USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1100 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 93 HIS :FLIP no HD1:sc= -0.0934 F(o=-1.7,f=-0.18) USER MOD Set 1.2: A 95 THR OG1 : rot 160:sc= -0.0869 USER MOD Set 2.1: A 14 SER OG : rot -140:sc= 0.277 USER MOD Set 2.2: A 27 ASN : amide:sc= 0.789! K(o=1.6!,f=0.71) USER MOD Set 2.3: A 76 THR OG1 : rot 180:sc= 0.215 USER MOD Set 2.4: A 124 LYS NZ :NH3+ -146:sc= 0.298 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 58:sc= 0.827 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 62:sc= 0.431 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot 0:sc= -1.18 USER MOD Single : A 18 ASN : amide:sc= -0.78 K(o=-0.78,f=-2.3!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -140:sc= -2.19 (180deg=-5.93!) USER MOD Single : A 40 GLN : amide:sc= -0.0849 X(o=-0.085,f=-0.54) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -153:sc= -0.156 (180deg=-1.93) USER MOD Single : A 43 THR OG1 : rot 54:sc= -2.91! USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 15:sc= -2.4! USER MOD Single : A 49 LYS NZ :NH3+ -177:sc= -0.17 (180deg=-0.18) USER MOD Single : A 50 MET CE :methyl -144:sc= -0.23 (180deg=-0.643) USER MOD Single : A 51 THR OG1 : rot -27:sc= 0.0543 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS :FLIP no HD1:sc= -4.75! C(o=-5.9!,f=-4.8!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot -103:sc= -1.1! USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0454 USER MOD Single : A 80 TYR OH : rot 180:sc=-9.67e-05 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= -0.333 USER MOD Single : A 86 GLN : amide:sc= -2.29! C(o=-2.3!,f=-2.1!) USER MOD Single : A 88 GLN : amide:sc= -0.0176 X(o=-0.018,f=0) USER MOD Single : A 98 SER OG : rot 180:sc= -1.75 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= -0.256 USER MOD Single : A 125 MET CE :methyl -162:sc= -7.04! (180deg=-9.64!) USER MOD Single : A 127 MET CE :methyl -122:sc= -3.43! (180deg=-4.49!) USER MOD Single : A 128 ASN : amide:sc= -0.0227 X(o=-0.023,f=0) USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.426 -6.265 17.010 1.00 0.00 N ATOM 2 CA GLY A 1 -22.383 -6.392 15.925 1.00 0.00 C ATOM 3 C GLY A 1 -21.969 -7.501 14.955 1.00 0.00 C ATOM 4 O GLY A 1 -21.461 -7.223 13.870 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.730 -5.507 17.654 1.00 0.00 H new ATOM 0 H2 GLY A 1 -21.373 -7.162 17.533 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.489 -6.035 16.621 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -23.371 -6.609 16.331 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -22.459 -5.446 15.390 1.00 0.00 H new ATOM 8 N SER A 2 -22.203 -8.733 15.382 1.00 0.00 N ATOM 9 CA SER A 2 -21.860 -9.885 14.565 1.00 0.00 C ATOM 10 C SER A 2 -23.130 -10.637 14.162 1.00 0.00 C ATOM 11 O SER A 2 -24.069 -10.743 14.950 1.00 0.00 O ATOM 12 CB SER A 2 -20.902 -10.820 15.305 1.00 0.00 C ATOM 13 OG SER A 2 -19.555 -10.360 15.245 1.00 0.00 O ATOM 0 H SER A 2 -22.626 -8.959 16.282 1.00 0.00 H new ATOM 0 HA SER A 2 -21.355 -9.529 13.667 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.210 -10.904 16.347 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.964 -11.819 14.873 1.00 0.00 H new ATOM 0 HG SER A 2 -18.975 -10.983 15.730 1.00 0.00 H new ATOM 19 N SER A 3 -23.119 -11.140 12.937 1.00 0.00 N ATOM 20 CA SER A 3 -24.258 -11.880 12.420 1.00 0.00 C ATOM 21 C SER A 3 -23.996 -12.300 10.973 1.00 0.00 C ATOM 22 O SER A 3 -24.040 -11.472 10.064 1.00 0.00 O ATOM 23 CB SER A 3 -25.540 -11.048 12.508 1.00 0.00 C ATOM 24 OG SER A 3 -26.336 -11.412 13.632 1.00 0.00 O ATOM 0 H SER A 3 -22.339 -11.050 12.286 1.00 0.00 H new ATOM 0 HA SER A 3 -24.393 -12.772 13.031 1.00 0.00 H new ATOM 0 HB2 SER A 3 -25.282 -9.991 12.573 1.00 0.00 H new ATOM 0 HB3 SER A 3 -26.121 -11.179 11.595 1.00 0.00 H new ATOM 0 HG SER A 3 -25.813 -11.301 14.453 1.00 0.00 H new ATOM 30 N GLY A 4 -23.730 -13.587 10.803 1.00 0.00 N ATOM 31 CA GLY A 4 -23.461 -14.128 9.481 1.00 0.00 C ATOM 32 C GLY A 4 -22.092 -13.673 8.971 1.00 0.00 C ATOM 33 O GLY A 4 -21.060 -14.095 9.490 1.00 0.00 O ATOM 0 H GLY A 4 -23.695 -14.271 11.559 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -23.497 -15.217 9.515 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -24.237 -13.805 8.787 1.00 0.00 H new ATOM 37 N SER A 5 -22.128 -12.818 7.959 1.00 0.00 N ATOM 38 CA SER A 5 -20.903 -12.301 7.373 1.00 0.00 C ATOM 39 C SER A 5 -20.117 -13.438 6.717 1.00 0.00 C ATOM 40 O SER A 5 -20.348 -14.609 7.013 1.00 0.00 O ATOM 41 CB SER A 5 -20.042 -11.599 8.425 1.00 0.00 C ATOM 42 OG SER A 5 -19.786 -10.239 8.085 1.00 0.00 O ATOM 0 H SER A 5 -22.986 -12.471 7.530 1.00 0.00 H new ATOM 0 HA SER A 5 -21.171 -11.567 6.613 1.00 0.00 H new ATOM 0 HB2 SER A 5 -20.544 -11.643 9.392 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.096 -12.130 8.532 1.00 0.00 H new ATOM 0 HG SER A 5 -19.235 -9.826 8.782 1.00 0.00 H new ATOM 48 N SER A 6 -19.204 -13.053 5.837 1.00 0.00 N ATOM 49 CA SER A 6 -18.383 -14.025 5.136 1.00 0.00 C ATOM 50 C SER A 6 -17.497 -13.318 4.108 1.00 0.00 C ATOM 51 O SER A 6 -17.961 -12.956 3.028 1.00 0.00 O ATOM 52 CB SER A 6 -19.248 -15.085 4.451 1.00 0.00 C ATOM 53 OG SER A 6 -19.205 -16.333 5.137 1.00 0.00 O ATOM 0 H SER A 6 -19.015 -12.081 5.594 1.00 0.00 H new ATOM 0 HA SER A 6 -17.750 -14.528 5.867 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.279 -14.734 4.400 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.907 -15.223 3.425 1.00 0.00 H new ATOM 0 HG SER A 6 -19.561 -16.221 6.043 1.00 0.00 H new ATOM 59 N GLY A 7 -16.238 -13.142 4.481 1.00 0.00 N ATOM 60 CA GLY A 7 -15.283 -12.485 3.605 1.00 0.00 C ATOM 61 C GLY A 7 -15.283 -10.972 3.831 1.00 0.00 C ATOM 62 O GLY A 7 -16.332 -10.376 4.068 1.00 0.00 O ATOM 0 H GLY A 7 -15.857 -13.443 5.378 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.285 -12.883 3.786 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.529 -12.701 2.565 1.00 0.00 H new ATOM 66 N LEU A 8 -14.093 -10.394 3.749 1.00 0.00 N ATOM 67 CA LEU A 8 -13.943 -8.961 3.942 1.00 0.00 C ATOM 68 C LEU A 8 -13.817 -8.278 2.579 1.00 0.00 C ATOM 69 O LEU A 8 -14.728 -7.574 2.146 1.00 0.00 O ATOM 70 CB LEU A 8 -12.776 -8.667 4.887 1.00 0.00 C ATOM 71 CG LEU A 8 -13.005 -9.008 6.361 1.00 0.00 C ATOM 72 CD1 LEU A 8 -11.708 -8.875 7.162 1.00 0.00 C ATOM 73 CD2 LEU A 8 -14.133 -8.160 6.951 1.00 0.00 C ATOM 0 H LEU A 8 -13.225 -10.891 3.552 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.827 -8.547 4.426 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.904 -9.219 4.538 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.533 -7.607 4.813 1.00 0.00 H new ATOM 0 HG LEU A 8 -13.318 -10.050 6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.898 -9.123 8.206 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -10.959 -9.556 6.758 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -11.341 -7.851 7.093 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -14.275 -8.422 7.999 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.873 -7.104 6.873 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -15.055 -8.348 6.402 1.00 0.00 H new ATOM 85 N GLY A 9 -12.680 -8.510 1.939 1.00 0.00 N ATOM 86 CA GLY A 9 -12.423 -7.925 0.634 1.00 0.00 C ATOM 87 C GLY A 9 -11.007 -8.254 0.155 1.00 0.00 C ATOM 88 O GLY A 9 -10.314 -9.066 0.767 1.00 0.00 O ATOM 0 H GLY A 9 -11.927 -9.095 2.300 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.151 -8.299 -0.086 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.552 -6.844 0.684 1.00 0.00 H new ATOM 92 N THR A 10 -10.621 -7.608 -0.935 1.00 0.00 N ATOM 93 CA THR A 10 -9.301 -7.822 -1.504 1.00 0.00 C ATOM 94 C THR A 10 -8.545 -6.497 -1.611 1.00 0.00 C ATOM 95 O THR A 10 -9.122 -5.430 -1.404 1.00 0.00 O ATOM 96 CB THR A 10 -9.474 -8.534 -2.847 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.011 -9.807 -2.499 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.136 -8.863 -3.512 1.00 0.00 C ATOM 0 H THR A 10 -11.199 -6.936 -1.440 1.00 0.00 H new ATOM 0 HA THR A 10 -8.691 -8.456 -0.860 1.00 0.00 H new ATOM 0 HB THR A 10 -10.067 -7.909 -3.515 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.156 -10.334 -3.312 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.316 -9.367 -4.461 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.582 -7.941 -3.690 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.556 -9.515 -2.859 1.00 0.00 H new ATOM 106 N LEU A 11 -7.265 -6.606 -1.934 1.00 0.00 N ATOM 107 CA LEU A 11 -6.424 -5.430 -2.072 1.00 0.00 C ATOM 108 C LEU A 11 -5.544 -5.579 -3.314 1.00 0.00 C ATOM 109 O LEU A 11 -4.777 -6.534 -3.424 1.00 0.00 O ATOM 110 CB LEU A 11 -5.634 -5.182 -0.785 1.00 0.00 C ATOM 111 CG LEU A 11 -4.488 -4.174 -0.885 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.138 -4.886 -0.986 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.712 -3.202 -2.045 1.00 0.00 C ATOM 0 H LEU A 11 -6.789 -7.492 -2.104 1.00 0.00 H new ATOM 0 HA LEU A 11 -7.036 -4.540 -2.220 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.327 -4.839 -0.017 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.226 -6.133 -0.444 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.472 -3.583 0.031 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.341 -4.146 -1.056 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -2.984 -5.502 -0.100 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.125 -5.518 -1.874 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.883 -2.496 -2.094 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.770 -3.759 -2.980 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.643 -2.657 -1.889 1.00 0.00 H new ATOM 125 N PHE A 12 -5.684 -4.621 -4.218 1.00 0.00 N ATOM 126 CA PHE A 12 -4.911 -4.634 -5.449 1.00 0.00 C ATOM 127 C PHE A 12 -3.793 -3.590 -5.405 1.00 0.00 C ATOM 128 O PHE A 12 -3.984 -2.492 -4.884 1.00 0.00 O ATOM 129 CB PHE A 12 -5.874 -4.286 -6.586 1.00 0.00 C ATOM 130 CG PHE A 12 -7.090 -5.210 -6.676 1.00 0.00 C ATOM 131 CD1 PHE A 12 -6.964 -6.531 -6.378 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.297 -4.711 -7.056 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.092 -7.388 -6.462 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.425 -5.568 -7.140 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.299 -6.889 -6.841 1.00 0.00 C ATOM 0 H PHE A 12 -6.321 -3.830 -4.123 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.452 -5.613 -5.590 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.219 -3.260 -6.455 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.332 -4.322 -7.531 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -6.006 -6.928 -6.077 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.397 -3.662 -7.294 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -7.992 -8.437 -6.225 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.383 -5.171 -7.441 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.157 -7.541 -6.905 1.00 0.00 H new ATOM 145 N PHE A 13 -2.651 -3.969 -5.959 1.00 0.00 N ATOM 146 CA PHE A 13 -1.503 -3.080 -5.990 1.00 0.00 C ATOM 147 C PHE A 13 -0.417 -3.619 -6.924 1.00 0.00 C ATOM 148 O PHE A 13 -0.543 -4.719 -7.459 1.00 0.00 O ATOM 149 CB PHE A 13 -0.948 -3.016 -4.566 1.00 0.00 C ATOM 150 CG PHE A 13 -0.502 -4.370 -4.011 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.427 -5.322 -3.715 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.820 -4.622 -3.813 1.00 0.00 C ATOM 153 CE1 PHE A 13 -1.013 -6.579 -3.199 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.234 -5.879 -3.297 1.00 0.00 C ATOM 155 CZ PHE A 13 0.308 -6.831 -3.001 1.00 0.00 C ATOM 0 H PHE A 13 -2.496 -4.880 -6.390 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.803 -2.098 -6.354 1.00 0.00 H new ATOM 0 HB2 PHE A 13 -0.101 -2.330 -4.548 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.710 -2.598 -3.908 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.477 -5.122 -3.872 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.555 -3.866 -4.048 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.748 -7.335 -2.964 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.284 -6.079 -3.140 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.623 -7.787 -2.609 1.00 0.00 H new ATOM 165 N SER A 14 0.625 -2.817 -7.093 1.00 0.00 N ATOM 166 CA SER A 14 1.732 -3.200 -7.953 1.00 0.00 C ATOM 167 C SER A 14 3.024 -2.541 -7.467 1.00 0.00 C ATOM 168 O SER A 14 3.104 -1.317 -7.375 1.00 0.00 O ATOM 169 CB SER A 14 1.456 -2.818 -9.408 1.00 0.00 C ATOM 170 OG SER A 14 0.936 -1.496 -9.524 1.00 0.00 O ATOM 0 H SER A 14 0.726 -1.904 -6.649 1.00 0.00 H new ATOM 0 HA SER A 14 1.844 -4.283 -7.905 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.378 -2.897 -9.984 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.748 -3.525 -9.840 1.00 0.00 H new ATOM 0 HG SER A 14 0.232 -1.480 -10.206 1.00 0.00 H new ATOM 176 N LEU A 15 4.003 -3.381 -7.168 1.00 0.00 N ATOM 177 CA LEU A 15 5.288 -2.896 -6.693 1.00 0.00 C ATOM 178 C LEU A 15 6.122 -2.425 -7.886 1.00 0.00 C ATOM 179 O LEU A 15 5.947 -2.912 -9.002 1.00 0.00 O ATOM 180 CB LEU A 15 5.981 -3.959 -5.839 1.00 0.00 C ATOM 181 CG LEU A 15 5.315 -4.283 -4.500 1.00 0.00 C ATOM 182 CD1 LEU A 15 4.498 -3.093 -3.993 1.00 0.00 C ATOM 183 CD2 LEU A 15 4.473 -5.556 -4.601 1.00 0.00 C ATOM 0 H LEU A 15 3.933 -4.396 -7.245 1.00 0.00 H new ATOM 0 HA LEU A 15 5.152 -2.035 -6.038 1.00 0.00 H new ATOM 0 HB2 LEU A 15 6.047 -4.878 -6.421 1.00 0.00 H new ATOM 0 HB3 LEU A 15 7.002 -3.631 -5.644 1.00 0.00 H new ATOM 0 HG LEU A 15 6.097 -4.473 -3.765 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.035 -3.349 -3.040 1.00 0.00 H new ATOM 0 HD12 LEU A 15 5.153 -2.233 -3.858 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.723 -2.848 -4.719 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.011 -5.764 -3.636 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.696 -5.420 -5.354 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.111 -6.393 -4.885 1.00 0.00 H new ATOM 195 N GLU A 16 7.013 -1.484 -7.610 1.00 0.00 N ATOM 196 CA GLU A 16 7.875 -0.942 -8.647 1.00 0.00 C ATOM 197 C GLU A 16 9.105 -0.280 -8.022 1.00 0.00 C ATOM 198 O GLU A 16 8.980 0.521 -7.097 1.00 0.00 O ATOM 199 CB GLU A 16 7.113 0.044 -9.534 1.00 0.00 C ATOM 200 CG GLU A 16 8.078 0.901 -10.356 1.00 0.00 C ATOM 201 CD GLU A 16 7.510 1.184 -11.748 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.459 1.858 -11.806 1.00 0.00 O ATOM 203 OE2 GLU A 16 8.140 0.720 -12.723 1.00 0.00 O ATOM 0 H GLU A 16 7.157 -1.083 -6.683 1.00 0.00 H new ATOM 0 HA GLU A 16 8.211 -1.764 -9.280 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.447 -0.502 -10.202 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.487 0.687 -8.915 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.266 1.841 -9.838 1.00 0.00 H new ATOM 0 HG3 GLU A 16 9.036 0.390 -10.447 1.00 0.00 H new ATOM 210 N TYR A 17 10.265 -0.639 -8.553 1.00 0.00 N ATOM 211 CA TYR A 17 11.516 -0.090 -8.058 1.00 0.00 C ATOM 212 C TYR A 17 12.033 1.014 -8.983 1.00 0.00 C ATOM 213 O TYR A 17 12.115 0.826 -10.196 1.00 0.00 O ATOM 214 CB TYR A 17 12.515 -1.249 -8.059 1.00 0.00 C ATOM 215 CG TYR A 17 13.815 -0.950 -7.310 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.780 -0.628 -5.968 1.00 0.00 C ATOM 217 CD2 TYR A 17 15.022 -1.002 -7.976 1.00 0.00 C ATOM 218 CE1 TYR A 17 15.003 -0.347 -5.263 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.246 -0.721 -7.271 1.00 0.00 C ATOM 220 CZ TYR A 17 16.176 -0.407 -5.949 1.00 0.00 C ATOM 221 OH TYR A 17 17.332 -0.142 -5.283 1.00 0.00 O ATOM 0 H TYR A 17 10.365 -1.303 -9.321 1.00 0.00 H new ATOM 0 HA TYR A 17 11.380 0.344 -7.067 1.00 0.00 H new ATOM 0 HB2 TYR A 17 12.042 -2.123 -7.611 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.753 -1.509 -9.090 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.835 -0.587 -5.447 1.00 0.00 H new ATOM 0 HD2 TYR A 17 15.049 -1.253 -9.026 1.00 0.00 H new ATOM 0 HE1 TYR A 17 14.990 -0.094 -4.213 1.00 0.00 H new ATOM 0 HE2 TYR A 17 17.198 -0.759 -7.780 1.00 0.00 H new ATOM 0 HH TYR A 17 17.130 0.067 -4.347 1.00 0.00 H new ATOM 231 N ASN A 18 12.368 2.142 -8.375 1.00 0.00 N ATOM 232 CA ASN A 18 12.875 3.277 -9.128 1.00 0.00 C ATOM 233 C ASN A 18 14.354 3.051 -9.448 1.00 0.00 C ATOM 234 O ASN A 18 15.209 3.831 -9.032 1.00 0.00 O ATOM 235 CB ASN A 18 12.759 4.571 -8.321 1.00 0.00 C ATOM 236 CG ASN A 18 12.511 5.770 -9.239 1.00 0.00 C ATOM 237 OD1 ASN A 18 12.243 5.634 -10.421 1.00 0.00 O ATOM 238 ND2 ASN A 18 12.615 6.948 -8.630 1.00 0.00 N ATOM 0 H ASN A 18 12.298 2.295 -7.369 1.00 0.00 H new ATOM 0 HA ASN A 18 12.284 3.367 -10.040 1.00 0.00 H new ATOM 0 HB2 ASN A 18 11.944 4.484 -7.603 1.00 0.00 H new ATOM 0 HB3 ASN A 18 13.673 4.730 -7.748 1.00 0.00 H new ATOM 0 HD21 ASN A 18 12.467 7.809 -9.156 1.00 0.00 H new ATOM 0 HD22 ASN A 18 12.842 6.990 -7.637 1.00 0.00 H new ATOM 245 N PHE A 19 14.611 1.980 -10.185 1.00 0.00 N ATOM 246 CA PHE A 19 15.972 1.642 -10.565 1.00 0.00 C ATOM 247 C PHE A 19 16.758 2.893 -10.961 1.00 0.00 C ATOM 248 O PHE A 19 17.880 3.098 -10.501 1.00 0.00 O ATOM 249 CB PHE A 19 15.879 0.709 -11.774 1.00 0.00 C ATOM 250 CG PHE A 19 15.657 -0.761 -11.411 1.00 0.00 C ATOM 251 CD1 PHE A 19 16.722 -1.570 -11.167 1.00 0.00 C ATOM 252 CD2 PHE A 19 14.393 -1.258 -11.331 1.00 0.00 C ATOM 253 CE1 PHE A 19 16.516 -2.934 -10.830 1.00 0.00 C ATOM 254 CE2 PHE A 19 14.187 -2.621 -10.993 1.00 0.00 C ATOM 255 CZ PHE A 19 15.252 -3.431 -10.750 1.00 0.00 C ATOM 0 H PHE A 19 13.900 1.335 -10.529 1.00 0.00 H new ATOM 0 HA PHE A 19 16.487 1.173 -9.727 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.062 1.042 -12.415 1.00 0.00 H new ATOM 0 HB3 PHE A 19 16.796 0.794 -12.357 1.00 0.00 H new ATOM 0 HD1 PHE A 19 17.725 -1.175 -11.230 1.00 0.00 H new ATOM 0 HD2 PHE A 19 13.547 -0.616 -11.525 1.00 0.00 H new ATOM 0 HE1 PHE A 19 17.362 -3.577 -10.637 1.00 0.00 H new ATOM 0 HE2 PHE A 19 13.184 -3.015 -10.929 1.00 0.00 H new ATOM 0 HZ PHE A 19 15.095 -4.468 -10.494 1.00 0.00 H new ATOM 265 N GLU A 20 16.137 3.699 -11.811 1.00 0.00 N ATOM 266 CA GLU A 20 16.764 4.925 -12.274 1.00 0.00 C ATOM 267 C GLU A 20 17.472 5.630 -11.114 1.00 0.00 C ATOM 268 O GLU A 20 18.683 5.842 -11.158 1.00 0.00 O ATOM 269 CB GLU A 20 15.740 5.849 -12.934 1.00 0.00 C ATOM 270 CG GLU A 20 16.431 7.014 -13.647 1.00 0.00 C ATOM 271 CD GLU A 20 15.802 7.268 -15.018 1.00 0.00 C ATOM 272 OE1 GLU A 20 14.555 7.344 -15.065 1.00 0.00 O ATOM 273 OE2 GLU A 20 16.582 7.381 -15.988 1.00 0.00 O ATOM 0 H GLU A 20 15.206 3.526 -12.191 1.00 0.00 H new ATOM 0 HA GLU A 20 17.509 4.667 -13.026 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.142 5.284 -13.649 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.054 6.235 -12.180 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.357 7.914 -13.037 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.492 6.795 -13.765 1.00 0.00 H new ATOM 280 N ARG A 21 16.686 5.973 -10.105 1.00 0.00 N ATOM 281 CA ARG A 21 17.222 6.650 -8.936 1.00 0.00 C ATOM 282 C ARG A 21 17.370 5.665 -7.774 1.00 0.00 C ATOM 283 O ARG A 21 17.351 6.065 -6.611 1.00 0.00 O ATOM 284 CB ARG A 21 16.315 7.805 -8.504 1.00 0.00 C ATOM 285 CG ARG A 21 15.983 8.713 -9.689 1.00 0.00 C ATOM 286 CD ARG A 21 14.828 9.657 -9.349 1.00 0.00 C ATOM 287 NE ARG A 21 14.569 10.570 -10.485 1.00 0.00 N ATOM 288 CZ ARG A 21 13.881 11.715 -10.387 1.00 0.00 C ATOM 289 NH1 ARG A 21 13.379 12.096 -9.205 1.00 0.00 N ATOM 290 NH2 ARG A 21 13.695 12.481 -11.471 1.00 0.00 N ATOM 0 H ARG A 21 15.682 5.795 -10.072 1.00 0.00 H new ATOM 0 HA ARG A 21 18.199 7.051 -9.204 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.394 7.409 -8.076 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.806 8.385 -7.723 1.00 0.00 H new ATOM 0 HG2 ARG A 21 16.863 9.294 -9.965 1.00 0.00 H new ATOM 0 HG3 ARG A 21 15.718 8.105 -10.554 1.00 0.00 H new ATOM 0 HD2 ARG A 21 13.931 9.081 -9.123 1.00 0.00 H new ATOM 0 HD3 ARG A 21 15.070 10.234 -8.456 1.00 0.00 H new ATOM 0 HE ARG A 21 14.938 10.311 -11.400 1.00 0.00 H new ATOM 0 HH11 ARG A 21 13.521 11.514 -8.379 1.00 0.00 H new ATOM 0 HH12 ARG A 21 12.855 12.968 -9.131 1.00 0.00 H new ATOM 0 HH21 ARG A 21 14.077 12.192 -12.371 1.00 0.00 H new ATOM 0 HH22 ARG A 21 13.171 13.353 -11.396 1.00 0.00 H new ATOM 304 N LYS A 22 17.513 4.397 -8.130 1.00 0.00 N ATOM 305 CA LYS A 22 17.664 3.352 -7.131 1.00 0.00 C ATOM 306 C LYS A 22 16.754 3.656 -5.940 1.00 0.00 C ATOM 307 O LYS A 22 17.233 3.887 -4.831 1.00 0.00 O ATOM 308 CB LYS A 22 19.137 3.182 -6.752 1.00 0.00 C ATOM 309 CG LYS A 22 19.790 2.070 -7.575 1.00 0.00 C ATOM 310 CD LYS A 22 20.192 0.893 -6.685 1.00 0.00 C ATOM 311 CE LYS A 22 21.276 1.306 -5.687 1.00 0.00 C ATOM 312 NZ LYS A 22 22.408 0.354 -5.729 1.00 0.00 N ATOM 0 H LYS A 22 17.528 4.069 -9.096 1.00 0.00 H new ATOM 0 HA LYS A 22 17.350 2.390 -7.535 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.669 4.120 -6.915 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.219 2.949 -5.690 1.00 0.00 H new ATOM 0 HG2 LYS A 22 19.098 1.729 -8.345 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.670 2.460 -8.087 1.00 0.00 H new ATOM 0 HD2 LYS A 22 19.319 0.524 -6.147 1.00 0.00 H new ATOM 0 HD3 LYS A 22 20.555 0.072 -7.303 1.00 0.00 H new ATOM 0 HE2 LYS A 22 21.629 2.311 -5.920 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.859 1.340 -4.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 23.135 0.649 -5.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.070 -0.599 -5.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.816 0.342 -6.685 1.00 0.00 H new ATOM 326 N ALA A 23 15.457 3.645 -6.209 1.00 0.00 N ATOM 327 CA ALA A 23 14.475 3.917 -5.173 1.00 0.00 C ATOM 328 C ALA A 23 13.369 2.861 -5.236 1.00 0.00 C ATOM 329 O ALA A 23 13.383 1.993 -6.107 1.00 0.00 O ATOM 330 CB ALA A 23 13.934 5.338 -5.341 1.00 0.00 C ATOM 0 H ALA A 23 15.063 3.452 -7.130 1.00 0.00 H new ATOM 0 HA ALA A 23 14.933 3.858 -4.186 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.198 5.541 -4.564 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.754 6.052 -5.259 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.464 5.435 -6.320 1.00 0.00 H new ATOM 336 N PHE A 24 12.437 2.971 -4.300 1.00 0.00 N ATOM 337 CA PHE A 24 11.326 2.037 -4.238 1.00 0.00 C ATOM 338 C PHE A 24 9.992 2.757 -4.446 1.00 0.00 C ATOM 339 O PHE A 24 9.806 3.876 -3.972 1.00 0.00 O ATOM 340 CB PHE A 24 11.343 1.414 -2.841 1.00 0.00 C ATOM 341 CG PHE A 24 10.269 0.345 -2.623 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.837 -0.408 -3.669 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.748 0.149 -1.382 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.841 -1.399 -3.467 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.751 -0.843 -1.180 1.00 0.00 C ATOM 346 CZ PHE A 24 8.319 -1.596 -2.226 1.00 0.00 C ATOM 0 H PHE A 24 12.429 3.692 -3.579 1.00 0.00 H new ATOM 0 HA PHE A 24 11.428 1.285 -5.020 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.323 0.971 -2.664 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.211 2.203 -2.101 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.252 -0.252 -4.654 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.092 0.747 -0.551 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.498 -1.997 -4.298 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.336 -0.999 -0.195 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.562 -2.350 -2.072 1.00 0.00 H new ATOM 356 N VAL A 25 9.097 2.084 -5.156 1.00 0.00 N ATOM 357 CA VAL A 25 7.786 2.646 -5.433 1.00 0.00 C ATOM 358 C VAL A 25 6.711 1.610 -5.098 1.00 0.00 C ATOM 359 O VAL A 25 6.713 0.509 -5.647 1.00 0.00 O ATOM 360 CB VAL A 25 7.720 3.130 -6.882 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.469 3.979 -7.120 1.00 0.00 C ATOM 362 CG2 VAL A 25 8.986 3.900 -7.262 1.00 0.00 C ATOM 0 H VAL A 25 9.254 1.155 -5.547 1.00 0.00 H new ATOM 0 HA VAL A 25 7.603 3.518 -4.805 1.00 0.00 H new ATOM 0 HB VAL A 25 7.657 2.252 -7.525 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.446 4.311 -8.158 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.580 3.384 -6.910 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.488 4.848 -6.462 1.00 0.00 H new ATOM 0 HG21 VAL A 25 8.913 4.233 -8.297 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.095 4.766 -6.609 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.854 3.250 -7.150 1.00 0.00 H new ATOM 372 N VAL A 26 5.819 1.999 -4.200 1.00 0.00 N ATOM 373 CA VAL A 26 4.740 1.117 -3.786 1.00 0.00 C ATOM 374 C VAL A 26 3.402 1.712 -4.230 1.00 0.00 C ATOM 375 O VAL A 26 2.832 2.552 -3.536 1.00 0.00 O ATOM 376 CB VAL A 26 4.815 0.872 -2.278 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.647 0.002 -1.806 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.156 0.247 -1.889 1.00 0.00 C ATOM 0 H VAL A 26 5.821 2.913 -3.747 1.00 0.00 H new ATOM 0 HA VAL A 26 4.837 0.143 -4.265 1.00 0.00 H new ATOM 0 HB VAL A 26 4.739 1.837 -1.778 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.723 -0.157 -0.730 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.706 0.503 -2.033 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.679 -0.959 -2.318 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.182 0.084 -0.812 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.276 -0.706 -2.404 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.966 0.918 -2.174 1.00 0.00 H new ATOM 388 N ASN A 27 2.941 1.253 -5.384 1.00 0.00 N ATOM 389 CA ASN A 27 1.681 1.729 -5.929 1.00 0.00 C ATOM 390 C ASN A 27 0.528 0.956 -5.285 1.00 0.00 C ATOM 391 O ASN A 27 0.499 -0.273 -5.328 1.00 0.00 O ATOM 392 CB ASN A 27 1.615 1.505 -7.441 1.00 0.00 C ATOM 393 CG ASN A 27 0.205 1.769 -7.973 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.407 0.938 -8.624 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.274 2.970 -7.662 1.00 0.00 N ATOM 0 H ASN A 27 3.417 0.556 -5.957 1.00 0.00 H new ATOM 0 HA ASN A 27 1.604 2.796 -5.719 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.325 2.163 -7.941 1.00 0.00 H new ATOM 0 HB3 ASN A 27 1.910 0.482 -7.674 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.207 3.243 -7.972 1.00 0.00 H new ATOM 0 HD22 ASN A 27 0.291 3.618 -7.114 1.00 0.00 H new ATOM 402 N ILE A 28 -0.395 1.708 -4.705 1.00 0.00 N ATOM 403 CA ILE A 28 -1.548 1.110 -4.053 1.00 0.00 C ATOM 404 C ILE A 28 -2.788 1.320 -4.925 1.00 0.00 C ATOM 405 O ILE A 28 -3.340 2.418 -4.970 1.00 0.00 O ATOM 406 CB ILE A 28 -1.699 1.648 -2.629 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.549 1.172 -1.738 1.00 0.00 C ATOM 408 CG2 ILE A 28 -3.065 1.282 -2.046 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.650 1.784 -0.340 1.00 0.00 C ATOM 0 H ILE A 28 -0.368 2.727 -4.673 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.410 0.034 -3.948 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.647 2.736 -2.668 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.567 0.085 -1.665 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.404 1.446 -2.191 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.146 1.677 -1.033 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.852 1.711 -2.666 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -3.172 0.198 -2.022 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.179 1.430 0.273 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.608 2.871 -0.415 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.593 1.488 0.119 1.00 0.00 H new ATOM 421 N LYS A 29 -3.188 0.251 -5.596 1.00 0.00 N ATOM 422 CA LYS A 29 -4.353 0.305 -6.464 1.00 0.00 C ATOM 423 C LYS A 29 -5.593 0.623 -5.627 1.00 0.00 C ATOM 424 O LYS A 29 -5.549 1.483 -4.748 1.00 0.00 O ATOM 425 CB LYS A 29 -4.474 -0.985 -7.278 1.00 0.00 C ATOM 426 CG LYS A 29 -5.233 -0.740 -8.584 1.00 0.00 C ATOM 427 CD LYS A 29 -4.390 -1.149 -9.793 1.00 0.00 C ATOM 428 CE LYS A 29 -5.235 -1.904 -10.821 1.00 0.00 C ATOM 429 NZ LYS A 29 -5.418 -1.088 -12.042 1.00 0.00 N ATOM 0 H LYS A 29 -2.727 -0.658 -5.557 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.247 1.107 -7.195 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.480 -1.375 -7.498 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.991 -1.743 -6.690 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -6.165 -1.305 -8.578 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.499 0.314 -8.662 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -3.956 -0.262 -10.255 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.561 -1.777 -9.467 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.751 -2.847 -11.076 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.206 -2.150 -10.392 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.994 -1.615 -12.729 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.899 -0.199 -11.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.490 -0.875 -12.460 1.00 0.00 H new ATOM 443 N GLU A 30 -6.670 -0.087 -5.929 1.00 0.00 N ATOM 444 CA GLU A 30 -7.920 0.109 -5.215 1.00 0.00 C ATOM 445 C GLU A 30 -8.281 -1.148 -4.421 1.00 0.00 C ATOM 446 O GLU A 30 -7.585 -2.159 -4.502 1.00 0.00 O ATOM 447 CB GLU A 30 -9.047 0.491 -6.178 1.00 0.00 C ATOM 448 CG GLU A 30 -9.345 -0.650 -7.153 1.00 0.00 C ATOM 449 CD GLU A 30 -10.847 -0.931 -7.226 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.366 -1.499 -6.241 1.00 0.00 O ATOM 451 OE2 GLU A 30 -11.442 -0.570 -8.264 1.00 0.00 O ATOM 0 H GLU A 30 -6.703 -0.799 -6.659 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.790 0.933 -4.514 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.946 0.735 -5.613 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.767 1.386 -6.734 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.971 -0.393 -8.144 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.818 -1.550 -6.837 1.00 0.00 H new ATOM 458 N ALA A 31 -9.368 -1.043 -3.670 1.00 0.00 N ATOM 459 CA ALA A 31 -9.829 -2.159 -2.861 1.00 0.00 C ATOM 460 C ALA A 31 -11.306 -2.423 -3.159 1.00 0.00 C ATOM 461 O ALA A 31 -12.136 -1.522 -3.050 1.00 0.00 O ATOM 462 CB ALA A 31 -9.577 -1.856 -1.383 1.00 0.00 C ATOM 0 H ALA A 31 -9.942 -0.203 -3.605 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.276 -3.066 -3.107 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.923 -2.693 -0.776 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.510 -1.705 -1.219 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -10.119 -0.954 -1.099 1.00 0.00 H new ATOM 468 N ARG A 32 -11.589 -3.663 -3.531 1.00 0.00 N ATOM 469 CA ARG A 32 -12.952 -4.057 -3.845 1.00 0.00 C ATOM 470 C ARG A 32 -13.490 -5.009 -2.775 1.00 0.00 C ATOM 471 O ARG A 32 -12.764 -5.875 -2.288 1.00 0.00 O ATOM 472 CB ARG A 32 -13.026 -4.741 -5.211 1.00 0.00 C ATOM 473 CG ARG A 32 -13.652 -3.815 -6.256 1.00 0.00 C ATOM 474 CD ARG A 32 -14.733 -4.544 -7.057 1.00 0.00 C ATOM 475 NE ARG A 32 -14.880 -3.922 -8.392 1.00 0.00 N ATOM 476 CZ ARG A 32 -15.816 -4.270 -9.285 1.00 0.00 C ATOM 477 NH1 ARG A 32 -16.694 -5.238 -8.991 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.874 -3.651 -10.472 1.00 0.00 N ATOM 0 H ARG A 32 -10.898 -4.408 -3.622 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.561 -3.153 -3.870 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.025 -5.032 -5.531 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.614 -5.656 -5.132 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -14.085 -2.944 -5.763 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.879 -3.448 -6.931 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.470 -5.596 -7.164 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.682 -4.505 -6.522 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.227 -3.181 -8.648 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.650 -5.710 -8.088 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -17.407 -5.503 -9.670 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.205 -2.914 -10.696 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.587 -3.917 -11.151 1.00 0.00 H new ATOM 492 N GLY A 33 -14.758 -4.817 -2.441 1.00 0.00 N ATOM 493 CA GLY A 33 -15.401 -5.649 -1.438 1.00 0.00 C ATOM 494 C GLY A 33 -15.122 -5.122 -0.028 1.00 0.00 C ATOM 495 O GLY A 33 -14.355 -5.723 0.722 1.00 0.00 O ATOM 0 H GLY A 33 -15.357 -4.098 -2.847 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.476 -5.673 -1.615 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.041 -6.674 -1.525 1.00 0.00 H new ATOM 499 N LEU A 34 -15.760 -4.005 0.288 1.00 0.00 N ATOM 500 CA LEU A 34 -15.590 -3.391 1.594 1.00 0.00 C ATOM 501 C LEU A 34 -16.927 -3.408 2.339 1.00 0.00 C ATOM 502 O LEU A 34 -17.906 -2.823 1.879 1.00 0.00 O ATOM 503 CB LEU A 34 -14.983 -1.993 1.454 1.00 0.00 C ATOM 504 CG LEU A 34 -13.671 -1.908 0.671 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.920 -0.616 0.999 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.808 -3.148 0.909 1.00 0.00 C ATOM 0 H LEU A 34 -16.395 -3.509 -0.337 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.882 -3.963 2.194 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.715 -1.347 0.969 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.814 -1.590 2.453 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.909 -1.882 -0.392 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.991 -0.580 0.429 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -13.540 0.242 0.737 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.693 -0.587 2.065 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.882 -3.061 0.341 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.576 -3.231 1.971 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.350 -4.036 0.585 1.00 0.00 H new ATOM 518 N PRO A 35 -16.924 -4.104 3.508 1.00 0.00 N ATOM 519 CA PRO A 35 -18.124 -4.206 4.321 1.00 0.00 C ATOM 520 C PRO A 35 -18.397 -2.895 5.061 1.00 0.00 C ATOM 521 O PRO A 35 -17.515 -2.361 5.732 1.00 0.00 O ATOM 522 CB PRO A 35 -17.867 -5.375 5.257 1.00 0.00 C ATOM 523 CG PRO A 35 -16.362 -5.588 5.254 1.00 0.00 C ATOM 524 CD PRO A 35 -15.783 -4.810 4.084 1.00 0.00 C ATOM 0 HA PRO A 35 -19.022 -4.379 3.727 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.229 -5.158 6.262 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.389 -6.270 4.917 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.926 -5.246 6.193 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.127 -6.648 5.161 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.012 -4.114 4.414 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.320 -5.476 3.356 1.00 0.00 H new ATOM 532 N ALA A 36 -19.623 -2.414 4.915 1.00 0.00 N ATOM 533 CA ALA A 36 -20.024 -1.176 5.562 1.00 0.00 C ATOM 534 C ALA A 36 -19.660 -1.241 7.046 1.00 0.00 C ATOM 535 O ALA A 36 -19.742 -2.301 7.664 1.00 0.00 O ATOM 536 CB ALA A 36 -21.519 -0.943 5.337 1.00 0.00 C ATOM 0 H ALA A 36 -20.352 -2.859 4.358 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.494 -0.327 5.130 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.820 -0.014 5.822 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.720 -0.875 4.268 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -22.084 -1.773 5.760 1.00 0.00 H new ATOM 542 N MET A 37 -19.265 -0.092 7.577 1.00 0.00 N ATOM 543 CA MET A 37 -18.889 -0.005 8.977 1.00 0.00 C ATOM 544 C MET A 37 -19.798 0.969 9.730 1.00 0.00 C ATOM 545 O MET A 37 -20.106 0.757 10.902 1.00 0.00 O ATOM 546 CB MET A 37 -17.436 0.463 9.087 1.00 0.00 C ATOM 547 CG MET A 37 -16.486 -0.537 8.426 1.00 0.00 C ATOM 548 SD MET A 37 -16.458 -2.060 9.357 1.00 0.00 S ATOM 549 CE MET A 37 -15.102 -1.719 10.467 1.00 0.00 C ATOM 0 H MET A 37 -19.198 0.786 7.062 1.00 0.00 H new ATOM 0 HA MET A 37 -18.997 -0.993 9.425 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.328 1.439 8.615 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.168 0.585 10.136 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.806 -0.733 7.402 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.482 -0.116 8.372 1.00 0.00 H new ATOM 0 HE1 MET A 37 -14.496 -2.617 10.587 1.00 0.00 H new ATOM 0 HE2 MET A 37 -14.487 -0.918 10.055 1.00 0.00 H new ATOM 0 HE3 MET A 37 -15.494 -1.413 11.437 1.00 0.00 H new ATOM 559 N ASP A 38 -20.202 2.016 9.025 1.00 0.00 N ATOM 560 CA ASP A 38 -21.070 3.022 9.612 1.00 0.00 C ATOM 561 C ASP A 38 -22.517 2.743 9.204 1.00 0.00 C ATOM 562 O ASP A 38 -22.771 1.915 8.330 1.00 0.00 O ATOM 563 CB ASP A 38 -20.701 4.423 9.118 1.00 0.00 C ATOM 564 CG ASP A 38 -20.992 5.554 10.105 1.00 0.00 C ATOM 565 OD1 ASP A 38 -22.153 5.623 10.564 1.00 0.00 O ATOM 566 OD2 ASP A 38 -20.047 6.325 10.379 1.00 0.00 O ATOM 0 H ASP A 38 -19.944 2.189 8.053 1.00 0.00 H new ATOM 0 HA ASP A 38 -20.953 2.978 10.695 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -19.639 4.438 8.875 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -21.243 4.620 8.193 1.00 0.00 H new ATOM 571 N GLU A 39 -23.430 3.448 9.856 1.00 0.00 N ATOM 572 CA GLU A 39 -24.845 3.286 9.572 1.00 0.00 C ATOM 573 C GLU A 39 -25.448 4.612 9.102 1.00 0.00 C ATOM 574 O GLU A 39 -26.304 5.182 9.776 1.00 0.00 O ATOM 575 CB GLU A 39 -25.592 2.748 10.795 1.00 0.00 C ATOM 576 CG GLU A 39 -25.090 1.353 11.173 1.00 0.00 C ATOM 577 CD GLU A 39 -26.184 0.303 10.970 1.00 0.00 C ATOM 578 OE1 GLU A 39 -26.299 -0.183 9.824 1.00 0.00 O ATOM 579 OE2 GLU A 39 -26.881 0.010 11.966 1.00 0.00 O ATOM 0 H GLU A 39 -23.217 4.133 10.581 1.00 0.00 H new ATOM 0 HA GLU A 39 -24.953 2.555 8.770 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -25.457 3.428 11.636 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -26.661 2.709 10.585 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -24.220 1.099 10.567 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -24.766 1.349 12.214 1.00 0.00 H new ATOM 586 N GLN A 40 -24.976 5.063 7.949 1.00 0.00 N ATOM 587 CA GLN A 40 -25.458 6.311 7.381 1.00 0.00 C ATOM 588 C GLN A 40 -26.165 6.050 6.049 1.00 0.00 C ATOM 589 O GLN A 40 -27.383 6.190 5.951 1.00 0.00 O ATOM 590 CB GLN A 40 -24.314 7.312 7.207 1.00 0.00 C ATOM 591 CG GLN A 40 -23.800 7.798 8.564 1.00 0.00 C ATOM 592 CD GLN A 40 -23.668 9.322 8.586 1.00 0.00 C ATOM 593 OE1 GLN A 40 -23.377 9.960 7.587 1.00 0.00 O ATOM 594 NE2 GLN A 40 -23.897 9.868 9.777 1.00 0.00 N ATOM 0 H GLN A 40 -24.265 4.587 7.393 1.00 0.00 H new ATOM 0 HA GLN A 40 -26.178 6.748 8.073 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -23.500 6.847 6.651 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -24.657 8.163 6.618 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -24.482 7.477 9.351 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -22.832 7.342 8.775 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -24.136 9.276 10.572 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -23.833 10.879 9.895 1.00 0.00 H new ATOM 603 N SER A 41 -25.370 5.674 5.058 1.00 0.00 N ATOM 604 CA SER A 41 -25.905 5.392 3.736 1.00 0.00 C ATOM 605 C SER A 41 -25.257 4.128 3.168 1.00 0.00 C ATOM 606 O SER A 41 -24.966 4.058 1.975 1.00 0.00 O ATOM 607 CB SER A 41 -25.684 6.574 2.789 1.00 0.00 C ATOM 608 OG SER A 41 -26.851 6.871 2.026 1.00 0.00 O ATOM 0 H SER A 41 -24.360 5.558 5.143 1.00 0.00 H new ATOM 0 HA SER A 41 -26.979 5.231 3.829 1.00 0.00 H new ATOM 0 HB2 SER A 41 -25.395 7.452 3.366 1.00 0.00 H new ATOM 0 HB3 SER A 41 -24.857 6.349 2.115 1.00 0.00 H new ATOM 0 HG SER A 41 -26.671 7.632 1.435 1.00 0.00 H new ATOM 614 N MET A 42 -25.049 3.161 4.049 1.00 0.00 N ATOM 615 CA MET A 42 -24.440 1.904 3.650 1.00 0.00 C ATOM 616 C MET A 42 -23.077 2.137 2.995 1.00 0.00 C ATOM 617 O MET A 42 -22.704 1.430 2.061 1.00 0.00 O ATOM 618 CB MET A 42 -25.362 1.179 2.667 1.00 0.00 C ATOM 619 CG MET A 42 -25.513 -0.296 3.043 1.00 0.00 C ATOM 620 SD MET A 42 -24.344 -1.283 2.123 1.00 0.00 S ATOM 621 CE MET A 42 -23.912 -2.490 3.366 1.00 0.00 C ATOM 0 H MET A 42 -25.291 3.223 5.038 1.00 0.00 H new ATOM 0 HA MET A 42 -24.293 1.295 4.542 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.341 1.658 2.660 1.00 0.00 H new ATOM 0 HB3 MET A 42 -24.960 1.261 1.657 1.00 0.00 H new ATOM 0 HG2 MET A 42 -25.349 -0.426 4.113 1.00 0.00 H new ATOM 0 HG3 MET A 42 -26.529 -0.631 2.834 1.00 0.00 H new ATOM 0 HE1 MET A 42 -22.907 -2.866 3.174 1.00 0.00 H new ATOM 0 HE2 MET A 42 -23.944 -2.025 4.351 1.00 0.00 H new ATOM 0 HE3 MET A 42 -24.621 -3.317 3.332 1.00 0.00 H new ATOM 631 N THR A 43 -22.371 3.133 3.512 1.00 0.00 N ATOM 632 CA THR A 43 -21.058 3.469 2.989 1.00 0.00 C ATOM 633 C THR A 43 -20.053 3.626 4.131 1.00 0.00 C ATOM 634 O THR A 43 -20.401 3.447 5.298 1.00 0.00 O ATOM 635 CB THR A 43 -21.199 4.725 2.127 1.00 0.00 C ATOM 636 OG1 THR A 43 -19.884 4.953 1.627 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.504 5.973 2.957 1.00 0.00 C ATOM 0 H THR A 43 -22.684 3.717 4.287 1.00 0.00 H new ATOM 0 HA THR A 43 -20.666 2.669 2.361 1.00 0.00 H new ATOM 0 HB THR A 43 -21.991 4.575 1.393 1.00 0.00 H new ATOM 0 HG1 THR A 43 -19.556 4.141 1.186 1.00 0.00 H new ATOM 0 HG21 THR A 43 -21.594 6.836 2.297 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.440 5.831 3.498 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.696 6.143 3.668 1.00 0.00 H new ATOM 645 N SER A 44 -18.826 3.959 3.757 1.00 0.00 N ATOM 646 CA SER A 44 -17.768 4.142 4.736 1.00 0.00 C ATOM 647 C SER A 44 -16.582 4.864 4.095 1.00 0.00 C ATOM 648 O SER A 44 -16.598 5.152 2.899 1.00 0.00 O ATOM 649 CB SER A 44 -17.321 2.801 5.321 1.00 0.00 C ATOM 650 OG SER A 44 -17.591 1.716 4.437 1.00 0.00 O ATOM 0 H SER A 44 -18.541 4.107 2.789 1.00 0.00 H new ATOM 0 HA SER A 44 -18.158 4.751 5.552 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.253 2.837 5.535 1.00 0.00 H new ATOM 0 HB3 SER A 44 -17.831 2.631 6.269 1.00 0.00 H new ATOM 0 HG SER A 44 -17.290 0.878 4.846 1.00 0.00 H new ATOM 656 N ASP A 45 -15.580 5.136 4.919 1.00 0.00 N ATOM 657 CA ASP A 45 -14.388 5.820 4.447 1.00 0.00 C ATOM 658 C ASP A 45 -13.153 4.995 4.817 1.00 0.00 C ATOM 659 O ASP A 45 -12.315 5.442 5.599 1.00 0.00 O ATOM 660 CB ASP A 45 -14.249 7.197 5.098 1.00 0.00 C ATOM 661 CG ASP A 45 -15.561 7.961 5.282 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.498 7.676 4.505 1.00 0.00 O ATOM 663 OD2 ASP A 45 -15.599 8.813 6.196 1.00 0.00 O ATOM 0 H ASP A 45 -15.569 4.895 5.910 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.472 5.939 3.367 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -13.777 7.075 6.073 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.576 7.803 4.492 1.00 0.00 H new ATOM 668 N PRO A 46 -13.078 3.774 4.223 1.00 0.00 N ATOM 669 CA PRO A 46 -11.960 2.883 4.482 1.00 0.00 C ATOM 670 C PRO A 46 -10.702 3.355 3.750 1.00 0.00 C ATOM 671 O PRO A 46 -10.791 4.075 2.756 1.00 0.00 O ATOM 672 CB PRO A 46 -12.435 1.513 4.025 1.00 0.00 C ATOM 673 CG PRO A 46 -13.617 1.768 3.103 1.00 0.00 C ATOM 674 CD PRO A 46 -14.052 3.212 3.292 1.00 0.00 C ATOM 0 HA PRO A 46 -11.675 2.860 5.534 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.641 0.978 3.504 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.729 0.898 4.875 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.338 1.586 2.065 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.437 1.089 3.336 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -14.052 3.752 2.345 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.064 3.271 3.694 1.00 0.00 H new ATOM 682 N TYR A 47 -9.560 2.930 4.270 1.00 0.00 N ATOM 683 CA TYR A 47 -8.285 3.301 3.678 1.00 0.00 C ATOM 684 C TYR A 47 -7.186 2.316 4.082 1.00 0.00 C ATOM 685 O TYR A 47 -7.188 1.802 5.200 1.00 0.00 O ATOM 686 CB TYR A 47 -7.946 4.683 4.239 1.00 0.00 C ATOM 687 CG TYR A 47 -7.679 4.695 5.745 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.719 4.899 6.628 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.398 4.502 6.221 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.469 4.911 8.046 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.147 4.513 7.639 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.195 4.717 8.482 1.00 0.00 C ATOM 693 OH TYR A 47 -6.958 4.728 9.821 1.00 0.00 O ATOM 0 H TYR A 47 -9.490 2.333 5.094 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.351 3.296 2.590 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.067 5.068 3.722 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.769 5.364 4.021 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.721 5.050 6.255 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.584 4.343 5.530 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -9.275 5.070 8.747 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.149 4.363 8.024 1.00 0.00 H new ATOM 0 HH TYR A 47 -7.807 4.645 10.304 1.00 0.00 H new ATOM 703 N ILE A 48 -6.274 2.081 3.151 1.00 0.00 N ATOM 704 CA ILE A 48 -5.172 1.167 3.396 1.00 0.00 C ATOM 705 C ILE A 48 -3.976 1.951 3.940 1.00 0.00 C ATOM 706 O ILE A 48 -3.768 3.107 3.575 1.00 0.00 O ATOM 707 CB ILE A 48 -4.855 0.359 2.135 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.131 -0.215 1.517 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.819 -0.729 2.427 1.00 0.00 C ATOM 710 CD1 ILE A 48 -5.813 -1.040 0.269 1.00 0.00 C ATOM 0 H ILE A 48 -6.276 2.508 2.225 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.446 0.435 4.156 1.00 0.00 H new ATOM 0 HB ILE A 48 -4.416 1.032 1.399 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.645 -0.839 2.248 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -6.810 0.597 1.257 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.612 -1.288 1.515 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.899 -0.268 2.787 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -4.207 -1.406 3.188 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.738 -1.436 -0.150 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -5.321 -0.407 -0.470 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.153 -1.865 0.537 1.00 0.00 H new ATOM 722 N LYS A 49 -3.220 1.290 4.805 1.00 0.00 N ATOM 723 CA LYS A 49 -2.051 1.911 5.404 1.00 0.00 C ATOM 724 C LYS A 49 -0.797 1.150 4.970 1.00 0.00 C ATOM 725 O LYS A 49 -0.734 -0.072 5.095 1.00 0.00 O ATOM 726 CB LYS A 49 -2.215 2.011 6.922 1.00 0.00 C ATOM 727 CG LYS A 49 -3.095 3.205 7.300 1.00 0.00 C ATOM 728 CD LYS A 49 -2.957 3.537 8.787 1.00 0.00 C ATOM 729 CE LYS A 49 -2.444 4.965 8.985 1.00 0.00 C ATOM 730 NZ LYS A 49 -1.081 4.950 9.563 1.00 0.00 N ATOM 0 H LYS A 49 -3.394 0.331 5.105 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.941 2.936 5.051 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.658 1.092 7.305 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.237 2.113 7.391 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.814 4.072 6.702 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -4.136 2.982 7.068 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.922 3.422 9.280 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.272 2.832 9.259 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -2.435 5.490 8.030 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.119 5.512 9.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -0.768 5.926 9.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.090 4.423 10.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -0.427 4.491 8.898 1.00 0.00 H new ATOM 744 N MET A 50 0.171 1.904 4.470 1.00 0.00 N ATOM 745 CA MET A 50 1.420 1.315 4.017 1.00 0.00 C ATOM 746 C MET A 50 2.489 1.388 5.109 1.00 0.00 C ATOM 747 O MET A 50 2.519 2.338 5.890 1.00 0.00 O ATOM 748 CB MET A 50 1.911 2.056 2.771 1.00 0.00 C ATOM 749 CG MET A 50 2.585 1.093 1.791 1.00 0.00 C ATOM 750 SD MET A 50 4.206 0.647 2.390 1.00 0.00 S ATOM 751 CE MET A 50 5.185 1.918 1.608 1.00 0.00 C ATOM 0 H MET A 50 0.116 2.917 4.369 1.00 0.00 H new ATOM 0 HA MET A 50 1.241 0.266 3.780 1.00 0.00 H new ATOM 0 HB2 MET A 50 1.071 2.549 2.282 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.614 2.837 3.061 1.00 0.00 H new ATOM 0 HG2 MET A 50 1.974 0.198 1.670 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.667 1.559 0.809 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.150 1.505 1.315 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.664 2.286 0.724 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.339 2.740 2.307 1.00 0.00 H new ATOM 761 N THR A 51 3.339 0.373 5.129 1.00 0.00 N ATOM 762 CA THR A 51 4.407 0.310 6.113 1.00 0.00 C ATOM 763 C THR A 51 5.546 -0.578 5.609 1.00 0.00 C ATOM 764 O THR A 51 5.309 -1.693 5.145 1.00 0.00 O ATOM 765 CB THR A 51 3.804 -0.167 7.436 1.00 0.00 C ATOM 766 OG1 THR A 51 2.808 0.807 7.735 1.00 0.00 O ATOM 767 CG2 THR A 51 4.790 -0.062 8.601 1.00 0.00 C ATOM 0 H THR A 51 3.310 -0.413 4.480 1.00 0.00 H new ATOM 0 HA THR A 51 4.851 1.292 6.277 1.00 0.00 H new ATOM 0 HB THR A 51 3.474 -1.201 7.332 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.057 1.664 7.330 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.312 -0.413 9.515 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.667 -0.675 8.392 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.095 0.977 8.727 1.00 0.00 H new ATOM 775 N ILE A 52 6.757 -0.052 5.717 1.00 0.00 N ATOM 776 CA ILE A 52 7.933 -0.783 5.277 1.00 0.00 C ATOM 777 C ILE A 52 8.473 -1.617 6.440 1.00 0.00 C ATOM 778 O ILE A 52 9.116 -1.086 7.344 1.00 0.00 O ATOM 779 CB ILE A 52 8.964 0.173 4.675 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.385 0.915 3.469 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.258 -0.566 4.325 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.498 1.418 2.548 1.00 0.00 C ATOM 0 H ILE A 52 6.949 0.872 6.103 1.00 0.00 H new ATOM 0 HA ILE A 52 7.673 -1.478 4.479 1.00 0.00 H new ATOM 0 HB ILE A 52 9.214 0.923 5.426 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.721 0.252 2.914 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.783 1.757 3.810 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.974 0.136 3.899 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.679 -1.011 5.227 1.00 0.00 H new ATOM 0 HG23 ILE A 52 10.044 -1.351 3.600 1.00 0.00 H new ATOM 0 HD11 ILE A 52 9.059 1.942 1.699 1.00 0.00 H new ATOM 0 HD12 ILE A 52 10.146 2.100 3.099 1.00 0.00 H new ATOM 0 HD13 ILE A 52 10.083 0.572 2.189 1.00 0.00 H new ATOM 794 N LEU A 53 8.192 -2.911 6.380 1.00 0.00 N ATOM 795 CA LEU A 53 8.642 -3.824 7.417 1.00 0.00 C ATOM 796 C LEU A 53 10.017 -4.378 7.041 1.00 0.00 C ATOM 797 O LEU A 53 10.393 -4.374 5.870 1.00 0.00 O ATOM 798 CB LEU A 53 7.591 -4.906 7.671 1.00 0.00 C ATOM 799 CG LEU A 53 6.310 -4.447 8.371 1.00 0.00 C ATOM 800 CD1 LEU A 53 5.152 -5.402 8.076 1.00 0.00 C ATOM 801 CD2 LEU A 53 6.540 -4.270 9.873 1.00 0.00 C ATOM 0 H LEU A 53 7.658 -3.349 5.629 1.00 0.00 H new ATOM 0 HA LEU A 53 8.759 -3.297 8.364 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.319 -5.352 6.714 1.00 0.00 H new ATOM 0 HB3 LEU A 53 8.047 -5.693 8.271 1.00 0.00 H new ATOM 0 HG LEU A 53 6.032 -3.472 7.971 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.254 -5.053 8.585 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.971 -5.433 7.002 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.405 -6.401 8.431 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.614 -3.943 10.347 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.855 -5.219 10.307 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.315 -3.521 10.037 1.00 0.00 H new ATOM 813 N PRO A 54 10.750 -4.854 8.083 1.00 0.00 N ATOM 814 CA PRO A 54 10.230 -4.822 9.440 1.00 0.00 C ATOM 815 C PRO A 54 10.276 -3.403 10.011 1.00 0.00 C ATOM 816 O PRO A 54 9.331 -2.961 10.662 1.00 0.00 O ATOM 817 CB PRO A 54 11.094 -5.803 10.215 1.00 0.00 C ATOM 818 CG PRO A 54 12.352 -5.998 9.385 1.00 0.00 C ATOM 819 CD PRO A 54 12.087 -5.434 7.998 1.00 0.00 C ATOM 0 HA PRO A 54 9.179 -5.107 9.495 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.335 -5.414 11.204 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.573 -6.749 10.363 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.198 -5.490 9.849 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.609 -7.055 9.324 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.828 -4.682 7.728 1.00 0.00 H new ATOM 0 HD3 PRO A 54 12.133 -6.214 7.238 1.00 0.00 H new ATOM 827 N GLU A 55 11.386 -2.729 9.746 1.00 0.00 N ATOM 828 CA GLU A 55 11.567 -1.369 10.225 1.00 0.00 C ATOM 829 C GLU A 55 10.232 -0.789 10.694 1.00 0.00 C ATOM 830 O GLU A 55 10.052 -0.515 11.880 1.00 0.00 O ATOM 831 CB GLU A 55 12.200 -0.487 9.146 1.00 0.00 C ATOM 832 CG GLU A 55 11.706 -0.885 7.754 1.00 0.00 C ATOM 833 CD GLU A 55 12.881 -1.138 6.807 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.516 -2.203 6.962 1.00 0.00 O ATOM 835 OE2 GLU A 55 13.118 -0.259 5.950 1.00 0.00 O ATOM 0 H GLU A 55 12.168 -3.099 9.206 1.00 0.00 H new ATOM 0 HA GLU A 55 12.249 -1.392 11.075 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.957 0.558 9.337 1.00 0.00 H new ATOM 0 HB3 GLU A 55 13.286 -0.575 9.190 1.00 0.00 H new ATOM 0 HG2 GLU A 55 11.092 -1.783 7.825 1.00 0.00 H new ATOM 0 HG3 GLU A 55 11.072 -0.096 7.350 1.00 0.00 H new ATOM 842 N LYS A 56 9.329 -0.618 9.739 1.00 0.00 N ATOM 843 CA LYS A 56 8.015 -0.075 10.040 1.00 0.00 C ATOM 844 C LYS A 56 8.104 1.451 10.115 1.00 0.00 C ATOM 845 O LYS A 56 7.130 2.116 10.464 1.00 0.00 O ATOM 846 CB LYS A 56 7.445 -0.721 11.305 1.00 0.00 C ATOM 847 CG LYS A 56 5.917 -0.644 11.319 1.00 0.00 C ATOM 848 CD LYS A 56 5.368 -0.911 12.721 1.00 0.00 C ATOM 849 CE LYS A 56 4.083 -1.739 12.658 1.00 0.00 C ATOM 850 NZ LYS A 56 3.122 -1.285 13.688 1.00 0.00 N ATOM 0 H LYS A 56 9.482 -0.846 8.757 1.00 0.00 H new ATOM 0 HA LYS A 56 7.311 -0.315 9.243 1.00 0.00 H new ATOM 0 HB2 LYS A 56 7.761 -1.763 11.360 1.00 0.00 H new ATOM 0 HB3 LYS A 56 7.846 -0.220 12.186 1.00 0.00 H new ATOM 0 HG2 LYS A 56 5.596 0.341 10.980 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.506 -1.372 10.619 1.00 0.00 H new ATOM 0 HD2 LYS A 56 6.116 -1.438 13.314 1.00 0.00 H new ATOM 0 HD3 LYS A 56 5.171 0.035 13.225 1.00 0.00 H new ATOM 0 HE2 LYS A 56 3.634 -1.649 11.669 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.315 -2.793 12.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 2.256 -1.858 13.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 3.547 -1.393 14.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.887 -0.285 13.527 1.00 0.00 H new ATOM 864 N LYS A 57 9.280 1.960 9.781 1.00 0.00 N ATOM 865 CA LYS A 57 9.508 3.395 9.805 1.00 0.00 C ATOM 866 C LYS A 57 8.667 4.060 8.714 1.00 0.00 C ATOM 867 O LYS A 57 7.651 4.689 9.005 1.00 0.00 O ATOM 868 CB LYS A 57 11.003 3.702 9.702 1.00 0.00 C ATOM 869 CG LYS A 57 11.498 4.446 10.944 1.00 0.00 C ATOM 870 CD LYS A 57 11.701 5.933 10.648 1.00 0.00 C ATOM 871 CE LYS A 57 11.520 6.774 11.914 1.00 0.00 C ATOM 872 NZ LYS A 57 12.482 7.899 11.930 1.00 0.00 N ATOM 0 H LYS A 57 10.085 1.405 9.492 1.00 0.00 H new ATOM 0 HA LYS A 57 9.185 3.816 10.757 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.561 2.773 9.584 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.194 4.304 8.813 1.00 0.00 H new ATOM 0 HG2 LYS A 57 10.778 4.328 11.754 1.00 0.00 H new ATOM 0 HG3 LYS A 57 12.436 4.008 11.285 1.00 0.00 H new ATOM 0 HD2 LYS A 57 12.699 6.093 10.240 1.00 0.00 H new ATOM 0 HD3 LYS A 57 10.990 6.256 9.888 1.00 0.00 H new ATOM 0 HE2 LYS A 57 10.501 7.158 11.960 1.00 0.00 H new ATOM 0 HE3 LYS A 57 11.666 6.150 12.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 12.346 8.460 12.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 13.453 7.526 11.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 12.324 8.503 11.098 1.00 0.00 H new ATOM 886 N HIS A 58 9.122 3.898 7.480 1.00 0.00 N ATOM 887 CA HIS A 58 8.424 4.474 6.343 1.00 0.00 C ATOM 888 C HIS A 58 6.940 4.107 6.412 1.00 0.00 C ATOM 889 O HIS A 58 6.538 3.044 5.940 1.00 0.00 O ATOM 890 CB HIS A 58 9.080 4.047 5.029 1.00 0.00 C ATOM 891 CG HIS A 58 10.555 4.362 4.949 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.500 3.978 4.044 1.00 0.00 N flip ATOM 893 CD2 HIS A 58 11.203 5.160 5.875 1.00 0.00 C flip ATOM 894 CE1 HIS A 58 12.662 4.513 4.398 1.00 0.00 C flip ATOM 895 NE2 HIS A 58 12.480 5.246 5.533 1.00 0.00 N flip ATOM 0 H HIS A 58 9.966 3.376 7.243 1.00 0.00 H new ATOM 0 HA HIS A 58 8.496 5.561 6.381 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.940 2.974 4.897 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.568 4.540 4.202 1.00 0.00 H new ATOM 0 HD2 HIS A 58 10.745 5.633 6.731 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.598 4.388 3.873 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.200 5.769 6.031 1.00 0.00 H new ATOM 903 N LYS A 59 6.167 5.006 7.003 1.00 0.00 N ATOM 904 CA LYS A 59 4.737 4.789 7.139 1.00 0.00 C ATOM 905 C LYS A 59 3.986 5.852 6.334 1.00 0.00 C ATOM 906 O LYS A 59 4.093 7.043 6.620 1.00 0.00 O ATOM 907 CB LYS A 59 4.340 4.742 8.616 1.00 0.00 C ATOM 908 CG LYS A 59 4.835 3.454 9.276 1.00 0.00 C ATOM 909 CD LYS A 59 4.453 3.414 10.757 1.00 0.00 C ATOM 910 CE LYS A 59 3.086 2.757 10.954 1.00 0.00 C ATOM 911 NZ LYS A 59 2.332 3.439 12.030 1.00 0.00 N ATOM 0 H LYS A 59 6.504 5.886 7.393 1.00 0.00 H new ATOM 0 HA LYS A 59 4.458 3.819 6.727 1.00 0.00 H new ATOM 0 HB2 LYS A 59 4.757 5.605 9.136 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.256 4.808 8.707 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.409 2.592 8.764 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.918 3.382 9.174 1.00 0.00 H new ATOM 0 HD2 LYS A 59 5.209 2.863 11.316 1.00 0.00 H new ATOM 0 HD3 LYS A 59 4.435 4.427 11.159 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.520 2.797 10.024 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.215 1.704 11.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 1.407 2.980 12.150 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 2.866 3.379 12.920 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 2.193 4.438 11.777 1.00 0.00 H new ATOM 925 N VAL A 60 3.242 5.382 5.344 1.00 0.00 N ATOM 926 CA VAL A 60 2.473 6.276 4.495 1.00 0.00 C ATOM 927 C VAL A 60 1.064 5.711 4.311 1.00 0.00 C ATOM 928 O VAL A 60 0.825 4.532 4.569 1.00 0.00 O ATOM 929 CB VAL A 60 3.206 6.500 3.171 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.530 7.234 3.394 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.430 5.176 2.438 1.00 0.00 C ATOM 0 H VAL A 60 3.155 4.393 5.111 1.00 0.00 H new ATOM 0 HA VAL A 60 2.371 7.255 4.964 1.00 0.00 H new ATOM 0 HB VAL A 60 2.576 7.129 2.542 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.031 7.380 2.437 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.336 8.203 3.854 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.168 6.642 4.050 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.953 5.363 1.500 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.029 4.512 3.061 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.468 4.708 2.230 1.00 0.00 H new ATOM 941 N LYS A 61 0.167 6.578 3.864 1.00 0.00 N ATOM 942 CA LYS A 61 -1.213 6.180 3.642 1.00 0.00 C ATOM 943 C LYS A 61 -1.801 7.011 2.500 1.00 0.00 C ATOM 944 O LYS A 61 -1.224 8.022 2.102 1.00 0.00 O ATOM 945 CB LYS A 61 -2.013 6.269 4.943 1.00 0.00 C ATOM 946 CG LYS A 61 -2.293 7.726 5.316 1.00 0.00 C ATOM 947 CD LYS A 61 -2.609 7.860 6.807 1.00 0.00 C ATOM 948 CE LYS A 61 -1.327 7.861 7.641 1.00 0.00 C ATOM 949 NZ LYS A 61 -1.556 8.528 8.943 1.00 0.00 N ATOM 0 H LYS A 61 0.369 7.555 3.650 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.263 5.135 3.336 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -2.954 5.731 4.833 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.461 5.784 5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.428 8.341 5.067 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -3.131 8.101 4.728 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.163 8.782 6.984 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.251 7.037 7.122 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -0.992 6.837 7.804 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.533 8.374 7.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.676 8.520 9.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -1.855 9.511 8.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -2.299 8.022 9.466 1.00 0.00 H new ATOM 963 N THR A 62 -2.943 6.555 2.006 1.00 0.00 N ATOM 964 CA THR A 62 -3.616 7.244 0.918 1.00 0.00 C ATOM 965 C THR A 62 -4.883 7.935 1.426 1.00 0.00 C ATOM 966 O THR A 62 -5.587 7.397 2.279 1.00 0.00 O ATOM 967 CB THR A 62 -3.883 6.227 -0.193 1.00 0.00 C ATOM 968 OG1 THR A 62 -5.067 6.705 -0.825 1.00 0.00 O ATOM 969 CG2 THR A 62 -4.280 4.854 0.353 1.00 0.00 C ATOM 0 H THR A 62 -3.419 5.717 2.339 1.00 0.00 H new ATOM 0 HA THR A 62 -2.992 8.039 0.508 1.00 0.00 H new ATOM 0 HB THR A 62 -2.993 6.127 -0.814 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.831 6.161 -0.542 1.00 0.00 H new ATOM 0 HG21 THR A 62 -4.458 4.170 -0.477 1.00 0.00 H new ATOM 0 HG22 THR A 62 -3.476 4.465 0.978 1.00 0.00 H new ATOM 0 HG23 THR A 62 -5.189 4.948 0.947 1.00 0.00 H new ATOM 977 N ARG A 63 -5.133 9.116 0.882 1.00 0.00 N ATOM 978 CA ARG A 63 -6.303 9.886 1.270 1.00 0.00 C ATOM 979 C ARG A 63 -7.514 8.965 1.435 1.00 0.00 C ATOM 980 O ARG A 63 -8.095 8.515 0.449 1.00 0.00 O ATOM 981 CB ARG A 63 -6.626 10.959 0.228 1.00 0.00 C ATOM 982 CG ARG A 63 -6.347 10.451 -1.188 1.00 0.00 C ATOM 983 CD ARG A 63 -7.546 10.699 -2.105 1.00 0.00 C ATOM 984 NE ARG A 63 -7.388 11.992 -2.808 1.00 0.00 N ATOM 985 CZ ARG A 63 -6.660 12.158 -3.920 1.00 0.00 C ATOM 986 NH1 ARG A 63 -6.019 11.114 -4.464 1.00 0.00 N ATOM 987 NH2 ARG A 63 -6.573 13.368 -4.489 1.00 0.00 N ATOM 0 H ARG A 63 -4.546 9.559 0.176 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.080 10.372 2.220 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.673 11.251 0.314 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.030 11.851 0.422 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.467 10.952 -1.591 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.122 9.385 -1.158 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.633 9.890 -2.830 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.466 10.704 -1.521 1.00 0.00 H new ATOM 0 HE ARG A 63 -7.863 12.808 -2.421 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.086 10.193 -4.031 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.465 11.241 -5.311 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -7.061 14.162 -4.075 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.019 13.495 -5.336 1.00 0.00 H new ATOM 1001 N VAL A 64 -7.857 8.712 2.690 1.00 0.00 N ATOM 1002 CA VAL A 64 -8.988 7.853 2.997 1.00 0.00 C ATOM 1003 C VAL A 64 -10.250 8.429 2.354 1.00 0.00 C ATOM 1004 O VAL A 64 -10.841 9.373 2.876 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.115 7.677 4.512 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.876 9.002 5.239 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.476 7.085 4.883 1.00 0.00 C ATOM 0 H VAL A 64 -7.372 9.087 3.505 1.00 0.00 H new ATOM 0 HA VAL A 64 -8.836 6.858 2.579 1.00 0.00 H new ATOM 0 HB VAL A 64 -8.346 6.975 4.834 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.972 8.850 6.314 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.874 9.366 5.012 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -9.612 9.736 4.909 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -10.540 6.970 5.965 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -11.268 7.751 4.541 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -10.591 6.111 4.407 1.00 0.00 H new ATOM 1017 N LEU A 65 -10.627 7.837 1.230 1.00 0.00 N ATOM 1018 CA LEU A 65 -11.809 8.280 0.511 1.00 0.00 C ATOM 1019 C LEU A 65 -13.006 8.294 1.464 1.00 0.00 C ATOM 1020 O LEU A 65 -13.072 7.493 2.395 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.028 7.424 -0.739 1.00 0.00 C ATOM 1022 CG LEU A 65 -10.954 7.534 -1.824 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -10.596 6.156 -2.382 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -11.386 8.505 -2.925 1.00 0.00 C ATOM 0 H LEU A 65 -10.134 7.054 0.800 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.676 9.300 0.152 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.101 6.381 -0.432 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -12.988 7.695 -1.177 1.00 0.00 H new ATOM 0 HG LEU A 65 -10.050 7.942 -1.371 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -9.831 6.262 -3.151 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -10.217 5.525 -1.578 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.485 5.697 -2.815 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -10.606 8.565 -3.684 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -12.310 8.149 -3.382 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -11.551 9.493 -2.495 1.00 0.00 H new ATOM 1036 N ARG A 66 -13.923 9.212 1.198 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.114 9.341 2.020 1.00 0.00 C ATOM 1038 C ARG A 66 -16.312 8.693 1.324 1.00 0.00 C ATOM 1039 O ARG A 66 -16.494 8.851 0.118 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.431 10.811 2.304 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.274 11.490 3.039 1.00 0.00 C ATOM 1042 CD ARG A 66 -13.720 10.586 4.142 1.00 0.00 C ATOM 1043 NE ARG A 66 -12.998 11.398 5.147 1.00 0.00 N ATOM 1044 CZ ARG A 66 -11.788 11.938 4.948 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -11.156 11.755 3.781 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -11.209 12.660 5.917 1.00 0.00 N ATOM 0 H ARG A 66 -13.865 9.874 0.424 1.00 0.00 H new ATOM 0 HA ARG A 66 -14.921 8.834 2.965 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -15.627 11.332 1.367 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.339 10.882 2.903 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.482 11.734 2.331 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -14.615 12.431 3.472 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -14.534 10.041 4.620 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.048 9.843 3.712 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.450 11.556 6.048 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -11.596 11.204 3.044 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -10.235 12.166 3.630 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.689 12.798 6.806 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.288 13.071 5.766 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.098 7.976 2.114 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.274 7.303 1.589 1.00 0.00 C ATOM 1062 C LYS A 67 -17.918 6.622 0.266 1.00 0.00 C ATOM 1063 O LYS A 67 -17.994 7.241 -0.795 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.447 8.279 1.482 1.00 0.00 C ATOM 1065 CG LYS A 67 -19.806 8.857 2.853 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.225 9.431 2.852 1.00 0.00 C ATOM 1067 CE LYS A 67 -21.249 10.832 2.239 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.344 11.636 2.826 1.00 0.00 N ATOM 0 H LYS A 67 -16.943 7.847 3.114 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.602 6.520 2.273 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.190 9.088 0.798 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.313 7.768 1.061 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -19.725 8.079 3.612 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.094 9.638 3.120 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -21.887 8.773 2.290 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -21.606 9.470 3.872 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -20.293 11.327 2.412 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -21.381 10.761 1.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.346 12.584 2.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -23.255 11.170 2.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -22.202 11.719 3.853 1.00 0.00 H new ATOM 1082 N THR A 68 -17.537 5.358 0.371 1.00 0.00 N ATOM 1083 CA THR A 68 -17.169 4.587 -0.804 1.00 0.00 C ATOM 1084 C THR A 68 -16.813 3.152 -0.410 1.00 0.00 C ATOM 1085 O THR A 68 -15.805 2.918 0.255 1.00 0.00 O ATOM 1086 CB THR A 68 -16.031 5.322 -1.514 1.00 0.00 C ATOM 1087 OG1 THR A 68 -15.641 4.432 -2.558 1.00 0.00 O ATOM 1088 CG2 THR A 68 -14.779 5.445 -0.643 1.00 0.00 C ATOM 0 H THR A 68 -17.475 4.848 1.252 1.00 0.00 H new ATOM 0 HA THR A 68 -18.004 4.502 -1.499 1.00 0.00 H new ATOM 0 HB THR A 68 -16.368 6.316 -1.807 1.00 0.00 H new ATOM 0 HG1 THR A 68 -14.907 4.831 -3.071 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.002 5.975 -1.195 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.020 5.998 0.265 1.00 0.00 H new ATOM 0 HG23 THR A 68 -14.421 4.450 -0.378 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.661 2.227 -0.837 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.449 0.822 -0.537 1.00 0.00 C ATOM 1098 C LEU A 69 -16.321 0.281 -1.419 1.00 0.00 C ATOM 1099 O LEU A 69 -15.742 -0.762 -1.121 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.759 0.042 -0.667 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.757 0.210 0.481 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.724 -0.973 0.544 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -19.031 0.429 1.810 1.00 0.00 C ATOM 0 H LEU A 69 -18.496 2.424 -1.388 1.00 0.00 H new ATOM 0 HA LEU A 69 -17.133 0.698 0.499 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -19.248 0.343 -1.594 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.520 -1.017 -0.762 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.353 1.102 0.289 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.422 -0.829 1.368 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -21.277 -1.041 -0.393 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -20.163 -1.894 0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.763 0.546 2.609 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.395 -0.430 2.023 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.418 1.328 1.746 1.00 0.00 H new ATOM 1115 N ASP A 70 -16.045 1.015 -2.486 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.997 0.622 -3.413 1.00 0.00 C ATOM 1117 C ASP A 70 -14.094 1.825 -3.695 1.00 0.00 C ATOM 1118 O ASP A 70 -14.168 2.424 -4.767 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.587 0.153 -4.744 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.466 1.180 -5.461 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -17.551 1.476 -4.917 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -16.032 1.646 -6.537 1.00 0.00 O ATOM 0 H ASP A 70 -16.528 1.879 -2.730 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.435 -0.194 -2.960 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.769 -0.129 -5.407 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -16.177 -0.746 -4.566 1.00 0.00 H new ATOM 1127 N PRO A 71 -13.240 2.151 -2.688 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.324 3.271 -2.816 1.00 0.00 C ATOM 1129 C PRO A 71 -11.156 2.921 -3.740 1.00 0.00 C ATOM 1130 O PRO A 71 -10.633 1.809 -3.690 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.885 3.585 -1.396 1.00 0.00 C ATOM 1132 CG PRO A 71 -12.203 2.345 -0.577 1.00 0.00 C ATOM 1133 CD PRO A 71 -13.125 1.464 -1.404 1.00 0.00 C ATOM 0 HA PRO A 71 -12.788 4.143 -3.277 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.820 3.815 -1.358 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.413 4.456 -1.007 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -11.288 1.809 -0.325 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.680 2.621 0.363 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.712 0.463 -1.526 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -14.098 1.351 -0.927 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.780 3.891 -4.561 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.683 3.698 -5.494 1.00 0.00 C ATOM 1143 C ALA A 72 -8.592 4.733 -5.212 1.00 0.00 C ATOM 1144 O ALA A 72 -8.689 5.878 -5.651 1.00 0.00 O ATOM 1145 CB ALA A 72 -10.211 3.784 -6.927 1.00 0.00 C ATOM 0 H ALA A 72 -11.216 4.813 -4.599 1.00 0.00 H new ATOM 0 HA ALA A 72 -9.241 2.710 -5.368 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.388 3.639 -7.627 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.962 3.010 -7.085 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.659 4.764 -7.091 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.579 4.293 -4.480 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.470 5.166 -4.134 1.00 0.00 C ATOM 1153 C PHE A 73 -5.482 5.285 -5.297 1.00 0.00 C ATOM 1154 O PHE A 73 -5.068 6.387 -5.654 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.758 4.532 -2.938 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.704 3.924 -1.901 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.363 4.730 -1.026 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.887 2.577 -1.855 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.241 4.165 -0.063 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.765 2.012 -0.893 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.424 2.818 -0.017 1.00 0.00 C ATOM 0 H PHE A 73 -7.503 3.343 -4.117 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.841 6.165 -3.904 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -5.084 3.755 -3.299 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -5.141 5.288 -2.453 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.219 5.800 -1.063 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -6.364 1.937 -2.550 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.763 4.805 0.633 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.910 0.942 -0.857 1.00 0.00 H new ATOM 0 HZ PHE A 73 -9.092 2.388 0.715 1.00 0.00 H new ATOM 1171 N ASP A 74 -5.133 4.135 -5.855 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.202 4.097 -6.969 1.00 0.00 C ATOM 1173 C ASP A 74 -3.073 5.099 -6.720 1.00 0.00 C ATOM 1174 O ASP A 74 -2.637 5.790 -7.639 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.894 4.480 -8.279 1.00 0.00 C ATOM 1176 CG ASP A 74 -4.488 3.644 -9.494 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -4.879 2.457 -9.522 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -3.795 4.210 -10.367 1.00 0.00 O ATOM 0 H ASP A 74 -5.478 3.223 -5.556 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.815 3.081 -7.049 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.972 4.394 -8.142 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -4.682 5.528 -8.491 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.632 5.146 -5.471 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.562 6.052 -5.089 1.00 0.00 C ATOM 1185 C GLU A 75 -0.203 5.366 -5.248 1.00 0.00 C ATOM 1186 O GLU A 75 -0.136 4.160 -5.481 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.756 6.557 -3.659 1.00 0.00 C ATOM 1188 CG GLU A 75 -2.023 8.064 -3.641 1.00 0.00 C ATOM 1189 CD GLU A 75 -0.720 8.853 -3.782 1.00 0.00 C ATOM 1190 OE1 GLU A 75 -0.297 9.048 -4.942 1.00 0.00 O ATOM 1191 OE2 GLU A 75 -0.176 9.244 -2.726 1.00 0.00 O ATOM 0 H GLU A 75 -2.996 4.571 -4.711 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.591 6.917 -5.752 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.589 6.031 -3.194 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -0.868 6.334 -3.067 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -2.701 8.327 -4.453 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -2.519 8.338 -2.710 1.00 0.00 H new ATOM 1198 N THR A 76 0.846 6.164 -5.117 1.00 0.00 N ATOM 1199 CA THR A 76 2.199 5.649 -5.244 1.00 0.00 C ATOM 1200 C THR A 76 3.155 6.439 -4.348 1.00 0.00 C ATOM 1201 O THR A 76 3.219 7.665 -4.430 1.00 0.00 O ATOM 1202 CB THR A 76 2.582 5.686 -6.724 1.00 0.00 C ATOM 1203 OG1 THR A 76 1.907 4.565 -7.286 1.00 0.00 O ATOM 1204 CG2 THR A 76 4.064 5.382 -6.953 1.00 0.00 C ATOM 0 H THR A 76 0.787 7.164 -4.924 1.00 0.00 H new ATOM 0 HA THR A 76 2.263 4.616 -4.904 1.00 0.00 H new ATOM 0 HB THR A 76 2.345 6.667 -7.135 1.00 0.00 H new ATOM 0 HG1 THR A 76 2.099 4.515 -8.246 1.00 0.00 H new ATOM 0 HG21 THR A 76 4.283 5.421 -8.020 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.672 6.121 -6.431 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.295 4.387 -6.572 1.00 0.00 H new ATOM 1212 N PHE A 77 3.876 5.704 -3.514 1.00 0.00 N ATOM 1213 CA PHE A 77 4.827 6.320 -2.604 1.00 0.00 C ATOM 1214 C PHE A 77 6.260 5.909 -2.948 1.00 0.00 C ATOM 1215 O PHE A 77 6.594 4.725 -2.919 1.00 0.00 O ATOM 1216 CB PHE A 77 4.489 5.820 -1.198 1.00 0.00 C ATOM 1217 CG PHE A 77 3.039 6.073 -0.780 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.646 7.320 -0.406 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.142 5.050 -0.783 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.300 7.554 -0.018 1.00 0.00 C ATOM 1221 CE2 PHE A 77 0.797 5.284 -0.395 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.404 6.531 -0.021 1.00 0.00 C ATOM 0 H PHE A 77 3.821 4.688 -3.449 1.00 0.00 H new ATOM 0 HA PHE A 77 4.762 7.406 -2.676 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.690 4.750 -1.146 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.153 6.304 -0.482 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.358 8.132 -0.404 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.454 4.060 -1.081 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.988 8.544 0.279 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.085 4.472 -0.397 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.620 6.709 0.274 1.00 0.00 H new ATOM 1232 N THR A 78 7.069 6.909 -3.265 1.00 0.00 N ATOM 1233 CA THR A 78 8.458 6.666 -3.613 1.00 0.00 C ATOM 1234 C THR A 78 9.339 6.719 -2.363 1.00 0.00 C ATOM 1235 O THR A 78 8.977 7.349 -1.370 1.00 0.00 O ATOM 1236 CB THR A 78 8.862 7.682 -4.684 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.457 7.076 -5.908 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.380 7.819 -4.819 1.00 0.00 C ATOM 0 H THR A 78 6.789 7.889 -3.288 1.00 0.00 H new ATOM 0 HA THR A 78 8.593 5.666 -4.025 1.00 0.00 H new ATOM 0 HB THR A 78 8.431 8.654 -4.443 1.00 0.00 H new ATOM 0 HG1 THR A 78 8.680 7.669 -6.656 1.00 0.00 H new ATOM 0 HG21 THR A 78 10.612 8.552 -5.592 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.802 8.148 -3.869 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.809 6.855 -5.092 1.00 0.00 H new ATOM 1246 N PHE A 79 10.479 6.049 -2.452 1.00 0.00 N ATOM 1247 CA PHE A 79 11.414 6.012 -1.341 1.00 0.00 C ATOM 1248 C PHE A 79 12.847 5.811 -1.837 1.00 0.00 C ATOM 1249 O PHE A 79 13.118 4.890 -2.606 1.00 0.00 O ATOM 1250 CB PHE A 79 11.018 4.822 -0.464 1.00 0.00 C ATOM 1251 CG PHE A 79 9.540 4.803 -0.071 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.033 5.789 0.716 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.733 3.799 -0.508 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.661 5.771 1.081 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.361 3.781 -0.143 1.00 0.00 C ATOM 1256 CZ PHE A 79 6.854 4.768 0.644 1.00 0.00 C ATOM 0 H PHE A 79 10.776 5.527 -3.277 1.00 0.00 H new ATOM 0 HA PHE A 79 11.377 6.953 -0.792 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.254 3.899 -0.994 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.624 4.834 0.442 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.674 6.586 1.063 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.136 3.015 -1.133 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.258 6.554 1.706 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.720 2.984 -0.490 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.810 4.755 0.922 1.00 0.00 H new ATOM 1266 N TYR A 80 13.727 6.687 -1.376 1.00 0.00 N ATOM 1267 CA TYR A 80 15.126 6.618 -1.763 1.00 0.00 C ATOM 1268 C TYR A 80 15.992 6.124 -0.602 1.00 0.00 C ATOM 1269 O TYR A 80 15.573 6.170 0.554 1.00 0.00 O ATOM 1270 CB TYR A 80 15.537 8.048 -2.118 1.00 0.00 C ATOM 1271 CG TYR A 80 14.639 8.711 -3.165 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.792 8.401 -4.501 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.678 9.620 -2.773 1.00 0.00 C ATOM 1274 CE1 TYR A 80 13.947 9.025 -5.486 1.00 0.00 C ATOM 1275 CE2 TYR A 80 12.833 10.245 -3.758 1.00 0.00 C ATOM 1276 CZ TYR A 80 13.009 9.916 -5.066 1.00 0.00 C ATOM 1277 OH TYR A 80 12.212 10.506 -5.996 1.00 0.00 O ATOM 0 H TYR A 80 13.498 7.449 -0.738 1.00 0.00 H new ATOM 0 HA TYR A 80 15.260 5.926 -2.595 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.529 8.653 -1.212 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.563 8.040 -2.487 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.545 7.691 -4.808 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.559 9.863 -1.727 1.00 0.00 H new ATOM 0 HE1 TYR A 80 14.056 8.791 -6.535 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.077 10.958 -3.465 1.00 0.00 H new ATOM 0 HH TYR A 80 11.589 11.118 -5.552 1.00 0.00 H new ATOM 1287 N GLY A 81 17.185 5.664 -0.949 1.00 0.00 N ATOM 1288 CA GLY A 81 18.114 5.163 0.049 1.00 0.00 C ATOM 1289 C GLY A 81 17.965 3.650 0.226 1.00 0.00 C ATOM 1290 O GLY A 81 18.954 2.943 0.410 1.00 0.00 O ATOM 0 H GLY A 81 17.530 5.628 -1.908 1.00 0.00 H new ATOM 0 HA2 GLY A 81 19.136 5.399 -0.249 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.936 5.663 1.001 1.00 0.00 H new ATOM 1294 N ILE A 82 16.720 3.199 0.165 1.00 0.00 N ATOM 1295 CA ILE A 82 16.429 1.784 0.316 1.00 0.00 C ATOM 1296 C ILE A 82 17.113 1.004 -0.809 1.00 0.00 C ATOM 1297 O ILE A 82 16.767 1.164 -1.979 1.00 0.00 O ATOM 1298 CB ILE A 82 14.919 1.553 0.395 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.340 2.147 1.680 1.00 0.00 C ATOM 1300 CG2 ILE A 82 14.583 0.067 0.247 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.248 3.172 1.367 1.00 0.00 C ATOM 0 H ILE A 82 15.902 3.789 0.013 1.00 0.00 H new ATOM 0 HA ILE A 82 16.835 1.410 1.256 1.00 0.00 H new ATOM 0 HB ILE A 82 14.450 2.074 -0.440 1.00 0.00 H new ATOM 0 HG12 ILE A 82 13.929 1.350 2.300 1.00 0.00 H new ATOM 0 HG13 ILE A 82 15.135 2.621 2.256 1.00 0.00 H new ATOM 0 HG21 ILE A 82 13.503 -0.070 0.307 1.00 0.00 H new ATOM 0 HG22 ILE A 82 14.941 -0.293 -0.717 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.065 -0.496 1.046 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.853 3.579 2.298 1.00 0.00 H new ATOM 0 HD12 ILE A 82 13.668 3.980 0.767 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.444 2.689 0.812 1.00 0.00 H new ATOM 1313 N PRO A 83 18.095 0.155 -0.405 1.00 0.00 N ATOM 1314 CA PRO A 83 18.830 -0.650 -1.366 1.00 0.00 C ATOM 1315 C PRO A 83 17.979 -1.819 -1.867 1.00 0.00 C ATOM 1316 O PRO A 83 17.309 -2.486 -1.080 1.00 0.00 O ATOM 1317 CB PRO A 83 20.080 -1.100 -0.627 1.00 0.00 C ATOM 1318 CG PRO A 83 19.778 -0.921 0.851 1.00 0.00 C ATOM 1319 CD PRO A 83 18.531 -0.060 0.972 1.00 0.00 C ATOM 0 HA PRO A 83 19.093 -0.095 -2.266 1.00 0.00 H new ATOM 0 HB2 PRO A 83 20.315 -2.140 -0.854 1.00 0.00 H new ATOM 0 HB3 PRO A 83 20.944 -0.506 -0.924 1.00 0.00 H new ATOM 0 HG2 PRO A 83 19.622 -1.888 1.328 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.619 -0.448 1.358 1.00 0.00 H new ATOM 0 HD2 PRO A 83 17.760 -0.560 1.558 1.00 0.00 H new ATOM 0 HD3 PRO A 83 18.749 0.884 1.471 1.00 0.00 H new ATOM 1327 N TYR A 84 18.033 -2.031 -3.174 1.00 0.00 N ATOM 1328 CA TYR A 84 17.275 -3.107 -3.789 1.00 0.00 C ATOM 1329 C TYR A 84 17.487 -4.424 -3.041 1.00 0.00 C ATOM 1330 O TYR A 84 16.631 -5.307 -3.075 1.00 0.00 O ATOM 1331 CB TYR A 84 17.822 -3.248 -5.211 1.00 0.00 C ATOM 1332 CG TYR A 84 17.321 -4.490 -5.950 1.00 0.00 C ATOM 1333 CD1 TYR A 84 15.965 -4.713 -6.086 1.00 0.00 C ATOM 1334 CD2 TYR A 84 18.224 -5.389 -6.481 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.494 -5.882 -6.781 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.752 -6.558 -7.177 1.00 0.00 C ATOM 1337 CZ TYR A 84 16.410 -6.747 -7.292 1.00 0.00 C ATOM 1338 OH TYR A 84 15.965 -7.852 -7.949 1.00 0.00 O ATOM 0 H TYR A 84 18.590 -1.476 -3.824 1.00 0.00 H new ATOM 0 HA TYR A 84 16.208 -2.884 -3.771 1.00 0.00 H new ATOM 0 HB2 TYR A 84 17.549 -2.362 -5.784 1.00 0.00 H new ATOM 0 HB3 TYR A 84 18.911 -3.277 -5.169 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.258 -4.010 -5.671 1.00 0.00 H new ATOM 0 HD2 TYR A 84 19.285 -5.216 -6.374 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.436 -6.068 -6.894 1.00 0.00 H new ATOM 0 HE2 TYR A 84 18.448 -7.269 -7.598 1.00 0.00 H new ATOM 0 HH TYR A 84 16.731 -8.378 -8.261 1.00 0.00 H new ATOM 1348 N THR A 85 18.633 -4.516 -2.382 1.00 0.00 N ATOM 1349 CA THR A 85 18.969 -5.711 -1.627 1.00 0.00 C ATOM 1350 C THR A 85 18.157 -5.768 -0.331 1.00 0.00 C ATOM 1351 O THR A 85 17.985 -6.838 0.251 1.00 0.00 O ATOM 1352 CB THR A 85 20.481 -5.716 -1.397 1.00 0.00 C ATOM 1353 OG1 THR A 85 20.740 -4.469 -0.758 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.272 -5.635 -2.705 1.00 0.00 C ATOM 0 H THR A 85 19.341 -3.782 -2.355 1.00 0.00 H new ATOM 0 HA THR A 85 18.707 -6.614 -2.178 1.00 0.00 H new ATOM 0 HB THR A 85 20.763 -6.620 -0.857 1.00 0.00 H new ATOM 0 HG1 THR A 85 21.699 -4.390 -0.571 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.340 -5.642 -2.486 1.00 0.00 H new ATOM 0 HG22 THR A 85 21.025 -6.491 -3.333 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.015 -4.714 -3.229 1.00 0.00 H new ATOM 1362 N GLN A 86 17.681 -4.603 0.083 1.00 0.00 N ATOM 1363 CA GLN A 86 16.892 -4.507 1.299 1.00 0.00 C ATOM 1364 C GLN A 86 15.415 -4.766 0.996 1.00 0.00 C ATOM 1365 O GLN A 86 14.608 -4.927 1.911 1.00 0.00 O ATOM 1366 CB GLN A 86 17.083 -3.145 1.970 1.00 0.00 C ATOM 1367 CG GLN A 86 17.636 -3.305 3.388 1.00 0.00 C ATOM 1368 CD GLN A 86 19.065 -2.766 3.483 1.00 0.00 C ATOM 1369 OE1 GLN A 86 20.037 -3.465 3.248 1.00 0.00 O ATOM 1370 NE2 GLN A 86 19.138 -1.487 3.839 1.00 0.00 N ATOM 0 H GLN A 86 17.827 -3.718 -0.402 1.00 0.00 H new ATOM 0 HA GLN A 86 17.239 -5.271 1.995 1.00 0.00 H new ATOM 0 HB2 GLN A 86 17.765 -2.536 1.377 1.00 0.00 H new ATOM 0 HB3 GLN A 86 16.131 -2.616 2.005 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.996 -2.775 4.094 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.621 -4.357 3.672 1.00 0.00 H new ATOM 0 HE21 GLN A 86 18.285 -0.959 4.021 1.00 0.00 H new ATOM 0 HE22 GLN A 86 20.047 -1.034 3.930 1.00 0.00 H new ATOM 1379 N ILE A 87 15.105 -4.799 -0.292 1.00 0.00 N ATOM 1380 CA ILE A 87 13.739 -5.036 -0.728 1.00 0.00 C ATOM 1381 C ILE A 87 13.280 -6.407 -0.228 1.00 0.00 C ATOM 1382 O ILE A 87 12.325 -6.504 0.542 1.00 0.00 O ATOM 1383 CB ILE A 87 13.623 -4.864 -2.243 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.164 -3.502 -2.683 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.183 -5.087 -2.711 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.147 -2.393 -2.409 1.00 0.00 C ATOM 0 H ILE A 87 15.777 -4.666 -1.048 1.00 0.00 H new ATOM 0 HA ILE A 87 13.067 -4.296 -0.294 1.00 0.00 H new ATOM 0 HB ILE A 87 14.239 -5.625 -2.722 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.093 -3.287 -2.154 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.402 -3.528 -3.746 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.128 -4.959 -3.792 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.867 -6.097 -2.449 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.527 -4.364 -2.226 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.557 -1.436 -2.731 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.228 -2.598 -2.959 1.00 0.00 H new ATOM 0 HD13 ILE A 87 12.930 -2.354 -1.342 1.00 0.00 H new ATOM 1398 N GLN A 88 13.981 -7.434 -0.685 1.00 0.00 N ATOM 1399 CA GLN A 88 13.658 -8.796 -0.294 1.00 0.00 C ATOM 1400 C GLN A 88 13.494 -8.887 1.224 1.00 0.00 C ATOM 1401 O GLN A 88 12.683 -9.668 1.719 1.00 0.00 O ATOM 1402 CB GLN A 88 14.721 -9.777 -0.791 1.00 0.00 C ATOM 1403 CG GLN A 88 14.805 -9.767 -2.319 1.00 0.00 C ATOM 1404 CD GLN A 88 16.213 -10.129 -2.793 1.00 0.00 C ATOM 1405 OE1 GLN A 88 16.781 -11.142 -2.418 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.743 -9.248 -3.637 1.00 0.00 N ATOM 0 H GLN A 88 14.772 -7.350 -1.323 1.00 0.00 H new ATOM 0 HA GLN A 88 12.712 -9.072 -0.759 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.690 -9.513 -0.368 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.484 -10.782 -0.443 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.086 -10.475 -2.731 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.533 -8.781 -2.695 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.213 -8.420 -3.910 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.680 -9.400 -4.011 1.00 0.00 H new ATOM 1415 N GLU A 89 14.279 -8.078 1.922 1.00 0.00 N ATOM 1416 CA GLU A 89 14.231 -8.058 3.374 1.00 0.00 C ATOM 1417 C GLU A 89 13.064 -7.193 3.855 1.00 0.00 C ATOM 1418 O GLU A 89 12.557 -7.387 4.958 1.00 0.00 O ATOM 1419 CB GLU A 89 15.556 -7.565 3.959 1.00 0.00 C ATOM 1420 CG GLU A 89 16.558 -8.714 4.092 1.00 0.00 C ATOM 1421 CD GLU A 89 16.302 -9.519 5.368 1.00 0.00 C ATOM 1422 OE1 GLU A 89 16.813 -9.086 6.424 1.00 0.00 O ATOM 1423 OE2 GLU A 89 15.601 -10.549 5.259 1.00 0.00 O ATOM 0 H GLU A 89 14.951 -7.432 1.508 1.00 0.00 H new ATOM 0 HA GLU A 89 14.072 -9.077 3.727 1.00 0.00 H new ATOM 0 HB2 GLU A 89 15.973 -6.787 3.320 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.381 -7.115 4.936 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.484 -9.369 3.224 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.573 -8.317 4.106 1.00 0.00 H new ATOM 1430 N LEU A 90 12.673 -6.256 3.003 1.00 0.00 N ATOM 1431 CA LEU A 90 11.576 -5.361 3.327 1.00 0.00 C ATOM 1432 C LEU A 90 10.270 -6.157 3.374 1.00 0.00 C ATOM 1433 O LEU A 90 10.287 -7.386 3.327 1.00 0.00 O ATOM 1434 CB LEU A 90 11.542 -4.181 2.354 1.00 0.00 C ATOM 1435 CG LEU A 90 12.337 -2.942 2.774 1.00 0.00 C ATOM 1436 CD1 LEU A 90 13.302 -3.271 3.915 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.057 -2.321 1.575 1.00 0.00 C ATOM 0 H LEU A 90 13.097 -6.098 2.089 1.00 0.00 H new ATOM 0 HA LEU A 90 11.720 -4.925 4.316 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.919 -4.520 1.389 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.503 -3.888 2.205 1.00 0.00 H new ATOM 0 HG LEU A 90 11.636 -2.197 3.150 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.854 -2.374 4.194 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.739 -3.633 4.775 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.001 -4.041 3.589 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.614 -1.443 1.900 1.00 0.00 H new ATOM 0 HD22 LEU A 90 13.745 -3.050 1.147 1.00 0.00 H new ATOM 0 HD23 LEU A 90 12.325 -2.028 0.823 1.00 0.00 H new ATOM 1449 N ALA A 91 9.170 -5.425 3.465 1.00 0.00 N ATOM 1450 CA ALA A 91 7.859 -6.047 3.519 1.00 0.00 C ATOM 1451 C ALA A 91 6.796 -4.969 3.740 1.00 0.00 C ATOM 1452 O ALA A 91 6.856 -4.224 4.716 1.00 0.00 O ATOM 1453 CB ALA A 91 7.844 -7.114 4.615 1.00 0.00 C ATOM 0 H ALA A 91 9.160 -4.406 3.503 1.00 0.00 H new ATOM 0 HA ALA A 91 7.632 -6.545 2.576 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.860 -7.581 4.655 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.596 -7.872 4.395 1.00 0.00 H new ATOM 0 HB3 ALA A 91 8.066 -6.651 5.577 1.00 0.00 H new ATOM 1459 N LEU A 92 5.847 -4.921 2.817 1.00 0.00 N ATOM 1460 CA LEU A 92 4.772 -3.947 2.898 1.00 0.00 C ATOM 1461 C LEU A 92 3.635 -4.518 3.747 1.00 0.00 C ATOM 1462 O LEU A 92 3.369 -5.719 3.709 1.00 0.00 O ATOM 1463 CB LEU A 92 4.335 -3.512 1.498 1.00 0.00 C ATOM 1464 CG LEU A 92 5.462 -3.228 0.502 1.00 0.00 C ATOM 1465 CD1 LEU A 92 4.928 -3.186 -0.931 1.00 0.00 C ATOM 1466 CD2 LEU A 92 6.212 -1.948 0.872 1.00 0.00 C ATOM 0 H LEU A 92 5.800 -5.541 2.009 1.00 0.00 H new ATOM 0 HA LEU A 92 5.117 -3.040 3.395 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.695 -4.290 1.081 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.725 -2.614 1.592 1.00 0.00 H new ATOM 0 HG LEU A 92 6.179 -4.047 0.555 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.748 -2.983 -1.619 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.476 -4.146 -1.179 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.179 -2.399 -1.017 1.00 0.00 H new ATOM 0 HD21 LEU A 92 7.007 -1.770 0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.520 -1.106 0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.644 -2.054 1.867 1.00 0.00 H new ATOM 1478 N HIS A 93 2.993 -3.632 4.494 1.00 0.00 N ATOM 1479 CA HIS A 93 1.890 -4.033 5.351 1.00 0.00 C ATOM 1480 C HIS A 93 0.663 -3.172 5.045 1.00 0.00 C ATOM 1481 O HIS A 93 0.599 -2.011 5.446 1.00 0.00 O ATOM 1482 CB HIS A 93 2.300 -3.979 6.824 1.00 0.00 C ATOM 1483 CG HIS A 93 1.232 -4.463 7.777 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.671 -5.696 7.935 1.00 0.00 N flip ATOM 1485 CD2 HIS A 93 0.624 -3.635 8.704 1.00 0.00 C flip ATOM 1486 CE1 HIS A 93 -0.230 -5.625 8.906 1.00 0.00 C flip ATOM 1487 NE2 HIS A 93 -0.261 -4.348 9.384 1.00 0.00 N flip ATOM 0 H HIS A 93 3.216 -2.637 4.524 1.00 0.00 H new ATOM 0 HA HIS A 93 1.623 -5.070 5.146 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.197 -4.582 6.963 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.563 -2.953 7.080 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.835 -2.586 8.848 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.839 -6.444 9.260 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.860 -4.003 10.134 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.281 -3.775 4.338 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.503 -3.078 3.973 1.00 0.00 C ATOM 1497 C PHE A 94 -2.615 -3.354 4.988 1.00 0.00 C ATOM 1498 O PHE A 94 -3.149 -4.461 5.043 1.00 0.00 O ATOM 1499 CB PHE A 94 -1.932 -3.613 2.606 1.00 0.00 C ATOM 1500 CG PHE A 94 -0.893 -3.407 1.502 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.361 -2.173 1.292 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.500 -4.457 0.732 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.604 -1.981 0.268 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.465 -4.265 -0.292 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.996 -3.031 -0.503 1.00 0.00 C ATOM 0 H PHE A 94 -0.225 -4.739 4.008 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.326 -2.003 3.951 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.146 -4.678 2.695 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.861 -3.125 2.312 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.672 -1.339 1.904 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -0.922 -5.437 0.899 1.00 0.00 H new ATOM 0 HE1 PHE A 94 1.027 -1.001 0.101 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.777 -5.099 -0.903 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.729 -2.885 -1.283 1.00 0.00 H new ATOM 1515 N THR A 95 -2.930 -2.329 5.765 1.00 0.00 N ATOM 1516 CA THR A 95 -3.969 -2.447 6.775 1.00 0.00 C ATOM 1517 C THR A 95 -5.270 -1.815 6.277 1.00 0.00 C ATOM 1518 O THR A 95 -5.392 -0.592 6.228 1.00 0.00 O ATOM 1519 CB THR A 95 -3.445 -1.820 8.068 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.312 -2.616 8.406 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.403 -2.016 9.244 1.00 0.00 C ATOM 0 H THR A 95 -2.485 -1.413 5.716 1.00 0.00 H new ATOM 0 HA THR A 95 -4.208 -3.491 6.977 1.00 0.00 H new ATOM 0 HB THR A 95 -3.276 -0.755 7.912 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.733 -2.117 9.019 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.983 -1.552 10.137 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.363 -1.554 9.012 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.547 -3.082 9.422 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.211 -2.678 5.920 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.499 -2.219 5.428 1.00 0.00 C ATOM 1531 C ILE A 96 -8.363 -1.776 6.611 1.00 0.00 C ATOM 1532 O ILE A 96 -9.196 -2.540 7.096 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.153 -3.294 4.557 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.261 -3.651 3.366 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.553 -2.864 4.116 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.108 -4.560 3.798 1.00 0.00 C ATOM 0 H ILE A 96 -6.107 -3.692 5.962 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.373 -1.350 4.782 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.267 -4.197 5.156 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -7.854 -4.149 2.599 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -6.863 -2.740 2.919 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -9.996 -3.645 3.498 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.177 -2.699 4.995 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.486 -1.941 3.540 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.489 -4.799 2.933 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.503 -4.049 4.547 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.510 -5.480 4.222 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.135 -0.544 7.040 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.883 0.010 8.156 1.00 0.00 C ATOM 1550 C LEU A 97 -9.689 1.218 7.676 1.00 0.00 C ATOM 1551 O LEU A 97 -9.496 1.692 6.557 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.947 0.320 9.327 1.00 0.00 C ATOM 1553 CG LEU A 97 -7.292 1.703 9.313 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -6.659 2.023 10.668 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.285 1.820 8.167 1.00 0.00 C ATOM 0 H LEU A 97 -7.443 0.087 6.635 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.599 -0.720 8.534 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -8.510 0.216 10.254 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -7.159 -0.433 9.346 1.00 0.00 H new ATOM 0 HG LEU A 97 -8.068 2.448 9.137 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -6.200 3.011 10.631 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -7.427 2.008 11.441 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.897 1.278 10.899 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.834 2.812 8.179 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.507 1.066 8.288 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.796 1.665 7.217 1.00 0.00 H new ATOM 1567 N SER A 98 -10.574 1.683 8.545 1.00 0.00 N ATOM 1568 CA SER A 98 -11.409 2.827 8.223 1.00 0.00 C ATOM 1569 C SER A 98 -11.291 3.887 9.321 1.00 0.00 C ATOM 1570 O SER A 98 -10.976 3.567 10.466 1.00 0.00 O ATOM 1571 CB SER A 98 -12.870 2.410 8.044 1.00 0.00 C ATOM 1572 OG SER A 98 -13.469 3.036 6.913 1.00 0.00 O ATOM 0 H SER A 98 -10.731 1.288 9.472 1.00 0.00 H new ATOM 0 HA SER A 98 -11.061 3.249 7.280 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.927 1.327 7.931 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.433 2.667 8.941 1.00 0.00 H new ATOM 0 HG SER A 98 -14.401 2.743 6.832 1.00 0.00 H new ATOM 1578 N PHE A 99 -11.549 5.127 8.932 1.00 0.00 N ATOM 1579 CA PHE A 99 -11.475 6.235 9.869 1.00 0.00 C ATOM 1580 C PHE A 99 -12.816 6.445 10.576 1.00 0.00 C ATOM 1581 O PHE A 99 -13.852 6.569 9.926 1.00 0.00 O ATOM 1582 CB PHE A 99 -11.140 7.487 9.055 1.00 0.00 C ATOM 1583 CG PHE A 99 -11.469 8.800 9.769 1.00 0.00 C ATOM 1584 CD1 PHE A 99 -11.058 8.999 11.050 1.00 0.00 C ATOM 1585 CD2 PHE A 99 -12.173 9.767 9.122 1.00 0.00 C ATOM 1586 CE1 PHE A 99 -11.364 10.218 11.712 1.00 0.00 C ATOM 1587 CE2 PHE A 99 -12.479 10.985 9.784 1.00 0.00 C ATOM 1588 CZ PHE A 99 -12.068 11.185 11.065 1.00 0.00 C ATOM 0 H PHE A 99 -11.809 5.389 7.981 1.00 0.00 H new ATOM 0 HA PHE A 99 -10.721 6.030 10.629 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -10.078 7.475 8.810 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -11.685 7.452 8.112 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -10.499 8.231 11.564 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -12.499 9.608 8.105 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -11.038 10.377 12.729 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -13.038 11.753 9.270 1.00 0.00 H new ATOM 0 HZ PHE A 99 -12.301 12.112 11.568 1.00 0.00 H new ATOM 1598 N ASP A 100 -12.751 6.479 11.899 1.00 0.00 N ATOM 1599 CA ASP A 100 -13.947 6.672 12.702 1.00 0.00 C ATOM 1600 C ASP A 100 -13.882 8.039 13.385 1.00 0.00 C ATOM 1601 O ASP A 100 -13.091 8.896 12.994 1.00 0.00 O ATOM 1602 CB ASP A 100 -14.057 5.603 13.791 1.00 0.00 C ATOM 1603 CG ASP A 100 -15.395 4.863 13.838 1.00 0.00 C ATOM 1604 OD1 ASP A 100 -15.742 4.251 12.805 1.00 0.00 O ATOM 1605 OD2 ASP A 100 -16.041 4.926 14.907 1.00 0.00 O ATOM 0 H ASP A 100 -11.889 6.376 12.435 1.00 0.00 H new ATOM 0 HA ASP A 100 -14.812 6.604 12.042 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -13.260 4.873 13.645 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -13.885 6.073 14.759 1.00 0.00 H new ATOM 1610 N ARG A 101 -14.725 8.201 14.394 1.00 0.00 N ATOM 1611 CA ARG A 101 -14.774 9.450 15.136 1.00 0.00 C ATOM 1612 C ARG A 101 -13.986 9.323 16.441 1.00 0.00 C ATOM 1613 O ARG A 101 -13.541 8.233 16.799 1.00 0.00 O ATOM 1614 CB ARG A 101 -16.217 9.845 15.455 1.00 0.00 C ATOM 1615 CG ARG A 101 -16.519 11.262 14.963 1.00 0.00 C ATOM 1616 CD ARG A 101 -17.699 11.867 15.726 1.00 0.00 C ATOM 1617 NE ARG A 101 -18.932 11.099 15.445 1.00 0.00 N ATOM 1618 CZ ARG A 101 -19.623 11.180 14.299 1.00 0.00 C ATOM 1619 NH1 ARG A 101 -19.205 11.996 13.322 1.00 0.00 N ATOM 1620 NH2 ARG A 101 -20.731 10.446 14.131 1.00 0.00 N ATOM 0 H ARG A 101 -15.380 7.488 14.715 1.00 0.00 H new ATOM 0 HA ARG A 101 -14.327 10.224 14.512 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -16.903 9.139 14.986 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -16.385 9.786 16.530 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -15.638 11.891 15.091 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -16.743 11.241 13.897 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -17.492 11.860 16.796 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -17.835 12.908 15.435 1.00 0.00 H new ATOM 0 HE ARG A 101 -19.278 10.469 16.168 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -18.362 12.555 13.450 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -19.730 12.058 12.450 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -21.049 9.825 14.875 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -21.256 10.508 13.259 1.00 0.00 H new ATOM 1634 N PHE A 102 -13.837 10.453 17.118 1.00 0.00 N ATOM 1635 CA PHE A 102 -13.111 10.482 18.376 1.00 0.00 C ATOM 1636 C PHE A 102 -11.699 9.916 18.207 1.00 0.00 C ATOM 1637 O PHE A 102 -11.062 9.524 19.183 1.00 0.00 O ATOM 1638 CB PHE A 102 -13.885 9.602 19.359 1.00 0.00 C ATOM 1639 CG PHE A 102 -15.116 10.280 19.964 1.00 0.00 C ATOM 1640 CD1 PHE A 102 -15.676 11.352 19.342 1.00 0.00 C ATOM 1641 CD2 PHE A 102 -15.651 9.810 21.122 1.00 0.00 C ATOM 1642 CE1 PHE A 102 -16.819 11.981 19.903 1.00 0.00 C ATOM 1643 CE2 PHE A 102 -16.794 10.439 21.683 1.00 0.00 C ATOM 1644 CZ PHE A 102 -17.354 11.511 21.062 1.00 0.00 C ATOM 0 H PHE A 102 -14.207 11.355 16.818 1.00 0.00 H new ATOM 0 HA PHE A 102 -13.022 11.509 18.731 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -14.199 8.692 18.847 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -13.216 9.300 20.165 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -15.252 11.725 18.422 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -15.207 8.958 21.615 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -17.264 12.833 19.409 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -17.219 10.066 22.603 1.00 0.00 H new ATOM 0 HZ PHE A 102 -18.223 11.989 21.489 1.00 0.00 H new ATOM 1654 N SER A 103 -11.251 9.893 16.960 1.00 0.00 N ATOM 1655 CA SER A 103 -9.926 9.382 16.651 1.00 0.00 C ATOM 1656 C SER A 103 -9.991 7.873 16.408 1.00 0.00 C ATOM 1657 O SER A 103 -9.312 7.353 15.523 1.00 0.00 O ATOM 1658 CB SER A 103 -8.938 9.697 17.775 1.00 0.00 C ATOM 1659 OG SER A 103 -7.597 9.781 17.300 1.00 0.00 O ATOM 0 H SER A 103 -11.782 10.220 16.152 1.00 0.00 H new ATOM 0 HA SER A 103 -9.572 9.874 15.745 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.215 10.640 18.247 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.003 8.925 18.542 1.00 0.00 H new ATOM 0 HG SER A 103 -6.997 9.985 18.048 1.00 0.00 H new ATOM 1665 N ARG A 104 -10.813 7.211 17.209 1.00 0.00 N ATOM 1666 CA ARG A 104 -10.974 5.772 17.093 1.00 0.00 C ATOM 1667 C ARG A 104 -10.961 5.354 15.621 1.00 0.00 C ATOM 1668 O ARG A 104 -11.535 6.035 14.773 1.00 0.00 O ATOM 1669 CB ARG A 104 -12.285 5.311 17.735 1.00 0.00 C ATOM 1670 CG ARG A 104 -12.036 4.719 19.123 1.00 0.00 C ATOM 1671 CD ARG A 104 -13.015 3.581 19.417 1.00 0.00 C ATOM 1672 NE ARG A 104 -13.798 3.889 20.635 1.00 0.00 N ATOM 1673 CZ ARG A 104 -14.789 3.119 21.105 1.00 0.00 C ATOM 1674 NH1 ARG A 104 -15.125 1.992 20.463 1.00 0.00 N ATOM 1675 NH2 ARG A 104 -15.445 3.477 22.218 1.00 0.00 N ATOM 0 H ARG A 104 -11.375 7.645 17.941 1.00 0.00 H new ATOM 0 HA ARG A 104 -10.141 5.302 17.616 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -12.972 6.154 17.813 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -12.764 4.567 17.099 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -11.013 4.349 19.186 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -12.140 5.498 19.879 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -13.686 3.439 18.570 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -12.470 2.647 19.552 1.00 0.00 H new ATOM 0 HE ARG A 104 -13.569 4.740 21.148 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -14.626 1.720 19.616 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -15.879 1.406 20.821 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -15.190 4.335 22.707 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -16.199 2.891 22.576 1.00 0.00 H new ATOM 1689 N ASP A 105 -10.299 4.236 15.362 1.00 0.00 N ATOM 1690 CA ASP A 105 -10.204 3.719 14.008 1.00 0.00 C ATOM 1691 C ASP A 105 -10.763 2.295 13.969 1.00 0.00 C ATOM 1692 O ASP A 105 -10.336 1.436 14.739 1.00 0.00 O ATOM 1693 CB ASP A 105 -8.748 3.668 13.539 1.00 0.00 C ATOM 1694 CG ASP A 105 -7.731 3.312 14.626 1.00 0.00 C ATOM 1695 OD1 ASP A 105 -7.737 2.135 15.045 1.00 0.00 O ATOM 1696 OD2 ASP A 105 -6.971 4.226 15.012 1.00 0.00 O ATOM 0 H ASP A 105 -9.823 3.674 16.067 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.771 4.381 13.354 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -8.667 2.938 12.733 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.483 4.638 13.118 1.00 0.00 H new ATOM 1701 N ASP A 106 -11.709 2.089 13.065 1.00 0.00 N ATOM 1702 CA ASP A 106 -12.331 0.785 12.916 1.00 0.00 C ATOM 1703 C ASP A 106 -11.630 0.015 11.794 1.00 0.00 C ATOM 1704 O ASP A 106 -11.889 0.255 10.616 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.809 0.918 12.545 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.782 0.822 13.722 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -14.828 1.797 14.502 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -15.458 -0.225 13.815 1.00 0.00 O ATOM 0 H ASP A 106 -12.060 2.804 12.428 1.00 0.00 H new ATOM 0 HA ASP A 106 -12.244 0.260 13.867 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.958 1.876 12.047 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -14.058 0.141 11.823 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.755 -0.893 12.200 1.00 0.00 N ATOM 1714 CA ILE A 107 -10.015 -1.699 11.244 1.00 0.00 C ATOM 1715 C ILE A 107 -10.909 -2.832 10.737 1.00 0.00 C ATOM 1716 O ILE A 107 -11.645 -3.440 11.513 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.698 -2.182 11.856 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -7.767 -1.005 12.154 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -8.030 -3.230 10.964 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -6.866 -1.307 13.353 1.00 0.00 C ATOM 0 H ILE A 107 -10.542 -1.088 13.178 1.00 0.00 H new ATOM 0 HA ILE A 107 -9.737 -1.100 10.377 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.921 -2.665 12.808 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -7.154 -0.791 11.279 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -8.358 -0.111 12.355 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -7.096 -3.556 11.422 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.695 -4.086 10.847 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.822 -2.796 9.986 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -6.215 -0.454 13.543 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -7.482 -1.496 14.232 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -6.259 -2.187 13.139 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.817 -3.080 9.439 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.609 -4.129 8.820 1.00 0.00 C ATOM 1734 C ILE A 108 -10.766 -5.401 8.710 1.00 0.00 C ATOM 1735 O ILE A 108 -11.239 -6.493 9.023 1.00 0.00 O ATOM 1736 CB ILE A 108 -12.179 -3.651 7.483 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -13.329 -2.665 7.698 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.596 -4.837 6.610 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -13.277 -1.530 6.673 1.00 0.00 C ATOM 0 H ILE A 108 -10.206 -2.573 8.799 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.472 -4.371 9.440 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.394 -3.117 6.948 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -14.282 -3.189 7.618 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -13.276 -2.253 8.706 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -12.998 -4.470 5.666 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.729 -5.468 6.415 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.359 -5.419 7.127 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -14.105 -0.843 6.848 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -12.334 -0.993 6.772 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.355 -1.944 5.668 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.532 -5.218 8.264 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.619 -6.338 8.109 1.00 0.00 C ATOM 1753 C GLY A 109 -7.195 -5.850 7.832 1.00 0.00 C ATOM 1754 O GLY A 109 -6.984 -4.673 7.543 1.00 0.00 O ATOM 0 H GLY A 109 -9.143 -4.311 8.005 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.629 -6.948 9.012 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.955 -6.975 7.291 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.256 -6.779 7.929 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.859 -6.458 7.692 1.00 0.00 C ATOM 1760 C GLU A 110 -4.299 -7.326 6.563 1.00 0.00 C ATOM 1761 O GLU A 110 -4.752 -8.451 6.357 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.034 -6.623 8.970 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.534 -5.684 10.070 1.00 0.00 C ATOM 1764 CD GLU A 110 -5.387 -6.440 11.091 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -6.589 -6.621 10.803 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -4.816 -6.820 12.136 1.00 0.00 O ATOM 0 H GLU A 110 -6.435 -7.754 8.168 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.793 -5.413 7.388 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.092 -7.656 9.314 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -2.985 -6.416 8.759 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -3.684 -5.221 10.572 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.120 -4.878 9.627 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.322 -6.770 5.862 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.695 -7.479 4.759 1.00 0.00 C ATOM 1775 C VAL A 111 -1.180 -7.276 4.822 1.00 0.00 C ATOM 1776 O VAL A 111 -0.707 -6.274 5.356 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.305 -7.025 3.431 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.293 -7.152 2.291 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.584 -7.804 3.119 1.00 0.00 C ATOM 0 H VAL A 111 -2.949 -5.837 6.036 1.00 0.00 H new ATOM 0 HA VAL A 111 -2.882 -8.550 4.838 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.570 -5.972 3.527 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.752 -6.823 1.359 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.423 -6.531 2.506 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.982 -8.192 2.195 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -4.996 -7.461 2.170 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.355 -8.868 3.052 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.313 -7.639 3.912 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.462 -8.242 4.269 1.00 0.00 N ATOM 1790 CA LEU A 112 0.990 -8.181 4.256 1.00 0.00 C ATOM 1791 C LEU A 112 1.510 -8.799 2.956 1.00 0.00 C ATOM 1792 O LEU A 112 0.952 -9.778 2.463 1.00 0.00 O ATOM 1793 CB LEU A 112 1.564 -8.829 5.517 1.00 0.00 C ATOM 1794 CG LEU A 112 3.091 -8.895 5.602 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.663 -7.610 6.204 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.544 -10.139 6.368 1.00 0.00 C ATOM 0 H LEU A 112 -0.858 -9.071 3.827 1.00 0.00 H new ATOM 0 HA LEU A 112 1.328 -7.145 4.275 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.195 -8.280 6.384 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.172 -9.843 5.591 1.00 0.00 H new ATOM 0 HG LEU A 112 3.486 -8.979 4.590 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.749 -7.683 6.253 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.384 -6.761 5.580 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.263 -7.469 7.208 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.633 -10.162 6.414 1.00 0.00 H new ATOM 0 HD22 LEU A 112 3.139 -10.111 7.379 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.184 -11.032 5.857 1.00 0.00 H new ATOM 1808 N ILE A 113 2.572 -8.200 2.438 1.00 0.00 N ATOM 1809 CA ILE A 113 3.174 -8.679 1.205 1.00 0.00 C ATOM 1810 C ILE A 113 4.697 -8.579 1.313 1.00 0.00 C ATOM 1811 O ILE A 113 5.269 -7.512 1.096 1.00 0.00 O ATOM 1812 CB ILE A 113 2.593 -7.936 0.001 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.436 -8.873 -1.198 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.432 -6.703 -0.340 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.108 -9.629 -1.133 1.00 0.00 C ATOM 0 H ILE A 113 3.031 -7.387 2.849 1.00 0.00 H new ATOM 0 HA ILE A 113 2.934 -9.730 1.048 1.00 0.00 H new ATOM 0 HB ILE A 113 1.596 -7.583 0.266 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.486 -8.298 -2.123 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.262 -9.584 -1.219 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.997 -6.193 -1.200 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.447 -6.026 0.514 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.450 -7.010 -0.578 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.022 -10.288 -1.997 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.071 -10.222 -0.219 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.283 -8.916 -1.136 1.00 0.00 H new ATOM 1827 N PRO A 114 5.326 -9.734 1.658 1.00 0.00 N ATOM 1828 CA PRO A 114 6.772 -9.786 1.798 1.00 0.00 C ATOM 1829 C PRO A 114 7.455 -9.782 0.429 1.00 0.00 C ATOM 1830 O PRO A 114 7.210 -10.662 -0.395 1.00 0.00 O ATOM 1831 CB PRO A 114 7.045 -11.052 2.593 1.00 0.00 C ATOM 1832 CG PRO A 114 5.790 -11.901 2.470 1.00 0.00 C ATOM 1833 CD PRO A 114 4.681 -11.017 1.923 1.00 0.00 C ATOM 0 HA PRO A 114 7.177 -8.914 2.312 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.914 -11.580 2.200 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.258 -10.820 3.636 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.965 -12.748 1.806 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.509 -12.310 3.441 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.250 -11.439 1.015 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.868 -10.911 2.642 1.00 0.00 H new ATOM 1841 N LEU A 115 8.299 -8.780 0.228 1.00 0.00 N ATOM 1842 CA LEU A 115 9.020 -8.649 -1.027 1.00 0.00 C ATOM 1843 C LEU A 115 10.158 -9.671 -1.066 1.00 0.00 C ATOM 1844 O LEU A 115 10.893 -9.751 -2.049 1.00 0.00 O ATOM 1845 CB LEU A 115 9.483 -7.205 -1.231 1.00 0.00 C ATOM 1846 CG LEU A 115 8.450 -6.120 -0.922 1.00 0.00 C ATOM 1847 CD1 LEU A 115 8.941 -4.748 -1.387 1.00 0.00 C ATOM 1848 CD2 LEU A 115 7.087 -6.474 -1.519 1.00 0.00 C ATOM 0 H LEU A 115 8.500 -8.051 0.913 1.00 0.00 H new ATOM 0 HA LEU A 115 8.363 -8.871 -1.868 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.359 -7.033 -0.606 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.803 -7.090 -2.267 1.00 0.00 H new ATOM 0 HG LEU A 115 8.323 -6.067 0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 115 8.188 -3.994 -1.156 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.871 -4.501 -0.874 1.00 0.00 H new ATOM 0 HD13 LEU A 115 9.114 -4.769 -2.463 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.371 -5.686 -1.284 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.178 -6.571 -2.601 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.739 -7.417 -1.098 1.00 0.00 H new ATOM 1860 N SER A 116 10.268 -10.428 0.017 1.00 0.00 N ATOM 1861 CA SER A 116 11.304 -11.441 0.119 1.00 0.00 C ATOM 1862 C SER A 116 11.104 -12.505 -0.962 1.00 0.00 C ATOM 1863 O SER A 116 10.205 -13.338 -0.860 1.00 0.00 O ATOM 1864 CB SER A 116 11.307 -12.088 1.505 1.00 0.00 C ATOM 1865 OG SER A 116 12.409 -12.975 1.678 1.00 0.00 O ATOM 0 H SER A 116 9.657 -10.359 0.831 1.00 0.00 H new ATOM 0 HA SER A 116 12.270 -10.958 -0.029 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.344 -11.310 2.268 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.375 -12.634 1.652 1.00 0.00 H new ATOM 0 HG SER A 116 12.376 -13.366 2.576 1.00 0.00 H new ATOM 1871 N GLY A 117 11.958 -12.442 -1.974 1.00 0.00 N ATOM 1872 CA GLY A 117 11.886 -13.390 -3.073 1.00 0.00 C ATOM 1873 C GLY A 117 11.321 -12.728 -4.332 1.00 0.00 C ATOM 1874 O GLY A 117 11.741 -13.041 -5.444 1.00 0.00 O ATOM 0 H GLY A 117 12.703 -11.750 -2.056 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.880 -13.787 -3.281 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.258 -14.235 -2.789 1.00 0.00 H new ATOM 1878 N ILE A 118 10.375 -11.825 -4.113 1.00 0.00 N ATOM 1879 CA ILE A 118 9.748 -11.117 -5.216 1.00 0.00 C ATOM 1880 C ILE A 118 10.831 -10.479 -6.088 1.00 0.00 C ATOM 1881 O ILE A 118 11.808 -9.936 -5.574 1.00 0.00 O ATOM 1882 CB ILE A 118 8.713 -10.119 -4.692 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.401 -10.824 -4.341 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.502 -8.976 -5.686 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.449 -10.837 -5.538 1.00 0.00 C ATOM 0 H ILE A 118 10.028 -11.568 -3.189 1.00 0.00 H new ATOM 0 HA ILE A 118 9.196 -11.811 -5.850 1.00 0.00 H new ATOM 0 HB ILE A 118 9.098 -9.678 -3.772 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.607 -11.846 -4.024 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.926 -10.319 -3.500 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.762 -8.281 -5.289 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.445 -8.452 -5.843 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.149 -9.380 -6.635 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.524 -11.344 -5.262 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.226 -9.813 -5.837 1.00 0.00 H new ATOM 0 HD13 ILE A 118 6.917 -11.364 -6.370 1.00 0.00 H new ATOM 1897 N GLU A 119 10.621 -10.565 -7.394 1.00 0.00 N ATOM 1898 CA GLU A 119 11.567 -10.003 -8.342 1.00 0.00 C ATOM 1899 C GLU A 119 10.887 -8.932 -9.199 1.00 0.00 C ATOM 1900 O GLU A 119 9.972 -9.233 -9.964 1.00 0.00 O ATOM 1901 CB GLU A 119 12.181 -11.097 -9.218 1.00 0.00 C ATOM 1902 CG GLU A 119 11.247 -11.464 -10.373 1.00 0.00 C ATOM 1903 CD GLU A 119 11.657 -12.794 -11.008 1.00 0.00 C ATOM 1904 OE1 GLU A 119 12.208 -13.632 -10.263 1.00 0.00 O ATOM 1905 OE2 GLU A 119 11.409 -12.943 -12.224 1.00 0.00 O ATOM 0 H GLU A 119 9.810 -11.015 -7.817 1.00 0.00 H new ATOM 0 HA GLU A 119 12.376 -9.534 -7.783 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.138 -10.757 -9.614 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.382 -11.981 -8.614 1.00 0.00 H new ATOM 0 HG2 GLU A 119 10.222 -11.531 -10.009 1.00 0.00 H new ATOM 0 HG3 GLU A 119 11.267 -10.676 -11.126 1.00 0.00 H new ATOM 1912 N LEU A 120 11.361 -7.705 -9.042 1.00 0.00 N ATOM 1913 CA LEU A 120 10.810 -6.589 -9.791 1.00 0.00 C ATOM 1914 C LEU A 120 11.744 -6.251 -10.955 1.00 0.00 C ATOM 1915 O LEU A 120 11.458 -5.351 -11.743 1.00 0.00 O ATOM 1916 CB LEU A 120 10.533 -5.405 -8.862 1.00 0.00 C ATOM 1917 CG LEU A 120 9.696 -5.710 -7.618 1.00 0.00 C ATOM 1918 CD1 LEU A 120 10.314 -5.073 -6.372 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.240 -5.283 -7.818 1.00 0.00 C ATOM 0 H LEU A 120 12.121 -7.459 -8.407 1.00 0.00 H new ATOM 0 HA LEU A 120 9.846 -6.859 -10.223 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.488 -4.990 -8.540 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.026 -4.629 -9.436 1.00 0.00 H new ATOM 0 HG LEU A 120 9.696 -6.789 -7.462 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.700 -5.305 -5.502 1.00 0.00 H new ATOM 0 HD12 LEU A 120 11.319 -5.467 -6.222 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.364 -3.992 -6.503 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.667 -5.511 -6.919 1.00 0.00 H new ATOM 0 HD22 LEU A 120 8.199 -4.211 -8.013 1.00 0.00 H new ATOM 0 HD23 LEU A 120 7.816 -5.822 -8.665 1.00 0.00 H new ATOM 1931 N SER A 121 12.840 -6.992 -11.026 1.00 0.00 N ATOM 1932 CA SER A 121 13.817 -6.782 -12.081 1.00 0.00 C ATOM 1933 C SER A 121 13.106 -6.462 -13.397 1.00 0.00 C ATOM 1934 O SER A 121 13.273 -5.375 -13.948 1.00 0.00 O ATOM 1935 CB SER A 121 14.718 -8.008 -12.249 1.00 0.00 C ATOM 1936 OG SER A 121 13.983 -9.158 -12.659 1.00 0.00 O ATOM 0 H SER A 121 13.073 -7.738 -10.371 1.00 0.00 H new ATOM 0 HA SER A 121 14.446 -5.937 -11.801 1.00 0.00 H new ATOM 0 HB2 SER A 121 15.492 -7.791 -12.985 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.224 -8.218 -11.307 1.00 0.00 H new ATOM 0 HG SER A 121 14.593 -9.919 -12.757 1.00 0.00 H new ATOM 1942 N GLU A 122 12.329 -7.428 -13.863 1.00 0.00 N ATOM 1943 CA GLU A 122 11.592 -7.263 -15.104 1.00 0.00 C ATOM 1944 C GLU A 122 10.977 -5.864 -15.174 1.00 0.00 C ATOM 1945 O GLU A 122 11.014 -5.216 -16.219 1.00 0.00 O ATOM 1946 CB GLU A 122 10.517 -8.342 -15.252 1.00 0.00 C ATOM 1947 CG GLU A 122 11.118 -9.645 -15.782 1.00 0.00 C ATOM 1948 CD GLU A 122 10.113 -10.396 -16.658 1.00 0.00 C ATOM 1949 OE1 GLU A 122 9.552 -9.744 -17.565 1.00 0.00 O ATOM 1950 OE2 GLU A 122 9.928 -11.605 -16.401 1.00 0.00 O ATOM 0 H GLU A 122 12.194 -8.328 -13.403 1.00 0.00 H new ATOM 0 HA GLU A 122 12.289 -7.375 -15.935 1.00 0.00 H new ATOM 0 HB2 GLU A 122 10.042 -8.522 -14.288 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.738 -7.994 -15.931 1.00 0.00 H new ATOM 0 HG2 GLU A 122 12.017 -9.427 -16.359 1.00 0.00 H new ATOM 0 HG3 GLU A 122 11.421 -10.276 -14.947 1.00 0.00 H new ATOM 1957 N GLY A 123 10.425 -5.438 -14.047 1.00 0.00 N ATOM 1958 CA GLY A 123 9.803 -4.127 -13.967 1.00 0.00 C ATOM 1959 C GLY A 123 8.716 -4.101 -12.891 1.00 0.00 C ATOM 1960 O GLY A 123 8.919 -4.602 -11.786 1.00 0.00 O ATOM 0 H GLY A 123 10.396 -5.978 -13.182 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.559 -3.375 -13.743 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.370 -3.866 -14.933 1.00 0.00 H new ATOM 1964 N LYS A 124 7.585 -3.512 -13.251 1.00 0.00 N ATOM 1965 CA LYS A 124 6.466 -3.414 -12.330 1.00 0.00 C ATOM 1966 C LYS A 124 5.584 -4.655 -12.472 1.00 0.00 C ATOM 1967 O LYS A 124 5.367 -5.143 -13.580 1.00 0.00 O ATOM 1968 CB LYS A 124 5.714 -2.098 -12.539 1.00 0.00 C ATOM 1969 CG LYS A 124 4.456 -2.041 -11.670 1.00 0.00 C ATOM 1970 CD LYS A 124 3.541 -0.894 -12.103 1.00 0.00 C ATOM 1971 CE LYS A 124 3.266 0.058 -10.937 1.00 0.00 C ATOM 1972 NZ LYS A 124 1.983 0.768 -11.139 1.00 0.00 N ATOM 0 H LYS A 124 7.420 -3.098 -14.168 1.00 0.00 H new ATOM 0 HA LYS A 124 6.821 -3.391 -11.300 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.367 -1.260 -12.296 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.440 -1.994 -13.589 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.918 -2.986 -11.741 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.737 -1.912 -10.625 1.00 0.00 H new ATOM 0 HD2 LYS A 124 4.003 -0.345 -12.924 1.00 0.00 H new ATOM 0 HD3 LYS A 124 2.600 -1.296 -12.478 1.00 0.00 H new ATOM 0 HE2 LYS A 124 3.235 -0.502 -10.002 1.00 0.00 H new ATOM 0 HE3 LYS A 124 4.078 0.780 -10.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 2.053 1.730 -10.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 1.772 0.821 -12.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.221 0.253 -10.654 1.00 0.00 H new ATOM 1986 N MET A 125 5.099 -5.131 -11.334 1.00 0.00 N ATOM 1987 CA MET A 125 4.245 -6.307 -11.318 1.00 0.00 C ATOM 1988 C MET A 125 2.977 -6.052 -10.501 1.00 0.00 C ATOM 1989 O MET A 125 3.009 -5.325 -9.510 1.00 0.00 O ATOM 1990 CB MET A 125 5.012 -7.487 -10.718 1.00 0.00 C ATOM 1991 CG MET A 125 5.182 -7.318 -9.206 1.00 0.00 C ATOM 1992 SD MET A 125 5.883 -8.800 -8.501 1.00 0.00 S ATOM 1993 CE MET A 125 7.620 -8.466 -8.743 1.00 0.00 C ATOM 0 H MET A 125 5.281 -4.724 -10.417 1.00 0.00 H new ATOM 0 HA MET A 125 3.954 -6.536 -12.343 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.480 -8.415 -10.926 1.00 0.00 H new ATOM 0 HB3 MET A 125 5.991 -7.568 -11.191 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.828 -6.465 -8.997 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.217 -7.107 -8.745 1.00 0.00 H new ATOM 0 HE1 MET A 125 8.184 -9.395 -8.661 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.773 -8.034 -9.732 1.00 0.00 H new ATOM 0 HE3 MET A 125 7.965 -7.764 -7.984 1.00 0.00 H new ATOM 2003 N LEU A 126 1.891 -6.666 -10.947 1.00 0.00 N ATOM 2004 CA LEU A 126 0.614 -6.515 -10.270 1.00 0.00 C ATOM 2005 C LEU A 126 0.424 -7.671 -9.286 1.00 0.00 C ATOM 2006 O LEU A 126 0.724 -8.820 -9.607 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.520 -6.381 -11.287 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.772 -5.647 -10.803 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.375 -6.339 -9.579 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.474 -4.170 -10.538 1.00 0.00 C ATOM 0 H LEU A 126 1.869 -7.269 -11.769 1.00 0.00 H new ATOM 0 HA LEU A 126 0.599 -5.594 -9.688 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.135 -5.861 -12.164 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.811 -7.380 -11.611 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.519 -5.687 -11.596 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.264 -5.797 -9.255 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.648 -7.362 -9.837 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.644 -6.352 -8.771 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.381 -3.672 -10.195 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.702 -4.086 -9.773 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.126 -3.698 -11.457 1.00 0.00 H new ATOM 2022 N MET A 127 -0.072 -7.327 -8.106 1.00 0.00 N ATOM 2023 CA MET A 127 -0.306 -8.322 -7.073 1.00 0.00 C ATOM 2024 C MET A 127 -1.577 -8.005 -6.284 1.00 0.00 C ATOM 2025 O MET A 127 -2.003 -6.852 -6.223 1.00 0.00 O ATOM 2026 CB MET A 127 0.891 -8.359 -6.120 1.00 0.00 C ATOM 2027 CG MET A 127 2.171 -8.748 -6.863 1.00 0.00 C ATOM 2028 SD MET A 127 3.133 -9.877 -5.869 1.00 0.00 S ATOM 2029 CE MET A 127 3.351 -8.888 -4.399 1.00 0.00 C ATOM 0 H MET A 127 -0.318 -6.373 -7.843 1.00 0.00 H new ATOM 0 HA MET A 127 -0.431 -9.293 -7.552 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.019 -7.382 -5.654 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.700 -9.072 -5.318 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.921 -9.212 -7.817 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.757 -7.857 -7.086 1.00 0.00 H new ATOM 0 HE1 MET A 127 4.415 -8.757 -4.203 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.886 -7.913 -4.544 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.885 -9.390 -3.551 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.149 -9.048 -5.700 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.363 -8.895 -4.917 1.00 0.00 C ATOM 2041 C ASN A 128 -3.237 -9.704 -3.625 1.00 0.00 C ATOM 2042 O ASN A 128 -2.374 -10.574 -3.514 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.581 -9.416 -5.683 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.211 -10.624 -6.545 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.980 -10.521 -7.739 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.168 -11.773 -5.877 1.00 0.00 N ATOM 0 H ASN A 128 -1.794 -10.003 -5.754 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.496 -7.834 -4.705 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.366 -9.694 -4.980 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -4.984 -8.624 -6.314 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.931 -12.637 -6.364 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -4.372 -11.790 -4.878 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.109 -9.388 -2.679 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.106 -10.074 -1.398 1.00 0.00 C ATOM 2055 C ARG A 129 -5.514 -10.088 -0.800 1.00 0.00 C ATOM 2056 O ARG A 129 -6.289 -9.155 -1.005 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.148 -9.399 -0.414 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.850 -10.198 -0.278 1.00 0.00 C ATOM 2059 CD ARG A 129 -2.101 -11.538 0.416 1.00 0.00 C ATOM 2060 NE ARG A 129 -2.120 -11.352 1.884 1.00 0.00 N ATOM 2061 CZ ARG A 129 -2.027 -12.354 2.770 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.909 -13.618 2.341 1.00 0.00 N ATOM 2063 NH2 ARG A 129 -2.053 -12.091 4.083 1.00 0.00 N ATOM 0 H ARG A 129 -4.823 -8.666 -2.774 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.771 -11.097 -1.570 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.923 -8.388 -0.755 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.627 -9.308 0.561 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.420 -10.370 -1.265 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.121 -9.621 0.291 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -3.050 -11.958 0.082 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -1.323 -12.250 0.141 1.00 0.00 H new ATOM 0 HE ARG A 129 -2.209 -10.402 2.244 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.890 -13.817 1.341 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.838 -14.381 3.015 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -2.144 -11.129 4.409 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -1.982 -12.853 4.757 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.803 -11.158 -0.073 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.104 -11.306 0.556 1.00 0.00 C ATOM 2079 C GLU A 130 -7.111 -10.626 1.927 1.00 0.00 C ATOM 2080 O GLU A 130 -6.109 -10.648 2.640 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.492 -12.781 0.674 1.00 0.00 C ATOM 2082 CG GLU A 130 -6.844 -13.422 1.903 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.308 -14.818 1.575 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -5.840 -14.991 0.429 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -6.380 -15.679 2.478 1.00 0.00 O ATOM 0 H GLU A 130 -5.158 -11.930 0.094 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.848 -10.818 -0.074 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.576 -12.871 0.741 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.183 -13.315 -0.225 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.030 -12.791 2.260 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.574 -13.489 2.710 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.253 -10.038 2.254 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.403 -9.353 3.527 1.00 0.00 C ATOM 2094 C ILE A 131 -9.179 -10.249 4.495 1.00 0.00 C ATOM 2095 O ILE A 131 -10.296 -10.669 4.198 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.037 -7.976 3.323 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.069 -7.026 2.616 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.539 -7.401 4.649 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.775 -6.251 1.502 1.00 0.00 C ATOM 0 H ILE A 131 -9.082 -10.022 1.660 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.428 -9.166 3.976 1.00 0.00 H new ATOM 0 HB ILE A 131 -9.905 -8.093 2.674 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.647 -6.327 3.339 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.237 -7.593 2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.985 -6.422 4.475 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.287 -8.070 5.076 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.704 -7.301 5.342 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.064 -5.583 1.016 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.175 -6.951 0.768 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.591 -5.666 1.927 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.555 -10.516 5.633 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.172 -11.355 6.646 1.00 0.00 C ATOM 2113 C ILE A 132 -8.932 -10.741 8.026 1.00 0.00 C ATOM 2114 O ILE A 132 -8.439 -9.619 8.133 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.679 -12.798 6.521 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.181 -12.840 6.212 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.499 -13.570 5.486 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.358 -12.397 7.423 1.00 0.00 C ATOM 0 H ILE A 132 -7.628 -10.166 5.876 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.251 -11.398 6.499 1.00 0.00 H new ATOM 0 HB ILE A 132 -8.824 -13.293 7.481 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -6.894 -13.851 5.923 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -6.963 -12.192 5.363 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.128 -14.593 5.417 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.546 -13.584 5.788 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.408 -13.085 4.514 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.297 -12.436 7.176 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.630 -11.377 7.694 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.560 -13.062 8.263 1.00 0.00 H new ATOM 2130 N SER A 133 -9.292 -11.503 9.049 1.00 0.00 N ATOM 2131 CA SER A 133 -9.122 -11.047 10.418 1.00 0.00 C ATOM 2132 C SER A 133 -7.744 -11.462 10.940 1.00 0.00 C ATOM 2133 O SER A 133 -7.622 -12.448 11.665 1.00 0.00 O ATOM 2134 CB SER A 133 -10.222 -11.603 11.324 1.00 0.00 C ATOM 2135 OG SER A 133 -10.023 -11.241 12.688 1.00 0.00 O ATOM 0 H SER A 133 -9.701 -12.433 8.957 1.00 0.00 H new ATOM 0 HA SER A 133 -9.195 -9.960 10.428 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.190 -11.232 10.988 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.249 -12.689 11.237 1.00 0.00 H new ATOM 0 HG SER A 133 -10.747 -11.613 13.234 1.00 0.00 H new ATOM 2141 N GLY A 134 -6.742 -10.687 10.551 1.00 0.00 N ATOM 2142 CA GLY A 134 -5.378 -10.962 10.970 1.00 0.00 C ATOM 2143 C GLY A 134 -4.932 -12.351 10.510 1.00 0.00 C ATOM 2144 O GLY A 134 -5.756 -13.250 10.350 1.00 0.00 O ATOM 0 H GLY A 134 -6.847 -9.869 9.951 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -4.708 -10.207 10.559 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -5.307 -10.894 12.056 1.00 0.00 H new ATOM 2148 N PRO A 135 -3.594 -12.487 10.306 1.00 0.00 N ATOM 2149 CA PRO A 135 -3.028 -13.751 9.868 1.00 0.00 C ATOM 2150 C PRO A 135 -2.991 -14.762 11.016 1.00 0.00 C ATOM 2151 O PRO A 135 -2.164 -14.650 11.920 1.00 0.00 O ATOM 2152 CB PRO A 135 -1.647 -13.402 9.339 1.00 0.00 C ATOM 2153 CG PRO A 135 -1.309 -12.040 9.924 1.00 0.00 C ATOM 2154 CD PRO A 135 -2.588 -11.444 10.487 1.00 0.00 C ATOM 0 HA PRO A 135 -3.625 -14.234 9.095 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -0.913 -14.149 9.640 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -1.642 -13.371 8.249 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.556 -12.137 10.706 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -0.890 -11.389 9.157 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.473 -11.183 11.539 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -2.865 -10.531 9.960 1.00 0.00 H new ATOM 2162 N SER A 136 -3.897 -15.727 10.943 1.00 0.00 N ATOM 2163 CA SER A 136 -3.978 -16.757 11.964 1.00 0.00 C ATOM 2164 C SER A 136 -4.732 -17.973 11.423 1.00 0.00 C ATOM 2165 O SER A 136 -5.949 -17.928 11.255 1.00 0.00 O ATOM 2166 CB SER A 136 -4.661 -16.228 13.227 1.00 0.00 C ATOM 2167 OG SER A 136 -4.315 -16.990 14.380 1.00 0.00 O ATOM 0 H SER A 136 -4.581 -15.817 10.192 1.00 0.00 H new ATOM 0 HA SER A 136 -2.964 -17.055 12.229 1.00 0.00 H new ATOM 0 HB2 SER A 136 -4.379 -15.187 13.383 1.00 0.00 H new ATOM 0 HB3 SER A 136 -5.742 -16.248 13.090 1.00 0.00 H new ATOM 0 HG SER A 136 -4.770 -16.620 15.165 1.00 0.00 H new ATOM 2173 N SER A 137 -3.976 -19.030 11.165 1.00 0.00 N ATOM 2174 CA SER A 137 -4.558 -20.256 10.645 1.00 0.00 C ATOM 2175 C SER A 137 -4.551 -21.338 11.728 1.00 0.00 C ATOM 2176 O SER A 137 -3.681 -21.346 12.597 1.00 0.00 O ATOM 2177 CB SER A 137 -3.804 -20.742 9.406 1.00 0.00 C ATOM 2178 OG SER A 137 -4.185 -20.025 8.235 1.00 0.00 O ATOM 0 H SER A 137 -2.966 -19.063 11.306 1.00 0.00 H new ATOM 0 HA SER A 137 -5.587 -20.049 10.352 1.00 0.00 H new ATOM 0 HB2 SER A 137 -2.732 -20.630 9.567 1.00 0.00 H new ATOM 0 HB3 SER A 137 -3.995 -21.805 9.259 1.00 0.00 H new ATOM 0 HG SER A 137 -3.681 -20.363 7.466 1.00 0.00 H new ATOM 2184 N GLY A 138 -5.532 -22.224 11.640 1.00 0.00 N ATOM 2185 CA GLY A 138 -5.650 -23.308 12.600 1.00 0.00 C ATOM 2186 C GLY A 138 -6.022 -24.619 11.905 1.00 0.00 C ATOM 2187 O GLY A 138 -5.295 -25.607 12.006 1.00 0.00 O ATOM 0 H GLY A 138 -6.253 -22.213 10.918 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -4.707 -23.430 13.133 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -6.407 -23.059 13.344 1.00 0.00 H new TER 2191 GLY A 138