ALA A 50 9.773 0.345 -5.036 1.00 0.00 O ATOM 734 CB ALA A 50 12.274 -1.532 -5.601 1.00 0.00 C ATOM 0 H ALA A 50 10.231 -1.224 -3.341 1.00 0.00 H new ATOM 0 HA ALA A 50 12.813 -0.059 -4.076 1.00 0.00 H new ATOM 0 HB1 ALA A 50 12.782 -0.993 -6.401 1.00 0.00 H new ATOM 0 HB2 ALA A 50 12.929 -2.315 -5.218 1.00 0.00 H new ATOM 0 HB3 ALA A 50 11.360 -1.981 -5.989 1.00 0.00 H new ATOM 740 N THR A 51 11.495 1.692 -5.358 1.00 0.00 N ATOM 741 CA THR A 51 10.604 2.783 -5.880 1.00 0.00 C ATOM 742 C THR A 51 10.585 2.715 -7.396 1.00 0.00 C ATOM 743 O THR A 51 11.594 2.925 -8.040 1.00 0.00 O ATOM 744 CB THR A 51 11.228 4.107 -5.434 1.00 0.00 C ATOM 745 OG1 THR A 51 11.725 3.976 -4.110 1.00 0.00 O ATOM 746 CG2 THR A 51 10.160 5.202 -5.463 1.00 0.00 C ATOM 0 H THR A 51 12.489 1.919 -5.330 1.00 0.00 H new ATOM 0 HA THR A 51 9.584 2.686 -5.509 1.00 0.00 H new ATOM 0 HB THR A 51 12.045 4.368 -6.106 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.074 4.839 -3.805 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.600 6.148 -5.146 1.00 0.00 H new ATOM 0 HG22 THR A 51 9.771 5.304 -6.476 1.00 0.00 H new ATOM 0 HG23 THR A 51 9.347 4.935 -4.788 1.00 0.00 H new ATOM 754 N TYR A 52 9.450 2.425 -7.969 1.00 0.00 N ATOM 755 CA TYR A 52 9.374 2.329 -9.455 1.00 0.00 C ATOM 756 C TYR A 52 8.587 3.488 -10.046 1.00 0.00 C ATOM 757 O TYR A 52 7.613 3.941 -9.474 1.00 0.00 O ATOM 758 CB TYR A 52 8.654 1.003 -9.745 1.00 0.00 C ATOM 759 CG TYR A 52 7.279 0.997 -9.112 1.00 0.00 C ATOM 760 CD1 TYR A 52 6.183 1.576 -9.803 1.00 0.00 C ATOM 761 CD2 TYR A 52 7.081 0.411 -7.833 1.00 0.00 C ATOM 762 CE1 TYR A 52 4.890 1.575 -9.216 1.00 0.00 C ATOM 763 CE2 TYR A 52 5.787 0.409 -7.247 1.00 0.00 C ATOM 764 CZ TYR A 52 4.692 0.992 -7.937 1.00 0.00 C ATOM 765 OH TYR A 52 3.437 0.993 -7.363 1.00 0.00 O ATOM 0 H TYR A 52 8.575 2.251 -7.475 1.00 0.00 H new ATOM 0 HA TYR A 52 10.368 2.368 -9.901 1.00 0.00 H new ATOM 0 HB2 TYR A 52 8.566 0.858 -10.822 1.00 0.00 H new ATOM 0 HB3 TYR A 52 9.242 0.171 -9.359 1.00 0.00 H new ATOM 0 HD1 TYR A 52 6.333 2.018 -10.777 1.00 0.00 H new ATOM 0 HD2 TYR A 52 7.913 -0.032 -7.307 1.00 0.00 H new ATOM 0 HE1 TYR A 52 4.057 2.018 -9.743 1.00 0.00 H new ATOM 0 HE2 TYR A 52 5.636 -0.037 -6.275 1.00 0.00 H new ATOM 0 HH TYR A 52 2.939 1.780 -7.667 1.00 0.00 H new ATOM 775 N MET A 53 8.985 3.938 -11.209 1.00 0.00 N ATOM 776 CA MET A 53 8.237 5.034 -11.872 1.00 0.00 C ATOM 777 C MET A 53 6.930 4.428 -12.389 1.00 0.00 C ATOM 778 O MET A 53 6.855 3.226 -12.575 1.00 0.00 O ATOM 779 CB MET A 53 9.097 5.485 -13.060 1.00 0.00 C ATOM 780 CG MET A 53 10.460 5.976 -12.578 1.00 0.00 C ATOM 781 SD MET A 53 10.804 5.286 -10.949 1.00 0.00 S ATOM 782 CE MET A 53 10.382 6.761 -9.997 1.00 0.00 C ATOM 0 H MET A 53 9.795 3.591 -11.723 1.00 0.00 H new ATOM 0 HA MET A 53 8.027 5.873 -11.209 1.00 0.00 H new ATOM 0 HB2 MET A 53 9.228 4.657 -13.757 1.00 0.00 H new ATOM 0 HB3 MET A 53 8.588 6.281 -13.603 1.00 0.00 H new ATOM 0 HG2 MET A 53 11.236 5.678 -13.283 1.00 0.00 H new ATOM 0 HG3 MET A 53 10.471 7.065 -12.533 1.00 0.00 H new ATOM 0 HE1 MET A 53 10.540 6.567 -8.936 1.00 0.00 H new ATOM 0 HE2 MET A 53 11.014 7.591 -10.312 1.00 0.00 H new ATOM 0 HE3 MET A 53 9.336 7.017 -10.167 1.00 0.00 H new ATOM 792 N MET A 54 5.911 5.209 -12.635 1.00 0.00 N ATOM 793 CA MET A 54 4.642 4.604 -13.150 1.00 0.00 C ATOM 794 C MET A 54 4.865 4.052 -14.560 1.00 0.00 C ATOM 795 O MET A 54 5.397 4.722 -15.425 1.00 0.00 O ATOM 796 CB MET A 54 3.616 5.736 -13.152 1.00 0.00 C ATOM 797 CG MET A 54 3.320 6.138 -11.708 1.00 0.00 C ATOM 798 SD MET A 54 3.018 4.648 -10.722 1.00 0.00 S ATOM 799 CE MET A 54 4.716 4.419 -10.133 1.00 0.00 C ATOM 0 H MET A 54 5.898 6.221 -12.506 1.00 0.00 H new ATOM 0 HA MET A 54 4.300 3.771 -12.536 1.00 0.00 H new ATOM 0 HB2 MET A 54 3.998 6.590 -13.710 1.00 0.00 H new ATOM 0 HB3 MET A 54 2.701 5.414 -13.649 1.00 0.00 H new ATOM 0 HG2 MET A 54 4.159 6.698 -11.295 1.00 0.00 H new ATOM 0 HG3 MET A 54 2.451 6.794 -11.672 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.701 4.143 -9.079 1.00 0.00 H new ATOM 0 HE2 MET A 54 5.197 3.628 -10.708 1.00 0.00 H new ATOM 0 HE3 MET A 54 5.273 5.348 -10.257 1.00 0.00 H new ATOM 809 N GLY A 55 4.463 2.826 -14.787 1.00 0.00 N ATOM 810 CA GLY A 55 4.648 2.205 -16.131 1.00 0.00 C ATOM 811 C GLY A 55 6.028 1.541 -16.219 1.00 0.00 C ATOM 812 O GLY A 55 6.615 1.464 -17.282 1.00 0.00 O ATOM 0 H GLY A 55 4.013 2.227 -14.095 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.868 1.465 -16.309 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.551 2.964 -16.907 1.00 0.00 H new ATOM 816 N ASN A 56 6.550 1.056 -15.114 1.00 0.00 N ATOM 817 CA ASN A 56 7.894 0.393 -15.149 1.00 0.00 C ATOM 818 C ASN A 56 7.991 -0.704 -14.082 1.00 0.00 C ATOM 819 O ASN A 56 7.092 -0.896 -13.286 1.00 0.00 O ATOM 820 CB ASN A 56 8.903 1.499 -14.852 1.00 0.00 C ATOM 821 CG ASN A 56 10.225 1.185 -15.555 1.00 0.00 C ATOM 822 OD1 ASN A 56 10.941 0.288 -15.158 1.00 0.00 O ATOM 823 ND2 ASN A 56 10.580 1.891 -16.594 1.00 0.00 N ATOM 0 H ASN A 56 6.106 1.091 -14.196 1.00 0.00 H new ATOM 0 HA ASN A 56 8.076 -0.083 -16.113 1.00 0.00 H new ATOM 0 HB2 ASN A 56 8.517 2.460 -15.193 1.00 0.00 H new ATOM 0 HB3 ASN A 56 9.061 1.582 -13.777 1.00 0.00 H new ATOM 0 HD21 ASN A 56 11.458 1.689 -17.072 1.00 0.00 H new ATOM 0 HD22 ASN A 56 9.979 2.645 -16.928 1.00 0.00 H new ATOM 830 N GLU A 57 9.087 -1.418 -14.070 1.00 0.00 N ATOM 831 CA GLU A 57 9.280 -2.512 -13.064 1.00 0.00 C ATOM 832 C GLU A 57 10.714 -2.479 -12.516 1.00 0.00 C ATOM 833 O GLU A 57 11.635 -2.081 -13.203 1.00 0.00 O ATOM 834 CB GLU A 57 9.043 -3.810 -13.842 1.00 0.00 C ATOM 835 CG GLU A 57 7.592 -3.867 -14.328 1.00 0.00 C ATOM 836 CD GLU A 57 6.652 -3.959 -13.125 1.00 0.00 C ATOM 837 OE1 GLU A 57 6.720 -4.953 -12.421 1.00 0.00 O ATOM 838 OE2 GLU A 57 5.879 -3.036 -12.929 1.00 0.00 O ATOM 0 H GLU A 57 9.864 -1.291 -14.718 1.00 0.00 H new ATOM 0 HA GLU A 57 8.607 -2.413 -12.213 1.00 0.00 H new ATOM 0 HB2 GLU A 57 9.723 -3.864 -14.692 1.00 0.00 H new ATOM 0 HB3 GLU A 57 9.257 -4.670 -13.207 1.00 0.00 H new ATOM 0 HG2 GLU A 57 7.360 -2.980 -14.917 1.00 0.00 H new ATOM 0 HG3 GLU A 57 7.450 -4.729 -14.980 1.00 0.00 H new ATOM 845 N LEU A 58 10.911 -2.898 -11.286 1.00 0.00 N ATOM 846 CA LEU A 58 12.289 -2.892 -10.702 1.00 0.00 C ATOM 847 C LEU A 58 12.600 -4.203 -9.983 1.00 0.00 C ATOM 848 O LEU A 58 11.787 -5.105 -9.921 1.00 0.00 O ATOM 849 CB LEU A 58 12.316 -1.737 -9.710 1.00 0.00 C ATOM 850 CG LEU A 58 12.269 -0.410 -10.460 1.00 0.00 C ATOM 851 CD1 LEU A 58 12.213 0.721 -9.444 1.00 0.00 C ATOM 852 CD2 LEU A 58 13.527 -0.256 -11.320 1.00 0.00 C ATOM 0 H LEU A 58 10.179 -3.242 -10.665 1.00 0.00 H new ATOM 0 HA LEU A 58 13.038 -2.781 -11.486 1.00 0.00 H new ATOM 0 HB2 LEU A 58 11.468 -1.811 -9.029 1.00 0.00 H new ATOM 0 HB3 LEU A 58 13.219 -1.789 -9.101 1.00 0.00 H new ATOM 0 HG LEU A 58 11.390 -0.382 -11.105 1.00 0.00 H new ATOM 0 HD11 LEU A 58 12.179 1.677 -9.966 1.00 0.00 H new ATOM 0 HD12 LEU A 58 11.321 0.612 -8.827 1.00 0.00 H new ATOM 0 HD13 LEU A 58 13.099 0.685 -8.810 1.00 0.00 H new ATOM 0 HD21 LEU A 58 13.489 0.694 -11.854 1.00 0.00 H new ATOM 0 HD22 LEU A 58 14.410 -0.278 -10.681 1.00 0.00 H new ATOM 0 HD23 LEU A 58 13.579 -1.074 -12.038 1.00 0.00 H new ATOM 864 N THR A 59 13.785 -4.302 -9.443 1.00 0.00 N ATOM 865 CA THR A 59 14.206 -5.522 -8.727 1.00 0.00 C ATOM 866 C THR A 59 14.401 -5.218 -7.242 1.00 0.00 C ATOM 867 O THR A 59 14.573 -4.078 -6.853 1.00 0.00 O ATOM 868 CB THR A 59 15.536 -5.878 -9.379 1.00 0.00 C ATOM 869 OG1 THR A 59 16.451 -4.807 -9.197 1.00 0.00 O ATOM 870 CG2 THR A 59 15.344 -6.158 -10.871 1.00 0.00 C ATOM 0 H THR A 59 14.490 -3.565 -9.474 1.00 0.00 H new ATOM 0 HA THR A 59 13.476 -6.330 -8.787 1.00 0.00 H new ATOM 0 HB THR A 59 15.933 -6.779 -8.910 1.00 0.00 H new ATOM 0 HG1 THR A 59 17.308 -5.035 -9.614 1.00 0.00 H new ATOM 0 HG21 THR A 59 16.304 -6.411 -11.320 1.00 0.00 H new ATOM 0 HG22 THR A 59 14.653 -6.991 -10.999 1.00 0.00 H new ATOM 0 HG23 THR A 59 14.937 -5.272 -11.358 1.00 0.00 H new ATOM 878 N PHE A 60 14.374 -6.227 -6.414 1.00 0.00 N ATOM 879 CA PHE A 60 14.562 -6.008 -4.950 1.00 0.00 C ATOM 880 C PHE A 60 15.917 -6.580 -4.512 1.00 0.00 C ATOM 881 O PHE A 60 16.213 -7.736 -4.740 1.00 0.00 O ATOM 882 CB PHE A 60 13.397 -6.759 -4.304 1.00 0.00 C ATOM 883 CG PHE A 60 12.092 -6.138 -4.755 1.00 0.00 C ATOM 884 CD1 PHE A 60 11.873 -4.745 -4.587 1.00 0.00 C ATOM 885 CD2 PHE A 60 11.087 -6.946 -5.354 1.00 0.00 C ATOM 886 CE1 PHE A 60 10.650 -4.159 -5.015 1.00 0.00 C ATOM 887 CE2 PHE A 60 9.864 -6.360 -5.782 1.00 0.00 C ATOM 888 CZ PHE A 60 9.646 -4.967 -5.612 1.00 0.00 C ATOM 0 H PHE A 60 14.229 -7.198 -6.689 1.00 0.00 H new ATOM 0 HA PHE A 60 14.567 -4.956 -4.665 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.428 -7.812 -4.584 1.00 0.00 H new ATOM 0 HB3 PHE A 60 13.478 -6.715 -3.218 1.00 0.00 H new ATOM 0 HD1 PHE A 60 12.636 -4.130 -4.134 1.00 0.00 H new ATOM 0 HD2 PHE A 60 11.253 -8.005 -5.484 1.00 0.00 H new ATOM 0 HE1 PHE A 60 10.485 -3.100 -4.886 1.00 0.00 H new ATOM 0 HE2 PHE A 60 9.101 -6.974 -6.236 1.00 0.00 H new ATOM 0 HZ PHE A 60 8.717 -4.522 -5.937 1.00 0.00 H new ATOM 898 N LEU A 61 16.753 -5.764 -3.921 1.00 0.00 N ATOM 899 CA LEU A 61 18.112 -6.237 -3.493 1.00 0.00 C ATOM 900 C LEU A 61 18.044 -7.223 -2.317 1.00 0.00 C ATOM 901 O LEU A 61 18.835 -8.143 -2.229 1.00 0.00 O ATOM 902 CB LEU A 61 18.858 -4.968 -3.071 1.00 0.00 C ATOM 903 CG LEU A 61 19.163 -4.113 -4.304 1.00 0.00 C ATOM 904 CD1 LEU A 61 19.807 -2.797 -3.865 1.00 0.00 C ATOM 905 CD2 LEU A 61 20.128 -4.866 -5.224 1.00 0.00 C ATOM 0 H LEU A 61 16.555 -4.785 -3.714 1.00 0.00 H new ATOM 0 HA LEU A 61 18.607 -6.774 -4.302 1.00 0.00 H new ATOM 0 HB2 LEU A 61 18.256 -4.399 -2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 61 19.785 -5.232 -2.562 1.00 0.00 H new ATOM 0 HG LEU A 61 18.236 -3.907 -4.839 1.00 0.00 H new ATOM 0 HD11 LEU A 61 20.024 -2.188 -4.742 1.00 0.00 H new ATOM 0 HD12 LEU A 61 19.123 -2.258 -3.209 1.00 0.00 H new ATOM 0 HD13 LEU A 61 20.733 -3.006 -3.330 1.00 0.00 H new ATOM 0 HD21 LEU A 61 20.344 -4.257 -6.101 1.00 0.00 H new ATOM 0 HD22 LEU A 61 21.054 -5.073 -4.688 1.00 0.00 H new ATOM 0 HD23 LEU A 61 19.673 -5.805 -5.538 1.00 0.00 H new ATOM 917 N ASP A 62 17.125 -7.028 -1.405 1.00 0.00 N ATOM 918 CA ASP A 62 17.034 -7.939 -0.217 1.00 0.00 C ATOM 919 C ASP A 62 16.606 -9.354 -0.634 1.00 0.00 C ATOM 920 O ASP A 62 16.946 -9.816 -1.705 1.00 0.00 O ATOM 921 CB ASP A 62 16.016 -7.276 0.725 1.00 0.00 C ATOM 922 CG ASP A 62 14.627 -7.217 0.079 1.00 0.00 C ATOM 923 OD1 ASP A 62 14.483 -7.669 -1.047 1.00 0.00 O ATOM 924 OD2 ASP A 62 13.726 -6.716 0.731 1.00 0.00 O ATOM 0 H ASP A 62 16.433 -6.279 -1.429 1.00 0.00 H new ATOM 0 HA ASP A 62 17.997 -8.068 0.276 1.00 0.00 H new ATOM 0 HB2 ASP A 62 15.963 -7.834 1.660 1.00 0.00 H new ATOM 0 HB3 ASP A 62 16.348 -6.268 0.974 1.00 0.00 H new ATOM 929 N ASP A 63 15.880 -10.057 0.212 1.00 0.00 N ATOM 930 CA ASP A 63 15.444 -11.452 -0.107 1.00 0.00 C ATOM 931 C ASP A 63 14.869 -11.588 -1.519 1.00 0.00 C ATOM 932 O ASP A 63 14.796 -12.671 -2.066 1.00 0.00 O ATOM 933 CB ASP A 63 14.380 -11.796 0.940 1.00 0.00 C ATOM 934 CG ASP A 63 15.043 -12.001 2.306 1.00 0.00 C ATOM 935 OD1 ASP A 63 16.200 -12.390 2.335 1.00 0.00 O ATOM 936 OD2 ASP A 63 14.379 -11.767 3.303 1.00 0.00 O ATOM 0 H ASP A 63 15.570 -9.714 1.121 1.00 0.00 H new ATOM 0 HA ASP A 63 16.297 -12.130 -0.079 1.00 0.00 H new ATOM 0 HB2 ASP A 63 13.643 -10.995 1.000 1.00 0.00 H new ATOM 0 HB3 ASP A 63 13.846 -12.699 0.646 1.00 0.00 H new ATOM 941 N SER A 64 14.472 -10.500 -2.106 1.00 0.00 N ATOM 942 CA SER A 64 13.904 -10.527 -3.492 1.00 0.00 C ATOM 943 C SER A 64 12.680 -11.465 -3.560 1.00 0.00 C ATOM 944 O SER A 64 11.799 -11.383 -2.727 1.00 0.00 O ATOM 945 CB SER A 64 15.061 -11.001 -4.386 1.00 0.00 C ATOM 946 OG SER A 64 16.178 -10.144 -4.207 1.00 0.00 O ATOM 0 H SER A 64 14.515 -9.573 -1.683 1.00 0.00 H new ATOM 0 HA SER A 64 13.537 -9.553 -3.817 1.00 0.00 H new ATOM 0 HB2 SER A 64 15.332 -12.027 -4.135 1.00 0.00 H new ATOM 0 HB3 SER A 64 14.752 -10.999 -5.431 1.00 0.00 H new ATOM 0 HG SER A 64 15.876 -9.212 -4.195 1.00 0.00 H new ATOM 952 N ILE A 67 12.599 -12.343 -4.547 1.00 0.00 N ATOM 953 CA ILE A 67 11.420 -13.264 -4.662 1.00 0.00 C ATOM 954 C ILE A 67 10.113 -12.452 -4.727 1.00 0.00 C ATOM 955 O ILE A 67 9.042 -12.952 -4.437 1.00 0.00 O ATOM 956 CB ILE A 67 11.477 -14.163 -3.423 1.00 0.00 C ATOM 957 CG1 ILE A 67 12.775 -14.970 -3.480 1.00 0.00 C ATOM 958 CG2 ILE A 67 10.281 -15.126 -3.418 1.00 0.00 C ATOM 959 CD1 ILE A 67 12.920 -15.788 -2.206 1.00 0.00 C ATOM 0 H ILE A 67 13.303 -12.457 -5.276 1.00 0.00 H new ATOM 0 HA ILE A 67 11.448 -13.862 -5.573 1.00 0.00 H new ATOM 0 HB ILE A 67 11.442 -13.554 -2.520 1.00 0.00 H new ATOM 0 HG12 ILE A 67 12.769 -15.628 -4.349 1.00 0.00 H new ATOM 0 HG13 ILE A 67 13.627 -14.300 -3.594 1.00 0.00 H new ATOM 0 HG21 ILE A 67 10.329 -15.762 -2.534 1.00 0.00 H new ATOM 0 HG22 ILE A 67 9.353 -14.554 -3.403 1.00 0.00 H new ATOM 0 HG23 ILE A 67 10.310 -15.747 -4.313 1.00 0.00 H new ATOM 0 HD11 ILE A 67 13.845 -16.363 -2.246 1.00 0.00 H new ATOM 0 HD12 ILE A 67 12.946 -15.120 -1.345 1.00 0.00 H new ATOM 0 HD13 ILE A 67 12.073 -16.468 -2.112 1.00 0.00 H new ATOM 971 N CYS A 68 10.195 -11.201 -5.118 1.00 0.00 N ATOM 972 CA CYS A 68 8.966 -10.357 -5.215 1.00 0.00 C ATOM 973 C CYS A 68 9.006 -9.526 -6.500 1.00 0.00 C ATOM 974 O CYS A 68 10.065 -9.229 -7.020 1.00 0.00 O ATOM 975 CB CYS A 68 9.015 -9.425 -4.005 1.00 0.00 C ATOM 976 SG CYS A 68 9.376 -10.370 -2.509 1.00 0.00 S ATOM 0 H CYS A 68 11.063 -10.730 -5.374 1.00 0.00 H new ATOM 0 HA CYS A 68 8.059 -10.962 -5.233 1.00 0.00 H new ATOM 0 HB2 CYS A 68 9.778 -8.661 -4.155 1.00 0.00 H new ATOM 0 HB3 CYS A 68 8.062 -8.907 -3.896 1.00 0.00 H new ATOM 981 N THR A 69 7.864 -9.130 -7.000 1.00 0.00 N ATOM 982 CA THR A 69 7.839 -8.294 -8.238 1.00 0.00 C ATOM 983 C THR A 69 7.155 -6.956 -7.936 1.00 0.00 C ATOM 984 O THR A 69 6.178 -6.902 -7.213 1.00 0.00 O ATOM 985 CB THR A 69 7.047 -9.109 -9.270 1.00 0.00 C ATOM 986 OG1 THR A 69 7.052 -8.423 -10.514 1.00 0.00 O ATOM 987 CG2 THR A 69 5.603 -9.301 -8.800 1.00 0.00 C ATOM 0 H THR A 69 6.949 -9.349 -6.606 1.00 0.00 H new ATOM 0 HA THR A 69 8.837 -8.064 -8.611 1.00 0.00 H new ATOM 0 HB THR A 69 7.514 -10.087 -9.384 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.548 -8.942 -11.176 1.00 0.00 H new ATOM 0 HG21 THR A 69 5.053 -9.881 -9.541 1.00 0.00 H new ATOM 0 HG22 THR A 69 5.598 -9.832 -7.848 1.00 0.00 H new ATOM 0 HG23 THR A 69 5.128 -8.328 -8.675 1.00 0.00 H new ATOM 995 N GLY A 70 7.667 -5.880 -8.474 1.00 0.00 N ATOM 996 CA GLY A 70 7.057 -4.546 -8.207 1.00 0.00 C ATOM 997 C GLY A 70 6.183 -4.124 -9.388 1.00 0.00 C ATOM 998 O GLY A 70 6.665 -3.568 -10.357 1.00 0.00 O ATOM 0 H GLY A 70 8.482 -5.869 -9.087 1.00 0.00 H new ATOM 0 HA2 GLY A 70 6.458 -4.587 -7.297 1.00 0.00 H new ATOM 0 HA3 GLY A 70 7.840 -3.806 -8.041 1.00 0.00 H new ATOM 1002 N THR A 71 4.898 -4.367 -9.306 1.00 0.00 N ATOM 1003 CA THR A 71 3.986 -3.963 -10.413 1.00 0.00 C ATOM 1004 C THR A 71 2.892 -3.065 -9.852 1.00 0.00 C ATOM 1005 O THR A 71 2.590 -3.110 -8.673 1.00 0.00 O ATOM 1006 CB THR A 71 3.382 -5.249 -10.950 1.00 0.00 C ATOM 1007 OG1 THR A 71 4.409 -6.208 -11.161 1.00 0.00 O ATOM 1008 CG2 THR A 71 2.671 -4.964 -12.273 1.00 0.00 C ATOM 0 H THR A 71 4.444 -4.828 -8.518 1.00 0.00 H new ATOM 0 HA THR A 71 4.508 -3.416 -11.198 1.00 0.00 H new ATOM 0 HB THR A 71 2.665 -5.641 -10.228 1.00 0.00 H new ATOM 0 HG1 THR A 71 5.179 -5.775 -11.586 1.00 0.00 H new ATOM 0 HG21 THR A 71 2.237 -5.886 -12.659 1.00 0.00 H new ATOM 0 HG22 THR A 71 1.880 -4.231 -12.111 1.00 0.00 H new ATOM 0 HG23 THR A 71 3.388 -4.571 -12.994 1.00 0.00 H new ATOM 1016 N SER A 72 2.306 -2.246 -10.677 1.00 0.00 N ATOM 1017 CA SER A 72 1.234 -1.337 -10.179 1.00 0.00 C ATOM 1018 C SER A 72 0.303 -0.903 -11.317 1.00 0.00 C ATOM 1019 O SER A 72 0.656 -0.950 -12.479 1.00 0.00 O ATOM 1020 CB SER A 72 1.982 -0.131 -9.620 1.00 0.00 C ATOM 1021 OG SER A 72 2.674 0.522 -10.676 1.00 0.00 O ATOM 0 H SER A 72 2.520 -2.165 -11.671 1.00 0.00 H new ATOM 0 HA SER A 72 0.603 -1.823 -9.435 1.00 0.00 H new ATOM 0 HB2 SER A 72 1.283 0.558 -9.147 1.00 0.00 H new ATOM 0 HB3 SER A 72 2.685 -0.449 -8.851 1.00 0.00 H new ATOM 0 HG SER A 72 3.625 0.594 -10.449 1.00 0.00 H new ATOM 1027 N SER A 73 -0.873 -0.451 -10.973 1.00 0.00 N ATOM 1028 CA SER A 73 -1.845 0.020 -12.001 1.00 0.00 C ATOM 1029 C SER A 73 -2.556 1.270 -11.474 1.00 0.00 C ATOM 1030 O SER A 73 -3.368 1.193 -10.571 1.00 0.00 O ATOM 1031 CB SER A 73 -2.835 -1.130 -12.177 1.00 0.00 C ATOM 1032 OG SER A 73 -3.754 -0.805 -13.212 1.00 0.00 O ATOM 0 H SER A 73 -1.205 -0.387 -10.011 1.00 0.00 H new ATOM 0 HA SER A 73 -1.371 0.280 -12.947 1.00 0.00 H new ATOM 0 HB2 SER A 73 -2.303 -2.049 -12.423 1.00 0.00 H new ATOM 0 HB3 SER A 73 -3.369 -1.311 -11.244 1.00 0.00 H new ATOM 0 HG SER A 73 -4.390 -1.542 -13.328 1.00 0.00 H new ATOM 1038 N GLY A 74 -2.245 2.423 -12.016 1.00 0.00 N ATOM 1039 CA GLY A 74 -2.893 3.681 -11.531 1.00 0.00 C ATOM 1040 C GLY A 74 -2.527 3.894 -10.058 1.00 0.00 C ATOM 1041 O GLY A 74 -1.365 3.927 -9.700 1.00 0.00 O ATOM 0 H GLY A 74 -1.572 2.547 -12.772 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -2.561 4.530 -12.128 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -3.975 3.615 -11.645 1.00 0.00 H new ATOM 1045 N ASN A 75 -3.510 4.025 -9.202 1.00 0.00 N ATOM 1046 CA ASN A 75 -3.224 4.216 -7.746 1.00 0.00 C ATOM 1047 C ASN A 75 -3.234 2.868 -7.009 1.00 0.00 C ATOM 1048 O ASN A 75 -3.212 2.820 -5.793 1.00 0.00 O ATOM 1049 CB ASN A 75 -4.351 5.113 -7.235 1.00 0.00 C ATOM 1050 CG ASN A 75 -4.275 6.476 -7.923 1.00 0.00 C ATOM 1051 OD1 ASN A 75 -3.259 7.140 -7.870 1.00 0.00 O ATOM 1052 ND2 ASN A 75 -5.315 6.925 -8.572 1.00 0.00 N ATOM 0 H ASN A 75 -4.500 4.008 -9.449 1.00 0.00 H new ATOM 0 HA ASN A 75 -2.241 4.656 -7.579 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -5.317 4.648 -7.433 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -4.271 5.235 -6.155 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -5.274 7.833 -9.035 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -6.168 6.368 -8.617 1.00 0.00 H new ATOM 1059 N GLN A 76 -3.283 1.775 -7.732 1.00 0.00 N ATOM 1060 CA GLN A 76 -3.306 0.434 -7.094 1.00 0.00 C ATOM 1061 C GLN A 76 -1.997 -0.311 -7.379 1.00 0.00 C ATOM 1062 O GLN A 76 -1.503 -0.283 -8.489 1.00 0.00 O ATOM 1063 CB GLN A 76 -4.496 -0.250 -7.763 1.00 0.00 C ATOM 1064 CG GLN A 76 -4.650 -1.645 -7.206 1.00 0.00 C ATOM 1065 CD GLN A 76 -5.936 -2.275 -7.744 1.00 0.00 C ATOM 1066 OE1 GLN A 76 -5.939 -2.873 -8.802 1.00 0.00 O ATOM 1067 NE2 GLN A 76 -7.038 -2.161 -7.056 1.00 0.00 N ATOM 0 H GLN A 76 -3.308 1.762 -8.752 1.00 0.00 H new ATOM 0 HA GLN A 76 -3.399 0.466 -6.008 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -5.405 0.325 -7.589 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -4.346 -0.292 -8.842 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -3.791 -2.255 -7.484 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -4.678 -1.611 -6.117 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -7.035 -1.659 -6.168 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -7.903 -2.574 -7.406 1.00 0.00 H new ATOM 1076 N VAL A 77 -1.411 -0.960 -6.390 1.00 0.00 N ATOM 1077 CA VAL A 77 -0.129 -1.670 -6.634 1.00 0.00 C ATOM 1078 C VAL A 77 -0.304 -3.196 -6.518 1.00 0.00 C ATOM 1079 O VAL A 77 -1.029 -3.683 -5.673 1.00 0.00 O ATOM 1080 CB VAL A 77 0.839 -1.143 -5.567 1.00 0.00 C ATOM 1081 CG1 VAL A 77 0.870 0.393 -5.580 1.00 0.00 C ATOM 1082 CG2 VAL A 77 0.445 -1.643 -4.165 1.00 0.00 C ATOM 0 H VAL A 77 -1.770 -1.022 -5.437 1.00 0.00 H new ATOM 0 HA VAL A 77 0.243 -1.488 -7.642 1.00 0.00 H new ATOM 0 HB VAL A 77 1.833 -1.523 -5.804 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.562 0.749 -4.817 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.198 0.742 -6.559 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -0.128 0.779 -5.373 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.149 -1.254 -3.429 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -0.560 -1.297 -3.925 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.467 -2.733 -4.148 1.00 0.00 H new ATOM 1092 N ASN A 78 0.362 -3.945 -7.362 1.00 0.00 N ATOM 1093 CA ASN A 78 0.246 -5.434 -7.308 1.00 0.00 C ATOM 1094 C ASN A 78 1.575 -6.069 -6.869 1.00 0.00 C ATOM 1095 O ASN A 78 2.583 -5.951 -7.543 1.00 0.00 O ATOM 1096 CB ASN A 78 -0.098 -5.848 -8.742 1.00 0.00 C ATOM 1097 CG ASN A 78 -0.425 -7.344 -8.790 1.00 0.00 C ATOM 1098 OD1 ASN A 78 -0.168 -8.078 -7.856 1.00 0.00 O ATOM 1099 ND2 ASN A 78 -0.992 -7.804 -9.877 1.00 0.00 N ATOM 0 H ASN A 78 0.983 -3.587 -8.088 1.00 0.00 H new ATOM 0 HA ASN A 78 -0.505 -5.761 -6.589 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -0.949 -5.269 -9.102 1.00 0.00 H new ATOM 0 HB3 ASN A 78 0.740 -5.629 -9.404 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -1.200 -7.172 -10.650 1.00 0.00 H new ATOM 1105 N LEU A 79 1.573 -6.756 -5.752 1.00 0.00 N ATOM 1106 CA LEU A 79 2.820 -7.426 -5.265 1.00 0.00 C ATOM 1107 C LEU A 79 2.644 -8.949 -5.344 1.00 0.00 C ATOM 1108 O LEU A 79 1.655 -9.484 -4.878 1.00 0.00 O ATOM 1109 CB LEU A 79 2.980 -6.981 -3.804 1.00 0.00 C ATOM 1110 CG LEU A 79 3.309 -5.483 -3.736 1.00 0.00 C ATOM 1111 CD1 LEU A 79 3.367 -5.024 -2.273 1.00 0.00 C ATOM 1112 CD2 LEU A 79 4.662 -5.228 -4.414 1.00 0.00 C ATOM 0 H LEU A 79 0.757 -6.882 -5.154 1.00 0.00 H new ATOM 0 HA LEU A 79 3.694 -7.162 -5.860 1.00 0.00 H new ATOM 0 HB2 LEU A 79 2.062 -7.184 -3.252 1.00 0.00 H new ATOM 0 HB3 LEU A 79 3.773 -7.556 -3.326 1.00 0.00 H new ATOM 0 HG LEU A 79 2.531 -4.920 -4.252 1.00 0.00 H new ATOM 0 HD11 LEU A 79 3.601 -3.960 -2.234 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.402 -5.201 -1.798 1.00 0.00 H new ATOM 0 HD13 LEU A 79 4.139 -5.585 -1.746 1.00 0.00 H new ATOM 0 HD21 LEU A 79 4.898 -4.165 -4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 79 5.439 -5.795 -3.901 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.612 -5.543 -5.456 1.00 0.00 H new ATOM 1124 N THR A 80 3.586 -9.651 -5.932 1.00 0.00 N ATOM 1125 CA THR A 80 3.455 -11.138 -6.040 1.00 0.00 C ATOM 1126 C THR A 80 4.739 -11.834 -5.569 1.00 0.00 C ATOM 1127 O THR A 80 5.819 -11.276 -5.625 1.00 0.00 O ATOM 1128 CB THR A 80 3.211 -11.407 -7.525 1.00 0.00 C ATOM 1129 OG1 THR A 80 2.062 -10.692 -7.952 1.00 0.00 O ATOM 1130 CG2 THR A 80 2.989 -12.903 -7.743 1.00 0.00 C ATOM 0 H THR A 80 4.435 -9.259 -6.339 1.00 0.00 H new ATOM 0 HA THR A 80 2.649 -11.522 -5.415 1.00 0.00 H new ATOM 0 HB THR A 80 4.078 -11.081 -8.100 1.00 0.00 H new ATOM 0 HG1 THR A 80 1.996 -10.732 -8.929 1.00 0.00 H new ATOM 0 HG21 THR A 80 2.815 -13.095 -8.802 1.00 0.00 H new ATOM 0 HG22 THR A 80 3.871 -13.453 -7.415 1.00 0.00 H new ATOM 0 HG23 THR A 80 2.123 -13.230 -7.168 1.00 0.00 H new ATOM 1138 N ILE A 81 4.618 -13.061 -5.123 1.00 0.00 N ATOM 1139 CA ILE A 81 5.815 -13.821 -4.645 1.00 0.00 C ATOM 1140 C ILE A 81 5.989 -15.097 -5.479 1.00 0.00 C ATOM 1141 O ILE A 81 5.031 -15.781 -5.760 1.00 0.00 O ATOM 1142 CB ILE A 81 5.476 -14.220 -3.199 1.00 0.00 C ATOM 1143 CG1 ILE A 81 5.348 -12.965 -2.331 1.00 0.00 C ATOM 1144 CG2 ILE A 81 6.586 -15.125 -2.629 1.00 0.00 C ATOM 1145 CD1 ILE A 81 4.687 -13.337 -0.997 1.00 0.00 C ATOM 0 H ILE A 81 3.736 -13.571 -5.069 1.00 0.00 H new ATOM 0 HA ILE A 81 6.729 -13.233 -4.723 1.00 0.00 H new ATOM 0 HB ILE A 81 4.531 -14.763 -3.195 1.00 0.00 H new ATOM 0 HG12 ILE A 81 6.331 -12.529 -2.154 1.00 0.00 H new ATOM 0 HG13 ILE A 81 4.754 -12.211 -2.847 1.00 0.00 H new ATOM 0 HG21 ILE A 81 6.338 -15.403 -1.605 1.00 0.00 H new ATOM 0 HG22 ILE A 81 6.671 -16.024 -3.239 1.00 0.00 H new ATOM 0 HG23 ILE A 81 7.535 -14.588 -2.640 1.00 0.00 H new ATOM 0 HD11 ILE A 81 4.594 -12.446 -0.376 1.00 0.00 H new ATOM 0 HD12 ILE A 81 3.697 -13.753 -1.185 1.00 0.00 H new ATOM 0 HD13 ILE A 81 5.300 -14.076 -0.481 1.00 0.00 H new ATOM 1157 N GLN A 82 7.206 -15.442 -5.829 1.00 0.00 N ATOM 1158 CA GLN A 82 7.430 -16.714 -6.581 1.00 0.00 C ATOM 1159 C GLN A 82 8.338 -17.625 -5.763 1.00 0.00 C ATOM 1160 O GLN A 82 9.436 -17.257 -5.388 1.00 0.00 O ATOM 1161 CB GLN A 82 8.118 -16.353 -7.895 1.00 0.00 C ATOM 1162 CG GLN A 82 7.167 -15.570 -8.798 1.00 0.00 C ATOM 1163 CD GLN A 82 7.970 -14.610 -9.678 1.00 0.00 C ATOM 1164 OE1 GLN A 82 9.058 -14.205 -9.321 1.00 0.00 O ATOM 1165 NE2 GLN A 82 7.476 -14.228 -10.825 1.00 0.00 N ATOM 0 H GLN A 82 8.047 -14.901 -5.627 1.00 0.00 H new ATOM 0 HA GLN A 82 6.488 -17.229 -6.769 1.00 0.00 H new ATOM 0 HB2 GLN A 82 9.010 -15.760 -7.694 1.00 0.00 H new ATOM 0 HB3 GLN A 82 8.446 -17.260 -8.402 1.00 0.00 H new ATOM 0 HG2 GLN A 82 6.593 -16.256 -9.421 1.00 0.00 H new ATOM 0 HG3 GLN A 82 6.451 -15.013 -8.194 1.00 0.00 H new ATOM 0 HE21 GLN A 82 6.562 -14.568 -11.125 1.00 0.00 H new ATOM 0 HE22 GLN A 82 8.004 -13.590 -11.420 1.00 0.00 H new ATOM 1174 N GLY A 83 7.877 -18.805 -5.478 1.00 0.00 N ATOM 1175 CA GLY A 83 8.687 -19.764 -4.673 1.00 0.00 C ATOM 1176 C GLY A 83 8.130 -19.797 -3.253 1.00 0.00 C ATOM 1177 O GLY A 83 8.828 -19.525 -2.294 1.00 0.00 O ATOM 0 H GLY A 83 6.964 -19.154 -5.770 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.649 -20.758 -5.118 1.00 0.00 H new ATOM 0 HA3 GLY A 83 9.734 -19.460 -4.662 1.00 0.00 H new ATOM 1181 N LEU A 84 6.867 -20.105 -3.120 1.00 0.00 N ATOM 1182 CA LEU A 84 6.234 -20.134 -1.770 1.00 0.00 C ATOM 1183 C LEU A 84 6.533 -21.437 -1.031 1.00 0.00 C ATOM 1184 O LEU A 84 6.272 -22.521 -1.516 1.00 0.00 O ATOM 1185 CB LEU A 84 4.735 -20.022 -2.032 1.00 0.00 C ATOM 1186 CG LEU A 84 4.408 -18.626 -2.560 1.00 0.00 C ATOM 1187 CD1 LEU A 84 2.931 -18.562 -2.968 1.00 0.00 C ATOM 1188 CD2 LEU A 84 4.688 -17.594 -1.461 1.00 0.00 C ATOM 0 H LEU A 84 6.244 -20.339 -3.893 1.00 0.00 H new ATOM 0 HA LEU A 84 6.617 -19.330 -1.142 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.425 -20.777 -2.755 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.180 -20.213 -1.114 1.00 0.00 H new ATOM 0 HG LEU A 84 5.027 -18.409 -3.430 1.00 0.00 H new ATOM 0 HD11 LEU A 84 2.700 -17.565 -3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 84 2.737 -19.298 -3.748 1.00 0.00 H new ATOM 0 HD13 LEU A 84 2.305 -18.777 -2.102 1.00 0.00 H new ATOM 0 HD21 LEU A 84 4.456 -16.596 -1.832 1.00 0.00 H new ATOM 0 HD22 LEU A 84 4.068 -17.811 -0.592 1.00 0.00 H new ATOM 0 HD23 LEU A 84 5.739 -17.641 -1.177 1.00 0.00 H new ATOM 1200 N ARG A 85 7.054 -21.319 0.157 1.00 0.00 N ATOM 1201 CA ARG A 85 7.357 -22.518 0.985 1.00 0.00 C ATOM 1202 C ARG A 85 6.322 -22.627 2.105 1.00 0.00 C ATOM 1203 O ARG A 85 5.546 -21.715 2.323 1.00 0.00 O ATOM 1204 CB ARG A 85 8.740 -22.258 1.554 1.00 0.00 C ATOM 1205 CG ARG A 85 9.752 -22.342 0.417 1.00 0.00 C ATOM 1206 CD ARG A 85 11.153 -22.184 0.987 1.00 0.00 C ATOM 1207 NE ARG A 85 11.603 -23.569 1.332 1.00 0.00 N ATOM 1208 CZ ARG A 85 12.759 -23.784 1.930 1.00 0.00 C ATOM 1209 NH1 ARG A 85 13.568 -22.796 2.240 1.00 0.00 N ATOM 1210 NH2 ARG A 85 13.107 -25.007 2.220 1.00 0.00 N ATOM 0 H ARG A 85 7.286 -20.428 0.596 1.00 0.00 H new ATOM 0 HA ARG A 85 7.326 -23.449 0.419 1.00 0.00 H new ATOM 0 HB2 ARG A 85 8.778 -21.275 2.024 1.00 0.00 H new ATOM 0 HB3 ARG A 85 8.976 -22.990 2.327 1.00 0.00 H new ATOM 0 HG2 ARG A 85 9.661 -23.298 -0.098 1.00 0.00 H new ATOM 0 HG3 ARG A 85 9.556 -21.563 -0.320 1.00 0.00 H new ATOM 0 HD2 ARG A 85 11.823 -21.723 0.261 1.00 0.00 H new ATOM 0 HD3 ARG A 85 11.148 -21.542 1.868 1.00 0.00 H new ATOM 0 HE ARG A 85 11.004 -24.362 1.100 1.00 0.00 H new ATOM 0 HH11 ARG A 85 13.308 -21.835 2.018 1.00 0.00 H new ATOM 0 HH12 ARG A 85 14.456 -22.990 2.702 1.00 0.00 H new ATOM 0 HH21 ARG A 85 12.488 -25.783 1.984 1.00 0.00 H new ATOM 0 HH22 ARG A 85 13.998 -25.188 2.682 1.00 0.00 H new ATOM 1224 N ALA A 86 6.301 -23.723 2.821 1.00 0.00 N ATOM 1225 CA ALA A 86 5.310 -23.868 3.936 1.00 0.00 C ATOM 1226 C ALA A 86 5.530 -22.753 4.962 1.00 0.00 C ATOM 1227 O ALA A 86 4.595 -22.166 5.472 1.00 0.00 O ATOM 1228 CB ALA A 86 5.595 -25.237 4.558 1.00 0.00 C ATOM 0 H ALA A 86 6.922 -24.520 2.685 1.00 0.00 H new ATOM 0 HA ALA A 86 4.279 -23.796 3.590 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.905 -25.412 5.384 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.464 -26.013 3.804 1.00 0.00 H new ATOM 0 HB3 ALA A 86 6.619 -25.262 4.930 1.00 0.00 H new ATOM 1234 N MET A 87 6.769 -22.457 5.253 1.00 0.00 N ATOM 1235 CA MET A 87 7.085 -21.375 6.232 1.00 0.00 C ATOM 1236 C MET A 87 6.638 -20.015 5.685 1.00 0.00 C ATOM 1237 O MET A 87 6.180 -19.159 6.419 1.00 0.00 O ATOM 1238 CB MET A 87 8.607 -21.414 6.390 1.00 0.00 C ATOM 1239 CG MET A 87 9.038 -20.405 7.455 1.00 0.00 C ATOM 1240 SD MET A 87 10.845 -20.369 7.555 1.00 0.00 S ATOM 1241 CE MET A 87 11.062 -21.982 8.347 1.00 0.00 C ATOM 0 H MET A 87 7.583 -22.922 4.851 1.00 0.00 H new ATOM 0 HA MET A 87 6.572 -21.518 7.183 1.00 0.00 H new ATOM 0 HB2 MET A 87 8.928 -22.416 6.673 1.00 0.00 H new ATOM 0 HB3 MET A 87 9.088 -21.182 5.439 1.00 0.00 H new ATOM 0 HG2 MET A 87 8.657 -19.414 7.208 1.00 0.00 H new ATOM 0 HG3 MET A 87 8.615 -20.677 8.422 1.00 0.00 H new ATOM 0 HE1 MET A 87 11.957 -21.965 8.968 1.00 0.00 H new ATOM 0 HE2 MET A 87 10.194 -22.202 8.968 1.00 0.00 H new ATOM 0 HE3 MET A 87 11.166 -22.752 7.582 1.00 0.00 H new ATOM 1251 N ASP A 88 6.795 -19.807 4.404 1.00 0.00 N ATOM 1252 CA ASP A 88 6.398 -18.501 3.785 1.00 0.00 C ATOM 1253 C ASP A 88 4.913 -18.217 3.998 1.00 0.00 C ATOM 1254 O ASP A 88 4.516 -17.083 4.182 1.00 0.00 O ATOM 1255 CB ASP A 88 6.699 -18.642 2.298 1.00 0.00 C ATOM 1256 CG ASP A 88 8.214 -18.679 2.067 1.00 0.00 C ATOM 1257 OD1 ASP A 88 8.938 -18.138 2.890 1.00 0.00 O ATOM 1258 OD2 ASP A 88 8.626 -19.244 1.068 1.00 0.00 O ATOM 0 H ASP A 88 7.184 -20.489 3.753 1.00 0.00 H new ATOM 0 HA ASP A 88 6.942 -17.671 4.237 1.00 0.00 H new ATOM 0 HB2 ASP A 88 6.242 -19.553 1.912 1.00 0.00 H new ATOM 0 HB3 ASP A 88 6.260 -17.808 1.750 1.00 0.00 H new ATOM 1263 N THR A 89 4.078 -19.236 3.957 1.00 0.00 N ATOM 1264 CA THR A 89 2.614 -19.026 4.149 1.00 0.00 C ATOM 1265 C THR A 89 2.363 -18.216 5.414 1.00 0.00 C ATOM 1266 O THR A 89 2.952 -18.467 6.451 1.00 0.00 O ATOM 1267 CB THR A 89 2.014 -20.411 4.274 1.00 0.00 C ATOM 1268 OG1 THR A 89 2.475 -21.229 3.207 1.00 0.00 O ATOM 1269 CG2 THR A 89 0.491 -20.319 4.232 1.00 0.00 C ATOM 0 H THR A 89 4.356 -20.204 3.798 1.00 0.00 H new ATOM 0 HA THR A 89 2.170 -18.473 3.321 1.00 0.00 H new ATOM 0 HB THR A 89 2.320 -20.851 5.223 1.00 0.00 H new ATOM 0 HG1 THR A 89 2.087 -22.125 3.291 1.00 0.00 H new ATOM 0 HG21 THR A 89 0.064 -21.318 4.322 1.00 0.00 H new ATOM 0 HG22 THR A 89 0.141 -19.699 5.057 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.179 -19.875 3.287 1.00 0.00 H new ATOM 1277 N GLY A 90 1.521 -17.232 5.325 1.00 0.00 N ATOM 1278 CA GLY A 90 1.251 -16.376 6.515 1.00 0.00 C ATOM 1279 C GLY A 90 0.661 -15.035 6.075 1.00 0.00 C ATOM 1280 O GLY A 90 -0.121 -14.967 5.148 1.00 0.00 O ATOM 0 H GLY A 90 1.006 -16.980 4.482 1.00 0.00 H new ATOM 0 HA2 GLY A 90 0.560 -16.883 7.188 1.00 0.00 H new ATOM 0 HA3 GLY A 90 2.174 -16.211 7.071 1.00 0.00 H new ATOM 1284 N LEU A 91 1.018 -13.973 6.755 1.00 0.00 N ATOM 1285 CA LEU A 91 0.468 -12.630 6.412 1.00 0.00 C ATOM 1286 C LEU A 91 1.535 -11.724 5.776 1.00 0.00 C ATOM 1287 O LEU A 91 2.571 -11.467 6.361 1.00 0.00 O ATOM 1288 CB LEU A 91 0.042 -12.069 7.767 1.00 0.00 C ATOM 1289 CG LEU A 91 -0.643 -10.722 7.579 1.00 0.00 C ATOM 1290 CD1 LEU A 91 -2.000 -10.941 6.911 1.00 0.00 C ATOM 1291 CD2 LEU A 91 -0.840 -10.070 8.942 1.00 0.00 C ATOM 0 H LEU A 91 1.672 -13.982 7.538 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.342 -12.688 5.685 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.635 -12.765 8.262 1.00 0.00 H new ATOM 0 HB3 LEU A 91 0.912 -11.957 8.414 1.00 0.00 H new ATOM 0 HG LEU A 91 -0.030 -10.074 6.952 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -2.497 -9.981 6.773 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -1.856 -11.418 5.941 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -2.617 -11.581 7.542 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -1.330 -9.105 8.816 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -1.460 -10.713 9.567 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.129 -9.925 9.420 1.00 0.00 H new ATOM 1303 N TYR A 92 1.272 -11.218 4.593 1.00 0.00 N ATOM 1304 CA TYR A 92 2.249 -10.300 3.922 1.00 0.00 C ATOM 1305 C TYR A 92 1.689 -8.872 3.885 1.00 0.00 C ATOM 1306 O TYR A 92 0.679 -8.618 3.262 1.00 0.00 O ATOM 1307 CB TYR A 92 2.419 -10.853 2.507 1.00 0.00 C ATOM 1308 CG TYR A 92 3.289 -12.085 2.554 1.00 0.00 C ATOM 1309 CD1 TYR A 92 2.738 -13.337 2.935 1.00 0.00 C ATOM 1310 CD2 TYR A 92 4.664 -11.989 2.209 1.00 0.00 C ATOM 1311 CE1 TYR A 92 3.564 -14.493 2.977 1.00 0.00 C ATOM 1312 CE2 TYR A 92 5.490 -13.142 2.250 1.00 0.00 C ATOM 1313 CZ TYR A 92 4.940 -14.396 2.632 1.00 0.00 C ATOM 1314 OH TYR A 92 5.742 -15.518 2.673 1.00 0.00 O ATOM 0 H TYR A 92 0.421 -11.402 4.062 1.00 0.00 H new ATOM 0 HA TYR A 92 3.201 -10.254 4.450 1.00 0.00 H new ATOM 0 HB2 TYR A 92 1.446 -11.097 2.080 1.00 0.00 H new ATOM 0 HB3 TYR A 92 2.870 -10.100 1.862 1.00 0.00 H new ATOM 0 HD1 TYR A 92 1.692 -13.411 3.193 1.00 0.00 H new ATOM 0 HD2 TYR A 92 5.081 -11.037 1.915 1.00 0.00 H new ATOM 0 HE1 TYR A 92 3.147 -15.445 3.271 1.00 0.00 H new ATOM 0 HE2 TYR A 92 6.536 -13.067 1.991 1.00 0.00 H new ATOM 0 HH TYR A 92 5.649 -15.955 3.545 1.00 0.00 H new ATOM 1324 N ILE A 93 2.334 -7.946 4.558 1.00 0.00 N ATOM 1325 CA ILE A 93 1.830 -6.531 4.589 1.00 0.00 C ATOM 1326 C ILE A 93 2.169 -5.776 3.308 1.00 0.00 C ATOM 1327 O ILE A 93 3.304 -5.762 2.867 1.00 0.00 O ATOM 1328 CB ILE A 93 2.568 -5.849 5.750 1.00 0.00 C ATOM 1329 CG1 ILE A 93 2.368 -6.620 7.052 1.00 0.00 C ATOM 1330 CG2 ILE A 93 2.075 -4.403 5.923 1.00 0.00 C ATOM 1331 CD1 ILE A 93 0.914 -6.607 7.445 1.00 0.00 C ATOM 0 H ILE A 93 3.190 -8.109 5.089 1.00 0.00 H new ATOM 0 HA ILE A 93 0.745 -6.528 4.698 1.00 0.00 H new ATOM 0 HB ILE A 93 3.631 -5.839 5.511 1.00 0.00 H new ATOM 0 HG12 ILE A 93 2.711 -7.648 6.931 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.970 -6.174 7.844 1.00 0.00 H new ATOM 0 HG21 ILE A 93 2.608 -3.933 6.750 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.261 -3.843 5.007 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.006 -4.406 6.135 1.00 0.00 H new ATOM 0 HD11 ILE A 93 0.784 -7.160 8.375 1.00 0.00 H new ATOM 0 HD12 ILE A 93 0.584 -5.578 7.586 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.320 -7.074 6.659 1.00 0.00 H new ATOM 1343 N CYS A 94 1.206 -5.080 2.758 1.00 0.00 N ATOM 1344 CA CYS A 94 1.491 -4.247 1.564 1.00 0.00 C ATOM 1345 C CYS A 94 2.007 -2.909 2.092 1.00 0.00 C ATOM 1346 O CYS A 94 1.644 -2.495 3.180 1.00 0.00 O ATOM 1347 CB CYS A 94 0.162 -4.092 0.819 1.00 0.00 C ATOM 1348 SG CYS A 94 -0.945 -2.983 1.729 1.00 0.00 S ATOM 0 H CYS A 94 0.241 -5.056 3.087 1.00 0.00 H new ATOM 0 HA CYS A 94 2.230 -4.672 0.885 1.00 0.00 H new ATOM 0 HB2 CYS A 94 0.342 -3.697 -0.181 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -0.310 -5.067 0.696 1.00 0.00 H new ATOM 1353 N LYS A 95 2.855 -2.242 1.366 1.00 0.00 N ATOM 1354 CA LYS A 95 3.402 -0.952 1.850 1.00 0.00 C ATOM 1355 C LYS A 95 3.644 -0.056 0.657 1.00 0.00 C ATOM 1356 O LYS A 95 4.257 -0.459 -0.302 1.00 0.00 O ATOM 1357 CB LYS A 95 4.723 -1.308 2.522 1.00 0.00 C ATOM 1358 CG LYS A 95 5.345 -0.053 3.148 1.00 0.00 C ATOM 1359 CD LYS A 95 5.548 -0.284 4.641 1.00 0.00 C ATOM 1360 CE LYS A 95 6.106 0.987 5.288 1.00 0.00 C ATOM 1361 NZ LYS A 95 6.357 0.619 6.711 1.00 0.00 N ATOM 0 H LYS A 95 3.194 -2.539 0.451 1.00 0.00 H new ATOM 0 HA LYS A 95 2.733 -0.432 2.536 1.00 0.00 H new ATOM 0 HB2 LYS A 95 4.558 -2.064 3.289 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.408 -1.739 1.792 1.00 0.00 H new ATOM 0 HG2 LYS A 95 6.298 0.172 2.670 1.00 0.00 H new ATOM 0 HG3 LYS A 95 4.696 0.808 2.986 1.00 0.00 H new ATOM 0 HD2 LYS A 95 4.602 -0.557 5.109 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.234 -1.116 4.800 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.024 1.310 4.796 1.00 0.00 H new ATOM 0 HE3 LYS A 95 5.397 1.812 5.213 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 6.259 1.463 7.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 5.668 -0.100 7.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.320 0.237 6.806 1.00 0.00 H new ATOM 1375 N VAL A 96 3.134 1.129 0.698 1.00 0.00 N ATOM 1376 CA VAL A 96 3.289 2.066 -0.435 1.00 0.00 C ATOM 1377 C VAL A 96 3.671 3.450 0.101 1.00 0.00 C ATOM 1378 O VAL A 96 2.909 4.097 0.812 1.00 0.00 O ATOM 1379 CB VAL A 96 1.917 2.018 -1.103 1.00 0.00 C ATOM 1380 CG1 VAL A 96 0.797 2.179 -0.071 1.00 0.00 C ATOM 1381 CG2 VAL A 96 1.805 3.096 -2.185 1.00 0.00 C ATOM 0 H VAL A 96 2.603 1.498 1.487 1.00 0.00 H new ATOM 0 HA VAL A 96 4.078 1.817 -1.145 1.00 0.00 H new ATOM 0 HB VAL A 96 1.808 1.041 -1.574 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -0.169 2.141 -0.574 1.00 0.00 H new ATOM 0 HG12 VAL A 96 0.857 1.373 0.660 1.00 0.00 H new ATOM 0 HG13 VAL A 96 0.905 3.138 0.436 1.00 0.00 H new ATOM 0 HG21 VAL A 96 0.820 3.045 -2.649 1.00 0.00 H new ATOM 0 HG22 VAL A 96 1.944 4.079 -1.735 1.00 0.00 H new ATOM 0 HG23 VAL A 96 2.572 2.932 -2.942 1.00 0.00 H new ATOM 1391 N GLU A 97 4.876 3.881 -0.199 1.00 0.00 N ATOM 1392 CA GLU A 97 5.357 5.191 0.324 1.00 0.00 C ATOM 1393 C GLU A 97 6.046 6.045 -0.742 1.00 0.00 C ATOM 1394 O GLU A 97 6.940 5.595 -1.433 1.00 0.00 O ATOM 1395 CB GLU A 97 6.394 4.801 1.388 1.00 0.00 C ATOM 1396 CG GLU A 97 5.712 4.040 2.544 1.00 0.00 C ATOM 1397 CD GLU A 97 4.530 4.842 3.109 1.00 0.00 C ATOM 1398 OE1 GLU A 97 4.668 6.041 3.265 1.00 0.00 O ATOM 1399 OE2 GLU A 97 3.503 4.239 3.365 1.00 0.00 O ATOM 0 H GLU A 97 5.543 3.378 -0.784 1.00 0.00 H new ATOM 0 HA GLU A 97 4.523 5.788 0.693 1.00 0.00 H new ATOM 0 HB2 GLU A 97 7.169 4.178 0.940 1.00 0.00 H new ATOM 0 HB3 GLU A 97 6.886 5.695 1.772 1.00 0.00 H new ATOM 0 HG2 GLU A 97 5.362 3.071 2.189 1.00 0.00 H new ATOM 0 HG3 GLU A 97 6.437 3.847 3.335 1.00 0.00 H new ATOM 1406 N LEU A 98 5.676 7.298 -0.824 1.00 0.00 N ATOM 1407 CA LEU A 98 6.345 8.218 -1.775 1.00 0.00 C ATOM 1408 C LEU A 98 7.615 8.642 -1.052 1.00 0.00 C ATOM 1409 O LEU A 98 7.649 9.648 -0.362 1.00 0.00 O ATOM 1410 CB LEU A 98 5.367 9.397 -1.936 1.00 0.00 C ATOM 1411 CG LEU A 98 4.166 9.047 -2.856 1.00 0.00 C ATOM 1412 CD1 LEU A 98 4.587 9.138 -4.323 1.00 0.00 C ATOM 1413 CD2 LEU A 98 3.610 7.642 -2.584 1.00 0.00 C ATOM 0 H LEU A 98 4.933 7.720 -0.266 1.00 0.00 H new ATOM 0 HA LEU A 98 6.589 7.808 -2.755 1.00 0.00 H new ATOM 0 HB2 LEU A 98 4.996 9.694 -0.955 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.900 10.254 -2.348 1.00 0.00 H new ATOM 0 HG LEU A 98 3.379 9.769 -2.638 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.738 8.891 -4.961 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.923 10.151 -4.543 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.400 8.437 -4.512 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.772 7.446 -3.253 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.392 6.902 -2.755 1.00 0.00 H new ATOM 0 HD23 LEU A 98 3.271 7.579 -1.550 1.00 0.00 H new ATOM 1425 N MET A 99 8.653 7.856 -1.162 1.00 0.00 N ATOM 1426 CA MET A 99 9.888 8.156 -0.384 1.00 0.00 C ATOM 1427 C MET A 99 10.761 9.208 -1.084 1.00 0.00 C ATOM 1428 O MET A 99 11.221 10.140 -0.451 1.00 0.00 O ATOM 1429 CB MET A 99 10.657 6.831 -0.336 1.00 0.00 C ATOM 1430 CG MET A 99 11.875 6.993 0.568 1.00 0.00 C ATOM 1431 SD MET A 99 11.342 7.635 2.176 1.00 0.00 S ATOM 1432 CE MET A 99 10.533 6.127 2.761 1.00 0.00 C ATOM 0 H MET A 99 8.699 7.026 -1.752 1.00 0.00 H new ATOM 0 HA MET A 99 9.637 8.552 0.600 1.00 0.00 H new ATOM 0 HB2 MET A 99 10.013 6.036 0.040 1.00 0.00 H new ATOM 0 HB3 MET A 99 10.969 6.541 -1.339 1.00 0.00 H new ATOM 0 HG2 MET A 99 12.379 6.035 0.694 1.00 0.00 H new ATOM 0 HG3 MET A 99 12.594 7.673 0.111 1.00 0.00 H new ATOM 0 HE1 MET A 99 9.875 6.368 3.596 1.00 0.00 H new ATOM 0 HE2 MET A 99 9.948 5.691 1.952 1.00 0.00 H new ATOM 0 HE3 MET A 99 11.288 5.413 3.089 1.00 0.00 H new ATOM 1442 N TYR A 100 10.999 9.071 -2.358 1.00 0.00 N ATOM 1443 CA TYR A 100 11.871 10.051 -3.081 1.00 0.00 C ATOM 1444 C TYR A 100 11.202 11.446 -3.276 1.00 0.00 C ATOM 1445 O TYR A 100 11.868 12.459 -3.099 1.00 0.00 O ATOM 1446 CB TYR A 100 12.198 9.396 -4.432 1.00 0.00 C ATOM 1447 CG TYR A 100 13.218 8.300 -4.215 1.00 0.00 C ATOM 1448 CD1 TYR A 100 12.810 7.018 -3.758 1.00 0.00 C ATOM 1449 CD2 TYR A 100 14.600 8.569 -4.431 1.00 0.00 C ATOM 1450 CE1 TYR A 100 13.769 6.003 -3.525 1.00 0.00 C ATOM 1451 CE2 TYR A 100 15.563 7.541 -4.206 1.00 0.00 C ATOM 1452 CZ TYR A 100 15.144 6.264 -3.738 1.00 0.00 C ATOM 1453 OH TYR A 100 16.082 5.283 -3.490 1.00 0.00 O ATOM 0 H TYR A 100 10.626 8.319 -2.937 1.00 0.00 H new ATOM 0 HA TYR A 100 12.767 10.260 -2.496 1.00 0.00 H new ATOM 0 HB2 TYR A 100 11.293 8.985 -4.880 1.00 0.00 H new ATOM 0 HB3 TYR A 100 12.587 10.140 -5.127 1.00 0.00 H new ATOM 0 HD1 TYR A 100 11.763 6.817 -3.587 1.00 0.00 H new ATOM 0 HD2 TYR A 100 14.917 9.546 -4.763 1.00 0.00 H new ATOM 0 HE1 TYR A 100 13.451 5.029 -3.184 1.00 0.00 H new ATOM 0 HE2 TYR A 100 16.610 7.732 -4.391 1.00 0.00 H new ATOM 0 HH TYR A 100 16.977 5.628 -3.689 1.00 0.00 H new ATOM 1463 N PRO A 101 9.955 11.494 -3.639 1.00 0.00 N ATOM 1464 CA PRO A 101 9.271 12.795 -3.879 1.00 0.00 C ATOM 1465 C PRO A 101 8.784 13.448 -2.588 1.00 0.00 C ATOM 1466 O PRO A 101 7.832 12.920 -1.986 1.00 0.00 O ATOM 1467 CB PRO A 101 8.105 12.440 -4.788 1.00 0.00 C ATOM 1468 CG PRO A 101 7.809 10.989 -4.521 1.00 0.00 C ATOM 1469 CD PRO A 101 9.024 10.385 -3.845 1.00 0.00 C ATOM 0 HA PRO A 101 9.947 13.528 -4.320 1.00 0.00 H new ATOM 0 HB2 PRO A 101 7.237 13.063 -4.573 1.00 0.00 H new ATOM 0 HB3 PRO A 101 8.361 12.601 -5.835 1.00 0.00 H new ATOM 0 HG2 PRO A 101 6.929 10.889 -3.885 1.00 0.00 H new ATOM 0 HG3 PRO A 101 7.590 10.466 -5.452 1.00 0.00 H new ATOM 0 HD2 PRO A 101 8.754 9.920 -2.897 1.00 0.00 H new ATOM 0 HD3 PRO A 101 9.471 9.608 -4.465 1.00 0.00 H new ATOM 1477 N PRO A 102 9.363 14.571 -2.219 1.00 0.00 N ATOM 1478 CA PRO A 102 8.859 15.187 -1.039 1.00 0.00 C ATOM 1479 C PRO A 102 7.448 15.939 -1.414 1.00 0.00 C ATOM 1480 O PRO A 102 7.485 16.454 -2.544 1.00 0.00 O ATOM 1481 CB PRO A 102 10.089 16.198 -0.678 1.00 0.00 C ATOM 1482 CG PRO A 102 10.788 16.457 -1.994 1.00 0.00 C ATOM 1483 CD PRO A 102 10.462 15.294 -2.890 1.00 0.00 C ATOM 0 HA PRO A 102 8.609 14.539 -0.199 1.00 0.00 H new ATOM 0 HB2 PRO A 102 9.721 17.125 -0.238 1.00 0.00 H new ATOM 0 HB3 PRO A 102 10.768 15.749 0.047 1.00 0.00 H new ATOM 0 HG2 PRO A 102 10.448 17.394 -2.436 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.865 16.545 -1.850 1.00 0.00 H new ATOM 0 HD2 PRO A 102 10.160 15.635 -3.880 1.00 0.00 H new ATOM 0 HD3 PRO A 102 11.330 14.649 -3.026 1.00 0.00 H new ATOM 1491 N PRO A 103 6.563 16.410 -0.339 1.00 0.00 N ATOM 1492 CA PRO A 103 7.133 15.664 0.757 1.00 0.00 C ATOM 1493 C PRO A 103 6.679 14.200 0.908 1.00 0.00 C ATOM 1494 O PRO A 103 6.083 13.577 0.012 1.00 0.00 O ATOM 1495 CB PRO A 103 7.125 16.429 1.969 1.00 0.00 C ATOM 1496 CG PRO A 103 6.019 17.292 1.791 1.00 0.00 C ATOM 1497 CD PRO A 103 5.276 16.693 0.575 1.00 0.00 C ATOM 0 HA PRO A 103 8.177 15.514 0.481 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.005 15.794 2.847 1.00 0.00 H new ATOM 0 HB3 PRO A 103 8.053 16.984 2.102 1.00 0.00 H new ATOM 0 HG2 PRO A 103 5.383 17.316 2.676 1.00 0.00 H new ATOM 0 HG3 PRO A 103 6.338 18.317 1.600 1.00 0.00 H new ATOM 0 HD2 PRO A 103 4.717 15.789 0.818 1.00 0.00 H new ATOM 0 HD3 PRO A 103 4.572 17.389 0.119 1.00 0.00 H new ATOM 1505 N TYR A 104 7.052 13.543 1.983 1.00 0.00 N ATOM 1506 CA TYR A 104 6.773 12.101 2.165 1.00 0.00 C ATOM 1507 C TYR A 104 5.539 11.934 3.060 1.00 0.00 C ATOM 1508 O TYR A 104 5.475 12.447 4.156 1.00 0.00 O ATOM 1509 CB TYR A 104 8.015 11.475 2.816 1.00 0.00 C ATOM 1510 CG TYR A 104 7.732 10.022 3.110 1.00 0.00 C ATOM 1511 CD1 TYR A 104 6.835 9.265 2.289 1.00 0.00 C ATOM 1512 CD2 TYR A 104 8.379 9.434 4.201 1.00 0.00 C ATOM 1513 CE1 TYR A 104 6.569 7.920 2.621 1.00 0.00 C ATOM 1514 CE2 TYR A 104 8.119 8.083 4.535 1.00 0.00 C ATOM 1515 CZ TYR A 104 7.230 7.313 3.745 1.00 0.00 C ATOM 1516 OH TYR A 104 6.995 6.005 4.066 1.00 0.00 O ATOM 0 H TYR A 104 7.554 13.971 2.761 1.00 0.00 H new ATOM 0 HA TYR A 104 6.566 11.609 1.215 1.00 0.00 H new ATOM 0 HB2 TYR A 104 8.875 11.565 2.152 1.00 0.00 H new ATOM 0 HB3 TYR A 104 8.266 12.004 3.735 1.00 0.00 H new ATOM 0 HD1 TYR A 104 6.368 9.718 1.427 1.00 0.00 H new ATOM 0 HD2 TYR A 104 9.077 10.011 4.789 1.00 0.00 H new ATOM 0 HE1 TYR A 104 5.869 7.346 2.031 1.00 0.00 H new ATOM 0 HE2 TYR A 104 8.599 7.638 5.394 1.00 0.00 H new ATOM 0 HH TYR A 104 6.088 5.914 4.426 1.00 0.00 H new ATOM 1526 N TYR A 105 4.573 11.208 2.558 1.00 0.00 N ATOM 1527 CA TYR A 105 3.313 10.986 3.317 1.00 0.00 C ATOM 1528 C TYR A 105 2.439 9.914 2.673 1.00 0.00 C ATOM 1529 O TYR A 105 1.871 10.169 1.623 1.00 0.00 O ATOM 1530 CB TYR A 105 2.522 12.291 3.413 1.00 0.00 C ATOM 1531 CG TYR A 105 2.248 12.877 2.049 1.00 0.00 C ATOM 1532 CD1 TYR A 105 3.264 13.575 1.344 1.00 0.00 C ATOM 1533 CD2 TYR A 105 0.954 12.736 1.469 1.00 0.00 C ATOM 1534 CE1 TYR A 105 2.995 14.111 0.059 1.00 0.00 C ATOM 1535 CE2 TYR A 105 0.684 13.288 0.191 1.00 0.00 C ATOM 1536 CZ TYR A 105 1.708 13.965 -0.509 1.00 0.00 C ATOM 1537 OH TYR A 105 1.454 14.450 -1.770 1.00 0.00 O ATOM 0 H TYR A 105 4.607 10.756 1.644 1.00 0.00 H new ATOM 0 HA TYR A 105 3.592 10.642 4.313 1.00 0.00 H new ATOM 0 HB2 TYR A 105 1.578 12.108 3.927 1.00 0.00 H new ATOM 0 HB3 TYR A 105 3.078 13.011 4.014 1.00 0.00 H new ATOM 0 HD1 TYR A 105 4.242 13.698 1.786 1.00 0.00 H new ATOM 0 HD2 TYR A 105 0.178 12.208 2.003 1.00 0.00 H new ATOM 0 HE1 TYR A 105 3.771 14.629 -0.485 1.00 0.00 H new ATOM 0 HE2 TYR A 105 -0.299 13.191 -0.245 1.00 0.00 H new ATOM 0 HH TYR A 105 0.765 13.901 -2.199 1.00 0.00 H new ATOM 1547 N LEU A 106 2.330 8.750 3.263 1.00 0.00 N ATOM 1548 CA LEU A 106 1.468 7.679 2.652 1.00 0.00 C ATOM 1549 C LEU A 106 0.932 6.713 3.732 1.00 0.00 C ATOM 1550 O LEU A 106 0.643 7.139 4.840 1.00 0.00 O ATOM 1551 CB LEU A 106 2.387 6.939 1.664 1.00 0.00 C ATOM 1552 CG LEU A 106 1.731 6.891 0.272 1.00 0.00 C ATOM 1553 CD1 LEU A 106 0.372 6.175 0.314 1.00 0.00 C ATOM 1554 CD2 LEU A 106 1.527 8.323 -0.258 1.00 0.00 C ATOM 0 H LEU A 106 2.794 8.492 4.134 1.00 0.00 H new ATOM 0 HA LEU A 106 0.591 8.099 2.159 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.351 7.443 1.604 1.00 0.00 H new ATOM 0 HB3 LEU A 106 2.578 5.927 2.020 1.00 0.00 H new ATOM 0 HG LEU A 106 2.396 6.334 -0.389 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.062 6.160 -0.686 1.00 0.00 H new ATOM 0 HD12 LEU A 106 0.510 5.152 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -0.297 6.704 0.992 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.063 8.284 -1.243 1.00 0.00 H new ATOM 0 HD22 LEU A 106 0.882 8.875 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 106 2.492 8.825 -0.332 1.00 0.00 H new ATOM 1566 N GLY A 108 0.733 5.448 3.414 1.00 0.00 N ATOM 1567 CA GLY A 108 0.152 4.520 4.423 1.00 0.00 C ATOM 1568 C GLY A 108 0.540 3.063 4.165 1.00 0.00 C ATOM 1569 O GLY A 108 1.007 2.701 3.099 1.00 0.00 O ATOM 0 H GLY A 108 0.948 5.031 2.508 1.00 0.00 H new ATOM 0 HA2 GLY A 108 0.488 4.812 5.418 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -0.934 4.611 4.414 1.00 0.00 H new ATOM 1573 N ILE A 109 0.328 2.231 5.151 1.00 0.00 N ATOM 1574 CA ILE A 109 0.657 0.793 5.029 1.00 0.00 C ATOM 1575 C ILE A 109 -0.618 -0.041 5.282 1.00 0.00 C ATOM 1576 O ILE A 109 -1.481 0.351 6.045 1.00 0.00 O ATOM 1577 CB ILE A 109 1.697 0.538 6.127 1.00 0.00 C ATOM 1578 CG1 ILE A 109 3.003 1.252 5.776 1.00 0.00 C ATOM 1579 CG2 ILE A 109 1.979 -0.957 6.252 1.00 0.00 C ATOM 1580 CD1 ILE A 109 2.913 2.731 6.137 1.00 0.00 C ATOM 0 H ILE A 109 -0.068 2.500 6.052 1.00 0.00 H new ATOM 0 HA ILE A 109 1.036 0.521 4.044 1.00 0.00 H new ATOM 0 HB ILE A 109 1.303 0.916 7.070 1.00 0.00 H new ATOM 0 HG12 ILE A 109 3.833 0.790 6.311 1.00 0.00 H new ATOM 0 HG13 ILE A 109 3.210 1.143 4.711 1.00 0.00 H new ATOM 0 HG21 ILE A 109 2.719 -1.123 7.035 1.00 0.00 H new ATOM 0 HG22 ILE A 109 1.058 -1.481 6.506 1.00 0.00 H new ATOM 0 HG23 ILE A 109 2.362 -1.335 5.304 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.850 3.226 5.881 1.00 0.00 H new ATOM 0 HD12 ILE A 109 2.096 3.192 5.582 1.00 0.00 H new ATOM 0 HD13 ILE A 109 2.728 2.834 7.206 1.00 0.00 H new ATOM 1592 N GLY A 110 -0.729 -1.188 4.658 1.00 0.00 N ATOM 1593 CA GLY A 110 -1.934 -2.044 4.876 1.00 0.00 C ATOM 1594 C GLY A 110 -1.688 -2.962 6.077 1.00 0.00 C ATOM 1595 O GLY A 110 -0.651 -2.882 6.711 1.00 0.00 O ATOM 0 H GLY A 110 -0.039 -1.567 4.009 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -2.811 -1.421 5.053 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -2.139 -2.638 3.985 1.00 0.00 H new ATOM 1599 N ASN A 111 -2.619 -3.829 6.403 1.00 0.00 N ATOM 1600 CA ASN A 111 -2.407 -4.731 7.569 1.00 0.00 C ATOM 1601 C ASN A 111 -2.146 -6.175 7.131 1.00 0.00 C ATOM 1602 O ASN A 111 -2.254 -7.096 7.920 1.00 0.00 O ATOM 1603 CB ASN A 111 -3.663 -4.624 8.446 1.00 0.00 C ATOM 1604 CG ASN A 111 -3.651 -3.288 9.206 1.00 0.00 C ATOM 1605 OD1 ASN A 111 -3.596 -2.231 8.609 1.00 0.00 O ATOM 1606 ND2 ASN A 111 -3.709 -3.321 10.520 1.00 0.00 N ATOM 0 H ASN A 111 -3.506 -3.947 5.914 1.00 0.00 H new ATOM 0 HA ASN A 111 -1.521 -4.431 8.128 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -4.558 -4.693 7.827 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -3.698 -5.454 9.151 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -3.708 -2.451 11.053 1.00 0.00 H new ATOM 1612 N GLY A 112 -1.721 -6.368 5.910 1.00 0.00 N ATOM 1613 CA GLY A 112 -1.353 -7.734 5.446 1.00 0.00 C ATOM 1614 C GLY A 112 -2.538 -8.571 4.973 1.00 0.00 C ATOM 1615 O GLY A 112 -3.630 -8.522 5.501 1.00 0.00 O ATOM 0 H GLY A 112 -1.613 -5.632 5.212 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -0.634 -7.648 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -0.852 -8.260 6.259 1.00 0.00 H new ATOM 1619 N THR A 113 -2.260 -9.400 3.997 1.00 0.00 N ATOM 1620 CA THR A 113 -3.265 -10.348 3.451 1.00 0.00 C ATOM 1621 C THR A 113 -2.746 -11.750 3.747 1.00 0.00 C ATOM 1622 O THR A 113 -1.613 -12.058 3.421 1.00 0.00 O ATOM 1623 CB THR A 113 -3.253 -10.135 1.931 1.00 0.00 C ATOM 1624 OG1 THR A 113 -3.690 -8.819 1.624 1.00 0.00 O ATOM 1625 CG2 THR A 113 -4.162 -11.177 1.252 1.00 0.00 C ATOM 0 H THR A 113 -1.347 -9.456 3.546 1.00 0.00 H new ATOM 0 HA THR A 113 -4.262 -10.209 3.868 1.00 0.00 H new ATOM 0 HB THR A 113 -2.237 -10.260 1.557 1.00 0.00 H new ATOM 0 HG1 THR A 113 -4.509 -8.621 2.124 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.150 -11.022 0.173 1.00 0.00 H new ATOM 0 HG22 THR A 113 -3.799 -12.179 1.478 1.00 0.00 H new ATOM 0 HG23 THR A 113 -5.181 -11.068 1.623 1.00 0.00 H new ATOM 1633 N GLN A 114 -3.535 -12.606 4.331 1.00 0.00 N ATOM 1634 CA GLN A 114 -3.020 -13.977 4.593 1.00 0.00 C ATOM 1635 C GLN A 114 -2.845 -14.679 3.243 1.00 0.00 C ATOM 1636 O GLN A 114 -3.691 -14.569 2.381 1.00 0.00 O ATOM 1637 CB GLN A 114 -4.083 -14.672 5.453 1.00 0.00 C ATOM 1638 CG GLN A 114 -3.466 -15.895 6.128 1.00 0.00 C ATOM 1639 CD GLN A 114 -2.609 -15.450 7.311 1.00 0.00 C ATOM 1640 OE1 GLN A 114 -2.856 -14.419 7.905 1.00 0.00 O ATOM 1641 NE2 GLN A 114 -1.604 -16.192 7.681 1.00 0.00 N ATOM 0 H GLN A 114 -4.492 -12.423 4.632 1.00 0.00 H new ATOM 0 HA GLN A 114 -2.060 -13.987 5.109 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -4.467 -13.982 6.205 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -4.929 -14.972 4.834 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -4.251 -16.570 6.469 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -2.857 -16.449 5.413 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -1.398 -17.057 7.182 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -1.024 -15.908 8.470 1.00 0.00 H new ATOM 1650 N ILE A 115 -1.760 -15.382 3.036 1.00 0.00 N ATOM 1651 CA ILE A 115 -1.581 -16.077 1.728 1.00 0.00 C ATOM 1652 C ILE A 115 -1.613 -17.596 1.970 1.00 0.00 C ATOM 1653 O ILE A 115 -0.851 -18.121 2.768 1.00 0.00 O ATOM 1654 CB ILE A 115 -0.212 -15.629 1.173 1.00 0.00 C ATOM 1655 CG1 ILE A 115 -0.289 -14.157 0.750 1.00 0.00 C ATOM 1656 CG2 ILE A 115 0.160 -16.481 -0.051 1.00 0.00 C ATOM 1657 CD1 ILE A 115 1.083 -13.691 0.253 1.00 0.00 C ATOM 0 H ILE A 115 -1.001 -15.503 3.706 1.00 0.00 H new ATOM 0 HA ILE A 115 -2.369 -15.833 1.016 1.00 0.00 H new ATOM 0 HB ILE A 115 0.544 -15.754 1.948 1.00 0.00 H new ATOM 0 HG12 ILE A 115 -1.033 -14.033 -0.037 1.00 0.00 H new ATOM 0 HG13 ILE A 115 -0.610 -13.543 1.592 1.00 0.00 H new ATOM 0 HG21 ILE A 115 1.127 -16.160 -0.438 1.00 0.00 H new ATOM 0 HG22 ILE A 115 0.216 -17.530 0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 115 -0.599 -16.358 -0.824 1.00 0.00 H new ATOM 0 HD11 ILE A 115 1.025 -12.645 -0.047 1.00 0.00 H new ATOM 0 HD12 ILE A 115 1.816 -13.799 1.053 1.00 0.00 H new ATOM 0 HD13 ILE A 115 1.386 -14.297 -0.601 1.00 0.00 H new ATOM 1669 N TYR A 116 -2.480 -18.292 1.280 1.00 0.00 N ATOM 1670 CA TYR A 116 -2.575 -19.778 1.433 1.00 0.00 C ATOM 1671 C TYR A 116 -2.051 -20.459 0.172 1.00 0.00 C ATOM 1672 O TYR A 116 -2.018 -19.858 -0.885 1.00 0.00 O ATOM 1673 CB TYR A 116 -4.070 -20.092 1.560 1.00 0.00 C ATOM 1674 CG TYR A 116 -4.620 -19.648 2.893 1.00 0.00 C ATOM 1675 CD1 TYR A 116 -3.967 -20.028 4.097 1.00 0.00 C ATOM 1676 CD2 TYR A 116 -5.813 -18.874 2.946 1.00 0.00 C ATOM 1677 CE1 TYR A 116 -4.507 -19.631 5.352 1.00 0.00 C ATOM 1678 CE2 TYR A 116 -6.344 -18.478 4.193 1.00 0.00 C ATOM 1679 CZ TYR A 116 -5.696 -18.853 5.399 1.00 0.00 C ATOM 1680 OH TYR A 116 -6.221 -18.466 6.615 1.00 0.00 O ATOM 0 H TYR A 116 -3.135 -17.890 0.609 1.00 0.00 H new ATOM 0 HA TYR A 116 -1.999 -20.124 2.291 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -4.616 -19.596 0.757 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -4.229 -21.164 1.439 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -3.063 -20.617 4.059 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -6.313 -18.589 2.032 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -4.014 -19.920 6.268 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -7.247 -17.887 4.229 1.00 0.00 H new ATOM 0 HH TYR A 116 -7.034 -17.939 6.468 1.00 0.00 H new ATOM 1690 N VAL A 117 -1.678 -21.712 0.256 1.00 0.00 N ATOM 1691 CA VAL A 117 -1.204 -22.421 -0.968 1.00 0.00 C ATOM 1692 C VAL A 117 -2.306 -23.352 -1.472 1.00 0.00 C ATOM 1693 O VAL A 117 -3.266 -23.636 -0.782 1.00 0.00 O ATOM 1694 CB VAL A 117 0.038 -23.222 -0.573 1.00 0.00 C ATOM 1695 CG1 VAL A 117 0.531 -24.016 -1.794 1.00 0.00 C ATOM 1696 CG2 VAL A 117 1.137 -22.262 -0.112 1.00 0.00 C ATOM 0 H VAL A 117 -1.681 -22.268 1.111 1.00 0.00 H new ATOM 0 HA VAL A 117 -0.962 -21.720 -1.767 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.207 -23.907 0.238 1.00 0.00 H new ATOM 0 HG11 VAL A 117 1.417 -24.590 -1.521 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -0.254 -24.695 -2.127 1.00 0.00 H new ATOM 0 HG13 VAL A 117 0.780 -23.326 -2.600 1.00 0.00 H new ATOM 0 HG21 VAL A 117 2.023 -22.831 0.170 1.00 0.00 H new ATOM 0 HG22 VAL A 117 1.388 -21.579 -0.924 1.00 0.00 H new ATOM 0 HG23 VAL A 117 0.784 -21.691 0.747 1.00 0.00 H new ATOM 1706 N ILE A 118 -2.171 -23.802 -2.683 1.00 0.00 N ATOM 1707 CA ILE A 118 -3.190 -24.693 -3.287 1.00 0.00 C ATOM 1708 C ILE A 118 -2.580 -26.060 -3.630 1.00 0.00 C ATOM 1709 O ILE A 118 -1.469 -26.149 -4.116 1.00 0.00 O ATOM 1710 CB ILE A 118 -3.571 -23.932 -4.552 1.00 0.00 C ATOM 1711 CG1 ILE A 118 -4.243 -22.601 -4.180 1.00 0.00 C ATOM 1712 CG2 ILE A 118 -4.514 -24.764 -5.433 1.00 0.00 C ATOM 1713 CD1 ILE A 118 -5.511 -22.866 -3.374 1.00 0.00 C ATOM 0 H ILE A 118 -1.381 -23.585 -3.291 1.00 0.00 H new ATOM 0 HA ILE A 118 -4.036 -24.906 -2.633 1.00 0.00 H new ATOM 0 HB ILE A 118 -2.661 -23.733 -5.118 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -3.555 -21.986 -3.600 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -4.486 -22.042 -5.083 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.770 -24.197 -6.328 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -4.020 -25.692 -5.720 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -5.423 -24.994 -4.877 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -5.982 -21.918 -3.114 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -6.202 -23.463 -3.969 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -5.256 -23.407 -2.462 1.00 0.00 H new ATOM 1725 N ASP A 119 -3.314 -27.118 -3.398 1.00 0.00 N ATOM 1726 CA ASP A 119 -2.800 -28.481 -3.726 1.00 0.00 C ATOM 1727 C ASP A 119 -3.516 -29.005 -4.984 1.00 0.00 C ATOM 1728 O ASP A 119 -4.716 -29.195 -4.961 1.00 0.00 O ATOM 1729 CB ASP A 119 -3.153 -29.343 -2.508 1.00 0.00 C ATOM 1730 CG ASP A 119 -2.585 -30.760 -2.676 1.00 0.00 C ATOM 1731 OD1 ASP A 119 -2.163 -31.095 -3.773 1.00 0.00 O ATOM 1732 OD2 ASP A 119 -2.589 -31.492 -1.700 1.00 0.00 O ATOM 0 H ASP A 119 -4.250 -27.096 -2.994 1.00 0.00 H new ATOM 0 HA ASP A 119 -1.729 -28.492 -3.929 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -2.751 -28.888 -1.603 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -4.235 -29.389 -2.388 1.00 0.00 H new ATOM 1737 N PRO A 120 -2.773 -29.219 -6.053 1.00 0.00 N ATOM 1738 CA PRO A 120 -3.399 -29.711 -7.309 1.00 0.00 C ATOM 1739 C PRO A 120 -3.866 -31.161 -7.151 1.00 0.00 C ATOM 1740 O PRO A 120 -3.194 -31.978 -6.550 1.00 0.00 O ATOM 1741 CB PRO A 120 -2.274 -29.609 -8.337 1.00 0.00 C ATOM 1742 CG PRO A 120 -1.015 -29.667 -7.536 1.00 0.00 C ATOM 1743 CD PRO A 120 -1.320 -29.033 -6.206 1.00 0.00 C ATOM 0 HA PRO A 120 -4.283 -29.141 -7.594 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -2.322 -30.426 -9.057 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -2.339 -28.680 -8.903 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -0.685 -30.698 -7.407 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -0.209 -29.136 -8.042 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -0.768 -29.513 -5.398 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -1.048 -27.977 -6.194 1.00 0.00 H new ATOM 1751 N GLU A 121 -5.014 -31.482 -7.693 1.00 0.00 N ATOM 1752 CA GLU A 121 -5.538 -32.876 -7.589 1.00 0.00 C ATOM 1753 C GLU A 121 -5.958 -33.388 -8.977 1.00 0.00 C ATOM 1754 O GLU A 121 -6.493 -32.634 -9.766 1.00 0.00 O ATOM 1755 CB GLU A 121 -6.752 -32.775 -6.665 1.00 0.00 C ATOM 1756 CG GLU A 121 -6.298 -32.329 -5.272 1.00 0.00 C ATOM 1757 CD GLU A 121 -7.520 -32.129 -4.372 1.00 0.00 C ATOM 1758 OE1 GLU A 121 -8.556 -31.743 -4.887 1.00 0.00 O ATOM 1759 OE2 GLU A 121 -7.397 -32.366 -3.181 1.00 0.00 O ATOM 0 H GLU A 121 -5.613 -30.834 -8.205 1.00 0.00 H new ATOM 0 HA GLU A 121 -4.791 -33.571 -7.205 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -7.472 -32.064 -7.070 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -7.257 -33.739 -6.603 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -5.633 -33.076 -4.839 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -5.731 -31.401 -5.343 1.00 0.00 H new ATOM 1766 N PRO A 122 -5.709 -34.653 -9.243 1.00 0.00 N ATOM 1767 CA PRO A 122 -6.084 -35.229 -10.561 1.00 0.00 C ATOM 1768 C PRO A 122 -7.610 -35.343 -10.705 1.00 0.00 C ATOM 1769 O PRO A 122 -8.116 -35.586 -11.785 1.00 0.00 O ATOM 1770 CB PRO A 122 -5.432 -36.610 -10.551 1.00 0.00 C ATOM 1771 CG PRO A 122 -5.285 -36.955 -9.105 1.00 0.00 C ATOM 1772 CD PRO A 122 -5.076 -35.658 -8.370 1.00 0.00 C ATOM 0 HA PRO A 122 -5.756 -34.611 -11.397 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -6.050 -37.342 -11.071 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -4.465 -36.594 -11.054 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -6.173 -37.469 -8.738 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -4.441 -37.627 -8.951 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -5.538 -35.679 -7.383 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -4.017 -35.449 -8.222 1.00 0.00 H new ATOM 1780 N CYS A 123 -8.347 -35.174 -9.631 1.00 0.00 N ATOM 1781 CA CYS A 123 -9.835 -35.281 -9.715 1.00 0.00 C ATOM 1782 C CYS A 123 -10.498 -34.037 -9.096 1.00 0.00 C ATOM 1783 O CYS A 123 -9.993 -33.492 -8.135 1.00 0.00 O ATOM 1784 CB CYS A 123 -10.188 -36.528 -8.906 1.00 0.00 C ATOM 1785 SG CYS A 123 -11.967 -36.840 -9.026 1.00 0.00 S ATOM 0 H CYS A 123 -7.980 -34.967 -8.702 1.00 0.00 H new ATOM 0 HA CYS A 123 -10.184 -35.347 -10.746 1.00 0.00 H new ATOM 0 HB2 CYS A 123 -9.631 -37.387 -9.280 1.00 0.00 H new ATOM 0 HB3 CYS A 123 -9.901 -36.392 -7.863 1.00 0.00 H new ATOM 0 HG CYS A 123 -12.617 -35.865 -8.463 1.00 0.00 H new ATOM 1791 N PRO A 124 -11.605 -33.613 -9.671 1.00 0.00 N ATOM 1792 CA PRO A 124 -12.322 -32.424 -9.141 1.00 0.00 C ATOM 1793 C PRO A 124 -12.949 -32.733 -7.781 1.00 0.00 C ATOM 1794 O PRO A 124 -13.124 -33.881 -7.419 1.00 0.00 O ATOM 1795 CB PRO A 124 -13.390 -32.143 -10.194 1.00 0.00 C ATOM 1796 CG PRO A 124 -13.619 -33.458 -10.865 1.00 0.00 C ATOM 1797 CD PRO A 124 -12.308 -34.196 -10.829 1.00 0.00 C ATOM 0 HA PRO A 124 -11.666 -31.569 -8.977 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -14.306 -31.767 -9.738 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -13.055 -31.389 -10.906 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -14.396 -34.024 -10.352 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -13.955 -33.315 -11.892 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -12.457 -35.269 -10.707 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -11.744 -34.055 -11.751 1.00 0.00 H new ATOM 1805 N ASP A 125 -13.293 -31.717 -7.030 1.00 0.00 N ATOM 1806 CA ASP A 125 -13.911 -31.946 -5.690 1.00 0.00 C ATOM 1807 C ASP A 125 -15.405 -32.267 -5.836 1.00 0.00 C ATOM 1808 O ASP A 125 -15.910 -32.430 -6.931 1.00 0.00 O ATOM 1809 CB ASP A 125 -13.699 -30.633 -4.921 1.00 0.00 C ATOM 1810 CG ASP A 125 -14.431 -29.470 -5.611 1.00 0.00 C ATOM 1811 OD1 ASP A 125 -14.996 -29.685 -6.673 1.00 0.00 O ATOM 1812 OD2 ASP A 125 -14.408 -28.380 -5.065 1.00 0.00 O ATOM 0 H ASP A 125 -13.172 -30.738 -7.288 1.00 0.00 H new ATOM 0 HA ASP A 125 -13.464 -32.793 -5.169 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -14.063 -30.742 -3.899 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -12.634 -30.411 -4.858 1.00 0.00 H new ATOM 1817 N SER A 126 -16.107 -32.367 -4.736 1.00 0.00 N ATOM 1818 CA SER A 126 -17.568 -32.688 -4.795 1.00 0.00 C ATOM 1819 C SER A 126 -18.328 -31.619 -5.587 1.00 0.00 C ATOM 1820 O SER A 126 -19.337 -31.900 -6.206 1.00 0.00 O ATOM 1821 CB SER A 126 -18.036 -32.703 -3.339 1.00 0.00 C ATOM 1822 OG SER A 126 -17.889 -31.401 -2.785 1.00 0.00 O ATOM 0 H SER A 126 -15.731 -32.240 -3.796 1.00 0.00 H new ATOM 0 HA SER A 126 -17.751 -33.639 -5.295 1.00 0.00 H new ATOM 0 HB2 SER A 126 -19.078 -33.019 -3.283 1.00 0.00 H new ATOM 0 HB3 SER A 126 -17.453 -33.423 -2.765 1.00 0.00 H new ATOM 0 HG SER A 126 -18.190 -31.407 -1.852 1.00 0.00 H new ATOM 1828 N ASP A 127 -17.856 -30.398 -5.568 1.00 0.00 N ATOM 1829 CA ASP A 127 -18.555 -29.309 -6.315 1.00 0.00 C ATOM 1830 C ASP A 127 -18.118 -29.302 -7.783 1.00 0.00 C ATOM 1831 O ASP A 127 -16.954 -29.130 -8.091 1.00 0.00 O ATOM 1832 CB ASP A 127 -18.127 -28.013 -5.620 1.00 0.00 C ATOM 1833 CG ASP A 127 -18.967 -26.831 -6.130 1.00 0.00 C ATOM 1834 OD1 ASP A 127 -19.657 -26.992 -7.125 1.00 0.00 O ATOM 1835 OD2 ASP A 127 -18.899 -25.780 -5.514 1.00 0.00 O ATOM 0 H ASP A 127 -17.016 -30.108 -5.067 1.00 0.00 H new ATOM 0 HA ASP A 127 -19.637 -29.437 -6.310 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -18.247 -28.114 -4.541 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -17.070 -27.824 -5.807 1.00 0.00 H new ATOM 1840 N GLN A 128 -19.047 -29.484 -8.687 1.00 0.00 N ATOM 1841 CA GLN A 128 -18.694 -29.489 -10.139 1.00 0.00 C ATOM 1842 C GLN A 128 -19.465 -28.385 -10.871 1.00 0.00 C ATOM 1843 O GLN A 128 -20.618 -28.127 -10.586 1.00 0.00 O ATOM 1844 CB GLN A 128 -19.121 -30.867 -10.645 1.00 0.00 C ATOM 1845 CG GLN A 128 -18.286 -31.946 -9.951 1.00 0.00 C ATOM 1846 CD GLN A 128 -18.776 -33.330 -10.383 1.00 0.00 C ATOM 1847 OE1 GLN A 128 -19.909 -33.487 -10.792 1.00 0.00 O ATOM 1848 NE2 GLN A 128 -17.963 -34.348 -10.307 1.00 0.00 N ATOM 0 H GLN A 128 -20.036 -29.629 -8.482 1.00 0.00 H new ATOM 0 HA GLN A 128 -17.633 -29.304 -10.309 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -20.180 -31.027 -10.445 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -18.987 -30.927 -11.725 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -17.233 -31.826 -10.206 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -18.366 -31.842 -8.869 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -17.012 -34.216 -9.964 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -18.279 -35.275 -10.591 1.00 0.00 H new ATOM 1857 N GLU A 129 -18.832 -27.737 -11.821 1.00 0.00 N ATOM 1858 CA GLU A 129 -19.514 -26.642 -12.589 1.00 0.00 C ATOM 1859 C GLU A 129 -20.133 -25.595 -11.640 1.00 0.00 C ATOM 1860 O GLU A 129 -21.291 -25.255 -11.779 1.00 0.00 O ATOM 1861 CB GLU A 129 -20.605 -27.342 -13.407 1.00 0.00 C ATOM 1862 CG GLU A 129 -19.961 -28.302 -14.412 1.00 0.00 C ATOM 1863 CD GLU A 129 -19.126 -27.511 -15.424 1.00 0.00 C ATOM 1864 OE1 GLU A 129 -19.488 -26.382 -15.712 1.00 0.00 O ATOM 1865 OE2 GLU A 129 -18.139 -28.052 -15.896 1.00 0.00 O ATOM 0 H GLU A 129 -17.868 -27.919 -12.100 1.00 0.00 H new ATOM 0 HA GLU A 129 -18.811 -26.101 -13.222 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -21.275 -27.890 -12.744 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -21.210 -26.603 -13.932 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -19.330 -29.021 -13.889 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -20.732 -28.872 -14.930 1.00 0.00 H new ATOM 1872 N PRO A 130 -19.351 -25.125 -10.688 1.00 0.00 N ATOM 1873 CA PRO A 130 -19.866 -24.113 -9.729 1.00 0.00 C ATOM 1874 C PRO A 130 -20.096 -22.773 -10.430 1.00 0.00 C ATOM 1875 O PRO A 130 -19.418 -22.439 -11.384 1.00 0.00 O ATOM 1876 CB PRO A 130 -18.757 -24.006 -8.685 1.00 0.00 C ATOM 1877 CG PRO A 130 -17.517 -24.436 -9.398 1.00 0.00 C ATOM 1878 CD PRO A 130 -17.939 -25.451 -10.427 1.00 0.00 C ATOM 0 HA PRO A 130 -20.826 -24.389 -9.292 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -18.664 -22.987 -8.310 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -18.960 -24.645 -7.825 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -17.028 -23.585 -9.872 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.799 -24.868 -8.700 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -17.338 -25.375 -11.333 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -17.826 -26.469 -10.054 1.00 0.00 H new ATOM 1886 N LYS A 131 -21.049 -22.004 -9.963 1.00 0.00 N ATOM 1887 CA LYS A 131 -21.326 -20.682 -10.599 1.00 0.00 C ATOM 1888 C LYS A 131 -22.026 -19.754 -9.600 1.00 0.00 C ATOM 1889 O LYS A 131 -23.072 -20.072 -9.070 1.00 0.00 O ATOM 1890 CB LYS A 131 -22.251 -20.996 -11.776 1.00 0.00 C ATOM 1891 CG LYS A 131 -22.529 -19.714 -12.564 1.00 0.00 C ATOM 1892 CD LYS A 131 -21.270 -19.307 -13.335 1.00 0.00 C ATOM 1893 CE LYS A 131 -21.551 -18.035 -14.138 1.00 0.00 C ATOM 1894 NZ LYS A 131 -20.247 -17.680 -14.762 1.00 0.00 N ATOM 0 H LYS A 131 -21.646 -22.236 -9.169 1.00 0.00 H new ATOM 0 HA LYS A 131 -20.415 -20.177 -10.920 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -21.791 -21.742 -12.425 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -23.186 -21.422 -11.413 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -23.357 -19.871 -13.255 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -22.828 -18.915 -11.886 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -20.446 -19.138 -12.642 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -20.964 -20.112 -14.004 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -22.317 -18.206 -14.894 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -21.912 -17.233 -13.494 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -20.358 -16.816 -15.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -19.539 -17.516 -14.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -19.932 -18.459 -15.374 1.00 0.00 H new TER 1908 LYS A 131 HETATM 1909 C1 NAG A 132 -2.693 -4.017 11.290 1.00 0.00 C HETATM 1910 C2 NAG A 132 -1.487 -3.107 11.530 1.00 0.00 C HETATM 1911 C3 NAG A 132 -0.423 -3.845 12.334 1.00 0.00 C HETATM 1912 C4 NAG A 132 -1.017 -4.458 13.599 1.00 0.00 C HETATM 1913 C5 NAG A 132 -2.280 -5.258 13.282 1.00 0.00 C HETATM 1914 C6 NAG A 132 -2.982 -5.723 14.542 1.00 0.00 C HETATM 1915 C7 NAG A 132 0.002 -1.738 10.261 1.00 0.00 C HETATM 1916 C8 NAG A 132 1.226 -1.978 9.389 1.00 0.00 C HETATM 1917 N2 NAG A 132 -0.919 -2.664 10.270 1.00 0.00 N HETATM 1918 O3 NAG A 132 0.617 -2.943 12.684 1.00 0.00 O HETATM 1919 O4 NAG A 132 -0.048 -5.335 14.205 1.00 0.00 O HETATM 1920 O5 NAG A 132 -3.222 -4.458 12.541 1.00 0.00 O HETATM 1921 O6 NAG A 132 -4.379 -5.971 14.262 1.00 0.00 O HETATM 1922 O7 NAG A 132 -0.116 -0.726 10.923 1.00 0.00 O HETATM 0 HO3 NAG A 132 1.337 -3.433 13.133 1.00 0.00 H new HETATM 0 HN2 NAG A 132 -1.239 -3.075 9.393 1.00 0.00 H new HETATM 0 H83 NAG A 132 1.732 -2.887 9.715 1.00 0.00 H new HETATM 0 H82 NAG A 132 0.916 -2.088 8.350 1.00 0.00 H new HETATM 0 H81 NAG A 132 1.907 -1.131 9.477 1.00 0.00 H new HETATM 0 H62 NAG A 132 -2.510 -6.631 14.918 1.00 0.00 H new HETATM 0 H61 NAG A 132 -2.887 -4.968 15.322 1.00 0.00 H new HETATM 0 H5 NAG A 132 -1.956 -6.119 12.697 1.00 0.00 H new HETATM 0 H4 NAG A 132 -1.278 -3.649 14.281 1.00 0.00 H new HETATM 0 H3 NAG A 132 -0.024 -4.651 11.718 1.00 0.00 H new HETATM 0 H2 NAG A 132 -1.826 -2.236 12.090 1.00 0.00 H new HETATM 1935 C1 NAG A 133 0.715 -4.806 15.232 1.00 0.00 C HETATM 1936 C2 NAG A 133 1.277 -5.944 16.082 1.00 0.00 C HETATM 1937 C3 NAG A 133 2.245 -5.409 17.136 1.00 0.00 C HETATM 1938 C4 NAG A 133 3.297 -4.517 16.486 1.00 0.00 C HETATM 1939 C5 NAG A 133 2.630 -3.446 15.628 1.00 0.00 C HETATM 1940 C6 NAG A 133 3.642 -2.602 14.877 1.00 0.00 C HETATM 1941 C7 NAG A 133 -0.556 -6.101 17.621 1.00 0.00 C HETATM 1942 C8 NAG A 133 -1.487 -6.998 18.419 1.00 0.00 C HETATM 1943 N2 NAG A 133 0.197 -6.676 16.719 1.00 0.00 N HETATM 1944 O3 NAG A 133 2.883 -6.495 17.792 1.00 0.00 O HETATM 1945 O4 NAG A 133 4.099 -3.889 17.506 1.00 0.00 O HETATM 1946 O5 NAG A 133 1.782 -4.060 14.643 1.00 0.00 O HETATM 1947 O6 NAG A 133 3.002 -1.736 13.951 1.00 0.00 O HETATM 1948 O7 NAG A 133 -0.514 -4.902 17.812 1.00 0.00 O HETATM 0 HO6 NAG A 133 3.677 -1.203 13.482 1.00 0.00 H new HETATM 0 HO3 NAG A 133 3.505 -6.150 18.466 1.00 0.00 H new HETATM 0 HN2 NAG A 133 0.024 -7.647 16.461 1.00 0.00 H new HETATM 0 H83 NAG A 133 -2.176 -7.502 17.741 1.00 0.00 H new HETATM 0 H82 NAG A 133 -0.901 -7.742 18.959 1.00 0.00 H new HETATM 0 H81 NAG A 133 -2.052 -6.395 19.130 1.00 0.00 H new HETATM 0 H62 NAG A 133 4.226 -2.014 15.585 1.00 0.00 H new HETATM 0 H61 NAG A 133 4.341 -3.251 14.349 1.00 0.00 H new HETATM 0 H5 NAG A 133 2.062 -2.814 16.310 1.00 0.00 H new HETATM 0 H4 NAG A 133 3.933 -5.132 15.849 1.00 0.00 H new HETATM 0 H3 NAG A 133 1.684 -4.821 17.862 1.00 0.00 H new HETATM 0 H2 NAG A 133 1.825 -6.621 15.427 1.00 0.00 H new HETATM 1962 C1 FUL A 134 -4.788 -7.261 14.649 1.00 0.00 C HETATM 1963 C2 FUL A 134 -4.681 -7.363 16.174 1.00 0.00 C HETATM 1964 O2 FUL A 134 -5.572 -6.445 16.795 1.00 0.00 O HETATM 1965 C3 FUL A 134 -5.019 -8.780 16.624 1.00 0.00 C HETATM 1966 O3 FUL A 134 -4.816 -8.893 18.025 1.00 0.00 O HETATM 1967 C4 FUL A 134 -4.129 -9.782 15.898 1.00 0.00 C HETATM 1968 O4 FUL A 134 -2.788 -9.621 16.334 1.00 0.00 O HETATM 1969 C5 FUL A 134 -4.197 -9.571 14.388 1.00 0.00 C HETATM 1970 C6 FUL A 134 -3.203 -10.436 13.643 1.00 0.00 C HETATM 1971 O5 FUL A 134 -3.893 -8.200 14.066 1.00 0.00 O HETATM 0 HO4 FUL A 134 -2.322 -10.481 16.282 1.00 0.00 H new HETATM 0 HO3 FUL A 134 -3.916 -9.241 18.198 1.00 0.00 H new HETATM 0 HO2 FUL A 134 -5.890 -6.820 17.642 1.00 0.00 H new HETATM 0 H63 FUL A 134 -2.192 -10.195 13.973 1.00 0.00 H new HETATM 0 H62 FUL A 134 -3.410 -11.487 13.847 1.00 0.00 H new HETATM 0 H61 FUL A 134 -3.290 -10.250 12.572 1.00 0.00 H new HETATM 0 H5 FUL A 134 -5.209 -9.839 14.084 1.00 0.00 H new HETATM 0 H4 FUL A 134 -4.479 -10.789 16.126 1.00 0.00 H new HETATM 0 H3 FUL A 134 -6.062 -8.992 16.388 1.00 0.00 H new HETATM 0 H2 FUL A 134 -3.659 -7.121 16.467 1.00 0.00 H new HETATM 1983 C1 BMA A 135 5.443 -4.224 17.516 1.00 0.00 C HETATM 1984 C2 BMA A 135 6.220 -3.257 16.628 1.00 0.00 C HETATM 1985 C3 BMA A 135 7.712 -3.555 16.704 1.00 0.00 C HETATM 1986 C4 BMA A 135 8.173 -3.576 18.158 1.00 0.00 C HETATM 1987 C5 BMA A 135 7.295 -4.512 18.987 1.00 0.00 C HETATM 1988 C6 BMA A 135 7.639 -4.464 20.462 1.00 0.00 C HETATM 1989 O2 BMA A 135 5.977 -1.923 17.049 1.00 0.00 O HETATM 1990 O3 BMA A 135 8.434 -2.562 15.989 1.00 0.00 O HETATM 1991 O4 BMA A 135 9.523 -4.012 18.222 1.00 0.00 O HETATM 1992 O5 BMA A 135 5.910 -4.141 18.864 1.00 0.00 O HETATM 1993 O6 BMA A 135 8.876 -5.112 20.722 1.00 0.00 O HETATM 0 HO6 BMA A 135 9.075 -5.065 21.680 1.00 0.00 H new HETATM 0 HO4 BMA A 135 9.673 -4.490 19.064 1.00 0.00 H new HETATM 0 HO3 BMA A 135 9.394 -2.755 16.041 1.00 0.00 H new HETATM 0 HO2 BMA A 135 6.788 -1.387 16.922 1.00 0.00 H new HETATM 0 H62 BMA A 135 7.692 -3.427 20.792 1.00 0.00 H new HETATM 0 H61 BMA A 135 6.847 -4.942 21.039 1.00 0.00 H new HETATM 0 H5 BMA A 135 7.474 -5.516 18.603 1.00 0.00 H new HETATM 0 H4 BMA A 135 8.091 -2.568 18.565 1.00 0.00 H new HETATM 0 H3 BMA A 135 7.900 -4.533 16.260 1.00 0.00 H new HETATM 0 H2 BMA A 135 5.888 -3.379 15.597 1.00 0.00 H new HETATM 2005 C1 NAG A 136 -0.307 -8.776 -10.707 1.00 0.00 C HETATM 2006 C2 NAG A 136 -1.308 -9.829 -11.184 1.00 0.00 C HETATM 2007 C3 NAG A 136 -0.630 -10.836 -12.108 1.00 0.00 C HETATM 2008 C4 NAG A 136 0.086 -10.099 -13.230 1.00 0.00 C HETATM 2009 C5 NAG A 136 1.036 -9.041 -12.658 1.00 0.00 C HETATM 2010 C6 NAG A 136 1.709 -8.221 -13.741 1.00 0.00 C HETATM 2011 C7 NAG A 136 -3.111 -10.951 -10.092 1.00 0.00 C HETATM 2012 C8 NAG A 136 -3.932 -10.860 -8.815 1.00 0.00 C HETATM 2013 N2 NAG A 136 -1.880 -10.519 -10.044 1.00 0.00 N HETATM 2014 O3 NAG A 136 -1.604 -11.711 -12.657 1.00 0.00 O HETATM 2015 O4 NAG A 136 0.766 -11.037 -14.101 1.00 0.00 O HETATM 2016 O5 NAG A 136 0.304 -8.125 -11.825 1.00 0.00 O HETATM 2017 O6 NAG A 136 0.771 -7.269 -14.282 1.00 0.00 O HETATM 2018 O7 NAG A 136 -3.580 -11.407 -11.116 1.00 0.00 O HETATM 0 HO3 NAG A 136 -2.499 -11.409 -12.396 1.00 0.00 H new HETATM 0 HN2 NAG A 136 -1.320 -10.667 -9.204 1.00 0.00 H new HETATM 0 H83 NAG A 136 -3.450 -11.444 -8.030 1.00 0.00 H new HETATM 0 H82 NAG A 136 -4.002 -9.819 -8.501 1.00 0.00 H new HETATM 0 H81 NAG A 136 -4.932 -11.252 -8.997 1.00 0.00 H new HETATM 0 H62 NAG A 136 2.575 -7.701 -13.332 1.00 0.00 H new HETATM 0 H61 NAG A 136 2.075 -8.876 -14.532 1.00 0.00 H new HETATM 0 H5 NAG A 136 1.796 -9.582 -12.094 1.00 0.00 H new HETATM 0 H4 NAG A 136 -0.651 -9.573 -13.837 1.00 0.00 H new HETATM 0 H3 NAG A 136 0.095 -11.417 -11.538 1.00 0.00 H new HETATM 0 H2 NAG A 136 -2.101 -9.326 -11.738 1.00 0.00 H new HETATM 2031 C1 NAG A 137 2.074 -11.403 -13.830 1.00 0.00 C HETATM 2032 C2 NAG A 137 2.151 -12.909 -13.597 1.00 0.00 C HETATM 2033 C3 NAG A 137 3.603 -13.346 -13.426 1.00 0.00 C HETATM 2034 C4 NAG A 137 4.464 -12.829 -14.575 1.00 0.00 C HETATM 2035 C5 NAG A 137 4.263 -11.328 -14.766 1.00 0.00 C HETATM 2036 C6 NAG A 137 4.999 -10.804 -15.983 1.00 0.00 C HETATM 2037 C7 NAG A 137 0.516 -14.220 -12.446 1.00 0.00 C HETATM 2038 C8 NAG A 137 0.487 -15.188 -11.274 1.00 0.00 C HETATM 2039 N2 NAG A 137 1.399 -13.259 -12.407 1.00 0.00 N HETATM 2040 O3 NAG A 137 3.673 -14.763 -13.382 1.00 0.00 O HETATM 2041 O4 NAG A 137 5.851 -13.094 -14.295 1.00 0.00 O HETATM 2042 O5 NAG A 137 2.870 -11.030 -14.956 1.00 0.00 O HETATM 2043 O6 NAG A 137 6.249 -10.234 -15.623 1.00 0.00 O HETATM 2044 O7 NAG A 137 -0.250 -14.334 -13.383 1.00 0.00 O HETATM 0 HO6 NAG A 137 6.969 -10.865 -15.833 1.00 0.00 H new HETATM 0 HO3 NAG A 137 4.517 -15.036 -12.966 1.00 0.00 H new HETATM 0 HN2 NAG A 137 1.561 -12.752 -11.537 1.00 0.00 H new HETATM 0 H83 NAG A 137 1.453 -15.685 -11.189 1.00 0.00 H new HETATM 0 H82 NAG A 137 0.279 -14.640 -10.355 1.00 0.00 H new HETATM 0 H81 NAG A 137 -0.292 -15.933 -11.437 1.00 0.00 H new HETATM 0 H62 NAG A 137 5.158 -11.616 -16.692 1.00 0.00 H new HETATM 0 H61 NAG A 137 4.387 -10.056 -16.487 1.00 0.00 H new HETATM 0 H5 NAG A 137 4.654 -10.851 -13.867 1.00 0.00 H new HETATM 0 H4 NAG A 137 4.166 -13.341 -15.490 1.00 0.00 H new HETATM 0 H3 NAG A 137 3.981 -12.929 -12.493 1.00 0.00 H new HETATM 0 H2 NAG A 137 1.726 -13.419 -14.462 1.00 0.00 H new HETATM 2058 C1 FUC A 138 0.584 -7.436 -15.659 1.00 0.00 C HETATM 2059 C2 FUC A 138 -0.301 -6.314 -16.170 1.00 0.00 C HETATM 2060 C3 FUC A 138 0.361 -5.000 -15.764 1.00 0.00 C HETATM 2061 C4 FUC A 138 1.803 -4.940 -16.297 1.00 0.00 C HETATM 2062 C5 FUC A 138 2.594 -6.223 -15.989 1.00 0.00 C HETATM 2063 C6 FUC A 138 3.895 -6.300 -16.764 1.00 0.00 C HETATM 2064 O2 FUC A 138 -1.598 -6.413 -15.599 1.00 0.00 O HETATM 2065 O3 FUC A 138 -0.383 -3.912 -16.292 1.00 0.00 O HETATM 2066 O4 FUC A 138 1.768 -4.750 -17.704 1.00 0.00 O HETATM 2067 O5 FUC A 138 1.813 -7.373 -16.353 1.00 0.00 O HETATM 0 HO4 FUC A 138 2.563 -4.251 -17.987 1.00 0.00 H new HETATM 0 HO3 FUC A 138 0.004 -3.637 -17.149 1.00 0.00 H new HETATM 0 HO2 FUC A 138 -1.531 -6.800 -14.701 1.00 0.00 H new HETATM 0 H63 FUC A 138 3.683 -6.284 -17.833 1.00 0.00 H new HETATM 0 H62 FUC A 138 4.523 -5.448 -16.506 1.00 0.00 H new HETATM 0 H61 FUC A 138 4.415 -7.224 -16.511 1.00 0.00 H new HETATM 0 H5 FUC A 138 2.815 -6.204 -14.922 1.00 0.00 H new HETATM 0 H4 FUC A 138 2.305 -4.111 -15.799 1.00 0.00 H new HETATM 0 H3 FUC A 138 0.384 -4.939 -14.676 1.00 0.00 H new HETATM 0 H2 FUC A 138 -0.413 -6.370 -17.253 1.00 0.00 H new HETATM 2079 C1 BMA A 139 6.395 -14.208 -14.912 1.00 0.00 C HETATM 2080 C2 BMA A 139 6.582 -13.929 -16.400 1.00 0.00 C HETATM 2081 C3 BMA A 139 7.274 -15.108 -17.074 1.00 0.00 C HETATM 2082 C4 BMA A 139 8.563 -15.456 -16.336 1.00 0.00 C HETATM 2083 C5 BMA A 139 8.295 -15.645 -14.845 1.00 0.00 C HETATM 2084 C6 BMA A 139 9.571 -15.863 -14.056 1.00 0.00 C HETATM 2085 O2 BMA A 139 7.361 -12.755 -16.572 1.00 0.00 O HETATM 2086 O3 BMA A 139 7.571 -14.780 -18.423 1.00 0.00 O HETATM 2087 O4 BMA A 139 9.111 -16.651 -16.874 1.00 0.00 O HETATM 2088 O5 BMA A 139 7.657 -14.476 -14.297 1.00 0.00 O HETATM 2089 O6 BMA A 139 10.550 -14.887 -14.381 1.00 0.00 O HETATM 0 HO6 BMA A 139 11.362 -15.051 -13.857 1.00 0.00 H new HETATM 0 HO4 BMA A 139 10.062 -16.706 -16.646 1.00 0.00 H new HETATM 0 HO3 BMA A 139 8.017 -15.539 -18.854 1.00 0.00 H new HETATM 0 HO2 BMA A 139 7.950 -12.864 -17.347 1.00 0.00 H new HETATM 0 H62 BMA A 139 9.353 -15.822 -12.989 1.00 0.00 H new HETATM 0 H61 BMA A 139 9.964 -16.859 -14.263 1.00 0.00 H new HETATM 0 H5 BMA A 139 7.657 -16.525 -14.761 1.00 0.00 H new HETATM 0 H4 BMA A 139 9.269 -14.636 -16.463 1.00 0.00 H new HETATM 0 H3 BMA A 139 6.608 -15.970 -17.047 1.00 0.00 H new HETATM 0 H2 BMA A 139 5.603 -13.785 -16.858 1.00 0.00 H new