USER MOD reduce.3.24.130724 H: found=0, std=0, add=1706, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 1707 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 34 THR OG1 : rot -160:sc= -0.591 USER MOD Set 1.2: B 74 SER OG : rot -6:sc= -1.38! USER MOD Set 2.1: B 25 GLN : amide:sc= -3.37! C(o=-3.1!,f=-12!) USER MOD Set 2.2: B 26 SER OG : rot 60:sc= 0.278! USER MOD Set 3.1: B 5 THR OG1 : rot 144:sc= 1.84 USER MOD Set 3.2: B 7 TYR OH : rot -37:sc= 1.05 USER MOD Set 4.1: A 25 GLN : amide:sc= -3.46! C(o=-3.6!,f=-7.5!) USER MOD Set 4.2: A 26 SER OG : rot 79:sc= -0.139 USER MOD Set 5.1: A 9 ASN : amide:sc= -9.83! C(o=-9.5!,f=-17!) USER MOD Set 5.2: A 14 SER OG : rot 164:sc= 0.335 USER MOD Set 6.1: A 8 LYS NZ :NH3+ 180:sc= -0.121 (180deg=-0.121) USER MOD Set 6.2: A 12 LYS NZ :NH3+ -160:sc= 0.407 (180deg=0.253) USER MOD Set 7.1: A 5 THR OG1 : rot 129:sc= 2 USER MOD Set 7.2: A 7 TYR OH : rot -29:sc= 0.696 USER MOD Single : A 2 SER OG : rot 14:sc= 0.85 USER MOD Single : A 3 GLN : amide:sc= -1.68 K(o=-1.7,f=-2.8!) USER MOD Single : A 10 LYS NZ :NH3+ -157:sc= -0.0587 (180deg=-0.427) USER MOD Single : A 13 SER OG : rot 85:sc= 1.22 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 13:sc= -7.72! USER MOD Single : A 31 ASN : amide:sc= -2.99 K(o=-3,f=-9.2!) USER MOD Single : A 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -3.56! USER MOD Single : A 48 LYS NZ :NH3+ 158:sc= -0.0699 (180deg=-0.38) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 55 CYS SG : rot 180:sc= 0 USER MOD Single : A 57 THR OG1 : rot 109:sc= -11.9! USER MOD Single : A 59 HIS :FLIP no HD1:sc= -0.571 F(o=-2.1,f=-0.57) USER MOD Single : A 67 MET CE :methyl -154:sc= -3.97! (180deg=-5.32!) USER MOD Single : A 69 THR OG1 : rot -17:sc= -4.57! USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 MET CE :methyl -109:sc= -4.44! (180deg=-10.5!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 SER OG : rot -130:sc= -2.55 USER MOD Single : A 78 LYS NZ :NH3+ 138:sc= 0.0132 (180deg=-0.0734) USER MOD Single : A 81 SER OG : rot -151:sc= -3.22! USER MOD Single : A 85 ASN : amide:sc= -6.2! C(o=-6.2!,f=-10!) USER MOD Single : A 88 SER OG : rot -28:sc= 0.0689 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 92 ASN :FLIP amide:sc= -1.4 F(o=-2.8,f=-1.4) USER MOD Single : A 103 THR OG1 : rot -11:sc= -1.74 USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -136:sc= 0.0581 (180deg=-0.139) USER MOD Single : B 2 SER OG : rot -38:sc= -3.29! USER MOD Single : B 3 GLN :FLIP amide:sc= -0.194 F(o=-1.2,f=-0.19) USER MOD Single : B 8 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.107) USER MOD Single : B 9 ASN : amide:sc= -7.06! C(o=-7.1!,f=-13!) USER MOD Single : B 10 LYS NZ :NH3+ 145:sc= -0.346 (180deg=-1.55!) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 SER OG : rot 87:sc= 0.344 USER MOD Single : B 14 SER OG : rot 89:sc= 0.557 USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 17 THR OG1 : rot 180:sc= 0 USER MOD Single : B 18 TYR OH : rot 180:sc= 0 USER MOD Single : B 20 TYR OH : rot 90:sc= -1.38! USER MOD Single : B 31 ASN : amide:sc= -2.05 K(o=-2.1,f=-10!) USER MOD Single : B 33 ASN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : B 41 THR OG1 : rot 148:sc= -3.92! USER MOD Single : B 48 LYS NZ :NH3+ 147:sc= -1.73 (180deg=-3.87!) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 SER OG : rot 180:sc= 0 USER MOD Single : B 53 HIS : no HD1:sc= -0.0569 X(o=-0.057,f=-0.22) USER MOD Single : B 55 CYS SG : rot 180:sc= -0.0736 USER MOD Single : B 57 THR OG1 : rot -48:sc= -2.48! USER MOD Single : B 59 HIS :FLIP no HE2:sc= -1.79 F(o=-2.5,f=-1.8) USER MOD Single : B 67 MET CE :methyl 179:sc= -7.83! (180deg=-7.97!) USER MOD Single : B 69 THR OG1 : rot -170:sc= -0.62 USER MOD Single : B 70 GLN : amide:sc= -0.171 K(o=-0.17,f=-2.1!) USER MOD Single : B 71 GLN : amide:sc= -0.331 X(o=-0.33,f=0) USER MOD Single : B 72 MET CE :methyl 144:sc= -11! (180deg=-17.2!) USER MOD Single : B 73 THR OG1 : rot 180:sc= -1.77! USER MOD Single : B 78 LYS NZ :NH3+ -154:sc= -0.0817 (180deg=-0.439) USER MOD Single : B 81 SER OG : rot 92:sc= -5.91! USER MOD Single : B 85 ASN : amide:sc= -0.524 X(o=-0.52,f=-0.73) USER MOD Single : B 88 SER OG : rot -24:sc= 0.71 USER MOD Single : B 89 THR OG1 : rot 180:sc= 0 USER MOD Single : B 92 ASN :FLIP amide:sc= -1.63 F(o=-2.5!,f=-1.6) USER MOD Single : B 103 THR OG1 : rot 180:sc= -0.0698 USER MOD ----------------------------------------------------------------- ATOM 20 N SER A 2 2.174 8.435 15.654 1.00 0.00 N ATOM 21 CA SER A 2 3.013 7.804 14.641 1.00 0.00 C ATOM 22 C SER A 2 2.234 7.608 13.343 1.00 0.00 C ATOM 23 O SER A 2 1.922 6.481 12.971 1.00 0.00 O ATOM 24 CB SER A 2 3.534 6.450 15.158 1.00 0.00 C ATOM 25 OG SER A 2 3.286 6.306 16.546 1.00 0.00 O ATOM 0 HA SER A 2 3.862 8.457 14.437 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.052 5.639 14.613 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.604 6.371 14.966 1.00 0.00 H new ATOM 0 HG SER A 2 2.652 6.994 16.838 1.00 0.00 H new ATOM 31 N GLN A 3 1.918 8.705 12.649 1.00 0.00 N ATOM 32 CA GLN A 3 1.168 8.601 11.399 1.00 0.00 C ATOM 33 C GLN A 3 0.971 9.948 10.698 1.00 0.00 C ATOM 34 O GLN A 3 -0.064 10.160 10.068 1.00 0.00 O ATOM 35 CB GLN A 3 -0.199 7.966 11.665 1.00 0.00 C ATOM 36 CG GLN A 3 -0.842 7.365 10.426 1.00 0.00 C ATOM 37 CD GLN A 3 -2.281 6.950 10.659 1.00 0.00 C ATOM 38 OE1 GLN A 3 -2.662 6.585 11.772 1.00 0.00 O ATOM 39 NE2 GLN A 3 -3.090 7.002 9.607 1.00 0.00 N ATOM 0 H GLN A 3 2.164 9.655 12.925 1.00 0.00 H new ATOM 0 HA GLN A 3 1.762 7.975 10.732 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -0.088 7.188 12.420 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -0.866 8.721 12.081 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -0.804 8.090 9.613 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.265 6.497 10.106 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -2.732 7.311 8.703 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -4.069 6.733 9.703 1.00 0.00 H new ATOM 48 N PHE A 4 1.953 10.850 10.774 1.00 0.00 N ATOM 49 CA PHE A 4 1.814 12.141 10.096 1.00 0.00 C ATOM 50 C PHE A 4 3.104 12.961 10.081 1.00 0.00 C ATOM 51 O PHE A 4 3.128 14.114 10.511 1.00 0.00 O ATOM 52 CB PHE A 4 0.669 12.955 10.707 1.00 0.00 C ATOM 53 CG PHE A 4 -0.638 12.755 9.990 1.00 0.00 C ATOM 54 CD1 PHE A 4 -0.676 12.669 8.606 1.00 0.00 C ATOM 55 CD2 PHE A 4 -1.822 12.632 10.697 1.00 0.00 C ATOM 56 CE1 PHE A 4 -1.867 12.464 7.941 1.00 0.00 C ATOM 57 CE2 PHE A 4 -3.020 12.431 10.037 1.00 0.00 C ATOM 58 CZ PHE A 4 -3.041 12.346 8.657 1.00 0.00 C ATOM 0 H PHE A 4 2.828 10.718 11.282 1.00 0.00 H new ATOM 0 HA PHE A 4 1.580 11.913 9.056 1.00 0.00 H new ATOM 0 HB2 PHE A 4 0.550 12.676 11.754 1.00 0.00 H new ATOM 0 HB3 PHE A 4 0.931 14.013 10.687 1.00 0.00 H new ATOM 0 HD1 PHE A 4 0.240 12.764 8.041 1.00 0.00 H new ATOM 0 HD2 PHE A 4 -1.810 12.694 11.775 1.00 0.00 H new ATOM 0 HE1 PHE A 4 -1.881 12.396 6.863 1.00 0.00 H new ATOM 0 HE2 PHE A 4 -3.938 12.340 10.598 1.00 0.00 H new ATOM 0 HZ PHE A 4 -3.976 12.187 8.140 1.00 0.00 H new ATOM 68 N THR A 5 4.160 12.367 9.544 1.00 0.00 N ATOM 69 CA THR A 5 5.447 13.034 9.416 1.00 0.00 C ATOM 70 C THR A 5 5.849 13.086 7.947 1.00 0.00 C ATOM 71 O THR A 5 5.343 12.315 7.133 1.00 0.00 O ATOM 72 CB THR A 5 6.522 12.285 10.203 1.00 0.00 C ATOM 73 OG1 THR A 5 5.973 11.667 11.354 1.00 0.00 O ATOM 74 CG2 THR A 5 7.664 13.169 10.658 1.00 0.00 C ATOM 0 H THR A 5 4.149 11.412 9.186 1.00 0.00 H new ATOM 0 HA THR A 5 5.356 14.044 9.815 1.00 0.00 H new ATOM 0 HB THR A 5 6.914 11.543 9.507 1.00 0.00 H new ATOM 0 HG1 THR A 5 6.238 10.724 11.376 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.389 12.571 11.210 1.00 0.00 H new ATOM 0 HG22 THR A 5 8.148 13.615 9.789 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.278 13.958 11.303 1.00 0.00 H new ATOM 82 N LEU A 6 6.786 13.961 7.616 1.00 0.00 N ATOM 83 CA LEU A 6 7.274 14.057 6.250 1.00 0.00 C ATOM 84 C LEU A 6 8.476 13.148 6.115 1.00 0.00 C ATOM 85 O LEU A 6 9.620 13.601 6.165 1.00 0.00 O ATOM 86 CB LEU A 6 7.665 15.493 5.894 1.00 0.00 C ATOM 87 CG LEU A 6 7.609 15.830 4.400 1.00 0.00 C ATOM 88 CD1 LEU A 6 8.409 17.087 4.103 1.00 0.00 C ATOM 89 CD2 LEU A 6 8.118 14.666 3.565 1.00 0.00 C ATOM 0 H LEU A 6 7.221 14.611 8.271 1.00 0.00 H new ATOM 0 HA LEU A 6 6.482 13.756 5.565 1.00 0.00 H new ATOM 0 HB2 LEU A 6 7.006 16.176 6.430 1.00 0.00 H new ATOM 0 HB3 LEU A 6 8.677 15.678 6.255 1.00 0.00 H new ATOM 0 HG LEU A 6 6.568 16.013 4.133 1.00 0.00 H new ATOM 0 HD11 LEU A 6 8.356 17.309 3.037 1.00 0.00 H new ATOM 0 HD12 LEU A 6 7.997 17.923 4.668 1.00 0.00 H new ATOM 0 HD13 LEU A 6 9.449 16.933 4.390 1.00 0.00 H new ATOM 0 HD21 LEU A 6 8.069 14.928 2.508 1.00 0.00 H new ATOM 0 HD22 LEU A 6 9.150 14.447 3.837 1.00 0.00 H new ATOM 0 HD23 LEU A 6 7.500 13.788 3.750 1.00 0.00 H new ATOM 101 N TYR A 7 8.218 11.854 5.995 1.00 0.00 N ATOM 102 CA TYR A 7 9.299 10.889 5.913 1.00 0.00 C ATOM 103 C TYR A 7 9.910 10.812 4.530 1.00 0.00 C ATOM 104 O TYR A 7 9.267 10.370 3.581 1.00 0.00 O ATOM 105 CB TYR A 7 8.816 9.495 6.347 1.00 0.00 C ATOM 106 CG TYR A 7 7.909 9.458 7.559 1.00 0.00 C ATOM 107 CD1 TYR A 7 6.589 9.901 7.494 1.00 0.00 C ATOM 108 CD2 TYR A 7 8.365 8.932 8.761 1.00 0.00 C ATOM 109 CE1 TYR A 7 5.762 9.822 8.595 1.00 0.00 C ATOM 110 CE2 TYR A 7 7.538 8.846 9.864 1.00 0.00 C ATOM 111 CZ TYR A 7 6.238 9.291 9.776 1.00 0.00 C ATOM 112 OH TYR A 7 5.410 9.207 10.872 1.00 0.00 O ATOM 0 H TYR A 7 7.281 11.454 5.953 1.00 0.00 H new ATOM 0 HA TYR A 7 10.076 11.236 6.594 1.00 0.00 H new ATOM 0 HB2 TYR A 7 8.290 9.037 5.509 1.00 0.00 H new ATOM 0 HB3 TYR A 7 9.690 8.876 6.552 1.00 0.00 H new ATOM 0 HD1 TYR A 7 6.209 10.311 6.570 1.00 0.00 H new ATOM 0 HD2 TYR A 7 9.385 8.584 8.834 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.743 10.175 8.533 1.00 0.00 H new ATOM 0 HE2 TYR A 7 7.909 8.432 10.790 1.00 0.00 H new ATOM 0 HH TYR A 7 4.744 9.925 10.835 1.00 0.00 H new ATOM 122 N LYS A 8 11.185 11.213 4.450 1.00 0.00 N ATOM 123 CA LYS A 8 11.943 11.174 3.203 1.00 0.00 C ATOM 124 C LYS A 8 12.779 9.916 3.111 1.00 0.00 C ATOM 125 O LYS A 8 13.688 9.711 3.905 1.00 0.00 O ATOM 126 CB LYS A 8 12.847 12.395 3.073 1.00 0.00 C ATOM 127 CG LYS A 8 13.963 12.213 2.050 1.00 0.00 C ATOM 128 CD LYS A 8 13.932 13.298 0.985 1.00 0.00 C ATOM 129 CE LYS A 8 14.720 14.524 1.415 1.00 0.00 C ATOM 130 NZ LYS A 8 14.086 15.786 0.943 1.00 0.00 N ATOM 0 H LYS A 8 11.714 11.571 5.246 1.00 0.00 H new ATOM 0 HA LYS A 8 11.221 11.178 2.386 1.00 0.00 H new ATOM 0 HB2 LYS A 8 12.243 13.257 2.792 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.287 12.618 4.045 1.00 0.00 H new ATOM 0 HG2 LYS A 8 14.928 12.228 2.557 1.00 0.00 H new ATOM 0 HG3 LYS A 8 13.867 11.236 1.577 1.00 0.00 H new ATOM 0 HD2 LYS A 8 14.344 12.908 0.054 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.899 13.581 0.782 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.799 14.542 2.502 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.735 14.459 1.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.654 16.599 1.257 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 14.034 15.781 -0.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.127 15.861 1.338 1.00 0.00 H new ATOM 144 N ASN A 9 12.456 9.104 2.113 1.00 0.00 N ATOM 145 CA ASN A 9 13.138 7.846 1.834 1.00 0.00 C ATOM 146 C ASN A 9 14.304 7.566 2.787 1.00 0.00 C ATOM 147 O ASN A 9 15.240 8.360 2.884 1.00 0.00 O ATOM 148 CB ASN A 9 13.640 7.843 0.388 1.00 0.00 C ATOM 149 CG ASN A 9 12.954 6.795 -0.465 1.00 0.00 C ATOM 150 OD1 ASN A 9 13.263 5.608 -0.377 1.00 0.00 O ATOM 151 ND2 ASN A 9 12.021 7.232 -1.302 1.00 0.00 N ATOM 0 H ASN A 9 11.697 9.305 1.461 1.00 0.00 H new ATOM 0 HA ASN A 9 12.409 7.050 1.988 1.00 0.00 H new ATOM 0 HB2 ASN A 9 13.477 8.827 -0.051 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.715 7.665 0.381 1.00 0.00 H new ATOM 0 HD21 ASN A 9 11.528 6.574 -1.905 1.00 0.00 H new ATOM 0 HD22 ASN A 9 11.797 8.226 -1.342 1.00 0.00 H new ATOM 158 N LYS A 10 14.224 6.418 3.478 1.00 0.00 N ATOM 159 CA LYS A 10 15.251 5.966 4.439 1.00 0.00 C ATOM 160 C LYS A 10 16.600 6.595 4.156 1.00 0.00 C ATOM 161 O LYS A 10 17.325 7.013 5.058 1.00 0.00 O ATOM 162 CB LYS A 10 15.419 4.456 4.375 1.00 0.00 C ATOM 163 CG LYS A 10 14.614 3.834 3.276 1.00 0.00 C ATOM 164 CD LYS A 10 15.021 4.403 1.935 1.00 0.00 C ATOM 165 CE LYS A 10 14.574 3.513 0.789 1.00 0.00 C ATOM 166 NZ LYS A 10 15.270 2.197 0.804 1.00 0.00 N ATOM 0 H LYS A 10 13.441 5.771 3.387 1.00 0.00 H new ATOM 0 HA LYS A 10 14.907 6.272 5.427 1.00 0.00 H new ATOM 0 HB2 LYS A 10 16.472 4.217 4.229 1.00 0.00 H new ATOM 0 HB3 LYS A 10 15.123 4.020 5.329 1.00 0.00 H new ATOM 0 HG2 LYS A 10 14.758 2.754 3.278 1.00 0.00 H new ATOM 0 HG3 LYS A 10 13.553 4.014 3.447 1.00 0.00 H new ATOM 0 HD2 LYS A 10 14.588 5.396 1.815 1.00 0.00 H new ATOM 0 HD3 LYS A 10 16.104 4.521 1.903 1.00 0.00 H new ATOM 0 HE2 LYS A 10 13.497 3.355 0.851 1.00 0.00 H new ATOM 0 HE3 LYS A 10 14.769 4.016 -0.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 15.254 1.785 -0.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 16.256 2.329 1.108 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 14.787 1.556 1.465 1.00 0.00 H new ATOM 180 N ASP A 11 16.919 6.628 2.877 1.00 0.00 N ATOM 181 CA ASP A 11 18.159 7.166 2.399 1.00 0.00 C ATOM 182 C ASP A 11 17.872 8.310 1.425 1.00 0.00 C ATOM 183 O ASP A 11 17.366 8.089 0.325 1.00 0.00 O ATOM 184 CB ASP A 11 18.944 6.031 1.743 1.00 0.00 C ATOM 185 CG ASP A 11 20.443 6.192 1.903 1.00 0.00 C ATOM 186 OD1 ASP A 11 20.988 5.701 2.914 1.00 0.00 O ATOM 187 OD2 ASP A 11 21.073 6.809 1.018 1.00 0.00 O ATOM 0 H ASP A 11 16.311 6.275 2.138 1.00 0.00 H new ATOM 0 HA ASP A 11 18.757 7.577 3.212 1.00 0.00 H new ATOM 0 HB2 ASP A 11 18.636 5.081 2.179 1.00 0.00 H new ATOM 0 HB3 ASP A 11 18.698 5.989 0.682 1.00 0.00 H new ATOM 192 N LYS A 12 18.162 9.539 1.856 1.00 0.00 N ATOM 193 CA LYS A 12 17.901 10.734 1.046 1.00 0.00 C ATOM 194 C LYS A 12 18.370 10.565 -0.401 1.00 0.00 C ATOM 195 O LYS A 12 17.870 11.243 -1.298 1.00 0.00 O ATOM 196 CB LYS A 12 18.562 11.962 1.687 1.00 0.00 C ATOM 197 CG LYS A 12 17.568 12.960 2.277 1.00 0.00 C ATOM 198 CD LYS A 12 18.029 14.393 2.066 1.00 0.00 C ATOM 199 CE LYS A 12 17.468 15.321 3.131 1.00 0.00 C ATOM 200 NZ LYS A 12 17.339 16.720 2.637 1.00 0.00 N ATOM 0 H LYS A 12 18.580 9.735 2.766 1.00 0.00 H new ATOM 0 HA LYS A 12 16.821 10.881 1.017 1.00 0.00 H new ATOM 0 HB2 LYS A 12 19.239 11.629 2.474 1.00 0.00 H new ATOM 0 HB3 LYS A 12 19.170 12.469 0.937 1.00 0.00 H new ATOM 0 HG2 LYS A 12 16.591 12.819 1.815 1.00 0.00 H new ATOM 0 HG3 LYS A 12 17.447 12.768 3.343 1.00 0.00 H new ATOM 0 HD2 LYS A 12 19.118 14.432 2.085 1.00 0.00 H new ATOM 0 HD3 LYS A 12 17.714 14.736 1.080 1.00 0.00 H new ATOM 0 HE2 LYS A 12 16.492 14.958 3.451 1.00 0.00 H new ATOM 0 HE3 LYS A 12 18.117 15.304 4.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 17.286 17.371 3.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 18.166 16.960 2.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 16.475 16.808 2.065 1.00 0.00 H new ATOM 214 N SER A 13 19.307 9.650 -0.636 1.00 0.00 N ATOM 215 CA SER A 13 19.794 9.403 -1.990 1.00 0.00 C ATOM 216 C SER A 13 18.643 8.938 -2.882 1.00 0.00 C ATOM 217 O SER A 13 18.633 9.182 -4.089 1.00 0.00 O ATOM 218 CB SER A 13 20.906 8.353 -1.976 1.00 0.00 C ATOM 219 OG SER A 13 21.759 8.528 -0.857 1.00 0.00 O ATOM 0 H SER A 13 19.740 9.073 0.085 1.00 0.00 H new ATOM 0 HA SER A 13 20.201 10.332 -2.389 1.00 0.00 H new ATOM 0 HB2 SER A 13 20.468 7.355 -1.951 1.00 0.00 H new ATOM 0 HB3 SER A 13 21.488 8.423 -2.895 1.00 0.00 H new ATOM 0 HG SER A 13 21.373 8.077 -0.078 1.00 0.00 H new ATOM 225 N SER A 14 17.669 8.278 -2.262 1.00 0.00 N ATOM 226 CA SER A 14 16.486 7.776 -2.959 1.00 0.00 C ATOM 227 C SER A 14 15.764 8.883 -3.685 1.00 0.00 C ATOM 228 O SER A 14 15.160 8.663 -4.731 1.00 0.00 O ATOM 229 CB SER A 14 15.509 7.182 -1.951 1.00 0.00 C ATOM 230 OG SER A 14 14.848 6.047 -2.482 1.00 0.00 O ATOM 0 H SER A 14 17.676 8.075 -1.262 1.00 0.00 H new ATOM 0 HA SER A 14 16.824 7.027 -3.674 1.00 0.00 H new ATOM 0 HB2 SER A 14 16.044 6.902 -1.044 1.00 0.00 H new ATOM 0 HB3 SER A 14 14.773 7.935 -1.668 1.00 0.00 H new ATOM 0 HG SER A 14 14.431 5.541 -1.754 1.00 0.00 H new ATOM 236 N ALA A 15 15.781 10.059 -3.091 1.00 0.00 N ATOM 237 CA ALA A 15 15.068 11.188 -3.643 1.00 0.00 C ATOM 238 C ALA A 15 15.366 11.400 -5.120 1.00 0.00 C ATOM 239 O ALA A 15 14.552 11.988 -5.834 1.00 0.00 O ATOM 240 CB ALA A 15 15.371 12.443 -2.839 1.00 0.00 C ATOM 0 H ALA A 15 16.282 10.256 -2.225 1.00 0.00 H new ATOM 0 HA ALA A 15 14.003 10.968 -3.571 1.00 0.00 H new ATOM 0 HB1 ALA A 15 14.828 13.287 -3.264 1.00 0.00 H new ATOM 0 HB2 ALA A 15 15.061 12.296 -1.804 1.00 0.00 H new ATOM 0 HB3 ALA A 15 16.441 12.646 -2.871 1.00 0.00 H new ATOM 246 N LYS A 16 16.501 10.896 -5.600 1.00 0.00 N ATOM 247 CA LYS A 16 16.820 11.027 -7.015 1.00 0.00 C ATOM 248 C LYS A 16 15.626 10.522 -7.816 1.00 0.00 C ATOM 249 O LYS A 16 15.161 11.171 -8.753 1.00 0.00 O ATOM 250 CB LYS A 16 18.076 10.225 -7.366 1.00 0.00 C ATOM 251 CG LYS A 16 19.358 10.836 -6.824 1.00 0.00 C ATOM 252 CD LYS A 16 20.577 10.026 -7.233 1.00 0.00 C ATOM 253 CE LYS A 16 21.822 10.476 -6.486 1.00 0.00 C ATOM 254 NZ LYS A 16 22.603 11.479 -7.262 1.00 0.00 N ATOM 0 H LYS A 16 17.199 10.404 -5.043 1.00 0.00 H new ATOM 0 HA LYS A 16 17.021 12.071 -7.254 1.00 0.00 H new ATOM 0 HB2 LYS A 16 17.972 9.213 -6.975 1.00 0.00 H new ATOM 0 HB3 LYS A 16 18.153 10.142 -8.450 1.00 0.00 H new ATOM 0 HG2 LYS A 16 19.459 11.858 -7.191 1.00 0.00 H new ATOM 0 HG3 LYS A 16 19.305 10.891 -5.737 1.00 0.00 H new ATOM 0 HD2 LYS A 16 20.396 8.969 -7.036 1.00 0.00 H new ATOM 0 HD3 LYS A 16 20.739 10.127 -8.306 1.00 0.00 H new ATOM 0 HE2 LYS A 16 21.534 10.904 -5.526 1.00 0.00 H new ATOM 0 HE3 LYS A 16 22.451 9.611 -6.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 23.444 11.760 -6.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 22.900 11.063 -8.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 22.012 12.315 -7.442 1.00 0.00 H new ATOM 268 N THR A 17 15.112 9.373 -7.387 1.00 0.00 N ATOM 269 CA THR A 17 13.937 8.770 -7.994 1.00 0.00 C ATOM 270 C THR A 17 12.723 8.976 -7.088 1.00 0.00 C ATOM 271 O THR A 17 11.638 9.329 -7.550 1.00 0.00 O ATOM 272 CB THR A 17 14.161 7.277 -8.239 1.00 0.00 C ATOM 273 OG1 THR A 17 15.251 7.071 -9.120 1.00 0.00 O ATOM 274 CG2 THR A 17 12.954 6.580 -8.831 1.00 0.00 C ATOM 0 H THR A 17 15.500 8.837 -6.610 1.00 0.00 H new ATOM 0 HA THR A 17 13.755 9.252 -8.955 1.00 0.00 H new ATOM 0 HB THR A 17 14.362 6.850 -7.256 1.00 0.00 H new ATOM 0 HG1 THR A 17 15.379 6.110 -9.263 1.00 0.00 H new ATOM 0 HG21 THR A 17 13.180 5.524 -8.980 1.00 0.00 H new ATOM 0 HG22 THR A 17 12.108 6.678 -8.151 1.00 0.00 H new ATOM 0 HG23 THR A 17 12.704 7.036 -9.789 1.00 0.00 H new ATOM 282 N TYR A 18 12.923 8.737 -5.789 1.00 0.00 N ATOM 283 CA TYR A 18 11.857 8.877 -4.796 1.00 0.00 C ATOM 284 C TYR A 18 12.368 9.535 -3.526 1.00 0.00 C ATOM 285 O TYR A 18 13.251 8.993 -2.866 1.00 0.00 O ATOM 286 CB TYR A 18 11.341 7.515 -4.407 1.00 0.00 C ATOM 287 CG TYR A 18 11.075 6.593 -5.575 1.00 0.00 C ATOM 288 CD1 TYR A 18 10.082 6.883 -6.502 1.00 0.00 C ATOM 289 CD2 TYR A 18 11.817 5.432 -5.751 1.00 0.00 C ATOM 290 CE1 TYR A 18 9.836 6.042 -7.571 1.00 0.00 C ATOM 291 CE2 TYR A 18 11.578 4.586 -6.817 1.00 0.00 C ATOM 292 CZ TYR A 18 10.586 4.895 -7.724 1.00 0.00 C ATOM 293 OH TYR A 18 10.344 4.056 -8.786 1.00 0.00 O ATOM 0 H TYR A 18 13.819 8.444 -5.400 1.00 0.00 H new ATOM 0 HA TYR A 18 11.075 9.489 -5.246 1.00 0.00 H new ATOM 0 HB2 TYR A 18 12.064 7.042 -3.743 1.00 0.00 H new ATOM 0 HB3 TYR A 18 10.419 7.637 -3.839 1.00 0.00 H new ATOM 0 HD1 TYR A 18 9.492 7.780 -6.386 1.00 0.00 H new ATOM 0 HD2 TYR A 18 12.594 5.186 -5.042 1.00 0.00 H new ATOM 0 HE1 TYR A 18 9.060 6.282 -8.283 1.00 0.00 H new ATOM 0 HE2 TYR A 18 12.165 3.688 -6.939 1.00 0.00 H new ATOM 0 HH TYR A 18 10.960 3.295 -8.748 1.00 0.00 H new ATOM 303 N PRO A 19 11.852 10.712 -3.155 1.00 0.00 N ATOM 304 CA PRO A 19 12.311 11.406 -1.967 1.00 0.00 C ATOM 305 C PRO A 19 11.617 10.992 -0.673 1.00 0.00 C ATOM 306 O PRO A 19 12.276 10.866 0.354 1.00 0.00 O ATOM 307 CB PRO A 19 12.015 12.878 -2.265 1.00 0.00 C ATOM 308 CG PRO A 19 11.230 12.900 -3.542 1.00 0.00 C ATOM 309 CD PRO A 19 10.830 11.482 -3.855 1.00 0.00 C ATOM 0 HA PRO A 19 13.361 11.176 -1.787 1.00 0.00 H new ATOM 0 HB2 PRO A 19 11.448 13.333 -1.453 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.939 13.447 -2.367 1.00 0.00 H new ATOM 0 HG2 PRO A 19 10.348 13.533 -3.439 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.828 13.317 -4.352 1.00 0.00 H new ATOM 0 HD2 PRO A 19 9.828 11.252 -3.493 1.00 0.00 H new ATOM 0 HD3 PRO A 19 10.835 11.285 -4.927 1.00 0.00 H new ATOM 317 N TYR A 20 10.296 10.820 -0.686 1.00 0.00 N ATOM 318 CA TYR A 20 9.604 10.471 0.558 1.00 0.00 C ATOM 319 C TYR A 20 8.266 9.796 0.383 1.00 0.00 C ATOM 320 O TYR A 20 7.756 9.590 -0.718 1.00 0.00 O ATOM 321 CB TYR A 20 9.351 11.704 1.433 1.00 0.00 C ATOM 322 CG TYR A 20 9.528 13.016 0.755 1.00 0.00 C ATOM 323 CD1 TYR A 20 9.136 13.203 -0.560 1.00 0.00 C ATOM 324 CD2 TYR A 20 10.087 14.069 1.449 1.00 0.00 C ATOM 325 CE1 TYR A 20 9.297 14.411 -1.182 1.00 0.00 C ATOM 326 CE2 TYR A 20 10.254 15.296 0.844 1.00 0.00 C ATOM 327 CZ TYR A 20 9.861 15.466 -0.473 1.00 0.00 C ATOM 328 OH TYR A 20 10.024 16.692 -1.065 1.00 0.00 O ATOM 0 H TYR A 20 9.700 10.912 -1.509 1.00 0.00 H new ATOM 0 HA TYR A 20 10.291 9.766 1.025 1.00 0.00 H new ATOM 0 HB2 TYR A 20 8.334 11.650 1.822 1.00 0.00 H new ATOM 0 HB3 TYR A 20 10.023 11.664 2.290 1.00 0.00 H new ATOM 0 HD1 TYR A 20 8.695 12.381 -1.104 1.00 0.00 H new ATOM 0 HD2 TYR A 20 10.396 13.931 2.475 1.00 0.00 H new ATOM 0 HE1 TYR A 20 8.990 14.543 -2.209 1.00 0.00 H new ATOM 0 HE2 TYR A 20 10.688 16.119 1.393 1.00 0.00 H new ATOM 0 HH TYR A 20 9.518 16.720 -1.904 1.00 0.00 H new ATOM 338 N PHE A 21 7.707 9.509 1.551 1.00 0.00 N ATOM 339 CA PHE A 21 6.411 8.909 1.701 1.00 0.00 C ATOM 340 C PHE A 21 5.763 9.504 2.938 1.00 0.00 C ATOM 341 O PHE A 21 6.421 10.195 3.717 1.00 0.00 O ATOM 342 CB PHE A 21 6.512 7.395 1.845 1.00 0.00 C ATOM 343 CG PHE A 21 7.834 6.803 1.396 1.00 0.00 C ATOM 344 CD1 PHE A 21 8.208 6.859 0.063 1.00 0.00 C ATOM 345 CD2 PHE A 21 8.694 6.177 2.296 1.00 0.00 C ATOM 346 CE1 PHE A 21 9.399 6.309 -0.366 1.00 0.00 C ATOM 347 CE2 PHE A 21 9.888 5.628 1.869 1.00 0.00 C ATOM 348 CZ PHE A 21 10.239 5.693 0.538 1.00 0.00 C ATOM 0 H PHE A 21 8.167 9.698 2.442 1.00 0.00 H new ATOM 0 HA PHE A 21 5.813 9.112 0.813 1.00 0.00 H new ATOM 0 HB2 PHE A 21 6.347 7.131 2.890 1.00 0.00 H new ATOM 0 HB3 PHE A 21 5.709 6.934 1.270 1.00 0.00 H new ATOM 0 HD1 PHE A 21 7.557 7.341 -0.652 1.00 0.00 H new ATOM 0 HD2 PHE A 21 8.424 6.120 3.340 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.673 6.361 -1.409 1.00 0.00 H new ATOM 0 HE2 PHE A 21 10.546 5.148 2.578 1.00 0.00 H new ATOM 0 HZ PHE A 21 11.171 5.262 0.203 1.00 0.00 H new ATOM 358 N VAL A 22 4.483 9.260 3.113 1.00 0.00 N ATOM 359 CA VAL A 22 3.771 9.802 4.255 1.00 0.00 C ATOM 360 C VAL A 22 3.177 8.711 5.126 1.00 0.00 C ATOM 361 O VAL A 22 2.302 7.971 4.686 1.00 0.00 O ATOM 362 CB VAL A 22 2.626 10.707 3.807 1.00 0.00 C ATOM 363 CG1 VAL A 22 2.121 11.538 4.978 1.00 0.00 C ATOM 364 CG2 VAL A 22 3.041 11.606 2.652 1.00 0.00 C ATOM 0 H VAL A 22 3.914 8.693 2.484 1.00 0.00 H new ATOM 0 HA VAL A 22 4.507 10.367 4.827 1.00 0.00 H new ATOM 0 HB VAL A 22 1.816 10.070 3.451 1.00 0.00 H new ATOM 0 HG11 VAL A 22 1.305 12.179 4.644 1.00 0.00 H new ATOM 0 HG12 VAL A 22 1.763 10.876 5.767 1.00 0.00 H new ATOM 0 HG13 VAL A 22 2.933 12.155 5.363 1.00 0.00 H new ATOM 0 HG21 VAL A 22 2.200 12.235 2.361 1.00 0.00 H new ATOM 0 HG22 VAL A 22 3.875 12.235 2.962 1.00 0.00 H new ATOM 0 HG23 VAL A 22 3.345 10.992 1.804 1.00 0.00 H new ATOM 374 N ASP A 23 3.628 8.624 6.372 1.00 0.00 N ATOM 375 CA ASP A 23 3.083 7.615 7.282 1.00 0.00 C ATOM 376 C ASP A 23 1.569 7.802 7.408 1.00 0.00 C ATOM 377 O ASP A 23 1.106 8.771 8.009 1.00 0.00 O ATOM 378 CB ASP A 23 3.747 7.700 8.659 1.00 0.00 C ATOM 379 CG ASP A 23 3.292 6.600 9.599 1.00 0.00 C ATOM 380 OD1 ASP A 23 2.122 6.174 9.497 1.00 0.00 O ATOM 381 OD2 ASP A 23 4.108 6.163 10.438 1.00 0.00 O ATOM 0 H ASP A 23 4.351 9.222 6.771 1.00 0.00 H new ATOM 0 HA ASP A 23 3.292 6.627 6.872 1.00 0.00 H new ATOM 0 HB2 ASP A 23 4.829 7.645 8.540 1.00 0.00 H new ATOM 0 HB3 ASP A 23 3.524 8.669 9.106 1.00 0.00 H new ATOM 386 N VAL A 24 0.800 6.887 6.811 1.00 0.00 N ATOM 387 CA VAL A 24 -0.658 6.986 6.838 1.00 0.00 C ATOM 388 C VAL A 24 -1.320 5.634 6.639 1.00 0.00 C ATOM 389 O VAL A 24 -1.451 5.156 5.513 1.00 0.00 O ATOM 390 CB VAL A 24 -1.155 7.968 5.754 1.00 0.00 C ATOM 391 CG1 VAL A 24 -0.617 7.581 4.381 1.00 0.00 C ATOM 392 CG2 VAL A 24 -2.676 8.052 5.741 1.00 0.00 C ATOM 0 H VAL A 24 1.161 6.077 6.308 1.00 0.00 H new ATOM 0 HA VAL A 24 -0.936 7.359 7.824 1.00 0.00 H new ATOM 0 HB VAL A 24 -0.771 8.958 6.000 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -0.981 8.288 3.635 1.00 0.00 H new ATOM 0 HG12 VAL A 24 0.473 7.601 4.398 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -0.957 6.577 4.127 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -2.995 8.751 4.968 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -3.093 7.066 5.534 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -3.030 8.399 6.712 1.00 0.00 H new ATOM 402 N GLN A 25 -1.755 5.022 7.736 1.00 0.00 N ATOM 403 CA GLN A 25 -2.412 3.730 7.648 1.00 0.00 C ATOM 404 C GLN A 25 -2.880 3.217 9.004 1.00 0.00 C ATOM 405 O GLN A 25 -3.597 3.910 9.725 1.00 0.00 O ATOM 406 CB GLN A 25 -1.471 2.719 7.020 1.00 0.00 C ATOM 407 CG GLN A 25 -2.191 1.534 6.384 1.00 0.00 C ATOM 408 CD GLN A 25 -1.499 0.212 6.670 1.00 0.00 C ATOM 409 OE1 GLN A 25 -0.955 0.007 7.755 1.00 0.00 O ATOM 410 NE2 GLN A 25 -1.515 -0.691 5.696 1.00 0.00 N ATOM 0 H GLN A 25 -1.665 5.396 8.681 1.00 0.00 H new ATOM 0 HA GLN A 25 -3.298 3.861 7.027 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -0.868 3.218 6.261 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -0.784 2.351 7.782 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -3.215 1.493 6.756 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -2.249 1.684 5.306 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -1.978 -0.479 4.812 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -1.065 -1.596 5.832 1.00 0.00 H new ATOM 419 N SER A 26 -2.470 1.986 9.333 1.00 0.00 N ATOM 420 CA SER A 26 -2.849 1.353 10.604 1.00 0.00 C ATOM 421 C SER A 26 -2.848 2.348 11.752 1.00 0.00 C ATOM 422 O SER A 26 -1.826 2.543 12.390 1.00 0.00 O ATOM 423 CB SER A 26 -1.890 0.231 10.960 1.00 0.00 C ATOM 424 OG SER A 26 -2.240 -0.974 10.302 1.00 0.00 O ATOM 0 H SER A 26 -1.876 1.408 8.738 1.00 0.00 H new ATOM 0 HA SER A 26 -3.856 0.961 10.462 1.00 0.00 H new ATOM 0 HB2 SER A 26 -0.875 0.516 10.685 1.00 0.00 H new ATOM 0 HB3 SER A 26 -1.895 0.074 12.039 1.00 0.00 H new ATOM 0 HG SER A 26 -1.926 -0.943 9.374 1.00 0.00 H new ATOM 430 N ASP A 27 -3.985 2.967 12.038 1.00 0.00 N ATOM 431 CA ASP A 27 -4.039 3.917 13.142 1.00 0.00 C ATOM 432 C ASP A 27 -3.380 3.303 14.372 1.00 0.00 C ATOM 433 O ASP A 27 -2.704 3.988 15.140 1.00 0.00 O ATOM 434 CB ASP A 27 -5.485 4.313 13.449 1.00 0.00 C ATOM 435 CG ASP A 27 -5.572 5.534 14.344 1.00 0.00 C ATOM 436 OD1 ASP A 27 -4.638 5.751 15.145 1.00 0.00 O ATOM 437 OD2 ASP A 27 -6.574 6.273 14.244 1.00 0.00 O ATOM 0 H ASP A 27 -4.863 2.834 11.536 1.00 0.00 H new ATOM 0 HA ASP A 27 -3.499 4.820 12.858 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -6.010 4.512 12.515 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -5.994 3.477 13.929 1.00 0.00 H new ATOM 442 N LEU A 28 -3.559 1.994 14.528 1.00 0.00 N ATOM 443 CA LEU A 28 -2.959 1.266 15.636 1.00 0.00 C ATOM 444 C LEU A 28 -1.546 0.831 15.280 1.00 0.00 C ATOM 445 O LEU A 28 -0.582 1.155 15.973 1.00 0.00 O ATOM 446 CB LEU A 28 -3.811 0.051 16.011 1.00 0.00 C ATOM 447 CG LEU A 28 -5.234 0.373 16.469 1.00 0.00 C ATOM 448 CD1 LEU A 28 -5.213 1.388 17.602 1.00 0.00 C ATOM 449 CD2 LEU A 28 -6.064 0.889 15.304 1.00 0.00 C ATOM 0 H LEU A 28 -4.116 1.417 13.898 1.00 0.00 H new ATOM 0 HA LEU A 28 -2.913 1.932 16.498 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.865 -0.615 15.150 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.305 -0.497 16.806 1.00 0.00 H new ATOM 0 HG LEU A 28 -5.693 -0.544 16.839 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.234 1.605 17.915 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.654 0.981 18.445 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.736 2.306 17.259 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.074 1.113 15.648 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -5.607 1.795 14.905 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -6.107 0.130 14.523 1.00 0.00 H new ATOM 461 N LEU A 29 -1.445 0.104 14.182 1.00 0.00 N ATOM 462 CA LEU A 29 -0.171 -0.390 13.681 1.00 0.00 C ATOM 463 C LEU A 29 0.449 0.614 12.715 1.00 0.00 C ATOM 464 O LEU A 29 1.067 0.232 11.722 1.00 0.00 O ATOM 465 CB LEU A 29 -0.401 -1.710 12.954 1.00 0.00 C ATOM 466 CG LEU A 29 -1.020 -2.809 13.810 1.00 0.00 C ATOM 467 CD1 LEU A 29 -1.657 -3.876 12.934 1.00 0.00 C ATOM 468 CD2 LEU A 29 0.025 -3.421 14.731 1.00 0.00 C ATOM 0 H LEU A 29 -2.246 -0.162 13.609 1.00 0.00 H new ATOM 0 HA LEU A 29 0.508 -0.535 14.521 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.048 -1.529 12.096 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.553 -2.066 12.564 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.801 -2.365 14.427 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.093 -4.651 13.564 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -2.437 -3.425 12.321 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -0.898 -4.318 12.288 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -0.435 -4.204 15.334 1.00 0.00 H new ATOM 0 HD22 LEU A 29 0.830 -3.849 14.134 1.00 0.00 H new ATOM 0 HD23 LEU A 29 0.430 -2.649 15.386 1.00 0.00 H new ATOM 480 N ASP A 30 0.242 1.897 12.984 1.00 0.00 N ATOM 481 CA ASP A 30 0.743 2.942 12.103 1.00 0.00 C ATOM 482 C ASP A 30 2.266 2.932 12.023 1.00 0.00 C ATOM 483 O ASP A 30 2.821 2.727 10.956 1.00 0.00 O ATOM 484 CB ASP A 30 0.229 4.313 12.566 1.00 0.00 C ATOM 485 CG ASP A 30 0.419 4.538 14.055 1.00 0.00 C ATOM 486 OD1 ASP A 30 0.974 3.643 14.728 1.00 0.00 O ATOM 487 OD2 ASP A 30 0.011 5.610 14.549 1.00 0.00 O ATOM 0 H ASP A 30 -0.266 2.237 13.800 1.00 0.00 H new ATOM 0 HA ASP A 30 0.367 2.744 11.099 1.00 0.00 H new ATOM 0 HB2 ASP A 30 0.749 5.096 12.015 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -0.830 4.401 12.322 1.00 0.00 H new ATOM 492 N ASN A 31 2.946 3.120 13.144 1.00 0.00 N ATOM 493 CA ASN A 31 4.408 3.095 13.143 1.00 0.00 C ATOM 494 C ASN A 31 4.940 2.052 14.104 1.00 0.00 C ATOM 495 O ASN A 31 6.149 1.948 14.316 1.00 0.00 O ATOM 496 CB ASN A 31 4.978 4.468 13.491 1.00 0.00 C ATOM 497 CG ASN A 31 6.388 4.664 12.971 1.00 0.00 C ATOM 498 OD1 ASN A 31 7.121 3.699 12.752 1.00 0.00 O ATOM 499 ND2 ASN A 31 6.776 5.918 12.771 1.00 0.00 N ATOM 0 H ASN A 31 2.520 3.289 14.055 1.00 0.00 H new ATOM 0 HA ASN A 31 4.729 2.829 12.136 1.00 0.00 H new ATOM 0 HB2 ASN A 31 4.331 5.241 13.076 1.00 0.00 H new ATOM 0 HB3 ASN A 31 4.973 4.595 14.574 1.00 0.00 H new ATOM 0 HD21 ASN A 31 7.715 6.112 12.422 1.00 0.00 H new ATOM 0 HD22 ASN A 31 6.135 6.687 12.966 1.00 0.00 H new ATOM 506 N LEU A 32 4.037 1.273 14.673 1.00 0.00 N ATOM 507 CA LEU A 32 4.423 0.222 15.603 1.00 0.00 C ATOM 508 C LEU A 32 5.538 -0.595 14.999 1.00 0.00 C ATOM 509 O LEU A 32 6.654 -0.650 15.516 1.00 0.00 O ATOM 510 CB LEU A 32 3.253 -0.711 15.883 1.00 0.00 C ATOM 511 CG LEU A 32 2.778 -0.748 17.337 1.00 0.00 C ATOM 512 CD1 LEU A 32 1.341 -1.239 17.417 1.00 0.00 C ATOM 513 CD2 LEU A 32 3.693 -1.630 18.173 1.00 0.00 C ATOM 0 H LEU A 32 3.033 1.347 14.509 1.00 0.00 H new ATOM 0 HA LEU A 32 4.743 0.692 16.533 1.00 0.00 H new ATOM 0 HB2 LEU A 32 2.415 -0.415 15.252 1.00 0.00 H new ATOM 0 HB3 LEU A 32 3.536 -1.721 15.585 1.00 0.00 H new ATOM 0 HG LEU A 32 2.816 0.265 17.738 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.021 -1.259 18.459 1.00 0.00 H new ATOM 0 HD12 LEU A 32 0.695 -0.568 16.851 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.276 -2.243 16.998 1.00 0.00 H new ATOM 0 HD21 LEU A 32 3.341 -1.645 19.204 1.00 0.00 H new ATOM 0 HD22 LEU A 32 3.687 -2.644 17.772 1.00 0.00 H new ATOM 0 HD23 LEU A 32 4.708 -1.234 18.142 1.00 0.00 H new ATOM 525 N ASN A 33 5.208 -1.231 13.888 1.00 0.00 N ATOM 526 CA ASN A 33 6.155 -2.056 13.186 1.00 0.00 C ATOM 527 C ASN A 33 6.292 -1.634 11.723 1.00 0.00 C ATOM 528 O ASN A 33 7.332 -1.865 11.110 1.00 0.00 O ATOM 529 CB ASN A 33 5.735 -3.525 13.264 1.00 0.00 C ATOM 530 CG ASN A 33 6.922 -4.459 13.405 1.00 0.00 C ATOM 531 OD1 ASN A 33 7.490 -4.600 14.488 1.00 0.00 O ATOM 532 ND2 ASN A 33 7.301 -5.103 12.308 1.00 0.00 N ATOM 0 H ASN A 33 4.285 -1.186 13.457 1.00 0.00 H new ATOM 0 HA ASN A 33 7.125 -1.929 13.667 1.00 0.00 H new ATOM 0 HB2 ASN A 33 5.064 -3.664 14.112 1.00 0.00 H new ATOM 0 HB3 ASN A 33 5.174 -3.788 12.367 1.00 0.00 H new ATOM 0 HD21 ASN A 33 8.093 -5.745 12.342 1.00 0.00 H new ATOM 0 HD22 ASN A 33 6.801 -4.955 11.431 1.00 0.00 H new ATOM 539 N THR A 34 5.242 -1.005 11.171 1.00 0.00 N ATOM 540 CA THR A 34 5.251 -0.553 9.771 1.00 0.00 C ATOM 541 C THR A 34 4.039 0.326 9.490 1.00 0.00 C ATOM 542 O THR A 34 3.124 0.409 10.309 1.00 0.00 O ATOM 543 CB THR A 34 5.219 -1.730 8.781 1.00 0.00 C ATOM 544 OG1 THR A 34 3.983 -2.416 8.863 1.00 0.00 O ATOM 545 CG2 THR A 34 6.318 -2.752 8.976 1.00 0.00 C ATOM 0 H THR A 34 4.378 -0.798 11.672 1.00 0.00 H new ATOM 0 HA THR A 34 6.177 0.005 9.632 1.00 0.00 H new ATOM 0 HB THR A 34 5.367 -1.266 7.806 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.979 -3.160 8.226 1.00 0.00 H new ATOM 0 HG21 THR A 34 6.215 -3.544 8.234 1.00 0.00 H new ATOM 0 HG22 THR A 34 7.288 -2.270 8.859 1.00 0.00 H new ATOM 0 HG23 THR A 34 6.244 -3.180 9.976 1.00 0.00 H new ATOM 553 N ARG A 35 4.017 0.956 8.318 1.00 0.00 N ATOM 554 CA ARG A 35 2.888 1.796 7.936 1.00 0.00 C ATOM 555 C ARG A 35 2.715 1.864 6.428 1.00 0.00 C ATOM 556 O ARG A 35 3.653 1.622 5.672 1.00 0.00 O ATOM 557 CB ARG A 35 3.053 3.210 8.516 1.00 0.00 C ATOM 558 CG ARG A 35 3.462 4.284 7.512 1.00 0.00 C ATOM 559 CD ARG A 35 4.928 4.663 7.659 1.00 0.00 C ATOM 560 NE ARG A 35 5.784 3.491 7.820 1.00 0.00 N ATOM 561 CZ ARG A 35 6.205 3.030 8.996 1.00 0.00 C ATOM 562 NH1 ARG A 35 5.848 3.628 10.124 1.00 0.00 N ATOM 563 NH2 ARG A 35 6.985 1.964 9.046 1.00 0.00 N ATOM 0 H ARG A 35 4.761 0.901 7.623 1.00 0.00 H new ATOM 0 HA ARG A 35 1.988 1.341 8.350 1.00 0.00 H new ATOM 0 HB2 ARG A 35 2.111 3.507 8.978 1.00 0.00 H new ATOM 0 HB3 ARG A 35 3.800 3.174 9.309 1.00 0.00 H new ATOM 0 HG2 ARG A 35 3.279 3.924 6.500 1.00 0.00 H new ATOM 0 HG3 ARG A 35 2.841 5.169 7.653 1.00 0.00 H new ATOM 0 HD2 ARG A 35 5.246 5.226 6.782 1.00 0.00 H new ATOM 0 HD3 ARG A 35 5.048 5.320 8.520 1.00 0.00 H new ATOM 0 HE ARG A 35 6.078 2.994 6.979 1.00 0.00 H new ATOM 0 HH11 ARG A 35 5.245 4.450 10.097 1.00 0.00 H new ATOM 0 HH12 ARG A 35 6.177 3.266 11.019 1.00 0.00 H new ATOM 0 HH21 ARG A 35 7.264 1.495 8.184 1.00 0.00 H new ATOM 0 HH22 ARG A 35 7.308 1.610 9.946 1.00 0.00 H new ATOM 577 N LEU A 36 1.520 2.264 6.007 1.00 0.00 N ATOM 578 CA LEU A 36 1.237 2.443 4.591 1.00 0.00 C ATOM 579 C LEU A 36 1.463 3.905 4.259 1.00 0.00 C ATOM 580 O LEU A 36 0.889 4.783 4.902 1.00 0.00 O ATOM 581 CB LEU A 36 -0.197 2.038 4.243 1.00 0.00 C ATOM 582 CG LEU A 36 -0.473 1.893 2.747 1.00 0.00 C ATOM 583 CD1 LEU A 36 0.552 0.977 2.096 1.00 0.00 C ATOM 584 CD2 LEU A 36 -1.883 1.375 2.511 1.00 0.00 C ATOM 0 H LEU A 36 0.735 2.469 6.625 1.00 0.00 H new ATOM 0 HA LEU A 36 1.897 1.802 4.006 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.422 1.091 4.734 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.880 2.781 4.655 1.00 0.00 H new ATOM 0 HG LEU A 36 -0.388 2.878 2.287 1.00 0.00 H new ATOM 0 HD11 LEU A 36 0.336 0.888 1.031 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.550 1.394 2.230 1.00 0.00 H new ATOM 0 HD13 LEU A 36 0.505 -0.009 2.559 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -2.061 1.278 1.440 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -1.997 0.401 2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -2.603 2.074 2.937 1.00 0.00 H new ATOM 596 N VAL A 37 2.328 4.181 3.295 1.00 0.00 N ATOM 597 CA VAL A 37 2.630 5.562 2.958 1.00 0.00 C ATOM 598 C VAL A 37 2.237 5.946 1.551 1.00 0.00 C ATOM 599 O VAL A 37 2.094 5.107 0.662 1.00 0.00 O ATOM 600 CB VAL A 37 4.134 5.880 3.104 1.00 0.00 C ATOM 601 CG1 VAL A 37 4.503 6.092 4.563 1.00 0.00 C ATOM 602 CG2 VAL A 37 4.993 4.782 2.486 1.00 0.00 C ATOM 0 H VAL A 37 2.824 3.482 2.742 1.00 0.00 H new ATOM 0 HA VAL A 37 2.036 6.137 3.668 1.00 0.00 H new ATOM 0 HB VAL A 37 4.332 6.805 2.563 1.00 0.00 H new ATOM 0 HG11 VAL A 37 5.567 6.315 4.641 1.00 0.00 H new ATOM 0 HG12 VAL A 37 3.928 6.925 4.966 1.00 0.00 H new ATOM 0 HG13 VAL A 37 4.279 5.188 5.130 1.00 0.00 H new ATOM 0 HG21 VAL A 37 6.047 5.034 2.604 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.788 3.835 2.986 1.00 0.00 H new ATOM 0 HG23 VAL A 37 4.759 4.690 1.425 1.00 0.00 H new ATOM 612 N ILE A 38 2.151 7.252 1.360 1.00 0.00 N ATOM 613 CA ILE A 38 1.874 7.827 0.068 1.00 0.00 C ATOM 614 C ILE A 38 3.181 8.451 -0.381 1.00 0.00 C ATOM 615 O ILE A 38 3.495 9.589 -0.033 1.00 0.00 O ATOM 616 CB ILE A 38 0.769 8.900 0.137 1.00 0.00 C ATOM 617 CG1 ILE A 38 -0.253 8.543 1.222 1.00 0.00 C ATOM 618 CG2 ILE A 38 0.088 9.038 -1.213 1.00 0.00 C ATOM 619 CD1 ILE A 38 -1.471 9.439 1.234 1.00 0.00 C ATOM 0 H ILE A 38 2.273 7.940 2.103 1.00 0.00 H new ATOM 0 HA ILE A 38 1.512 7.067 -0.624 1.00 0.00 H new ATOM 0 HB ILE A 38 1.224 9.856 0.395 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -0.574 7.511 1.080 1.00 0.00 H new ATOM 0 HG13 ILE A 38 0.233 8.594 2.196 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.690 9.799 -1.152 1.00 0.00 H new ATOM 0 HG22 ILE A 38 0.823 9.330 -1.963 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -0.358 8.084 -1.495 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -2.147 9.123 2.029 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -1.163 10.470 1.408 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -1.983 9.370 0.274 1.00 0.00 H new ATOM 631 N PRO A 39 4.000 7.668 -1.095 1.00 0.00 N ATOM 632 CA PRO A 39 5.330 8.094 -1.522 1.00 0.00 C ATOM 633 C PRO A 39 5.352 9.402 -2.313 1.00 0.00 C ATOM 634 O PRO A 39 5.463 9.388 -3.535 1.00 0.00 O ATOM 635 CB PRO A 39 5.831 6.931 -2.393 1.00 0.00 C ATOM 636 CG PRO A 39 4.652 6.041 -2.623 1.00 0.00 C ATOM 637 CD PRO A 39 3.727 6.271 -1.469 1.00 0.00 C ATOM 0 HA PRO A 39 5.955 8.305 -0.654 1.00 0.00 H new ATOM 0 HB2 PRO A 39 6.232 7.298 -3.338 1.00 0.00 H new ATOM 0 HB3 PRO A 39 6.635 6.390 -1.894 1.00 0.00 H new ATOM 0 HG2 PRO A 39 4.163 6.278 -3.568 1.00 0.00 H new ATOM 0 HG3 PRO A 39 4.957 4.996 -2.676 1.00 0.00 H new ATOM 0 HD2 PRO A 39 2.685 6.126 -1.753 1.00 0.00 H new ATOM 0 HD3 PRO A 39 3.931 5.586 -0.646 1.00 0.00 H new ATOM 645 N LEU A 40 5.277 10.536 -1.615 1.00 0.00 N ATOM 646 CA LEU A 40 5.315 11.836 -2.281 1.00 0.00 C ATOM 647 C LEU A 40 6.614 12.013 -3.027 1.00 0.00 C ATOM 648 O LEU A 40 7.602 11.328 -2.760 1.00 0.00 O ATOM 649 CB LEU A 40 5.114 12.997 -1.296 1.00 0.00 C ATOM 650 CG LEU A 40 5.091 12.635 0.183 1.00 0.00 C ATOM 651 CD1 LEU A 40 6.460 12.176 0.630 1.00 0.00 C ATOM 652 CD2 LEU A 40 4.633 13.824 1.016 1.00 0.00 C ATOM 0 H LEU A 40 5.191 10.580 -0.600 1.00 0.00 H new ATOM 0 HA LEU A 40 4.487 11.855 -2.990 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.910 13.723 -1.457 1.00 0.00 H new ATOM 0 HB3 LEU A 40 4.175 13.494 -1.541 1.00 0.00 H new ATOM 0 HG LEU A 40 4.383 11.819 0.329 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.430 11.920 1.689 1.00 0.00 H new ATOM 0 HD12 LEU A 40 6.756 11.300 0.053 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.182 12.977 0.470 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.623 13.547 2.070 1.00 0.00 H new ATOM 0 HD22 LEU A 40 5.318 14.658 0.867 1.00 0.00 H new ATOM 0 HD23 LEU A 40 3.630 14.119 0.708 1.00 0.00 H new ATOM 664 N THR A 41 6.595 12.918 -3.987 1.00 0.00 N ATOM 665 CA THR A 41 7.763 13.162 -4.799 1.00 0.00 C ATOM 666 C THR A 41 7.723 14.540 -5.441 1.00 0.00 C ATOM 667 O THR A 41 6.691 15.204 -5.455 1.00 0.00 O ATOM 668 CB THR A 41 7.885 12.054 -5.834 1.00 0.00 C ATOM 669 OG1 THR A 41 8.531 12.504 -7.012 1.00 0.00 O ATOM 670 CG2 THR A 41 6.557 11.447 -6.248 1.00 0.00 C ATOM 0 H THR A 41 5.785 13.492 -4.220 1.00 0.00 H new ATOM 0 HA THR A 41 8.650 13.152 -4.165 1.00 0.00 H new ATOM 0 HB THR A 41 8.477 11.288 -5.332 1.00 0.00 H new ATOM 0 HG1 THR A 41 8.593 11.766 -7.653 1.00 0.00 H new ATOM 0 HG21 THR A 41 6.729 10.665 -6.988 1.00 0.00 H new ATOM 0 HG22 THR A 41 6.065 11.018 -5.375 1.00 0.00 H new ATOM 0 HG23 THR A 41 5.922 12.221 -6.679 1.00 0.00 H new ATOM 678 N PRO A 42 8.871 15.013 -5.939 1.00 0.00 N ATOM 679 CA PRO A 42 8.989 16.342 -6.537 1.00 0.00 C ATOM 680 C PRO A 42 8.173 16.513 -7.800 1.00 0.00 C ATOM 681 O PRO A 42 8.395 15.847 -8.811 1.00 0.00 O ATOM 682 CB PRO A 42 10.496 16.445 -6.814 1.00 0.00 C ATOM 683 CG PRO A 42 10.902 15.037 -7.011 1.00 0.00 C ATOM 684 CD PRO A 42 10.174 14.325 -5.922 1.00 0.00 C ATOM 0 HA PRO A 42 8.601 17.125 -5.886 1.00 0.00 H new ATOM 0 HB2 PRO A 42 10.702 17.051 -7.697 1.00 0.00 H new ATOM 0 HB3 PRO A 42 11.028 16.904 -5.981 1.00 0.00 H new ATOM 0 HG2 PRO A 42 10.616 14.668 -7.996 1.00 0.00 H new ATOM 0 HG3 PRO A 42 11.981 14.912 -6.924 1.00 0.00 H new ATOM 0 HD2 PRO A 42 10.077 13.258 -6.123 1.00 0.00 H new ATOM 0 HD3 PRO A 42 10.677 14.423 -4.960 1.00 0.00 H new ATOM 692 N ILE A 43 7.229 17.438 -7.716 1.00 0.00 N ATOM 693 CA ILE A 43 6.352 17.764 -8.820 1.00 0.00 C ATOM 694 C ILE A 43 7.156 18.080 -10.078 1.00 0.00 C ATOM 695 O ILE A 43 6.674 17.919 -11.199 1.00 0.00 O ATOM 696 CB ILE A 43 5.466 18.970 -8.443 1.00 0.00 C ATOM 697 CG1 ILE A 43 4.274 18.491 -7.634 1.00 0.00 C ATOM 698 CG2 ILE A 43 5.032 19.747 -9.679 1.00 0.00 C ATOM 699 CD1 ILE A 43 3.281 19.589 -7.338 1.00 0.00 C ATOM 0 H ILE A 43 7.052 17.984 -6.873 1.00 0.00 H new ATOM 0 HA ILE A 43 5.720 16.900 -9.027 1.00 0.00 H new ATOM 0 HB ILE A 43 6.048 19.658 -7.830 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.771 17.691 -8.177 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.627 18.065 -6.695 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.409 20.590 -9.379 1.00 0.00 H new ATOM 0 HG22 ILE A 43 5.913 20.116 -10.205 1.00 0.00 H new ATOM 0 HG23 ILE A 43 4.463 19.092 -10.339 1.00 0.00 H new ATOM 0 HD11 ILE A 43 2.452 19.183 -6.757 1.00 0.00 H new ATOM 0 HD12 ILE A 43 3.771 20.379 -6.768 1.00 0.00 H new ATOM 0 HD13 ILE A 43 2.902 19.999 -8.274 1.00 0.00 H new ATOM 711 N GLU A 44 8.381 18.539 -9.873 1.00 0.00 N ATOM 712 CA GLU A 44 9.267 18.895 -10.969 1.00 0.00 C ATOM 713 C GLU A 44 9.811 17.658 -11.681 1.00 0.00 C ATOM 714 O GLU A 44 10.356 17.758 -12.780 1.00 0.00 O ATOM 715 CB GLU A 44 10.412 19.741 -10.427 1.00 0.00 C ATOM 716 CG GLU A 44 11.317 20.308 -11.507 1.00 0.00 C ATOM 717 CD GLU A 44 12.548 20.988 -10.940 1.00 0.00 C ATOM 718 OE1 GLU A 44 13.343 20.305 -10.261 1.00 0.00 O ATOM 719 OE2 GLU A 44 12.717 22.202 -11.176 1.00 0.00 O ATOM 0 H GLU A 44 8.787 18.674 -8.947 1.00 0.00 H new ATOM 0 HA GLU A 44 8.698 19.465 -11.704 1.00 0.00 H new ATOM 0 HB2 GLU A 44 9.999 20.563 -9.843 1.00 0.00 H new ATOM 0 HB3 GLU A 44 11.009 19.135 -9.746 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.626 19.504 -12.175 1.00 0.00 H new ATOM 0 HG3 GLU A 44 10.755 21.024 -12.107 1.00 0.00 H new ATOM 726 N LEU A 45 9.659 16.494 -11.057 1.00 0.00 N ATOM 727 CA LEU A 45 10.136 15.247 -11.647 1.00 0.00 C ATOM 728 C LEU A 45 9.024 14.552 -12.429 1.00 0.00 C ATOM 729 O LEU A 45 9.101 13.355 -12.706 1.00 0.00 O ATOM 730 CB LEU A 45 10.670 14.316 -10.557 1.00 0.00 C ATOM 731 CG LEU A 45 12.063 14.664 -10.016 1.00 0.00 C ATOM 732 CD1 LEU A 45 13.143 14.058 -10.898 1.00 0.00 C ATOM 733 CD2 LEU A 45 12.245 16.173 -9.911 1.00 0.00 C ATOM 0 H LEU A 45 9.211 16.388 -10.147 1.00 0.00 H new ATOM 0 HA LEU A 45 10.944 15.487 -12.339 1.00 0.00 H new ATOM 0 HB2 LEU A 45 9.966 14.317 -9.725 1.00 0.00 H new ATOM 0 HB3 LEU A 45 10.696 13.300 -10.952 1.00 0.00 H new ATOM 0 HG LEU A 45 12.153 14.241 -9.015 1.00 0.00 H new ATOM 0 HD11 LEU A 45 14.125 14.315 -10.500 1.00 0.00 H new ATOM 0 HD12 LEU A 45 13.031 12.974 -10.917 1.00 0.00 H new ATOM 0 HD13 LEU A 45 13.048 14.450 -11.911 1.00 0.00 H new ATOM 0 HD21 LEU A 45 13.240 16.393 -9.525 1.00 0.00 H new ATOM 0 HD22 LEU A 45 12.130 16.623 -10.897 1.00 0.00 H new ATOM 0 HD23 LEU A 45 11.495 16.584 -9.235 1.00 0.00 H new ATOM 745 N LEU A 46 7.991 15.311 -12.784 1.00 0.00 N ATOM 746 CA LEU A 46 6.864 14.775 -13.535 1.00 0.00 C ATOM 747 C LEU A 46 6.064 15.904 -14.176 1.00 0.00 C ATOM 748 O LEU A 46 4.849 15.801 -14.347 1.00 0.00 O ATOM 749 CB LEU A 46 5.960 13.946 -12.619 1.00 0.00 C ATOM 750 CG LEU A 46 5.174 12.835 -13.317 1.00 0.00 C ATOM 751 CD1 LEU A 46 6.060 11.622 -13.553 1.00 0.00 C ATOM 752 CD2 LEU A 46 3.951 12.453 -12.497 1.00 0.00 C ATOM 0 H LEU A 46 7.913 16.303 -12.562 1.00 0.00 H new ATOM 0 HA LEU A 46 7.252 14.130 -14.324 1.00 0.00 H new ATOM 0 HB2 LEU A 46 6.573 13.499 -11.836 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.254 14.616 -12.128 1.00 0.00 H new ATOM 0 HG LEU A 46 4.837 13.206 -14.285 1.00 0.00 H new ATOM 0 HD11 LEU A 46 5.484 10.842 -14.050 1.00 0.00 H new ATOM 0 HD12 LEU A 46 6.905 11.905 -14.181 1.00 0.00 H new ATOM 0 HD13 LEU A 46 6.427 11.248 -12.597 1.00 0.00 H new ATOM 0 HD21 LEU A 46 3.403 11.661 -13.008 1.00 0.00 H new ATOM 0 HD22 LEU A 46 4.267 12.100 -11.515 1.00 0.00 H new ATOM 0 HD23 LEU A 46 3.305 13.323 -12.379 1.00 0.00 H new ATOM 764 N ASP A 47 6.758 16.985 -14.526 1.00 0.00 N ATOM 765 CA ASP A 47 6.122 18.144 -15.147 1.00 0.00 C ATOM 766 C ASP A 47 5.331 18.937 -14.141 1.00 0.00 C ATOM 767 O ASP A 47 4.356 18.463 -13.558 1.00 0.00 O ATOM 768 CB ASP A 47 5.218 17.733 -16.306 1.00 0.00 C ATOM 769 CG ASP A 47 5.763 16.553 -17.089 1.00 0.00 C ATOM 770 OD1 ASP A 47 6.753 16.737 -17.828 1.00 0.00 O ATOM 771 OD2 ASP A 47 5.201 15.445 -16.961 1.00 0.00 O ATOM 0 H ASP A 47 7.764 17.082 -14.389 1.00 0.00 H new ATOM 0 HA ASP A 47 6.922 18.772 -15.539 1.00 0.00 H new ATOM 0 HB2 ASP A 47 4.231 17.481 -15.919 1.00 0.00 H new ATOM 0 HB3 ASP A 47 5.090 18.581 -16.979 1.00 0.00 H new ATOM 776 N LYS A 48 5.778 20.158 -13.957 1.00 0.00 N ATOM 777 CA LYS A 48 5.157 21.077 -13.040 1.00 0.00 C ATOM 778 C LYS A 48 3.782 21.498 -13.547 1.00 0.00 C ATOM 779 O LYS A 48 2.868 21.758 -12.764 1.00 0.00 O ATOM 780 CB LYS A 48 6.068 22.284 -12.887 1.00 0.00 C ATOM 781 CG LYS A 48 6.334 22.674 -11.442 1.00 0.00 C ATOM 782 CD LYS A 48 7.653 22.104 -10.950 1.00 0.00 C ATOM 783 CE LYS A 48 8.827 22.974 -11.368 1.00 0.00 C ATOM 784 NZ LYS A 48 8.811 24.296 -10.682 1.00 0.00 N ATOM 0 H LYS A 48 6.588 20.541 -14.444 1.00 0.00 H new ATOM 0 HA LYS A 48 5.013 20.596 -12.072 1.00 0.00 H new ATOM 0 HB2 LYS A 48 7.019 22.074 -13.378 1.00 0.00 H new ATOM 0 HB3 LYS A 48 5.622 23.132 -13.406 1.00 0.00 H new ATOM 0 HG2 LYS A 48 6.349 23.760 -11.353 1.00 0.00 H new ATOM 0 HG3 LYS A 48 5.522 22.314 -10.811 1.00 0.00 H new ATOM 0 HD2 LYS A 48 7.631 22.019 -9.864 1.00 0.00 H new ATOM 0 HD3 LYS A 48 7.786 21.097 -11.346 1.00 0.00 H new ATOM 0 HE2 LYS A 48 9.760 22.458 -11.141 1.00 0.00 H new ATOM 0 HE3 LYS A 48 8.801 23.125 -12.447 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 9.769 24.701 -10.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 8.162 24.938 -11.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 8.491 24.174 -9.700 1.00 0.00 H new ATOM 798 N LYS A 49 3.649 21.558 -14.868 1.00 0.00 N ATOM 799 CA LYS A 49 2.394 21.943 -15.501 1.00 0.00 C ATOM 800 C LYS A 49 1.311 20.896 -15.252 1.00 0.00 C ATOM 801 O LYS A 49 0.123 21.215 -15.211 1.00 0.00 O ATOM 802 CB LYS A 49 2.598 22.130 -17.005 1.00 0.00 C ATOM 803 CG LYS A 49 3.412 21.018 -17.653 1.00 0.00 C ATOM 804 CD LYS A 49 2.639 20.336 -18.771 1.00 0.00 C ATOM 805 CE LYS A 49 3.198 18.954 -19.072 1.00 0.00 C ATOM 806 NZ LYS A 49 2.230 18.118 -19.835 1.00 0.00 N ATOM 0 H LYS A 49 4.400 21.343 -15.524 1.00 0.00 H new ATOM 0 HA LYS A 49 2.069 22.886 -15.061 1.00 0.00 H new ATOM 0 HB2 LYS A 49 1.624 22.186 -17.491 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.097 23.083 -17.180 1.00 0.00 H new ATOM 0 HG2 LYS A 49 4.340 21.430 -18.050 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.688 20.281 -16.899 1.00 0.00 H new ATOM 0 HD2 LYS A 49 1.589 20.252 -18.490 1.00 0.00 H new ATOM 0 HD3 LYS A 49 2.680 20.950 -19.671 1.00 0.00 H new ATOM 0 HE2 LYS A 49 4.122 19.052 -19.643 1.00 0.00 H new ATOM 0 HE3 LYS A 49 3.452 18.454 -18.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.648 17.184 -20.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 1.358 18.003 -19.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.007 18.583 -20.738 1.00 0.00 H new ATOM 820 N ALA A 50 1.730 19.644 -15.091 1.00 0.00 N ATOM 821 CA ALA A 50 0.795 18.549 -14.852 1.00 0.00 C ATOM 822 C ALA A 50 -0.108 18.841 -13.654 1.00 0.00 C ATOM 823 O ALA A 50 0.338 19.402 -12.653 1.00 0.00 O ATOM 824 CB ALA A 50 1.554 17.248 -14.636 1.00 0.00 C ATOM 0 H ALA A 50 2.710 19.363 -15.122 1.00 0.00 H new ATOM 0 HA ALA A 50 0.161 18.449 -15.733 1.00 0.00 H new ATOM 0 HB1 ALA A 50 0.846 16.439 -14.459 1.00 0.00 H new ATOM 0 HB2 ALA A 50 2.149 17.022 -15.521 1.00 0.00 H new ATOM 0 HB3 ALA A 50 2.212 17.350 -13.773 1.00 0.00 H new ATOM 830 N PRO A 51 -1.396 18.461 -13.740 1.00 0.00 N ATOM 831 CA PRO A 51 -2.359 18.685 -12.660 1.00 0.00 C ATOM 832 C PRO A 51 -2.177 17.703 -11.507 1.00 0.00 C ATOM 833 O PRO A 51 -1.400 16.753 -11.605 1.00 0.00 O ATOM 834 CB PRO A 51 -3.706 18.462 -13.344 1.00 0.00 C ATOM 835 CG PRO A 51 -3.415 17.487 -14.432 1.00 0.00 C ATOM 836 CD PRO A 51 -2.014 17.784 -14.898 1.00 0.00 C ATOM 0 HA PRO A 51 -2.249 19.672 -12.210 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -4.445 18.069 -12.646 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.108 19.394 -13.743 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -3.495 16.463 -14.069 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -4.128 17.592 -15.250 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -1.478 16.872 -15.162 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -2.013 18.422 -15.782 1.00 0.00 H new ATOM 844 N SER A 52 -2.899 17.938 -10.417 1.00 0.00 N ATOM 845 CA SER A 52 -2.817 17.073 -9.245 1.00 0.00 C ATOM 846 C SER A 52 -4.209 16.715 -8.734 1.00 0.00 C ATOM 847 O SER A 52 -4.689 17.290 -7.757 1.00 0.00 O ATOM 848 CB SER A 52 -2.014 17.755 -8.137 1.00 0.00 C ATOM 849 OG SER A 52 -1.092 18.688 -8.674 1.00 0.00 O ATOM 0 H SER A 52 -3.547 18.720 -10.320 1.00 0.00 H new ATOM 0 HA SER A 52 -2.310 16.154 -9.538 1.00 0.00 H new ATOM 0 HB2 SER A 52 -2.693 18.263 -7.452 1.00 0.00 H new ATOM 0 HB3 SER A 52 -1.479 17.004 -7.556 1.00 0.00 H new ATOM 0 HG SER A 52 -0.593 19.111 -7.945 1.00 0.00 H new ATOM 855 N HIS A 53 -4.853 15.762 -9.401 1.00 0.00 N ATOM 856 CA HIS A 53 -6.190 15.327 -9.013 1.00 0.00 C ATOM 857 C HIS A 53 -6.123 14.322 -7.868 1.00 0.00 C ATOM 858 O HIS A 53 -6.489 14.633 -6.734 1.00 0.00 O ATOM 859 CB HIS A 53 -6.915 14.709 -10.210 1.00 0.00 C ATOM 860 CG HIS A 53 -8.317 14.281 -9.905 1.00 0.00 C ATOM 861 ND1 HIS A 53 -9.400 15.131 -9.992 1.00 0.00 N ATOM 862 CD2 HIS A 53 -8.812 13.083 -9.511 1.00 0.00 C ATOM 863 CE1 HIS A 53 -10.499 14.475 -9.664 1.00 0.00 C ATOM 864 NE2 HIS A 53 -10.170 13.231 -9.369 1.00 0.00 N ATOM 0 H HIS A 53 -4.471 15.277 -10.212 1.00 0.00 H new ATOM 0 HA HIS A 53 -6.746 16.201 -8.673 1.00 0.00 H new ATOM 0 HB2 HIS A 53 -6.934 15.432 -11.026 1.00 0.00 H new ATOM 0 HB3 HIS A 53 -6.349 13.846 -10.561 1.00 0.00 H new ATOM 0 HD2 HIS A 53 -8.245 12.180 -9.340 1.00 0.00 H new ATOM 0 HE1 HIS A 53 -11.497 14.887 -9.641 1.00 0.00 H new ATOM 0 HE2 HIS A 53 -10.819 12.498 -9.082 1.00 0.00 H new ATOM 873 N LEU A 54 -5.651 13.117 -8.171 1.00 0.00 N ATOM 874 CA LEU A 54 -5.534 12.067 -7.165 1.00 0.00 C ATOM 875 C LEU A 54 -4.322 12.308 -6.271 1.00 0.00 C ATOM 876 O LEU A 54 -4.394 12.146 -5.053 1.00 0.00 O ATOM 877 CB LEU A 54 -5.424 10.697 -7.838 1.00 0.00 C ATOM 878 CG LEU A 54 -5.222 9.519 -6.879 1.00 0.00 C ATOM 879 CD1 LEU A 54 -6.365 8.523 -7.004 1.00 0.00 C ATOM 880 CD2 LEU A 54 -3.888 8.835 -7.145 1.00 0.00 C ATOM 0 H LEU A 54 -5.344 12.843 -9.104 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.431 12.087 -6.546 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.329 10.521 -8.420 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -4.592 10.720 -8.541 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.214 9.906 -5.860 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.202 7.694 -6.315 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.306 9.017 -6.762 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.407 8.143 -8.025 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.763 8.001 -6.454 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.867 8.464 -8.170 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -3.078 9.550 -7.002 1.00 0.00 H new ATOM 892 N CYS A 55 -3.210 12.698 -6.885 1.00 0.00 N ATOM 893 CA CYS A 55 -1.982 12.965 -6.146 1.00 0.00 C ATOM 894 C CYS A 55 -2.016 14.362 -5.525 1.00 0.00 C ATOM 895 O CYS A 55 -2.176 15.355 -6.234 1.00 0.00 O ATOM 896 CB CYS A 55 -0.770 12.838 -7.071 1.00 0.00 C ATOM 897 SG CYS A 55 -0.570 11.196 -7.803 1.00 0.00 S ATOM 0 H CYS A 55 -3.134 12.836 -7.893 1.00 0.00 H new ATOM 0 HA CYS A 55 -1.900 12.230 -5.345 1.00 0.00 H new ATOM 0 HB2 CYS A 55 -0.858 13.573 -7.871 1.00 0.00 H new ATOM 0 HB3 CYS A 55 0.130 13.086 -6.509 1.00 0.00 H new ATOM 0 HG CYS A 55 0.479 11.188 -8.570 1.00 0.00 H new ATOM 903 N PRO A 56 -1.864 14.465 -4.190 1.00 0.00 N ATOM 904 CA PRO A 56 -1.876 15.736 -3.487 1.00 0.00 C ATOM 905 C PRO A 56 -0.475 16.312 -3.328 1.00 0.00 C ATOM 906 O PRO A 56 0.482 15.580 -3.076 1.00 0.00 O ATOM 907 CB PRO A 56 -2.461 15.366 -2.118 1.00 0.00 C ATOM 908 CG PRO A 56 -2.349 13.871 -2.000 1.00 0.00 C ATOM 909 CD PRO A 56 -1.664 13.367 -3.246 1.00 0.00 C ATOM 0 HA PRO A 56 -2.443 16.501 -4.018 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -1.915 15.861 -1.315 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -3.500 15.685 -2.040 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -1.779 13.598 -1.112 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -3.336 13.420 -1.896 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -0.606 13.169 -3.074 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -2.108 12.439 -3.605 1.00 0.00 H new ATOM 917 N THR A 57 -0.358 17.625 -3.478 1.00 0.00 N ATOM 918 CA THR A 57 0.931 18.293 -3.351 1.00 0.00 C ATOM 919 C THR A 57 1.059 18.991 -2.027 1.00 0.00 C ATOM 920 O THR A 57 0.073 19.255 -1.339 1.00 0.00 O ATOM 921 CB THR A 57 1.135 19.317 -4.469 1.00 0.00 C ATOM 922 OG1 THR A 57 1.520 18.675 -5.666 1.00 0.00 O ATOM 923 CG2 THR A 57 2.183 20.380 -4.158 1.00 0.00 C ATOM 0 H THR A 57 -1.138 18.248 -3.687 1.00 0.00 H new ATOM 0 HA THR A 57 1.694 17.518 -3.424 1.00 0.00 H new ATOM 0 HB THR A 57 0.171 19.815 -4.570 1.00 0.00 H new ATOM 0 HG1 THR A 57 0.781 18.711 -6.309 1.00 0.00 H new ATOM 0 HG21 THR A 57 2.267 21.066 -5.001 1.00 0.00 H new ATOM 0 HG22 THR A 57 1.886 20.934 -3.267 1.00 0.00 H new ATOM 0 HG23 THR A 57 3.146 19.901 -3.983 1.00 0.00 H new ATOM 931 N ILE A 58 2.294 19.325 -1.695 1.00 0.00 N ATOM 932 CA ILE A 58 2.559 20.032 -0.483 1.00 0.00 C ATOM 933 C ILE A 58 3.473 21.217 -0.705 1.00 0.00 C ATOM 934 O ILE A 58 3.949 21.462 -1.811 1.00 0.00 O ATOM 935 CB ILE A 58 3.231 19.151 0.571 1.00 0.00 C ATOM 936 CG1 ILE A 58 4.513 18.574 -0.021 1.00 0.00 C ATOM 937 CG2 ILE A 58 2.285 18.060 1.059 1.00 0.00 C ATOM 938 CD1 ILE A 58 4.255 17.369 -0.885 1.00 0.00 C ATOM 0 H ILE A 58 3.119 19.112 -2.256 1.00 0.00 H new ATOM 0 HA ILE A 58 1.580 20.361 -0.134 1.00 0.00 H new ATOM 0 HB ILE A 58 3.485 19.749 1.446 1.00 0.00 H new ATOM 0 HG12 ILE A 58 5.014 19.341 -0.612 1.00 0.00 H new ATOM 0 HG13 ILE A 58 5.192 18.300 0.787 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.789 17.449 1.808 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.399 18.517 1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.989 17.433 0.218 1.00 0.00 H new ATOM 0 HD11 ILE A 58 5.200 16.997 -1.282 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.779 16.590 -0.290 1.00 0.00 H new ATOM 0 HD13 ILE A 58 3.599 17.647 -1.710 1.00 0.00 H new ATOM 950 N HIS A 59 3.771 21.895 0.390 1.00 0.00 N ATOM 951 CA HIS A 59 4.700 22.998 0.373 1.00 0.00 C ATOM 952 C HIS A 59 5.667 22.811 1.519 1.00 0.00 C ATOM 953 O HIS A 59 5.493 23.366 2.604 1.00 0.00 O ATOM 954 CB HIS A 59 3.995 24.331 0.509 1.00 0.00 C ATOM 955 CG HIS A 59 2.928 24.564 -0.515 1.00 0.00 C ATOM 956 ND1 HIS A 59 1.869 23.802 -0.881 1.00 0.00 N flip ATOM 957 CD2 HIS A 59 2.874 25.694 -1.303 1.00 0.00 C flip ATOM 958 CE1 HIS A 59 1.203 24.481 -1.871 1.00 0.00 C flip ATOM 959 NE2 HIS A 59 1.828 25.619 -2.107 1.00 0.00 N flip ATOM 0 H HIS A 59 3.375 21.693 1.308 1.00 0.00 H new ATOM 0 HA HIS A 59 5.223 23.007 -0.584 1.00 0.00 H new ATOM 0 HB2 HIS A 59 3.551 24.396 1.502 1.00 0.00 H new ATOM 0 HB3 HIS A 59 4.733 25.130 0.437 1.00 0.00 H new ATOM 0 HD2 HIS A 59 3.577 26.513 -1.269 1.00 0.00 H new ATOM 0 HE1 HIS A 59 0.311 24.139 -2.375 1.00 0.00 H new ATOM 0 HE2 HIS A 59 1.551 26.321 -2.793 1.00 0.00 H new ATOM 968 N ILE A 60 6.668 22.004 1.269 1.00 0.00 N ATOM 969 CA ILE A 60 7.672 21.694 2.268 1.00 0.00 C ATOM 970 C ILE A 60 8.984 22.424 1.989 1.00 0.00 C ATOM 971 O ILE A 60 9.112 23.129 0.988 1.00 0.00 O ATOM 972 CB ILE A 60 7.911 20.176 2.330 1.00 0.00 C ATOM 973 CG1 ILE A 60 8.394 19.661 0.974 1.00 0.00 C ATOM 974 CG2 ILE A 60 6.626 19.466 2.746 1.00 0.00 C ATOM 975 CD1 ILE A 60 9.298 18.452 1.071 1.00 0.00 C ATOM 0 H ILE A 60 6.814 21.542 0.371 1.00 0.00 H new ATOM 0 HA ILE A 60 7.298 22.037 3.233 1.00 0.00 H new ATOM 0 HB ILE A 60 8.683 19.967 3.071 1.00 0.00 H new ATOM 0 HG12 ILE A 60 7.528 19.408 0.362 1.00 0.00 H new ATOM 0 HG13 ILE A 60 8.926 20.461 0.460 1.00 0.00 H new ATOM 0 HG21 ILE A 60 6.802 18.391 2.788 1.00 0.00 H new ATOM 0 HG22 ILE A 60 6.315 19.822 3.728 1.00 0.00 H new ATOM 0 HG23 ILE A 60 5.842 19.677 2.019 1.00 0.00 H new ATOM 0 HD11 ILE A 60 9.601 18.143 0.071 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.182 18.705 1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 60 8.763 17.636 1.556 1.00 0.00 H new ATOM 987 N ASP A 61 9.948 22.266 2.892 1.00 0.00 N ATOM 988 CA ASP A 61 11.246 22.925 2.761 1.00 0.00 C ATOM 989 C ASP A 61 11.846 22.734 1.371 1.00 0.00 C ATOM 990 O ASP A 61 12.359 23.681 0.775 1.00 0.00 O ATOM 991 CB ASP A 61 12.215 22.401 3.822 1.00 0.00 C ATOM 992 CG ASP A 61 11.706 22.625 5.232 1.00 0.00 C ATOM 993 OD1 ASP A 61 10.483 22.818 5.397 1.00 0.00 O ATOM 994 OD2 ASP A 61 12.529 22.608 6.170 1.00 0.00 O ATOM 0 H ASP A 61 9.855 21.685 3.725 1.00 0.00 H new ATOM 0 HA ASP A 61 11.085 23.993 2.909 1.00 0.00 H new ATOM 0 HB2 ASP A 61 12.381 21.335 3.664 1.00 0.00 H new ATOM 0 HB3 ASP A 61 13.180 22.895 3.704 1.00 0.00 H new ATOM 999 N GLU A 62 11.781 21.512 0.859 1.00 0.00 N ATOM 1000 CA GLU A 62 12.324 21.216 -0.461 1.00 0.00 C ATOM 1001 C GLU A 62 11.452 21.810 -1.569 1.00 0.00 C ATOM 1002 O GLU A 62 11.799 21.730 -2.747 1.00 0.00 O ATOM 1003 CB GLU A 62 12.452 19.704 -0.655 1.00 0.00 C ATOM 1004 CG GLU A 62 13.131 18.997 0.507 1.00 0.00 C ATOM 1005 CD GLU A 62 14.639 18.949 0.359 1.00 0.00 C ATOM 1006 OE1 GLU A 62 15.187 19.766 -0.411 1.00 0.00 O ATOM 1007 OE2 GLU A 62 15.273 18.094 1.013 1.00 0.00 O ATOM 0 H GLU A 62 11.360 20.713 1.334 1.00 0.00 H new ATOM 0 HA GLU A 62 13.312 21.673 -0.524 1.00 0.00 H new ATOM 0 HB2 GLU A 62 11.458 19.279 -0.798 1.00 0.00 H new ATOM 0 HB3 GLU A 62 13.016 19.510 -1.567 1.00 0.00 H new ATOM 0 HG2 GLU A 62 12.877 19.507 1.436 1.00 0.00 H new ATOM 0 HG3 GLU A 62 12.745 17.981 0.585 1.00 0.00 H new ATOM 1014 N GLY A 63 10.320 22.402 -1.190 1.00 0.00 N ATOM 1015 CA GLY A 63 9.429 22.991 -2.175 1.00 0.00 C ATOM 1016 C GLY A 63 8.073 22.310 -2.210 1.00 0.00 C ATOM 1017 O GLY A 63 7.451 22.100 -1.170 1.00 0.00 O ATOM 0 H GLY A 63 10.006 22.484 -0.223 1.00 0.00 H new ATOM 0 HA2 GLY A 63 9.295 24.050 -1.953 1.00 0.00 H new ATOM 0 HA3 GLY A 63 9.890 22.928 -3.161 1.00 0.00 H new ATOM 1021 N ASP A 64 7.614 21.964 -3.409 1.00 0.00 N ATOM 1022 CA ASP A 64 6.322 21.303 -3.571 1.00 0.00 C ATOM 1023 C ASP A 64 6.490 19.928 -4.211 1.00 0.00 C ATOM 1024 O ASP A 64 7.128 19.785 -5.254 1.00 0.00 O ATOM 1025 CB ASP A 64 5.385 22.163 -4.421 1.00 0.00 C ATOM 1026 CG ASP A 64 5.358 23.610 -3.969 1.00 0.00 C ATOM 1027 OD1 ASP A 64 6.399 24.289 -4.092 1.00 0.00 O ATOM 1028 OD2 ASP A 64 4.297 24.063 -3.493 1.00 0.00 O ATOM 0 H ASP A 64 8.116 22.130 -4.281 1.00 0.00 H new ATOM 0 HA ASP A 64 5.884 21.173 -2.581 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.700 22.117 -5.463 1.00 0.00 H new ATOM 0 HB3 ASP A 64 4.377 21.752 -4.374 1.00 0.00 H new ATOM 1033 N PHE A 65 5.914 18.921 -3.567 1.00 0.00 N ATOM 1034 CA PHE A 65 5.989 17.546 -4.043 1.00 0.00 C ATOM 1035 C PHE A 65 4.580 16.974 -4.192 1.00 0.00 C ATOM 1036 O PHE A 65 3.609 17.717 -4.072 1.00 0.00 O ATOM 1037 CB PHE A 65 6.874 16.725 -3.103 1.00 0.00 C ATOM 1038 CG PHE A 65 8.294 17.229 -3.096 1.00 0.00 C ATOM 1039 CD1 PHE A 65 8.577 18.509 -2.654 1.00 0.00 C ATOM 1040 CD2 PHE A 65 9.336 16.440 -3.554 1.00 0.00 C ATOM 1041 CE1 PHE A 65 9.871 18.994 -2.668 1.00 0.00 C ATOM 1042 CE2 PHE A 65 10.634 16.917 -3.566 1.00 0.00 C ATOM 1043 CZ PHE A 65 10.901 18.197 -3.124 1.00 0.00 C ATOM 0 H PHE A 65 5.384 19.034 -2.703 1.00 0.00 H new ATOM 0 HA PHE A 65 6.451 17.508 -5.029 1.00 0.00 H new ATOM 0 HB2 PHE A 65 6.468 16.766 -2.092 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.860 15.679 -3.410 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.776 19.137 -2.293 1.00 0.00 H new ATOM 0 HD2 PHE A 65 9.132 15.440 -3.906 1.00 0.00 H new ATOM 0 HE1 PHE A 65 10.076 19.996 -2.322 1.00 0.00 H new ATOM 0 HE2 PHE A 65 11.438 16.289 -3.921 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.913 18.574 -3.135 1.00 0.00 H new ATOM 1053 N ILE A 66 4.447 15.680 -4.491 1.00 0.00 N ATOM 1054 CA ILE A 66 3.121 15.102 -4.683 1.00 0.00 C ATOM 1055 C ILE A 66 3.021 13.695 -4.119 1.00 0.00 C ATOM 1056 O ILE A 66 3.613 12.761 -4.658 1.00 0.00 O ATOM 1057 CB ILE A 66 2.720 15.064 -6.180 1.00 0.00 C ATOM 1058 CG1 ILE A 66 3.939 15.281 -7.072 1.00 0.00 C ATOM 1059 CG2 ILE A 66 1.643 16.095 -6.482 1.00 0.00 C ATOM 1060 CD1 ILE A 66 4.906 14.137 -6.988 1.00 0.00 C ATOM 0 H ILE A 66 5.223 15.028 -4.603 1.00 0.00 H new ATOM 0 HA ILE A 66 2.436 15.753 -4.140 1.00 0.00 H new ATOM 0 HB ILE A 66 2.311 14.076 -6.394 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.615 15.407 -8.105 1.00 0.00 H new ATOM 0 HG13 ILE A 66 4.442 16.203 -6.781 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.380 16.047 -7.539 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.760 15.886 -5.878 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.017 17.091 -6.246 1.00 0.00 H new ATOM 0 HD11 ILE A 66 5.759 14.333 -7.638 1.00 0.00 H new ATOM 0 HD12 ILE A 66 5.251 14.027 -5.960 1.00 0.00 H new ATOM 0 HD13 ILE A 66 4.412 13.219 -7.305 1.00 0.00 H new ATOM 1072 N MET A 67 2.248 13.536 -3.045 1.00 0.00 N ATOM 1073 CA MET A 67 2.068 12.221 -2.445 1.00 0.00 C ATOM 1074 C MET A 67 1.636 11.232 -3.513 1.00 0.00 C ATOM 1075 O MET A 67 0.527 11.314 -4.041 1.00 0.00 O ATOM 1076 CB MET A 67 1.040 12.273 -1.314 1.00 0.00 C ATOM 1077 CG MET A 67 1.408 13.265 -0.232 1.00 0.00 C ATOM 1078 SD MET A 67 0.029 13.676 0.852 1.00 0.00 S ATOM 1079 CE MET A 67 0.617 15.211 1.565 1.00 0.00 C ATOM 0 H MET A 67 1.744 14.292 -2.580 1.00 0.00 H new ATOM 0 HA MET A 67 3.016 11.896 -2.017 1.00 0.00 H new ATOM 0 HB2 MET A 67 0.066 12.537 -1.726 1.00 0.00 H new ATOM 0 HB3 MET A 67 0.941 11.281 -0.873 1.00 0.00 H new ATOM 0 HG2 MET A 67 2.222 12.855 0.366 1.00 0.00 H new ATOM 0 HG3 MET A 67 1.781 14.178 -0.696 1.00 0.00 H new ATOM 0 HE1 MET A 67 0.155 15.359 2.541 1.00 0.00 H new ATOM 0 HE2 MET A 67 1.700 15.168 1.679 1.00 0.00 H new ATOM 0 HE3 MET A 67 0.354 16.041 0.909 1.00 0.00 H new ATOM 1089 N LEU A 68 2.525 10.307 -3.837 1.00 0.00 N ATOM 1090 CA LEU A 68 2.233 9.313 -4.858 1.00 0.00 C ATOM 1091 C LEU A 68 1.278 8.264 -4.307 1.00 0.00 C ATOM 1092 O LEU A 68 1.682 7.156 -3.954 1.00 0.00 O ATOM 1093 CB LEU A 68 3.529 8.667 -5.367 1.00 0.00 C ATOM 1094 CG LEU A 68 3.606 8.476 -6.884 1.00 0.00 C ATOM 1095 CD1 LEU A 68 4.576 9.476 -7.498 1.00 0.00 C ATOM 1096 CD2 LEU A 68 4.021 7.052 -7.224 1.00 0.00 C ATOM 0 H LEU A 68 3.448 10.223 -3.412 1.00 0.00 H new ATOM 0 HA LEU A 68 1.751 9.805 -5.703 1.00 0.00 H new ATOM 0 HB2 LEU A 68 4.372 9.281 -5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 68 3.645 7.695 -4.887 1.00 0.00 H new ATOM 0 HG LEU A 68 2.616 8.654 -7.304 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.619 9.326 -8.577 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.236 10.490 -7.286 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.568 9.329 -7.072 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.070 6.936 -8.307 1.00 0.00 H new ATOM 0 HD22 LEU A 68 5.000 6.845 -6.792 1.00 0.00 H new ATOM 0 HD23 LEU A 68 3.290 6.353 -6.817 1.00 0.00 H new ATOM 1108 N THR A 69 0.002 8.635 -4.232 1.00 0.00 N ATOM 1109 CA THR A 69 -1.032 7.746 -3.719 1.00 0.00 C ATOM 1110 C THR A 69 -1.505 6.775 -4.800 1.00 0.00 C ATOM 1111 O THR A 69 -2.162 5.777 -4.505 1.00 0.00 O ATOM 1112 CB THR A 69 -2.202 8.574 -3.151 1.00 0.00 C ATOM 1113 OG1 THR A 69 -2.735 7.979 -1.981 1.00 0.00 O ATOM 1114 CG2 THR A 69 -3.346 8.798 -4.123 1.00 0.00 C ATOM 0 H THR A 69 -0.340 9.551 -4.522 1.00 0.00 H new ATOM 0 HA THR A 69 -0.612 7.147 -2.911 1.00 0.00 H new ATOM 0 HB THR A 69 -1.757 9.545 -2.932 1.00 0.00 H new ATOM 0 HG1 THR A 69 -2.443 7.045 -1.927 1.00 0.00 H new ATOM 0 HG21 THR A 69 -4.124 9.389 -3.639 1.00 0.00 H new ATOM 0 HG22 THR A 69 -2.979 9.330 -5.001 1.00 0.00 H new ATOM 0 HG23 THR A 69 -3.758 7.836 -4.428 1.00 0.00 H new ATOM 1122 N GLN A 70 -1.153 7.065 -6.050 1.00 0.00 N ATOM 1123 CA GLN A 70 -1.528 6.206 -7.164 1.00 0.00 C ATOM 1124 C GLN A 70 -0.872 4.833 -7.029 1.00 0.00 C ATOM 1125 O GLN A 70 -1.274 3.875 -7.690 1.00 0.00 O ATOM 1126 CB GLN A 70 -1.126 6.849 -8.492 1.00 0.00 C ATOM 1127 CG GLN A 70 -2.051 6.497 -9.645 1.00 0.00 C ATOM 1128 CD GLN A 70 -1.383 6.650 -10.997 1.00 0.00 C ATOM 1129 OE1 GLN A 70 -0.440 5.930 -11.322 1.00 0.00 O ATOM 1130 NE2 GLN A 70 -1.871 7.594 -11.794 1.00 0.00 N ATOM 0 H GLN A 70 -0.610 7.887 -6.314 1.00 0.00 H new ATOM 0 HA GLN A 70 -2.610 6.079 -7.147 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -1.107 7.932 -8.370 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -0.112 6.539 -8.744 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -2.396 5.469 -9.529 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -2.933 7.136 -9.606 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -2.655 8.168 -11.484 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -1.462 7.744 -12.716 1.00 0.00 H new ATOM 1139 N GLN A 71 0.135 4.743 -6.161 1.00 0.00 N ATOM 1140 CA GLN A 71 0.839 3.490 -5.931 1.00 0.00 C ATOM 1141 C GLN A 71 0.710 3.084 -4.472 1.00 0.00 C ATOM 1142 O GLN A 71 0.091 2.072 -4.151 1.00 0.00 O ATOM 1143 CB GLN A 71 2.316 3.631 -6.305 1.00 0.00 C ATOM 1144 CG GLN A 71 3.028 2.300 -6.485 1.00 0.00 C ATOM 1145 CD GLN A 71 4.452 2.463 -6.980 1.00 0.00 C ATOM 1146 OE1 GLN A 71 5.371 2.695 -6.196 1.00 0.00 O ATOM 1147 NE2 GLN A 71 4.640 2.342 -8.289 1.00 0.00 N ATOM 0 H GLN A 71 0.479 5.527 -5.606 1.00 0.00 H new ATOM 0 HA GLN A 71 0.393 2.718 -6.558 1.00 0.00 H new ATOM 0 HB2 GLN A 71 2.395 4.204 -7.229 1.00 0.00 H new ATOM 0 HB3 GLN A 71 2.825 4.204 -5.530 1.00 0.00 H new ATOM 0 HG2 GLN A 71 3.036 1.765 -5.535 1.00 0.00 H new ATOM 0 HG3 GLN A 71 2.470 1.686 -7.192 1.00 0.00 H new ATOM 0 HE21 GLN A 71 3.848 2.149 -8.902 1.00 0.00 H new ATOM 0 HE22 GLN A 71 5.576 2.442 -8.681 1.00 0.00 H new ATOM 1156 N MET A 72 1.286 3.890 -3.589 1.00 0.00 N ATOM 1157 CA MET A 72 1.222 3.618 -2.162 1.00 0.00 C ATOM 1158 C MET A 72 1.890 2.286 -1.839 1.00 0.00 C ATOM 1159 O MET A 72 1.724 1.303 -2.561 1.00 0.00 O ATOM 1160 CB MET A 72 -0.235 3.611 -1.704 1.00 0.00 C ATOM 1161 CG MET A 72 -0.450 4.252 -0.342 1.00 0.00 C ATOM 1162 SD MET A 72 -2.191 4.551 0.018 1.00 0.00 S ATOM 1163 CE MET A 72 -2.835 2.880 -0.011 1.00 0.00 C ATOM 0 H MET A 72 1.801 4.735 -3.837 1.00 0.00 H new ATOM 0 HA MET A 72 1.758 4.403 -1.629 1.00 0.00 H new ATOM 0 HB2 MET A 72 -0.841 4.135 -2.442 1.00 0.00 H new ATOM 0 HB3 MET A 72 -0.592 2.582 -1.672 1.00 0.00 H new ATOM 0 HG2 MET A 72 -0.029 3.607 0.429 1.00 0.00 H new ATOM 0 HG3 MET A 72 0.093 5.196 -0.299 1.00 0.00 H new ATOM 0 HE1 MET A 72 -3.453 2.744 -0.898 1.00 0.00 H new ATOM 0 HE2 MET A 72 -2.007 2.171 -0.033 1.00 0.00 H new ATOM 0 HE3 MET A 72 -3.437 2.707 0.881 1.00 0.00 H new ATOM 1173 N THR A 73 2.658 2.262 -0.758 1.00 0.00 N ATOM 1174 CA THR A 73 3.361 1.052 -0.354 1.00 0.00 C ATOM 1175 C THR A 73 3.761 1.122 1.115 1.00 0.00 C ATOM 1176 O THR A 73 4.253 2.149 1.577 1.00 0.00 O ATOM 1177 CB THR A 73 4.607 0.869 -1.223 1.00 0.00 C ATOM 1178 OG1 THR A 73 5.319 2.093 -1.344 1.00 0.00 O ATOM 1179 CG2 THR A 73 4.297 0.379 -2.621 1.00 0.00 C ATOM 0 H THR A 73 2.810 3.064 -0.147 1.00 0.00 H new ATOM 0 HA THR A 73 2.693 0.201 -0.487 1.00 0.00 H new ATOM 0 HB THR A 73 5.204 0.112 -0.715 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.113 1.956 -1.902 1.00 0.00 H new ATOM 0 HG21 THR A 73 5.225 0.271 -3.183 1.00 0.00 H new ATOM 0 HG22 THR A 73 3.792 -0.586 -2.565 1.00 0.00 H new ATOM 0 HG23 THR A 73 3.650 1.098 -3.124 1.00 0.00 H new ATOM 1187 N SER A 74 3.561 0.029 1.849 1.00 0.00 N ATOM 1188 CA SER A 74 3.923 0.004 3.262 1.00 0.00 C ATOM 1189 C SER A 74 5.434 0.002 3.411 1.00 0.00 C ATOM 1190 O SER A 74 6.113 -0.947 3.021 1.00 0.00 O ATOM 1191 CB SER A 74 3.316 -1.213 3.965 1.00 0.00 C ATOM 1192 OG SER A 74 2.269 -1.779 3.196 1.00 0.00 O ATOM 0 H SER A 74 3.157 -0.838 1.495 1.00 0.00 H new ATOM 0 HA SER A 74 3.520 0.900 3.735 1.00 0.00 H new ATOM 0 HB2 SER A 74 4.090 -1.961 4.137 1.00 0.00 H new ATOM 0 HB3 SER A 74 2.935 -0.919 4.943 1.00 0.00 H new ATOM 0 HG SER A 74 1.479 -1.905 3.762 1.00 0.00 H new ATOM 1198 N VAL A 75 5.949 1.084 3.975 1.00 0.00 N ATOM 1199 CA VAL A 75 7.378 1.238 4.180 1.00 0.00 C ATOM 1200 C VAL A 75 7.754 0.853 5.607 1.00 0.00 C ATOM 1201 O VAL A 75 7.387 1.537 6.561 1.00 0.00 O ATOM 1202 CB VAL A 75 7.820 2.680 3.876 1.00 0.00 C ATOM 1203 CG1 VAL A 75 7.571 2.997 2.411 1.00 0.00 C ATOM 1204 CG2 VAL A 75 7.111 3.667 4.790 1.00 0.00 C ATOM 0 H VAL A 75 5.392 1.874 4.301 1.00 0.00 H new ATOM 0 HA VAL A 75 7.897 0.571 3.492 1.00 0.00 H new ATOM 0 HB VAL A 75 8.889 2.773 4.069 1.00 0.00 H new ATOM 0 HG11 VAL A 75 7.886 4.019 2.201 1.00 0.00 H new ATOM 0 HG12 VAL A 75 8.140 2.307 1.788 1.00 0.00 H new ATOM 0 HG13 VAL A 75 6.508 2.892 2.192 1.00 0.00 H new ATOM 0 HG21 VAL A 75 7.439 4.680 4.556 1.00 0.00 H new ATOM 0 HG22 VAL A 75 6.034 3.592 4.641 1.00 0.00 H new ATOM 0 HG23 VAL A 75 7.351 3.438 5.828 1.00 0.00 H new ATOM 1214 N PRO A 76 8.468 -0.274 5.772 1.00 0.00 N ATOM 1215 CA PRO A 76 8.865 -0.773 7.091 1.00 0.00 C ATOM 1216 C PRO A 76 9.545 0.279 7.964 1.00 0.00 C ATOM 1217 O PRO A 76 10.417 1.020 7.513 1.00 0.00 O ATOM 1218 CB PRO A 76 9.830 -1.911 6.767 1.00 0.00 C ATOM 1219 CG PRO A 76 9.432 -2.377 5.410 1.00 0.00 C ATOM 1220 CD PRO A 76 8.919 -1.165 4.686 1.00 0.00 C ATOM 0 HA PRO A 76 7.996 -1.079 7.674 1.00 0.00 H new ATOM 0 HB2 PRO A 76 10.864 -1.567 6.779 1.00 0.00 H new ATOM 0 HB3 PRO A 76 9.753 -2.715 7.499 1.00 0.00 H new ATOM 0 HG2 PRO A 76 10.280 -2.815 4.884 1.00 0.00 H new ATOM 0 HG3 PRO A 76 8.664 -3.148 5.473 1.00 0.00 H new ATOM 0 HD2 PRO A 76 9.698 -0.699 4.083 1.00 0.00 H new ATOM 0 HD3 PRO A 76 8.102 -1.418 4.010 1.00 0.00 H new ATOM 1228 N VAL A 77 9.122 0.330 9.223 1.00 0.00 N ATOM 1229 CA VAL A 77 9.659 1.279 10.201 1.00 0.00 C ATOM 1230 C VAL A 77 11.189 1.349 10.180 1.00 0.00 C ATOM 1231 O VAL A 77 11.767 2.422 10.345 1.00 0.00 O ATOM 1232 CB VAL A 77 9.207 0.909 11.626 1.00 0.00 C ATOM 1233 CG1 VAL A 77 9.769 -0.448 12.025 1.00 0.00 C ATOM 1234 CG2 VAL A 77 9.628 1.983 12.618 1.00 0.00 C ATOM 0 H VAL A 77 8.398 -0.283 9.597 1.00 0.00 H new ATOM 0 HA VAL A 77 9.266 2.256 9.918 1.00 0.00 H new ATOM 0 HB VAL A 77 8.119 0.846 11.639 1.00 0.00 H new ATOM 0 HG11 VAL A 77 9.441 -0.695 13.035 1.00 0.00 H new ATOM 0 HG12 VAL A 77 9.411 -1.208 11.331 1.00 0.00 H new ATOM 0 HG13 VAL A 77 10.858 -0.414 11.996 1.00 0.00 H new ATOM 0 HG21 VAL A 77 9.299 1.703 13.619 1.00 0.00 H new ATOM 0 HG22 VAL A 77 10.713 2.083 12.607 1.00 0.00 H new ATOM 0 HG23 VAL A 77 9.173 2.934 12.340 1.00 0.00 H new ATOM 1244 N LYS A 78 11.840 0.202 10.008 1.00 0.00 N ATOM 1245 CA LYS A 78 13.310 0.146 9.998 1.00 0.00 C ATOM 1246 C LYS A 78 13.912 1.288 9.207 1.00 0.00 C ATOM 1247 O LYS A 78 14.751 2.041 9.702 1.00 0.00 O ATOM 1248 CB LYS A 78 13.840 -1.145 9.375 1.00 0.00 C ATOM 1249 CG LYS A 78 12.777 -2.012 8.753 1.00 0.00 C ATOM 1250 CD LYS A 78 12.202 -2.959 9.793 1.00 0.00 C ATOM 1251 CE LYS A 78 10.717 -3.200 9.587 1.00 0.00 C ATOM 1252 NZ LYS A 78 10.073 -3.774 10.801 1.00 0.00 N ATOM 0 H LYS A 78 11.382 -0.699 9.874 1.00 0.00 H new ATOM 0 HA LYS A 78 13.600 0.206 11.047 1.00 0.00 H new ATOM 0 HB2 LYS A 78 14.578 -0.892 8.614 1.00 0.00 H new ATOM 0 HB3 LYS A 78 14.358 -1.720 10.143 1.00 0.00 H new ATOM 0 HG2 LYS A 78 11.984 -1.389 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 78 13.199 -2.581 7.925 1.00 0.00 H new ATOM 0 HD2 LYS A 78 12.733 -3.910 9.749 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.367 -2.547 10.789 1.00 0.00 H new ATOM 0 HE2 LYS A 78 10.229 -2.260 9.328 1.00 0.00 H new ATOM 0 HE3 LYS A 78 10.573 -3.877 8.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 9.153 -3.314 10.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 9.931 -4.796 10.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 10.684 -3.613 11.627 1.00 0.00 H new ATOM 1266 N ILE A 79 13.499 1.374 7.956 1.00 0.00 N ATOM 1267 CA ILE A 79 14.016 2.384 7.055 1.00 0.00 C ATOM 1268 C ILE A 79 13.126 3.628 7.023 1.00 0.00 C ATOM 1269 O ILE A 79 13.599 4.716 6.698 1.00 0.00 O ATOM 1270 CB ILE A 79 14.211 1.840 5.613 1.00 0.00 C ATOM 1271 CG1 ILE A 79 13.384 0.566 5.382 1.00 0.00 C ATOM 1272 CG2 ILE A 79 15.696 1.587 5.322 1.00 0.00 C ATOM 1273 CD1 ILE A 79 11.905 0.853 5.275 1.00 0.00 C ATOM 0 H ILE A 79 12.804 0.753 7.541 1.00 0.00 H new ATOM 0 HA ILE A 79 14.993 2.665 7.448 1.00 0.00 H new ATOM 0 HB ILE A 79 13.852 2.600 4.919 1.00 0.00 H new ATOM 0 HG12 ILE A 79 13.723 0.076 4.470 1.00 0.00 H new ATOM 0 HG13 ILE A 79 13.558 -0.131 6.202 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.808 1.206 4.307 1.00 0.00 H new ATOM 0 HG22 ILE A 79 16.251 2.520 5.423 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.086 0.855 6.029 1.00 0.00 H new ATOM 0 HD11 ILE A 79 11.364 -0.079 5.112 1.00 0.00 H new ATOM 0 HD12 ILE A 79 11.557 1.318 6.197 1.00 0.00 H new ATOM 0 HD13 ILE A 79 11.725 1.528 4.438 1.00 0.00 H new ATOM 1285 N LEU A 80 11.839 3.461 7.367 1.00 0.00 N ATOM 1286 CA LEU A 80 10.868 4.572 7.383 1.00 0.00 C ATOM 1287 C LEU A 80 11.465 5.864 6.870 1.00 0.00 C ATOM 1288 O LEU A 80 12.038 6.642 7.631 1.00 0.00 O ATOM 1289 CB LEU A 80 10.307 4.780 8.787 1.00 0.00 C ATOM 1290 CG LEU A 80 8.786 4.693 8.872 1.00 0.00 C ATOM 1291 CD1 LEU A 80 8.314 4.973 10.289 1.00 0.00 C ATOM 1292 CD2 LEU A 80 8.143 5.659 7.884 1.00 0.00 C ATOM 0 H LEU A 80 11.443 2.562 7.640 1.00 0.00 H new ATOM 0 HA LEU A 80 10.058 4.291 6.709 1.00 0.00 H new ATOM 0 HB2 LEU A 80 10.740 4.034 9.453 1.00 0.00 H new ATOM 0 HB3 LEU A 80 10.625 5.757 9.152 1.00 0.00 H new ATOM 0 HG LEU A 80 8.480 3.681 8.608 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.227 4.907 10.330 1.00 0.00 H new ATOM 0 HD12 LEU A 80 8.748 4.240 10.969 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.628 5.974 10.586 1.00 0.00 H new ATOM 0 HD21 LEU A 80 7.058 5.585 7.957 1.00 0.00 H new ATOM 0 HD22 LEU A 80 8.454 6.678 8.116 1.00 0.00 H new ATOM 0 HD23 LEU A 80 8.457 5.406 6.871 1.00 0.00 H new ATOM 1304 N SER A 81 11.317 6.064 5.565 1.00 0.00 N ATOM 1305 CA SER A 81 11.820 7.245 4.875 1.00 0.00 C ATOM 1306 C SER A 81 12.466 8.248 5.827 1.00 0.00 C ATOM 1307 O SER A 81 11.790 8.866 6.648 1.00 0.00 O ATOM 1308 CB SER A 81 10.697 7.906 4.083 1.00 0.00 C ATOM 1309 OG SER A 81 9.425 7.585 4.619 1.00 0.00 O ATOM 0 H SER A 81 10.840 5.404 4.951 1.00 0.00 H new ATOM 0 HA SER A 81 12.600 6.913 4.190 1.00 0.00 H new ATOM 0 HB2 SER A 81 10.833 8.987 4.090 1.00 0.00 H new ATOM 0 HB3 SER A 81 10.746 7.585 3.043 1.00 0.00 H new ATOM 0 HG SER A 81 8.755 7.599 3.904 1.00 0.00 H new ATOM 1315 N GLU A 82 13.782 8.400 5.705 1.00 0.00 N ATOM 1316 CA GLU A 82 14.535 9.329 6.552 1.00 0.00 C ATOM 1317 C GLU A 82 13.775 10.643 6.752 1.00 0.00 C ATOM 1318 O GLU A 82 13.760 11.499 5.870 1.00 0.00 O ATOM 1319 CB GLU A 82 15.905 9.619 5.935 1.00 0.00 C ATOM 1320 CG GLU A 82 17.023 9.712 6.960 1.00 0.00 C ATOM 1321 CD GLU A 82 18.332 9.143 6.450 1.00 0.00 C ATOM 1322 OE1 GLU A 82 18.776 9.560 5.359 1.00 0.00 O ATOM 1323 OE2 GLU A 82 18.914 8.280 7.140 1.00 0.00 O ATOM 0 H GLU A 82 14.352 7.893 5.028 1.00 0.00 H new ATOM 0 HA GLU A 82 14.667 8.856 7.525 1.00 0.00 H new ATOM 0 HB2 GLU A 82 16.145 8.835 5.217 1.00 0.00 H new ATOM 0 HB3 GLU A 82 15.854 10.555 5.379 1.00 0.00 H new ATOM 0 HG2 GLU A 82 17.169 10.756 7.239 1.00 0.00 H new ATOM 0 HG3 GLU A 82 16.727 9.179 7.864 1.00 0.00 H new ATOM 1330 N PRO A 83 13.126 10.815 7.919 1.00 0.00 N ATOM 1331 CA PRO A 83 12.356 12.025 8.229 1.00 0.00 C ATOM 1332 C PRO A 83 13.074 13.313 7.837 1.00 0.00 C ATOM 1333 O PRO A 83 13.905 13.825 8.586 1.00 0.00 O ATOM 1334 CB PRO A 83 12.192 11.946 9.744 1.00 0.00 C ATOM 1335 CG PRO A 83 12.161 10.488 10.035 1.00 0.00 C ATOM 1336 CD PRO A 83 13.083 9.842 9.031 1.00 0.00 C ATOM 0 HA PRO A 83 11.418 12.059 7.675 1.00 0.00 H new ATOM 0 HB2 PRO A 83 13.017 12.437 10.260 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.275 12.436 10.071 1.00 0.00 H new ATOM 0 HG2 PRO A 83 12.492 10.287 11.054 1.00 0.00 H new ATOM 0 HG3 PRO A 83 11.149 10.094 9.945 1.00 0.00 H new ATOM 0 HD2 PRO A 83 14.074 9.669 9.451 1.00 0.00 H new ATOM 0 HD3 PRO A 83 12.703 8.875 8.702 1.00 0.00 H new ATOM 1344 N VAL A 84 12.730 13.840 6.666 1.00 0.00 N ATOM 1345 CA VAL A 84 13.324 15.080 6.183 1.00 0.00 C ATOM 1346 C VAL A 84 12.676 16.280 6.881 1.00 0.00 C ATOM 1347 O VAL A 84 13.346 17.258 7.213 1.00 0.00 O ATOM 1348 CB VAL A 84 13.157 15.227 4.656 1.00 0.00 C ATOM 1349 CG1 VAL A 84 11.695 15.090 4.261 1.00 0.00 C ATOM 1350 CG2 VAL A 84 13.731 16.553 4.169 1.00 0.00 C ATOM 0 H VAL A 84 12.043 13.427 6.035 1.00 0.00 H new ATOM 0 HA VAL A 84 14.389 15.049 6.413 1.00 0.00 H new ATOM 0 HB VAL A 84 13.716 14.425 4.175 1.00 0.00 H new ATOM 0 HG11 VAL A 84 11.598 15.197 3.181 1.00 0.00 H new ATOM 0 HG12 VAL A 84 11.327 14.110 4.563 1.00 0.00 H new ATOM 0 HG13 VAL A 84 11.110 15.865 4.756 1.00 0.00 H new ATOM 0 HG21 VAL A 84 13.601 16.631 3.090 1.00 0.00 H new ATOM 0 HG22 VAL A 84 13.211 17.376 4.658 1.00 0.00 H new ATOM 0 HG23 VAL A 84 14.793 16.600 4.410 1.00 0.00 H new ATOM 1360 N ASN A 85 11.361 16.187 7.097 1.00 0.00 N ATOM 1361 CA ASN A 85 10.594 17.250 7.752 1.00 0.00 C ATOM 1362 C ASN A 85 9.308 16.681 8.365 1.00 0.00 C ATOM 1363 O ASN A 85 9.259 15.508 8.734 1.00 0.00 O ATOM 1364 CB ASN A 85 10.259 18.364 6.752 1.00 0.00 C ATOM 1365 CG ASN A 85 11.441 18.749 5.884 1.00 0.00 C ATOM 1366 OD1 ASN A 85 11.527 18.355 4.721 1.00 0.00 O ATOM 1367 ND2 ASN A 85 12.360 19.526 6.446 1.00 0.00 N ATOM 0 H ASN A 85 10.801 15.379 6.825 1.00 0.00 H new ATOM 0 HA ASN A 85 11.203 17.673 8.551 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.437 18.039 6.115 1.00 0.00 H new ATOM 0 HB3 ASN A 85 9.912 19.242 7.296 1.00 0.00 H new ATOM 0 HD21 ASN A 85 13.177 19.819 5.910 1.00 0.00 H new ATOM 0 HD22 ASN A 85 12.249 19.830 7.413 1.00 0.00 H new ATOM 1374 N GLU A 86 8.269 17.511 8.464 1.00 0.00 N ATOM 1375 CA GLU A 86 6.993 17.084 9.020 1.00 0.00 C ATOM 1376 C GLU A 86 5.871 17.904 8.409 1.00 0.00 C ATOM 1377 O GLU A 86 5.930 19.133 8.399 1.00 0.00 O ATOM 1378 CB GLU A 86 6.986 17.237 10.541 1.00 0.00 C ATOM 1379 CG GLU A 86 8.269 16.766 11.207 1.00 0.00 C ATOM 1380 CD GLU A 86 8.150 16.695 12.717 1.00 0.00 C ATOM 1381 OE1 GLU A 86 7.028 16.462 13.213 1.00 0.00 O ATOM 1382 OE2 GLU A 86 9.179 16.872 13.403 1.00 0.00 O ATOM 0 H GLU A 86 8.291 18.486 8.164 1.00 0.00 H new ATOM 0 HA GLU A 86 6.843 16.031 8.782 1.00 0.00 H new ATOM 0 HB2 GLU A 86 6.820 18.285 10.791 1.00 0.00 H new ATOM 0 HB3 GLU A 86 6.147 16.675 10.950 1.00 0.00 H new ATOM 0 HG2 GLU A 86 8.535 15.782 10.821 1.00 0.00 H new ATOM 0 HG3 GLU A 86 9.081 17.443 10.942 1.00 0.00 H new ATOM 1389 N LEU A 87 4.853 17.230 7.887 1.00 0.00 N ATOM 1390 CA LEU A 87 3.743 17.943 7.268 1.00 0.00 C ATOM 1391 C LEU A 87 2.380 17.485 7.774 1.00 0.00 C ATOM 1392 O LEU A 87 1.574 16.916 7.037 1.00 0.00 O ATOM 1393 CB LEU A 87 3.777 17.832 5.761 1.00 0.00 C ATOM 1394 CG LEU A 87 4.478 16.607 5.199 1.00 0.00 C ATOM 1395 CD1 LEU A 87 3.985 15.348 5.901 1.00 0.00 C ATOM 1396 CD2 LEU A 87 4.247 16.534 3.697 1.00 0.00 C ATOM 0 H LEU A 87 4.773 16.213 7.879 1.00 0.00 H new ATOM 0 HA LEU A 87 3.876 18.985 7.558 1.00 0.00 H new ATOM 0 HB2 LEU A 87 2.751 17.840 5.393 1.00 0.00 H new ATOM 0 HB3 LEU A 87 4.266 18.721 5.362 1.00 0.00 H new ATOM 0 HG LEU A 87 5.550 16.685 5.378 1.00 0.00 H new ATOM 0 HD11 LEU A 87 4.496 14.478 5.488 1.00 0.00 H new ATOM 0 HD12 LEU A 87 4.196 15.420 6.968 1.00 0.00 H new ATOM 0 HD13 LEU A 87 2.911 15.244 5.749 1.00 0.00 H new ATOM 0 HD21 LEU A 87 4.750 15.655 3.294 1.00 0.00 H new ATOM 0 HD22 LEU A 87 3.178 16.464 3.496 1.00 0.00 H new ATOM 0 HD23 LEU A 87 4.647 17.430 3.223 1.00 0.00 H new ATOM 1408 N SER A 88 2.133 17.781 9.021 1.00 0.00 N ATOM 1409 CA SER A 88 0.864 17.466 9.672 1.00 0.00 C ATOM 1410 C SER A 88 -0.224 18.352 9.129 1.00 0.00 C ATOM 1411 O SER A 88 -1.344 17.910 8.936 1.00 0.00 O ATOM 1412 CB SER A 88 0.960 17.629 11.184 1.00 0.00 C ATOM 1413 OG SER A 88 1.991 16.821 11.725 1.00 0.00 O ATOM 0 H SER A 88 2.803 18.251 9.629 1.00 0.00 H new ATOM 0 HA SER A 88 0.625 16.424 9.460 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.149 18.674 11.428 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.008 17.362 11.642 1.00 0.00 H new ATOM 0 HG SER A 88 2.126 16.037 11.153 1.00 0.00 H new ATOM 1419 N THR A 89 0.110 19.604 8.859 1.00 0.00 N ATOM 1420 CA THR A 89 -0.866 20.523 8.306 1.00 0.00 C ATOM 1421 C THR A 89 -1.425 19.939 7.017 1.00 0.00 C ATOM 1422 O THR A 89 -2.548 20.240 6.611 1.00 0.00 O ATOM 1423 CB THR A 89 -0.229 21.881 8.030 1.00 0.00 C ATOM 1424 OG1 THR A 89 -1.232 22.865 7.848 1.00 0.00 O ATOM 1425 CG2 THR A 89 0.663 21.885 6.802 1.00 0.00 C ATOM 0 H THR A 89 1.037 20.001 9.012 1.00 0.00 H new ATOM 0 HA THR A 89 -1.672 20.665 9.026 1.00 0.00 H new ATOM 0 HB THR A 89 0.389 22.103 8.900 1.00 0.00 H new ATOM 0 HG1 THR A 89 -0.811 23.733 7.673 1.00 0.00 H new ATOM 0 HG21 THR A 89 1.085 22.880 6.662 1.00 0.00 H new ATOM 0 HG22 THR A 89 1.470 21.165 6.936 1.00 0.00 H new ATOM 0 HG23 THR A 89 0.076 21.613 5.925 1.00 0.00 H new ATOM 1433 N PHE A 90 -0.622 19.084 6.393 1.00 0.00 N ATOM 1434 CA PHE A 90 -1.012 18.424 5.158 1.00 0.00 C ATOM 1435 C PHE A 90 -1.640 17.064 5.462 1.00 0.00 C ATOM 1436 O PHE A 90 -1.897 16.267 4.560 1.00 0.00 O ATOM 1437 CB PHE A 90 0.209 18.256 4.261 1.00 0.00 C ATOM 1438 CG PHE A 90 0.569 19.488 3.483 1.00 0.00 C ATOM 1439 CD1 PHE A 90 -0.329 20.060 2.597 1.00 0.00 C ATOM 1440 CD2 PHE A 90 1.814 20.075 3.640 1.00 0.00 C ATOM 1441 CE1 PHE A 90 0.012 21.195 1.884 1.00 0.00 C ATOM 1442 CE2 PHE A 90 2.155 21.200 2.938 1.00 0.00 C ATOM 1443 CZ PHE A 90 1.258 21.765 2.058 1.00 0.00 C ATOM 0 H PHE A 90 0.308 18.832 6.727 1.00 0.00 H new ATOM 0 HA PHE A 90 -1.751 19.037 4.642 1.00 0.00 H new ATOM 0 HB2 PHE A 90 1.061 17.965 4.875 1.00 0.00 H new ATOM 0 HB3 PHE A 90 0.025 17.439 3.563 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -1.304 19.616 2.462 1.00 0.00 H new ATOM 0 HD2 PHE A 90 2.526 19.639 4.326 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -0.693 21.634 1.194 1.00 0.00 H new ATOM 0 HE2 PHE A 90 3.129 21.646 3.074 1.00 0.00 H new ATOM 0 HZ PHE A 90 1.529 22.652 1.505 1.00 0.00 H new ATOM 1453 N ARG A 91 -1.878 16.811 6.751 1.00 0.00 N ATOM 1454 CA ARG A 91 -2.468 15.558 7.215 1.00 0.00 C ATOM 1455 C ARG A 91 -3.620 15.103 6.325 1.00 0.00 C ATOM 1456 O ARG A 91 -3.630 13.966 5.853 1.00 0.00 O ATOM 1457 CB ARG A 91 -2.966 15.715 8.645 1.00 0.00 C ATOM 1458 CG ARG A 91 -3.715 16.999 8.811 1.00 0.00 C ATOM 1459 CD ARG A 91 -3.634 17.556 10.223 1.00 0.00 C ATOM 1460 NE ARG A 91 -4.897 17.417 10.943 1.00 0.00 N ATOM 1461 CZ ARG A 91 -5.301 16.288 11.522 1.00 0.00 C ATOM 1462 NH1 ARG A 91 -4.545 15.199 11.467 1.00 0.00 N ATOM 1463 NH2 ARG A 91 -6.464 16.249 12.157 1.00 0.00 N ATOM 0 H ARG A 91 -1.666 17.470 7.500 1.00 0.00 H new ATOM 0 HA ARG A 91 -1.689 14.797 7.171 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -3.612 14.876 8.903 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -2.121 15.690 9.333 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -3.320 17.736 8.112 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -4.761 16.840 8.549 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -2.846 17.039 10.771 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -3.355 18.609 10.181 1.00 0.00 H new ATOM 0 HE ARG A 91 -5.506 18.233 11.006 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -3.649 15.224 10.979 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -4.859 14.337 11.912 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -7.049 17.083 12.202 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -6.774 15.384 12.601 1.00 0.00 H new ATOM 1477 N ASN A 92 -4.596 15.982 6.100 1.00 0.00 N ATOM 1478 CA ASN A 92 -5.739 15.626 5.270 1.00 0.00 C ATOM 1479 C ASN A 92 -5.290 15.228 3.872 1.00 0.00 C ATOM 1480 O ASN A 92 -5.726 14.208 3.346 1.00 0.00 O ATOM 1481 CB ASN A 92 -6.763 16.759 5.187 1.00 0.00 C ATOM 1482 CG ASN A 92 -6.376 17.839 4.194 1.00 0.00 C ATOM 1483 OD1 ASN A 92 -6.601 17.565 2.913 1.00 0.00 O flip ATOM 1484 ND2 ASN A 92 -5.883 18.902 4.572 1.00 0.00 N flip ATOM 0 H ASN A 92 -4.617 16.930 6.475 1.00 0.00 H new ATOM 0 HA ASN A 92 -6.223 14.773 5.746 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -7.732 16.346 4.906 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -6.882 17.207 6.174 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -5.729 19.068 5.567 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -5.629 19.617 3.891 1.00 0.00 H new ATOM 1491 N GLU A 93 -4.407 16.032 3.275 1.00 0.00 N ATOM 1492 CA GLU A 93 -3.894 15.737 1.939 1.00 0.00 C ATOM 1493 C GLU A 93 -3.594 14.263 1.830 1.00 0.00 C ATOM 1494 O GLU A 93 -4.045 13.575 0.915 1.00 0.00 O ATOM 1495 CB GLU A 93 -2.599 16.494 1.672 1.00 0.00 C ATOM 1496 CG GLU A 93 -2.657 17.397 0.451 1.00 0.00 C ATOM 1497 CD GLU A 93 -3.278 18.746 0.753 1.00 0.00 C ATOM 1498 OE1 GLU A 93 -4.183 18.804 1.612 1.00 0.00 O ATOM 1499 OE2 GLU A 93 -2.861 19.745 0.130 1.00 0.00 O ATOM 0 H GLU A 93 -4.036 16.885 3.693 1.00 0.00 H new ATOM 0 HA GLU A 93 -4.651 16.039 1.215 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.354 17.097 2.547 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.789 15.776 1.543 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -1.649 17.544 0.064 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -3.231 16.904 -0.334 1.00 0.00 H new ATOM 1506 N ILE A 94 -2.818 13.796 2.793 1.00 0.00 N ATOM 1507 CA ILE A 94 -2.435 12.412 2.842 1.00 0.00 C ATOM 1508 C ILE A 94 -3.675 11.535 2.981 1.00 0.00 C ATOM 1509 O ILE A 94 -3.798 10.497 2.334 1.00 0.00 O ATOM 1510 CB ILE A 94 -1.482 12.137 4.016 1.00 0.00 C ATOM 1511 CG1 ILE A 94 -0.332 13.147 4.012 1.00 0.00 C ATOM 1512 CG2 ILE A 94 -0.952 10.714 3.943 1.00 0.00 C ATOM 1513 CD1 ILE A 94 0.043 13.644 5.390 1.00 0.00 C ATOM 0 H ILE A 94 -2.443 14.366 3.552 1.00 0.00 H new ATOM 0 HA ILE A 94 -1.915 12.175 1.914 1.00 0.00 H new ATOM 0 HB ILE A 94 -2.032 12.248 4.950 1.00 0.00 H new ATOM 0 HG12 ILE A 94 0.542 12.688 3.550 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -0.610 13.999 3.391 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -0.278 10.533 4.781 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -1.785 10.013 3.989 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -0.412 10.574 3.006 1.00 0.00 H new ATOM 0 HD11 ILE A 94 0.864 14.356 5.309 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -0.817 14.133 5.847 1.00 0.00 H new ATOM 0 HD13 ILE A 94 0.353 12.802 6.009 1.00 0.00 H new ATOM 1525 N ILE A 95 -4.602 11.982 3.831 1.00 0.00 N ATOM 1526 CA ILE A 95 -5.848 11.263 4.062 1.00 0.00 C ATOM 1527 C ILE A 95 -6.728 11.294 2.818 1.00 0.00 C ATOM 1528 O ILE A 95 -6.905 10.271 2.165 1.00 0.00 O ATOM 1529 CB ILE A 95 -6.641 11.852 5.247 1.00 0.00 C ATOM 1530 CG1 ILE A 95 -5.770 11.908 6.500 1.00 0.00 C ATOM 1531 CG2 ILE A 95 -7.896 11.032 5.509 1.00 0.00 C ATOM 1532 CD1 ILE A 95 -6.187 12.989 7.475 1.00 0.00 C ATOM 0 H ILE A 95 -4.509 12.842 4.371 1.00 0.00 H new ATOM 0 HA ILE A 95 -5.577 10.234 4.299 1.00 0.00 H new ATOM 0 HB ILE A 95 -6.940 12.868 4.989 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -5.807 10.942 7.003 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -4.734 12.074 6.206 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -8.443 11.462 6.348 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -8.528 11.041 4.621 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -7.617 10.005 5.746 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -5.526 12.972 8.342 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -6.123 13.962 6.988 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -7.213 12.812 7.798 1.00 0.00 H new ATOM 1544 N ALA A 96 -7.280 12.472 2.490 1.00 0.00 N ATOM 1545 CA ALA A 96 -8.144 12.612 1.311 1.00 0.00 C ATOM 1546 C ALA A 96 -7.683 11.687 0.188 1.00 0.00 C ATOM 1547 O ALA A 96 -8.487 10.971 -0.406 1.00 0.00 O ATOM 1548 CB ALA A 96 -8.179 14.061 0.842 1.00 0.00 C ATOM 0 H ALA A 96 -7.145 13.333 3.020 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.156 12.321 1.592 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -8.824 14.145 -0.032 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -8.567 14.693 1.641 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -7.171 14.384 0.581 1.00 0.00 H new ATOM 1554 N ALA A 97 -6.372 11.659 -0.053 1.00 0.00 N ATOM 1555 CA ALA A 97 -5.798 10.761 -1.052 1.00 0.00 C ATOM 1556 C ALA A 97 -6.328 9.377 -0.795 1.00 0.00 C ATOM 1557 O ALA A 97 -7.150 8.845 -1.533 1.00 0.00 O ATOM 1558 CB ALA A 97 -4.283 10.754 -0.922 1.00 0.00 C ATOM 0 H ALA A 97 -5.691 12.246 0.429 1.00 0.00 H new ATOM 0 HA ALA A 97 -6.066 11.092 -2.055 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -3.857 10.083 -1.668 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.900 11.762 -1.079 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.005 10.411 0.075 1.00 0.00 H new ATOM 1564 N ILE A 98 -5.876 8.844 0.313 1.00 0.00 N ATOM 1565 CA ILE A 98 -6.285 7.560 0.798 1.00 0.00 C ATOM 1566 C ILE A 98 -7.806 7.496 0.838 1.00 0.00 C ATOM 1567 O ILE A 98 -8.451 6.734 0.127 1.00 0.00 O ATOM 1568 CB ILE A 98 -5.719 7.433 2.220 1.00 0.00 C ATOM 1569 CG1 ILE A 98 -4.246 7.020 2.165 1.00 0.00 C ATOM 1570 CG2 ILE A 98 -6.527 6.471 3.090 1.00 0.00 C ATOM 1571 CD1 ILE A 98 -3.814 6.181 3.343 1.00 0.00 C ATOM 0 H ILE A 98 -5.195 9.308 0.915 1.00 0.00 H new ATOM 0 HA ILE A 98 -5.925 6.755 0.158 1.00 0.00 H new ATOM 0 HB ILE A 98 -5.797 8.413 2.691 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -4.067 6.462 1.246 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -3.627 7.916 2.120 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -6.083 6.419 4.084 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -7.554 6.827 3.169 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -6.521 5.479 2.638 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -2.760 5.924 3.240 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -3.961 6.744 4.264 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -4.408 5.268 3.377 1.00 0.00 H new ATOM 1583 N ASP A 99 -8.343 8.332 1.698 1.00 0.00 N ATOM 1584 CA ASP A 99 -9.767 8.453 1.925 1.00 0.00 C ATOM 1585 C ASP A 99 -10.601 8.505 0.638 1.00 0.00 C ATOM 1586 O ASP A 99 -11.786 8.175 0.660 1.00 0.00 O ATOM 1587 CB ASP A 99 -9.997 9.705 2.762 1.00 0.00 C ATOM 1588 CG ASP A 99 -11.012 9.494 3.869 1.00 0.00 C ATOM 1589 OD1 ASP A 99 -11.379 8.329 4.127 1.00 0.00 O ATOM 1590 OD2 ASP A 99 -11.439 10.497 4.480 1.00 0.00 O ATOM 0 H ASP A 99 -7.787 8.964 2.275 1.00 0.00 H new ATOM 0 HA ASP A 99 -10.104 7.555 2.444 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.051 10.023 3.199 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -10.336 10.513 2.113 1.00 0.00 H new ATOM 1595 N PHE A 100 -10.002 8.917 -0.476 1.00 0.00 N ATOM 1596 CA PHE A 100 -10.733 8.998 -1.736 1.00 0.00 C ATOM 1597 C PHE A 100 -10.346 7.851 -2.647 1.00 0.00 C ATOM 1598 O PHE A 100 -11.161 7.314 -3.398 1.00 0.00 O ATOM 1599 CB PHE A 100 -10.453 10.335 -2.426 1.00 0.00 C ATOM 1600 CG PHE A 100 -11.129 10.481 -3.761 1.00 0.00 C ATOM 1601 CD1 PHE A 100 -12.506 10.369 -3.870 1.00 0.00 C ATOM 1602 CD2 PHE A 100 -10.387 10.731 -4.905 1.00 0.00 C ATOM 1603 CE1 PHE A 100 -13.130 10.502 -5.096 1.00 0.00 C ATOM 1604 CE2 PHE A 100 -11.006 10.865 -6.133 1.00 0.00 C ATOM 1605 CZ PHE A 100 -12.380 10.751 -6.228 1.00 0.00 C ATOM 0 H PHE A 100 -9.023 9.197 -0.532 1.00 0.00 H new ATOM 0 HA PHE A 100 -11.800 8.929 -1.522 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -10.778 11.145 -1.774 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -9.377 10.446 -2.560 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -13.098 10.176 -2.987 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -9.313 10.822 -4.836 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -14.204 10.411 -5.168 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -10.417 11.059 -7.017 1.00 0.00 H new ATOM 0 HZ PHE A 100 -12.866 10.857 -7.186 1.00 0.00 H new ATOM 1615 N LEU A 101 -9.073 7.519 -2.583 1.00 0.00 N ATOM 1616 CA LEU A 101 -8.490 6.476 -3.395 1.00 0.00 C ATOM 1617 C LEU A 101 -8.817 5.091 -2.863 1.00 0.00 C ATOM 1618 O LEU A 101 -9.074 4.166 -3.634 1.00 0.00 O ATOM 1619 CB LEU A 101 -6.986 6.728 -3.450 1.00 0.00 C ATOM 1620 CG LEU A 101 -6.086 5.859 -2.579 1.00 0.00 C ATOM 1621 CD1 LEU A 101 -5.603 4.647 -3.360 1.00 0.00 C ATOM 1622 CD2 LEU A 101 -4.901 6.679 -2.089 1.00 0.00 C ATOM 0 H LEU A 101 -8.408 7.973 -1.957 1.00 0.00 H new ATOM 0 HA LEU A 101 -8.911 6.504 -4.400 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -6.665 6.611 -4.485 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.811 7.769 -3.178 1.00 0.00 H new ATOM 0 HG LEU A 101 -6.656 5.508 -1.719 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.962 4.037 -2.724 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.461 4.057 -3.683 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -5.040 4.977 -4.233 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.259 6.055 -1.467 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -4.333 7.044 -2.944 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.261 7.526 -1.505 1.00 0.00 H new ATOM 1634 N ILE A 102 -8.810 4.948 -1.548 1.00 0.00 N ATOM 1635 CA ILE A 102 -9.111 3.670 -0.938 1.00 0.00 C ATOM 1636 C ILE A 102 -10.434 3.697 -0.182 1.00 0.00 C ATOM 1637 O ILE A 102 -10.949 2.648 0.205 1.00 0.00 O ATOM 1638 CB ILE A 102 -7.967 3.193 -0.021 1.00 0.00 C ATOM 1639 CG1 ILE A 102 -7.584 4.242 1.027 1.00 0.00 C ATOM 1640 CG2 ILE A 102 -6.757 2.859 -0.876 1.00 0.00 C ATOM 1641 CD1 ILE A 102 -8.707 4.593 1.974 1.00 0.00 C ATOM 0 H ILE A 102 -8.600 5.698 -0.889 1.00 0.00 H new ATOM 0 HA ILE A 102 -9.210 2.952 -1.752 1.00 0.00 H new ATOM 0 HB ILE A 102 -8.314 2.311 0.518 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.736 3.873 1.604 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -7.254 5.147 0.518 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.942 2.520 -0.236 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -7.017 2.070 -1.581 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.443 3.747 -1.425 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -8.361 5.341 2.687 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.549 4.993 1.408 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -9.023 3.699 2.511 1.00 0.00 H new ATOM 1653 N THR A 103 -10.995 4.891 0.028 1.00 0.00 N ATOM 1654 CA THR A 103 -12.267 4.992 0.742 1.00 0.00 C ATOM 1655 C THR A 103 -13.295 5.822 -0.024 1.00 0.00 C ATOM 1656 O THR A 103 -14.484 5.786 0.294 1.00 0.00 O ATOM 1657 CB THR A 103 -12.040 5.561 2.143 1.00 0.00 C ATOM 1658 OG1 THR A 103 -11.265 4.664 2.924 1.00 0.00 O ATOM 1659 CG2 THR A 103 -13.323 5.837 2.900 1.00 0.00 C ATOM 0 H THR A 103 -10.599 5.780 -0.278 1.00 0.00 H new ATOM 0 HA THR A 103 -12.677 3.986 0.830 1.00 0.00 H new ATOM 0 HB THR A 103 -11.522 6.508 1.989 1.00 0.00 H new ATOM 0 HG1 THR A 103 -11.194 3.804 2.460 1.00 0.00 H new ATOM 0 HG21 THR A 103 -13.085 6.239 3.885 1.00 0.00 H new ATOM 0 HG22 THR A 103 -13.923 6.561 2.348 1.00 0.00 H new ATOM 0 HG23 THR A 103 -13.886 4.910 3.012 1.00 0.00 H new ATOM 1667 N GLY A 104 -12.846 6.554 -1.038 1.00 0.00 N ATOM 1668 CA GLY A 104 -13.758 7.360 -1.831 1.00 0.00 C ATOM 1669 C GLY A 104 -14.742 8.151 -0.987 1.00 0.00 C ATOM 1670 O GLY A 104 -15.945 8.130 -1.247 1.00 0.00 O ATOM 0 H GLY A 104 -11.869 6.604 -1.325 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -13.182 8.049 -2.448 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -14.311 6.711 -2.510 1.00 0.00 H new ATOM 1674 N ILE A 105 -14.236 8.845 0.028 1.00 0.00 N ATOM 1675 CA ILE A 105 -15.089 9.637 0.909 1.00 0.00 C ATOM 1676 C ILE A 105 -15.914 10.650 0.120 1.00 0.00 C ATOM 1677 O ILE A 105 -16.711 11.379 0.747 1.00 0.00 O ATOM 1678 CB ILE A 105 -14.272 10.379 1.988 1.00 0.00 C ATOM 1679 CG1 ILE A 105 -13.004 11.006 1.394 1.00 0.00 C ATOM 1680 CG2 ILE A 105 -13.913 9.429 3.120 1.00 0.00 C ATOM 1681 CD1 ILE A 105 -13.249 11.842 0.156 1.00 0.00 C ATOM 1682 OXT ILE A 105 -15.755 10.705 -1.118 1.00 0.00 O ATOM 0 H ILE A 105 -13.243 8.875 0.261 1.00 0.00 H new ATOM 0 HA ILE A 105 -15.759 8.933 1.402 1.00 0.00 H new ATOM 0 HB ILE A 105 -14.889 11.186 2.384 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -12.530 11.629 2.152 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -12.299 10.211 1.149 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -13.337 9.964 3.875 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -14.826 9.038 3.570 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -13.319 8.604 2.728 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -12.303 12.249 -0.201 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -13.693 11.220 -0.621 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -13.928 12.660 0.398 1.00 0.00 H new ATOM 1695 N MET B 1 -13.005 -5.161 -14.461 1.00 0.00 N ATOM 1696 CA MET B 1 -12.657 -4.818 -13.057 1.00 0.00 C ATOM 1697 C MET B 1 -11.305 -5.406 -12.665 1.00 0.00 C ATOM 1698 O MET B 1 -10.657 -6.085 -13.462 1.00 0.00 O ATOM 1699 CB MET B 1 -13.754 -5.358 -12.138 1.00 0.00 C ATOM 1700 CG MET B 1 -15.138 -4.820 -12.463 1.00 0.00 C ATOM 1701 SD MET B 1 -16.295 -5.006 -11.092 1.00 0.00 S ATOM 1702 CE MET B 1 -17.792 -4.345 -11.819 1.00 0.00 C ATOM 0 H1 MET B 1 -13.383 -4.319 -14.940 1.00 0.00 H new ATOM 0 H2 MET B 1 -12.153 -5.490 -14.959 1.00 0.00 H new ATOM 0 H3 MET B 1 -13.722 -5.914 -14.467 1.00 0.00 H new ATOM 0 HA MET B 1 -12.584 -3.735 -12.960 1.00 0.00 H new ATOM 0 HB2 MET B 1 -13.771 -6.446 -12.206 1.00 0.00 H new ATOM 0 HB3 MET B 1 -13.509 -5.107 -11.106 1.00 0.00 H new ATOM 0 HG2 MET B 1 -15.061 -3.765 -12.728 1.00 0.00 H new ATOM 0 HG3 MET B 1 -15.530 -5.340 -13.337 1.00 0.00 H new ATOM 0 HE1 MET B 1 -18.602 -4.392 -11.091 1.00 0.00 H new ATOM 0 HE2 MET B 1 -17.627 -3.308 -12.112 1.00 0.00 H new ATOM 0 HE3 MET B 1 -18.060 -4.932 -12.697 1.00 0.00 H new ATOM 1714 N SER B 2 -10.886 -5.140 -11.432 1.00 0.00 N ATOM 1715 CA SER B 2 -9.611 -5.643 -10.934 1.00 0.00 C ATOM 1716 C SER B 2 -9.694 -5.974 -9.445 1.00 0.00 C ATOM 1717 O SER B 2 -9.213 -5.208 -8.611 1.00 0.00 O ATOM 1718 CB SER B 2 -8.499 -4.611 -11.162 1.00 0.00 C ATOM 1719 OG SER B 2 -7.243 -5.249 -11.313 1.00 0.00 O ATOM 0 H SER B 2 -11.410 -4.580 -10.760 1.00 0.00 H new ATOM 0 HA SER B 2 -9.379 -6.554 -11.485 1.00 0.00 H new ATOM 0 HB2 SER B 2 -8.721 -4.021 -12.051 1.00 0.00 H new ATOM 0 HB3 SER B 2 -8.461 -3.919 -10.321 1.00 0.00 H new ATOM 0 HG SER B 2 -7.186 -6.009 -10.696 1.00 0.00 H new ATOM 1725 N GLN B 3 -10.298 -7.112 -9.103 1.00 0.00 N ATOM 1726 CA GLN B 3 -10.413 -7.498 -7.698 1.00 0.00 C ATOM 1727 C GLN B 3 -11.170 -8.810 -7.502 1.00 0.00 C ATOM 1728 O GLN B 3 -11.886 -9.275 -8.388 1.00 0.00 O ATOM 1729 CB GLN B 3 -11.109 -6.390 -6.903 1.00 0.00 C ATOM 1730 CG GLN B 3 -12.367 -5.860 -7.572 1.00 0.00 C ATOM 1731 CD GLN B 3 -12.891 -4.599 -6.912 1.00 0.00 C ATOM 1732 OE1 GLN B 3 -12.028 -3.598 -6.779 1.00 0.00 O flip ATOM 1733 NE2 GLN B 3 -14.057 -4.526 -6.527 1.00 0.00 N flip ATOM 0 H GLN B 3 -10.708 -7.771 -9.765 1.00 0.00 H new ATOM 0 HA GLN B 3 -9.397 -7.648 -7.332 1.00 0.00 H new ATOM 0 HB2 GLN B 3 -11.366 -6.770 -5.914 1.00 0.00 H new ATOM 0 HB3 GLN B 3 -10.411 -5.566 -6.756 1.00 0.00 H new ATOM 0 HG2 GLN B 3 -12.157 -5.656 -8.622 1.00 0.00 H new ATOM 0 HG3 GLN B 3 -13.140 -6.628 -7.545 1.00 0.00 H new ATOM 0 HE21 GLN B 3 -14.685 -5.320 -6.650 1.00 0.00 H new ATOM 0 HE22 GLN B 3 -14.396 -3.671 -6.085 1.00 0.00 H new ATOM 1742 N PHE B 4 -11.013 -9.370 -6.301 1.00 0.00 N ATOM 1743 CA PHE B 4 -11.680 -10.609 -5.893 1.00 0.00 C ATOM 1744 C PHE B 4 -11.056 -11.866 -6.500 1.00 0.00 C ATOM 1745 O PHE B 4 -11.714 -12.901 -6.600 1.00 0.00 O ATOM 1746 CB PHE B 4 -13.179 -10.541 -6.201 1.00 0.00 C ATOM 1747 CG PHE B 4 -13.932 -9.594 -5.299 1.00 0.00 C ATOM 1748 CD1 PHE B 4 -13.260 -8.650 -4.531 1.00 0.00 C ATOM 1749 CD2 PHE B 4 -15.314 -9.648 -5.222 1.00 0.00 C ATOM 1750 CE1 PHE B 4 -13.950 -7.783 -3.707 1.00 0.00 C ATOM 1751 CE2 PHE B 4 -16.011 -8.782 -4.398 1.00 0.00 C ATOM 1752 CZ PHE B 4 -15.328 -7.849 -3.640 1.00 0.00 C ATOM 0 H PHE B 4 -10.414 -8.973 -5.577 1.00 0.00 H new ATOM 0 HA PHE B 4 -11.538 -10.693 -4.815 1.00 0.00 H new ATOM 0 HB2 PHE B 4 -13.316 -10.231 -7.237 1.00 0.00 H new ATOM 0 HB3 PHE B 4 -13.608 -11.539 -6.107 1.00 0.00 H new ATOM 0 HD1 PHE B 4 -12.183 -8.594 -4.580 1.00 0.00 H new ATOM 0 HD2 PHE B 4 -15.854 -10.374 -5.812 1.00 0.00 H new ATOM 0 HE1 PHE B 4 -13.414 -7.055 -3.116 1.00 0.00 H new ATOM 0 HE2 PHE B 4 -17.088 -8.835 -4.347 1.00 0.00 H new ATOM 0 HZ PHE B 4 -15.871 -7.173 -2.996 1.00 0.00 H new ATOM 1762 N THR B 5 -9.779 -11.791 -6.864 1.00 0.00 N ATOM 1763 CA THR B 5 -9.077 -12.941 -7.408 1.00 0.00 C ATOM 1764 C THR B 5 -7.890 -13.280 -6.520 1.00 0.00 C ATOM 1765 O THR B 5 -7.340 -12.410 -5.845 1.00 0.00 O ATOM 1766 CB THR B 5 -8.577 -12.659 -8.821 1.00 0.00 C ATOM 1767 OG1 THR B 5 -9.398 -11.706 -9.471 1.00 0.00 O ATOM 1768 CG2 THR B 5 -8.509 -13.890 -9.701 1.00 0.00 C ATOM 0 H THR B 5 -9.213 -10.946 -6.791 1.00 0.00 H new ATOM 0 HA THR B 5 -9.773 -13.779 -7.443 1.00 0.00 H new ATOM 0 HB THR B 5 -7.564 -12.278 -8.688 1.00 0.00 H new ATOM 0 HG1 THR B 5 -8.845 -11.135 -10.044 1.00 0.00 H new ATOM 0 HG21 THR B 5 -8.145 -13.611 -10.690 1.00 0.00 H new ATOM 0 HG22 THR B 5 -7.830 -14.618 -9.257 1.00 0.00 H new ATOM 0 HG23 THR B 5 -9.503 -14.328 -9.791 1.00 0.00 H new ATOM 1776 N LEU B 6 -7.484 -14.536 -6.540 1.00 0.00 N ATOM 1777 CA LEU B 6 -6.343 -14.975 -5.756 1.00 0.00 C ATOM 1778 C LEU B 6 -5.088 -14.835 -6.595 1.00 0.00 C ATOM 1779 O LEU B 6 -4.571 -15.821 -7.121 1.00 0.00 O ATOM 1780 CB LEU B 6 -6.526 -16.430 -5.323 1.00 0.00 C ATOM 1781 CG LEU B 6 -5.927 -16.782 -3.963 1.00 0.00 C ATOM 1782 CD1 LEU B 6 -6.487 -18.104 -3.470 1.00 0.00 C ATOM 1783 CD2 LEU B 6 -4.409 -16.839 -4.049 1.00 0.00 C ATOM 0 H LEU B 6 -7.927 -15.271 -7.091 1.00 0.00 H new ATOM 0 HA LEU B 6 -6.257 -14.359 -4.861 1.00 0.00 H new ATOM 0 HB2 LEU B 6 -7.592 -16.655 -5.302 1.00 0.00 H new ATOM 0 HB3 LEU B 6 -6.078 -17.076 -6.078 1.00 0.00 H new ATOM 0 HG LEU B 6 -6.198 -16.004 -3.249 1.00 0.00 H new ATOM 0 HD11 LEU B 6 -6.052 -18.344 -2.500 1.00 0.00 H new ATOM 0 HD12 LEU B 6 -7.570 -18.027 -3.373 1.00 0.00 H new ATOM 0 HD13 LEU B 6 -6.241 -18.892 -4.182 1.00 0.00 H new ATOM 0 HD21 LEU B 6 -3.998 -17.091 -3.071 1.00 0.00 H new ATOM 0 HD22 LEU B 6 -4.114 -17.598 -4.773 1.00 0.00 H new ATOM 0 HD23 LEU B 6 -4.026 -15.869 -4.364 1.00 0.00 H new ATOM 1795 N TYR B 7 -4.615 -13.603 -6.759 1.00 0.00 N ATOM 1796 CA TYR B 7 -3.441 -13.379 -7.587 1.00 0.00 C ATOM 1797 C TYR B 7 -2.144 -13.697 -6.858 1.00 0.00 C ATOM 1798 O TYR B 7 -1.785 -13.037 -5.887 1.00 0.00 O ATOM 1799 CB TYR B 7 -3.398 -11.930 -8.127 1.00 0.00 C ATOM 1800 CG TYR B 7 -4.733 -11.309 -8.505 1.00 0.00 C ATOM 1801 CD1 TYR B 7 -5.710 -11.012 -7.551 1.00 0.00 C ATOM 1802 CD2 TYR B 7 -4.992 -10.971 -9.828 1.00 0.00 C ATOM 1803 CE1 TYR B 7 -6.898 -10.406 -7.918 1.00 0.00 C ATOM 1804 CE2 TYR B 7 -6.176 -10.361 -10.196 1.00 0.00 C ATOM 1805 CZ TYR B 7 -7.125 -10.080 -9.239 1.00 0.00 C ATOM 1806 OH TYR B 7 -8.305 -9.473 -9.602 1.00 0.00 O ATOM 0 H TYR B 7 -5.017 -12.765 -6.340 1.00 0.00 H new ATOM 0 HA TYR B 7 -3.528 -14.068 -8.427 1.00 0.00 H new ATOM 0 HB2 TYR B 7 -2.929 -11.298 -7.373 1.00 0.00 H new ATOM 0 HB3 TYR B 7 -2.752 -11.912 -9.005 1.00 0.00 H new ATOM 0 HD1 TYR B 7 -5.535 -11.259 -6.514 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -4.253 -11.190 -10.584 1.00 0.00 H new ATOM 0 HE1 TYR B 7 -7.647 -10.188 -7.171 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -6.356 -10.106 -11.230 1.00 0.00 H new ATOM 0 HH TYR B 7 -9.040 -9.842 -9.069 1.00 0.00 H new ATOM 1816 N LYS B 8 -1.424 -14.692 -7.388 1.00 0.00 N ATOM 1817 CA LYS B 8 -0.130 -15.101 -6.847 1.00 0.00 C ATOM 1818 C LYS B 8 0.991 -14.367 -7.558 1.00 0.00 C ATOM 1819 O LYS B 8 1.121 -14.462 -8.769 1.00 0.00 O ATOM 1820 CB LYS B 8 0.069 -16.608 -6.997 1.00 0.00 C ATOM 1821 CG LYS B 8 1.531 -17.051 -6.983 1.00 0.00 C ATOM 1822 CD LYS B 8 1.829 -17.962 -5.801 1.00 0.00 C ATOM 1823 CE LYS B 8 2.598 -19.201 -6.231 1.00 0.00 C ATOM 1824 NZ LYS B 8 2.638 -20.231 -5.156 1.00 0.00 N ATOM 0 H LYS B 8 -1.723 -15.232 -8.200 1.00 0.00 H new ATOM 0 HA LYS B 8 -0.111 -14.849 -5.787 1.00 0.00 H new ATOM 0 HB2 LYS B 8 -0.460 -17.115 -6.190 1.00 0.00 H new ATOM 0 HB3 LYS B 8 -0.388 -16.932 -7.932 1.00 0.00 H new ATOM 0 HG2 LYS B 8 1.763 -17.572 -7.912 1.00 0.00 H new ATOM 0 HG3 LYS B 8 2.177 -16.174 -6.939 1.00 0.00 H new ATOM 0 HD2 LYS B 8 2.406 -17.415 -5.055 1.00 0.00 H new ATOM 0 HD3 LYS B 8 0.895 -18.260 -5.325 1.00 0.00 H new ATOM 0 HE2 LYS B 8 2.135 -19.624 -7.122 1.00 0.00 H new ATOM 0 HE3 LYS B 8 3.616 -18.920 -6.503 1.00 0.00 H new ATOM 0 HZ1 LYS B 8 3.320 -20.974 -5.412 1.00 0.00 H new ATOM 0 HZ2 LYS B 8 2.929 -19.788 -4.261 1.00 0.00 H new ATOM 0 HZ3 LYS B 8 1.694 -20.652 -5.043 1.00 0.00 H new ATOM 1838 N ASN B 9 1.797 -13.651 -6.784 1.00 0.00 N ATOM 1839 CA ASN B 9 2.926 -12.882 -7.293 1.00 0.00 C ATOM 1840 C ASN B 9 3.206 -13.132 -8.775 1.00 0.00 C ATOM 1841 O ASN B 9 3.468 -14.264 -9.180 1.00 0.00 O ATOM 1842 CB ASN B 9 4.177 -13.186 -6.472 1.00 0.00 C ATOM 1843 CG ASN B 9 4.282 -12.318 -5.233 1.00 0.00 C ATOM 1844 OD1 ASN B 9 3.539 -12.502 -4.269 1.00 0.00 O ATOM 1845 ND2 ASN B 9 5.207 -11.366 -5.254 1.00 0.00 N ATOM 0 H ASN B 9 1.684 -13.587 -5.772 1.00 0.00 H new ATOM 0 HA ASN B 9 2.657 -11.830 -7.195 1.00 0.00 H new ATOM 0 HB2 ASN B 9 4.168 -14.235 -6.177 1.00 0.00 H new ATOM 0 HB3 ASN B 9 5.060 -13.037 -7.093 1.00 0.00 H new ATOM 0 HD21 ASN B 9 5.324 -10.751 -4.449 1.00 0.00 H new ATOM 0 HD22 ASN B 9 5.801 -11.250 -6.075 1.00 0.00 H new ATOM 1852 N LYS B 10 3.156 -12.046 -9.559 1.00 0.00 N ATOM 1853 CA LYS B 10 3.414 -12.060 -11.014 1.00 0.00 C ATOM 1854 C LYS B 10 4.075 -13.349 -11.468 1.00 0.00 C ATOM 1855 O LYS B 10 3.675 -13.971 -12.450 1.00 0.00 O ATOM 1856 CB LYS B 10 4.331 -10.908 -11.391 1.00 0.00 C ATOM 1857 CG LYS B 10 4.753 -10.099 -10.195 1.00 0.00 C ATOM 1858 CD LYS B 10 5.386 -10.985 -9.135 1.00 0.00 C ATOM 1859 CE LYS B 10 6.847 -10.636 -8.899 1.00 0.00 C ATOM 1860 NZ LYS B 10 7.054 -9.165 -8.785 1.00 0.00 N ATOM 0 H LYS B 10 2.932 -11.118 -9.200 1.00 0.00 H new ATOM 0 HA LYS B 10 2.445 -11.968 -11.505 1.00 0.00 H new ATOM 0 HB2 LYS B 10 5.216 -11.300 -11.892 1.00 0.00 H new ATOM 0 HB3 LYS B 10 3.822 -10.260 -12.104 1.00 0.00 H new ATOM 0 HG2 LYS B 10 5.462 -9.331 -10.503 1.00 0.00 H new ATOM 0 HG3 LYS B 10 3.888 -9.585 -9.776 1.00 0.00 H new ATOM 0 HD2 LYS B 10 4.834 -10.884 -8.201 1.00 0.00 H new ATOM 0 HD3 LYS B 10 5.307 -12.028 -9.440 1.00 0.00 H new ATOM 0 HE2 LYS B 10 7.194 -11.123 -7.988 1.00 0.00 H new ATOM 0 HE3 LYS B 10 7.451 -11.025 -9.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 7.807 -8.973 -8.093 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 7.329 -8.780 -9.711 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 6.171 -8.714 -8.471 1.00 0.00 H new ATOM 1874 N ASP B 11 5.108 -13.715 -10.731 1.00 0.00 N ATOM 1875 CA ASP B 11 5.875 -14.895 -10.992 1.00 0.00 C ATOM 1876 C ASP B 11 5.831 -15.799 -9.759 1.00 0.00 C ATOM 1877 O ASP B 11 6.337 -15.439 -8.697 1.00 0.00 O ATOM 1878 CB ASP B 11 7.304 -14.481 -11.344 1.00 0.00 C ATOM 1879 CG ASP B 11 7.935 -15.393 -12.378 1.00 0.00 C ATOM 1880 OD1 ASP B 11 7.927 -16.624 -12.167 1.00 0.00 O ATOM 1881 OD2 ASP B 11 8.438 -14.876 -13.398 1.00 0.00 O ATOM 0 H ASP B 11 5.434 -13.184 -9.923 1.00 0.00 H new ATOM 0 HA ASP B 11 5.465 -15.454 -11.833 1.00 0.00 H new ATOM 0 HB2 ASP B 11 7.300 -13.458 -11.721 1.00 0.00 H new ATOM 0 HB3 ASP B 11 7.913 -14.486 -10.440 1.00 0.00 H new ATOM 1886 N LYS B 12 5.185 -16.957 -9.897 1.00 0.00 N ATOM 1887 CA LYS B 12 5.027 -17.897 -8.783 1.00 0.00 C ATOM 1888 C LYS B 12 6.335 -18.124 -8.016 1.00 0.00 C ATOM 1889 O LYS B 12 6.310 -18.566 -6.867 1.00 0.00 O ATOM 1890 CB LYS B 12 4.461 -19.230 -9.290 1.00 0.00 C ATOM 1891 CG LYS B 12 3.055 -19.117 -9.877 1.00 0.00 C ATOM 1892 CD LYS B 12 3.081 -19.166 -11.397 1.00 0.00 C ATOM 1893 CE LYS B 12 2.790 -20.566 -11.914 1.00 0.00 C ATOM 1894 NZ LYS B 12 3.403 -20.802 -13.250 1.00 0.00 N ATOM 0 H LYS B 12 4.761 -17.269 -10.771 1.00 0.00 H new ATOM 0 HA LYS B 12 4.323 -17.450 -8.081 1.00 0.00 H new ATOM 0 HB2 LYS B 12 5.131 -19.634 -10.049 1.00 0.00 H new ATOM 0 HB3 LYS B 12 4.445 -19.944 -8.467 1.00 0.00 H new ATOM 0 HG2 LYS B 12 2.434 -19.928 -9.496 1.00 0.00 H new ATOM 0 HG3 LYS B 12 2.597 -18.184 -9.550 1.00 0.00 H new ATOM 0 HD2 LYS B 12 2.345 -18.469 -11.797 1.00 0.00 H new ATOM 0 HD3 LYS B 12 4.057 -18.840 -11.756 1.00 0.00 H new ATOM 0 HE2 LYS B 12 3.170 -21.301 -11.205 1.00 0.00 H new ATOM 0 HE3 LYS B 12 1.712 -20.713 -11.978 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 3.182 -21.767 -13.568 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 3.021 -20.117 -13.933 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 4.435 -20.687 -13.184 1.00 0.00 H new ATOM 1908 N SER B 13 7.472 -17.811 -8.634 1.00 0.00 N ATOM 1909 CA SER B 13 8.765 -17.978 -7.972 1.00 0.00 C ATOM 1910 C SER B 13 8.838 -17.111 -6.713 1.00 0.00 C ATOM 1911 O SER B 13 9.425 -17.504 -5.705 1.00 0.00 O ATOM 1912 CB SER B 13 9.903 -17.611 -8.926 1.00 0.00 C ATOM 1913 OG SER B 13 9.681 -18.151 -10.217 1.00 0.00 O ATOM 0 H SER B 13 7.525 -17.443 -9.584 1.00 0.00 H new ATOM 0 HA SER B 13 8.870 -19.024 -7.684 1.00 0.00 H new ATOM 0 HB2 SER B 13 9.991 -16.527 -8.992 1.00 0.00 H new ATOM 0 HB3 SER B 13 10.848 -17.984 -8.530 1.00 0.00 H new ATOM 0 HG SER B 13 9.138 -17.528 -10.743 1.00 0.00 H new ATOM 1919 N SER B 14 8.222 -15.935 -6.785 1.00 0.00 N ATOM 1920 CA SER B 14 8.185 -14.993 -5.664 1.00 0.00 C ATOM 1921 C SER B 14 7.633 -15.639 -4.418 1.00 0.00 C ATOM 1922 O SER B 14 7.956 -15.240 -3.303 1.00 0.00 O ATOM 1923 CB SER B 14 7.278 -13.818 -6.010 1.00 0.00 C ATOM 1924 OG SER B 14 7.309 -13.536 -7.399 1.00 0.00 O ATOM 0 H SER B 14 7.735 -15.606 -7.618 1.00 0.00 H new ATOM 0 HA SER B 14 9.208 -14.664 -5.482 1.00 0.00 H new ATOM 0 HB2 SER B 14 6.256 -14.042 -5.705 1.00 0.00 H new ATOM 0 HB3 SER B 14 7.591 -12.937 -5.451 1.00 0.00 H new ATOM 0 HG SER B 14 6.620 -14.063 -7.855 1.00 0.00 H new ATOM 1930 N ALA B 15 6.757 -16.601 -4.615 1.00 0.00 N ATOM 1931 CA ALA B 15 6.104 -17.256 -3.506 1.00 0.00 C ATOM 1932 C ALA B 15 7.078 -17.738 -2.442 1.00 0.00 C ATOM 1933 O ALA B 15 6.684 -17.912 -1.288 1.00 0.00 O ATOM 1934 CB ALA B 15 5.238 -18.401 -4.007 1.00 0.00 C ATOM 0 H ALA B 15 6.482 -16.946 -5.535 1.00 0.00 H new ATOM 0 HA ALA B 15 5.471 -16.510 -3.025 1.00 0.00 H new ATOM 0 HB1 ALA B 15 4.751 -18.886 -3.161 1.00 0.00 H new ATOM 0 HB2 ALA B 15 4.480 -18.013 -4.688 1.00 0.00 H new ATOM 0 HB3 ALA B 15 5.861 -19.125 -4.532 1.00 0.00 H new ATOM 1940 N LYS B 16 8.348 -17.929 -2.796 1.00 0.00 N ATOM 1941 CA LYS B 16 9.320 -18.356 -1.799 1.00 0.00 C ATOM 1942 C LYS B 16 9.207 -17.420 -0.604 1.00 0.00 C ATOM 1943 O LYS B 16 9.104 -17.853 0.544 1.00 0.00 O ATOM 1944 CB LYS B 16 10.739 -18.321 -2.373 1.00 0.00 C ATOM 1945 CG LYS B 16 10.918 -19.194 -3.604 1.00 0.00 C ATOM 1946 CD LYS B 16 11.492 -20.555 -3.244 1.00 0.00 C ATOM 1947 CE LYS B 16 11.016 -21.632 -4.205 1.00 0.00 C ATOM 1948 NZ LYS B 16 11.701 -21.542 -5.524 1.00 0.00 N ATOM 0 H LYS B 16 8.718 -17.799 -3.738 1.00 0.00 H new ATOM 0 HA LYS B 16 9.116 -19.383 -1.496 1.00 0.00 H new ATOM 0 HB2 LYS B 16 10.994 -17.292 -2.627 1.00 0.00 H new ATOM 0 HB3 LYS B 16 11.441 -18.643 -1.604 1.00 0.00 H new ATOM 0 HG2 LYS B 16 9.957 -19.324 -4.102 1.00 0.00 H new ATOM 0 HG3 LYS B 16 11.579 -18.695 -4.312 1.00 0.00 H new ATOM 0 HD2 LYS B 16 12.581 -20.507 -3.259 1.00 0.00 H new ATOM 0 HD3 LYS B 16 11.199 -20.817 -2.228 1.00 0.00 H new ATOM 0 HE2 LYS B 16 11.197 -22.614 -3.768 1.00 0.00 H new ATOM 0 HE3 LYS B 16 9.939 -21.541 -4.348 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 11.348 -22.294 -6.150 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 11.508 -20.615 -5.953 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 12.726 -21.655 -5.391 1.00 0.00 H new ATOM 1962 N THR B 17 9.160 -16.127 -0.910 1.00 0.00 N ATOM 1963 CA THR B 17 8.980 -15.097 0.100 1.00 0.00 C ATOM 1964 C THR B 17 7.559 -14.541 0.028 1.00 0.00 C ATOM 1965 O THR B 17 6.885 -14.385 1.046 1.00 0.00 O ATOM 1966 CB THR B 17 9.992 -13.965 -0.080 1.00 0.00 C ATOM 1967 OG1 THR B 17 11.315 -14.441 0.097 1.00 0.00 O ATOM 1968 CG2 THR B 17 9.779 -12.821 0.891 1.00 0.00 C ATOM 0 H THR B 17 9.245 -15.768 -1.861 1.00 0.00 H new ATOM 0 HA THR B 17 9.145 -15.548 1.079 1.00 0.00 H new ATOM 0 HB THR B 17 9.841 -13.596 -1.094 1.00 0.00 H new ATOM 0 HG1 THR B 17 11.947 -13.702 -0.024 1.00 0.00 H new ATOM 0 HG21 THR B 17 10.528 -12.049 0.714 1.00 0.00 H new ATOM 0 HG22 THR B 17 8.784 -12.401 0.746 1.00 0.00 H new ATOM 0 HG23 THR B 17 9.872 -13.189 1.913 1.00 0.00 H new ATOM 1976 N TYR B 18 7.124 -14.222 -1.196 1.00 0.00 N ATOM 1977 CA TYR B 18 5.795 -13.654 -1.424 1.00 0.00 C ATOM 1978 C TYR B 18 5.060 -14.372 -2.539 1.00 0.00 C ATOM 1979 O TYR B 18 5.449 -14.270 -3.700 1.00 0.00 O ATOM 1980 CB TYR B 18 5.928 -12.216 -1.848 1.00 0.00 C ATOM 1981 CG TYR B 18 6.692 -11.346 -0.875 1.00 0.00 C ATOM 1982 CD1 TYR B 18 6.294 -11.239 0.452 1.00 0.00 C ATOM 1983 CD2 TYR B 18 7.812 -10.632 -1.284 1.00 0.00 C ATOM 1984 CE1 TYR B 18 6.989 -10.445 1.343 1.00 0.00 C ATOM 1985 CE2 TYR B 18 8.513 -9.836 -0.398 1.00 0.00 C ATOM 1986 CZ TYR B 18 8.097 -9.746 0.914 1.00 0.00 C ATOM 1987 OH TYR B 18 8.792 -8.954 1.799 1.00 0.00 O ATOM 0 H TYR B 18 7.676 -14.349 -2.044 1.00 0.00 H new ATOM 0 HA TYR B 18 5.240 -13.755 -0.491 1.00 0.00 H new ATOM 0 HB2 TYR B 18 6.426 -12.180 -2.817 1.00 0.00 H new ATOM 0 HB3 TYR B 18 4.931 -11.797 -1.986 1.00 0.00 H new ATOM 0 HD1 TYR B 18 5.427 -11.786 0.792 1.00 0.00 H new ATOM 0 HD2 TYR B 18 8.140 -10.700 -2.311 1.00 0.00 H new ATOM 0 HE1 TYR B 18 6.666 -10.372 2.371 1.00 0.00 H new ATOM 0 HE2 TYR B 18 9.382 -9.287 -0.731 1.00 0.00 H new ATOM 0 HH TYR B 18 9.546 -8.532 1.337 1.00 0.00 H new ATOM 1997 N PRO B 19 4.003 -15.124 -2.228 1.00 0.00 N ATOM 1998 CA PRO B 19 3.266 -15.861 -3.232 1.00 0.00 C ATOM 1999 C PRO B 19 2.124 -15.094 -3.892 1.00 0.00 C ATOM 2000 O PRO B 19 1.915 -15.250 -5.084 1.00 0.00 O ATOM 2001 CB PRO B 19 2.710 -17.059 -2.464 1.00 0.00 C ATOM 2002 CG PRO B 19 2.997 -16.795 -1.016 1.00 0.00 C ATOM 2003 CD PRO B 19 3.465 -15.369 -0.900 1.00 0.00 C ATOM 0 HA PRO B 19 3.924 -16.109 -4.065 1.00 0.00 H new ATOM 0 HB2 PRO B 19 1.639 -17.169 -2.635 1.00 0.00 H new ATOM 0 HB3 PRO B 19 3.182 -17.985 -2.792 1.00 0.00 H new ATOM 0 HG2 PRO B 19 2.104 -16.956 -0.413 1.00 0.00 H new ATOM 0 HG3 PRO B 19 3.759 -17.480 -0.645 1.00 0.00 H new ATOM 0 HD2 PRO B 19 2.648 -14.689 -0.658 1.00 0.00 H new ATOM 0 HD3 PRO B 19 4.221 -15.249 -0.124 1.00 0.00 H new ATOM 2011 N TYR B 20 1.349 -14.309 -3.140 1.00 0.00 N ATOM 2012 CA TYR B 20 0.214 -13.613 -3.764 1.00 0.00 C ATOM 2013 C TYR B 20 -0.160 -12.296 -3.136 1.00 0.00 C ATOM 2014 O TYR B 20 0.388 -11.854 -2.129 1.00 0.00 O ATOM 2015 CB TYR B 20 -1.060 -14.476 -3.742 1.00 0.00 C ATOM 2016 CG TYR B 20 -0.884 -15.816 -3.120 1.00 0.00 C ATOM 2017 CD1 TYR B 20 -0.333 -15.935 -1.857 1.00 0.00 C ATOM 2018 CD2 TYR B 20 -1.257 -16.953 -3.806 1.00 0.00 C ATOM 2019 CE1 TYR B 20 -0.149 -17.160 -1.274 1.00 0.00 C ATOM 2020 CE2 TYR B 20 -1.076 -18.200 -3.237 1.00 0.00 C ATOM 2021 CZ TYR B 20 -0.520 -18.298 -1.970 1.00 0.00 C ATOM 2022 OH TYR B 20 -0.328 -19.533 -1.410 1.00 0.00 O ATOM 0 H TYR B 20 1.474 -14.141 -2.142 1.00 0.00 H new ATOM 0 HA TYR B 20 0.574 -13.424 -4.775 1.00 0.00 H new ATOM 0 HB2 TYR B 20 -1.839 -13.938 -3.202 1.00 0.00 H new ATOM 0 HB3 TYR B 20 -1.413 -14.607 -4.765 1.00 0.00 H new ATOM 0 HD1 TYR B 20 -0.042 -15.044 -1.320 1.00 0.00 H new ATOM 0 HD2 TYR B 20 -1.692 -16.869 -4.791 1.00 0.00 H new ATOM 0 HE1 TYR B 20 0.279 -17.238 -0.286 1.00 0.00 H new ATOM 0 HE2 TYR B 20 -1.365 -19.091 -3.775 1.00 0.00 H new ATOM 0 HH TYR B 20 -1.124 -19.787 -0.897 1.00 0.00 H new ATOM 2032 N PHE B 21 -1.183 -11.739 -3.766 1.00 0.00 N ATOM 2033 CA PHE B 21 -1.832 -10.517 -3.374 1.00 0.00 C ATOM 2034 C PHE B 21 -3.255 -10.607 -3.863 1.00 0.00 C ATOM 2035 O PHE B 21 -3.579 -11.459 -4.691 1.00 0.00 O ATOM 2036 CB PHE B 21 -1.185 -9.264 -3.962 1.00 0.00 C ATOM 2037 CG PHE B 21 0.169 -9.458 -4.600 1.00 0.00 C ATOM 2038 CD1 PHE B 21 1.268 -9.805 -3.832 1.00 0.00 C ATOM 2039 CD2 PHE B 21 0.347 -9.271 -5.968 1.00 0.00 C ATOM 2040 CE1 PHE B 21 2.514 -9.964 -4.407 1.00 0.00 C ATOM 2041 CE2 PHE B 21 1.593 -9.432 -6.546 1.00 0.00 C ATOM 2042 CZ PHE B 21 2.677 -9.778 -5.765 1.00 0.00 C ATOM 0 H PHE B 21 -1.595 -12.153 -4.602 1.00 0.00 H new ATOM 0 HA PHE B 21 -1.756 -10.418 -2.291 1.00 0.00 H new ATOM 0 HB2 PHE B 21 -1.860 -8.846 -4.709 1.00 0.00 H new ATOM 0 HB3 PHE B 21 -1.089 -8.522 -3.169 1.00 0.00 H new ATOM 0 HD1 PHE B 21 1.149 -9.953 -2.769 1.00 0.00 H new ATOM 0 HD2 PHE B 21 -0.497 -8.997 -6.584 1.00 0.00 H new ATOM 0 HE1 PHE B 21 3.361 -10.234 -3.794 1.00 0.00 H new ATOM 0 HE2 PHE B 21 1.718 -9.287 -7.609 1.00 0.00 H new ATOM 0 HZ PHE B 21 3.651 -9.903 -6.215 1.00 0.00 H new ATOM 2052 N VAL B 22 -4.102 -9.746 -3.366 1.00 0.00 N ATOM 2053 CA VAL B 22 -5.481 -9.761 -3.777 1.00 0.00 C ATOM 2054 C VAL B 22 -5.915 -8.399 -4.259 1.00 0.00 C ATOM 2055 O VAL B 22 -5.925 -7.435 -3.504 1.00 0.00 O ATOM 2056 CB VAL B 22 -6.386 -10.220 -2.641 1.00 0.00 C ATOM 2057 CG1 VAL B 22 -7.831 -10.260 -3.111 1.00 0.00 C ATOM 2058 CG2 VAL B 22 -5.947 -11.583 -2.121 1.00 0.00 C ATOM 0 H VAL B 22 -3.864 -9.029 -2.680 1.00 0.00 H new ATOM 0 HA VAL B 22 -5.569 -10.469 -4.601 1.00 0.00 H new ATOM 0 HB VAL B 22 -6.307 -9.507 -1.820 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -8.471 -10.589 -2.292 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -8.137 -9.264 -3.433 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -7.923 -10.955 -3.946 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -6.606 -11.893 -1.310 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -5.997 -12.314 -2.928 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -4.923 -11.519 -1.752 1.00 0.00 H new ATOM 2068 N ASP B 23 -6.262 -8.329 -5.530 1.00 0.00 N ATOM 2069 CA ASP B 23 -6.690 -7.065 -6.125 1.00 0.00 C ATOM 2070 C ASP B 23 -7.885 -6.490 -5.364 1.00 0.00 C ATOM 2071 O ASP B 23 -8.963 -7.081 -5.342 1.00 0.00 O ATOM 2072 CB ASP B 23 -7.036 -7.270 -7.599 1.00 0.00 C ATOM 2073 CG ASP B 23 -5.812 -7.577 -8.436 1.00 0.00 C ATOM 2074 OD1 ASP B 23 -4.743 -7.848 -7.849 1.00 0.00 O ATOM 2075 OD2 ASP B 23 -5.922 -7.545 -9.679 1.00 0.00 O ATOM 0 H ASP B 23 -6.258 -9.122 -6.171 1.00 0.00 H new ATOM 0 HA ASP B 23 -5.870 -6.350 -6.056 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -7.752 -8.086 -7.692 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -7.522 -6.374 -7.984 1.00 0.00 H new ATOM 2080 N VAL B 24 -7.676 -5.342 -4.715 1.00 0.00 N ATOM 2081 CA VAL B 24 -8.732 -4.707 -3.931 1.00 0.00 C ATOM 2082 C VAL B 24 -8.484 -3.220 -3.760 1.00 0.00 C ATOM 2083 O VAL B 24 -7.693 -2.810 -2.910 1.00 0.00 O ATOM 2084 CB VAL B 24 -8.872 -5.378 -2.550 1.00 0.00 C ATOM 2085 CG1 VAL B 24 -7.506 -5.582 -1.906 1.00 0.00 C ATOM 2086 CG2 VAL B 24 -9.794 -4.576 -1.641 1.00 0.00 C ATOM 0 H VAL B 24 -6.790 -4.837 -4.718 1.00 0.00 H new ATOM 0 HA VAL B 24 -9.663 -4.836 -4.483 1.00 0.00 H new ATOM 0 HB VAL B 24 -9.324 -6.359 -2.697 1.00 0.00 H new ATOM 0 HG11 VAL B 24 -7.630 -6.057 -0.933 1.00 0.00 H new ATOM 0 HG12 VAL B 24 -6.894 -6.218 -2.545 1.00 0.00 H new ATOM 0 HG13 VAL B 24 -7.016 -4.617 -1.779 1.00 0.00 H new ATOM 0 HG21 VAL B 24 -9.874 -5.073 -0.674 1.00 0.00 H new ATOM 0 HG22 VAL B 24 -9.387 -3.575 -1.502 1.00 0.00 H new ATOM 0 HG23 VAL B 24 -10.782 -4.506 -2.096 1.00 0.00 H new ATOM 2096 N GLN B 25 -9.172 -2.407 -4.559 1.00 0.00 N ATOM 2097 CA GLN B 25 -9.014 -0.966 -4.462 1.00 0.00 C ATOM 2098 C GLN B 25 -9.893 -0.208 -5.448 1.00 0.00 C ATOM 2099 O GLN B 25 -11.106 -0.413 -5.506 1.00 0.00 O ATOM 2100 CB GLN B 25 -7.560 -0.586 -4.688 1.00 0.00 C ATOM 2101 CG GLN B 25 -7.172 0.720 -4.005 1.00 0.00 C ATOM 2102 CD GLN B 25 -6.329 1.616 -4.897 1.00 0.00 C ATOM 2103 OE1 GLN B 25 -6.708 1.912 -6.031 1.00 0.00 O ATOM 2104 NE2 GLN B 25 -5.182 2.052 -4.392 1.00 0.00 N ATOM 0 H GLN B 25 -9.834 -2.720 -5.269 1.00 0.00 H new ATOM 0 HA GLN B 25 -9.329 -0.682 -3.458 1.00 0.00 H new ATOM 0 HB2 GLN B 25 -6.919 -1.387 -4.319 1.00 0.00 H new ATOM 0 HB3 GLN B 25 -7.375 -0.498 -5.759 1.00 0.00 H new ATOM 0 HG2 GLN B 25 -8.075 1.254 -3.709 1.00 0.00 H new ATOM 0 HG3 GLN B 25 -6.619 0.498 -3.092 1.00 0.00 H new ATOM 0 HE21 GLN B 25 -4.905 1.783 -3.448 1.00 0.00 H new ATOM 0 HE22 GLN B 25 -4.577 2.656 -4.948 1.00 0.00 H new ATOM 2113 N SER B 26 -9.265 0.689 -6.213 1.00 0.00 N ATOM 2114 CA SER B 26 -9.987 1.503 -7.192 1.00 0.00 C ATOM 2115 C SER B 26 -10.950 0.672 -8.016 1.00 0.00 C ATOM 2116 O SER B 26 -10.574 -0.356 -8.563 1.00 0.00 O ATOM 2117 CB SER B 26 -9.029 2.197 -8.147 1.00 0.00 C ATOM 2118 OG SER B 26 -8.371 3.279 -7.511 1.00 0.00 O ATOM 0 H SER B 26 -8.262 0.869 -6.173 1.00 0.00 H new ATOM 0 HA SER B 26 -10.544 2.243 -6.618 1.00 0.00 H new ATOM 0 HB2 SER B 26 -8.291 1.482 -8.511 1.00 0.00 H new ATOM 0 HB3 SER B 26 -9.577 2.561 -9.016 1.00 0.00 H new ATOM 0 HG SER B 26 -7.858 2.945 -6.746 1.00 0.00 H new ATOM 2124 N ASP B 27 -12.177 1.146 -8.146 1.00 0.00 N ATOM 2125 CA ASP B 27 -13.156 0.457 -8.966 1.00 0.00 C ATOM 2126 C ASP B 27 -12.948 0.899 -10.403 1.00 0.00 C ATOM 2127 O ASP B 27 -13.064 0.109 -11.340 1.00 0.00 O ATOM 2128 CB ASP B 27 -14.581 0.768 -8.503 1.00 0.00 C ATOM 2129 CG ASP B 27 -15.604 -0.170 -9.113 1.00 0.00 C ATOM 2130 OD1 ASP B 27 -15.322 -0.738 -10.188 1.00 0.00 O ATOM 2131 OD2 ASP B 27 -16.688 -0.335 -8.514 1.00 0.00 O ATOM 0 H ASP B 27 -12.516 1.997 -7.698 1.00 0.00 H new ATOM 0 HA ASP B 27 -13.023 -0.621 -8.878 1.00 0.00 H new ATOM 0 HB2 ASP B 27 -14.630 0.698 -7.416 1.00 0.00 H new ATOM 0 HB3 ASP B 27 -14.830 1.795 -8.768 1.00 0.00 H new ATOM 2136 N LEU B 28 -12.596 2.173 -10.554 1.00 0.00 N ATOM 2137 CA LEU B 28 -12.316 2.743 -11.857 1.00 0.00 C ATOM 2138 C LEU B 28 -10.868 2.483 -12.221 1.00 0.00 C ATOM 2139 O LEU B 28 -10.548 2.072 -13.336 1.00 0.00 O ATOM 2140 CB LEU B 28 -12.599 4.245 -11.859 1.00 0.00 C ATOM 2141 CG LEU B 28 -14.058 4.631 -11.614 1.00 0.00 C ATOM 2142 CD1 LEU B 28 -14.970 3.924 -12.605 1.00 0.00 C ATOM 2143 CD2 LEU B 28 -14.463 4.301 -10.185 1.00 0.00 C ATOM 0 H LEU B 28 -12.499 2.830 -9.780 1.00 0.00 H new ATOM 0 HA LEU B 28 -12.965 2.273 -12.596 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -11.982 4.716 -11.094 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -12.287 4.656 -12.819 1.00 0.00 H new ATOM 0 HG LEU B 28 -14.160 5.706 -11.761 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -16.005 4.210 -12.416 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -14.694 4.209 -13.620 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -14.865 2.845 -12.490 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -15.504 4.582 -10.028 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -14.346 3.231 -10.011 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -13.829 4.853 -9.491 1.00 0.00 H new ATOM 2155 N LEU B 29 -10.004 2.715 -11.249 1.00 0.00 N ATOM 2156 CA LEU B 29 -8.577 2.505 -11.410 1.00 0.00 C ATOM 2157 C LEU B 29 -8.184 1.121 -10.902 1.00 0.00 C ATOM 2158 O LEU B 29 -7.051 0.907 -10.472 1.00 0.00 O ATOM 2159 CB LEU B 29 -7.811 3.579 -10.638 1.00 0.00 C ATOM 2160 CG LEU B 29 -8.102 5.011 -11.079 1.00 0.00 C ATOM 2161 CD1 LEU B 29 -7.717 5.996 -9.986 1.00 0.00 C ATOM 2162 CD2 LEU B 29 -7.369 5.332 -12.374 1.00 0.00 C ATOM 0 H LEU B 29 -10.272 3.055 -10.325 1.00 0.00 H new ATOM 0 HA LEU B 29 -8.327 2.572 -12.469 1.00 0.00 H new ATOM 0 HB2 LEU B 29 -8.048 3.484 -9.578 1.00 0.00 H new ATOM 0 HB3 LEU B 29 -6.743 3.391 -10.744 1.00 0.00 H new ATOM 0 HG LEU B 29 -9.173 5.103 -11.261 1.00 0.00 H new ATOM 0 HD11 LEU B 29 -7.932 7.011 -10.319 1.00 0.00 H new ATOM 0 HD12 LEU B 29 -8.290 5.781 -9.084 1.00 0.00 H new ATOM 0 HD13 LEU B 29 -6.653 5.902 -9.770 1.00 0.00 H new ATOM 0 HD21 LEU B 29 -7.589 6.357 -12.672 1.00 0.00 H new ATOM 0 HD22 LEU B 29 -6.295 5.221 -12.222 1.00 0.00 H new ATOM 0 HD23 LEU B 29 -7.697 4.648 -13.157 1.00 0.00 H new ATOM 2174 N ASP B 30 -9.134 0.186 -10.933 1.00 0.00 N ATOM 2175 CA ASP B 30 -8.885 -1.166 -10.451 1.00 0.00 C ATOM 2176 C ASP B 30 -7.745 -1.828 -11.221 1.00 0.00 C ATOM 2177 O ASP B 30 -6.731 -2.193 -10.635 1.00 0.00 O ATOM 2178 CB ASP B 30 -10.166 -2.004 -10.558 1.00 0.00 C ATOM 2179 CG ASP B 30 -10.383 -2.894 -9.349 1.00 0.00 C ATOM 2180 OD1 ASP B 30 -9.594 -2.791 -8.385 1.00 0.00 O ATOM 2181 OD2 ASP B 30 -11.344 -3.692 -9.363 1.00 0.00 O ATOM 0 H ASP B 30 -10.078 0.342 -11.286 1.00 0.00 H new ATOM 0 HA ASP B 30 -8.586 -1.106 -9.405 1.00 0.00 H new ATOM 0 HB2 ASP B 30 -11.022 -1.339 -10.674 1.00 0.00 H new ATOM 0 HB3 ASP B 30 -10.118 -2.621 -11.455 1.00 0.00 H new ATOM 2186 N ASN B 31 -7.900 -1.966 -12.533 1.00 0.00 N ATOM 2187 CA ASN B 31 -6.853 -2.569 -13.361 1.00 0.00 C ATOM 2188 C ASN B 31 -6.411 -1.614 -14.443 1.00 0.00 C ATOM 2189 O ASN B 31 -5.663 -1.987 -15.348 1.00 0.00 O ATOM 2190 CB ASN B 31 -7.323 -3.878 -14.002 1.00 0.00 C ATOM 2191 CG ASN B 31 -8.734 -3.785 -14.553 1.00 0.00 C ATOM 2192 OD1 ASN B 31 -9.634 -3.249 -13.906 1.00 0.00 O ATOM 2193 ND2 ASN B 31 -8.934 -4.310 -15.757 1.00 0.00 N ATOM 0 H ASN B 31 -8.731 -1.673 -13.046 1.00 0.00 H new ATOM 0 HA ASN B 31 -6.012 -2.788 -12.703 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -6.640 -4.150 -14.807 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -7.278 -4.677 -13.262 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -9.862 -4.278 -16.180 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -8.160 -4.745 -16.259 1.00 0.00 H new ATOM 2200 N LEU B 32 -6.862 -0.379 -14.339 1.00 0.00 N ATOM 2201 CA LEU B 32 -6.490 0.641 -15.313 1.00 0.00 C ATOM 2202 C LEU B 32 -4.996 0.597 -15.529 1.00 0.00 C ATOM 2203 O LEU B 32 -4.506 0.231 -16.597 1.00 0.00 O ATOM 2204 CB LEU B 32 -6.855 2.033 -14.817 1.00 0.00 C ATOM 2205 CG LEU B 32 -7.941 2.751 -15.620 1.00 0.00 C ATOM 2206 CD1 LEU B 32 -8.263 4.099 -14.996 1.00 0.00 C ATOM 2207 CD2 LEU B 32 -7.505 2.922 -17.068 1.00 0.00 C ATOM 0 H LEU B 32 -7.482 -0.054 -13.597 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.028 0.438 -16.239 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -7.184 1.956 -13.781 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -5.956 2.649 -14.822 1.00 0.00 H new ATOM 0 HG LEU B 32 -8.844 2.141 -15.602 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -9.038 4.595 -15.581 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -8.617 3.952 -13.976 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -7.366 4.718 -14.983 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -8.289 3.435 -17.626 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -6.589 3.511 -17.105 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -7.325 1.943 -17.512 1.00 0.00 H new ATOM 2219 N ASN B 33 -4.284 0.971 -14.480 1.00 0.00 N ATOM 2220 CA ASN B 33 -2.845 0.979 -14.508 1.00 0.00 C ATOM 2221 C ASN B 33 -2.268 0.210 -13.318 1.00 0.00 C ATOM 2222 O ASN B 33 -1.101 -0.180 -13.334 1.00 0.00 O ATOM 2223 CB ASN B 33 -2.323 2.417 -14.502 1.00 0.00 C ATOM 2224 CG ASN B 33 -2.428 3.076 -15.864 1.00 0.00 C ATOM 2225 OD1 ASN B 33 -3.508 3.496 -16.281 1.00 0.00 O ATOM 2226 ND2 ASN B 33 -1.304 3.169 -16.565 1.00 0.00 N ATOM 0 H ASN B 33 -4.690 1.274 -13.595 1.00 0.00 H new ATOM 0 HA ASN B 33 -2.523 0.485 -15.425 1.00 0.00 H new ATOM 0 HB2 ASN B 33 -2.885 3.002 -13.774 1.00 0.00 H new ATOM 0 HB3 ASN B 33 -1.282 2.421 -14.179 1.00 0.00 H new ATOM 0 HD21 ASN B 33 -1.313 3.602 -17.488 1.00 0.00 H new ATOM 0 HD22 ASN B 33 -0.431 2.807 -16.180 1.00 0.00 H new ATOM 2233 N THR B 34 -3.090 -0.007 -12.281 1.00 0.00 N ATOM 2234 CA THR B 34 -2.649 -0.726 -11.083 1.00 0.00 C ATOM 2235 C THR B 34 -3.830 -1.005 -10.163 1.00 0.00 C ATOM 2236 O THR B 34 -4.948 -0.556 -10.416 1.00 0.00 O ATOM 2237 CB THR B 34 -1.570 0.054 -10.297 1.00 0.00 C ATOM 2238 OG1 THR B 34 -2.068 0.474 -9.038 1.00 0.00 O ATOM 2239 CG2 THR B 34 -1.040 1.290 -10.998 1.00 0.00 C ATOM 0 H THR B 34 -4.061 0.305 -12.250 1.00 0.00 H new ATOM 0 HA THR B 34 -2.211 -1.664 -11.424 1.00 0.00 H new ATOM 0 HB THR B 34 -0.750 -0.657 -10.200 1.00 0.00 H new ATOM 0 HG1 THR B 34 -1.518 1.211 -8.698 1.00 0.00 H new ATOM 0 HG21 THR B 34 -0.289 1.770 -10.371 1.00 0.00 H new ATOM 0 HG22 THR B 34 -0.590 1.004 -11.949 1.00 0.00 H new ATOM 0 HG23 THR B 34 -1.860 1.985 -11.179 1.00 0.00 H new ATOM 2247 N ARG B 35 -3.566 -1.727 -9.081 1.00 0.00 N ATOM 2248 CA ARG B 35 -4.597 -2.045 -8.104 1.00 0.00 C ATOM 2249 C ARG B 35 -3.986 -2.237 -6.722 1.00 0.00 C ATOM 2250 O ARG B 35 -2.859 -2.716 -6.605 1.00 0.00 O ATOM 2251 CB ARG B 35 -5.368 -3.301 -8.536 1.00 0.00 C ATOM 2252 CG ARG B 35 -4.761 -4.616 -8.060 1.00 0.00 C ATOM 2253 CD ARG B 35 -3.867 -5.239 -9.121 1.00 0.00 C ATOM 2254 NE ARG B 35 -4.562 -5.412 -10.396 1.00 0.00 N ATOM 2255 CZ ARG B 35 -4.377 -4.634 -11.463 1.00 0.00 C ATOM 2256 NH1 ARG B 35 -3.528 -3.615 -11.419 1.00 0.00 N ATOM 2257 NH2 ARG B 35 -5.047 -4.877 -12.582 1.00 0.00 N ATOM 0 H ARG B 35 -2.644 -2.104 -8.859 1.00 0.00 H new ATOM 0 HA ARG B 35 -5.296 -1.210 -8.052 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -6.389 -3.231 -8.161 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -5.429 -3.317 -9.624 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -4.182 -4.442 -7.153 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -5.559 -5.312 -7.801 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -2.990 -4.610 -9.270 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -3.509 -6.207 -8.770 1.00 0.00 H new ATOM 0 HE ARG B 35 -5.232 -6.177 -10.474 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -3.009 -3.420 -10.563 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -3.394 -3.027 -12.241 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -5.702 -5.658 -12.625 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -4.907 -4.283 -13.399 1.00 0.00 H new ATOM 2271 N LEU B 36 -4.735 -1.904 -5.673 1.00 0.00 N ATOM 2272 CA LEU B 36 -4.229 -2.097 -4.321 1.00 0.00 C ATOM 2273 C LEU B 36 -4.510 -3.523 -3.892 1.00 0.00 C ATOM 2274 O LEU B 36 -5.660 -3.961 -3.889 1.00 0.00 O ATOM 2275 CB LEU B 36 -4.859 -1.116 -3.332 1.00 0.00 C ATOM 2276 CG LEU B 36 -4.021 -0.848 -2.082 1.00 0.00 C ATOM 2277 CD1 LEU B 36 -2.612 -0.418 -2.458 1.00 0.00 C ATOM 2278 CD2 LEU B 36 -4.687 0.199 -1.201 1.00 0.00 C ATOM 0 H LEU B 36 -5.673 -1.508 -5.732 1.00 0.00 H new ATOM 0 HA LEU B 36 -3.156 -1.907 -4.323 1.00 0.00 H new ATOM 0 HB2 LEU B 36 -5.039 -0.170 -3.843 1.00 0.00 H new ATOM 0 HB3 LEU B 36 -5.831 -1.503 -3.026 1.00 0.00 H new ATOM 0 HG LEU B 36 -3.952 -1.776 -1.515 1.00 0.00 H new ATOM 0 HD11 LEU B 36 -2.034 -0.233 -1.552 1.00 0.00 H new ATOM 0 HD12 LEU B 36 -2.134 -1.207 -3.039 1.00 0.00 H new ATOM 0 HD13 LEU B 36 -2.657 0.494 -3.053 1.00 0.00 H new ATOM 0 HD21 LEU B 36 -4.074 0.374 -0.317 1.00 0.00 H new ATOM 0 HD22 LEU B 36 -4.794 1.129 -1.759 1.00 0.00 H new ATOM 0 HD23 LEU B 36 -5.671 -0.156 -0.895 1.00 0.00 H new ATOM 2290 N VAL B 37 -3.462 -4.260 -3.558 1.00 0.00 N ATOM 2291 CA VAL B 37 -3.631 -5.648 -3.165 1.00 0.00 C ATOM 2292 C VAL B 37 -3.214 -5.914 -1.739 1.00 0.00 C ATOM 2293 O VAL B 37 -2.397 -5.199 -1.158 1.00 0.00 O ATOM 2294 CB VAL B 37 -2.816 -6.615 -4.053 1.00 0.00 C ATOM 2295 CG1 VAL B 37 -3.455 -6.762 -5.424 1.00 0.00 C ATOM 2296 CG2 VAL B 37 -1.366 -6.161 -4.182 1.00 0.00 C ATOM 0 H VAL B 37 -2.499 -3.925 -3.551 1.00 0.00 H new ATOM 0 HA VAL B 37 -4.700 -5.827 -3.281 1.00 0.00 H new ATOM 0 HB VAL B 37 -2.820 -7.591 -3.567 1.00 0.00 H new ATOM 0 HG11 VAL B 37 -2.863 -7.448 -6.030 1.00 0.00 H new ATOM 0 HG12 VAL B 37 -4.466 -7.155 -5.314 1.00 0.00 H new ATOM 0 HG13 VAL B 37 -3.496 -5.789 -5.913 1.00 0.00 H new ATOM 0 HG21 VAL B 37 -0.820 -6.862 -4.813 1.00 0.00 H new ATOM 0 HG22 VAL B 37 -1.334 -5.168 -4.631 1.00 0.00 H new ATOM 0 HG23 VAL B 37 -0.906 -6.127 -3.194 1.00 0.00 H new ATOM 2306 N ILE B 38 -3.731 -7.013 -1.222 1.00 0.00 N ATOM 2307 CA ILE B 38 -3.376 -7.477 0.095 1.00 0.00 C ATOM 2308 C ILE B 38 -2.510 -8.699 -0.136 1.00 0.00 C ATOM 2309 O ILE B 38 -3.011 -9.812 -0.297 1.00 0.00 O ATOM 2310 CB ILE B 38 -4.611 -7.859 0.939 1.00 0.00 C ATOM 2311 CG1 ILE B 38 -5.842 -7.058 0.503 1.00 0.00 C ATOM 2312 CG2 ILE B 38 -4.326 -7.629 2.413 1.00 0.00 C ATOM 2313 CD1 ILE B 38 -7.143 -7.607 1.047 1.00 0.00 C ATOM 0 H ILE B 38 -4.407 -7.604 -1.706 1.00 0.00 H new ATOM 0 HA ILE B 38 -2.866 -6.692 0.653 1.00 0.00 H new ATOM 0 HB ILE B 38 -4.822 -8.916 0.779 1.00 0.00 H new ATOM 0 HG12 ILE B 38 -5.728 -6.025 0.830 1.00 0.00 H new ATOM 0 HG13 ILE B 38 -5.890 -7.044 -0.586 1.00 0.00 H new ATOM 0 HG21 ILE B 38 -5.203 -7.901 3.000 1.00 0.00 H new ATOM 0 HG22 ILE B 38 -3.479 -8.243 2.720 1.00 0.00 H new ATOM 0 HG23 ILE B 38 -4.091 -6.578 2.578 1.00 0.00 H new ATOM 0 HD11 ILE B 38 -7.972 -6.991 0.698 1.00 0.00 H new ATOM 0 HD12 ILE B 38 -7.280 -8.631 0.699 1.00 0.00 H new ATOM 0 HD13 ILE B 38 -7.116 -7.595 2.137 1.00 0.00 H new ATOM 2325 N PRO B 39 -1.193 -8.486 -0.236 1.00 0.00 N ATOM 2326 CA PRO B 39 -0.245 -9.547 -0.542 1.00 0.00 C ATOM 2327 C PRO B 39 -0.403 -10.795 0.322 1.00 0.00 C ATOM 2328 O PRO B 39 0.096 -10.854 1.440 1.00 0.00 O ATOM 2329 CB PRO B 39 1.129 -8.904 -0.315 1.00 0.00 C ATOM 2330 CG PRO B 39 0.871 -7.543 0.252 1.00 0.00 C ATOM 2331 CD PRO B 39 -0.528 -7.179 -0.142 1.00 0.00 C ATOM 0 HA PRO B 39 -0.400 -9.910 -1.558 1.00 0.00 H new ATOM 0 HB2 PRO B 39 1.729 -9.503 0.370 1.00 0.00 H new ATOM 0 HB3 PRO B 39 1.685 -8.836 -1.250 1.00 0.00 H new ATOM 0 HG2 PRO B 39 0.981 -7.547 1.336 1.00 0.00 H new ATOM 0 HG3 PRO B 39 1.585 -6.818 -0.138 1.00 0.00 H new ATOM 0 HD2 PRO B 39 -1.003 -6.537 0.600 1.00 0.00 H new ATOM 0 HD3 PRO B 39 -0.554 -6.643 -1.091 1.00 0.00 H new ATOM 2339 N LEU B 40 -1.073 -11.804 -0.224 1.00 0.00 N ATOM 2340 CA LEU B 40 -1.264 -13.066 0.476 1.00 0.00 C ATOM 2341 C LEU B 40 0.059 -13.779 0.631 1.00 0.00 C ATOM 2342 O LEU B 40 1.022 -13.476 -0.070 1.00 0.00 O ATOM 2343 CB LEU B 40 -2.228 -13.962 -0.299 1.00 0.00 C ATOM 2344 CG LEU B 40 -3.688 -13.797 0.072 1.00 0.00 C ATOM 2345 CD1 LEU B 40 -4.582 -14.250 -1.072 1.00 0.00 C ATOM 2346 CD2 LEU B 40 -4.004 -14.571 1.343 1.00 0.00 C ATOM 0 H LEU B 40 -1.494 -11.771 -1.153 1.00 0.00 H new ATOM 0 HA LEU B 40 -1.681 -12.853 1.460 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -2.113 -13.759 -1.364 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -1.943 -15.002 -0.140 1.00 0.00 H new ATOM 0 HG LEU B 40 -3.882 -12.741 0.258 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -5.627 -14.125 -0.789 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -4.372 -13.650 -1.958 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.389 -15.300 -1.291 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -5.056 -14.442 1.595 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -3.796 -15.629 1.186 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -3.386 -14.197 2.160 1.00 0.00 H new ATOM 2358 N THR B 41 0.103 -14.729 1.547 1.00 0.00 N ATOM 2359 CA THR B 41 1.318 -15.480 1.774 1.00 0.00 C ATOM 2360 C THR B 41 1.027 -16.805 2.460 1.00 0.00 C ATOM 2361 O THR B 41 -0.116 -17.082 2.823 1.00 0.00 O ATOM 2362 CB THR B 41 2.321 -14.638 2.557 1.00 0.00 C ATOM 2363 OG1 THR B 41 2.841 -15.333 3.676 1.00 0.00 O ATOM 2364 CG2 THR B 41 1.772 -13.323 3.067 1.00 0.00 C ATOM 0 H THR B 41 -0.683 -14.995 2.140 1.00 0.00 H new ATOM 0 HA THR B 41 1.765 -15.718 0.809 1.00 0.00 H new ATOM 0 HB THR B 41 3.101 -14.431 1.824 1.00 0.00 H new ATOM 0 HG1 THR B 41 3.764 -15.047 3.839 1.00 0.00 H new ATOM 0 HG21 THR B 41 2.551 -12.790 3.611 1.00 0.00 H new ATOM 0 HG22 THR B 41 1.438 -12.717 2.225 1.00 0.00 H new ATOM 0 HG23 THR B 41 0.930 -13.514 3.733 1.00 0.00 H new ATOM 2372 N PRO B 42 2.048 -17.663 2.633 1.00 0.00 N ATOM 2373 CA PRO B 42 1.861 -18.960 3.258 1.00 0.00 C ATOM 2374 C PRO B 42 1.897 -18.899 4.773 1.00 0.00 C ATOM 2375 O PRO B 42 2.960 -18.879 5.393 1.00 0.00 O ATOM 2376 CB PRO B 42 3.027 -19.761 2.703 1.00 0.00 C ATOM 2377 CG PRO B 42 4.123 -18.762 2.589 1.00 0.00 C ATOM 2378 CD PRO B 42 3.456 -17.460 2.219 1.00 0.00 C ATOM 0 HA PRO B 42 0.884 -19.392 3.042 1.00 0.00 H new ATOM 0 HB2 PRO B 42 3.301 -20.581 3.367 1.00 0.00 H new ATOM 0 HB3 PRO B 42 2.785 -20.201 1.736 1.00 0.00 H new ATOM 0 HG2 PRO B 42 4.667 -18.669 3.529 1.00 0.00 H new ATOM 0 HG3 PRO B 42 4.846 -19.060 1.830 1.00 0.00 H new ATOM 0 HD2 PRO B 42 3.909 -16.615 2.738 1.00 0.00 H new ATOM 0 HD3 PRO B 42 3.535 -17.258 1.151 1.00 0.00 H new ATOM 2386 N ILE B 43 0.705 -18.891 5.353 1.00 0.00 N ATOM 2387 CA ILE B 43 0.523 -18.858 6.802 1.00 0.00 C ATOM 2388 C ILE B 43 1.494 -19.813 7.504 1.00 0.00 C ATOM 2389 O ILE B 43 1.840 -19.619 8.669 1.00 0.00 O ATOM 2390 CB ILE B 43 -0.952 -19.196 7.164 1.00 0.00 C ATOM 2391 CG1 ILE B 43 -1.084 -19.965 8.480 1.00 0.00 C ATOM 2392 CG2 ILE B 43 -1.614 -19.987 6.051 1.00 0.00 C ATOM 2393 CD1 ILE B 43 -2.445 -19.797 9.119 1.00 0.00 C ATOM 0 H ILE B 43 -0.171 -18.907 4.830 1.00 0.00 H new ATOM 0 HA ILE B 43 0.744 -17.850 7.154 1.00 0.00 H new ATOM 0 HB ILE B 43 -1.457 -18.238 7.290 1.00 0.00 H new ATOM 0 HG12 ILE B 43 -0.901 -21.024 8.298 1.00 0.00 H new ATOM 0 HG13 ILE B 43 -0.316 -19.624 9.174 1.00 0.00 H new ATOM 0 HG21 ILE B 43 -2.644 -20.211 6.327 1.00 0.00 H new ATOM 0 HG22 ILE B 43 -1.604 -19.401 5.132 1.00 0.00 H new ATOM 0 HG23 ILE B 43 -1.070 -20.918 5.893 1.00 0.00 H new ATOM 0 HD11 ILE B 43 -2.483 -20.364 10.049 1.00 0.00 H new ATOM 0 HD12 ILE B 43 -2.620 -18.742 9.330 1.00 0.00 H new ATOM 0 HD13 ILE B 43 -3.214 -20.164 8.439 1.00 0.00 H new ATOM 2405 N GLU B 44 1.933 -20.836 6.778 1.00 0.00 N ATOM 2406 CA GLU B 44 2.868 -21.817 7.308 1.00 0.00 C ATOM 2407 C GLU B 44 4.269 -21.224 7.459 1.00 0.00 C ATOM 2408 O GLU B 44 4.830 -21.207 8.554 1.00 0.00 O ATOM 2409 CB GLU B 44 2.920 -23.025 6.374 1.00 0.00 C ATOM 2410 CG GLU B 44 1.840 -24.058 6.652 1.00 0.00 C ATOM 2411 CD GLU B 44 1.615 -24.995 5.482 1.00 0.00 C ATOM 2412 OE1 GLU B 44 0.926 -24.591 4.522 1.00 0.00 O ATOM 2413 OE2 GLU B 44 2.128 -26.133 5.525 1.00 0.00 O ATOM 0 H GLU B 44 1.652 -21.006 5.812 1.00 0.00 H new ATOM 0 HA GLU B 44 2.521 -22.123 8.295 1.00 0.00 H new ATOM 0 HB2 GLU B 44 2.825 -22.681 5.344 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.897 -23.500 6.463 1.00 0.00 H new ATOM 0 HG2 GLU B 44 2.117 -24.640 7.531 1.00 0.00 H new ATOM 0 HG3 GLU B 44 0.906 -23.548 6.889 1.00 0.00 H new ATOM 2420 N LEU B 45 4.831 -20.745 6.350 1.00 0.00 N ATOM 2421 CA LEU B 45 6.171 -20.160 6.363 1.00 0.00 C ATOM 2422 C LEU B 45 6.220 -18.917 7.245 1.00 0.00 C ATOM 2423 O LEU B 45 7.271 -18.570 7.783 1.00 0.00 O ATOM 2424 CB LEU B 45 6.619 -19.801 4.944 1.00 0.00 C ATOM 2425 CG LEU B 45 6.267 -20.828 3.865 1.00 0.00 C ATOM 2426 CD1 LEU B 45 6.871 -20.423 2.529 1.00 0.00 C ATOM 2427 CD2 LEU B 45 6.746 -22.214 4.271 1.00 0.00 C ATOM 0 H LEU B 45 4.381 -20.750 5.434 1.00 0.00 H new ATOM 0 HA LEU B 45 6.851 -20.906 6.774 1.00 0.00 H new ATOM 0 HB2 LEU B 45 6.172 -18.845 4.671 1.00 0.00 H new ATOM 0 HB3 LEU B 45 7.700 -19.659 4.947 1.00 0.00 H new ATOM 0 HG LEU B 45 5.183 -20.858 3.757 1.00 0.00 H new ATOM 0 HD11 LEU B 45 6.611 -21.164 1.773 1.00 0.00 H new ATOM 0 HD12 LEU B 45 6.480 -19.450 2.233 1.00 0.00 H new ATOM 0 HD13 LEU B 45 7.955 -20.365 2.623 1.00 0.00 H new ATOM 0 HD21 LEU B 45 6.487 -22.931 3.492 1.00 0.00 H new ATOM 0 HD22 LEU B 45 7.827 -22.200 4.406 1.00 0.00 H new ATOM 0 HD23 LEU B 45 6.267 -22.505 5.206 1.00 0.00 H new ATOM 2439 N LEU B 46 5.079 -18.252 7.393 1.00 0.00 N ATOM 2440 CA LEU B 46 4.999 -17.051 8.215 1.00 0.00 C ATOM 2441 C LEU B 46 4.660 -17.399 9.663 1.00 0.00 C ATOM 2442 O LEU B 46 4.194 -16.549 10.422 1.00 0.00 O ATOM 2443 CB LEU B 46 3.950 -16.090 7.651 1.00 0.00 C ATOM 2444 CG LEU B 46 4.047 -14.652 8.164 1.00 0.00 C ATOM 2445 CD1 LEU B 46 5.022 -13.849 7.317 1.00 0.00 C ATOM 2446 CD2 LEU B 46 2.674 -13.996 8.167 1.00 0.00 C ATOM 0 H LEU B 46 4.199 -18.524 6.955 1.00 0.00 H new ATOM 0 HA LEU B 46 5.975 -16.566 8.197 1.00 0.00 H new ATOM 0 HB2 LEU B 46 4.037 -16.079 6.565 1.00 0.00 H new ATOM 0 HB3 LEU B 46 2.959 -16.478 7.888 1.00 0.00 H new ATOM 0 HG LEU B 46 4.420 -14.674 9.188 1.00 0.00 H new ATOM 0 HD11 LEU B 46 5.079 -12.829 7.696 1.00 0.00 H new ATOM 0 HD12 LEU B 46 6.009 -14.309 7.364 1.00 0.00 H new ATOM 0 HD13 LEU B 46 4.678 -13.833 6.283 1.00 0.00 H new ATOM 0 HD21 LEU B 46 2.760 -12.973 8.535 1.00 0.00 H new ATOM 0 HD22 LEU B 46 2.274 -13.985 7.153 1.00 0.00 H new ATOM 0 HD23 LEU B 46 2.003 -14.559 8.815 1.00 0.00 H new ATOM 2458 N ASP B 47 4.894 -18.654 10.041 1.00 0.00 N ATOM 2459 CA ASP B 47 4.612 -19.112 11.395 1.00 0.00 C ATOM 2460 C ASP B 47 3.159 -18.944 11.735 1.00 0.00 C ATOM 2461 O ASP B 47 2.648 -17.834 11.886 1.00 0.00 O ATOM 2462 CB ASP B 47 5.462 -18.376 12.421 1.00 0.00 C ATOM 2463 CG ASP B 47 6.855 -18.053 11.914 1.00 0.00 C ATOM 2464 OD1 ASP B 47 7.316 -18.733 10.973 1.00 0.00 O ATOM 2465 OD2 ASP B 47 7.484 -17.121 12.457 1.00 0.00 O ATOM 0 H ASP B 47 5.279 -19.371 9.426 1.00 0.00 H new ATOM 0 HA ASP B 47 4.863 -20.172 11.429 1.00 0.00 H new ATOM 0 HB2 ASP B 47 4.960 -17.450 12.704 1.00 0.00 H new ATOM 0 HB3 ASP B 47 5.541 -18.984 13.322 1.00 0.00 H new ATOM 2470 N LYS B 48 2.510 -20.075 11.857 1.00 0.00 N ATOM 2471 CA LYS B 48 1.112 -20.123 12.185 1.00 0.00 C ATOM 2472 C LYS B 48 0.844 -19.487 13.546 1.00 0.00 C ATOM 2473 O LYS B 48 -0.191 -18.856 13.757 1.00 0.00 O ATOM 2474 CB LYS B 48 0.672 -21.576 12.175 1.00 0.00 C ATOM 2475 CG LYS B 48 -0.369 -21.887 11.115 1.00 0.00 C ATOM 2476 CD LYS B 48 0.272 -22.385 9.832 1.00 0.00 C ATOM 2477 CE LYS B 48 1.117 -23.630 10.064 1.00 0.00 C ATOM 2478 NZ LYS B 48 0.580 -24.810 9.330 1.00 0.00 N ATOM 0 H LYS B 48 2.941 -20.991 11.731 1.00 0.00 H new ATOM 0 HA LYS B 48 0.543 -19.555 11.449 1.00 0.00 H new ATOM 0 HB2 LYS B 48 1.544 -22.210 12.014 1.00 0.00 H new ATOM 0 HB3 LYS B 48 0.269 -21.832 13.155 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -1.061 -22.640 11.493 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -0.955 -20.992 10.906 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -0.505 -22.605 9.100 1.00 0.00 H new ATOM 0 HD3 LYS B 48 0.895 -21.597 9.408 1.00 0.00 H new ATOM 0 HE2 LYS B 48 2.141 -23.439 9.744 1.00 0.00 H new ATOM 0 HE3 LYS B 48 1.152 -23.851 11.131 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 1.367 -25.422 9.034 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -0.059 -25.344 9.952 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 0.057 -24.488 8.491 1.00 0.00 H new ATOM 2492 N LYS B 49 1.788 -19.662 14.466 1.00 0.00 N ATOM 2493 CA LYS B 49 1.663 -19.109 15.810 1.00 0.00 C ATOM 2494 C LYS B 49 1.500 -17.592 15.768 1.00 0.00 C ATOM 2495 O LYS B 49 0.961 -16.992 16.699 1.00 0.00 O ATOM 2496 CB LYS B 49 2.889 -19.477 16.648 1.00 0.00 C ATOM 2497 CG LYS B 49 4.207 -19.070 16.010 1.00 0.00 C ATOM 2498 CD LYS B 49 5.393 -19.508 16.854 1.00 0.00 C ATOM 2499 CE LYS B 49 6.008 -20.794 16.325 1.00 0.00 C ATOM 2500 NZ LYS B 49 6.464 -21.686 17.426 1.00 0.00 N ATOM 0 H LYS B 49 2.650 -20.184 14.304 1.00 0.00 H new ATOM 0 HA LYS B 49 0.771 -19.537 16.268 1.00 0.00 H new ATOM 0 HB2 LYS B 49 2.806 -19.002 17.626 1.00 0.00 H new ATOM 0 HB3 LYS B 49 2.894 -20.554 16.816 1.00 0.00 H new ATOM 0 HG2 LYS B 49 4.283 -19.512 15.016 1.00 0.00 H new ATOM 0 HG3 LYS B 49 4.231 -17.988 15.881 1.00 0.00 H new ATOM 0 HD2 LYS B 49 6.146 -18.720 16.862 1.00 0.00 H new ATOM 0 HD3 LYS B 49 5.073 -19.654 17.886 1.00 0.00 H new ATOM 0 HE2 LYS B 49 5.277 -21.320 15.711 1.00 0.00 H new ATOM 0 HE3 LYS B 49 6.853 -20.554 15.679 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 6.877 -22.551 17.023 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 7.180 -21.194 17.997 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 5.654 -21.937 18.028 1.00 0.00 H new ATOM 2514 N ALA B 50 1.969 -16.975 14.686 1.00 0.00 N ATOM 2515 CA ALA B 50 1.874 -15.527 14.528 1.00 0.00 C ATOM 2516 C ALA B 50 0.445 -15.037 14.754 1.00 0.00 C ATOM 2517 O ALA B 50 -0.517 -15.750 14.467 1.00 0.00 O ATOM 2518 CB ALA B 50 2.363 -15.116 13.148 1.00 0.00 C ATOM 0 H ALA B 50 2.418 -17.455 13.906 1.00 0.00 H new ATOM 0 HA ALA B 50 2.510 -15.063 15.282 1.00 0.00 H new ATOM 0 HB1 ALA B 50 2.287 -14.034 13.042 1.00 0.00 H new ATOM 0 HB2 ALA B 50 3.402 -15.421 13.025 1.00 0.00 H new ATOM 0 HB3 ALA B 50 1.751 -15.599 12.386 1.00 0.00 H new ATOM 2524 N PRO B 51 0.288 -13.807 15.274 1.00 0.00 N ATOM 2525 CA PRO B 51 -1.032 -13.225 15.538 1.00 0.00 C ATOM 2526 C PRO B 51 -1.790 -12.903 14.255 1.00 0.00 C ATOM 2527 O PRO B 51 -1.257 -12.259 13.351 1.00 0.00 O ATOM 2528 CB PRO B 51 -0.709 -11.940 16.305 1.00 0.00 C ATOM 2529 CG PRO B 51 0.675 -11.585 15.885 1.00 0.00 C ATOM 2530 CD PRO B 51 1.382 -12.890 15.645 1.00 0.00 C ATOM 0 HA PRO B 51 -1.677 -13.912 16.085 1.00 0.00 H new ATOM 0 HB2 PRO B 51 -1.413 -11.145 16.060 1.00 0.00 H new ATOM 0 HB3 PRO B 51 -0.768 -12.097 17.382 1.00 0.00 H new ATOM 0 HG2 PRO B 51 0.664 -10.975 14.982 1.00 0.00 H new ATOM 0 HG3 PRO B 51 1.180 -11.004 16.656 1.00 0.00 H new ATOM 0 HD2 PRO B 51 2.123 -12.806 14.850 1.00 0.00 H new ATOM 0 HD3 PRO B 51 1.908 -13.232 16.536 1.00 0.00 H new ATOM 2538 N SER B 52 -3.038 -13.355 14.182 1.00 0.00 N ATOM 2539 CA SER B 52 -3.871 -13.115 13.010 1.00 0.00 C ATOM 2540 C SER B 52 -4.812 -11.938 13.245 1.00 0.00 C ATOM 2541 O SER B 52 -5.927 -11.908 12.724 1.00 0.00 O ATOM 2542 CB SER B 52 -4.678 -14.368 12.666 1.00 0.00 C ATOM 2543 OG SER B 52 -3.870 -15.333 12.015 1.00 0.00 O ATOM 0 H SER B 52 -3.494 -13.890 14.921 1.00 0.00 H new ATOM 0 HA SER B 52 -3.216 -12.873 12.173 1.00 0.00 H new ATOM 0 HB2 SER B 52 -5.098 -14.795 13.577 1.00 0.00 H new ATOM 0 HB3 SER B 52 -5.517 -14.099 12.024 1.00 0.00 H new ATOM 0 HG SER B 52 -4.409 -16.125 11.807 1.00 0.00 H new ATOM 2549 N HIS B 53 -4.355 -10.970 14.033 1.00 0.00 N ATOM 2550 CA HIS B 53 -5.156 -9.789 14.337 1.00 0.00 C ATOM 2551 C HIS B 53 -5.525 -9.038 13.061 1.00 0.00 C ATOM 2552 O HIS B 53 -6.584 -8.416 12.980 1.00 0.00 O ATOM 2553 CB HIS B 53 -4.395 -8.862 15.286 1.00 0.00 C ATOM 2554 CG HIS B 53 -5.272 -8.187 16.294 1.00 0.00 C ATOM 2555 ND1 HIS B 53 -6.124 -8.875 17.133 1.00 0.00 N ATOM 2556 CD2 HIS B 53 -5.427 -6.876 16.598 1.00 0.00 C ATOM 2557 CE1 HIS B 53 -6.765 -8.018 17.907 1.00 0.00 C ATOM 2558 NE2 HIS B 53 -6.360 -6.799 17.603 1.00 0.00 N ATOM 0 H HIS B 53 -3.435 -10.980 14.473 1.00 0.00 H new ATOM 0 HA HIS B 53 -6.075 -10.119 14.821 1.00 0.00 H new ATOM 0 HB2 HIS B 53 -3.631 -9.438 15.809 1.00 0.00 H new ATOM 0 HB3 HIS B 53 -3.877 -8.102 14.701 1.00 0.00 H new ATOM 0 HD2 HIS B 53 -4.913 -6.046 16.136 1.00 0.00 H new ATOM 0 HE1 HIS B 53 -7.496 -8.271 18.660 1.00 0.00 H new ATOM 0 HE2 HIS B 53 -6.687 -5.939 18.043 1.00 0.00 H new ATOM 2567 N LEU B 54 -4.645 -9.102 12.068 1.00 0.00 N ATOM 2568 CA LEU B 54 -4.878 -8.429 10.795 1.00 0.00 C ATOM 2569 C LEU B 54 -4.813 -9.418 9.636 1.00 0.00 C ATOM 2570 O LEU B 54 -5.796 -9.618 8.924 1.00 0.00 O ATOM 2571 CB LEU B 54 -3.852 -7.313 10.588 1.00 0.00 C ATOM 2572 CG LEU B 54 -4.006 -6.525 9.286 1.00 0.00 C ATOM 2573 CD1 LEU B 54 -4.917 -5.325 9.493 1.00 0.00 C ATOM 2574 CD2 LEU B 54 -2.646 -6.081 8.768 1.00 0.00 C ATOM 0 H LEU B 54 -3.764 -9.613 12.120 1.00 0.00 H new ATOM 0 HA LEU B 54 -5.877 -7.994 10.821 1.00 0.00 H new ATOM 0 HB2 LEU B 54 -3.919 -6.618 11.425 1.00 0.00 H new ATOM 0 HB3 LEU B 54 -2.853 -7.749 10.615 1.00 0.00 H new ATOM 0 HG LEU B 54 -4.462 -7.177 8.541 1.00 0.00 H new ATOM 0 HD11 LEU B 54 -5.015 -4.776 8.556 1.00 0.00 H new ATOM 0 HD12 LEU B 54 -5.900 -5.666 9.818 1.00 0.00 H new ATOM 0 HD13 LEU B 54 -4.490 -4.671 10.253 1.00 0.00 H new ATOM 0 HD21 LEU B 54 -2.774 -5.522 7.841 1.00 0.00 H new ATOM 0 HD22 LEU B 54 -2.163 -5.446 9.511 1.00 0.00 H new ATOM 0 HD23 LEU B 54 -2.025 -6.957 8.580 1.00 0.00 H new ATOM 2586 N CYS B 55 -3.647 -10.034 9.455 1.00 0.00 N ATOM 2587 CA CYS B 55 -3.446 -11.006 8.382 1.00 0.00 C ATOM 2588 C CYS B 55 -4.572 -12.041 8.354 1.00 0.00 C ATOM 2589 O CYS B 55 -4.574 -12.986 9.143 1.00 0.00 O ATOM 2590 CB CYS B 55 -2.100 -11.712 8.555 1.00 0.00 C ATOM 2591 SG CYS B 55 -0.690 -10.588 8.691 1.00 0.00 S ATOM 0 H CYS B 55 -2.825 -9.877 10.039 1.00 0.00 H new ATOM 0 HA CYS B 55 -3.453 -10.466 7.435 1.00 0.00 H new ATOM 0 HB2 CYS B 55 -2.141 -12.336 9.448 1.00 0.00 H new ATOM 0 HB3 CYS B 55 -1.940 -12.378 7.707 1.00 0.00 H new ATOM 0 HG CYS B 55 0.402 -11.278 8.837 1.00 0.00 H new ATOM 2597 N PRO B 56 -5.551 -11.875 7.445 1.00 0.00 N ATOM 2598 CA PRO B 56 -6.682 -12.787 7.316 1.00 0.00 C ATOM 2599 C PRO B 56 -6.344 -14.002 6.459 1.00 0.00 C ATOM 2600 O PRO B 56 -6.018 -13.872 5.279 1.00 0.00 O ATOM 2601 CB PRO B 56 -7.763 -11.931 6.630 1.00 0.00 C ATOM 2602 CG PRO B 56 -7.135 -10.592 6.378 1.00 0.00 C ATOM 2603 CD PRO B 56 -5.650 -10.793 6.468 1.00 0.00 C ATOM 0 HA PRO B 56 -6.992 -13.190 8.280 1.00 0.00 H new ATOM 0 HB2 PRO B 56 -8.090 -12.390 5.697 1.00 0.00 H new ATOM 0 HB3 PRO B 56 -8.645 -11.835 7.264 1.00 0.00 H new ATOM 0 HG2 PRO B 56 -7.416 -10.211 5.396 1.00 0.00 H new ATOM 0 HG3 PRO B 56 -7.473 -9.861 7.113 1.00 0.00 H new ATOM 0 HD2 PRO B 56 -5.216 -11.070 5.507 1.00 0.00 H new ATOM 0 HD3 PRO B 56 -5.135 -9.892 6.803 1.00 0.00 H new ATOM 2611 N THR B 57 -6.420 -15.181 7.063 1.00 0.00 N ATOM 2612 CA THR B 57 -6.119 -16.422 6.362 1.00 0.00 C ATOM 2613 C THR B 57 -7.190 -16.770 5.366 1.00 0.00 C ATOM 2614 O THR B 57 -8.309 -16.259 5.412 1.00 0.00 O ATOM 2615 CB THR B 57 -5.947 -17.586 7.343 1.00 0.00 C ATOM 2616 OG1 THR B 57 -4.577 -17.836 7.594 1.00 0.00 O ATOM 2617 CG2 THR B 57 -6.571 -18.899 6.882 1.00 0.00 C ATOM 0 H THR B 57 -6.688 -15.304 8.039 1.00 0.00 H new ATOM 0 HA THR B 57 -5.182 -16.260 5.829 1.00 0.00 H new ATOM 0 HB THR B 57 -6.471 -17.260 8.241 1.00 0.00 H new ATOM 0 HG1 THR B 57 -4.091 -17.880 6.744 1.00 0.00 H new ATOM 0 HG21 THR B 57 -6.402 -19.667 7.637 1.00 0.00 H new ATOM 0 HG22 THR B 57 -7.643 -18.762 6.738 1.00 0.00 H new ATOM 0 HG23 THR B 57 -6.115 -19.208 5.941 1.00 0.00 H new ATOM 2625 N ILE B 58 -6.837 -17.689 4.490 1.00 0.00 N ATOM 2626 CA ILE B 58 -7.764 -18.166 3.500 1.00 0.00 C ATOM 2627 C ILE B 58 -7.718 -19.687 3.396 1.00 0.00 C ATOM 2628 O ILE B 58 -6.778 -20.324 3.867 1.00 0.00 O ATOM 2629 CB ILE B 58 -7.529 -17.518 2.111 1.00 0.00 C ATOM 2630 CG1 ILE B 58 -8.479 -16.345 1.921 1.00 0.00 C ATOM 2631 CG2 ILE B 58 -7.676 -18.509 0.963 1.00 0.00 C ATOM 2632 CD1 ILE B 58 -7.758 -15.038 1.781 1.00 0.00 C ATOM 0 H ILE B 58 -5.912 -18.117 4.449 1.00 0.00 H new ATOM 0 HA ILE B 58 -8.759 -17.868 3.831 1.00 0.00 H new ATOM 0 HB ILE B 58 -6.497 -17.167 2.090 1.00 0.00 H new ATOM 0 HG12 ILE B 58 -9.089 -16.516 1.034 1.00 0.00 H new ATOM 0 HG13 ILE B 58 -9.159 -16.292 2.771 1.00 0.00 H new ATOM 0 HG21 ILE B 58 -7.500 -17.998 0.016 1.00 0.00 H new ATOM 0 HG22 ILE B 58 -6.950 -19.313 1.081 1.00 0.00 H new ATOM 0 HG23 ILE B 58 -8.683 -18.926 0.969 1.00 0.00 H new ATOM 0 HD11 ILE B 58 -8.483 -14.235 1.648 1.00 0.00 H new ATOM 0 HD12 ILE B 58 -7.169 -14.850 2.678 1.00 0.00 H new ATOM 0 HD13 ILE B 58 -7.098 -15.078 0.915 1.00 0.00 H new ATOM 2644 N HIS B 59 -8.728 -20.253 2.754 1.00 0.00 N ATOM 2645 CA HIS B 59 -8.803 -21.688 2.553 1.00 0.00 C ATOM 2646 C HIS B 59 -9.116 -21.983 1.101 1.00 0.00 C ATOM 2647 O HIS B 59 -10.277 -22.091 0.705 1.00 0.00 O ATOM 2648 CB HIS B 59 -9.854 -22.327 3.446 1.00 0.00 C ATOM 2649 CG HIS B 59 -11.091 -21.500 3.618 1.00 0.00 C ATOM 2650 ND1 HIS B 59 -12.107 -21.235 2.761 1.00 0.00 N flip ATOM 2651 CD2 HIS B 59 -11.394 -20.831 4.785 1.00 0.00 C flip ATOM 2652 CE1 HIS B 59 -12.993 -20.420 3.421 1.00 0.00 C flip ATOM 2653 NE2 HIS B 59 -12.541 -20.191 4.639 1.00 0.00 N flip ATOM 0 H HIS B 59 -9.513 -19.733 2.361 1.00 0.00 H new ATOM 0 HA HIS B 59 -7.836 -22.115 2.819 1.00 0.00 H new ATOM 0 HB2 HIS B 59 -10.131 -23.295 3.028 1.00 0.00 H new ATOM 0 HB3 HIS B 59 -9.417 -22.517 4.426 1.00 0.00 H new ATOM 0 HD1 HIS B 59 -12.197 -21.577 1.804 1.00 0.00 H new ATOM 0 HD2 HIS B 59 -10.788 -20.830 5.679 1.00 0.00 H new ATOM 0 HE1 HIS B 59 -13.912 -20.029 3.009 1.00 0.00 H new ATOM 2662 N ILE B 60 -8.067 -22.098 0.318 1.00 0.00 N ATOM 2663 CA ILE B 60 -8.197 -22.368 -1.104 1.00 0.00 C ATOM 2664 C ILE B 60 -7.504 -23.678 -1.476 1.00 0.00 C ATOM 2665 O ILE B 60 -6.961 -24.368 -0.613 1.00 0.00 O ATOM 2666 CB ILE B 60 -7.633 -21.201 -1.948 1.00 0.00 C ATOM 2667 CG1 ILE B 60 -6.119 -21.076 -1.763 1.00 0.00 C ATOM 2668 CG2 ILE B 60 -8.327 -19.891 -1.574 1.00 0.00 C ATOM 2669 CD1 ILE B 60 -5.356 -21.038 -3.069 1.00 0.00 C ATOM 0 H ILE B 60 -7.104 -22.008 0.642 1.00 0.00 H new ATOM 0 HA ILE B 60 -9.260 -22.465 -1.326 1.00 0.00 H new ATOM 0 HB ILE B 60 -7.830 -21.413 -2.999 1.00 0.00 H new ATOM 0 HG12 ILE B 60 -5.903 -20.169 -1.198 1.00 0.00 H new ATOM 0 HG13 ILE B 60 -5.763 -21.916 -1.167 1.00 0.00 H new ATOM 0 HG21 ILE B 60 -7.920 -19.079 -2.176 1.00 0.00 H new ATOM 0 HG22 ILE B 60 -9.397 -19.980 -1.761 1.00 0.00 H new ATOM 0 HG23 ILE B 60 -8.160 -19.679 -0.518 1.00 0.00 H new ATOM 0 HD11 ILE B 60 -4.289 -20.949 -2.865 1.00 0.00 H new ATOM 0 HD12 ILE B 60 -5.543 -21.956 -3.626 1.00 0.00 H new ATOM 0 HD13 ILE B 60 -5.686 -20.182 -3.658 1.00 0.00 H new ATOM 2681 N ASP B 61 -7.548 -24.027 -2.756 1.00 0.00 N ATOM 2682 CA ASP B 61 -6.947 -25.270 -3.235 1.00 0.00 C ATOM 2683 C ASP B 61 -5.482 -25.401 -2.832 1.00 0.00 C ATOM 2684 O ASP B 61 -5.072 -26.425 -2.287 1.00 0.00 O ATOM 2685 CB ASP B 61 -7.080 -25.370 -4.755 1.00 0.00 C ATOM 2686 CG ASP B 61 -7.151 -26.807 -5.236 1.00 0.00 C ATOM 2687 OD1 ASP B 61 -6.503 -27.674 -4.613 1.00 0.00 O ATOM 2688 OD2 ASP B 61 -7.854 -27.064 -6.235 1.00 0.00 O ATOM 0 H ASP B 61 -7.994 -23.468 -3.483 1.00 0.00 H new ATOM 0 HA ASP B 61 -7.489 -26.090 -2.764 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -7.976 -24.838 -5.074 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -6.231 -24.874 -5.225 1.00 0.00 H new ATOM 2693 N GLU B 62 -4.692 -24.373 -3.113 1.00 0.00 N ATOM 2694 CA GLU B 62 -3.270 -24.399 -2.785 1.00 0.00 C ATOM 2695 C GLU B 62 -3.034 -24.500 -1.275 1.00 0.00 C ATOM 2696 O GLU B 62 -1.904 -24.718 -0.837 1.00 0.00 O ATOM 2697 CB GLU B 62 -2.564 -23.165 -3.350 1.00 0.00 C ATOM 2698 CG GLU B 62 -3.007 -22.800 -4.758 1.00 0.00 C ATOM 2699 CD GLU B 62 -1.850 -22.725 -5.735 1.00 0.00 C ATOM 2700 OE1 GLU B 62 -0.777 -22.218 -5.346 1.00 0.00 O ATOM 2701 OE2 GLU B 62 -2.016 -23.173 -6.889 1.00 0.00 O ATOM 0 H GLU B 62 -5.008 -23.515 -3.565 1.00 0.00 H new ATOM 0 HA GLU B 62 -2.848 -25.292 -3.246 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -2.748 -22.318 -2.689 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -1.488 -23.341 -3.351 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -3.727 -23.538 -5.111 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -3.521 -21.839 -4.735 1.00 0.00 H new ATOM 2708 N GLY B 63 -4.096 -24.359 -0.478 1.00 0.00 N ATOM 2709 CA GLY B 63 -3.946 -24.460 0.967 1.00 0.00 C ATOM 2710 C GLY B 63 -4.262 -23.169 1.705 1.00 0.00 C ATOM 2711 O GLY B 63 -4.881 -22.260 1.151 1.00 0.00 O ATOM 0 H GLY B 63 -5.046 -24.179 -0.803 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -4.600 -25.249 1.337 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -2.923 -24.759 1.197 1.00 0.00 H new ATOM 2715 N ASP B 64 -3.836 -23.101 2.967 1.00 0.00 N ATOM 2716 CA ASP B 64 -4.072 -21.927 3.808 1.00 0.00 C ATOM 2717 C ASP B 64 -3.029 -20.845 3.561 1.00 0.00 C ATOM 2718 O ASP B 64 -1.836 -21.124 3.446 1.00 0.00 O ATOM 2719 CB ASP B 64 -4.069 -22.326 5.285 1.00 0.00 C ATOM 2720 CG ASP B 64 -2.841 -23.128 5.667 1.00 0.00 C ATOM 2721 OD1 ASP B 64 -1.716 -22.655 5.401 1.00 0.00 O ATOM 2722 OD2 ASP B 64 -3.004 -24.230 6.232 1.00 0.00 O ATOM 0 H ASP B 64 -3.323 -23.850 3.431 1.00 0.00 H new ATOM 0 HA ASP B 64 -5.049 -21.521 3.545 1.00 0.00 H new ATOM 0 HB2 ASP B 64 -4.118 -21.428 5.901 1.00 0.00 H new ATOM 0 HB3 ASP B 64 -4.963 -22.911 5.502 1.00 0.00 H new ATOM 2727 N PHE B 65 -3.503 -19.608 3.481 1.00 0.00 N ATOM 2728 CA PHE B 65 -2.646 -18.453 3.243 1.00 0.00 C ATOM 2729 C PHE B 65 -3.104 -17.292 4.110 1.00 0.00 C ATOM 2730 O PHE B 65 -3.971 -17.473 4.959 1.00 0.00 O ATOM 2731 CB PHE B 65 -2.663 -18.109 1.761 1.00 0.00 C ATOM 2732 CG PHE B 65 -2.347 -19.318 0.941 1.00 0.00 C ATOM 2733 CD1 PHE B 65 -1.153 -19.987 1.137 1.00 0.00 C ATOM 2734 CD2 PHE B 65 -3.249 -19.813 0.020 1.00 0.00 C ATOM 2735 CE1 PHE B 65 -0.860 -21.135 0.426 1.00 0.00 C ATOM 2736 CE2 PHE B 65 -2.962 -20.954 -0.701 1.00 0.00 C ATOM 2737 CZ PHE B 65 -1.766 -21.618 -0.498 1.00 0.00 C ATOM 0 H PHE B 65 -4.492 -19.377 3.579 1.00 0.00 H new ATOM 0 HA PHE B 65 -1.616 -18.679 3.518 1.00 0.00 H new ATOM 0 HB2 PHE B 65 -3.642 -17.719 1.483 1.00 0.00 H new ATOM 0 HB3 PHE B 65 -1.937 -17.323 1.555 1.00 0.00 H new ATOM 0 HD1 PHE B 65 -0.441 -19.608 1.855 1.00 0.00 H new ATOM 0 HD2 PHE B 65 -4.188 -19.302 -0.137 1.00 0.00 H new ATOM 0 HE1 PHE B 65 0.073 -21.652 0.592 1.00 0.00 H new ATOM 0 HE2 PHE B 65 -3.672 -21.329 -1.424 1.00 0.00 H new ATOM 0 HZ PHE B 65 -1.541 -22.512 -1.061 1.00 0.00 H new ATOM 2747 N ILE B 66 -2.516 -16.113 3.933 1.00 0.00 N ATOM 2748 CA ILE B 66 -2.894 -14.973 4.758 1.00 0.00 C ATOM 2749 C ILE B 66 -2.611 -13.653 4.056 1.00 0.00 C ATOM 2750 O ILE B 66 -1.457 -13.316 3.792 1.00 0.00 O ATOM 2751 CB ILE B 66 -2.162 -14.989 6.122 1.00 0.00 C ATOM 2752 CG1 ILE B 66 -1.010 -15.995 6.101 1.00 0.00 C ATOM 2753 CG2 ILE B 66 -3.131 -15.304 7.251 1.00 0.00 C ATOM 2754 CD1 ILE B 66 0.058 -15.623 5.109 1.00 0.00 C ATOM 0 H ILE B 66 -1.791 -15.924 3.241 1.00 0.00 H new ATOM 0 HA ILE B 66 -3.967 -15.060 4.929 1.00 0.00 H new ATOM 0 HB ILE B 66 -1.748 -13.997 6.299 1.00 0.00 H new ATOM 0 HG12 ILE B 66 -0.571 -16.061 7.096 1.00 0.00 H new ATOM 0 HG13 ILE B 66 -1.399 -16.984 5.858 1.00 0.00 H new ATOM 0 HG21 ILE B 66 -2.595 -15.310 8.200 1.00 0.00 H new ATOM 0 HG22 ILE B 66 -3.913 -14.546 7.281 1.00 0.00 H new ATOM 0 HG23 ILE B 66 -3.581 -16.283 7.082 1.00 0.00 H new ATOM 0 HD11 ILE B 66 0.853 -16.369 5.133 1.00 0.00 H new ATOM 0 HD12 ILE B 66 -0.373 -15.584 4.108 1.00 0.00 H new ATOM 0 HD13 ILE B 66 0.469 -14.647 5.366 1.00 0.00 H new ATOM 2766 N MET B 67 -3.666 -12.896 3.768 1.00 0.00 N ATOM 2767 CA MET B 67 -3.504 -11.607 3.112 1.00 0.00 C ATOM 2768 C MET B 67 -2.658 -10.690 3.979 1.00 0.00 C ATOM 2769 O MET B 67 -3.088 -10.262 5.050 1.00 0.00 O ATOM 2770 CB MET B 67 -4.861 -10.956 2.841 1.00 0.00 C ATOM 2771 CG MET B 67 -5.796 -11.814 2.012 1.00 0.00 C ATOM 2772 SD MET B 67 -7.251 -10.911 1.452 1.00 0.00 S ATOM 2773 CE MET B 67 -7.768 -10.128 2.976 1.00 0.00 C ATOM 0 H MET B 67 -4.631 -13.151 3.977 1.00 0.00 H new ATOM 0 HA MET B 67 -3.004 -11.769 2.157 1.00 0.00 H new ATOM 0 HB2 MET B 67 -5.341 -10.727 3.793 1.00 0.00 H new ATOM 0 HB3 MET B 67 -4.703 -10.007 2.328 1.00 0.00 H new ATOM 0 HG2 MET B 67 -5.257 -12.200 1.147 1.00 0.00 H new ATOM 0 HG3 MET B 67 -6.112 -12.675 2.601 1.00 0.00 H new ATOM 0 HE1 MET B 67 -8.651 -9.516 2.790 1.00 0.00 H new ATOM 0 HE2 MET B 67 -8.006 -10.893 3.715 1.00 0.00 H new ATOM 0 HE3 MET B 67 -6.963 -9.497 3.352 1.00 0.00 H new ATOM 2783 N LEU B 68 -1.453 -10.395 3.517 1.00 0.00 N ATOM 2784 CA LEU B 68 -0.554 -9.529 4.266 1.00 0.00 C ATOM 2785 C LEU B 68 -1.034 -8.079 4.192 1.00 0.00 C ATOM 2786 O LEU B 68 -0.490 -7.270 3.441 1.00 0.00 O ATOM 2787 CB LEU B 68 0.885 -9.655 3.732 1.00 0.00 C ATOM 2788 CG LEU B 68 2.009 -9.553 4.775 1.00 0.00 C ATOM 2789 CD1 LEU B 68 1.534 -8.858 6.044 1.00 0.00 C ATOM 2790 CD2 LEU B 68 2.558 -10.937 5.096 1.00 0.00 C ATOM 0 H LEU B 68 -1.076 -10.739 2.634 1.00 0.00 H new ATOM 0 HA LEU B 68 -0.557 -9.841 5.310 1.00 0.00 H new ATOM 0 HB2 LEU B 68 0.978 -10.614 3.221 1.00 0.00 H new ATOM 0 HB3 LEU B 68 1.041 -8.879 2.983 1.00 0.00 H new ATOM 0 HG LEU B 68 2.808 -8.946 4.348 1.00 0.00 H new ATOM 0 HD11 LEU B 68 2.355 -8.804 6.759 1.00 0.00 H new ATOM 0 HD12 LEU B 68 1.197 -7.850 5.802 1.00 0.00 H new ATOM 0 HD13 LEU B 68 0.710 -9.422 6.481 1.00 0.00 H new ATOM 0 HD21 LEU B 68 3.354 -10.850 5.836 1.00 0.00 H new ATOM 0 HD22 LEU B 68 1.759 -11.562 5.494 1.00 0.00 H new ATOM 0 HD23 LEU B 68 2.955 -11.390 4.188 1.00 0.00 H new ATOM 2802 N THR B 69 -2.066 -7.763 4.979 1.00 0.00 N ATOM 2803 CA THR B 69 -2.633 -6.414 5.010 1.00 0.00 C ATOM 2804 C THR B 69 -1.675 -5.431 5.683 1.00 0.00 C ATOM 2805 O THR B 69 -1.860 -4.217 5.598 1.00 0.00 O ATOM 2806 CB THR B 69 -3.986 -6.413 5.739 1.00 0.00 C ATOM 2807 OG1 THR B 69 -4.269 -7.693 6.276 1.00 0.00 O ATOM 2808 CG2 THR B 69 -5.158 -6.021 4.853 1.00 0.00 C ATOM 0 H THR B 69 -2.526 -8.425 5.604 1.00 0.00 H new ATOM 0 HA THR B 69 -2.787 -6.093 3.980 1.00 0.00 H new ATOM 0 HB THR B 69 -3.882 -5.664 6.524 1.00 0.00 H new ATOM 0 HG1 THR B 69 -5.195 -7.716 6.596 1.00 0.00 H new ATOM 0 HG21 THR B 69 -6.078 -6.043 5.436 1.00 0.00 H new ATOM 0 HG22 THR B 69 -4.999 -5.015 4.463 1.00 0.00 H new ATOM 0 HG23 THR B 69 -5.238 -6.723 4.023 1.00 0.00 H new ATOM 2816 N GLN B 70 -0.650 -5.960 6.348 1.00 0.00 N ATOM 2817 CA GLN B 70 0.333 -5.123 7.028 1.00 0.00 C ATOM 2818 C GLN B 70 1.491 -4.761 6.097 1.00 0.00 C ATOM 2819 O GLN B 70 2.548 -4.324 6.551 1.00 0.00 O ATOM 2820 CB GLN B 70 0.868 -5.839 8.269 1.00 0.00 C ATOM 2821 CG GLN B 70 1.329 -4.892 9.365 1.00 0.00 C ATOM 2822 CD GLN B 70 2.393 -5.504 10.255 1.00 0.00 C ATOM 2823 OE1 GLN B 70 3.084 -6.443 9.860 1.00 0.00 O ATOM 2824 NE2 GLN B 70 2.530 -4.974 11.465 1.00 0.00 N ATOM 0 H GLN B 70 -0.480 -6.962 6.430 1.00 0.00 H new ATOM 0 HA GLN B 70 -0.163 -4.201 7.330 1.00 0.00 H new ATOM 0 HB2 GLN B 70 0.090 -6.490 8.667 1.00 0.00 H new ATOM 0 HB3 GLN B 70 1.701 -6.479 7.978 1.00 0.00 H new ATOM 0 HG2 GLN B 70 1.720 -3.981 8.912 1.00 0.00 H new ATOM 0 HG3 GLN B 70 0.473 -4.603 9.975 1.00 0.00 H new ATOM 0 HE21 GLN B 70 1.936 -4.196 11.751 1.00 0.00 H new ATOM 0 HE22 GLN B 70 3.230 -5.345 12.108 1.00 0.00 H new ATOM 2833 N GLN B 71 1.284 -4.939 4.794 1.00 0.00 N ATOM 2834 CA GLN B 71 2.308 -4.624 3.805 1.00 0.00 C ATOM 2835 C GLN B 71 1.666 -4.349 2.450 1.00 0.00 C ATOM 2836 O GLN B 71 2.277 -4.568 1.404 1.00 0.00 O ATOM 2837 CB GLN B 71 3.307 -5.777 3.682 1.00 0.00 C ATOM 2838 CG GLN B 71 4.536 -5.613 4.561 1.00 0.00 C ATOM 2839 CD GLN B 71 5.766 -5.204 3.774 1.00 0.00 C ATOM 2840 OE1 GLN B 71 6.409 -6.033 3.130 1.00 0.00 O ATOM 2841 NE2 GLN B 71 6.099 -3.919 3.821 1.00 0.00 N ATOM 0 H GLN B 71 0.415 -5.300 4.400 1.00 0.00 H new ATOM 0 HA GLN B 71 2.840 -3.732 4.134 1.00 0.00 H new ATOM 0 HB2 GLN B 71 2.806 -6.710 3.942 1.00 0.00 H new ATOM 0 HB3 GLN B 71 3.623 -5.864 2.642 1.00 0.00 H new ATOM 0 HG2 GLN B 71 4.333 -4.864 5.326 1.00 0.00 H new ATOM 0 HG3 GLN B 71 4.736 -6.551 5.078 1.00 0.00 H new ATOM 0 HE21 GLN B 71 5.537 -3.266 4.368 1.00 0.00 H new ATOM 0 HE22 GLN B 71 6.916 -3.585 3.310 1.00 0.00 H new ATOM 2850 N MET B 72 0.425 -3.872 2.481 1.00 0.00 N ATOM 2851 CA MET B 72 -0.317 -3.567 1.263 1.00 0.00 C ATOM 2852 C MET B 72 0.533 -2.756 0.288 1.00 0.00 C ATOM 2853 O MET B 72 1.439 -2.029 0.695 1.00 0.00 O ATOM 2854 CB MET B 72 -1.595 -2.808 1.612 1.00 0.00 C ATOM 2855 CG MET B 72 -2.798 -3.228 0.782 1.00 0.00 C ATOM 2856 SD MET B 72 -4.332 -2.473 1.353 1.00 0.00 S ATOM 2857 CE MET B 72 -3.830 -0.761 1.502 1.00 0.00 C ATOM 0 H MET B 72 -0.090 -3.688 3.342 1.00 0.00 H new ATOM 0 HA MET B 72 -0.579 -4.506 0.776 1.00 0.00 H new ATOM 0 HB2 MET B 72 -1.821 -2.960 2.667 1.00 0.00 H new ATOM 0 HB3 MET B 72 -1.423 -1.741 1.473 1.00 0.00 H new ATOM 0 HG2 MET B 72 -2.629 -2.955 -0.260 1.00 0.00 H new ATOM 0 HG3 MET B 72 -2.897 -4.313 0.816 1.00 0.00 H new ATOM 0 HE1 MET B 72 -4.658 -0.113 1.214 1.00 0.00 H new ATOM 0 HE2 MET B 72 -3.548 -0.553 2.534 1.00 0.00 H new ATOM 0 HE3 MET B 72 -2.978 -0.573 0.848 1.00 0.00 H new ATOM 2867 N THR B 73 0.243 -2.898 -1.000 1.00 0.00 N ATOM 2868 CA THR B 73 0.991 -2.190 -2.032 1.00 0.00 C ATOM 2869 C THR B 73 0.337 -2.374 -3.400 1.00 0.00 C ATOM 2870 O THR B 73 -0.074 -3.477 -3.751 1.00 0.00 O ATOM 2871 CB THR B 73 2.436 -2.702 -2.066 1.00 0.00 C ATOM 2872 OG1 THR B 73 3.049 -2.401 -3.308 1.00 0.00 O ATOM 2873 CG2 THR B 73 2.554 -4.201 -1.844 1.00 0.00 C ATOM 0 H THR B 73 -0.504 -3.496 -1.354 1.00 0.00 H new ATOM 0 HA THR B 73 0.990 -1.126 -1.794 1.00 0.00 H new ATOM 0 HB THR B 73 2.938 -2.191 -1.244 1.00 0.00 H new ATOM 0 HG1 THR B 73 3.970 -2.735 -3.308 1.00 0.00 H new ATOM 0 HG21 THR B 73 3.604 -4.493 -1.881 1.00 0.00 H new ATOM 0 HG22 THR B 73 2.140 -4.458 -0.869 1.00 0.00 H new ATOM 0 HG23 THR B 73 2.003 -4.729 -2.623 1.00 0.00 H new ATOM 2881 N SER B 74 0.244 -1.293 -4.175 1.00 0.00 N ATOM 2882 CA SER B 74 -0.363 -1.367 -5.502 1.00 0.00 C ATOM 2883 C SER B 74 0.536 -2.133 -6.460 1.00 0.00 C ATOM 2884 O SER B 74 1.644 -1.700 -6.776 1.00 0.00 O ATOM 2885 CB SER B 74 -0.647 0.028 -6.057 1.00 0.00 C ATOM 2886 OG SER B 74 0.523 0.601 -6.615 1.00 0.00 O ATOM 0 H SER B 74 0.577 -0.366 -3.910 1.00 0.00 H new ATOM 0 HA SER B 74 -1.310 -1.898 -5.404 1.00 0.00 H new ATOM 0 HB2 SER B 74 -1.426 -0.031 -6.818 1.00 0.00 H new ATOM 0 HB3 SER B 74 -1.026 0.669 -5.262 1.00 0.00 H new ATOM 0 HG SER B 74 1.289 0.014 -6.443 1.00 0.00 H new ATOM 2892 N VAL B 75 0.048 -3.279 -6.915 1.00 0.00 N ATOM 2893 CA VAL B 75 0.797 -4.121 -7.834 1.00 0.00 C ATOM 2894 C VAL B 75 0.362 -3.872 -9.279 1.00 0.00 C ATOM 2895 O VAL B 75 -0.744 -4.237 -9.677 1.00 0.00 O ATOM 2896 CB VAL B 75 0.625 -5.611 -7.478 1.00 0.00 C ATOM 2897 CG1 VAL B 75 1.218 -5.895 -6.108 1.00 0.00 C ATOM 2898 CG2 VAL B 75 -0.836 -6.017 -7.545 1.00 0.00 C ATOM 0 H VAL B 75 -0.868 -3.647 -6.660 1.00 0.00 H new ATOM 0 HA VAL B 75 1.851 -3.861 -7.739 1.00 0.00 H new ATOM 0 HB VAL B 75 1.164 -6.211 -8.211 1.00 0.00 H new ATOM 0 HG11 VAL B 75 1.090 -6.951 -5.868 1.00 0.00 H new ATOM 0 HG12 VAL B 75 2.280 -5.650 -6.113 1.00 0.00 H new ATOM 0 HG13 VAL B 75 0.710 -5.288 -5.359 1.00 0.00 H new ATOM 0 HG21 VAL B 75 -0.932 -7.072 -7.290 1.00 0.00 H new ATOM 0 HG22 VAL B 75 -1.413 -5.419 -6.839 1.00 0.00 H new ATOM 0 HG23 VAL B 75 -1.214 -5.852 -8.554 1.00 0.00 H new ATOM 2908 N PRO B 76 1.226 -3.225 -10.082 1.00 0.00 N ATOM 2909 CA PRO B 76 0.924 -2.908 -11.482 1.00 0.00 C ATOM 2910 C PRO B 76 0.366 -4.097 -12.262 1.00 0.00 C ATOM 2911 O PRO B 76 0.957 -5.176 -12.283 1.00 0.00 O ATOM 2912 CB PRO B 76 2.282 -2.485 -12.042 1.00 0.00 C ATOM 2913 CG PRO B 76 3.007 -1.924 -10.870 1.00 0.00 C ATOM 2914 CD PRO B 76 2.561 -2.734 -9.684 1.00 0.00 C ATOM 0 HA PRO B 76 0.150 -2.145 -11.564 1.00 0.00 H new ATOM 0 HB2 PRO B 76 2.816 -3.333 -12.471 1.00 0.00 H new ATOM 0 HB3 PRO B 76 2.172 -1.744 -12.833 1.00 0.00 H new ATOM 0 HG2 PRO B 76 4.086 -1.994 -11.008 1.00 0.00 H new ATOM 0 HG3 PRO B 76 2.771 -0.869 -10.733 1.00 0.00 H new ATOM 0 HD2 PRO B 76 3.246 -3.557 -9.480 1.00 0.00 H new ATOM 0 HD3 PRO B 76 2.512 -2.128 -8.780 1.00 0.00 H new ATOM 2922 N VAL B 77 -0.781 -3.876 -12.904 1.00 0.00 N ATOM 2923 CA VAL B 77 -1.453 -4.903 -13.703 1.00 0.00 C ATOM 2924 C VAL B 77 -0.463 -5.775 -14.477 1.00 0.00 C ATOM 2925 O VAL B 77 -0.651 -6.984 -14.598 1.00 0.00 O ATOM 2926 CB VAL B 77 -2.423 -4.257 -14.709 1.00 0.00 C ATOM 2927 CG1 VAL B 77 -1.661 -3.358 -15.673 1.00 0.00 C ATOM 2928 CG2 VAL B 77 -3.206 -5.322 -15.463 1.00 0.00 C ATOM 0 H VAL B 77 -1.271 -2.981 -12.886 1.00 0.00 H new ATOM 0 HA VAL B 77 -1.998 -5.533 -13.000 1.00 0.00 H new ATOM 0 HB VAL B 77 -3.137 -3.644 -14.158 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -2.359 -2.907 -16.379 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -1.153 -2.573 -15.114 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -0.925 -3.950 -16.218 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -3.885 -4.843 -16.168 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -2.514 -5.966 -16.006 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -3.780 -5.920 -14.756 1.00 0.00 H new ATOM 2938 N LYS B 78 0.581 -5.148 -15.012 1.00 0.00 N ATOM 2939 CA LYS B 78 1.596 -5.868 -15.790 1.00 0.00 C ATOM 2940 C LYS B 78 1.964 -7.179 -15.129 1.00 0.00 C ATOM 2941 O LYS B 78 1.843 -8.255 -15.715 1.00 0.00 O ATOM 2942 CB LYS B 78 2.888 -5.067 -15.935 1.00 0.00 C ATOM 2943 CG LYS B 78 2.942 -3.840 -15.062 1.00 0.00 C ATOM 2944 CD LYS B 78 2.281 -2.664 -15.754 1.00 0.00 C ATOM 2945 CE LYS B 78 3.297 -1.794 -16.476 1.00 0.00 C ATOM 2946 NZ LYS B 78 4.218 -1.111 -15.526 1.00 0.00 N ATOM 0 H LYS B 78 0.750 -4.146 -14.924 1.00 0.00 H new ATOM 0 HA LYS B 78 1.149 -6.035 -16.770 1.00 0.00 H new ATOM 0 HB2 LYS B 78 3.733 -5.711 -15.693 1.00 0.00 H new ATOM 0 HB3 LYS B 78 3.004 -4.766 -16.976 1.00 0.00 H new ATOM 0 HG2 LYS B 78 2.442 -4.039 -14.114 1.00 0.00 H new ATOM 0 HG3 LYS B 78 3.979 -3.597 -14.831 1.00 0.00 H new ATOM 0 HD2 LYS B 78 1.542 -3.030 -16.467 1.00 0.00 H new ATOM 0 HD3 LYS B 78 1.745 -2.064 -15.019 1.00 0.00 H new ATOM 0 HE2 LYS B 78 3.876 -2.408 -17.165 1.00 0.00 H new ATOM 0 HE3 LYS B 78 2.775 -1.048 -17.076 1.00 0.00 H new ATOM 0 HZ1 LYS B 78 4.578 -0.237 -15.960 1.00 0.00 H new ATOM 0 HZ2 LYS B 78 3.705 -0.878 -14.652 1.00 0.00 H new ATOM 0 HZ3 LYS B 78 5.015 -1.740 -15.302 1.00 0.00 H new ATOM 2960 N ILE B 79 2.441 -7.058 -13.901 1.00 0.00 N ATOM 2961 CA ILE B 79 2.868 -8.209 -13.135 1.00 0.00 C ATOM 2962 C ILE B 79 1.758 -8.704 -12.206 1.00 0.00 C ATOM 2963 O ILE B 79 2.030 -9.362 -11.203 1.00 0.00 O ATOM 2964 CB ILE B 79 4.145 -7.922 -12.304 1.00 0.00 C ATOM 2965 CG1 ILE B 79 4.298 -6.423 -12.020 1.00 0.00 C ATOM 2966 CG2 ILE B 79 5.387 -8.477 -13.005 1.00 0.00 C ATOM 2967 CD1 ILE B 79 3.258 -5.908 -11.051 1.00 0.00 C ATOM 0 H ILE B 79 2.541 -6.167 -13.414 1.00 0.00 H new ATOM 0 HA ILE B 79 3.101 -8.987 -13.862 1.00 0.00 H new ATOM 0 HB ILE B 79 4.041 -8.431 -11.346 1.00 0.00 H new ATOM 0 HG12 ILE B 79 5.292 -6.233 -11.616 1.00 0.00 H new ATOM 0 HG13 ILE B 79 4.223 -5.870 -12.956 1.00 0.00 H new ATOM 0 HG21 ILE B 79 6.270 -8.264 -12.403 1.00 0.00 H new ATOM 0 HG22 ILE B 79 5.284 -9.555 -13.128 1.00 0.00 H new ATOM 0 HG23 ILE B 79 5.493 -8.008 -13.983 1.00 0.00 H new ATOM 0 HD11 ILE B 79 3.412 -4.842 -10.885 1.00 0.00 H new ATOM 0 HD12 ILE B 79 2.263 -6.071 -11.465 1.00 0.00 H new ATOM 0 HD13 ILE B 79 3.348 -6.440 -10.104 1.00 0.00 H new ATOM 2979 N LEU B 80 0.506 -8.387 -12.550 1.00 0.00 N ATOM 2980 CA LEU B 80 -0.653 -8.805 -11.753 1.00 0.00 C ATOM 2981 C LEU B 80 -0.512 -10.235 -11.288 1.00 0.00 C ATOM 2982 O LEU B 80 -0.870 -11.174 -11.999 1.00 0.00 O ATOM 2983 CB LEU B 80 -1.943 -8.638 -12.556 1.00 0.00 C ATOM 2984 CG LEU B 80 -3.247 -8.722 -11.753 1.00 0.00 C ATOM 2985 CD1 LEU B 80 -3.025 -8.367 -10.286 1.00 0.00 C ATOM 2986 CD2 LEU B 80 -4.291 -7.804 -12.369 1.00 0.00 C ATOM 0 H LEU B 80 0.268 -7.841 -13.378 1.00 0.00 H new ATOM 0 HA LEU B 80 -0.699 -8.165 -10.872 1.00 0.00 H new ATOM 0 HB2 LEU B 80 -1.911 -7.673 -13.061 1.00 0.00 H new ATOM 0 HB3 LEU B 80 -1.967 -9.403 -13.332 1.00 0.00 H new ATOM 0 HG LEU B 80 -3.604 -9.751 -11.791 1.00 0.00 H new ATOM 0 HD11 LEU B 80 -3.970 -8.437 -9.748 1.00 0.00 H new ATOM 0 HD12 LEU B 80 -2.306 -9.060 -9.849 1.00 0.00 H new ATOM 0 HD13 LEU B 80 -2.640 -7.350 -10.212 1.00 0.00 H new ATOM 0 HD21 LEU B 80 -5.215 -7.867 -11.795 1.00 0.00 H new ATOM 0 HD22 LEU B 80 -3.926 -6.777 -12.356 1.00 0.00 H new ATOM 0 HD23 LEU B 80 -4.481 -8.109 -13.398 1.00 0.00 H new ATOM 2998 N SER B 81 0.014 -10.368 -10.075 1.00 0.00 N ATOM 2999 CA SER B 81 0.232 -11.653 -9.431 1.00 0.00 C ATOM 3000 C SER B 81 -0.259 -12.825 -10.274 1.00 0.00 C ATOM 3001 O SER B 81 -1.463 -13.001 -10.455 1.00 0.00 O ATOM 3002 CB SER B 81 -0.471 -11.660 -8.084 1.00 0.00 C ATOM 3003 OG SER B 81 0.453 -11.734 -7.018 1.00 0.00 O ATOM 0 H SER B 81 0.304 -9.573 -9.506 1.00 0.00 H new ATOM 0 HA SER B 81 1.307 -11.780 -9.305 1.00 0.00 H new ATOM 0 HB2 SER B 81 -1.074 -10.758 -7.982 1.00 0.00 H new ATOM 0 HB3 SER B 81 -1.155 -12.507 -8.034 1.00 0.00 H new ATOM 0 HG SER B 81 0.686 -10.829 -6.724 1.00 0.00 H new ATOM 3009 N GLU B 82 0.677 -13.635 -10.773 1.00 0.00 N ATOM 3010 CA GLU B 82 0.312 -14.802 -11.582 1.00 0.00 C ATOM 3011 C GLU B 82 -0.852 -15.563 -10.943 1.00 0.00 C ATOM 3012 O GLU B 82 -0.661 -16.301 -9.978 1.00 0.00 O ATOM 3013 CB GLU B 82 1.504 -15.746 -11.745 1.00 0.00 C ATOM 3014 CG GLU B 82 1.636 -16.309 -13.150 1.00 0.00 C ATOM 3015 CD GLU B 82 3.071 -16.339 -13.638 1.00 0.00 C ATOM 3016 OE1 GLU B 82 3.952 -16.767 -12.863 1.00 0.00 O ATOM 3017 OE2 GLU B 82 3.313 -15.936 -14.795 1.00 0.00 O ATOM 0 H GLU B 82 1.680 -13.508 -10.635 1.00 0.00 H new ATOM 0 HA GLU B 82 0.007 -14.439 -12.564 1.00 0.00 H new ATOM 0 HB2 GLU B 82 2.419 -15.213 -11.487 1.00 0.00 H new ATOM 0 HB3 GLU B 82 1.405 -16.570 -11.038 1.00 0.00 H new ATOM 0 HG2 GLU B 82 1.229 -17.320 -13.171 1.00 0.00 H new ATOM 0 HG3 GLU B 82 1.037 -15.709 -13.835 1.00 0.00 H new ATOM 3024 N PRO B 83 -2.079 -15.387 -11.464 1.00 0.00 N ATOM 3025 CA PRO B 83 -3.268 -16.054 -10.924 1.00 0.00 C ATOM 3026 C PRO B 83 -3.090 -17.559 -10.745 1.00 0.00 C ATOM 3027 O PRO B 83 -2.938 -18.298 -11.718 1.00 0.00 O ATOM 3028 CB PRO B 83 -4.341 -15.770 -11.976 1.00 0.00 C ATOM 3029 CG PRO B 83 -3.918 -14.488 -12.598 1.00 0.00 C ATOM 3030 CD PRO B 83 -2.412 -14.518 -12.612 1.00 0.00 C ATOM 0 HA PRO B 83 -3.508 -15.687 -9.926 1.00 0.00 H new ATOM 0 HB2 PRO B 83 -4.396 -16.571 -12.714 1.00 0.00 H new ATOM 0 HB3 PRO B 83 -5.329 -15.685 -11.523 1.00 0.00 H new ATOM 0 HG2 PRO B 83 -4.317 -14.393 -13.608 1.00 0.00 H new ATOM 0 HG3 PRO B 83 -4.287 -13.636 -12.028 1.00 0.00 H new ATOM 0 HD2 PRO B 83 -2.026 -14.922 -13.548 1.00 0.00 H new ATOM 0 HD3 PRO B 83 -1.989 -13.520 -12.497 1.00 0.00 H new ATOM 3038 N VAL B 84 -3.142 -18.004 -9.494 1.00 0.00 N ATOM 3039 CA VAL B 84 -3.021 -19.423 -9.176 1.00 0.00 C ATOM 3040 C VAL B 84 -4.410 -20.020 -8.979 1.00 0.00 C ATOM 3041 O VAL B 84 -4.697 -21.136 -9.413 1.00 0.00 O ATOM 3042 CB VAL B 84 -2.207 -19.670 -7.892 1.00 0.00 C ATOM 3043 CG1 VAL B 84 -0.716 -19.598 -8.180 1.00 0.00 C ATOM 3044 CG2 VAL B 84 -2.613 -18.689 -6.799 1.00 0.00 C ATOM 0 H VAL B 84 -3.268 -17.401 -8.681 1.00 0.00 H new ATOM 0 HA VAL B 84 -2.500 -19.894 -10.010 1.00 0.00 H new ATOM 0 HB VAL B 84 -2.426 -20.675 -7.531 1.00 0.00 H new ATOM 0 HG11 VAL B 84 -0.159 -19.775 -7.260 1.00 0.00 H new ATOM 0 HG12 VAL B 84 -0.451 -20.356 -8.917 1.00 0.00 H new ATOM 0 HG13 VAL B 84 -0.468 -18.611 -8.570 1.00 0.00 H new ATOM 0 HG21 VAL B 84 -2.026 -18.881 -5.901 1.00 0.00 H new ATOM 0 HG22 VAL B 84 -2.432 -17.670 -7.140 1.00 0.00 H new ATOM 0 HG23 VAL B 84 -3.672 -18.814 -6.573 1.00 0.00 H new ATOM 3054 N ASN B 85 -5.266 -19.247 -8.312 1.00 0.00 N ATOM 3055 CA ASN B 85 -6.638 -19.652 -8.028 1.00 0.00 C ATOM 3056 C ASN B 85 -7.555 -18.426 -8.007 1.00 0.00 C ATOM 3057 O ASN B 85 -7.265 -17.419 -8.653 1.00 0.00 O ATOM 3058 CB ASN B 85 -6.699 -20.392 -6.689 1.00 0.00 C ATOM 3059 CG ASN B 85 -7.637 -21.583 -6.729 1.00 0.00 C ATOM 3060 OD1 ASN B 85 -7.673 -22.326 -7.709 1.00 0.00 O ATOM 3061 ND2 ASN B 85 -8.402 -21.770 -5.659 1.00 0.00 N ATOM 0 H ASN B 85 -5.026 -18.323 -7.954 1.00 0.00 H new ATOM 0 HA ASN B 85 -6.980 -20.326 -8.813 1.00 0.00 H new ATOM 0 HB2 ASN B 85 -5.699 -20.730 -6.418 1.00 0.00 H new ATOM 0 HB3 ASN B 85 -7.025 -19.702 -5.910 1.00 0.00 H new ATOM 0 HD21 ASN B 85 -9.052 -22.555 -5.628 1.00 0.00 H new ATOM 0 HD22 ASN B 85 -8.339 -21.128 -4.869 1.00 0.00 H new ATOM 3068 N GLU B 86 -8.655 -18.509 -7.263 1.00 0.00 N ATOM 3069 CA GLU B 86 -9.595 -17.402 -7.165 1.00 0.00 C ATOM 3070 C GLU B 86 -10.374 -17.492 -5.863 1.00 0.00 C ATOM 3071 O GLU B 86 -11.024 -18.503 -5.595 1.00 0.00 O ATOM 3072 CB GLU B 86 -10.558 -17.413 -8.354 1.00 0.00 C ATOM 3073 CG GLU B 86 -9.858 -17.426 -9.703 1.00 0.00 C ATOM 3074 CD GLU B 86 -10.820 -17.248 -10.861 1.00 0.00 C ATOM 3075 OE1 GLU B 86 -11.765 -18.057 -10.978 1.00 0.00 O ATOM 3076 OE2 GLU B 86 -10.629 -16.299 -11.651 1.00 0.00 O ATOM 0 H GLU B 86 -8.915 -19.332 -6.720 1.00 0.00 H new ATOM 0 HA GLU B 86 -9.034 -16.467 -7.179 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.203 -18.288 -8.280 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.203 -16.536 -8.297 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -9.113 -16.631 -9.729 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -9.323 -18.368 -9.821 1.00 0.00 H new ATOM 3083 N LEU B 87 -10.310 -16.441 -5.049 1.00 0.00 N ATOM 3084 CA LEU B 87 -11.029 -16.452 -3.779 1.00 0.00 C ATOM 3085 C LEU B 87 -12.022 -15.308 -3.641 1.00 0.00 C ATOM 3086 O LEU B 87 -11.894 -14.433 -2.784 1.00 0.00 O ATOM 3087 CB LEU B 87 -10.097 -16.501 -2.580 1.00 0.00 C ATOM 3088 CG LEU B 87 -9.237 -15.272 -2.287 1.00 0.00 C ATOM 3089 CD1 LEU B 87 -7.974 -15.708 -1.550 1.00 0.00 C ATOM 3090 CD2 LEU B 87 -8.902 -14.526 -3.573 1.00 0.00 C ATOM 0 H LEU B 87 -9.781 -15.590 -5.240 1.00 0.00 H new ATOM 0 HA LEU B 87 -11.605 -17.377 -3.791 1.00 0.00 H new ATOM 0 HB2 LEU B 87 -10.701 -16.704 -1.696 1.00 0.00 H new ATOM 0 HB3 LEU B 87 -9.429 -17.352 -2.711 1.00 0.00 H new ATOM 0 HG LEU B 87 -9.794 -14.583 -1.652 1.00 0.00 H new ATOM 0 HD11 LEU B 87 -7.357 -14.835 -1.338 1.00 0.00 H new ATOM 0 HD12 LEU B 87 -8.249 -16.194 -0.614 1.00 0.00 H new ATOM 0 HD13 LEU B 87 -7.413 -16.407 -2.171 1.00 0.00 H new ATOM 0 HD21 LEU B 87 -8.289 -13.655 -3.339 1.00 0.00 H new ATOM 0 HD22 LEU B 87 -8.353 -15.186 -4.244 1.00 0.00 H new ATOM 0 HD23 LEU B 87 -9.824 -14.202 -4.056 1.00 0.00 H new ATOM 3102 N SER B 88 -13.029 -15.378 -4.480 1.00 0.00 N ATOM 3103 CA SER B 88 -14.133 -14.414 -4.500 1.00 0.00 C ATOM 3104 C SER B 88 -15.009 -14.597 -3.286 1.00 0.00 C ATOM 3105 O SER B 88 -15.459 -13.629 -2.695 1.00 0.00 O ATOM 3106 CB SER B 88 -14.969 -14.561 -5.766 1.00 0.00 C ATOM 3107 OG SER B 88 -14.172 -14.420 -6.929 1.00 0.00 O ATOM 0 H SER B 88 -13.117 -16.112 -5.183 1.00 0.00 H new ATOM 0 HA SER B 88 -13.703 -13.413 -4.486 1.00 0.00 H new ATOM 0 HB2 SER B 88 -15.455 -15.537 -5.772 1.00 0.00 H new ATOM 0 HB3 SER B 88 -15.760 -13.811 -5.771 1.00 0.00 H new ATOM 0 HG SER B 88 -13.373 -13.895 -6.716 1.00 0.00 H new ATOM 3113 N THR B 89 -15.231 -15.844 -2.898 1.00 0.00 N ATOM 3114 CA THR B 89 -16.031 -16.129 -1.718 1.00 0.00 C ATOM 3115 C THR B 89 -15.417 -15.413 -0.528 1.00 0.00 C ATOM 3116 O THR B 89 -16.089 -15.087 0.451 1.00 0.00 O ATOM 3117 CB THR B 89 -16.060 -17.629 -1.460 1.00 0.00 C ATOM 3118 OG1 THR B 89 -14.738 -18.147 -1.378 1.00 0.00 O ATOM 3119 CG2 THR B 89 -16.795 -18.391 -2.539 1.00 0.00 C ATOM 0 H THR B 89 -14.871 -16.668 -3.379 1.00 0.00 H new ATOM 0 HA THR B 89 -17.053 -15.782 -1.873 1.00 0.00 H new ATOM 0 HB THR B 89 -16.589 -17.763 -0.516 1.00 0.00 H new ATOM 0 HG1 THR B 89 -14.775 -19.112 -1.210 1.00 0.00 H new ATOM 0 HG21 THR B 89 -16.785 -19.455 -2.304 1.00 0.00 H new ATOM 0 HG22 THR B 89 -17.826 -18.041 -2.593 1.00 0.00 H new ATOM 0 HG23 THR B 89 -16.305 -18.227 -3.499 1.00 0.00 H new ATOM 3127 N PHE B 90 -14.120 -15.163 -0.650 1.00 0.00 N ATOM 3128 CA PHE B 90 -13.354 -14.474 0.368 1.00 0.00 C ATOM 3129 C PHE B 90 -13.380 -12.965 0.127 1.00 0.00 C ATOM 3130 O PHE B 90 -12.716 -12.204 0.828 1.00 0.00 O ATOM 3131 CB PHE B 90 -11.921 -14.978 0.312 1.00 0.00 C ATOM 3132 CG PHE B 90 -11.593 -16.017 1.336 1.00 0.00 C ATOM 3133 CD1 PHE B 90 -11.658 -15.734 2.690 1.00 0.00 C ATOM 3134 CD2 PHE B 90 -11.197 -17.280 0.940 1.00 0.00 C ATOM 3135 CE1 PHE B 90 -11.330 -16.696 3.624 1.00 0.00 C ATOM 3136 CE2 PHE B 90 -10.876 -18.235 1.857 1.00 0.00 C ATOM 3137 CZ PHE B 90 -10.937 -17.951 3.203 1.00 0.00 C ATOM 0 H PHE B 90 -13.571 -15.436 -1.465 1.00 0.00 H new ATOM 0 HA PHE B 90 -13.788 -14.671 1.349 1.00 0.00 H new ATOM 0 HB2 PHE B 90 -11.732 -15.389 -0.679 1.00 0.00 H new ATOM 0 HB3 PHE B 90 -11.246 -14.132 0.441 1.00 0.00 H new ATOM 0 HD1 PHE B 90 -11.968 -14.753 3.018 1.00 0.00 H new ATOM 0 HD2 PHE B 90 -11.141 -17.514 -0.113 1.00 0.00 H new ATOM 0 HE1 PHE B 90 -11.380 -16.468 4.679 1.00 0.00 H new ATOM 0 HE2 PHE B 90 -10.573 -19.218 1.527 1.00 0.00 H new ATOM 0 HZ PHE B 90 -10.678 -18.708 3.928 1.00 0.00 H new ATOM 3147 N ARG B 91 -14.141 -12.547 -0.886 1.00 0.00 N ATOM 3148 CA ARG B 91 -14.246 -11.139 -1.255 1.00 0.00 C ATOM 3149 C ARG B 91 -14.346 -10.231 -0.039 1.00 0.00 C ATOM 3150 O ARG B 91 -13.661 -9.212 0.024 1.00 0.00 O ATOM 3151 CB ARG B 91 -15.450 -10.910 -2.153 1.00 0.00 C ATOM 3152 CG ARG B 91 -16.648 -11.638 -1.640 1.00 0.00 C ATOM 3153 CD ARG B 91 -17.641 -11.979 -2.741 1.00 0.00 C ATOM 3154 NE ARG B 91 -18.963 -11.415 -2.481 1.00 0.00 N ATOM 3155 CZ ARG B 91 -19.743 -11.790 -1.470 1.00 0.00 C ATOM 3156 NH1 ARG B 91 -19.338 -12.728 -0.622 1.00 0.00 N ATOM 3157 NH2 ARG B 91 -20.932 -11.226 -1.305 1.00 0.00 N ATOM 0 H ARG B 91 -14.698 -13.172 -1.469 1.00 0.00 H new ATOM 0 HA ARG B 91 -13.331 -10.886 -1.792 1.00 0.00 H new ATOM 0 HB2 ARG B 91 -15.666 -9.843 -2.212 1.00 0.00 H new ATOM 0 HB3 ARG B 91 -15.222 -11.245 -3.165 1.00 0.00 H new ATOM 0 HG2 ARG B 91 -16.327 -12.556 -1.148 1.00 0.00 H new ATOM 0 HG3 ARG B 91 -17.144 -11.028 -0.885 1.00 0.00 H new ATOM 0 HD2 ARG B 91 -17.268 -11.604 -3.694 1.00 0.00 H new ATOM 0 HD3 ARG B 91 -17.721 -13.062 -2.834 1.00 0.00 H new ATOM 0 HE ARG B 91 -19.309 -10.691 -3.111 1.00 0.00 H new ATOM 0 HH11 ARG B 91 -18.425 -13.165 -0.743 1.00 0.00 H new ATOM 0 HH12 ARG B 91 -19.940 -13.011 0.151 1.00 0.00 H new ATOM 0 HH21 ARG B 91 -21.249 -10.505 -1.953 1.00 0.00 H new ATOM 0 HH22 ARG B 91 -21.530 -11.514 -0.530 1.00 0.00 H new ATOM 3171 N ASN B 92 -15.187 -10.586 0.933 1.00 0.00 N ATOM 3172 CA ASN B 92 -15.312 -9.749 2.116 1.00 0.00 C ATOM 3173 C ASN B 92 -13.966 -9.632 2.809 1.00 0.00 C ATOM 3174 O ASN B 92 -13.506 -8.533 3.089 1.00 0.00 O ATOM 3175 CB ASN B 92 -16.368 -10.253 3.098 1.00 0.00 C ATOM 3176 CG ASN B 92 -15.867 -11.366 4.000 1.00 0.00 C ATOM 3177 OD1 ASN B 92 -15.119 -10.988 5.032 1.00 0.00 O flip ATOM 3178 ND2 ASN B 92 -16.147 -12.543 3.774 1.00 0.00 N flip ATOM 0 H ASN B 92 -15.773 -11.421 0.924 1.00 0.00 H new ATOM 0 HA ASN B 92 -15.645 -8.768 1.777 1.00 0.00 H new ATOM 0 HB2 ASN B 92 -16.708 -9.421 3.714 1.00 0.00 H new ATOM 0 HB3 ASN B 92 -17.233 -10.610 2.539 1.00 0.00 H new ATOM 0 HD21 ASN B 92 -16.725 -12.784 2.969 1.00 0.00 H new ATOM 0 HD22 ASN B 92 -15.801 -13.277 4.392 1.00 0.00 H new ATOM 3185 N GLU B 93 -13.314 -10.770 3.054 1.00 0.00 N ATOM 3186 CA GLU B 93 -11.995 -10.756 3.676 1.00 0.00 C ATOM 3187 C GLU B 93 -11.157 -9.720 2.977 1.00 0.00 C ATOM 3188 O GLU B 93 -10.517 -8.871 3.596 1.00 0.00 O ATOM 3189 CB GLU B 93 -11.299 -12.101 3.512 1.00 0.00 C ATOM 3190 CG GLU B 93 -10.810 -12.704 4.819 1.00 0.00 C ATOM 3191 CD GLU B 93 -11.937 -13.288 5.649 1.00 0.00 C ATOM 3192 OE1 GLU B 93 -12.900 -12.550 5.944 1.00 0.00 O ATOM 3193 OE2 GLU B 93 -11.855 -14.482 6.004 1.00 0.00 O ATOM 0 H GLU B 93 -13.674 -11.699 2.834 1.00 0.00 H new ATOM 0 HA GLU B 93 -12.111 -10.539 4.738 1.00 0.00 H new ATOM 0 HB2 GLU B 93 -11.987 -12.800 3.036 1.00 0.00 H new ATOM 0 HB3 GLU B 93 -10.450 -11.980 2.839 1.00 0.00 H new ATOM 0 HG2 GLU B 93 -10.080 -13.484 4.604 1.00 0.00 H new ATOM 0 HG3 GLU B 93 -10.296 -11.937 5.399 1.00 0.00 H new ATOM 3200 N ILE B 94 -11.191 -9.817 1.660 1.00 0.00 N ATOM 3201 CA ILE B 94 -10.464 -8.918 0.813 1.00 0.00 C ATOM 3202 C ILE B 94 -10.987 -7.495 1.005 1.00 0.00 C ATOM 3203 O ILE B 94 -10.220 -6.534 1.034 1.00 0.00 O ATOM 3204 CB ILE B 94 -10.591 -9.346 -0.664 1.00 0.00 C ATOM 3205 CG1 ILE B 94 -9.693 -10.554 -0.945 1.00 0.00 C ATOM 3206 CG2 ILE B 94 -10.240 -8.199 -1.598 1.00 0.00 C ATOM 3207 CD1 ILE B 94 -9.921 -11.732 -0.024 1.00 0.00 C ATOM 0 H ILE B 94 -11.727 -10.525 1.157 1.00 0.00 H new ATOM 0 HA ILE B 94 -9.409 -8.948 1.085 1.00 0.00 H new ATOM 0 HB ILE B 94 -11.628 -9.626 -0.848 1.00 0.00 H new ATOM 0 HG12 ILE B 94 -9.851 -10.877 -1.974 1.00 0.00 H new ATOM 0 HG13 ILE B 94 -8.651 -10.243 -0.865 1.00 0.00 H new ATOM 0 HG21 ILE B 94 -10.338 -8.529 -2.632 1.00 0.00 H new ATOM 0 HG22 ILE B 94 -10.916 -7.363 -1.418 1.00 0.00 H new ATOM 0 HG23 ILE B 94 -9.214 -7.881 -1.414 1.00 0.00 H new ATOM 0 HD11 ILE B 94 -9.243 -12.542 -0.294 1.00 0.00 H new ATOM 0 HD12 ILE B 94 -9.733 -11.430 1.006 1.00 0.00 H new ATOM 0 HD13 ILE B 94 -10.951 -12.074 -0.119 1.00 0.00 H new ATOM 3219 N ILE B 95 -12.308 -7.381 1.160 1.00 0.00 N ATOM 3220 CA ILE B 95 -12.952 -6.092 1.380 1.00 0.00 C ATOM 3221 C ILE B 95 -12.668 -5.613 2.798 1.00 0.00 C ATOM 3222 O ILE B 95 -11.958 -4.626 2.991 1.00 0.00 O ATOM 3223 CB ILE B 95 -14.477 -6.167 1.152 1.00 0.00 C ATOM 3224 CG1 ILE B 95 -14.779 -6.563 -0.294 1.00 0.00 C ATOM 3225 CG2 ILE B 95 -15.137 -4.835 1.485 1.00 0.00 C ATOM 3226 CD1 ILE B 95 -16.036 -7.392 -0.445 1.00 0.00 C ATOM 0 H ILE B 95 -12.952 -8.172 1.136 1.00 0.00 H new ATOM 0 HA ILE B 95 -12.541 -5.386 0.658 1.00 0.00 H new ATOM 0 HB ILE B 95 -14.886 -6.928 1.816 1.00 0.00 H new ATOM 0 HG12 ILE B 95 -14.875 -5.660 -0.897 1.00 0.00 H new ATOM 0 HG13 ILE B 95 -13.934 -7.124 -0.692 1.00 0.00 H new ATOM 0 HG21 ILE B 95 -16.211 -4.909 1.318 1.00 0.00 H new ATOM 0 HG22 ILE B 95 -14.949 -4.587 2.530 1.00 0.00 H new ATOM 0 HG23 ILE B 95 -14.723 -4.054 0.846 1.00 0.00 H new ATOM 0 HD11 ILE B 95 -16.187 -7.636 -1.497 1.00 0.00 H new ATOM 0 HD12 ILE B 95 -15.936 -8.312 0.130 1.00 0.00 H new ATOM 0 HD13 ILE B 95 -16.892 -6.826 -0.077 1.00 0.00 H new ATOM 3238 N ALA B 96 -13.203 -6.331 3.796 1.00 0.00 N ATOM 3239 CA ALA B 96 -12.967 -5.980 5.197 1.00 0.00 C ATOM 3240 C ALA B 96 -11.502 -5.599 5.409 1.00 0.00 C ATOM 3241 O ALA B 96 -11.189 -4.744 6.231 1.00 0.00 O ATOM 3242 CB ALA B 96 -13.367 -7.133 6.110 1.00 0.00 C ATOM 0 H ALA B 96 -13.796 -7.150 3.658 1.00 0.00 H new ATOM 0 HA ALA B 96 -13.584 -5.118 5.450 1.00 0.00 H new ATOM 0 HB1 ALA B 96 -13.185 -6.855 7.148 1.00 0.00 H new ATOM 0 HB2 ALA B 96 -14.426 -7.354 5.974 1.00 0.00 H new ATOM 0 HB3 ALA B 96 -12.777 -8.015 5.862 1.00 0.00 H new ATOM 3248 N ALA B 97 -10.614 -6.209 4.620 1.00 0.00 N ATOM 3249 CA ALA B 97 -9.186 -5.896 4.676 1.00 0.00 C ATOM 3250 C ALA B 97 -9.004 -4.401 4.653 1.00 0.00 C ATOM 3251 O ALA B 97 -8.699 -3.774 5.659 1.00 0.00 O ATOM 3252 CB ALA B 97 -8.479 -6.507 3.477 1.00 0.00 C ATOM 0 H ALA B 97 -10.860 -6.923 3.935 1.00 0.00 H new ATOM 0 HA ALA B 97 -8.761 -6.306 5.592 1.00 0.00 H new ATOM 0 HB1 ALA B 97 -7.416 -6.271 3.523 1.00 0.00 H new ATOM 0 HB2 ALA B 97 -8.612 -7.589 3.489 1.00 0.00 H new ATOM 0 HB3 ALA B 97 -8.902 -6.099 2.559 1.00 0.00 H new ATOM 3258 N ILE B 98 -9.237 -3.842 3.491 1.00 0.00 N ATOM 3259 CA ILE B 98 -9.145 -2.427 3.278 1.00 0.00 C ATOM 3260 C ILE B 98 -9.913 -1.677 4.360 1.00 0.00 C ATOM 3261 O ILE B 98 -9.417 -0.754 4.999 1.00 0.00 O ATOM 3262 CB ILE B 98 -9.803 -2.115 1.921 1.00 0.00 C ATOM 3263 CG1 ILE B 98 -8.802 -2.229 0.772 1.00 0.00 C ATOM 3264 CG2 ILE B 98 -10.464 -0.739 1.914 1.00 0.00 C ATOM 3265 CD1 ILE B 98 -8.172 -3.593 0.649 1.00 0.00 C ATOM 0 H ILE B 98 -9.499 -4.369 2.658 1.00 0.00 H new ATOM 0 HA ILE B 98 -8.099 -2.120 3.302 1.00 0.00 H new ATOM 0 HB ILE B 98 -10.581 -2.863 1.772 1.00 0.00 H new ATOM 0 HG12 ILE B 98 -9.307 -1.986 -0.163 1.00 0.00 H new ATOM 0 HG13 ILE B 98 -8.016 -1.487 0.912 1.00 0.00 H new ATOM 0 HG21 ILE B 98 -10.916 -0.558 0.939 1.00 0.00 H new ATOM 0 HG22 ILE B 98 -11.235 -0.702 2.684 1.00 0.00 H new ATOM 0 HG23 ILE B 98 -9.714 0.026 2.114 1.00 0.00 H new ATOM 0 HD11 ILE B 98 -7.474 -3.597 -0.188 1.00 0.00 H new ATOM 0 HD12 ILE B 98 -7.638 -3.831 1.569 1.00 0.00 H new ATOM 0 HD13 ILE B 98 -8.949 -4.338 0.477 1.00 0.00 H new ATOM 3277 N ASP B 99 -11.159 -2.086 4.491 1.00 0.00 N ATOM 3278 CA ASP B 99 -12.112 -1.497 5.411 1.00 0.00 C ATOM 3279 C ASP B 99 -11.707 -1.598 6.886 1.00 0.00 C ATOM 3280 O ASP B 99 -12.152 -0.799 7.707 1.00 0.00 O ATOM 3281 CB ASP B 99 -13.454 -2.170 5.164 1.00 0.00 C ATOM 3282 CG ASP B 99 -14.612 -1.191 5.185 1.00 0.00 C ATOM 3283 OD1 ASP B 99 -14.381 0.009 4.924 1.00 0.00 O ATOM 3284 OD2 ASP B 99 -15.751 -1.624 5.462 1.00 0.00 O ATOM 0 H ASP B 99 -11.547 -2.857 3.947 1.00 0.00 H new ATOM 0 HA ASP B 99 -12.158 -0.425 5.217 1.00 0.00 H new ATOM 0 HB2 ASP B 99 -13.430 -2.677 4.199 1.00 0.00 H new ATOM 0 HB3 ASP B 99 -13.617 -2.936 5.922 1.00 0.00 H new ATOM 3289 N PHE B 100 -10.868 -2.563 7.228 1.00 0.00 N ATOM 3290 CA PHE B 100 -10.421 -2.724 8.608 1.00 0.00 C ATOM 3291 C PHE B 100 -9.000 -2.212 8.739 1.00 0.00 C ATOM 3292 O PHE B 100 -8.660 -1.448 9.642 1.00 0.00 O ATOM 3293 CB PHE B 100 -10.496 -4.194 9.028 1.00 0.00 C ATOM 3294 CG PHE B 100 -9.991 -4.451 10.420 1.00 0.00 C ATOM 3295 CD1 PHE B 100 -10.682 -3.972 11.521 1.00 0.00 C ATOM 3296 CD2 PHE B 100 -8.826 -5.172 10.625 1.00 0.00 C ATOM 3297 CE1 PHE B 100 -10.220 -4.206 12.802 1.00 0.00 C ATOM 3298 CE2 PHE B 100 -8.358 -5.409 11.904 1.00 0.00 C ATOM 3299 CZ PHE B 100 -9.056 -4.926 12.994 1.00 0.00 C ATOM 0 H PHE B 100 -10.483 -3.245 6.575 1.00 0.00 H new ATOM 0 HA PHE B 100 -11.074 -2.149 9.264 1.00 0.00 H new ATOM 0 HB2 PHE B 100 -11.531 -4.530 8.958 1.00 0.00 H new ATOM 0 HB3 PHE B 100 -9.918 -4.794 8.325 1.00 0.00 H new ATOM 0 HD1 PHE B 100 -11.592 -3.409 11.376 1.00 0.00 H new ATOM 0 HD2 PHE B 100 -8.277 -5.553 9.776 1.00 0.00 H new ATOM 0 HE1 PHE B 100 -10.768 -3.827 13.652 1.00 0.00 H new ATOM 0 HE2 PHE B 100 -7.448 -5.971 12.051 1.00 0.00 H new ATOM 0 HZ PHE B 100 -8.693 -5.111 13.994 1.00 0.00 H new ATOM 3309 N LEU B 101 -8.191 -2.660 7.802 1.00 0.00 N ATOM 3310 CA LEU B 101 -6.790 -2.308 7.716 1.00 0.00 C ATOM 3311 C LEU B 101 -6.616 -0.828 7.413 1.00 0.00 C ATOM 3312 O LEU B 101 -5.737 -0.165 7.963 1.00 0.00 O ATOM 3313 CB LEU B 101 -6.162 -3.157 6.603 1.00 0.00 C ATOM 3314 CG LEU B 101 -5.514 -2.392 5.438 1.00 0.00 C ATOM 3315 CD1 LEU B 101 -4.008 -2.281 5.611 1.00 0.00 C ATOM 3316 CD2 LEU B 101 -5.867 -3.041 4.099 1.00 0.00 C ATOM 0 H LEU B 101 -8.496 -3.293 7.063 1.00 0.00 H new ATOM 0 HA LEU B 101 -6.300 -2.503 8.670 1.00 0.00 H new ATOM 0 HB2 LEU B 101 -5.405 -3.801 7.051 1.00 0.00 H new ATOM 0 HB3 LEU B 101 -6.934 -3.809 6.195 1.00 0.00 H new ATOM 0 HG LEU B 101 -5.918 -1.379 5.443 1.00 0.00 H new ATOM 0 HD11 LEU B 101 -3.584 -1.734 4.769 1.00 0.00 H new ATOM 0 HD12 LEU B 101 -3.786 -1.750 6.537 1.00 0.00 H new ATOM 0 HD13 LEU B 101 -3.572 -3.279 5.652 1.00 0.00 H new ATOM 0 HD21 LEU B 101 -5.398 -2.483 3.289 1.00 0.00 H new ATOM 0 HD22 LEU B 101 -5.507 -4.070 4.087 1.00 0.00 H new ATOM 0 HD23 LEU B 101 -6.949 -3.034 3.965 1.00 0.00 H new ATOM 3328 N ILE B 102 -7.439 -0.331 6.498 1.00 0.00 N ATOM 3329 CA ILE B 102 -7.353 1.054 6.080 1.00 0.00 C ATOM 3330 C ILE B 102 -8.362 1.936 6.807 1.00 0.00 C ATOM 3331 O ILE B 102 -8.118 3.126 7.005 1.00 0.00 O ATOM 3332 CB ILE B 102 -7.561 1.190 4.558 1.00 0.00 C ATOM 3333 CG1 ILE B 102 -6.841 0.056 3.814 1.00 0.00 C ATOM 3334 CG2 ILE B 102 -7.061 2.544 4.081 1.00 0.00 C ATOM 3335 CD1 ILE B 102 -6.971 0.140 2.309 1.00 0.00 C ATOM 0 H ILE B 102 -8.171 -0.869 6.034 1.00 0.00 H new ATOM 0 HA ILE B 102 -6.350 1.393 6.340 1.00 0.00 H new ATOM 0 HB ILE B 102 -8.627 1.117 4.342 1.00 0.00 H new ATOM 0 HG12 ILE B 102 -5.784 0.072 4.080 1.00 0.00 H new ATOM 0 HG13 ILE B 102 -7.241 -0.900 4.152 1.00 0.00 H new ATOM 0 HG21 ILE B 102 -7.213 2.629 3.005 1.00 0.00 H new ATOM 0 HG22 ILE B 102 -7.612 3.335 4.589 1.00 0.00 H new ATOM 0 HG23 ILE B 102 -5.999 2.640 4.306 1.00 0.00 H new ATOM 0 HD11 ILE B 102 -6.438 -0.693 1.851 1.00 0.00 H new ATOM 0 HD12 ILE B 102 -8.024 0.093 2.032 1.00 0.00 H new ATOM 0 HD13 ILE B 102 -6.545 1.080 1.959 1.00 0.00 H new ATOM 3347 N THR B 103 -9.497 1.362 7.206 1.00 0.00 N ATOM 3348 CA THR B 103 -10.518 2.139 7.907 1.00 0.00 C ATOM 3349 C THR B 103 -10.682 1.671 9.345 1.00 0.00 C ATOM 3350 O THR B 103 -10.859 2.484 10.253 1.00 0.00 O ATOM 3351 CB THR B 103 -11.858 2.069 7.171 1.00 0.00 C ATOM 3352 OG1 THR B 103 -11.659 1.946 5.774 1.00 0.00 O ATOM 3353 CG2 THR B 103 -12.731 3.283 7.405 1.00 0.00 C ATOM 0 H THR B 103 -9.730 0.380 7.059 1.00 0.00 H new ATOM 0 HA THR B 103 -10.184 3.176 7.925 1.00 0.00 H new ATOM 0 HB THR B 103 -12.364 1.192 7.575 1.00 0.00 H new ATOM 0 HG1 THR B 103 -12.528 1.901 5.323 1.00 0.00 H new ATOM 0 HG21 THR B 103 -13.666 3.170 6.856 1.00 0.00 H new ATOM 0 HG22 THR B 103 -12.945 3.377 8.470 1.00 0.00 H new ATOM 0 HG23 THR B 103 -12.212 4.177 7.059 1.00 0.00 H new ATOM 3361 N GLY B 104 -10.618 0.365 9.552 1.00 0.00 N ATOM 3362 CA GLY B 104 -10.759 -0.168 10.890 1.00 0.00 C ATOM 3363 C GLY B 104 -12.152 0.038 11.450 1.00 0.00 C ATOM 3364 O GLY B 104 -12.312 0.466 12.594 1.00 0.00 O ATOM 0 H GLY B 104 -10.472 -0.332 8.822 1.00 0.00 H new ATOM 0 HA2 GLY B 104 -10.528 -1.233 10.880 1.00 0.00 H new ATOM 0 HA3 GLY B 104 -10.032 0.310 11.547 1.00 0.00 H new ATOM 3368 N ILE B 105 -13.162 -0.264 10.642 1.00 0.00 N ATOM 3369 CA ILE B 105 -14.550 -0.106 11.062 1.00 0.00 C ATOM 3370 C ILE B 105 -15.153 -1.441 11.486 1.00 0.00 C ATOM 3371 O ILE B 105 -14.447 -2.467 11.386 1.00 0.00 O ATOM 3372 CB ILE B 105 -15.418 0.508 9.942 1.00 0.00 C ATOM 3373 CG1 ILE B 105 -15.054 -0.086 8.577 1.00 0.00 C ATOM 3374 CG2 ILE B 105 -15.259 2.021 9.922 1.00 0.00 C ATOM 3375 CD1 ILE B 105 -15.107 -1.599 8.538 1.00 0.00 C ATOM 3376 OXT ILE B 105 -16.326 -1.450 11.916 1.00 0.00 O ATOM 0 H ILE B 105 -13.046 -0.619 9.693 1.00 0.00 H new ATOM 0 HA ILE B 105 -14.543 0.574 11.914 1.00 0.00 H new ATOM 0 HB ILE B 105 -16.461 0.267 10.148 1.00 0.00 H new ATOM 0 HG12 ILE B 105 -15.734 0.312 7.824 1.00 0.00 H new ATOM 0 HG13 ILE B 105 -14.051 0.241 8.304 1.00 0.00 H new ATOM 0 HG21 ILE B 105 -15.876 2.441 9.128 1.00 0.00 H new ATOM 0 HG22 ILE B 105 -15.572 2.432 10.881 1.00 0.00 H new ATOM 0 HG23 ILE B 105 -14.214 2.275 9.742 1.00 0.00 H new ATOM 0 HD11 ILE B 105 -14.837 -1.947 7.541 1.00 0.00 H new ATOM 0 HD12 ILE B 105 -14.406 -2.007 9.266 1.00 0.00 H new ATOM 0 HD13 ILE B 105 -16.116 -1.934 8.779 1.00 0.00 H new