USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 919 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 41 TYR OH : rot 169:sc= 0.00447 USER MOD Set 1.2: A 67 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 62 GLN : amide:sc= -2.47! K(o=-2.4!,f=0.22) USER MOD Set 2.2: A 63 GLN : amide:sc= 0.0754 K(o=-2.4,f=-9.1!) USER MOD Set 3.1: A 46 MET CE :methyl -177:sc= -0.987 (180deg=-1) USER MOD Set 3.2: A 50 LYS NZ :NH3+ 157:sc= 1.11 (180deg=0.237) USER MOD Set 4.1: A 42 SER OG : rot 114:sc= -0.272 USER MOD Set 4.2: A 43 ASN : amide:sc= -2.27 K(o=-2.5,f=-0.63) USER MOD Set 5.1: A 7 GLN : amide:sc= -0.228 K(o=0.9,f=0.21) USER MOD Set 5.2: A 29 GLN : amide:sc= 1.12 K(o=0.9,f=-1.9!) USER MOD Set 6.1: A 25 HIS : no HD1:sc= -4.59! C(o=-4.6!,f=-2.8!) USER MOD Set 6.2: A 26 CYS SG : rot 174:sc= -0.0344 USER MOD Single : A 2 SER OG : rot -22:sc= 0.0929 USER MOD Single : A 3 GLN : amide:sc= -0.169 K(o=-0.17,f=-1.2) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 139:sc= 0.101 (180deg=-0.435) USER MOD Single : A 10 GLN : amide:sc= -1.6 X(o=-1.6,f=-1.4) USER MOD Single : A 12 ASN : amide:sc= -0.87 K(o=-0.87,f=0.085) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ -170:sc= 0.166 (180deg=0.139) USER MOD Single : A 17 GLN : amide:sc= -1.08 K(o=-1.1,f=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 52:sc= 0.647 USER MOD Single : A 32 THR OG1 : rot 82:sc= 0.0144 USER MOD Single : A 34 GLN : amide:sc= -2.54! K(o=-2.5!,f=-0.5) USER MOD Single : A 36 GLN : amide:sc= -2.13 K(o=-2.1,f=-0.001) USER MOD Single : A 37 ASN : amide:sc= -0.634! C(o=-0.63!,f=-4.8!) USER MOD Single : A 44 LYS NZ :NH3+ 178:sc= 1.28 (180deg=1.27) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= -0.615 USER MOD Single : A 56 GLN : amide:sc= -1.15 K(o=-1.2,f=-0.07) USER MOD Single : A 59 GLN : amide:sc= -0.212 X(o=-0.21,f=-0.21) USER MOD Single : A 60 MET CE :methyl 155:sc= -0.199 (180deg=-1.4) USER MOD Single : A 61 CYS SG : rot 79:sc= 0.254 USER MOD Single : A 68 THR OG1 : rot 120:sc= -0.0349 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.0477 USER MOD Single : A 73 HIS : no HE2:sc= -2.64! C(o=-2.6!,f=-3.8!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -162:sc= 1.67 (180deg=0.727) USER MOD Single : A 81 GLN : amide:sc= -8.93! C(o=-8.9!,f=-7.7!) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0.555 K(o=0.56,f=0) USER MOD Single : A 93 SER OG : rot -179:sc= 0.00296 USER MOD Single : A 95 GLN : amide:sc= -0.126 X(o=-0.13,f=-0.13) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : B 703 THR OG1 : rot 160:sc= -0.925 USER MOD Single : B 705 MET CE :methyl 152:sc= -1.76! (180deg=-3.63!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 21.276 -12.374 -3.041 1.00 0.00 N ATOM 2 CA SER A 2 20.525 -11.740 -4.140 1.00 0.00 C ATOM 3 C SER A 2 21.007 -10.310 -4.371 1.00 0.00 C ATOM 4 O SER A 2 21.797 -9.783 -3.588 1.00 0.00 O ATOM 5 CB SER A 2 19.023 -11.761 -3.840 1.00 0.00 C ATOM 6 OG SER A 2 18.774 -11.097 -2.619 1.00 0.00 O ATOM 0 HA SER A 2 20.704 -12.309 -5.052 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.474 -11.277 -4.647 1.00 0.00 H new ATOM 0 HB3 SER A 2 18.667 -12.790 -3.785 1.00 0.00 H new ATOM 0 HG SER A 2 19.591 -11.092 -2.077 1.00 0.00 H new ATOM 14 N GLN A 3 20.529 -9.678 -5.447 1.00 0.00 N ATOM 15 CA GLN A 3 20.899 -8.316 -5.806 1.00 0.00 C ATOM 16 C GLN A 3 19.703 -7.600 -6.434 1.00 0.00 C ATOM 17 O GLN A 3 18.709 -8.231 -6.794 1.00 0.00 O ATOM 18 CB GLN A 3 22.059 -8.341 -6.808 1.00 0.00 C ATOM 19 CG GLN A 3 23.385 -8.756 -6.161 1.00 0.00 C ATOM 20 CD GLN A 3 23.857 -7.754 -5.113 1.00 0.00 C ATOM 21 OE1 GLN A 3 23.464 -6.587 -5.127 1.00 0.00 O ATOM 22 NE2 GLN A 3 24.704 -8.202 -4.188 1.00 0.00 N ATOM 0 H GLN A 3 19.869 -10.106 -6.096 1.00 0.00 H new ATOM 0 HA GLN A 3 21.207 -7.784 -4.906 1.00 0.00 H new ATOM 0 HB2 GLN A 3 21.821 -9.032 -7.617 1.00 0.00 H new ATOM 0 HB3 GLN A 3 22.170 -7.353 -7.255 1.00 0.00 H new ATOM 0 HG2 GLN A 3 23.269 -9.736 -5.697 1.00 0.00 H new ATOM 0 HG3 GLN A 3 24.148 -8.857 -6.933 1.00 0.00 H new ATOM 0 HE21 GLN A 3 25.010 -9.175 -4.205 1.00 0.00 H new ATOM 0 HE22 GLN A 3 25.047 -7.572 -3.463 1.00 0.00 H new ATOM 31 N PHE A 4 19.808 -6.277 -6.564 1.00 0.00 N ATOM 32 CA PHE A 4 18.773 -5.445 -7.168 1.00 0.00 C ATOM 33 C PHE A 4 19.448 -4.144 -7.549 1.00 0.00 C ATOM 34 O PHE A 4 19.255 -3.597 -8.629 1.00 0.00 O ATOM 35 CB PHE A 4 17.699 -5.158 -6.116 1.00 0.00 C ATOM 36 CG PHE A 4 16.686 -4.099 -6.500 1.00 0.00 C ATOM 37 CD1 PHE A 4 16.958 -2.732 -6.312 1.00 0.00 C ATOM 38 CD2 PHE A 4 15.453 -4.490 -7.036 1.00 0.00 C ATOM 39 CE1 PHE A 4 15.991 -1.767 -6.631 1.00 0.00 C ATOM 40 CE2 PHE A 4 14.493 -3.522 -7.364 1.00 0.00 C ATOM 41 CZ PHE A 4 14.767 -2.158 -7.187 1.00 0.00 C ATOM 0 H PHE A 4 20.623 -5.750 -6.249 1.00 0.00 H new ATOM 0 HA PHE A 4 18.313 -5.928 -8.030 1.00 0.00 H new ATOM 0 HB2 PHE A 4 17.168 -6.085 -5.900 1.00 0.00 H new ATOM 0 HB3 PHE A 4 18.190 -4.850 -5.193 1.00 0.00 H new ATOM 0 HD1 PHE A 4 17.916 -2.424 -5.920 1.00 0.00 H new ATOM 0 HD2 PHE A 4 15.241 -5.537 -7.197 1.00 0.00 H new ATOM 0 HE1 PHE A 4 16.191 -0.722 -6.448 1.00 0.00 H new ATOM 0 HE2 PHE A 4 13.535 -3.829 -7.756 1.00 0.00 H new ATOM 0 HZ PHE A 4 14.039 -1.415 -7.477 1.00 0.00 H new ATOM 51 N GLU A 5 20.256 -3.676 -6.606 1.00 0.00 N ATOM 52 CA GLU A 5 21.054 -2.484 -6.728 1.00 0.00 C ATOM 53 C GLU A 5 21.941 -2.498 -7.960 1.00 0.00 C ATOM 54 O GLU A 5 22.121 -1.462 -8.592 1.00 0.00 O ATOM 55 CB GLU A 5 21.953 -2.439 -5.509 1.00 0.00 C ATOM 56 CG GLU A 5 21.138 -2.227 -4.233 1.00 0.00 C ATOM 57 CD GLU A 5 22.044 -2.130 -3.008 1.00 0.00 C ATOM 58 OE1 GLU A 5 22.486 -1.000 -2.703 1.00 0.00 O ATOM 59 OE2 GLU A 5 22.291 -3.189 -2.384 1.00 0.00 O ATOM 0 H GLU A 5 20.371 -4.141 -5.705 1.00 0.00 H new ATOM 0 HA GLU A 5 20.390 -1.624 -6.811 1.00 0.00 H new ATOM 0 HB2 GLU A 5 22.517 -3.369 -5.434 1.00 0.00 H new ATOM 0 HB3 GLU A 5 22.680 -1.634 -5.618 1.00 0.00 H new ATOM 0 HG2 GLU A 5 20.546 -1.316 -4.324 1.00 0.00 H new ATOM 0 HG3 GLU A 5 20.437 -3.052 -4.105 1.00 0.00 H new ATOM 66 N LYS A 6 22.504 -3.655 -8.318 1.00 0.00 N ATOM 67 CA LYS A 6 23.497 -3.686 -9.350 1.00 0.00 C ATOM 68 C LYS A 6 22.914 -3.371 -10.707 1.00 0.00 C ATOM 69 O LYS A 6 23.411 -2.470 -11.364 1.00 0.00 O ATOM 70 CB LYS A 6 24.117 -5.051 -9.335 1.00 0.00 C ATOM 71 CG LYS A 6 25.240 -5.091 -10.346 1.00 0.00 C ATOM 72 CD LYS A 6 26.011 -6.362 -10.040 1.00 0.00 C ATOM 73 CE LYS A 6 27.034 -6.123 -8.930 1.00 0.00 C ATOM 74 NZ LYS A 6 27.786 -7.356 -8.625 1.00 0.00 N ATOM 0 H LYS A 6 22.282 -4.561 -7.905 1.00 0.00 H new ATOM 0 HA LYS A 6 24.248 -2.919 -9.160 1.00 0.00 H new ATOM 0 HB2 LYS A 6 24.498 -5.281 -8.340 1.00 0.00 H new ATOM 0 HB3 LYS A 6 23.369 -5.807 -9.573 1.00 0.00 H new ATOM 0 HG2 LYS A 6 24.852 -5.102 -11.364 1.00 0.00 H new ATOM 0 HG3 LYS A 6 25.879 -4.213 -10.258 1.00 0.00 H new ATOM 0 HD2 LYS A 6 25.319 -7.149 -9.740 1.00 0.00 H new ATOM 0 HD3 LYS A 6 26.519 -6.710 -10.940 1.00 0.00 H new ATOM 0 HE2 LYS A 6 27.726 -5.337 -9.232 1.00 0.00 H new ATOM 0 HE3 LYS A 6 26.525 -5.772 -8.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 28.473 -7.165 -7.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 27.126 -8.097 -8.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 28.289 -7.675 -9.477 1.00 0.00 H new ATOM 88 N GLN A 7 21.876 -4.089 -11.135 1.00 0.00 N ATOM 89 CA GLN A 7 21.201 -3.837 -12.400 1.00 0.00 C ATOM 90 C GLN A 7 20.608 -2.427 -12.422 1.00 0.00 C ATOM 91 O GLN A 7 20.302 -1.902 -13.489 1.00 0.00 O ATOM 92 CB GLN A 7 20.112 -4.892 -12.526 1.00 0.00 C ATOM 93 CG GLN A 7 20.760 -6.277 -12.431 1.00 0.00 C ATOM 94 CD GLN A 7 20.576 -7.031 -13.729 1.00 0.00 C ATOM 95 OE1 GLN A 7 21.520 -7.247 -14.484 1.00 0.00 O ATOM 96 NE2 GLN A 7 19.343 -7.427 -13.994 1.00 0.00 N ATOM 0 H GLN A 7 21.480 -4.867 -10.607 1.00 0.00 H new ATOM 0 HA GLN A 7 21.896 -3.897 -13.238 1.00 0.00 H new ATOM 0 HB2 GLN A 7 19.370 -4.766 -11.737 1.00 0.00 H new ATOM 0 HB3 GLN A 7 19.588 -4.784 -13.476 1.00 0.00 H new ATOM 0 HG2 GLN A 7 21.822 -6.175 -12.209 1.00 0.00 H new ATOM 0 HG3 GLN A 7 20.315 -6.839 -11.610 1.00 0.00 H new ATOM 0 HE21 GLN A 7 18.590 -7.225 -13.336 1.00 0.00 H new ATOM 0 HE22 GLN A 7 19.145 -7.935 -14.856 1.00 0.00 H new ATOM 105 N LYS A 8 20.448 -1.818 -11.237 1.00 0.00 N ATOM 106 CA LYS A 8 19.938 -0.467 -11.076 1.00 0.00 C ATOM 107 C LYS A 8 21.074 0.559 -11.090 1.00 0.00 C ATOM 108 O LYS A 8 20.837 1.751 -10.932 1.00 0.00 O ATOM 109 CB LYS A 8 19.219 -0.442 -9.742 1.00 0.00 C ATOM 110 CG LYS A 8 18.264 0.738 -9.629 1.00 0.00 C ATOM 111 CD LYS A 8 17.740 0.758 -8.200 1.00 0.00 C ATOM 112 CE LYS A 8 18.921 0.974 -7.257 1.00 0.00 C ATOM 113 NZ LYS A 8 18.524 1.693 -6.030 1.00 0.00 N ATOM 0 H LYS A 8 20.677 -2.269 -10.351 1.00 0.00 H new ATOM 0 HA LYS A 8 19.270 -0.205 -11.897 1.00 0.00 H new ATOM 0 HB2 LYS A 8 18.664 -1.371 -9.612 1.00 0.00 H new ATOM 0 HB3 LYS A 8 19.952 -0.393 -8.936 1.00 0.00 H new ATOM 0 HG2 LYS A 8 18.776 1.671 -9.864 1.00 0.00 H new ATOM 0 HG3 LYS A 8 17.443 0.638 -10.339 1.00 0.00 H new ATOM 0 HD2 LYS A 8 17.006 1.554 -8.076 1.00 0.00 H new ATOM 0 HD3 LYS A 8 17.236 -0.180 -7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 8 19.352 0.009 -6.989 1.00 0.00 H new ATOM 0 HE3 LYS A 8 19.698 1.538 -7.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 19.001 1.269 -5.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 18.797 2.693 -6.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 17.494 1.624 -5.905 1.00 0.00 H new ATOM 127 N GLU A 9 22.306 0.081 -11.281 1.00 0.00 N ATOM 128 CA GLU A 9 23.520 0.881 -11.442 1.00 0.00 C ATOM 129 C GLU A 9 24.216 0.521 -12.751 1.00 0.00 C ATOM 130 O GLU A 9 24.882 1.349 -13.368 1.00 0.00 O ATOM 131 CB GLU A 9 24.456 0.596 -10.273 1.00 0.00 C ATOM 132 CG GLU A 9 23.773 1.009 -8.978 1.00 0.00 C ATOM 133 CD GLU A 9 24.252 2.370 -8.488 1.00 0.00 C ATOM 134 OE1 GLU A 9 24.122 3.343 -9.264 1.00 0.00 O ATOM 135 OE2 GLU A 9 24.747 2.429 -7.340 1.00 0.00 O ATOM 0 H GLU A 9 22.492 -0.921 -11.330 1.00 0.00 H new ATOM 0 HA GLU A 9 23.258 1.939 -11.463 1.00 0.00 H new ATOM 0 HB2 GLU A 9 24.709 -0.464 -10.243 1.00 0.00 H new ATOM 0 HB3 GLU A 9 25.390 1.144 -10.397 1.00 0.00 H new ATOM 0 HG2 GLU A 9 22.694 1.038 -9.131 1.00 0.00 H new ATOM 0 HG3 GLU A 9 23.966 0.259 -8.211 1.00 0.00 H new ATOM 142 N GLN A 10 24.046 -0.730 -13.169 1.00 0.00 N ATOM 143 CA GLN A 10 24.444 -1.218 -14.482 1.00 0.00 C ATOM 144 C GLN A 10 23.585 -0.585 -15.571 1.00 0.00 C ATOM 145 O GLN A 10 24.097 0.132 -16.426 1.00 0.00 O ATOM 146 CB GLN A 10 24.397 -2.752 -14.435 1.00 0.00 C ATOM 147 CG GLN A 10 23.546 -3.472 -15.464 1.00 0.00 C ATOM 148 CD GLN A 10 24.007 -3.278 -16.895 1.00 0.00 C ATOM 149 OE1 GLN A 10 25.188 -3.076 -17.171 1.00 0.00 O ATOM 150 NE2 GLN A 10 23.053 -3.339 -17.815 1.00 0.00 N ATOM 0 H GLN A 10 23.616 -1.449 -12.587 1.00 0.00 H new ATOM 0 HA GLN A 10 25.462 -0.926 -14.738 1.00 0.00 H new ATOM 0 HB2 GLN A 10 25.419 -3.120 -14.530 1.00 0.00 H new ATOM 0 HB3 GLN A 10 24.044 -3.045 -13.446 1.00 0.00 H new ATOM 0 HG2 GLN A 10 23.544 -4.538 -15.236 1.00 0.00 H new ATOM 0 HG3 GLN A 10 22.517 -3.125 -15.375 1.00 0.00 H new ATOM 0 HE21 GLN A 10 22.086 -3.509 -17.537 1.00 0.00 H new ATOM 0 HE22 GLN A 10 23.286 -3.216 -18.800 1.00 0.00 H new ATOM 159 N GLY A 11 22.281 -0.844 -15.533 1.00 0.00 N ATOM 160 CA GLY A 11 21.335 -0.291 -16.491 1.00 0.00 C ATOM 161 C GLY A 11 21.184 1.214 -16.296 1.00 0.00 C ATOM 162 O GLY A 11 20.682 1.915 -17.170 1.00 0.00 O ATOM 0 H GLY A 11 21.851 -1.447 -14.832 1.00 0.00 H new ATOM 0 HA2 GLY A 11 21.675 -0.498 -17.506 1.00 0.00 H new ATOM 0 HA3 GLY A 11 20.366 -0.776 -16.374 1.00 0.00 H new ATOM 166 N ASN A 12 21.629 1.699 -15.134 1.00 0.00 N ATOM 167 CA ASN A 12 21.620 3.102 -14.755 1.00 0.00 C ATOM 168 C ASN A 12 22.410 3.938 -15.745 1.00 0.00 C ATOM 169 O ASN A 12 22.210 5.145 -15.801 1.00 0.00 O ATOM 170 CB ASN A 12 22.268 3.176 -13.380 1.00 0.00 C ATOM 171 CG ASN A 12 21.982 4.414 -12.541 1.00 0.00 C ATOM 172 OD1 ASN A 12 21.779 5.514 -13.047 1.00 0.00 O ATOM 173 ND2 ASN A 12 21.967 4.209 -11.226 1.00 0.00 N ATOM 0 H ASN A 12 22.019 1.097 -14.409 1.00 0.00 H new ATOM 0 HA ASN A 12 20.603 3.493 -14.745 1.00 0.00 H new ATOM 0 HB2 ASN A 12 21.952 2.302 -12.810 1.00 0.00 H new ATOM 0 HB3 ASN A 12 23.347 3.099 -13.511 1.00 0.00 H new ATOM 0 HD21 ASN A 12 21.781 4.985 -10.591 1.00 0.00 H new ATOM 0 HD22 ASN A 12 22.142 3.276 -10.853 1.00 0.00 H new ATOM 180 N SER A 13 23.303 3.315 -16.526 1.00 0.00 N ATOM 181 CA SER A 13 24.059 4.067 -17.516 1.00 0.00 C ATOM 182 C SER A 13 23.716 3.623 -18.933 1.00 0.00 C ATOM 183 O SER A 13 23.953 4.375 -19.872 1.00 0.00 O ATOM 184 CB SER A 13 25.554 3.957 -17.233 1.00 0.00 C ATOM 185 OG SER A 13 25.825 4.365 -15.908 1.00 0.00 O ATOM 0 H SER A 13 23.511 2.317 -16.489 1.00 0.00 H new ATOM 0 HA SER A 13 23.778 5.117 -17.440 1.00 0.00 H new ATOM 0 HB2 SER A 13 25.886 2.929 -17.381 1.00 0.00 H new ATOM 0 HB3 SER A 13 26.112 4.577 -17.935 1.00 0.00 H new ATOM 0 HG SER A 13 26.786 4.290 -15.733 1.00 0.00 H new ATOM 191 N LEU A 14 23.163 2.422 -19.122 1.00 0.00 N ATOM 192 CA LEU A 14 22.711 2.008 -20.443 1.00 0.00 C ATOM 193 C LEU A 14 21.542 2.890 -20.885 1.00 0.00 C ATOM 194 O LEU A 14 21.334 3.105 -22.076 1.00 0.00 O ATOM 195 CB LEU A 14 22.306 0.529 -20.404 1.00 0.00 C ATOM 196 CG LEU A 14 23.493 -0.405 -20.602 1.00 0.00 C ATOM 197 CD1 LEU A 14 24.164 -0.554 -19.262 1.00 0.00 C ATOM 198 CD2 LEU A 14 23.041 -1.791 -21.053 1.00 0.00 C ATOM 0 H LEU A 14 23.021 1.731 -18.385 1.00 0.00 H new ATOM 0 HA LEU A 14 23.518 2.124 -21.166 1.00 0.00 H new ATOM 0 HB2 LEU A 14 21.831 0.311 -19.447 1.00 0.00 H new ATOM 0 HB3 LEU A 14 21.564 0.338 -21.179 1.00 0.00 H new ATOM 0 HG LEU A 14 24.155 0.009 -21.363 1.00 0.00 H new ATOM 0 HD11 LEU A 14 25.023 -1.218 -19.357 1.00 0.00 H new ATOM 0 HD12 LEU A 14 24.497 0.423 -18.911 1.00 0.00 H new ATOM 0 HD13 LEU A 14 23.458 -0.975 -18.546 1.00 0.00 H new ATOM 0 HD21 LEU A 14 23.912 -2.433 -21.185 1.00 0.00 H new ATOM 0 HD22 LEU A 14 22.383 -2.223 -20.298 1.00 0.00 H new ATOM 0 HD23 LEU A 14 22.504 -1.709 -21.998 1.00 0.00 H new ATOM 210 N PHE A 15 20.779 3.411 -19.919 1.00 0.00 N ATOM 211 CA PHE A 15 19.676 4.313 -20.188 1.00 0.00 C ATOM 212 C PHE A 15 20.212 5.668 -20.624 1.00 0.00 C ATOM 213 O PHE A 15 19.623 6.321 -21.481 1.00 0.00 O ATOM 214 CB PHE A 15 18.880 4.455 -18.894 1.00 0.00 C ATOM 215 CG PHE A 15 18.128 5.754 -18.702 1.00 0.00 C ATOM 216 CD1 PHE A 15 17.014 6.055 -19.495 1.00 0.00 C ATOM 217 CD2 PHE A 15 18.542 6.655 -17.710 1.00 0.00 C ATOM 218 CE1 PHE A 15 16.301 7.246 -19.287 1.00 0.00 C ATOM 219 CE2 PHE A 15 17.797 7.810 -17.456 1.00 0.00 C ATOM 220 CZ PHE A 15 16.690 8.118 -18.259 1.00 0.00 C ATOM 0 H PHE A 15 20.917 3.213 -18.928 1.00 0.00 H new ATOM 0 HA PHE A 15 19.043 3.926 -20.987 1.00 0.00 H new ATOM 0 HB2 PHE A 15 18.163 3.635 -18.843 1.00 0.00 H new ATOM 0 HB3 PHE A 15 19.566 4.331 -18.056 1.00 0.00 H new ATOM 0 HD1 PHE A 15 16.703 5.369 -20.269 1.00 0.00 H new ATOM 0 HD2 PHE A 15 19.438 6.456 -17.141 1.00 0.00 H new ATOM 0 HE1 PHE A 15 15.457 7.490 -19.915 1.00 0.00 H new ATOM 0 HE2 PHE A 15 18.074 8.464 -16.642 1.00 0.00 H new ATOM 0 HZ PHE A 15 16.135 9.028 -18.086 1.00 0.00 H new ATOM 230 N LYS A 16 21.332 6.089 -20.033 1.00 0.00 N ATOM 231 CA LYS A 16 21.868 7.415 -20.277 1.00 0.00 C ATOM 232 C LYS A 16 22.709 7.490 -21.556 1.00 0.00 C ATOM 233 O LYS A 16 23.131 8.579 -21.940 1.00 0.00 O ATOM 234 CB LYS A 16 22.708 7.822 -19.070 1.00 0.00 C ATOM 235 CG LYS A 16 21.962 7.468 -17.791 1.00 0.00 C ATOM 236 CD LYS A 16 22.725 7.970 -16.571 1.00 0.00 C ATOM 237 CE LYS A 16 22.508 9.473 -16.398 1.00 0.00 C ATOM 238 NZ LYS A 16 23.115 9.952 -15.145 1.00 0.00 N ATOM 0 H LYS A 16 21.880 5.525 -19.383 1.00 0.00 H new ATOM 0 HA LYS A 16 21.032 8.100 -20.420 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.671 7.312 -19.095 1.00 0.00 H new ATOM 0 HB3 LYS A 16 22.913 8.892 -19.100 1.00 0.00 H new ATOM 0 HG2 LYS A 16 20.965 7.909 -17.811 1.00 0.00 H new ATOM 0 HG3 LYS A 16 21.831 6.388 -17.726 1.00 0.00 H new ATOM 0 HD2 LYS A 16 22.389 7.441 -15.679 1.00 0.00 H new ATOM 0 HD3 LYS A 16 23.788 7.759 -16.685 1.00 0.00 H new ATOM 0 HE2 LYS A 16 22.942 10.007 -17.244 1.00 0.00 H new ATOM 0 HE3 LYS A 16 21.440 9.692 -16.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 22.813 10.931 -14.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 22.810 9.345 -14.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 24.151 9.919 -15.226 1.00 0.00 H new ATOM 252 N GLN A 17 22.958 6.352 -22.214 1.00 0.00 N ATOM 253 CA GLN A 17 23.821 6.265 -23.381 1.00 0.00 C ATOM 254 C GLN A 17 23.053 6.331 -24.693 1.00 0.00 C ATOM 255 O GLN A 17 23.631 6.685 -25.719 1.00 0.00 O ATOM 256 CB GLN A 17 24.556 4.924 -23.333 1.00 0.00 C ATOM 257 CG GLN A 17 25.750 5.037 -22.392 1.00 0.00 C ATOM 258 CD GLN A 17 26.595 3.771 -22.448 1.00 0.00 C ATOM 259 OE1 GLN A 17 27.681 3.762 -23.018 1.00 0.00 O ATOM 260 NE2 GLN A 17 26.095 2.691 -21.855 1.00 0.00 N ATOM 0 H GLN A 17 22.556 5.456 -21.940 1.00 0.00 H new ATOM 0 HA GLN A 17 24.501 7.116 -23.350 1.00 0.00 H new ATOM 0 HB2 GLN A 17 23.882 4.139 -22.991 1.00 0.00 H new ATOM 0 HB3 GLN A 17 24.891 4.644 -24.332 1.00 0.00 H new ATOM 0 HG2 GLN A 17 26.357 5.899 -22.668 1.00 0.00 H new ATOM 0 HG3 GLN A 17 25.403 5.205 -21.373 1.00 0.00 H new ATOM 0 HE21 GLN A 17 25.188 2.738 -21.391 1.00 0.00 H new ATOM 0 HE22 GLN A 17 26.619 1.816 -21.864 1.00 0.00 H new ATOM 269 N GLY A 18 21.759 5.996 -24.675 1.00 0.00 N ATOM 270 CA GLY A 18 20.978 5.958 -25.903 1.00 0.00 C ATOM 271 C GLY A 18 20.150 4.705 -26.045 1.00 0.00 C ATOM 272 O GLY A 18 19.226 4.643 -26.854 1.00 0.00 O ATOM 0 H GLY A 18 21.240 5.751 -23.832 1.00 0.00 H new ATOM 0 HA2 GLY A 18 20.319 6.826 -25.933 1.00 0.00 H new ATOM 0 HA3 GLY A 18 21.651 6.039 -26.756 1.00 0.00 H new ATOM 276 N LEU A 19 20.499 3.704 -25.246 1.00 0.00 N ATOM 277 CA LEU A 19 20.002 2.365 -25.407 1.00 0.00 C ATOM 278 C LEU A 19 19.076 2.025 -24.262 1.00 0.00 C ATOM 279 O LEU A 19 19.297 1.114 -23.465 1.00 0.00 O ATOM 280 CB LEU A 19 21.160 1.415 -25.663 1.00 0.00 C ATOM 281 CG LEU A 19 22.468 1.682 -24.905 1.00 0.00 C ATOM 282 CD1 LEU A 19 22.584 0.741 -23.711 1.00 0.00 C ATOM 283 CD2 LEU A 19 23.673 1.427 -25.808 1.00 0.00 C ATOM 0 H LEU A 19 21.143 3.812 -24.462 1.00 0.00 H new ATOM 0 HA LEU A 19 19.376 2.262 -26.293 1.00 0.00 H new ATOM 0 HB2 LEU A 19 20.829 0.405 -25.420 1.00 0.00 H new ATOM 0 HB3 LEU A 19 21.379 1.430 -26.731 1.00 0.00 H new ATOM 0 HG LEU A 19 22.454 2.722 -24.577 1.00 0.00 H new ATOM 0 HD11 LEU A 19 23.515 0.939 -23.181 1.00 0.00 H new ATOM 0 HD12 LEU A 19 21.742 0.902 -23.038 1.00 0.00 H new ATOM 0 HD13 LEU A 19 22.578 -0.292 -24.060 1.00 0.00 H new ATOM 0 HD21 LEU A 19 24.591 1.622 -25.253 1.00 0.00 H new ATOM 0 HD22 LEU A 19 23.664 0.390 -26.142 1.00 0.00 H new ATOM 0 HD23 LEU A 19 23.625 2.088 -26.674 1.00 0.00 H new ATOM 295 N TYR A 20 18.014 2.821 -24.226 1.00 0.00 N ATOM 296 CA TYR A 20 16.948 2.770 -23.254 1.00 0.00 C ATOM 297 C TYR A 20 16.449 1.351 -23.060 1.00 0.00 C ATOM 298 O TYR A 20 16.122 0.973 -21.942 1.00 0.00 O ATOM 299 CB TYR A 20 15.842 3.678 -23.793 1.00 0.00 C ATOM 300 CG TYR A 20 16.395 5.008 -24.244 1.00 0.00 C ATOM 301 CD1 TYR A 20 17.184 5.769 -23.367 1.00 0.00 C ATOM 302 CD2 TYR A 20 16.142 5.466 -25.545 1.00 0.00 C ATOM 303 CE1 TYR A 20 17.731 6.988 -23.796 1.00 0.00 C ATOM 304 CE2 TYR A 20 16.690 6.682 -25.978 1.00 0.00 C ATOM 305 CZ TYR A 20 17.487 7.448 -25.106 1.00 0.00 C ATOM 306 OH TYR A 20 18.021 8.627 -25.531 1.00 0.00 O ATOM 0 H TYR A 20 17.873 3.558 -24.917 1.00 0.00 H new ATOM 0 HA TYR A 20 17.290 3.104 -22.275 1.00 0.00 H new ATOM 0 HB2 TYR A 20 15.341 3.188 -24.628 1.00 0.00 H new ATOM 0 HB3 TYR A 20 15.091 3.838 -23.020 1.00 0.00 H new ATOM 0 HD1 TYR A 20 17.370 5.417 -22.363 1.00 0.00 H new ATOM 0 HD2 TYR A 20 15.526 4.883 -26.213 1.00 0.00 H new ATOM 0 HE1 TYR A 20 18.339 7.574 -23.122 1.00 0.00 H new ATOM 0 HE2 TYR A 20 16.500 7.032 -26.982 1.00 0.00 H new ATOM 0 HH TYR A 20 17.753 8.792 -26.459 1.00 0.00 H new ATOM 316 N ARG A 21 16.388 0.554 -24.128 1.00 0.00 N ATOM 317 CA ARG A 21 15.859 -0.798 -24.038 1.00 0.00 C ATOM 318 C ARG A 21 16.881 -1.713 -23.384 1.00 0.00 C ATOM 319 O ARG A 21 16.526 -2.556 -22.567 1.00 0.00 O ATOM 320 CB ARG A 21 15.595 -1.283 -25.459 1.00 0.00 C ATOM 321 CG ARG A 21 14.412 -2.233 -25.531 1.00 0.00 C ATOM 322 CD ARG A 21 14.368 -3.236 -24.377 1.00 0.00 C ATOM 323 NE ARG A 21 13.316 -4.239 -24.579 1.00 0.00 N ATOM 324 CZ ARG A 21 12.006 -4.021 -24.409 1.00 0.00 C ATOM 325 NH1 ARG A 21 11.555 -2.827 -24.032 1.00 0.00 N ATOM 326 NH2 ARG A 21 11.139 -5.005 -24.619 1.00 0.00 N ATOM 0 H ARG A 21 16.699 0.825 -25.061 1.00 0.00 H new ATOM 0 HA ARG A 21 14.946 -0.808 -23.442 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.410 -0.425 -26.105 1.00 0.00 H new ATOM 0 HB3 ARG A 21 16.485 -1.784 -25.841 1.00 0.00 H new ATOM 0 HG2 ARG A 21 13.489 -1.653 -25.534 1.00 0.00 H new ATOM 0 HG3 ARG A 21 14.449 -2.777 -26.475 1.00 0.00 H new ATOM 0 HD2 ARG A 21 15.334 -3.733 -24.288 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.194 -2.707 -23.440 1.00 0.00 H new ATOM 0 HE ARG A 21 13.605 -5.173 -24.871 1.00 0.00 H new ATOM 0 HH11 ARG A 21 12.210 -2.063 -23.868 1.00 0.00 H new ATOM 0 HH12 ARG A 21 10.554 -2.676 -23.907 1.00 0.00 H new ATOM 0 HH21 ARG A 21 11.472 -5.925 -24.909 1.00 0.00 H new ATOM 0 HH22 ARG A 21 10.141 -4.841 -24.490 1.00 0.00 H new ATOM 340 N GLU A 22 18.153 -1.544 -23.738 1.00 0.00 N ATOM 341 CA GLU A 22 19.213 -2.328 -23.139 1.00 0.00 C ATOM 342 C GLU A 22 19.356 -1.948 -21.662 1.00 0.00 C ATOM 343 O GLU A 22 20.016 -2.643 -20.894 1.00 0.00 O ATOM 344 CB GLU A 22 20.527 -2.100 -23.882 1.00 0.00 C ATOM 345 CG GLU A 22 20.395 -2.463 -25.360 1.00 0.00 C ATOM 346 CD GLU A 22 21.720 -2.313 -26.107 1.00 0.00 C ATOM 347 OE1 GLU A 22 22.722 -2.902 -25.639 1.00 0.00 O ATOM 348 OE2 GLU A 22 21.719 -1.611 -27.141 1.00 0.00 O ATOM 0 H GLU A 22 18.467 -0.870 -24.436 1.00 0.00 H new ATOM 0 HA GLU A 22 18.963 -3.386 -23.211 1.00 0.00 H new ATOM 0 HB2 GLU A 22 20.826 -1.056 -23.786 1.00 0.00 H new ATOM 0 HB3 GLU A 22 21.315 -2.700 -23.426 1.00 0.00 H new ATOM 0 HG2 GLU A 22 20.042 -3.490 -25.451 1.00 0.00 H new ATOM 0 HG3 GLU A 22 19.643 -1.825 -25.824 1.00 0.00 H new ATOM 355 N ALA A 23 18.728 -0.841 -21.263 1.00 0.00 N ATOM 356 CA ALA A 23 18.581 -0.482 -19.873 1.00 0.00 C ATOM 357 C ALA A 23 17.380 -1.220 -19.271 1.00 0.00 C ATOM 358 O ALA A 23 17.517 -1.846 -18.221 1.00 0.00 O ATOM 359 CB ALA A 23 18.411 1.036 -19.786 1.00 0.00 C ATOM 0 H ALA A 23 18.308 -0.172 -21.908 1.00 0.00 H new ATOM 0 HA ALA A 23 19.463 -0.773 -19.302 1.00 0.00 H new ATOM 0 HB1 ALA A 23 18.298 1.330 -18.743 1.00 0.00 H new ATOM 0 HB2 ALA A 23 19.289 1.525 -20.208 1.00 0.00 H new ATOM 0 HB3 ALA A 23 17.525 1.336 -20.345 1.00 0.00 H new ATOM 365 N VAL A 24 16.200 -1.161 -19.910 1.00 0.00 N ATOM 366 CA VAL A 24 14.994 -1.750 -19.375 1.00 0.00 C ATOM 367 C VAL A 24 15.059 -3.253 -19.285 1.00 0.00 C ATOM 368 O VAL A 24 14.560 -3.860 -18.347 1.00 0.00 O ATOM 369 CB VAL A 24 13.745 -1.377 -20.166 1.00 0.00 C ATOM 370 CG1 VAL A 24 13.777 -0.066 -20.920 1.00 0.00 C ATOM 371 CG2 VAL A 24 13.052 -2.504 -20.904 1.00 0.00 C ATOM 0 H VAL A 24 16.071 -0.700 -20.811 1.00 0.00 H new ATOM 0 HA VAL A 24 14.923 -1.332 -18.371 1.00 0.00 H new ATOM 0 HB VAL A 24 13.067 -1.161 -19.340 1.00 0.00 H new ATOM 0 HG11 VAL A 24 12.829 0.078 -21.439 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.935 0.753 -20.219 1.00 0.00 H new ATOM 0 HG13 VAL A 24 14.589 -0.084 -21.646 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.179 -2.114 -21.428 1.00 0.00 H new ATOM 0 HG22 VAL A 24 13.741 -2.944 -21.625 1.00 0.00 H new ATOM 0 HG23 VAL A 24 12.737 -3.266 -20.191 1.00 0.00 H new ATOM 381 N HIS A 25 15.681 -3.860 -20.283 1.00 0.00 N ATOM 382 CA HIS A 25 15.776 -5.299 -20.344 1.00 0.00 C ATOM 383 C HIS A 25 16.679 -5.868 -19.243 1.00 0.00 C ATOM 384 O HIS A 25 16.909 -7.077 -19.190 1.00 0.00 O ATOM 385 CB HIS A 25 16.129 -5.736 -21.767 1.00 0.00 C ATOM 386 CG HIS A 25 17.593 -5.785 -22.098 1.00 0.00 C ATOM 387 ND1 HIS A 25 18.164 -6.632 -23.051 1.00 0.00 N ATOM 388 CD2 HIS A 25 18.564 -5.014 -21.536 1.00 0.00 C ATOM 389 CE1 HIS A 25 19.473 -6.347 -23.036 1.00 0.00 C ATOM 390 NE2 HIS A 25 19.748 -5.397 -22.126 1.00 0.00 N ATOM 0 H HIS A 25 16.126 -3.372 -21.060 1.00 0.00 H new ATOM 0 HA HIS A 25 14.803 -5.738 -20.125 1.00 0.00 H new ATOM 0 HB2 HIS A 25 15.705 -6.726 -21.937 1.00 0.00 H new ATOM 0 HB3 HIS A 25 15.642 -5.056 -22.466 1.00 0.00 H new ATOM 0 HD2 HIS A 25 18.432 -4.255 -20.779 1.00 0.00 H new ATOM 0 HE1 HIS A 25 20.209 -6.818 -23.671 1.00 0.00 H new ATOM 0 HE2 HIS A 25 20.673 -5.025 -21.910 1.00 0.00 H new ATOM 398 N CYS A 26 17.188 -4.996 -18.363 1.00 0.00 N ATOM 399 CA CYS A 26 17.905 -5.366 -17.152 1.00 0.00 C ATOM 400 C CYS A 26 17.188 -4.751 -15.949 1.00 0.00 C ATOM 401 O CYS A 26 17.253 -5.286 -14.843 1.00 0.00 O ATOM 402 CB CYS A 26 19.352 -4.870 -17.234 1.00 0.00 C ATOM 403 SG CYS A 26 20.206 -5.719 -18.587 1.00 0.00 S ATOM 0 H CYS A 26 17.106 -3.987 -18.484 1.00 0.00 H new ATOM 0 HA CYS A 26 17.924 -6.450 -17.042 1.00 0.00 H new ATOM 0 HB2 CYS A 26 19.370 -3.793 -17.398 1.00 0.00 H new ATOM 0 HB3 CYS A 26 19.866 -5.057 -16.291 1.00 0.00 H new ATOM 0 HG CYS A 26 21.388 -5.201 -18.747 1.00 0.00 H new ATOM 409 N TYR A 27 16.497 -3.629 -16.166 1.00 0.00 N ATOM 410 CA TYR A 27 15.588 -3.019 -15.205 1.00 0.00 C ATOM 411 C TYR A 27 14.437 -3.965 -14.902 1.00 0.00 C ATOM 412 O TYR A 27 13.936 -3.981 -13.785 1.00 0.00 O ATOM 413 CB TYR A 27 14.979 -1.790 -15.867 1.00 0.00 C ATOM 414 CG TYR A 27 15.866 -0.589 -16.059 1.00 0.00 C ATOM 415 CD1 TYR A 27 17.111 -0.479 -15.419 1.00 0.00 C ATOM 416 CD2 TYR A 27 15.395 0.457 -16.868 1.00 0.00 C ATOM 417 CE1 TYR A 27 17.864 0.695 -15.556 1.00 0.00 C ATOM 418 CE2 TYR A 27 16.134 1.636 -17.002 1.00 0.00 C ATOM 419 CZ TYR A 27 17.371 1.759 -16.339 1.00 0.00 C ATOM 420 OH TYR A 27 18.086 2.910 -16.448 1.00 0.00 O ATOM 0 H TYR A 27 16.560 -3.109 -17.041 1.00 0.00 H new ATOM 0 HA TYR A 27 16.132 -2.780 -14.291 1.00 0.00 H new ATOM 0 HB2 TYR A 27 14.601 -2.088 -16.845 1.00 0.00 H new ATOM 0 HB3 TYR A 27 14.119 -1.481 -15.274 1.00 0.00 H new ATOM 0 HD1 TYR A 27 17.487 -1.297 -14.823 1.00 0.00 H new ATOM 0 HD2 TYR A 27 14.456 0.350 -17.390 1.00 0.00 H new ATOM 0 HE1 TYR A 27 18.820 0.785 -15.063 1.00 0.00 H new ATOM 0 HE2 TYR A 27 15.759 2.447 -17.609 1.00 0.00 H new ATOM 0 HH TYR A 27 19.006 2.700 -16.711 1.00 0.00 H new ATOM 430 N ASP A 28 14.015 -4.753 -15.890 1.00 0.00 N ATOM 431 CA ASP A 28 12.886 -5.656 -15.751 1.00 0.00 C ATOM 432 C ASP A 28 13.146 -6.673 -14.645 1.00 0.00 C ATOM 433 O ASP A 28 12.206 -7.205 -14.055 1.00 0.00 O ATOM 434 CB ASP A 28 12.626 -6.325 -17.099 1.00 0.00 C ATOM 435 CG ASP A 28 11.306 -7.089 -17.095 1.00 0.00 C ATOM 436 OD1 ASP A 28 10.251 -6.417 -17.076 1.00 0.00 O ATOM 437 OD2 ASP A 28 11.363 -8.340 -17.113 1.00 0.00 O ATOM 0 H ASP A 28 14.452 -4.779 -16.811 1.00 0.00 H new ATOM 0 HA ASP A 28 11.994 -5.101 -15.461 1.00 0.00 H new ATOM 0 HB2 ASP A 28 12.609 -5.570 -17.885 1.00 0.00 H new ATOM 0 HB3 ASP A 28 13.443 -7.008 -17.332 1.00 0.00 H new ATOM 442 N GLN A 29 14.421 -6.954 -14.350 1.00 0.00 N ATOM 443 CA GLN A 29 14.757 -7.842 -13.260 1.00 0.00 C ATOM 444 C GLN A 29 14.640 -7.159 -11.898 1.00 0.00 C ATOM 445 O GLN A 29 14.567 -7.844 -10.882 1.00 0.00 O ATOM 446 CB GLN A 29 16.156 -8.423 -13.449 1.00 0.00 C ATOM 447 CG GLN A 29 16.164 -9.393 -14.630 1.00 0.00 C ATOM 448 CD GLN A 29 16.692 -8.767 -15.915 1.00 0.00 C ATOM 449 OE1 GLN A 29 17.895 -8.567 -16.063 1.00 0.00 O ATOM 450 NE2 GLN A 29 15.806 -8.452 -16.853 1.00 0.00 N ATOM 0 H GLN A 29 15.223 -6.576 -14.854 1.00 0.00 H new ATOM 0 HA GLN A 29 14.031 -8.655 -13.276 1.00 0.00 H new ATOM 0 HB2 GLN A 29 16.872 -7.620 -13.623 1.00 0.00 H new ATOM 0 HB3 GLN A 29 16.470 -8.939 -12.542 1.00 0.00 H new ATOM 0 HG2 GLN A 29 16.776 -10.259 -14.377 1.00 0.00 H new ATOM 0 HG3 GLN A 29 15.151 -9.757 -14.800 1.00 0.00 H new ATOM 0 HE21 GLN A 29 14.814 -8.631 -16.698 1.00 0.00 H new ATOM 0 HE22 GLN A 29 16.118 -8.031 -17.728 1.00 0.00 H new ATOM 459 N LEU A 30 14.617 -5.822 -11.849 1.00 0.00 N ATOM 460 CA LEU A 30 14.345 -5.107 -10.605 1.00 0.00 C ATOM 461 C LEU A 30 12.930 -5.455 -10.172 1.00 0.00 C ATOM 462 O LEU A 30 12.665 -5.655 -8.989 1.00 0.00 O ATOM 463 CB LEU A 30 14.417 -3.598 -10.836 1.00 0.00 C ATOM 464 CG LEU A 30 15.762 -3.108 -11.356 1.00 0.00 C ATOM 465 CD1 LEU A 30 15.816 -1.582 -11.301 1.00 0.00 C ATOM 466 CD2 LEU A 30 16.931 -3.669 -10.549 1.00 0.00 C ATOM 0 H LEU A 30 14.783 -5.219 -12.655 1.00 0.00 H new ATOM 0 HA LEU A 30 15.078 -5.390 -9.850 1.00 0.00 H new ATOM 0 HB2 LEU A 30 13.640 -3.313 -11.546 1.00 0.00 H new ATOM 0 HB3 LEU A 30 14.195 -3.088 -9.899 1.00 0.00 H new ATOM 0 HG LEU A 30 15.855 -3.459 -12.384 1.00 0.00 H new ATOM 0 HD11 LEU A 30 16.781 -1.238 -11.674 1.00 0.00 H new ATOM 0 HD12 LEU A 30 15.019 -1.167 -11.919 1.00 0.00 H new ATOM 0 HD13 LEU A 30 15.687 -1.250 -10.271 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.869 -3.292 -10.957 1.00 0.00 H new ATOM 0 HD22 LEU A 30 16.837 -3.359 -9.508 1.00 0.00 H new ATOM 0 HD23 LEU A 30 16.923 -4.758 -10.605 1.00 0.00 H new ATOM 478 N ILE A 31 12.021 -5.532 -11.145 1.00 0.00 N ATOM 479 CA ILE A 31 10.637 -5.840 -10.865 1.00 0.00 C ATOM 480 C ILE A 31 10.462 -7.335 -10.649 1.00 0.00 C ATOM 481 O ILE A 31 9.690 -7.747 -9.802 1.00 0.00 O ATOM 482 CB ILE A 31 9.745 -5.345 -12.009 1.00 0.00 C ATOM 483 CG1 ILE A 31 9.995 -3.875 -12.351 1.00 0.00 C ATOM 484 CG2 ILE A 31 8.325 -5.436 -11.490 1.00 0.00 C ATOM 485 CD1 ILE A 31 10.756 -3.756 -13.662 1.00 0.00 C ATOM 0 H ILE A 31 12.229 -5.383 -12.132 1.00 0.00 H new ATOM 0 HA ILE A 31 10.338 -5.328 -9.950 1.00 0.00 H new ATOM 0 HB ILE A 31 9.943 -5.940 -12.900 1.00 0.00 H new ATOM 0 HG12 ILE A 31 9.045 -3.346 -12.426 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.562 -3.400 -11.550 1.00 0.00 H new ATOM 0 HG21 ILE A 31 7.633 -5.096 -12.261 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.098 -6.470 -11.230 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.220 -4.808 -10.605 1.00 0.00 H new ATOM 0 HD11 ILE A 31 10.925 -2.704 -13.890 1.00 0.00 H new ATOM 0 HD12 ILE A 31 11.715 -4.267 -13.574 1.00 0.00 H new ATOM 0 HD13 ILE A 31 10.174 -4.212 -14.463 1.00 0.00 H new ATOM 497 N THR A 32 11.159 -8.183 -11.390 1.00 0.00 N ATOM 498 CA THR A 32 11.016 -9.611 -11.155 1.00 0.00 C ATOM 499 C THR A 32 11.668 -10.027 -9.836 1.00 0.00 C ATOM 500 O THR A 32 11.247 -11.015 -9.231 1.00 0.00 O ATOM 501 CB THR A 32 11.667 -10.346 -12.323 1.00 0.00 C ATOM 502 OG1 THR A 32 10.904 -10.143 -13.488 1.00 0.00 O ATOM 503 CG2 THR A 32 11.821 -11.844 -12.088 1.00 0.00 C ATOM 0 H THR A 32 11.807 -7.921 -12.133 1.00 0.00 H new ATOM 0 HA THR A 32 9.958 -9.865 -11.083 1.00 0.00 H new ATOM 0 HB THR A 32 12.670 -9.933 -12.429 1.00 0.00 H new ATOM 0 HG1 THR A 32 11.135 -9.277 -13.883 1.00 0.00 H new ATOM 0 HG21 THR A 32 12.291 -12.302 -12.958 1.00 0.00 H new ATOM 0 HG22 THR A 32 12.443 -12.012 -11.209 1.00 0.00 H new ATOM 0 HG23 THR A 32 10.839 -12.290 -11.928 1.00 0.00 H new ATOM 511 N ALA A 33 12.684 -9.289 -9.378 1.00 0.00 N ATOM 512 CA ALA A 33 13.327 -9.605 -8.115 1.00 0.00 C ATOM 513 C ALA A 33 12.551 -8.966 -6.967 1.00 0.00 C ATOM 514 O ALA A 33 12.577 -9.457 -5.842 1.00 0.00 O ATOM 515 CB ALA A 33 14.757 -9.069 -8.123 1.00 0.00 C ATOM 0 H ALA A 33 13.070 -8.479 -9.863 1.00 0.00 H new ATOM 0 HA ALA A 33 13.343 -10.687 -7.981 1.00 0.00 H new ATOM 0 HB1 ALA A 33 15.240 -9.306 -7.175 1.00 0.00 H new ATOM 0 HB2 ALA A 33 15.314 -9.530 -8.939 1.00 0.00 H new ATOM 0 HB3 ALA A 33 14.740 -7.988 -8.261 1.00 0.00 H new ATOM 521 N GLN A 34 11.863 -7.861 -7.265 1.00 0.00 N ATOM 522 CA GLN A 34 11.083 -7.110 -6.312 1.00 0.00 C ATOM 523 C GLN A 34 9.859 -6.519 -7.002 1.00 0.00 C ATOM 524 O GLN A 34 9.760 -5.317 -7.238 1.00 0.00 O ATOM 525 CB GLN A 34 12.004 -6.031 -5.771 1.00 0.00 C ATOM 526 CG GLN A 34 11.838 -5.748 -4.285 1.00 0.00 C ATOM 527 CD GLN A 34 12.944 -4.769 -3.915 1.00 0.00 C ATOM 528 OE1 GLN A 34 12.720 -3.773 -3.232 1.00 0.00 O ATOM 529 NE2 GLN A 34 14.151 -5.069 -4.387 1.00 0.00 N ATOM 0 H GLN A 34 11.841 -7.464 -8.204 1.00 0.00 H new ATOM 0 HA GLN A 34 10.712 -7.732 -5.497 1.00 0.00 H new ATOM 0 HB2 GLN A 34 13.037 -6.324 -5.959 1.00 0.00 H new ATOM 0 HB3 GLN A 34 11.828 -5.109 -6.326 1.00 0.00 H new ATOM 0 HG2 GLN A 34 10.856 -5.323 -4.077 1.00 0.00 H new ATOM 0 HG3 GLN A 34 11.919 -6.666 -3.702 1.00 0.00 H new ATOM 0 HE21 GLN A 34 14.284 -5.909 -4.950 1.00 0.00 H new ATOM 0 HE22 GLN A 34 14.943 -4.459 -4.186 1.00 0.00 H new ATOM 538 N PRO A 35 8.903 -7.382 -7.337 1.00 0.00 N ATOM 539 CA PRO A 35 7.720 -7.025 -8.098 1.00 0.00 C ATOM 540 C PRO A 35 6.786 -6.157 -7.279 1.00 0.00 C ATOM 541 O PRO A 35 5.801 -5.610 -7.771 1.00 0.00 O ATOM 542 CB PRO A 35 7.123 -8.352 -8.521 1.00 0.00 C ATOM 543 CG PRO A 35 7.773 -9.425 -7.650 1.00 0.00 C ATOM 544 CD PRO A 35 8.955 -8.776 -6.968 1.00 0.00 C ATOM 0 HA PRO A 35 7.937 -6.413 -8.974 1.00 0.00 H new ATOM 0 HB2 PRO A 35 6.041 -8.349 -8.388 1.00 0.00 H new ATOM 0 HB3 PRO A 35 7.314 -8.543 -9.577 1.00 0.00 H new ATOM 0 HG2 PRO A 35 7.065 -9.808 -6.915 1.00 0.00 H new ATOM 0 HG3 PRO A 35 8.094 -10.273 -8.256 1.00 0.00 H new ATOM 0 HD2 PRO A 35 8.897 -8.897 -5.886 1.00 0.00 H new ATOM 0 HD3 PRO A 35 9.891 -9.231 -7.290 1.00 0.00 H new ATOM 552 N GLN A 36 7.142 -6.057 -6.008 1.00 0.00 N ATOM 553 CA GLN A 36 6.564 -5.106 -5.081 1.00 0.00 C ATOM 554 C GLN A 36 7.546 -3.995 -4.720 1.00 0.00 C ATOM 555 O GLN A 36 7.759 -3.695 -3.545 1.00 0.00 O ATOM 556 CB GLN A 36 6.008 -5.791 -3.832 1.00 0.00 C ATOM 557 CG GLN A 36 5.054 -6.944 -4.146 1.00 0.00 C ATOM 558 CD GLN A 36 5.733 -8.260 -3.802 1.00 0.00 C ATOM 559 OE1 GLN A 36 5.418 -8.893 -2.797 1.00 0.00 O ATOM 560 NE2 GLN A 36 6.677 -8.672 -4.639 1.00 0.00 N ATOM 0 H GLN A 36 7.857 -6.650 -5.586 1.00 0.00 H new ATOM 0 HA GLN A 36 5.723 -4.639 -5.593 1.00 0.00 H new ATOM 0 HB2 GLN A 36 6.837 -6.168 -3.234 1.00 0.00 H new ATOM 0 HB3 GLN A 36 5.486 -5.053 -3.224 1.00 0.00 H new ATOM 0 HG2 GLN A 36 4.132 -6.836 -3.574 1.00 0.00 H new ATOM 0 HG3 GLN A 36 4.779 -6.927 -5.200 1.00 0.00 H new ATOM 0 HE21 GLN A 36 6.907 -8.115 -5.462 1.00 0.00 H new ATOM 0 HE22 GLN A 36 7.172 -9.545 -4.459 1.00 0.00 H new ATOM 569 N ASN A 37 8.146 -3.384 -5.741 1.00 0.00 N ATOM 570 CA ASN A 37 9.061 -2.266 -5.572 1.00 0.00 C ATOM 571 C ASN A 37 8.855 -1.277 -6.722 1.00 0.00 C ATOM 572 O ASN A 37 8.701 -1.688 -7.869 1.00 0.00 O ATOM 573 CB ASN A 37 10.497 -2.788 -5.542 1.00 0.00 C ATOM 574 CG ASN A 37 11.263 -2.329 -6.767 1.00 0.00 C ATOM 575 OD1 ASN A 37 11.894 -1.278 -6.757 1.00 0.00 O ATOM 576 ND2 ASN A 37 11.201 -3.122 -7.825 1.00 0.00 N ATOM 0 H ASN A 37 8.007 -3.656 -6.714 1.00 0.00 H new ATOM 0 HA ASN A 37 8.866 -1.751 -4.631 1.00 0.00 H new ATOM 0 HB2 ASN A 37 10.998 -2.435 -4.641 1.00 0.00 H new ATOM 0 HB3 ASN A 37 10.492 -3.877 -5.498 1.00 0.00 H new ATOM 0 HD21 ASN A 37 11.692 -2.868 -8.682 1.00 0.00 H new ATOM 0 HD22 ASN A 37 10.662 -3.987 -7.783 1.00 0.00 H new ATOM 583 N PRO A 38 8.851 0.027 -6.429 1.00 0.00 N ATOM 584 CA PRO A 38 8.640 1.073 -7.411 1.00 0.00 C ATOM 585 C PRO A 38 9.818 1.374 -8.331 1.00 0.00 C ATOM 586 O PRO A 38 9.604 1.480 -9.531 1.00 0.00 O ATOM 587 CB PRO A 38 8.427 2.326 -6.580 1.00 0.00 C ATOM 588 CG PRO A 38 8.235 1.886 -5.142 1.00 0.00 C ATOM 589 CD PRO A 38 9.004 0.580 -5.101 1.00 0.00 C ATOM 0 HA PRO A 38 7.825 0.757 -8.062 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.284 2.994 -6.666 1.00 0.00 H new ATOM 0 HB3 PRO A 38 7.556 2.878 -6.933 1.00 0.00 H new ATOM 0 HG2 PRO A 38 8.633 2.615 -4.437 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.182 1.746 -4.896 1.00 0.00 H new ATOM 0 HD2 PRO A 38 10.054 0.745 -4.858 1.00 0.00 H new ATOM 0 HD3 PRO A 38 8.604 -0.093 -4.343 1.00 0.00 H new ATOM 597 N VAL A 39 11.049 1.521 -7.822 1.00 0.00 N ATOM 598 CA VAL A 39 12.163 1.863 -8.708 1.00 0.00 C ATOM 599 C VAL A 39 12.354 0.875 -9.840 1.00 0.00 C ATOM 600 O VAL A 39 12.887 1.192 -10.900 1.00 0.00 O ATOM 601 CB VAL A 39 13.433 2.178 -7.952 1.00 0.00 C ATOM 602 CG1 VAL A 39 14.098 1.163 -7.086 1.00 0.00 C ATOM 603 CG2 VAL A 39 14.509 2.589 -8.930 1.00 0.00 C ATOM 0 H VAL A 39 11.291 1.413 -6.837 1.00 0.00 H new ATOM 0 HA VAL A 39 11.881 2.794 -9.200 1.00 0.00 H new ATOM 0 HB VAL A 39 13.046 2.929 -7.263 1.00 0.00 H new ATOM 0 HG11 VAL A 39 14.992 1.597 -6.638 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.412 0.851 -6.298 1.00 0.00 H new ATOM 0 HG13 VAL A 39 14.377 0.298 -7.688 1.00 0.00 H new ATOM 0 HG21 VAL A 39 15.426 2.817 -8.387 1.00 0.00 H new ATOM 0 HG22 VAL A 39 14.695 1.775 -9.630 1.00 0.00 H new ATOM 0 HG23 VAL A 39 14.183 3.473 -9.479 1.00 0.00 H new ATOM 613 N GLY A 40 11.895 -0.340 -9.584 1.00 0.00 N ATOM 614 CA GLY A 40 11.783 -1.356 -10.626 1.00 0.00 C ATOM 615 C GLY A 40 11.019 -0.770 -11.801 1.00 0.00 C ATOM 616 O GLY A 40 11.492 -0.796 -12.936 1.00 0.00 O ATOM 0 H GLY A 40 11.592 -0.650 -8.661 1.00 0.00 H new ATOM 0 HA2 GLY A 40 12.774 -1.681 -10.944 1.00 0.00 H new ATOM 0 HA3 GLY A 40 11.267 -2.236 -10.241 1.00 0.00 H new ATOM 620 N TYR A 41 9.831 -0.229 -11.528 1.00 0.00 N ATOM 621 CA TYR A 41 8.967 0.342 -12.539 1.00 0.00 C ATOM 622 C TYR A 41 9.487 1.706 -12.971 1.00 0.00 C ATOM 623 O TYR A 41 9.255 2.109 -14.102 1.00 0.00 O ATOM 624 CB TYR A 41 7.580 0.499 -11.923 1.00 0.00 C ATOM 625 CG TYR A 41 6.898 -0.812 -11.630 1.00 0.00 C ATOM 626 CD1 TYR A 41 6.297 -1.533 -12.669 1.00 0.00 C ATOM 627 CD2 TYR A 41 6.875 -1.301 -10.319 1.00 0.00 C ATOM 628 CE1 TYR A 41 5.686 -2.765 -12.405 1.00 0.00 C ATOM 629 CE2 TYR A 41 6.273 -2.539 -10.047 1.00 0.00 C ATOM 630 CZ TYR A 41 5.675 -3.275 -11.092 1.00 0.00 C ATOM 631 OH TYR A 41 5.086 -4.478 -10.837 1.00 0.00 O ATOM 0 H TYR A 41 9.445 -0.179 -10.585 1.00 0.00 H new ATOM 0 HA TYR A 41 8.935 -0.305 -13.416 1.00 0.00 H new ATOM 0 HB2 TYR A 41 7.665 1.069 -10.998 1.00 0.00 H new ATOM 0 HB3 TYR A 41 6.955 1.081 -12.600 1.00 0.00 H new ATOM 0 HD1 TYR A 41 6.305 -1.139 -13.674 1.00 0.00 H new ATOM 0 HD2 TYR A 41 7.319 -0.727 -9.519 1.00 0.00 H new ATOM 0 HE1 TYR A 41 5.224 -3.323 -13.206 1.00 0.00 H new ATOM 0 HE2 TYR A 41 6.267 -2.928 -9.039 1.00 0.00 H new ATOM 0 HH TYR A 41 5.321 -4.772 -9.932 1.00 0.00 H new ATOM 641 N SER A 42 10.186 2.419 -12.083 1.00 0.00 N ATOM 642 CA SER A 42 10.620 3.787 -12.346 1.00 0.00 C ATOM 643 C SER A 42 11.690 3.811 -13.432 1.00 0.00 C ATOM 644 O SER A 42 11.709 4.718 -14.262 1.00 0.00 O ATOM 645 CB SER A 42 11.184 4.392 -11.057 1.00 0.00 C ATOM 646 OG SER A 42 12.569 4.162 -11.009 1.00 0.00 O ATOM 0 H SER A 42 10.464 2.064 -11.168 1.00 0.00 H new ATOM 0 HA SER A 42 9.765 4.370 -12.689 1.00 0.00 H new ATOM 0 HB2 SER A 42 10.979 5.462 -11.023 1.00 0.00 H new ATOM 0 HB3 SER A 42 10.699 3.947 -10.189 1.00 0.00 H new ATOM 0 HG SER A 42 13.045 5.016 -11.079 1.00 0.00 H new ATOM 652 N ASN A 43 12.577 2.813 -13.421 1.00 0.00 N ATOM 653 CA ASN A 43 13.668 2.713 -14.370 1.00 0.00 C ATOM 654 C ASN A 43 13.123 2.277 -15.729 1.00 0.00 C ATOM 655 O ASN A 43 13.364 2.934 -16.741 1.00 0.00 O ATOM 656 CB ASN A 43 14.662 1.675 -13.842 1.00 0.00 C ATOM 657 CG ASN A 43 15.598 2.216 -12.771 1.00 0.00 C ATOM 658 OD1 ASN A 43 16.788 1.918 -12.781 1.00 0.00 O ATOM 659 ND2 ASN A 43 15.083 3.007 -11.840 1.00 0.00 N ATOM 0 H ASN A 43 12.551 2.050 -12.745 1.00 0.00 H new ATOM 0 HA ASN A 43 14.164 3.676 -14.489 1.00 0.00 H new ATOM 0 HB2 ASN A 43 14.109 0.829 -13.435 1.00 0.00 H new ATOM 0 HB3 ASN A 43 15.256 1.297 -14.674 1.00 0.00 H new ATOM 0 HD21 ASN A 43 15.680 3.386 -11.105 1.00 0.00 H new ATOM 0 HD22 ASN A 43 14.089 3.237 -11.859 1.00 0.00 H new ATOM 666 N LYS A 44 12.384 1.165 -15.741 1.00 0.00 N ATOM 667 CA LYS A 44 11.716 0.644 -16.929 1.00 0.00 C ATOM 668 C LYS A 44 10.778 1.712 -17.492 1.00 0.00 C ATOM 669 O LYS A 44 10.560 1.754 -18.696 1.00 0.00 O ATOM 670 CB LYS A 44 10.968 -0.618 -16.505 1.00 0.00 C ATOM 671 CG LYS A 44 10.235 -1.284 -17.672 1.00 0.00 C ATOM 672 CD LYS A 44 9.632 -2.605 -17.198 1.00 0.00 C ATOM 673 CE LYS A 44 8.910 -3.304 -18.348 1.00 0.00 C ATOM 674 NZ LYS A 44 8.324 -4.585 -17.906 1.00 0.00 N ATOM 0 H LYS A 44 12.232 0.594 -14.910 1.00 0.00 H new ATOM 0 HA LYS A 44 12.422 0.393 -17.721 1.00 0.00 H new ATOM 0 HB2 LYS A 44 11.674 -1.327 -16.071 1.00 0.00 H new ATOM 0 HB3 LYS A 44 10.250 -0.366 -15.725 1.00 0.00 H new ATOM 0 HG2 LYS A 44 9.451 -0.626 -18.047 1.00 0.00 H new ATOM 0 HG3 LYS A 44 10.925 -1.461 -18.497 1.00 0.00 H new ATOM 0 HD2 LYS A 44 10.418 -3.251 -16.807 1.00 0.00 H new ATOM 0 HD3 LYS A 44 8.935 -2.421 -16.381 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.124 -2.656 -18.736 1.00 0.00 H new ATOM 0 HE3 LYS A 44 9.609 -3.483 -19.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 7.811 -5.023 -18.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 9.082 -5.223 -17.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 7.666 -4.413 -17.119 1.00 0.00 H new ATOM 688 N ALA A 45 10.225 2.579 -16.636 1.00 0.00 N ATOM 689 CA ALA A 45 9.311 3.624 -17.076 1.00 0.00 C ATOM 690 C ALA A 45 10.049 4.780 -17.743 1.00 0.00 C ATOM 691 O ALA A 45 9.677 5.179 -18.841 1.00 0.00 O ATOM 692 CB ALA A 45 8.512 4.153 -15.883 1.00 0.00 C ATOM 0 H ALA A 45 10.400 2.572 -15.631 1.00 0.00 H new ATOM 0 HA ALA A 45 8.638 3.183 -17.812 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.830 4.934 -16.219 1.00 0.00 H new ATOM 0 HB2 ALA A 45 7.940 3.339 -15.439 1.00 0.00 H new ATOM 0 HB3 ALA A 45 9.196 4.563 -15.140 1.00 0.00 H new ATOM 698 N MET A 46 11.087 5.328 -17.101 1.00 0.00 N ATOM 699 CA MET A 46 11.815 6.450 -17.676 1.00 0.00 C ATOM 700 C MET A 46 12.337 6.117 -19.071 1.00 0.00 C ATOM 701 O MET A 46 12.341 6.963 -19.963 1.00 0.00 O ATOM 702 CB MET A 46 12.985 6.819 -16.765 1.00 0.00 C ATOM 703 CG MET A 46 13.180 8.334 -16.677 1.00 0.00 C ATOM 704 SD MET A 46 13.560 9.180 -18.228 1.00 0.00 S ATOM 705 CE MET A 46 11.942 9.891 -18.610 1.00 0.00 C ATOM 0 H MET A 46 11.434 5.013 -16.195 1.00 0.00 H new ATOM 0 HA MET A 46 11.130 7.293 -17.763 1.00 0.00 H new ATOM 0 HB2 MET A 46 12.810 6.416 -15.767 1.00 0.00 H new ATOM 0 HB3 MET A 46 13.898 6.356 -17.140 1.00 0.00 H new ATOM 0 HG2 MET A 46 12.273 8.773 -16.261 1.00 0.00 H new ATOM 0 HG3 MET A 46 13.985 8.535 -15.970 1.00 0.00 H new ATOM 0 HE1 MET A 46 11.988 10.405 -19.570 1.00 0.00 H new ATOM 0 HE2 MET A 46 11.198 9.096 -18.659 1.00 0.00 H new ATOM 0 HE3 MET A 46 11.664 10.601 -17.831 1.00 0.00 H new ATOM 715 N ALA A 47 12.776 4.872 -19.264 1.00 0.00 N ATOM 716 CA ALA A 47 13.272 4.439 -20.553 1.00 0.00 C ATOM 717 C ALA A 47 12.152 4.402 -21.585 1.00 0.00 C ATOM 718 O ALA A 47 12.385 4.732 -22.746 1.00 0.00 O ATOM 719 CB ALA A 47 13.884 3.057 -20.383 1.00 0.00 C ATOM 0 H ALA A 47 12.795 4.154 -18.540 1.00 0.00 H new ATOM 0 HA ALA A 47 14.022 5.143 -20.914 1.00 0.00 H new ATOM 0 HB1 ALA A 47 14.266 2.708 -21.342 1.00 0.00 H new ATOM 0 HB2 ALA A 47 14.701 3.107 -19.664 1.00 0.00 H new ATOM 0 HB3 ALA A 47 13.124 2.365 -20.021 1.00 0.00 H new ATOM 725 N LEU A 48 10.939 4.009 -21.185 1.00 0.00 N ATOM 726 CA LEU A 48 9.812 3.946 -22.103 1.00 0.00 C ATOM 727 C LEU A 48 9.430 5.328 -22.617 1.00 0.00 C ATOM 728 O LEU A 48 8.873 5.430 -23.707 1.00 0.00 O ATOM 729 CB LEU A 48 8.619 3.274 -21.420 1.00 0.00 C ATOM 730 CG LEU A 48 8.844 1.771 -21.252 1.00 0.00 C ATOM 731 CD1 LEU A 48 7.771 1.222 -20.320 1.00 0.00 C ATOM 732 CD2 LEU A 48 8.765 1.035 -22.587 1.00 0.00 C ATOM 0 H LEU A 48 10.718 3.731 -20.229 1.00 0.00 H new ATOM 0 HA LEU A 48 10.110 3.350 -22.965 1.00 0.00 H new ATOM 0 HB2 LEU A 48 8.453 3.730 -20.444 1.00 0.00 H new ATOM 0 HB3 LEU A 48 7.718 3.445 -22.009 1.00 0.00 H new ATOM 0 HG LEU A 48 9.841 1.616 -20.840 1.00 0.00 H new ATOM 0 HD11 LEU A 48 7.917 0.150 -20.189 1.00 0.00 H new ATOM 0 HD12 LEU A 48 7.841 1.719 -19.352 1.00 0.00 H new ATOM 0 HD13 LEU A 48 6.787 1.404 -20.751 1.00 0.00 H new ATOM 0 HD21 LEU A 48 8.930 -0.030 -22.426 1.00 0.00 H new ATOM 0 HD22 LEU A 48 7.780 1.187 -23.028 1.00 0.00 H new ATOM 0 HD23 LEU A 48 9.528 1.422 -23.262 1.00 0.00 H new ATOM 744 N ILE A 49 9.715 6.399 -21.877 1.00 0.00 N ATOM 745 CA ILE A 49 9.488 7.749 -22.380 1.00 0.00 C ATOM 746 C ILE A 49 10.503 8.031 -23.480 1.00 0.00 C ATOM 747 O ILE A 49 10.143 8.490 -24.560 1.00 0.00 O ATOM 748 CB ILE A 49 9.672 8.760 -21.233 1.00 0.00 C ATOM 749 CG1 ILE A 49 8.421 8.903 -20.360 1.00 0.00 C ATOM 750 CG2 ILE A 49 10.030 10.139 -21.786 1.00 0.00 C ATOM 751 CD1 ILE A 49 8.259 7.732 -19.398 1.00 0.00 C ATOM 0 H ILE A 49 10.101 6.357 -20.934 1.00 0.00 H new ATOM 0 HA ILE A 49 8.476 7.839 -22.775 1.00 0.00 H new ATOM 0 HB ILE A 49 10.480 8.369 -20.615 1.00 0.00 H new ATOM 0 HG12 ILE A 49 8.479 9.832 -19.793 1.00 0.00 H new ATOM 0 HG13 ILE A 49 7.540 8.973 -20.998 1.00 0.00 H new ATOM 0 HG21 ILE A 49 10.156 10.840 -20.961 1.00 0.00 H new ATOM 0 HG22 ILE A 49 10.959 10.074 -22.352 1.00 0.00 H new ATOM 0 HG23 ILE A 49 9.230 10.488 -22.440 1.00 0.00 H new ATOM 0 HD11 ILE A 49 7.360 7.875 -18.799 1.00 0.00 H new ATOM 0 HD12 ILE A 49 8.174 6.805 -19.965 1.00 0.00 H new ATOM 0 HD13 ILE A 49 9.127 7.678 -18.741 1.00 0.00 H new ATOM 763 N LYS A 50 11.777 7.750 -23.200 1.00 0.00 N ATOM 764 CA LYS A 50 12.847 7.885 -24.163 1.00 0.00 C ATOM 765 C LYS A 50 12.718 6.898 -25.333 1.00 0.00 C ATOM 766 O LYS A 50 13.476 6.983 -26.298 1.00 0.00 O ATOM 767 CB LYS A 50 14.146 7.703 -23.395 1.00 0.00 C ATOM 768 CG LYS A 50 14.961 8.988 -23.481 1.00 0.00 C ATOM 769 CD LYS A 50 14.309 10.109 -22.676 1.00 0.00 C ATOM 770 CE LYS A 50 14.525 9.866 -21.190 1.00 0.00 C ATOM 771 NZ LYS A 50 14.442 11.134 -20.435 1.00 0.00 N ATOM 0 H LYS A 50 12.088 7.420 -22.286 1.00 0.00 H new ATOM 0 HA LYS A 50 12.812 8.868 -24.633 1.00 0.00 H new ATOM 0 HB2 LYS A 50 13.936 7.460 -22.353 1.00 0.00 H new ATOM 0 HB3 LYS A 50 14.714 6.869 -23.809 1.00 0.00 H new ATOM 0 HG2 LYS A 50 15.969 8.808 -23.108 1.00 0.00 H new ATOM 0 HG3 LYS A 50 15.056 9.293 -24.523 1.00 0.00 H new ATOM 0 HD2 LYS A 50 14.735 11.071 -22.963 1.00 0.00 H new ATOM 0 HD3 LYS A 50 13.242 10.154 -22.896 1.00 0.00 H new ATOM 0 HE2 LYS A 50 13.776 9.166 -20.818 1.00 0.00 H new ATOM 0 HE3 LYS A 50 15.500 9.405 -21.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 14.202 10.932 -19.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 15.359 11.624 -20.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 13.707 11.739 -20.853 1.00 0.00 H new ATOM 785 N LEU A 51 11.762 5.964 -25.258 1.00 0.00 N ATOM 786 CA LEU A 51 11.426 5.044 -26.331 1.00 0.00 C ATOM 787 C LEU A 51 10.093 5.486 -26.945 1.00 0.00 C ATOM 788 O LEU A 51 9.696 4.999 -28.002 1.00 0.00 O ATOM 789 CB LEU A 51 11.301 3.636 -25.749 1.00 0.00 C ATOM 790 CG LEU A 51 12.654 3.028 -25.352 1.00 0.00 C ATOM 791 CD1 LEU A 51 12.416 1.772 -24.518 1.00 0.00 C ATOM 792 CD2 LEU A 51 13.470 2.641 -26.579 1.00 0.00 C ATOM 0 H LEU A 51 11.191 5.831 -24.424 1.00 0.00 H new ATOM 0 HA LEU A 51 12.198 5.043 -27.101 1.00 0.00 H new ATOM 0 HB2 LEU A 51 10.652 3.667 -24.874 1.00 0.00 H new ATOM 0 HB3 LEU A 51 10.818 2.988 -26.481 1.00 0.00 H new ATOM 0 HG LEU A 51 13.205 3.777 -24.783 1.00 0.00 H new ATOM 0 HD11 LEU A 51 13.374 1.337 -24.234 1.00 0.00 H new ATOM 0 HD12 LEU A 51 11.855 2.032 -23.620 1.00 0.00 H new ATOM 0 HD13 LEU A 51 11.848 1.049 -25.103 1.00 0.00 H new ATOM 0 HD21 LEU A 51 14.422 2.214 -26.263 1.00 0.00 H new ATOM 0 HD22 LEU A 51 12.919 1.906 -27.165 1.00 0.00 H new ATOM 0 HD23 LEU A 51 13.654 3.526 -27.188 1.00 0.00 H new ATOM 804 N GLY A 52 9.408 6.414 -26.268 1.00 0.00 N ATOM 805 CA GLY A 52 8.123 6.965 -26.662 1.00 0.00 C ATOM 806 C GLY A 52 7.006 5.939 -26.521 1.00 0.00 C ATOM 807 O GLY A 52 5.924 6.100 -27.079 1.00 0.00 O ATOM 0 H GLY A 52 9.755 6.813 -25.396 1.00 0.00 H new ATOM 0 HA2 GLY A 52 7.897 7.837 -26.048 1.00 0.00 H new ATOM 0 HA3 GLY A 52 8.175 7.308 -27.695 1.00 0.00 H new ATOM 811 N GLU A 53 7.286 4.883 -25.757 1.00 0.00 N ATOM 812 CA GLU A 53 6.358 3.833 -25.386 1.00 0.00 C ATOM 813 C GLU A 53 5.652 4.247 -24.115 1.00 0.00 C ATOM 814 O GLU A 53 5.441 3.469 -23.188 1.00 0.00 O ATOM 815 CB GLU A 53 7.125 2.523 -25.263 1.00 0.00 C ATOM 816 CG GLU A 53 7.730 2.138 -26.614 1.00 0.00 C ATOM 817 CD GLU A 53 6.673 1.554 -27.548 1.00 0.00 C ATOM 818 OE1 GLU A 53 6.391 0.341 -27.413 1.00 0.00 O ATOM 819 OE2 GLU A 53 6.150 2.321 -28.388 1.00 0.00 O ATOM 0 H GLU A 53 8.216 4.736 -25.364 1.00 0.00 H new ATOM 0 HA GLU A 53 5.589 3.676 -26.142 1.00 0.00 H new ATOM 0 HB2 GLU A 53 7.914 2.624 -24.518 1.00 0.00 H new ATOM 0 HB3 GLU A 53 6.458 1.734 -24.916 1.00 0.00 H new ATOM 0 HG2 GLU A 53 8.182 3.016 -27.076 1.00 0.00 H new ATOM 0 HG3 GLU A 53 8.528 1.411 -26.464 1.00 0.00 H new ATOM 826 N TYR A 54 5.297 5.526 -24.124 1.00 0.00 N ATOM 827 CA TYR A 54 4.536 6.180 -23.097 1.00 0.00 C ATOM 828 C TYR A 54 3.350 5.329 -22.662 1.00 0.00 C ATOM 829 O TYR A 54 3.029 5.288 -21.480 1.00 0.00 O ATOM 830 CB TYR A 54 3.997 7.447 -23.729 1.00 0.00 C ATOM 831 CG TYR A 54 4.994 8.390 -24.358 1.00 0.00 C ATOM 832 CD1 TYR A 54 6.024 8.956 -23.599 1.00 0.00 C ATOM 833 CD2 TYR A 54 4.884 8.695 -25.722 1.00 0.00 C ATOM 834 CE1 TYR A 54 6.924 9.848 -24.198 1.00 0.00 C ATOM 835 CE2 TYR A 54 5.792 9.566 -26.336 1.00 0.00 C ATOM 836 CZ TYR A 54 6.816 10.156 -25.569 1.00 0.00 C ATOM 837 OH TYR A 54 7.700 11.017 -26.146 1.00 0.00 O ATOM 0 H TYR A 54 5.549 6.154 -24.888 1.00 0.00 H new ATOM 0 HA TYR A 54 5.160 6.364 -22.222 1.00 0.00 H new ATOM 0 HB2 TYR A 54 3.276 7.161 -24.494 1.00 0.00 H new ATOM 0 HB3 TYR A 54 3.449 7.998 -22.964 1.00 0.00 H new ATOM 0 HD1 TYR A 54 6.125 8.706 -22.553 1.00 0.00 H new ATOM 0 HD2 TYR A 54 4.090 8.253 -26.306 1.00 0.00 H new ATOM 0 HE1 TYR A 54 7.705 10.302 -23.606 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.708 9.784 -27.390 1.00 0.00 H new ATOM 0 HH TYR A 54 7.485 11.119 -27.097 1.00 0.00 H new ATOM 847 N THR A 55 2.694 4.649 -23.609 1.00 0.00 N ATOM 848 CA THR A 55 1.505 3.873 -23.297 1.00 0.00 C ATOM 849 C THR A 55 1.797 2.893 -22.176 1.00 0.00 C ATOM 850 O THR A 55 0.970 2.671 -21.298 1.00 0.00 O ATOM 851 CB THR A 55 1.033 3.075 -24.510 1.00 0.00 C ATOM 852 OG1 THR A 55 1.261 3.773 -25.709 1.00 0.00 O ATOM 853 CG2 THR A 55 -0.457 2.802 -24.350 1.00 0.00 C ATOM 0 H THR A 55 2.970 4.625 -24.591 1.00 0.00 H new ATOM 0 HA THR A 55 0.728 4.576 -22.997 1.00 0.00 H new ATOM 0 HB THR A 55 1.596 2.143 -24.562 1.00 0.00 H new ATOM 0 HG1 THR A 55 0.949 3.234 -26.466 1.00 0.00 H new ATOM 0 HG21 THR A 55 -0.817 2.232 -25.207 1.00 0.00 H new ATOM 0 HG22 THR A 55 -0.626 2.231 -23.437 1.00 0.00 H new ATOM 0 HG23 THR A 55 -0.996 3.748 -24.291 1.00 0.00 H new ATOM 861 N GLN A 56 2.995 2.312 -22.223 1.00 0.00 N ATOM 862 CA GLN A 56 3.451 1.350 -21.241 1.00 0.00 C ATOM 863 C GLN A 56 4.019 2.064 -20.022 1.00 0.00 C ATOM 864 O GLN A 56 3.838 1.619 -18.892 1.00 0.00 O ATOM 865 CB GLN A 56 4.537 0.501 -21.901 1.00 0.00 C ATOM 866 CG GLN A 56 4.053 -0.140 -23.200 1.00 0.00 C ATOM 867 CD GLN A 56 2.782 -0.948 -22.988 1.00 0.00 C ATOM 868 OE1 GLN A 56 2.824 -2.121 -22.623 1.00 0.00 O ATOM 869 NE2 GLN A 56 1.639 -0.312 -23.219 1.00 0.00 N ATOM 0 H GLN A 56 3.678 2.503 -22.956 1.00 0.00 H new ATOM 0 HA GLN A 56 2.621 0.727 -20.907 1.00 0.00 H new ATOM 0 HB2 GLN A 56 5.408 1.123 -22.107 1.00 0.00 H new ATOM 0 HB3 GLN A 56 4.858 -0.278 -21.210 1.00 0.00 H new ATOM 0 HG2 GLN A 56 3.871 0.636 -23.943 1.00 0.00 H new ATOM 0 HG3 GLN A 56 4.834 -0.787 -23.599 1.00 0.00 H new ATOM 0 HE21 GLN A 56 1.649 0.662 -23.521 1.00 0.00 H new ATOM 0 HE22 GLN A 56 0.751 -0.798 -23.095 1.00 0.00 H new ATOM 878 N ALA A 57 4.704 3.183 -20.258 1.00 0.00 N ATOM 879 CA ALA A 57 5.274 4.011 -19.209 1.00 0.00 C ATOM 880 C ALA A 57 4.219 4.451 -18.196 1.00 0.00 C ATOM 881 O ALA A 57 4.479 4.475 -16.994 1.00 0.00 O ATOM 882 CB ALA A 57 5.880 5.241 -19.879 1.00 0.00 C ATOM 0 H ALA A 57 4.878 3.540 -21.198 1.00 0.00 H new ATOM 0 HA ALA A 57 6.024 3.438 -18.665 1.00 0.00 H new ATOM 0 HB1 ALA A 57 6.319 5.889 -19.121 1.00 0.00 H new ATOM 0 HB2 ALA A 57 6.653 4.929 -20.582 1.00 0.00 H new ATOM 0 HB3 ALA A 57 5.101 5.785 -20.414 1.00 0.00 H new ATOM 888 N ILE A 58 3.029 4.796 -18.686 1.00 0.00 N ATOM 889 CA ILE A 58 1.921 5.225 -17.843 1.00 0.00 C ATOM 890 C ILE A 58 1.519 4.084 -16.913 1.00 0.00 C ATOM 891 O ILE A 58 1.143 4.322 -15.767 1.00 0.00 O ATOM 892 CB ILE A 58 0.750 5.620 -18.753 1.00 0.00 C ATOM 893 CG1 ILE A 58 1.153 6.778 -19.661 1.00 0.00 C ATOM 894 CG2 ILE A 58 -0.500 6.054 -17.982 1.00 0.00 C ATOM 895 CD1 ILE A 58 0.342 6.727 -20.956 1.00 0.00 C ATOM 0 H ILE A 58 2.809 4.785 -19.682 1.00 0.00 H new ATOM 0 HA ILE A 58 2.210 6.079 -17.231 1.00 0.00 H new ATOM 0 HB ILE A 58 0.509 4.724 -19.325 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.984 7.727 -19.152 1.00 0.00 H new ATOM 0 HG13 ILE A 58 2.218 6.722 -19.886 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -1.288 6.319 -18.687 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.840 5.234 -17.349 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.263 6.918 -17.361 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.634 7.556 -21.601 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.533 5.784 -21.468 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.720 6.804 -20.723 1.00 0.00 H new ATOM 907 N GLN A 59 1.600 2.837 -17.398 1.00 0.00 N ATOM 908 CA GLN A 59 1.255 1.672 -16.611 1.00 0.00 C ATOM 909 C GLN A 59 2.316 1.389 -15.556 1.00 0.00 C ATOM 910 O GLN A 59 1.988 0.969 -14.450 1.00 0.00 O ATOM 911 CB GLN A 59 1.139 0.469 -17.536 1.00 0.00 C ATOM 912 CG GLN A 59 0.138 0.683 -18.664 1.00 0.00 C ATOM 913 CD GLN A 59 -1.137 1.336 -18.172 1.00 0.00 C ATOM 914 OE1 GLN A 59 -1.822 0.819 -17.297 1.00 0.00 O ATOM 915 NE2 GLN A 59 -1.455 2.489 -18.744 1.00 0.00 N ATOM 0 H GLN A 59 1.907 2.621 -18.346 1.00 0.00 H new ATOM 0 HA GLN A 59 0.308 1.861 -16.105 1.00 0.00 H new ATOM 0 HB2 GLN A 59 2.118 0.249 -17.962 1.00 0.00 H new ATOM 0 HB3 GLN A 59 0.842 -0.403 -16.954 1.00 0.00 H new ATOM 0 HG2 GLN A 59 0.590 1.305 -19.437 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -0.100 -0.276 -19.125 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -0.854 2.882 -19.469 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -2.300 2.983 -18.459 1.00 0.00 H new ATOM 924 N MET A 60 3.589 1.618 -15.893 1.00 0.00 N ATOM 925 CA MET A 60 4.694 1.392 -14.965 1.00 0.00 C ATOM 926 C MET A 60 4.585 2.329 -13.769 1.00 0.00 C ATOM 927 O MET A 60 4.770 1.911 -12.630 1.00 0.00 O ATOM 928 CB MET A 60 6.033 1.647 -15.655 1.00 0.00 C ATOM 929 CG MET A 60 6.346 0.743 -16.846 1.00 0.00 C ATOM 930 SD MET A 60 6.268 -1.036 -16.537 1.00 0.00 S ATOM 931 CE MET A 60 4.549 -1.316 -17.024 1.00 0.00 C ATOM 0 H MET A 60 3.878 1.962 -16.809 1.00 0.00 H new ATOM 0 HA MET A 60 4.641 0.356 -14.631 1.00 0.00 H new ATOM 0 HB2 MET A 60 6.056 2.683 -15.993 1.00 0.00 H new ATOM 0 HB3 MET A 60 6.828 1.535 -14.918 1.00 0.00 H new ATOM 0 HG2 MET A 60 5.650 0.982 -17.650 1.00 0.00 H new ATOM 0 HG3 MET A 60 7.346 0.985 -17.207 1.00 0.00 H new ATOM 0 HE1 MET A 60 4.422 -2.354 -17.331 1.00 0.00 H new ATOM 0 HE2 MET A 60 3.893 -1.105 -16.180 1.00 0.00 H new ATOM 0 HE3 MET A 60 4.294 -0.658 -17.855 1.00 0.00 H new ATOM 941 N CYS A 61 4.287 3.605 -14.024 1.00 0.00 N ATOM 942 CA CYS A 61 4.297 4.603 -12.973 1.00 0.00 C ATOM 943 C CYS A 61 3.188 4.348 -11.955 1.00 0.00 C ATOM 944 O CYS A 61 3.457 4.193 -10.766 1.00 0.00 O ATOM 945 CB CYS A 61 4.157 5.973 -13.620 1.00 0.00 C ATOM 946 SG CYS A 61 5.608 6.306 -14.645 1.00 0.00 S ATOM 0 H CYS A 61 4.038 3.962 -14.947 1.00 0.00 H new ATOM 0 HA CYS A 61 5.236 4.552 -12.422 1.00 0.00 H new ATOM 0 HB2 CYS A 61 3.253 6.009 -14.228 1.00 0.00 H new ATOM 0 HB3 CYS A 61 4.056 6.741 -12.853 1.00 0.00 H new ATOM 0 HG CYS A 61 5.496 5.673 -15.775 1.00 0.00 H new ATOM 952 N GLN A 62 1.936 4.294 -12.401 1.00 0.00 N ATOM 953 CA GLN A 62 0.836 3.956 -11.505 1.00 0.00 C ATOM 954 C GLN A 62 1.039 2.628 -10.762 1.00 0.00 C ATOM 955 O GLN A 62 0.511 2.462 -9.666 1.00 0.00 O ATOM 956 CB GLN A 62 -0.489 4.010 -12.264 1.00 0.00 C ATOM 957 CG GLN A 62 -0.520 3.102 -13.493 1.00 0.00 C ATOM 958 CD GLN A 62 -1.451 1.920 -13.267 1.00 0.00 C ATOM 959 OE1 GLN A 62 -2.559 1.877 -13.796 1.00 0.00 O ATOM 960 NE2 GLN A 62 -1.008 0.950 -12.475 1.00 0.00 N ATOM 0 H GLN A 62 1.660 4.478 -13.366 1.00 0.00 H new ATOM 0 HA GLN A 62 0.812 4.708 -10.716 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -1.297 3.725 -11.590 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -0.680 5.037 -12.575 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -0.851 3.670 -14.362 1.00 0.00 H new ATOM 0 HG3 GLN A 62 0.486 2.742 -13.711 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -0.082 1.019 -12.053 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -1.594 0.136 -12.289 1.00 0.00 H new ATOM 969 N GLN A 63 1.794 1.677 -11.331 1.00 0.00 N ATOM 970 CA GLN A 63 2.188 0.462 -10.623 1.00 0.00 C ATOM 971 C GLN A 63 3.159 0.778 -9.498 1.00 0.00 C ATOM 972 O GLN A 63 2.968 0.302 -8.388 1.00 0.00 O ATOM 973 CB GLN A 63 2.888 -0.480 -11.608 1.00 0.00 C ATOM 974 CG GLN A 63 2.169 -1.813 -11.774 1.00 0.00 C ATOM 975 CD GLN A 63 0.741 -1.654 -12.267 1.00 0.00 C ATOM 976 OE1 GLN A 63 -0.200 -1.682 -11.483 1.00 0.00 O ATOM 977 NE2 GLN A 63 0.560 -1.486 -13.572 1.00 0.00 N ATOM 0 H GLN A 63 2.144 1.732 -12.288 1.00 0.00 H new ATOM 0 HA GLN A 63 1.293 0.002 -10.204 1.00 0.00 H new ATOM 0 HB2 GLN A 63 2.962 0.009 -12.579 1.00 0.00 H new ATOM 0 HB3 GLN A 63 3.906 -0.663 -11.265 1.00 0.00 H new ATOM 0 HG2 GLN A 63 2.724 -2.435 -12.476 1.00 0.00 H new ATOM 0 HG3 GLN A 63 2.163 -2.339 -10.819 1.00 0.00 H new ATOM 0 HE21 GLN A 63 1.363 -1.467 -14.200 1.00 0.00 H new ATOM 0 HE22 GLN A 63 -0.382 -1.376 -13.946 1.00 0.00 H new ATOM 986 N GLY A 64 4.200 1.570 -9.753 1.00 0.00 N ATOM 987 CA GLY A 64 5.160 1.909 -8.718 1.00 0.00 C ATOM 988 C GLY A 64 4.464 2.378 -7.437 1.00 0.00 C ATOM 989 O GLY A 64 4.889 2.030 -6.339 1.00 0.00 O ATOM 0 H GLY A 64 4.395 1.984 -10.665 1.00 0.00 H new ATOM 0 HA2 GLY A 64 5.781 1.041 -8.498 1.00 0.00 H new ATOM 0 HA3 GLY A 64 5.825 2.693 -9.080 1.00 0.00 H new ATOM 993 N LEU A 65 3.390 3.164 -7.582 1.00 0.00 N ATOM 994 CA LEU A 65 2.635 3.744 -6.471 1.00 0.00 C ATOM 995 C LEU A 65 1.882 2.710 -5.634 1.00 0.00 C ATOM 996 O LEU A 65 1.223 3.075 -4.660 1.00 0.00 O ATOM 997 CB LEU A 65 1.647 4.774 -7.020 1.00 0.00 C ATOM 998 CG LEU A 65 2.386 5.884 -7.760 1.00 0.00 C ATOM 999 CD1 LEU A 65 1.386 6.720 -8.545 1.00 0.00 C ATOM 1000 CD2 LEU A 65 3.148 6.783 -6.784 1.00 0.00 C ATOM 0 H LEU A 65 3.016 3.418 -8.496 1.00 0.00 H new ATOM 0 HA LEU A 65 3.361 4.210 -5.805 1.00 0.00 H new ATOM 0 HB2 LEU A 65 0.942 4.287 -7.694 1.00 0.00 H new ATOM 0 HB3 LEU A 65 1.065 5.199 -6.203 1.00 0.00 H new ATOM 0 HG LEU A 65 3.106 5.427 -8.439 1.00 0.00 H new ATOM 0 HD11 LEU A 65 1.912 7.514 -9.075 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.867 6.086 -9.264 1.00 0.00 H new ATOM 0 HD13 LEU A 65 0.662 7.159 -7.859 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.666 7.566 -7.339 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.446 7.237 -6.084 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.875 6.187 -6.233 1.00 0.00 H new ATOM 1012 N ARG A 66 1.966 1.427 -5.989 1.00 0.00 N ATOM 1013 CA ARG A 66 1.307 0.357 -5.268 1.00 0.00 C ATOM 1014 C ARG A 66 2.186 -0.049 -4.099 1.00 0.00 C ATOM 1015 O ARG A 66 1.741 -0.706 -3.158 1.00 0.00 O ATOM 1016 CB ARG A 66 1.202 -0.803 -6.245 1.00 0.00 C ATOM 1017 CG ARG A 66 0.268 -0.416 -7.385 1.00 0.00 C ATOM 1018 CD ARG A 66 0.204 -1.573 -8.369 1.00 0.00 C ATOM 1019 NE ARG A 66 -0.404 -2.768 -7.768 1.00 0.00 N ATOM 1020 CZ ARG A 66 -1.050 -3.722 -8.446 1.00 0.00 C ATOM 1021 NH1 ARG A 66 -1.191 -3.650 -9.766 1.00 0.00 N ATOM 1022 NH2 ARG A 66 -1.563 -4.762 -7.794 1.00 0.00 N ATOM 0 H ARG A 66 2.502 1.107 -6.796 1.00 0.00 H new ATOM 0 HA ARG A 66 0.328 0.653 -4.892 1.00 0.00 H new ATOM 0 HB2 ARG A 66 2.188 -1.055 -6.636 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.825 -1.690 -5.736 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.727 -0.190 -7.000 1.00 0.00 H new ATOM 0 HG3 ARG A 66 0.629 0.484 -7.882 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -0.372 -1.274 -9.245 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.210 -1.812 -8.715 1.00 0.00 H new ATOM 0 HE ARG A 66 -0.327 -2.878 -6.757 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -0.803 -2.858 -10.278 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -1.687 -4.387 -10.267 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -1.463 -4.829 -6.781 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -2.057 -5.492 -8.307 1.00 0.00 H new ATOM 1036 N TYR A 67 3.447 0.368 -4.197 1.00 0.00 N ATOM 1037 CA TYR A 67 4.512 -0.034 -3.304 1.00 0.00 C ATOM 1038 C TYR A 67 5.174 1.117 -2.545 1.00 0.00 C ATOM 1039 O TYR A 67 5.940 0.854 -1.622 1.00 0.00 O ATOM 1040 CB TYR A 67 5.531 -0.724 -4.198 1.00 0.00 C ATOM 1041 CG TYR A 67 4.895 -1.616 -5.226 1.00 0.00 C ATOM 1042 CD1 TYR A 67 4.247 -2.793 -4.830 1.00 0.00 C ATOM 1043 CD2 TYR A 67 4.929 -1.242 -6.577 1.00 0.00 C ATOM 1044 CE1 TYR A 67 3.644 -3.619 -5.786 1.00 0.00 C ATOM 1045 CE2 TYR A 67 4.281 -2.039 -7.528 1.00 0.00 C ATOM 1046 CZ TYR A 67 3.641 -3.234 -7.144 1.00 0.00 C ATOM 1047 OH TYR A 67 3.025 -4.009 -8.079 1.00 0.00 O ATOM 0 H TYR A 67 3.756 1.013 -4.924 1.00 0.00 H new ATOM 0 HA TYR A 67 4.106 -0.673 -2.519 1.00 0.00 H new ATOM 0 HB2 TYR A 67 6.135 0.030 -4.702 1.00 0.00 H new ATOM 0 HB3 TYR A 67 6.208 -1.314 -3.581 1.00 0.00 H new ATOM 0 HD1 TYR A 67 4.212 -3.064 -3.785 1.00 0.00 H new ATOM 0 HD2 TYR A 67 5.451 -0.347 -6.881 1.00 0.00 H new ATOM 0 HE1 TYR A 67 3.182 -4.548 -5.485 1.00 0.00 H new ATOM 0 HE2 TYR A 67 4.272 -1.735 -8.564 1.00 0.00 H new ATOM 0 HH TYR A 67 3.119 -3.594 -8.962 1.00 0.00 H new ATOM 1057 N THR A 68 4.903 2.373 -2.908 1.00 0.00 N ATOM 1058 CA THR A 68 5.557 3.538 -2.309 1.00 0.00 C ATOM 1059 C THR A 68 5.054 3.856 -0.898 1.00 0.00 C ATOM 1060 O THR A 68 5.143 4.999 -0.452 1.00 0.00 O ATOM 1061 CB THR A 68 5.398 4.757 -3.219 1.00 0.00 C ATOM 1062 OG1 THR A 68 4.038 4.977 -3.511 1.00 0.00 O ATOM 1063 CG2 THR A 68 6.158 4.548 -4.523 1.00 0.00 C ATOM 0 H THR A 68 4.221 2.611 -3.628 1.00 0.00 H new ATOM 0 HA THR A 68 6.613 3.287 -2.210 1.00 0.00 H new ATOM 0 HB THR A 68 5.803 5.624 -2.697 1.00 0.00 H new ATOM 0 HG1 THR A 68 3.774 5.865 -3.192 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.035 5.424 -5.160 1.00 0.00 H new ATOM 0 HG22 THR A 68 7.216 4.401 -4.308 1.00 0.00 H new ATOM 0 HG23 THR A 68 5.767 3.669 -5.035 1.00 0.00 H new ATOM 1071 N SER A 69 4.523 2.856 -0.192 1.00 0.00 N ATOM 1072 CA SER A 69 3.982 3.004 1.156 1.00 0.00 C ATOM 1073 C SER A 69 5.053 3.280 2.214 1.00 0.00 C ATOM 1074 O SER A 69 4.742 3.289 3.405 1.00 0.00 O ATOM 1075 CB SER A 69 3.243 1.726 1.532 1.00 0.00 C ATOM 1076 OG SER A 69 2.081 1.576 0.740 1.00 0.00 O ATOM 0 H SER A 69 4.457 1.903 -0.550 1.00 0.00 H new ATOM 0 HA SER A 69 3.317 3.868 1.139 1.00 0.00 H new ATOM 0 HB2 SER A 69 3.898 0.866 1.394 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.970 1.753 2.587 1.00 0.00 H new ATOM 0 HG SER A 69 1.618 0.750 0.992 1.00 0.00 H new ATOM 1082 N THR A 70 6.303 3.501 1.801 1.00 0.00 N ATOM 1083 CA THR A 70 7.425 3.702 2.712 1.00 0.00 C ATOM 1084 C THR A 70 8.363 4.802 2.212 1.00 0.00 C ATOM 1085 O THR A 70 8.367 5.141 1.029 1.00 0.00 O ATOM 1086 CB THR A 70 8.161 2.370 2.895 1.00 0.00 C ATOM 1087 OG1 THR A 70 9.311 2.560 3.687 1.00 0.00 O ATOM 1088 CG2 THR A 70 8.558 1.775 1.546 1.00 0.00 C ATOM 0 H THR A 70 6.564 3.545 0.816 1.00 0.00 H new ATOM 0 HA THR A 70 7.048 4.036 3.679 1.00 0.00 H new ATOM 0 HB THR A 70 7.486 1.675 3.394 1.00 0.00 H new ATOM 0 HG1 THR A 70 9.775 1.704 3.801 1.00 0.00 H new ATOM 0 HG21 THR A 70 9.079 0.830 1.704 1.00 0.00 H new ATOM 0 HG22 THR A 70 7.664 1.601 0.948 1.00 0.00 H new ATOM 0 HG23 THR A 70 9.216 2.468 1.022 1.00 0.00 H new ATOM 1096 N ALA A 71 9.164 5.365 3.123 1.00 0.00 N ATOM 1097 CA ALA A 71 10.025 6.505 2.834 1.00 0.00 C ATOM 1098 C ALA A 71 11.299 6.132 2.074 1.00 0.00 C ATOM 1099 O ALA A 71 12.057 7.023 1.701 1.00 0.00 O ATOM 1100 CB ALA A 71 10.373 7.215 4.142 1.00 0.00 C ATOM 0 H ALA A 71 9.230 5.036 4.086 1.00 0.00 H new ATOM 0 HA ALA A 71 9.468 7.170 2.174 1.00 0.00 H new ATOM 0 HB1 ALA A 71 11.017 8.069 3.932 1.00 0.00 H new ATOM 0 HB2 ALA A 71 9.458 7.560 4.623 1.00 0.00 H new ATOM 0 HB3 ALA A 71 10.892 6.523 4.805 1.00 0.00 H new ATOM 1106 N GLU A 72 11.558 4.846 1.830 1.00 0.00 N ATOM 1107 CA GLU A 72 12.641 4.453 0.936 1.00 0.00 C ATOM 1108 C GLU A 72 12.189 4.562 -0.515 1.00 0.00 C ATOM 1109 O GLU A 72 12.999 4.435 -1.434 1.00 0.00 O ATOM 1110 CB GLU A 72 13.063 3.017 1.224 1.00 0.00 C ATOM 1111 CG GLU A 72 11.900 2.037 1.142 1.00 0.00 C ATOM 1112 CD GLU A 72 12.338 0.637 1.565 1.00 0.00 C ATOM 1113 OE1 GLU A 72 12.909 -0.078 0.711 1.00 0.00 O ATOM 1114 OE2 GLU A 72 12.099 0.287 2.742 1.00 0.00 O ATOM 0 H GLU A 72 11.037 4.069 2.236 1.00 0.00 H new ATOM 0 HA GLU A 72 13.487 5.120 1.103 1.00 0.00 H new ATOM 0 HB2 GLU A 72 13.835 2.720 0.514 1.00 0.00 H new ATOM 0 HB3 GLU A 72 13.508 2.965 2.218 1.00 0.00 H new ATOM 0 HG2 GLU A 72 11.086 2.377 1.783 1.00 0.00 H new ATOM 0 HG3 GLU A 72 11.513 2.009 0.123 1.00 0.00 H new ATOM 1121 N HIS A 73 10.892 4.796 -0.716 1.00 0.00 N ATOM 1122 CA HIS A 73 10.271 4.791 -2.029 1.00 0.00 C ATOM 1123 C HIS A 73 9.703 6.158 -2.399 1.00 0.00 C ATOM 1124 O HIS A 73 9.182 6.333 -3.495 1.00 0.00 O ATOM 1125 CB HIS A 73 9.174 3.731 -2.038 1.00 0.00 C ATOM 1126 CG HIS A 73 9.689 2.314 -2.022 1.00 0.00 C ATOM 1127 ND1 HIS A 73 8.896 1.176 -1.842 1.00 0.00 N ATOM 1128 CD2 HIS A 73 10.991 1.933 -2.178 1.00 0.00 C ATOM 1129 CE1 HIS A 73 9.742 0.137 -1.898 1.00 0.00 C ATOM 1130 NE2 HIS A 73 11.005 0.560 -2.105 1.00 0.00 N ATOM 0 H HIS A 73 10.240 4.996 0.042 1.00 0.00 H new ATOM 0 HA HIS A 73 11.029 4.558 -2.777 1.00 0.00 H new ATOM 0 HB2 HIS A 73 8.530 3.882 -1.172 1.00 0.00 H new ATOM 0 HB3 HIS A 73 8.555 3.871 -2.924 1.00 0.00 H new ATOM 0 HD1 HIS A 73 7.887 1.143 -1.698 1.00 0.00 H new ATOM 0 HD2 HIS A 73 11.841 2.582 -2.329 1.00 0.00 H new ATOM 0 HE1 HIS A 73 9.451 -0.898 -1.792 1.00 0.00 H new ATOM 1138 N VAL A 74 9.808 7.131 -1.490 1.00 0.00 N ATOM 1139 CA VAL A 74 9.370 8.500 -1.734 1.00 0.00 C ATOM 1140 C VAL A 74 10.099 9.101 -2.932 1.00 0.00 C ATOM 1141 O VAL A 74 9.575 9.972 -3.624 1.00 0.00 O ATOM 1142 CB VAL A 74 9.644 9.317 -0.473 1.00 0.00 C ATOM 1143 CG1 VAL A 74 11.137 9.384 -0.147 1.00 0.00 C ATOM 1144 CG2 VAL A 74 9.141 10.746 -0.644 1.00 0.00 C ATOM 0 H VAL A 74 10.202 6.986 -0.560 1.00 0.00 H new ATOM 0 HA VAL A 74 8.305 8.511 -1.965 1.00 0.00 H new ATOM 0 HB VAL A 74 9.120 8.816 0.341 1.00 0.00 H new ATOM 0 HG11 VAL A 74 11.286 9.975 0.757 1.00 0.00 H new ATOM 0 HG12 VAL A 74 11.521 8.376 0.011 1.00 0.00 H new ATOM 0 HG13 VAL A 74 11.670 9.849 -0.976 1.00 0.00 H new ATOM 0 HG21 VAL A 74 9.344 11.314 0.264 1.00 0.00 H new ATOM 0 HG22 VAL A 74 9.651 11.213 -1.486 1.00 0.00 H new ATOM 0 HG23 VAL A 74 8.067 10.734 -0.832 1.00 0.00 H new ATOM 1154 N ALA A 75 11.317 8.621 -3.164 1.00 0.00 N ATOM 1155 CA ALA A 75 12.186 9.078 -4.240 1.00 0.00 C ATOM 1156 C ALA A 75 11.571 8.813 -5.598 1.00 0.00 C ATOM 1157 O ALA A 75 11.733 9.581 -6.548 1.00 0.00 O ATOM 1158 CB ALA A 75 13.454 8.240 -4.185 1.00 0.00 C ATOM 0 H ALA A 75 11.736 7.886 -2.594 1.00 0.00 H new ATOM 0 HA ALA A 75 12.360 10.147 -4.115 1.00 0.00 H new ATOM 0 HB1 ALA A 75 14.132 8.554 -4.979 1.00 0.00 H new ATOM 0 HB2 ALA A 75 13.939 8.377 -3.218 1.00 0.00 H new ATOM 0 HB3 ALA A 75 13.201 7.188 -4.319 1.00 0.00 H new ATOM 1164 N ILE A 76 10.856 7.695 -5.665 1.00 0.00 N ATOM 1165 CA ILE A 76 10.341 7.149 -6.894 1.00 0.00 C ATOM 1166 C ILE A 76 8.888 7.534 -7.047 1.00 0.00 C ATOM 1167 O ILE A 76 8.400 7.738 -8.154 1.00 0.00 O ATOM 1168 CB ILE A 76 10.471 5.642 -6.784 1.00 0.00 C ATOM 1169 CG1 ILE A 76 11.941 5.281 -6.601 1.00 0.00 C ATOM 1170 CG2 ILE A 76 9.902 5.022 -8.046 1.00 0.00 C ATOM 1171 CD1 ILE A 76 12.768 5.375 -7.875 1.00 0.00 C ATOM 0 H ILE A 76 10.619 7.139 -4.843 1.00 0.00 H new ATOM 0 HA ILE A 76 10.885 7.527 -7.760 1.00 0.00 H new ATOM 0 HB ILE A 76 9.920 5.261 -5.925 1.00 0.00 H new ATOM 0 HG12 ILE A 76 12.375 5.941 -5.850 1.00 0.00 H new ATOM 0 HG13 ILE A 76 12.009 4.265 -6.211 1.00 0.00 H new ATOM 0 HG21 ILE A 76 9.986 3.937 -7.988 1.00 0.00 H new ATOM 0 HG22 ILE A 76 8.853 5.300 -8.147 1.00 0.00 H new ATOM 0 HG23 ILE A 76 10.458 5.383 -8.911 1.00 0.00 H new ATOM 0 HD11 ILE A 76 13.801 5.102 -7.659 1.00 0.00 H new ATOM 0 HD12 ILE A 76 12.362 4.694 -8.623 1.00 0.00 H new ATOM 0 HD13 ILE A 76 12.734 6.396 -8.256 1.00 0.00 H new ATOM 1183 N ARG A 77 8.200 7.638 -5.914 1.00 0.00 N ATOM 1184 CA ARG A 77 6.836 8.144 -5.880 1.00 0.00 C ATOM 1185 C ARG A 77 6.793 9.508 -6.557 1.00 0.00 C ATOM 1186 O ARG A 77 5.773 9.921 -7.106 1.00 0.00 O ATOM 1187 CB ARG A 77 6.394 8.261 -4.423 1.00 0.00 C ATOM 1188 CG ARG A 77 4.891 8.514 -4.341 1.00 0.00 C ATOM 1189 CD ARG A 77 4.607 9.147 -2.985 1.00 0.00 C ATOM 1190 NE ARG A 77 3.172 9.389 -2.795 1.00 0.00 N ATOM 1191 CZ ARG A 77 2.650 9.962 -1.708 1.00 0.00 C ATOM 1192 NH1 ARG A 77 3.430 10.363 -0.706 1.00 0.00 N ATOM 1193 NH2 ARG A 77 1.334 10.138 -1.620 1.00 0.00 N ATOM 0 H ARG A 77 8.571 7.375 -5.001 1.00 0.00 H new ATOM 0 HA ARG A 77 6.164 7.467 -6.407 1.00 0.00 H new ATOM 0 HB2 ARG A 77 6.645 7.346 -3.886 1.00 0.00 H new ATOM 0 HB3 ARG A 77 6.933 9.074 -3.937 1.00 0.00 H new ATOM 0 HG2 ARG A 77 4.569 9.173 -5.147 1.00 0.00 H new ATOM 0 HG3 ARG A 77 4.338 7.581 -4.452 1.00 0.00 H new ATOM 0 HD2 ARG A 77 4.975 8.494 -2.193 1.00 0.00 H new ATOM 0 HD3 ARG A 77 5.150 10.088 -2.901 1.00 0.00 H new ATOM 0 HE ARG A 77 2.535 9.102 -3.538 1.00 0.00 H new ATOM 0 HH11 ARG A 77 4.440 10.234 -0.763 1.00 0.00 H new ATOM 0 HH12 ARG A 77 3.017 10.799 0.118 1.00 0.00 H new ATOM 0 HH21 ARG A 77 0.727 9.835 -2.382 1.00 0.00 H new ATOM 0 HH22 ARG A 77 0.932 10.575 -0.791 1.00 0.00 H new ATOM 1207 N SER A 78 7.927 10.201 -6.507 1.00 0.00 N ATOM 1208 CA SER A 78 8.099 11.517 -7.106 1.00 0.00 C ATOM 1209 C SER A 78 8.232 11.431 -8.623 1.00 0.00 C ATOM 1210 O SER A 78 7.943 12.401 -9.324 1.00 0.00 O ATOM 1211 CB SER A 78 9.374 12.115 -6.512 1.00 0.00 C ATOM 1212 OG SER A 78 9.494 13.477 -6.864 1.00 0.00 O ATOM 0 H SER A 78 8.766 9.856 -6.040 1.00 0.00 H new ATOM 0 HA SER A 78 7.226 12.135 -6.895 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.358 12.014 -5.427 1.00 0.00 H new ATOM 0 HB3 SER A 78 10.243 11.563 -6.871 1.00 0.00 H new ATOM 0 HG SER A 78 10.315 13.845 -6.474 1.00 0.00 H new ATOM 1218 N LYS A 79 8.669 10.276 -9.138 1.00 0.00 N ATOM 1219 CA LYS A 79 8.867 10.069 -10.565 1.00 0.00 C ATOM 1220 C LYS A 79 7.629 9.445 -11.196 1.00 0.00 C ATOM 1221 O LYS A 79 7.290 9.755 -12.334 1.00 0.00 O ATOM 1222 CB LYS A 79 10.054 9.130 -10.777 1.00 0.00 C ATOM 1223 CG LYS A 79 11.294 9.604 -10.021 1.00 0.00 C ATOM 1224 CD LYS A 79 12.469 8.694 -10.368 1.00 0.00 C ATOM 1225 CE LYS A 79 13.681 9.096 -9.543 1.00 0.00 C ATOM 1226 NZ LYS A 79 14.877 8.350 -9.966 1.00 0.00 N ATOM 0 H LYS A 79 8.894 9.460 -8.569 1.00 0.00 H new ATOM 0 HA LYS A 79 9.056 11.035 -11.033 1.00 0.00 H new ATOM 0 HB2 LYS A 79 9.787 8.127 -10.445 1.00 0.00 H new ATOM 0 HB3 LYS A 79 10.280 9.064 -11.841 1.00 0.00 H new ATOM 0 HG2 LYS A 79 11.526 10.635 -10.288 1.00 0.00 H new ATOM 0 HG3 LYS A 79 11.109 9.586 -8.947 1.00 0.00 H new ATOM 0 HD2 LYS A 79 12.209 7.654 -10.169 1.00 0.00 H new ATOM 0 HD3 LYS A 79 12.698 8.768 -11.431 1.00 0.00 H new ATOM 0 HE2 LYS A 79 13.859 10.166 -9.649 1.00 0.00 H new ATOM 0 HE3 LYS A 79 13.485 8.908 -8.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 15.600 8.402 -9.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 14.624 7.355 -10.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 15.253 8.765 -10.842 1.00 0.00 H new ATOM 1240 N LEU A 80 6.958 8.566 -10.450 1.00 0.00 N ATOM 1241 CA LEU A 80 5.735 7.894 -10.867 1.00 0.00 C ATOM 1242 C LEU A 80 4.593 8.888 -11.049 1.00 0.00 C ATOM 1243 O LEU A 80 3.504 8.513 -11.465 1.00 0.00 O ATOM 1244 CB LEU A 80 5.347 6.901 -9.776 1.00 0.00 C ATOM 1245 CG LEU A 80 6.131 5.584 -9.785 1.00 0.00 C ATOM 1246 CD1 LEU A 80 7.493 5.597 -10.478 1.00 0.00 C ATOM 1247 CD2 LEU A 80 6.287 5.131 -8.338 1.00 0.00 C ATOM 0 H LEU A 80 7.262 8.297 -9.514 1.00 0.00 H new ATOM 0 HA LEU A 80 5.912 7.395 -11.820 1.00 0.00 H new ATOM 0 HB2 LEU A 80 5.483 7.380 -8.806 1.00 0.00 H new ATOM 0 HB3 LEU A 80 4.285 6.674 -9.874 1.00 0.00 H new ATOM 0 HG LEU A 80 5.547 4.893 -10.393 1.00 0.00 H new ATOM 0 HD11 LEU A 80 7.943 4.606 -10.414 1.00 0.00 H new ATOM 0 HD12 LEU A 80 7.366 5.871 -11.525 1.00 0.00 H new ATOM 0 HD13 LEU A 80 8.143 6.323 -9.989 1.00 0.00 H new ATOM 0 HD21 LEU A 80 6.842 4.193 -8.308 1.00 0.00 H new ATOM 0 HD22 LEU A 80 6.828 5.891 -7.775 1.00 0.00 H new ATOM 0 HD23 LEU A 80 5.302 4.984 -7.895 1.00 0.00 H new ATOM 1259 N GLN A 81 4.842 10.155 -10.736 1.00 0.00 N ATOM 1260 CA GLN A 81 3.955 11.270 -10.945 1.00 0.00 C ATOM 1261 C GLN A 81 4.441 12.219 -12.038 1.00 0.00 C ATOM 1262 O GLN A 81 3.686 13.085 -12.479 1.00 0.00 O ATOM 1263 CB GLN A 81 4.030 11.987 -9.604 1.00 0.00 C ATOM 1264 CG GLN A 81 2.944 11.577 -8.635 1.00 0.00 C ATOM 1265 CD GLN A 81 2.537 10.126 -8.728 1.00 0.00 C ATOM 1266 OE1 GLN A 81 1.482 9.798 -9.266 1.00 0.00 O ATOM 1267 NE2 GLN A 81 3.376 9.253 -8.201 1.00 0.00 N ATOM 0 H GLN A 81 5.723 10.437 -10.305 1.00 0.00 H new ATOM 0 HA GLN A 81 2.962 10.949 -11.258 1.00 0.00 H new ATOM 0 HB2 GLN A 81 5.002 11.791 -9.151 1.00 0.00 H new ATOM 0 HB3 GLN A 81 3.968 13.062 -9.773 1.00 0.00 H new ATOM 0 HG2 GLN A 81 3.284 11.781 -7.620 1.00 0.00 H new ATOM 0 HG3 GLN A 81 2.066 12.199 -8.808 1.00 0.00 H new ATOM 0 HE21 GLN A 81 4.240 9.575 -7.765 1.00 0.00 H new ATOM 0 HE22 GLN A 81 3.160 8.257 -8.230 1.00 0.00 H new ATOM 1276 N TYR A 82 5.689 12.066 -12.478 1.00 0.00 N ATOM 1277 CA TYR A 82 6.263 12.915 -13.515 1.00 0.00 C ATOM 1278 C TYR A 82 6.222 12.232 -14.873 1.00 0.00 C ATOM 1279 O TYR A 82 5.539 12.705 -15.778 1.00 0.00 O ATOM 1280 CB TYR A 82 7.718 13.208 -13.166 1.00 0.00 C ATOM 1281 CG TYR A 82 8.546 13.696 -14.336 1.00 0.00 C ATOM 1282 CD1 TYR A 82 8.353 14.977 -14.867 1.00 0.00 C ATOM 1283 CD2 TYR A 82 9.515 12.843 -14.886 1.00 0.00 C ATOM 1284 CE1 TYR A 82 9.155 15.417 -15.932 1.00 0.00 C ATOM 1285 CE2 TYR A 82 10.339 13.283 -15.932 1.00 0.00 C ATOM 1286 CZ TYR A 82 10.157 14.579 -16.460 1.00 0.00 C ATOM 1287 OH TYR A 82 10.946 15.022 -17.481 1.00 0.00 O ATOM 0 H TYR A 82 6.327 11.352 -12.126 1.00 0.00 H new ATOM 0 HA TYR A 82 5.679 13.834 -13.567 1.00 0.00 H new ATOM 0 HB2 TYR A 82 7.747 13.958 -12.376 1.00 0.00 H new ATOM 0 HB3 TYR A 82 8.174 12.303 -12.764 1.00 0.00 H new ATOM 0 HD1 TYR A 82 7.590 15.624 -14.459 1.00 0.00 H new ATOM 0 HD2 TYR A 82 9.627 11.840 -14.501 1.00 0.00 H new ATOM 0 HE1 TYR A 82 9.003 16.402 -16.348 1.00 0.00 H new ATOM 0 HE2 TYR A 82 11.106 12.636 -16.330 1.00 0.00 H new ATOM 0 HH TYR A 82 11.587 14.322 -17.727 1.00 0.00 H new ATOM 1297 N ARG A 83 6.949 11.118 -15.020 1.00 0.00 N ATOM 1298 CA ARG A 83 7.002 10.443 -16.307 1.00 0.00 C ATOM 1299 C ARG A 83 5.729 9.635 -16.515 1.00 0.00 C ATOM 1300 O ARG A 83 5.539 9.005 -17.554 1.00 0.00 O ATOM 1301 CB ARG A 83 8.328 9.702 -16.521 1.00 0.00 C ATOM 1302 CG ARG A 83 8.510 8.338 -15.850 1.00 0.00 C ATOM 1303 CD ARG A 83 8.846 8.435 -14.359 1.00 0.00 C ATOM 1304 NE ARG A 83 10.047 7.657 -14.029 1.00 0.00 N ATOM 1305 CZ ARG A 83 11.278 8.172 -13.926 1.00 0.00 C ATOM 1306 NH1 ARG A 83 11.498 9.461 -14.164 1.00 0.00 N ATOM 1307 NH2 ARG A 83 12.300 7.399 -13.581 1.00 0.00 N ATOM 0 H ARG A 83 7.494 10.679 -14.278 1.00 0.00 H new ATOM 0 HA ARG A 83 7.013 11.173 -17.116 1.00 0.00 H new ATOM 0 HB2 ARG A 83 8.464 9.566 -17.594 1.00 0.00 H new ATOM 0 HB3 ARG A 83 9.132 10.352 -16.177 1.00 0.00 H new ATOM 0 HG2 ARG A 83 7.596 7.756 -15.972 1.00 0.00 H new ATOM 0 HG3 ARG A 83 9.305 7.794 -16.360 1.00 0.00 H new ATOM 0 HD2 ARG A 83 9.001 9.479 -14.086 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.003 8.073 -13.770 1.00 0.00 H new ATOM 0 HE ARG A 83 9.935 6.656 -13.867 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.724 10.070 -14.429 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.441 9.841 -14.082 1.00 0.00 H new ATOM 0 HH21 ARG A 83 12.149 6.408 -13.393 1.00 0.00 H new ATOM 0 HH22 ARG A 83 13.236 7.796 -13.504 1.00 0.00 H new ATOM 1321 N LEU A 84 4.852 9.667 -15.506 1.00 0.00 N ATOM 1322 CA LEU A 84 3.488 9.179 -15.618 1.00 0.00 C ATOM 1323 C LEU A 84 2.682 10.157 -16.458 1.00 0.00 C ATOM 1324 O LEU A 84 1.904 9.733 -17.309 1.00 0.00 O ATOM 1325 CB LEU A 84 2.860 9.124 -14.221 1.00 0.00 C ATOM 1326 CG LEU A 84 1.329 9.115 -14.201 1.00 0.00 C ATOM 1327 CD1 LEU A 84 0.754 7.943 -14.999 1.00 0.00 C ATOM 1328 CD2 LEU A 84 0.877 9.043 -12.742 1.00 0.00 C ATOM 0 H LEU A 84 5.079 10.037 -14.583 1.00 0.00 H new ATOM 0 HA LEU A 84 3.489 8.190 -16.075 1.00 0.00 H new ATOM 0 HB2 LEU A 84 3.221 8.230 -13.712 1.00 0.00 H new ATOM 0 HB3 LEU A 84 3.211 9.982 -13.647 1.00 0.00 H new ATOM 0 HG LEU A 84 0.959 10.025 -14.674 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -0.335 7.975 -14.959 1.00 0.00 H new ATOM 0 HD12 LEU A 84 1.081 8.014 -16.036 1.00 0.00 H new ATOM 0 HD13 LEU A 84 1.106 7.004 -14.571 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.212 9.035 -12.698 1.00 0.00 H new ATOM 0 HD22 LEU A 84 1.265 8.132 -12.285 1.00 0.00 H new ATOM 0 HD23 LEU A 84 1.256 9.910 -12.201 1.00 0.00 H new ATOM 1340 N GLU A 85 2.870 11.456 -16.224 1.00 0.00 N ATOM 1341 CA GLU A 85 2.005 12.484 -16.783 1.00 0.00 C ATOM 1342 C GLU A 85 2.436 12.883 -18.182 1.00 0.00 C ATOM 1343 O GLU A 85 1.600 13.087 -19.062 1.00 0.00 O ATOM 1344 CB GLU A 85 2.095 13.705 -15.883 1.00 0.00 C ATOM 1345 CG GLU A 85 1.368 13.408 -14.577 1.00 0.00 C ATOM 1346 CD GLU A 85 -0.143 13.301 -14.763 1.00 0.00 C ATOM 1347 OE1 GLU A 85 -0.727 14.255 -15.326 1.00 0.00 O ATOM 1348 OE2 GLU A 85 -0.707 12.270 -14.339 1.00 0.00 O ATOM 0 H GLU A 85 3.625 11.820 -15.643 1.00 0.00 H new ATOM 0 HA GLU A 85 0.989 12.094 -16.842 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.138 13.953 -15.686 1.00 0.00 H new ATOM 0 HB3 GLU A 85 1.649 14.570 -16.375 1.00 0.00 H new ATOM 0 HG2 GLU A 85 1.747 12.476 -14.158 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.588 14.195 -13.855 1.00 0.00 H new ATOM 1355 N LEU A 86 3.746 12.994 -18.392 1.00 0.00 N ATOM 1356 CA LEU A 86 4.275 13.437 -19.669 1.00 0.00 C ATOM 1357 C LEU A 86 4.014 12.399 -20.755 1.00 0.00 C ATOM 1358 O LEU A 86 3.756 12.750 -21.904 1.00 0.00 O ATOM 1359 CB LEU A 86 5.759 13.763 -19.487 1.00 0.00 C ATOM 1360 CG LEU A 86 6.716 12.570 -19.542 1.00 0.00 C ATOM 1361 CD1 LEU A 86 7.118 12.284 -20.990 1.00 0.00 C ATOM 1362 CD2 LEU A 86 7.973 12.917 -18.748 1.00 0.00 C ATOM 0 H LEU A 86 4.456 12.782 -17.691 1.00 0.00 H new ATOM 0 HA LEU A 86 3.767 14.341 -20.004 1.00 0.00 H new ATOM 0 HB2 LEU A 86 6.052 14.475 -20.258 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.886 14.263 -18.527 1.00 0.00 H new ATOM 0 HG LEU A 86 6.223 11.692 -19.124 1.00 0.00 H new ATOM 0 HD11 LEU A 86 7.799 11.433 -21.017 1.00 0.00 H new ATOM 0 HD12 LEU A 86 6.228 12.055 -21.576 1.00 0.00 H new ATOM 0 HD13 LEU A 86 7.614 13.159 -21.410 1.00 0.00 H new ATOM 0 HD21 LEU A 86 8.666 12.076 -18.778 1.00 0.00 H new ATOM 0 HD22 LEU A 86 8.449 13.795 -19.185 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.703 13.128 -17.713 1.00 0.00 H new ATOM 1374 N ALA A 87 4.083 11.119 -20.384 1.00 0.00 N ATOM 1375 CA ALA A 87 3.846 10.003 -21.259 1.00 0.00 C ATOM 1376 C ALA A 87 2.426 10.065 -21.819 1.00 0.00 C ATOM 1377 O ALA A 87 2.258 10.167 -23.026 1.00 0.00 O ATOM 1378 CB ALA A 87 4.065 8.734 -20.436 1.00 0.00 C ATOM 0 H ALA A 87 4.314 10.837 -19.431 1.00 0.00 H new ATOM 0 HA ALA A 87 4.525 10.018 -22.112 1.00 0.00 H new ATOM 0 HB1 ALA A 87 3.895 7.859 -21.064 1.00 0.00 H new ATOM 0 HB2 ALA A 87 5.088 8.717 -20.059 1.00 0.00 H new ATOM 0 HB3 ALA A 87 3.369 8.720 -19.597 1.00 0.00 H new ATOM 1384 N GLN A 88 1.403 10.010 -20.956 1.00 0.00 N ATOM 1385 CA GLN A 88 -0.003 10.064 -21.358 1.00 0.00 C ATOM 1386 C GLN A 88 -0.357 11.358 -22.080 1.00 0.00 C ATOM 1387 O GLN A 88 -1.371 11.425 -22.775 1.00 0.00 O ATOM 1388 CB GLN A 88 -0.912 9.876 -20.159 1.00 0.00 C ATOM 1389 CG GLN A 88 -0.526 10.825 -19.042 1.00 0.00 C ATOM 1390 CD GLN A 88 -1.460 10.692 -17.848 1.00 0.00 C ATOM 1391 OE1 GLN A 88 -2.606 11.131 -17.885 1.00 0.00 O ATOM 1392 NE2 GLN A 88 -0.967 10.080 -16.777 1.00 0.00 N ATOM 0 H GLN A 88 1.533 9.926 -19.948 1.00 0.00 H new ATOM 0 HA GLN A 88 -0.156 9.245 -22.061 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -1.948 10.051 -20.450 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -0.850 8.846 -19.806 1.00 0.00 H new ATOM 0 HG2 GLN A 88 0.498 10.622 -18.728 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -0.549 11.851 -19.411 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -0.009 9.729 -16.786 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -1.546 9.961 -15.946 1.00 0.00 H new ATOM 1401 N GLY A 89 0.480 12.382 -21.917 1.00 0.00 N ATOM 1402 CA GLY A 89 0.308 13.665 -22.573 1.00 0.00 C ATOM 1403 C GLY A 89 1.147 13.722 -23.848 1.00 0.00 C ATOM 1404 O GLY A 89 1.311 14.790 -24.439 1.00 0.00 O ATOM 0 H GLY A 89 1.304 12.337 -21.318 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.744 13.821 -22.814 1.00 0.00 H new ATOM 0 HA3 GLY A 89 0.603 14.469 -21.899 1.00 0.00 H new ATOM 1408 N ALA A 90 1.674 12.567 -24.266 1.00 0.00 N ATOM 1409 CA ALA A 90 2.524 12.444 -25.437 1.00 0.00 C ATOM 1410 C ALA A 90 2.210 11.199 -26.254 1.00 0.00 C ATOM 1411 O ALA A 90 2.556 11.150 -27.435 1.00 0.00 O ATOM 1412 CB ALA A 90 3.956 12.284 -24.953 1.00 0.00 C ATOM 0 H ALA A 90 1.515 11.681 -23.787 1.00 0.00 H new ATOM 0 HA ALA A 90 2.366 13.327 -26.056 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.622 12.189 -25.811 1.00 0.00 H new ATOM 0 HB2 ALA A 90 4.242 13.158 -24.367 1.00 0.00 H new ATOM 0 HB3 ALA A 90 4.033 11.391 -24.333 1.00 0.00 H new ATOM 1418 N VAL A 91 1.571 10.196 -25.645 1.00 0.00 N ATOM 1419 CA VAL A 91 1.427 8.900 -26.295 1.00 0.00 C ATOM 1420 C VAL A 91 0.881 9.010 -27.713 1.00 0.00 C ATOM 1421 O VAL A 91 1.455 8.479 -28.663 1.00 0.00 O ATOM 1422 CB VAL A 91 0.503 8.011 -25.510 1.00 0.00 C ATOM 1423 CG1 VAL A 91 0.664 6.565 -25.924 1.00 0.00 C ATOM 1424 CG2 VAL A 91 0.518 8.148 -24.015 1.00 0.00 C ATOM 0 H VAL A 91 1.153 10.258 -24.717 1.00 0.00 H new ATOM 0 HA VAL A 91 2.430 8.475 -26.338 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.486 8.381 -25.781 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -0.015 5.942 -25.342 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.432 6.462 -26.984 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.691 6.247 -25.745 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -0.195 7.448 -23.578 1.00 0.00 H new ATOM 0 HG22 VAL A 91 1.518 7.929 -23.640 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.242 9.166 -23.740 1.00 0.00 H new ATOM 1434 N GLY A 92 -0.241 9.712 -27.826 1.00 0.00 N ATOM 1435 CA GLY A 92 -0.967 9.901 -29.069 1.00 0.00 C ATOM 1436 C GLY A 92 -0.660 11.243 -29.730 1.00 0.00 C ATOM 1437 O GLY A 92 -1.242 11.561 -30.768 1.00 0.00 O ATOM 0 H GLY A 92 -0.680 10.177 -27.031 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -0.716 9.095 -29.758 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -2.037 9.832 -28.874 1.00 0.00 H new ATOM 1441 N SER A 93 0.243 12.037 -29.145 1.00 0.00 N ATOM 1442 CA SER A 93 0.634 13.343 -29.670 1.00 0.00 C ATOM 1443 C SER A 93 1.583 13.216 -30.858 1.00 0.00 C ATOM 1444 O SER A 93 2.315 14.154 -31.176 1.00 0.00 O ATOM 1445 CB SER A 93 1.275 14.169 -28.555 1.00 0.00 C ATOM 1446 OG SER A 93 0.387 14.271 -27.462 1.00 0.00 O ATOM 0 H SER A 93 0.727 11.785 -28.283 1.00 0.00 H new ATOM 0 HA SER A 93 -0.262 13.849 -30.029 1.00 0.00 H new ATOM 0 HB2 SER A 93 2.207 13.703 -28.235 1.00 0.00 H new ATOM 0 HB3 SER A 93 1.526 15.163 -28.925 1.00 0.00 H new ATOM 0 HG SER A 93 0.798 14.813 -26.756 1.00 0.00 H new ATOM 1452 N VAL A 94 1.566 12.057 -31.513 1.00 0.00 N ATOM 1453 CA VAL A 94 2.391 11.776 -32.679 1.00 0.00 C ATOM 1454 C VAL A 94 1.540 11.086 -33.733 1.00 0.00 C ATOM 1455 O VAL A 94 1.231 9.900 -33.628 1.00 0.00 O ATOM 1456 CB VAL A 94 3.601 10.908 -32.313 1.00 0.00 C ATOM 1457 CG1 VAL A 94 4.438 10.692 -33.572 1.00 0.00 C ATOM 1458 CG2 VAL A 94 4.461 11.602 -31.262 1.00 0.00 C ATOM 0 H VAL A 94 0.968 11.276 -31.242 1.00 0.00 H new ATOM 0 HA VAL A 94 2.775 12.717 -33.073 1.00 0.00 H new ATOM 0 HB VAL A 94 3.252 9.958 -31.909 1.00 0.00 H new ATOM 0 HG11 VAL A 94 5.304 10.076 -33.332 1.00 0.00 H new ATOM 0 HG12 VAL A 94 3.835 10.190 -34.328 1.00 0.00 H new ATOM 0 HG13 VAL A 94 4.773 11.656 -33.956 1.00 0.00 H new ATOM 0 HG21 VAL A 94 5.315 10.970 -31.015 1.00 0.00 H new ATOM 0 HG22 VAL A 94 4.816 12.555 -31.654 1.00 0.00 H new ATOM 0 HG23 VAL A 94 3.868 11.777 -30.364 1.00 0.00 H new ATOM 1468 N GLN A 95 1.171 11.860 -34.750 1.00 0.00 N ATOM 1469 CA GLN A 95 0.411 11.397 -35.890 1.00 0.00 C ATOM 1470 C GLN A 95 1.304 10.768 -36.964 1.00 0.00 C ATOM 1471 O GLN A 95 0.804 10.391 -38.024 1.00 0.00 O ATOM 1472 CB GLN A 95 -0.331 12.603 -36.459 1.00 0.00 C ATOM 1473 CG GLN A 95 -1.284 13.221 -35.431 1.00 0.00 C ATOM 1474 CD GLN A 95 -2.269 12.193 -34.890 1.00 0.00 C ATOM 1475 OE1 GLN A 95 -3.189 11.771 -35.585 1.00 0.00 O ATOM 1476 NE2 GLN A 95 -2.083 11.777 -33.640 1.00 0.00 N ATOM 0 H GLN A 95 1.402 12.852 -34.798 1.00 0.00 H new ATOM 0 HA GLN A 95 -0.282 10.618 -35.572 1.00 0.00 H new ATOM 0 HB2 GLN A 95 0.390 13.353 -36.784 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -0.895 12.300 -37.341 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -0.708 13.642 -34.607 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -1.832 14.044 -35.890 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -1.309 12.148 -33.089 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -2.715 11.088 -33.233 1.00 0.00 H new ATOM 1485 N ILE A 96 2.608 10.651 -36.708 1.00 0.00 N ATOM 1486 CA ILE A 96 3.561 10.123 -37.681 1.00 0.00 C ATOM 1487 C ILE A 96 4.633 9.255 -36.998 1.00 0.00 C ATOM 1488 O ILE A 96 5.828 9.467 -37.194 1.00 0.00 O ATOM 1489 CB ILE A 96 4.119 11.292 -38.513 1.00 0.00 C ATOM 1490 CG1 ILE A 96 5.003 10.855 -39.691 1.00 0.00 C ATOM 1491 CG2 ILE A 96 4.879 12.300 -37.650 1.00 0.00 C ATOM 1492 CD1 ILE A 96 4.281 9.847 -40.587 1.00 0.00 C ATOM 0 H ILE A 96 3.031 10.920 -35.820 1.00 0.00 H new ATOM 0 HA ILE A 96 3.065 9.444 -38.375 1.00 0.00 H new ATOM 0 HB ILE A 96 3.235 11.771 -38.934 1.00 0.00 H new ATOM 0 HG12 ILE A 96 5.287 11.728 -40.278 1.00 0.00 H new ATOM 0 HG13 ILE A 96 5.924 10.413 -39.312 1.00 0.00 H new ATOM 0 HG21 ILE A 96 5.255 13.107 -38.279 1.00 0.00 H new ATOM 0 HG22 ILE A 96 4.209 12.710 -36.895 1.00 0.00 H new ATOM 0 HG23 ILE A 96 5.716 11.802 -37.161 1.00 0.00 H new ATOM 0 HD11 ILE A 96 4.934 9.559 -41.410 1.00 0.00 H new ATOM 0 HD12 ILE A 96 4.020 8.964 -40.004 1.00 0.00 H new ATOM 0 HD13 ILE A 96 3.373 10.300 -40.986 1.00 0.00 H new ATOM 1504 N PRO A 97 4.221 8.267 -36.186 1.00 0.00 N ATOM 1505 CA PRO A 97 5.122 7.379 -35.477 1.00 0.00 C ATOM 1506 C PRO A 97 5.779 6.389 -36.439 1.00 0.00 C ATOM 1507 O PRO A 97 5.532 6.418 -37.645 1.00 0.00 O ATOM 1508 CB PRO A 97 4.246 6.662 -34.451 1.00 0.00 C ATOM 1509 CG PRO A 97 2.885 6.600 -35.147 1.00 0.00 C ATOM 1510 CD PRO A 97 2.838 7.926 -35.901 1.00 0.00 C ATOM 0 HA PRO A 97 5.940 7.918 -34.999 1.00 0.00 H new ATOM 0 HB2 PRO A 97 4.627 5.667 -34.219 1.00 0.00 H new ATOM 0 HB3 PRO A 97 4.194 7.210 -33.510 1.00 0.00 H new ATOM 0 HG2 PRO A 97 2.813 5.747 -35.822 1.00 0.00 H new ATOM 0 HG3 PRO A 97 2.067 6.511 -34.432 1.00 0.00 H new ATOM 0 HD2 PRO A 97 2.260 7.833 -36.821 1.00 0.00 H new ATOM 0 HD3 PRO A 97 2.360 8.700 -35.301 1.00 0.00 H new ATOM 1518 N VAL A 98 6.620 5.502 -35.898 1.00 0.00 N ATOM 1519 CA VAL A 98 7.318 4.474 -36.664 1.00 0.00 C ATOM 1520 C VAL A 98 6.362 3.350 -37.058 1.00 0.00 C ATOM 1521 O VAL A 98 6.457 2.231 -36.556 1.00 0.00 O ATOM 1522 CB VAL A 98 8.525 3.954 -35.880 1.00 0.00 C ATOM 1523 CG1 VAL A 98 9.393 3.043 -36.752 1.00 0.00 C ATOM 1524 CG2 VAL A 98 9.404 5.113 -35.400 1.00 0.00 C ATOM 0 H VAL A 98 6.836 5.481 -34.901 1.00 0.00 H new ATOM 0 HA VAL A 98 7.692 4.915 -37.588 1.00 0.00 H new ATOM 0 HB VAL A 98 8.135 3.398 -35.028 1.00 0.00 H new ATOM 0 HG11 VAL A 98 10.244 2.687 -36.172 1.00 0.00 H new ATOM 0 HG12 VAL A 98 8.802 2.192 -37.090 1.00 0.00 H new ATOM 0 HG13 VAL A 98 9.752 3.601 -37.617 1.00 0.00 H new ATOM 0 HG21 VAL A 98 10.255 4.718 -34.845 1.00 0.00 H new ATOM 0 HG22 VAL A 98 9.762 5.679 -36.260 1.00 0.00 H new ATOM 0 HG23 VAL A 98 8.821 5.768 -34.752 1.00 0.00 H new ATOM 1534 N VAL A 99 5.429 3.655 -37.964 1.00 0.00 N ATOM 1535 CA VAL A 99 4.470 2.692 -38.482 1.00 0.00 C ATOM 1536 C VAL A 99 5.186 1.682 -39.375 1.00 0.00 C ATOM 1537 O VAL A 99 5.279 1.858 -40.589 1.00 0.00 O ATOM 1538 CB VAL A 99 3.351 3.397 -39.253 1.00 0.00 C ATOM 1539 CG1 VAL A 99 2.327 2.360 -39.715 1.00 0.00 C ATOM 1540 CG2 VAL A 99 2.634 4.410 -38.362 1.00 0.00 C ATOM 0 H VAL A 99 5.322 4.589 -38.359 1.00 0.00 H new ATOM 0 HA VAL A 99 4.015 2.164 -37.644 1.00 0.00 H new ATOM 0 HB VAL A 99 3.794 3.913 -40.105 1.00 0.00 H new ATOM 0 HG11 VAL A 99 1.528 2.857 -40.265 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.814 1.631 -40.363 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.908 1.851 -38.847 1.00 0.00 H new ATOM 0 HG21 VAL A 99 1.843 4.899 -38.931 1.00 0.00 H new ATOM 0 HG22 VAL A 99 2.200 3.897 -37.504 1.00 0.00 H new ATOM 0 HG23 VAL A 99 3.347 5.158 -38.015 1.00 0.00 H new ATOM 1550 N GLU A 100 5.699 0.615 -38.761 1.00 0.00 N ATOM 1551 CA GLU A 100 6.342 -0.483 -39.464 1.00 0.00 C ATOM 1552 C GLU A 100 5.318 -1.283 -40.271 1.00 0.00 C ATOM 1553 O GLU A 100 4.132 -0.950 -40.301 1.00 0.00 O ATOM 1554 CB GLU A 100 7.065 -1.380 -38.458 1.00 0.00 C ATOM 1555 CG GLU A 100 6.123 -2.354 -37.775 1.00 0.00 C ATOM 1556 CD GLU A 100 6.750 -2.930 -36.509 1.00 0.00 C ATOM 1557 OE1 GLU A 100 7.629 -3.813 -36.642 1.00 0.00 O ATOM 1558 OE2 GLU A 100 6.346 -2.486 -35.411 1.00 0.00 O ATOM 0 H GLU A 100 5.677 0.493 -37.749 1.00 0.00 H new ATOM 0 HA GLU A 100 7.072 -0.078 -40.165 1.00 0.00 H new ATOM 0 HB2 GLU A 100 7.851 -1.936 -38.969 1.00 0.00 H new ATOM 0 HB3 GLU A 100 7.551 -0.760 -37.705 1.00 0.00 H new ATOM 0 HG2 GLU A 100 5.191 -1.848 -37.525 1.00 0.00 H new ATOM 0 HG3 GLU A 100 5.872 -3.163 -38.461 1.00 0.00 H new ATOM 1565 N VAL A 101 5.794 -2.343 -40.926 1.00 0.00 N ATOM 1566 CA VAL A 101 4.945 -3.253 -41.676 1.00 0.00 C ATOM 1567 C VAL A 101 5.257 -4.680 -41.250 1.00 0.00 C ATOM 1568 O VAL A 101 6.421 -5.036 -41.072 1.00 0.00 O ATOM 1569 CB VAL A 101 5.159 -3.040 -43.177 1.00 0.00 C ATOM 1570 CG1 VAL A 101 4.256 -3.964 -43.994 1.00 0.00 C ATOM 1571 CG2 VAL A 101 4.839 -1.595 -43.556 1.00 0.00 C ATOM 0 H VAL A 101 6.783 -2.590 -40.948 1.00 0.00 H new ATOM 0 HA VAL A 101 3.893 -3.058 -41.467 1.00 0.00 H new ATOM 0 HB VAL A 101 6.203 -3.265 -43.397 1.00 0.00 H new ATOM 0 HG11 VAL A 101 4.427 -3.793 -45.057 1.00 0.00 H new ATOM 0 HG12 VAL A 101 4.483 -5.002 -43.752 1.00 0.00 H new ATOM 0 HG13 VAL A 101 3.213 -3.756 -43.756 1.00 0.00 H new ATOM 0 HG21 VAL A 101 4.995 -1.456 -44.626 1.00 0.00 H new ATOM 0 HG22 VAL A 101 3.800 -1.376 -43.309 1.00 0.00 H new ATOM 0 HG23 VAL A 101 5.493 -0.921 -43.004 1.00 0.00 H new ATOM 1581 N ASP A 102 4.210 -5.492 -41.088 1.00 0.00 N ATOM 1582 CA ASP A 102 4.342 -6.842 -40.561 1.00 0.00 C ATOM 1583 C ASP A 102 3.282 -7.766 -41.156 1.00 0.00 C ATOM 1584 O ASP A 102 2.857 -8.740 -40.537 1.00 0.00 O ATOM 1585 CB ASP A 102 4.257 -6.780 -39.033 1.00 0.00 C ATOM 1586 CG ASP A 102 4.653 -8.100 -38.376 1.00 0.00 C ATOM 1587 OD1 ASP A 102 5.690 -8.664 -38.788 1.00 0.00 O ATOM 1588 OD2 ASP A 102 3.915 -8.534 -37.463 1.00 0.00 O ATOM 0 H ASP A 102 3.252 -5.229 -41.319 1.00 0.00 H new ATOM 0 HA ASP A 102 5.308 -7.259 -40.844 1.00 0.00 H new ATOM 0 HB2 ASP A 102 4.907 -5.985 -38.667 1.00 0.00 H new ATOM 0 HB3 ASP A 102 3.240 -6.521 -38.738 1.00 0.00 H new ATOM 1593 N GLU A 103 2.852 -7.442 -42.378 1.00 0.00 N ATOM 1594 CA GLU A 103 1.827 -8.184 -43.100 1.00 0.00 C ATOM 1595 C GLU A 103 2.248 -9.628 -43.366 1.00 0.00 C ATOM 1596 O GLU A 103 3.415 -10.000 -43.238 1.00 0.00 O ATOM 1597 CB GLU A 103 1.508 -7.442 -44.408 1.00 0.00 C ATOM 1598 CG GLU A 103 0.580 -8.186 -45.363 1.00 0.00 C ATOM 1599 CD GLU A 103 0.151 -7.279 -46.507 1.00 0.00 C ATOM 1600 OE1 GLU A 103 0.933 -7.149 -47.477 1.00 0.00 O ATOM 1601 OE2 GLU A 103 -0.964 -6.715 -46.408 1.00 0.00 O ATOM 0 H GLU A 103 3.215 -6.643 -42.898 1.00 0.00 H new ATOM 0 HA GLU A 103 0.929 -8.238 -42.484 1.00 0.00 H new ATOM 0 HB2 GLU A 103 1.056 -6.481 -44.162 1.00 0.00 H new ATOM 0 HB3 GLU A 103 2.444 -7.231 -44.926 1.00 0.00 H new ATOM 0 HG2 GLU A 103 1.087 -9.066 -45.760 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -0.298 -8.540 -44.823 1.00 0.00 H new ATOM 1608 N LEU A 104 1.249 -10.425 -43.747 1.00 0.00 N ATOM 1609 CA LEU A 104 1.357 -11.798 -44.195 1.00 0.00 C ATOM 1610 C LEU A 104 2.418 -11.994 -45.280 1.00 0.00 C ATOM 1611 O LEU A 104 2.963 -11.036 -45.829 1.00 0.00 O ATOM 1612 CB LEU A 104 0.002 -12.149 -44.793 1.00 0.00 C ATOM 1613 CG LEU A 104 -1.051 -12.455 -43.737 1.00 0.00 C ATOM 1614 CD1 LEU A 104 -2.429 -12.006 -44.208 1.00 0.00 C ATOM 1615 CD2 LEU A 104 -1.052 -13.972 -43.654 1.00 0.00 C ATOM 0 H LEU A 104 0.283 -10.099 -43.748 1.00 0.00 H new ATOM 0 HA LEU A 104 1.646 -12.425 -43.352 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -0.342 -11.320 -45.412 1.00 0.00 H new ATOM 0 HB3 LEU A 104 0.113 -13.012 -45.449 1.00 0.00 H new ATOM 0 HG LEU A 104 -0.839 -11.954 -42.793 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -3.168 -12.233 -43.440 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -2.418 -10.932 -44.394 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -2.688 -12.531 -45.127 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -1.784 -14.295 -42.914 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -1.311 -14.389 -44.627 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -0.062 -14.321 -43.361 1.00 0.00 H new ATOM 1627 N PRO A 105 2.697 -13.266 -45.584 1.00 0.00 N ATOM 1628 CA PRO A 105 3.550 -13.719 -46.669 1.00 0.00 C ATOM 1629 C PRO A 105 3.176 -13.081 -48.006 1.00 0.00 C ATOM 1630 O PRO A 105 2.075 -12.563 -48.176 1.00 0.00 O ATOM 1631 CB PRO A 105 3.356 -15.236 -46.693 1.00 0.00 C ATOM 1632 CG PRO A 105 3.078 -15.560 -45.232 1.00 0.00 C ATOM 1633 CD PRO A 105 2.167 -14.400 -44.865 1.00 0.00 C ATOM 0 HA PRO A 105 4.591 -13.434 -46.513 1.00 0.00 H new ATOM 0 HB2 PRO A 105 2.527 -15.528 -47.338 1.00 0.00 H new ATOM 0 HB3 PRO A 105 4.243 -15.752 -47.061 1.00 0.00 H new ATOM 0 HG2 PRO A 105 2.591 -16.527 -45.106 1.00 0.00 H new ATOM 0 HG3 PRO A 105 3.987 -15.581 -44.631 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.135 -14.602 -45.153 1.00 0.00 H new ATOM 0 HD3 PRO A 105 2.169 -14.222 -43.790 1.00 0.00 H new ATOM 1641 N GLU A 106 4.110 -13.124 -48.957 1.00 0.00 N ATOM 1642 CA GLU A 106 3.950 -12.506 -50.269 1.00 0.00 C ATOM 1643 C GLU A 106 3.026 -13.317 -51.184 1.00 0.00 C ATOM 1644 O GLU A 106 3.001 -13.103 -52.395 1.00 0.00 O ATOM 1645 CB GLU A 106 5.343 -12.333 -50.888 1.00 0.00 C ATOM 1646 CG GLU A 106 5.366 -11.270 -51.992 1.00 0.00 C ATOM 1647 CD GLU A 106 6.788 -11.042 -52.500 1.00 0.00 C ATOM 1648 OE1 GLU A 106 7.482 -10.179 -51.911 1.00 0.00 O ATOM 1649 OE2 GLU A 106 7.179 -11.727 -53.473 1.00 0.00 O ATOM 0 H GLU A 106 5.007 -13.594 -48.834 1.00 0.00 H new ATOM 0 HA GLU A 106 3.470 -11.534 -50.152 1.00 0.00 H new ATOM 0 HB2 GLU A 106 6.052 -12.057 -50.108 1.00 0.00 H new ATOM 0 HB3 GLU A 106 5.676 -13.286 -51.299 1.00 0.00 H new ATOM 0 HG2 GLU A 106 4.727 -11.583 -52.817 1.00 0.00 H new ATOM 0 HG3 GLU A 106 4.958 -10.334 -51.610 1.00 0.00 H new ATOM 1656 N GLY A 107 2.260 -14.251 -50.619 1.00 0.00 N ATOM 1657 CA GLY A 107 1.421 -15.133 -51.415 1.00 0.00 C ATOM 1658 C GLY A 107 0.552 -16.059 -50.571 1.00 0.00 C ATOM 1659 O GLY A 107 0.323 -17.201 -50.967 1.00 0.00 O ATOM 0 H GLY A 107 2.207 -14.412 -49.613 1.00 0.00 H new ATOM 0 HA2 GLY A 107 0.780 -14.531 -52.059 1.00 0.00 H new ATOM 0 HA3 GLY A 107 2.054 -15.734 -52.068 1.00 0.00 H new ATOM 1663 N TYR A 108 0.061 -15.592 -49.415 1.00 0.00 N ATOM 1664 CA TYR A 108 -0.801 -16.357 -48.548 1.00 0.00 C ATOM 1665 C TYR A 108 -2.069 -16.848 -49.241 1.00 0.00 C ATOM 1666 O TYR A 108 -2.384 -16.454 -50.365 1.00 0.00 O ATOM 1667 CB TYR A 108 -1.179 -15.411 -47.422 1.00 0.00 C ATOM 1668 CG TYR A 108 -1.589 -16.088 -46.154 1.00 0.00 C ATOM 1669 CD1 TYR A 108 -0.576 -16.495 -45.282 1.00 0.00 C ATOM 1670 CD2 TYR A 108 -2.937 -16.268 -45.817 1.00 0.00 C ATOM 1671 CE1 TYR A 108 -0.904 -16.973 -44.015 1.00 0.00 C ATOM 1672 CE2 TYR A 108 -3.273 -16.825 -44.574 1.00 0.00 C ATOM 1673 CZ TYR A 108 -2.252 -17.162 -43.656 1.00 0.00 C ATOM 1674 OH TYR A 108 -2.574 -17.666 -42.430 1.00 0.00 O ATOM 0 H TYR A 108 0.264 -14.656 -49.064 1.00 0.00 H new ATOM 0 HA TYR A 108 -0.281 -17.254 -48.210 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -0.331 -14.759 -47.213 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -1.996 -14.773 -47.759 1.00 0.00 H new ATOM 0 HD1 TYR A 108 0.458 -16.439 -45.589 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -3.713 -15.980 -46.510 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -0.121 -17.199 -43.306 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -4.309 -16.996 -44.319 1.00 0.00 H new ATOM 0 HH TYR A 108 -3.548 -17.730 -42.348 1.00 0.00 H new ATOM 1684 N ASP A 109 -2.800 -17.714 -48.539 1.00 0.00 N ATOM 1685 CA ASP A 109 -4.100 -18.187 -48.970 1.00 0.00 C ATOM 1686 C ASP A 109 -4.946 -18.531 -47.748 1.00 0.00 C ATOM 1687 O ASP A 109 -4.416 -18.967 -46.722 1.00 0.00 O ATOM 1688 CB ASP A 109 -3.915 -19.405 -49.882 1.00 0.00 C ATOM 1689 CG ASP A 109 -5.250 -19.916 -50.426 1.00 0.00 C ATOM 1690 OD1 ASP A 109 -6.101 -19.068 -50.782 1.00 0.00 O ATOM 1691 OD2 ASP A 109 -5.410 -21.156 -50.484 1.00 0.00 O ATOM 0 H ASP A 109 -2.497 -18.106 -47.648 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.618 -17.411 -49.533 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -3.261 -19.141 -50.713 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.419 -20.202 -49.328 1.00 0.00 H new ATOM 1696 N ARG A 110 -6.264 -18.338 -47.851 1.00 0.00 N ATOM 1697 CA ARG A 110 -7.178 -18.509 -46.733 1.00 0.00 C ATOM 1698 C ARG A 110 -8.512 -19.041 -47.248 1.00 0.00 C ATOM 1699 O ARG A 110 -9.391 -18.272 -47.635 1.00 0.00 O ATOM 1700 CB ARG A 110 -7.331 -17.167 -46.006 1.00 0.00 C ATOM 1701 CG ARG A 110 -7.909 -17.313 -44.589 1.00 0.00 C ATOM 1702 CD ARG A 110 -9.341 -17.851 -44.579 1.00 0.00 C ATOM 1703 NE ARG A 110 -9.903 -17.840 -43.225 1.00 0.00 N ATOM 1704 CZ ARG A 110 -11.169 -18.157 -42.940 1.00 0.00 C ATOM 1705 NH1 ARG A 110 -12.011 -18.523 -43.903 1.00 0.00 N ATOM 1706 NH2 ARG A 110 -11.595 -18.109 -41.682 1.00 0.00 N ATOM 0 H ARG A 110 -6.722 -18.058 -48.718 1.00 0.00 H new ATOM 0 HA ARG A 110 -6.788 -19.235 -46.020 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -6.358 -16.679 -45.947 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -7.979 -16.515 -46.591 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -7.272 -17.981 -44.010 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -7.888 -16.343 -44.092 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -9.964 -17.247 -45.239 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -9.353 -18.868 -44.972 1.00 0.00 H new ATOM 0 HE ARG A 110 -9.290 -17.574 -42.454 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -11.692 -18.564 -44.871 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -12.975 -18.763 -43.673 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -10.956 -17.831 -40.937 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -12.561 -18.350 -41.461 1.00 0.00 H new ATOM 1720 N SER A 111 -8.660 -20.368 -47.252 1.00 0.00 N ATOM 1721 CA SER A 111 -9.880 -21.038 -47.688 1.00 0.00 C ATOM 1722 C SER A 111 -10.117 -22.320 -46.893 1.00 0.00 C ATOM 1723 O SER A 111 -11.254 -22.839 -46.970 1.00 0.00 O ATOM 1724 CB SER A 111 -9.791 -21.342 -49.182 1.00 0.00 C ATOM 1725 OG SER A 111 -8.699 -22.194 -49.449 1.00 0.00 O ATOM 1726 OXT SER A 111 -9.167 -22.777 -46.219 1.00 0.00 O ATOM 0 H SER A 111 -7.928 -21.010 -46.949 1.00 0.00 H new ATOM 0 HA SER A 111 -10.726 -20.375 -47.506 1.00 0.00 H new ATOM 0 HB2 SER A 111 -10.716 -21.810 -49.520 1.00 0.00 H new ATOM 0 HB3 SER A 111 -9.681 -20.413 -49.742 1.00 0.00 H new ATOM 0 HG SER A 111 -8.657 -22.380 -50.410 1.00 0.00 H new TER 1732 SER A 111 ATOM 1733 N ALA B 701 19.602 18.962 -16.480 1.00 0.00 N ATOM 1734 CA ALA B 701 19.308 18.024 -15.381 1.00 0.00 C ATOM 1735 C ALA B 701 19.316 18.746 -14.035 1.00 0.00 C ATOM 1736 O ALA B 701 20.340 19.297 -13.633 1.00 0.00 O ATOM 1737 CB ALA B 701 20.303 16.861 -15.377 1.00 0.00 C ATOM 0 HA ALA B 701 18.310 17.617 -15.543 1.00 0.00 H new ATOM 0 HB1 ALA B 701 20.066 16.182 -14.558 1.00 0.00 H new ATOM 0 HB2 ALA B 701 20.239 16.324 -16.323 1.00 0.00 H new ATOM 0 HB3 ALA B 701 21.314 17.247 -15.247 1.00 0.00 H new ATOM 1745 N ASP B 702 18.175 18.741 -13.342 1.00 0.00 N ATOM 1746 CA ASP B 702 18.031 19.398 -12.044 1.00 0.00 C ATOM 1747 C ASP B 702 17.000 18.665 -11.185 1.00 0.00 C ATOM 1748 O ASP B 702 16.382 19.248 -10.295 1.00 0.00 O ATOM 1749 CB ASP B 702 17.652 20.864 -12.266 1.00 0.00 C ATOM 1750 CG ASP B 702 17.692 21.673 -10.970 1.00 0.00 C ATOM 1751 OD1 ASP B 702 18.700 21.552 -10.238 1.00 0.00 O ATOM 1752 OD2 ASP B 702 16.712 22.410 -10.724 1.00 0.00 O ATOM 0 H ASP B 702 17.325 18.280 -13.667 1.00 0.00 H new ATOM 0 HA ASP B 702 18.977 19.365 -11.503 1.00 0.00 H new ATOM 0 HB2 ASP B 702 18.334 21.308 -12.991 1.00 0.00 H new ATOM 0 HB3 ASP B 702 16.652 20.918 -12.695 1.00 0.00 H new ATOM 1757 N THR B 703 16.811 17.371 -11.455 1.00 0.00 N ATOM 1758 CA THR B 703 15.807 16.549 -10.797 1.00 0.00 C ATOM 1759 C THR B 703 16.247 15.089 -10.768 1.00 0.00 C ATOM 1760 O THR B 703 17.147 14.688 -11.503 1.00 0.00 O ATOM 1761 CB THR B 703 14.477 16.713 -11.529 1.00 0.00 C ATOM 1762 OG1 THR B 703 13.491 15.947 -10.882 1.00 0.00 O ATOM 1763 CG2 THR B 703 14.635 16.286 -12.986 1.00 0.00 C ATOM 0 H THR B 703 17.362 16.863 -12.147 1.00 0.00 H new ATOM 0 HA THR B 703 15.685 16.872 -9.763 1.00 0.00 H new ATOM 0 HB THR B 703 14.170 17.759 -11.512 1.00 0.00 H new ATOM 0 HG1 THR B 703 12.603 16.282 -11.128 1.00 0.00 H new ATOM 0 HG21 THR B 703 13.684 16.404 -13.505 1.00 0.00 H new ATOM 0 HG22 THR B 703 15.391 16.907 -13.467 1.00 0.00 H new ATOM 0 HG23 THR B 703 14.943 15.241 -13.028 1.00 0.00 H new ATOM 1771 N GLU B 704 15.609 14.291 -9.914 1.00 0.00 N ATOM 1772 CA GLU B 704 15.934 12.882 -9.766 1.00 0.00 C ATOM 1773 C GLU B 704 15.151 12.024 -10.758 1.00 0.00 C ATOM 1774 O GLU B 704 15.519 10.876 -10.985 1.00 0.00 O ATOM 1775 CB GLU B 704 15.682 12.441 -8.326 1.00 0.00 C ATOM 1776 CG GLU B 704 14.218 12.618 -7.930 1.00 0.00 C ATOM 1777 CD GLU B 704 14.010 12.313 -6.445 1.00 0.00 C ATOM 1778 OE1 GLU B 704 14.493 11.250 -5.990 1.00 0.00 O ATOM 1779 OE2 GLU B 704 13.365 13.149 -5.772 1.00 0.00 O ATOM 0 H GLU B 704 14.853 14.607 -9.307 1.00 0.00 H new ATOM 0 HA GLU B 704 16.991 12.743 -9.991 1.00 0.00 H new ATOM 0 HB2 GLU B 704 15.966 11.395 -8.210 1.00 0.00 H new ATOM 0 HB3 GLU B 704 16.314 13.020 -7.652 1.00 0.00 H new ATOM 0 HG2 GLU B 704 13.901 13.639 -8.143 1.00 0.00 H new ATOM 0 HG3 GLU B 704 13.593 11.958 -8.531 1.00 0.00 H new ATOM 1786 N MET B 705 14.080 12.555 -11.358 1.00 0.00 N ATOM 1787 CA MET B 705 13.390 11.833 -12.426 1.00 0.00 C ATOM 1788 C MET B 705 14.233 11.836 -13.695 1.00 0.00 C ATOM 1789 O MET B 705 14.023 11.012 -14.581 1.00 0.00 O ATOM 1790 CB MET B 705 12.028 12.434 -12.725 1.00 0.00 C ATOM 1791 CG MET B 705 12.086 13.952 -12.905 1.00 0.00 C ATOM 1792 SD MET B 705 10.613 14.848 -12.353 1.00 0.00 S ATOM 1793 CE MET B 705 10.255 13.871 -10.870 1.00 0.00 C ATOM 0 H MET B 705 13.680 13.464 -11.127 1.00 0.00 H new ATOM 0 HA MET B 705 13.243 10.809 -12.082 1.00 0.00 H new ATOM 0 HB2 MET B 705 11.624 11.979 -13.629 1.00 0.00 H new ATOM 0 HB3 MET B 705 11.342 12.193 -11.913 1.00 0.00 H new ATOM 0 HG2 MET B 705 12.950 14.334 -12.361 1.00 0.00 H new ATOM 0 HG3 MET B 705 12.251 14.171 -13.960 1.00 0.00 H new ATOM 0 HE1 MET B 705 9.741 14.495 -10.139 1.00 0.00 H new ATOM 0 HE2 MET B 705 9.621 13.025 -11.136 1.00 0.00 H new ATOM 0 HE3 MET B 705 11.188 13.504 -10.442 1.00 0.00 H new ATOM 1803 N GLU B 706 15.185 12.770 -13.764 1.00 0.00 N ATOM 1804 CA GLU B 706 16.164 12.831 -14.835 1.00 0.00 C ATOM 1805 C GLU B 706 17.313 11.862 -14.511 1.00 0.00 C ATOM 1806 O GLU B 706 18.371 11.904 -15.137 1.00 0.00 O ATOM 1807 CB GLU B 706 16.629 14.281 -14.990 1.00 0.00 C ATOM 1808 CG GLU B 706 15.602 15.089 -15.790 1.00 0.00 C ATOM 1809 CD GLU B 706 15.575 14.651 -17.254 1.00 0.00 C ATOM 1810 OE1 GLU B 706 16.466 15.105 -18.005 1.00 0.00 O ATOM 1811 OE2 GLU B 706 14.668 13.868 -17.611 1.00 0.00 O ATOM 0 H GLU B 706 15.293 13.508 -13.069 1.00 0.00 H new ATOM 0 HA GLU B 706 15.739 12.521 -15.790 1.00 0.00 H new ATOM 0 HB2 GLU B 706 16.770 14.731 -14.007 1.00 0.00 H new ATOM 0 HB3 GLU B 706 17.595 14.308 -15.494 1.00 0.00 H new ATOM 0 HG2 GLU B 706 14.613 14.961 -15.351 1.00 0.00 H new ATOM 0 HG3 GLU B 706 15.843 16.150 -15.729 1.00 0.00 H new ATOM 1818 N GLU B 707 17.084 10.989 -13.527 1.00 0.00 N ATOM 1819 CA GLU B 707 17.973 9.929 -13.089 1.00 0.00 C ATOM 1820 C GLU B 707 17.094 8.701 -12.822 1.00 0.00 C ATOM 1821 O GLU B 707 15.866 8.813 -12.824 1.00 0.00 O ATOM 1822 CB GLU B 707 18.738 10.392 -11.843 1.00 0.00 C ATOM 1823 CG GLU B 707 19.951 9.512 -11.516 1.00 0.00 C ATOM 1824 CD GLU B 707 21.029 9.633 -12.592 1.00 0.00 C ATOM 1825 OE1 GLU B 707 20.952 8.871 -13.580 1.00 0.00 O ATOM 1826 OE2 GLU B 707 21.928 10.487 -12.423 1.00 0.00 O ATOM 0 H GLU B 707 16.219 11.011 -12.987 1.00 0.00 H new ATOM 0 HA GLU B 707 18.724 9.676 -13.837 1.00 0.00 H new ATOM 0 HB2 GLU B 707 19.072 11.419 -11.991 1.00 0.00 H new ATOM 0 HB3 GLU B 707 18.060 10.397 -10.989 1.00 0.00 H new ATOM 0 HG2 GLU B 707 20.364 9.802 -10.550 1.00 0.00 H new ATOM 0 HG3 GLU B 707 19.636 8.472 -11.429 1.00 0.00 H new ATOM 1833 N VAL B 708 17.679 7.527 -12.591 1.00 0.00 N ATOM 1834 CA VAL B 708 16.875 6.313 -12.599 1.00 0.00 C ATOM 1835 C VAL B 708 16.299 5.925 -11.240 1.00 0.00 C ATOM 1836 O VAL B 708 15.089 5.723 -11.136 1.00 0.00 O ATOM 1837 CB VAL B 708 17.670 5.165 -13.219 1.00 0.00 C ATOM 1838 CG1 VAL B 708 18.370 5.647 -14.487 1.00 0.00 C ATOM 1839 CG2 VAL B 708 18.727 4.570 -12.291 1.00 0.00 C ATOM 0 H VAL B 708 18.673 7.394 -12.402 1.00 0.00 H new ATOM 0 HA VAL B 708 16.002 6.529 -13.215 1.00 0.00 H new ATOM 0 HB VAL B 708 16.942 4.382 -13.430 1.00 0.00 H new ATOM 0 HG11 VAL B 708 18.936 4.825 -14.925 1.00 0.00 H new ATOM 0 HG12 VAL B 708 17.626 5.998 -15.202 1.00 0.00 H new ATOM 0 HG13 VAL B 708 19.049 6.463 -14.240 1.00 0.00 H new ATOM 0 HG21 VAL B 708 19.248 3.761 -12.804 1.00 0.00 H new ATOM 0 HG22 VAL B 708 19.443 5.343 -12.012 1.00 0.00 H new ATOM 0 HG23 VAL B 708 18.246 4.180 -11.394 1.00 0.00 H new ATOM 1849 N ASP B 709 17.122 5.816 -10.196 1.00 0.00 N ATOM 1850 CA ASP B 709 16.663 5.343 -8.896 1.00 0.00 C ATOM 1851 C ASP B 709 16.498 6.498 -7.901 1.00 0.00 C ATOM 1852 O ASP B 709 16.863 7.638 -8.262 1.00 0.00 O ATOM 1853 CB ASP B 709 17.617 4.287 -8.330 1.00 0.00 C ATOM 1854 CG ASP B 709 19.048 4.792 -8.140 1.00 0.00 C ATOM 1855 OD1 ASP B 709 19.602 5.395 -9.086 1.00 0.00 O ATOM 1856 OD2 ASP B 709 19.579 4.564 -7.028 1.00 0.00 O ATOM 1857 OXT ASP B 709 16.005 6.229 -6.785 1.00 0.00 O ATOM 0 H ASP B 709 18.114 6.051 -10.230 1.00 0.00 H new ATOM 0 HA ASP B 709 15.685 4.886 -9.045 1.00 0.00 H new ATOM 0 HB2 ASP B 709 17.233 3.940 -7.371 1.00 0.00 H new ATOM 0 HB3 ASP B 709 17.630 3.426 -8.999 1.00 0.00 H new TER 1862 ASP B 709