USER MOD reduce.3.24.130724 H: found=0, std=0, add=1084, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1078 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 130 TYR OH : rot 180:sc=-0.00804 USER MOD Set 1.2: A 134 MET CE :methyl 159:sc= -0.896 (180deg=-2.29) USER MOD Set 2.1: A 114 GLN : amide:sc= -0.309 X(o=-1.4,f=-0.93) USER MOD Set 2.2: A 118 GLN : amide:sc= -1.07 X(o=-1.4,f=-1.7!) USER MOD Set 3.1: A 55 LYS NZ :NH3+ -179:sc= 1.27 (180deg=1.26) USER MOD Set 3.2: A 109 GLN : amide:sc= 0.0738 K(o=1.3,f=-0.75) USER MOD Set 4.1: A 101 THR OG1 : rot -140:sc= 1.07 USER MOD Set 4.2: A 103 HIS : no HE2:sc= -0.194 K(o=2.5,f=1.4) USER MOD Set 4.3: A 104 SER OG : rot 67:sc= 1.59 USER MOD Set 5.1: A 61 GLN : amide:sc= -4.36! C(o=-4.7!,f=-17!) USER MOD Set 5.2: A 62 GLN : amide:sc= -0.332 X(o=-4.7,f=-4.7) USER MOD Single : A 1 GLY N :NH3+ -118:sc= 0.0891 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 34:sc= 0.991 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00195) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00419) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 HIS : no HD1:sc= -1.46 K(o=-1.5,f=-3.4!) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot -54:sc= 1.12 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 ASN : amide:sc= -0.0509 K(o=-0.051,f=-3.3!) USER MOD Single : A 51 CYS SG : rot 68:sc= 0.136 USER MOD Single : A 56 LYS NZ :NH3+ -146:sc= -0.0789 (180deg=-1.37!) USER MOD Single : A 57 SER OG : rot -90:sc= -1.01 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 HIS : no HD1:sc= -0.514 X(o=-0.51,f=-0.046) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 150:sc= 1.63 (180deg=-0.119) USER MOD Single : A 76 GLN :FLIP amide:sc= -4.3! C(o=-9.1!,f=-4.3!) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -4.71! C(o=-4.7!,f=-6.1!) USER MOD Single : A 88 HIS : no HD1:sc= -0.0116 X(o=-0.012,f=0) USER MOD Single : A 89 THR OG1 : rot -179:sc= -0.338 USER MOD Single : A 90 LYS NZ :NH3+ -140:sc= -0.351 (180deg=-2.3!) USER MOD Single : A 94 THR OG1 : rot 75:sc= 1.25 USER MOD Single : A 95 ASN : amide:sc= -0.0139 X(o=-0.014,f=0) USER MOD Single : A 96 SER OG : rot -49:sc= 0.183 USER MOD Single : A 98 THR OG1 : rot -25:sc= 0.321 USER MOD Single : A 99 GLN : amide:sc= -0.0445 X(o=-0.044,f=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 TYR OH : rot -112:sc= 0.0385 USER MOD Single : A 116 MET CE :methyl -136:sc= -2.09 (180deg=-4.45!) USER MOD Single : A 120 SER OG : rot -170:sc= -0.0726 USER MOD Single : A 121 TYR OH : rot 122:sc= -0.208 USER MOD Single : A 122 THR OG1 : rot -30:sc= 0.344 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -99:sc= 1.25 USER MOD Single : A 135 SER OG : rot -57:sc= 0.0781 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.949 -7.805 5.467 1.00 0.00 N ATOM 2 CA GLY A 1 -18.779 -8.439 4.173 1.00 0.00 C ATOM 3 C GLY A 1 -17.326 -8.501 3.745 1.00 0.00 C ATOM 4 O GLY A 1 -16.436 -8.075 4.481 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.363 -8.486 6.135 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.024 -7.489 5.823 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.582 -6.985 5.371 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -19.187 -9.449 4.210 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -19.352 -7.891 3.425 1.00 0.00 H new ATOM 8 N SER A 2 -17.084 -9.035 2.551 1.00 0.00 N ATOM 9 CA SER A 2 -15.728 -9.155 2.029 1.00 0.00 C ATOM 10 C SER A 2 -15.174 -7.790 1.635 1.00 0.00 C ATOM 11 O SER A 2 -14.096 -7.394 2.077 1.00 0.00 O ATOM 12 CB SER A 2 -15.707 -10.095 0.822 1.00 0.00 C ATOM 13 OG SER A 2 -14.420 -10.659 0.636 1.00 0.00 O ATOM 0 H SER A 2 -17.809 -9.391 1.928 1.00 0.00 H new ATOM 0 HA SER A 2 -15.097 -9.569 2.815 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.439 -10.890 0.964 1.00 0.00 H new ATOM 0 HB3 SER A 2 -16.001 -9.548 -0.074 1.00 0.00 H new ATOM 0 HG SER A 2 -14.434 -11.257 -0.140 1.00 0.00 H new ATOM 19 N SER A 3 -15.919 -7.075 0.799 1.00 0.00 N ATOM 20 CA SER A 3 -15.502 -5.754 0.341 1.00 0.00 C ATOM 21 C SER A 3 -15.509 -4.752 1.492 1.00 0.00 C ATOM 22 O SER A 3 -16.489 -4.643 2.228 1.00 0.00 O ATOM 23 CB SER A 3 -16.420 -5.266 -0.781 1.00 0.00 C ATOM 24 OG SER A 3 -16.245 -3.880 -1.016 1.00 0.00 O ATOM 0 H SER A 3 -16.815 -7.388 0.425 1.00 0.00 H new ATOM 0 HA SER A 3 -14.484 -5.834 -0.041 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.210 -5.822 -1.695 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.459 -5.465 -0.518 1.00 0.00 H new ATOM 0 HG SER A 3 -16.842 -3.593 -1.738 1.00 0.00 H new ATOM 30 N GLY A 4 -14.408 -4.023 1.641 1.00 0.00 N ATOM 31 CA GLY A 4 -14.308 -3.039 2.703 1.00 0.00 C ATOM 32 C GLY A 4 -14.326 -1.616 2.180 1.00 0.00 C ATOM 33 O GLY A 4 -15.086 -0.779 2.666 1.00 0.00 O ATOM 0 H GLY A 4 -13.583 -4.096 1.045 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.134 -3.177 3.400 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -13.387 -3.205 3.263 1.00 0.00 H new ATOM 37 N SER A 5 -13.486 -1.342 1.187 1.00 0.00 N ATOM 38 CA SER A 5 -13.405 -0.009 0.602 1.00 0.00 C ATOM 39 C SER A 5 -14.025 0.011 -0.793 1.00 0.00 C ATOM 40 O SER A 5 -14.282 -1.038 -1.384 1.00 0.00 O ATOM 41 CB SER A 5 -11.948 0.452 0.531 1.00 0.00 C ATOM 42 OG SER A 5 -11.396 0.598 1.828 1.00 0.00 O ATOM 0 H SER A 5 -12.853 -2.025 0.771 1.00 0.00 H new ATOM 0 HA SER A 5 -13.965 0.675 1.240 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.362 -0.270 -0.038 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.889 1.401 -0.002 1.00 0.00 H new ATOM 0 HG SER A 5 -10.464 0.892 1.756 1.00 0.00 H new ATOM 48 N SER A 6 -14.261 1.212 -1.311 1.00 0.00 N ATOM 49 CA SER A 6 -14.854 1.369 -2.634 1.00 0.00 C ATOM 50 C SER A 6 -13.794 1.752 -3.663 1.00 0.00 C ATOM 51 O SER A 6 -13.217 2.837 -3.601 1.00 0.00 O ATOM 52 CB SER A 6 -15.955 2.431 -2.600 1.00 0.00 C ATOM 53 OG SER A 6 -15.408 3.727 -2.421 1.00 0.00 O ATOM 0 H SER A 6 -14.051 2.090 -0.835 1.00 0.00 H new ATOM 0 HA SER A 6 -15.290 0.413 -2.925 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.525 2.398 -3.529 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.651 2.212 -1.791 1.00 0.00 H new ATOM 0 HG SER A 6 -14.538 3.780 -2.870 1.00 0.00 H new ATOM 59 N GLY A 7 -13.543 0.853 -4.609 1.00 0.00 N ATOM 60 CA GLY A 7 -12.553 1.114 -5.637 1.00 0.00 C ATOM 61 C GLY A 7 -13.098 1.974 -6.760 1.00 0.00 C ATOM 62 O GLY A 7 -14.290 2.276 -6.798 1.00 0.00 O ATOM 0 H GLY A 7 -14.008 -0.052 -4.682 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -11.691 1.609 -5.190 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.200 0.167 -6.046 1.00 0.00 H new ATOM 66 N SER A 8 -12.220 2.372 -7.677 1.00 0.00 N ATOM 67 CA SER A 8 -12.619 3.208 -8.803 1.00 0.00 C ATOM 68 C SER A 8 -12.063 2.656 -10.113 1.00 0.00 C ATOM 69 O SER A 8 -10.914 2.224 -10.196 1.00 0.00 O ATOM 70 CB SER A 8 -12.134 4.645 -8.596 1.00 0.00 C ATOM 71 OG SER A 8 -12.971 5.339 -7.687 1.00 0.00 O ATOM 0 H SER A 8 -11.229 2.129 -7.662 1.00 0.00 H new ATOM 0 HA SER A 8 -13.708 3.204 -8.859 1.00 0.00 H new ATOM 0 HB2 SER A 8 -11.111 4.636 -8.220 1.00 0.00 H new ATOM 0 HB3 SER A 8 -12.117 5.168 -9.552 1.00 0.00 H new ATOM 0 HG SER A 8 -12.639 6.254 -7.570 1.00 0.00 H new ATOM 77 N PRO A 9 -12.899 2.669 -11.161 1.00 0.00 N ATOM 78 CA PRO A 9 -12.515 2.174 -12.487 1.00 0.00 C ATOM 79 C PRO A 9 -11.490 3.076 -13.167 1.00 0.00 C ATOM 80 O PRO A 9 -10.982 2.752 -14.240 1.00 0.00 O ATOM 81 CB PRO A 9 -13.833 2.182 -13.264 1.00 0.00 C ATOM 82 CG PRO A 9 -14.666 3.216 -12.589 1.00 0.00 C ATOM 83 CD PRO A 9 -14.284 3.170 -11.135 1.00 0.00 C ATOM 0 HA PRO A 9 -12.041 1.194 -12.435 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -13.672 2.427 -14.314 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -14.315 1.205 -13.235 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -14.480 4.204 -13.011 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -15.728 3.009 -12.720 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -14.346 4.155 -10.672 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -14.940 2.509 -10.568 1.00 0.00 H new ATOM 91 N GLU A 10 -11.191 4.206 -12.535 1.00 0.00 N ATOM 92 CA GLU A 10 -10.226 5.154 -13.082 1.00 0.00 C ATOM 93 C GLU A 10 -8.818 4.845 -12.582 1.00 0.00 C ATOM 94 O GLU A 10 -7.848 4.933 -13.333 1.00 0.00 O ATOM 95 CB GLU A 10 -10.612 6.584 -12.703 1.00 0.00 C ATOM 96 CG GLU A 10 -9.546 7.612 -13.042 1.00 0.00 C ATOM 97 CD GLU A 10 -9.705 8.179 -14.440 1.00 0.00 C ATOM 98 OE1 GLU A 10 -9.220 7.539 -15.396 1.00 0.00 O ATOM 99 OE2 GLU A 10 -10.312 9.260 -14.576 1.00 0.00 O ATOM 0 H GLU A 10 -11.602 4.488 -11.645 1.00 0.00 H new ATOM 0 HA GLU A 10 -10.236 5.059 -14.168 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.537 6.850 -13.215 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -10.817 6.625 -11.633 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -9.587 8.425 -12.317 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -8.562 7.153 -12.950 1.00 0.00 H new ATOM 106 N GLU A 11 -8.715 4.483 -11.306 1.00 0.00 N ATOM 107 CA GLU A 11 -7.425 4.163 -10.705 1.00 0.00 C ATOM 108 C GLU A 11 -7.047 2.709 -10.971 1.00 0.00 C ATOM 109 O GLU A 11 -5.938 2.418 -11.420 1.00 0.00 O ATOM 110 CB GLU A 11 -7.461 4.425 -9.198 1.00 0.00 C ATOM 111 CG GLU A 11 -7.529 5.900 -8.838 1.00 0.00 C ATOM 112 CD GLU A 11 -6.291 6.662 -9.269 1.00 0.00 C ATOM 113 OE1 GLU A 11 -5.226 6.029 -9.424 1.00 0.00 O ATOM 114 OE2 GLU A 11 -6.388 7.893 -9.454 1.00 0.00 O ATOM 0 H GLU A 11 -9.508 4.404 -10.670 1.00 0.00 H new ATOM 0 HA GLU A 11 -6.671 4.805 -11.160 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -8.324 3.915 -8.770 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -6.573 3.989 -8.741 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -8.407 6.345 -9.307 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.657 6.002 -7.760 1.00 0.00 H new ATOM 121 N ALA A 12 -7.976 1.802 -10.690 1.00 0.00 N ATOM 122 CA ALA A 12 -7.741 0.378 -10.901 1.00 0.00 C ATOM 123 C ALA A 12 -7.184 0.113 -12.295 1.00 0.00 C ATOM 124 O ALA A 12 -6.253 -0.674 -12.464 1.00 0.00 O ATOM 125 CB ALA A 12 -9.027 -0.406 -10.686 1.00 0.00 C ATOM 0 H ALA A 12 -8.898 2.027 -10.316 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.000 0.046 -10.174 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -8.837 -1.467 -10.847 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -9.382 -0.251 -9.667 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -9.785 -0.062 -11.390 1.00 0.00 H new ATOM 131 N VAL A 13 -7.762 0.775 -13.293 1.00 0.00 N ATOM 132 CA VAL A 13 -7.322 0.611 -14.674 1.00 0.00 C ATOM 133 C VAL A 13 -5.856 0.997 -14.834 1.00 0.00 C ATOM 134 O VAL A 13 -5.104 0.338 -15.553 1.00 0.00 O ATOM 135 CB VAL A 13 -8.173 1.460 -15.638 1.00 0.00 C ATOM 136 CG1 VAL A 13 -8.148 2.924 -15.224 1.00 0.00 C ATOM 137 CG2 VAL A 13 -7.683 1.293 -17.068 1.00 0.00 C ATOM 0 H VAL A 13 -8.535 1.429 -13.171 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.446 -0.443 -14.923 1.00 0.00 H new ATOM 0 HB VAL A 13 -9.204 1.111 -15.589 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -8.754 3.508 -15.916 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -8.550 3.024 -14.216 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -7.121 3.290 -15.243 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -8.295 1.899 -17.736 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -6.644 1.614 -17.136 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -7.758 0.245 -17.358 1.00 0.00 H new ATOM 147 N LYS A 14 -5.455 2.069 -14.158 1.00 0.00 N ATOM 148 CA LYS A 14 -4.078 2.542 -14.222 1.00 0.00 C ATOM 149 C LYS A 14 -3.145 1.612 -13.452 1.00 0.00 C ATOM 150 O LYS A 14 -2.055 1.286 -13.920 1.00 0.00 O ATOM 151 CB LYS A 14 -3.978 3.962 -13.659 1.00 0.00 C ATOM 152 CG LYS A 14 -4.870 4.964 -14.372 1.00 0.00 C ATOM 153 CD LYS A 14 -4.751 6.350 -13.762 1.00 0.00 C ATOM 154 CE LYS A 14 -5.737 7.322 -14.392 1.00 0.00 C ATOM 155 NZ LYS A 14 -6.149 8.389 -13.439 1.00 0.00 N ATOM 0 H LYS A 14 -6.065 2.626 -13.560 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.772 2.549 -15.268 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -4.240 3.944 -12.601 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -2.943 4.298 -13.725 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -4.601 5.006 -15.427 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -5.907 4.631 -14.321 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -4.930 6.293 -12.688 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -3.735 6.722 -13.896 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -5.286 7.777 -15.274 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -6.618 6.777 -14.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -6.834 9.021 -13.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -6.587 7.956 -12.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -5.314 8.936 -13.149 1.00 0.00 H new ATOM 169 N TRP A 15 -3.583 1.188 -12.273 1.00 0.00 N ATOM 170 CA TRP A 15 -2.787 0.294 -11.440 1.00 0.00 C ATOM 171 C TRP A 15 -2.177 -0.828 -12.273 1.00 0.00 C ATOM 172 O TRP A 15 -0.979 -1.095 -12.188 1.00 0.00 O ATOM 173 CB TRP A 15 -3.649 -0.296 -10.321 1.00 0.00 C ATOM 174 CG TRP A 15 -4.136 0.729 -9.342 1.00 0.00 C ATOM 175 CD1 TRP A 15 -3.654 1.995 -9.174 1.00 0.00 C ATOM 176 CD2 TRP A 15 -5.198 0.573 -8.396 1.00 0.00 C ATOM 177 NE1 TRP A 15 -4.352 2.636 -8.181 1.00 0.00 N ATOM 178 CE2 TRP A 15 -5.306 1.786 -7.687 1.00 0.00 C ATOM 179 CE3 TRP A 15 -6.071 -0.471 -8.080 1.00 0.00 C ATOM 180 CZ2 TRP A 15 -6.250 1.978 -6.682 1.00 0.00 C ATOM 181 CZ3 TRP A 15 -7.008 -0.278 -7.082 1.00 0.00 C ATOM 182 CH2 TRP A 15 -7.091 0.938 -6.393 1.00 0.00 C ATOM 0 H TRP A 15 -4.484 1.448 -11.872 1.00 0.00 H new ATOM 0 HA TRP A 15 -1.977 0.875 -10.998 1.00 0.00 H new ATOM 0 HB2 TRP A 15 -4.507 -0.803 -10.762 1.00 0.00 H new ATOM 0 HB3 TRP A 15 -3.072 -1.052 -9.788 1.00 0.00 H new ATOM 0 HD1 TRP A 15 -2.842 2.429 -9.739 1.00 0.00 H new ATOM 0 HE1 TRP A 15 -4.187 3.591 -7.862 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -6.015 -1.412 -8.606 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 -6.316 2.915 -6.149 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -7.687 -1.079 -6.830 1.00 0.00 H new ATOM 0 HH2 TRP A 15 -7.834 1.058 -5.618 1.00 0.00 H new ATOM 193 N GLY A 16 -3.008 -1.480 -13.079 1.00 0.00 N ATOM 194 CA GLY A 16 -2.531 -2.564 -13.917 1.00 0.00 C ATOM 195 C GLY A 16 -1.370 -2.148 -14.799 1.00 0.00 C ATOM 196 O GLY A 16 -0.434 -2.920 -15.009 1.00 0.00 O ATOM 0 H GLY A 16 -4.004 -1.277 -13.167 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.223 -3.398 -13.286 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -3.349 -2.922 -14.543 1.00 0.00 H new ATOM 200 N GLU A 17 -1.432 -0.926 -15.318 1.00 0.00 N ATOM 201 CA GLU A 17 -0.378 -0.410 -16.184 1.00 0.00 C ATOM 202 C GLU A 17 0.995 -0.870 -15.704 1.00 0.00 C ATOM 203 O GLU A 17 1.821 -1.326 -16.495 1.00 0.00 O ATOM 204 CB GLU A 17 -0.429 1.119 -16.231 1.00 0.00 C ATOM 205 CG GLU A 17 -1.752 1.669 -16.735 1.00 0.00 C ATOM 206 CD GLU A 17 -1.781 1.833 -18.242 1.00 0.00 C ATOM 207 OE1 GLU A 17 -0.805 2.378 -18.798 1.00 0.00 O ATOM 208 OE2 GLU A 17 -2.780 1.417 -18.864 1.00 0.00 O ATOM 0 H GLU A 17 -2.200 -0.275 -15.154 1.00 0.00 H new ATOM 0 HA GLU A 17 -0.543 -0.803 -17.187 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -0.239 1.511 -15.232 1.00 0.00 H new ATOM 0 HB3 GLU A 17 0.374 1.481 -16.873 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -2.558 1.001 -16.431 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -1.943 2.634 -16.265 1.00 0.00 H new ATOM 215 N SER A 18 1.233 -0.746 -14.402 1.00 0.00 N ATOM 216 CA SER A 18 2.507 -1.145 -13.816 1.00 0.00 C ATOM 217 C SER A 18 2.371 -1.350 -12.310 1.00 0.00 C ATOM 218 O SER A 18 1.415 -0.882 -11.691 1.00 0.00 O ATOM 219 CB SER A 18 3.577 -0.090 -14.104 1.00 0.00 C ATOM 220 OG SER A 18 4.878 -0.619 -13.917 1.00 0.00 O ATOM 0 H SER A 18 0.560 -0.372 -13.733 1.00 0.00 H new ATOM 0 HA SER A 18 2.808 -2.090 -14.268 1.00 0.00 H new ATOM 0 HB2 SER A 18 3.471 0.270 -15.127 1.00 0.00 H new ATOM 0 HB3 SER A 18 3.432 0.768 -13.448 1.00 0.00 H new ATOM 0 HG SER A 18 5.544 0.074 -14.109 1.00 0.00 H new ATOM 226 N PHE A 19 3.337 -2.051 -11.725 1.00 0.00 N ATOM 227 CA PHE A 19 3.327 -2.319 -10.293 1.00 0.00 C ATOM 228 C PHE A 19 3.405 -1.021 -9.495 1.00 0.00 C ATOM 229 O PHE A 19 2.731 -0.863 -8.477 1.00 0.00 O ATOM 230 CB PHE A 19 4.495 -3.234 -9.915 1.00 0.00 C ATOM 231 CG PHE A 19 4.507 -3.622 -8.464 1.00 0.00 C ATOM 232 CD1 PHE A 19 3.383 -4.174 -7.871 1.00 0.00 C ATOM 233 CD2 PHE A 19 5.642 -3.434 -7.692 1.00 0.00 C ATOM 234 CE1 PHE A 19 3.391 -4.533 -6.536 1.00 0.00 C ATOM 235 CE2 PHE A 19 5.657 -3.791 -6.357 1.00 0.00 C ATOM 236 CZ PHE A 19 4.530 -4.340 -5.778 1.00 0.00 C ATOM 0 H PHE A 19 4.137 -2.444 -12.222 1.00 0.00 H new ATOM 0 HA PHE A 19 2.389 -2.818 -10.050 1.00 0.00 H new ATOM 0 HB2 PHE A 19 4.451 -4.137 -10.524 1.00 0.00 H new ATOM 0 HB3 PHE A 19 5.432 -2.732 -10.157 1.00 0.00 H new ATOM 0 HD1 PHE A 19 2.490 -4.326 -8.459 1.00 0.00 H new ATOM 0 HD2 PHE A 19 6.526 -3.003 -8.139 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.508 -4.964 -6.086 1.00 0.00 H new ATOM 0 HE2 PHE A 19 6.549 -3.641 -5.767 1.00 0.00 H new ATOM 0 HZ PHE A 19 4.539 -4.618 -4.734 1.00 0.00 H new ATOM 246 N ASP A 20 4.233 -0.094 -9.965 1.00 0.00 N ATOM 247 CA ASP A 20 4.400 1.192 -9.297 1.00 0.00 C ATOM 248 C ASP A 20 3.083 1.961 -9.264 1.00 0.00 C ATOM 249 O ASP A 20 2.724 2.555 -8.246 1.00 0.00 O ATOM 250 CB ASP A 20 5.472 2.022 -10.005 1.00 0.00 C ATOM 251 CG ASP A 20 5.985 3.159 -9.143 1.00 0.00 C ATOM 252 OD1 ASP A 20 5.152 3.924 -8.613 1.00 0.00 O ATOM 253 OD2 ASP A 20 7.219 3.286 -9.000 1.00 0.00 O ATOM 0 H ASP A 20 4.799 -0.209 -10.806 1.00 0.00 H new ATOM 0 HA ASP A 20 4.716 1.004 -8.271 1.00 0.00 H new ATOM 0 HB2 ASP A 20 6.305 1.375 -10.282 1.00 0.00 H new ATOM 0 HB3 ASP A 20 5.062 2.427 -10.930 1.00 0.00 H new ATOM 258 N LYS A 21 2.367 1.948 -10.382 1.00 0.00 N ATOM 259 CA LYS A 21 1.089 2.643 -10.482 1.00 0.00 C ATOM 260 C LYS A 21 0.157 2.233 -9.347 1.00 0.00 C ATOM 261 O LYS A 21 -0.475 3.079 -8.712 1.00 0.00 O ATOM 262 CB LYS A 21 0.428 2.350 -11.831 1.00 0.00 C ATOM 263 CG LYS A 21 1.227 2.852 -13.021 1.00 0.00 C ATOM 264 CD LYS A 21 0.881 4.294 -13.355 1.00 0.00 C ATOM 265 CE LYS A 21 2.020 4.984 -14.090 1.00 0.00 C ATOM 266 NZ LYS A 21 3.113 5.391 -13.164 1.00 0.00 N ATOM 0 H LYS A 21 2.650 1.463 -11.233 1.00 0.00 H new ATOM 0 HA LYS A 21 1.279 3.713 -10.404 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.283 1.274 -11.929 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -0.561 2.808 -11.849 1.00 0.00 H new ATOM 0 HG2 LYS A 21 2.292 2.773 -12.805 1.00 0.00 H new ATOM 0 HG3 LYS A 21 1.029 2.219 -13.886 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -0.019 4.321 -13.969 1.00 0.00 H new ATOM 0 HD3 LYS A 21 0.657 4.838 -12.437 1.00 0.00 H new ATOM 0 HE2 LYS A 21 2.420 4.314 -14.851 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.638 5.863 -14.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 3.838 5.917 -13.693 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 2.724 5.997 -12.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 3.541 4.544 -12.739 1.00 0.00 H new ATOM 280 N LEU A 22 0.075 0.931 -9.095 1.00 0.00 N ATOM 281 CA LEU A 22 -0.780 0.409 -8.035 1.00 0.00 C ATOM 282 C LEU A 22 -0.356 0.955 -6.675 1.00 0.00 C ATOM 283 O LEU A 22 -1.177 1.480 -5.921 1.00 0.00 O ATOM 284 CB LEU A 22 -0.733 -1.119 -8.021 1.00 0.00 C ATOM 285 CG LEU A 22 -1.451 -1.803 -6.857 1.00 0.00 C ATOM 286 CD1 LEU A 22 -2.920 -2.016 -7.188 1.00 0.00 C ATOM 287 CD2 LEU A 22 -0.781 -3.127 -6.520 1.00 0.00 C ATOM 0 H LEU A 22 0.590 0.218 -9.611 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.802 0.733 -8.233 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -1.165 -1.484 -8.953 1.00 0.00 H new ATOM 0 HB3 LEU A 22 0.312 -1.430 -8.010 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.386 -1.154 -5.984 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.415 -2.504 -6.348 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.393 -1.053 -7.379 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.006 -2.644 -8.075 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -1.306 -3.599 -5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.814 -3.783 -7.390 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.257 -2.948 -6.239 1.00 0.00 H new ATOM 299 N LEU A 23 0.931 0.830 -6.368 1.00 0.00 N ATOM 300 CA LEU A 23 1.465 1.314 -5.099 1.00 0.00 C ATOM 301 C LEU A 23 1.197 2.805 -4.928 1.00 0.00 C ATOM 302 O LEU A 23 0.701 3.242 -3.890 1.00 0.00 O ATOM 303 CB LEU A 23 2.968 1.042 -5.020 1.00 0.00 C ATOM 304 CG LEU A 23 3.406 -0.394 -5.313 1.00 0.00 C ATOM 305 CD1 LEU A 23 4.923 -0.485 -5.385 1.00 0.00 C ATOM 306 CD2 LEU A 23 2.864 -1.344 -4.255 1.00 0.00 C ATOM 0 H LEU A 23 1.623 0.398 -6.980 1.00 0.00 H new ATOM 0 HA LEU A 23 0.962 0.779 -4.294 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.474 1.705 -5.721 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.314 1.310 -4.021 1.00 0.00 H new ATOM 0 HG LEU A 23 2.998 -0.687 -6.280 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.216 -1.514 -5.594 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.289 0.165 -6.179 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.352 -0.172 -4.433 1.00 0.00 H new ATOM 0 HD21 LEU A 23 3.186 -2.361 -4.480 1.00 0.00 H new ATOM 0 HD22 LEU A 23 3.243 -1.052 -3.275 1.00 0.00 H new ATOM 0 HD23 LEU A 23 1.775 -1.301 -4.251 1.00 0.00 H new ATOM 318 N SER A 24 1.525 3.582 -5.956 1.00 0.00 N ATOM 319 CA SER A 24 1.322 5.025 -5.918 1.00 0.00 C ATOM 320 C SER A 24 0.022 5.372 -5.199 1.00 0.00 C ATOM 321 O SER A 24 -0.003 6.234 -4.320 1.00 0.00 O ATOM 322 CB SER A 24 1.299 5.595 -7.338 1.00 0.00 C ATOM 323 OG SER A 24 1.693 6.957 -7.348 1.00 0.00 O ATOM 0 H SER A 24 1.932 3.236 -6.825 1.00 0.00 H new ATOM 0 HA SER A 24 2.151 5.469 -5.368 1.00 0.00 H new ATOM 0 HB2 SER A 24 1.966 5.016 -7.977 1.00 0.00 H new ATOM 0 HB3 SER A 24 0.296 5.500 -7.755 1.00 0.00 H new ATOM 0 HG SER A 24 1.672 7.297 -8.267 1.00 0.00 H new ATOM 329 N HIS A 25 -1.056 4.694 -5.578 1.00 0.00 N ATOM 330 CA HIS A 25 -2.361 4.929 -4.969 1.00 0.00 C ATOM 331 C HIS A 25 -2.539 4.074 -3.719 1.00 0.00 C ATOM 332 O HIS A 25 -2.193 2.892 -3.708 1.00 0.00 O ATOM 333 CB HIS A 25 -3.477 4.628 -5.971 1.00 0.00 C ATOM 334 CG HIS A 25 -4.771 5.308 -5.648 1.00 0.00 C ATOM 335 ND1 HIS A 25 -5.587 4.918 -4.607 1.00 0.00 N ATOM 336 CD2 HIS A 25 -5.389 6.359 -6.235 1.00 0.00 C ATOM 337 CE1 HIS A 25 -6.651 5.701 -4.568 1.00 0.00 C ATOM 338 NE2 HIS A 25 -6.555 6.583 -5.546 1.00 0.00 N ATOM 0 H HIS A 25 -1.052 3.977 -6.304 1.00 0.00 H new ATOM 0 HA HIS A 25 -2.416 5.979 -4.680 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -3.153 4.935 -6.966 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -3.641 3.551 -6.007 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -5.031 6.918 -7.087 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -7.461 5.631 -3.857 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -7.237 7.312 -5.756 1.00 0.00 H new ATOM 346 N ARG A 26 -3.078 4.680 -2.665 1.00 0.00 N ATOM 347 CA ARG A 26 -3.299 3.973 -1.409 1.00 0.00 C ATOM 348 C ARG A 26 -4.314 2.848 -1.588 1.00 0.00 C ATOM 349 O ARG A 26 -4.009 1.680 -1.347 1.00 0.00 O ATOM 350 CB ARG A 26 -3.786 4.946 -0.332 1.00 0.00 C ATOM 351 CG ARG A 26 -3.664 4.400 1.081 1.00 0.00 C ATOM 352 CD ARG A 26 -3.451 5.515 2.092 1.00 0.00 C ATOM 353 NE ARG A 26 -4.544 6.484 2.077 1.00 0.00 N ATOM 354 CZ ARG A 26 -5.729 6.262 2.632 1.00 0.00 C ATOM 355 NH1 ARG A 26 -5.975 5.112 3.244 1.00 0.00 N ATOM 356 NH2 ARG A 26 -6.674 7.193 2.577 1.00 0.00 N ATOM 0 H ARG A 26 -3.369 5.658 -2.656 1.00 0.00 H new ATOM 0 HA ARG A 26 -2.351 3.536 -1.095 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -3.215 5.872 -0.405 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -4.828 5.198 -0.526 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -4.566 3.843 1.336 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -2.831 3.698 1.131 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -3.360 5.087 3.090 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -2.512 6.025 1.877 1.00 0.00 H new ATOM 0 HE ARG A 26 -4.388 7.380 1.615 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -5.252 4.394 3.290 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -6.887 4.945 3.669 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -6.490 8.080 2.108 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -7.584 7.021 3.004 1.00 0.00 H new ATOM 370 N ASP A 27 -5.519 3.208 -2.014 1.00 0.00 N ATOM 371 CA ASP A 27 -6.579 2.228 -2.227 1.00 0.00 C ATOM 372 C ASP A 27 -6.020 0.946 -2.836 1.00 0.00 C ATOM 373 O ASP A 27 -6.210 -0.143 -2.297 1.00 0.00 O ATOM 374 CB ASP A 27 -7.664 2.808 -3.137 1.00 0.00 C ATOM 375 CG ASP A 27 -8.997 2.106 -2.968 1.00 0.00 C ATOM 376 OD1 ASP A 27 -9.239 1.115 -3.686 1.00 0.00 O ATOM 377 OD2 ASP A 27 -9.797 2.550 -2.118 1.00 0.00 O ATOM 0 H ASP A 27 -5.787 4.171 -2.219 1.00 0.00 H new ATOM 0 HA ASP A 27 -7.017 1.988 -1.258 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -7.786 3.870 -2.921 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -7.344 2.728 -4.176 1.00 0.00 H new ATOM 382 N GLY A 28 -5.329 1.085 -3.963 1.00 0.00 N ATOM 383 CA GLY A 28 -4.753 -0.071 -4.627 1.00 0.00 C ATOM 384 C GLY A 28 -3.745 -0.795 -3.758 1.00 0.00 C ATOM 385 O GLY A 28 -3.731 -2.027 -3.706 1.00 0.00 O ATOM 0 H GLY A 28 -5.158 1.976 -4.428 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -5.550 -0.761 -4.906 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -4.270 0.248 -5.551 1.00 0.00 H new ATOM 389 N LEU A 29 -2.897 -0.034 -3.076 1.00 0.00 N ATOM 390 CA LEU A 29 -1.879 -0.611 -2.206 1.00 0.00 C ATOM 391 C LEU A 29 -2.516 -1.457 -1.108 1.00 0.00 C ATOM 392 O LEU A 29 -2.111 -2.595 -0.875 1.00 0.00 O ATOM 393 CB LEU A 29 -1.026 0.495 -1.582 1.00 0.00 C ATOM 394 CG LEU A 29 0.038 0.039 -0.583 1.00 0.00 C ATOM 395 CD1 LEU A 29 1.127 -0.754 -1.288 1.00 0.00 C ATOM 396 CD2 LEU A 29 0.634 1.235 0.144 1.00 0.00 C ATOM 0 H LEU A 29 -2.894 0.985 -3.109 1.00 0.00 H new ATOM 0 HA LEU A 29 -1.242 -1.255 -2.812 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -0.531 1.041 -2.385 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -1.690 1.198 -1.079 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.437 -0.609 0.153 1.00 0.00 H new ATOM 0 HD11 LEU A 29 1.875 -1.070 -0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 29 0.689 -1.632 -1.763 1.00 0.00 H new ATOM 0 HD13 LEU A 29 1.599 -0.129 -2.046 1.00 0.00 H new ATOM 0 HD21 LEU A 29 1.389 0.892 0.851 1.00 0.00 H new ATOM 0 HD22 LEU A 29 1.094 1.909 -0.579 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -0.153 1.763 0.682 1.00 0.00 H new ATOM 408 N GLU A 30 -3.517 -0.894 -0.440 1.00 0.00 N ATOM 409 CA GLU A 30 -4.212 -1.598 0.632 1.00 0.00 C ATOM 410 C GLU A 30 -4.639 -2.991 0.180 1.00 0.00 C ATOM 411 O GLU A 30 -4.282 -3.993 0.798 1.00 0.00 O ATOM 412 CB GLU A 30 -5.434 -0.799 1.089 1.00 0.00 C ATOM 413 CG GLU A 30 -5.089 0.547 1.699 1.00 0.00 C ATOM 414 CD GLU A 30 -4.040 0.443 2.790 1.00 0.00 C ATOM 415 OE1 GLU A 30 -2.838 0.401 2.455 1.00 0.00 O ATOM 416 OE2 GLU A 30 -4.423 0.402 3.978 1.00 0.00 O ATOM 0 H GLU A 30 -3.865 0.047 -0.622 1.00 0.00 H new ATOM 0 HA GLU A 30 -3.523 -1.703 1.470 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -6.095 -0.643 0.236 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -5.990 -1.387 1.819 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -4.728 1.214 0.916 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -5.992 0.997 2.111 1.00 0.00 H new ATOM 423 N ALA A 31 -5.407 -3.046 -0.903 1.00 0.00 N ATOM 424 CA ALA A 31 -5.884 -4.314 -1.440 1.00 0.00 C ATOM 425 C ALA A 31 -4.736 -5.306 -1.605 1.00 0.00 C ATOM 426 O ALA A 31 -4.874 -6.488 -1.289 1.00 0.00 O ATOM 427 CB ALA A 31 -6.589 -4.094 -2.770 1.00 0.00 C ATOM 0 H ALA A 31 -5.712 -2.226 -1.426 1.00 0.00 H new ATOM 0 HA ALA A 31 -6.596 -4.736 -0.731 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -6.940 -5.050 -3.159 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -7.439 -3.427 -2.625 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -5.894 -3.647 -3.481 1.00 0.00 H new ATOM 433 N PHE A 32 -3.605 -4.817 -2.100 1.00 0.00 N ATOM 434 CA PHE A 32 -2.433 -5.659 -2.309 1.00 0.00 C ATOM 435 C PHE A 32 -1.995 -6.314 -1.001 1.00 0.00 C ATOM 436 O PHE A 32 -1.998 -7.539 -0.875 1.00 0.00 O ATOM 437 CB PHE A 32 -1.283 -4.836 -2.891 1.00 0.00 C ATOM 438 CG PHE A 32 0.006 -5.601 -2.999 1.00 0.00 C ATOM 439 CD1 PHE A 32 0.083 -6.748 -3.773 1.00 0.00 C ATOM 440 CD2 PHE A 32 1.140 -5.172 -2.328 1.00 0.00 C ATOM 441 CE1 PHE A 32 1.268 -7.453 -3.874 1.00 0.00 C ATOM 442 CE2 PHE A 32 2.326 -5.872 -2.428 1.00 0.00 C ATOM 443 CZ PHE A 32 2.390 -7.015 -3.200 1.00 0.00 C ATOM 0 H PHE A 32 -3.475 -3.841 -2.364 1.00 0.00 H new ATOM 0 HA PHE A 32 -2.702 -6.443 -3.017 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -1.568 -4.477 -3.880 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -1.123 -3.957 -2.267 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -0.792 -7.095 -4.303 1.00 0.00 H new ATOM 0 HD2 PHE A 32 1.096 -4.280 -1.720 1.00 0.00 H new ATOM 0 HE1 PHE A 32 1.316 -8.346 -4.480 1.00 0.00 H new ATOM 0 HE2 PHE A 32 3.204 -5.526 -1.902 1.00 0.00 H new ATOM 0 HZ PHE A 32 3.316 -7.565 -3.276 1.00 0.00 H new ATOM 453 N THR A 33 -1.618 -5.487 -0.030 1.00 0.00 N ATOM 454 CA THR A 33 -1.175 -5.984 1.267 1.00 0.00 C ATOM 455 C THR A 33 -2.074 -7.111 1.760 1.00 0.00 C ATOM 456 O THR A 33 -1.592 -8.136 2.241 1.00 0.00 O ATOM 457 CB THR A 33 -1.154 -4.860 2.320 1.00 0.00 C ATOM 458 OG1 THR A 33 -0.323 -3.784 1.872 1.00 0.00 O ATOM 459 CG2 THR A 33 -0.643 -5.380 3.655 1.00 0.00 C ATOM 0 H THR A 33 -1.611 -4.471 -0.117 1.00 0.00 H new ATOM 0 HA THR A 33 -0.163 -6.365 1.132 1.00 0.00 H new ATOM 0 HB THR A 33 -2.174 -4.499 2.454 1.00 0.00 H new ATOM 0 HG1 THR A 33 -0.317 -3.073 2.546 1.00 0.00 H new ATOM 0 HG21 THR A 33 -0.637 -4.569 4.383 1.00 0.00 H new ATOM 0 HG22 THR A 33 -1.295 -6.179 4.008 1.00 0.00 H new ATOM 0 HG23 THR A 33 0.369 -5.765 3.532 1.00 0.00 H new ATOM 467 N ARG A 34 -3.383 -6.915 1.638 1.00 0.00 N ATOM 468 CA ARG A 34 -4.350 -7.916 2.073 1.00 0.00 C ATOM 469 C ARG A 34 -4.006 -9.288 1.501 1.00 0.00 C ATOM 470 O ARG A 34 -3.762 -10.238 2.245 1.00 0.00 O ATOM 471 CB ARG A 34 -5.761 -7.512 1.643 1.00 0.00 C ATOM 472 CG ARG A 34 -6.402 -6.476 2.554 1.00 0.00 C ATOM 473 CD ARG A 34 -7.783 -6.077 2.057 1.00 0.00 C ATOM 474 NE ARG A 34 -8.132 -4.715 2.451 1.00 0.00 N ATOM 475 CZ ARG A 34 -9.383 -4.283 2.575 1.00 0.00 C ATOM 476 NH1 ARG A 34 -10.397 -5.104 2.337 1.00 0.00 N ATOM 477 NH2 ARG A 34 -9.621 -3.030 2.938 1.00 0.00 N ATOM 0 H ARG A 34 -3.798 -6.072 1.241 1.00 0.00 H new ATOM 0 HA ARG A 34 -4.311 -7.975 3.161 1.00 0.00 H new ATOM 0 HB2 ARG A 34 -5.723 -7.117 0.628 1.00 0.00 H new ATOM 0 HB3 ARG A 34 -6.392 -8.400 1.616 1.00 0.00 H new ATOM 0 HG2 ARG A 34 -6.479 -6.877 3.565 1.00 0.00 H new ATOM 0 HG3 ARG A 34 -5.765 -5.594 2.609 1.00 0.00 H new ATOM 0 HD2 ARG A 34 -7.816 -6.160 0.971 1.00 0.00 H new ATOM 0 HD3 ARG A 34 -8.525 -6.771 2.452 1.00 0.00 H new ATOM 0 HE ARG A 34 -7.374 -4.059 2.642 1.00 0.00 H new ATOM 0 HH11 ARG A 34 -10.218 -6.069 2.058 1.00 0.00 H new ATOM 0 HH12 ARG A 34 -11.356 -4.771 2.433 1.00 0.00 H new ATOM 0 HH21 ARG A 34 -8.844 -2.396 3.123 1.00 0.00 H new ATOM 0 HH22 ARG A 34 -10.582 -2.700 3.033 1.00 0.00 H new ATOM 491 N PHE A 35 -3.987 -9.384 0.176 1.00 0.00 N ATOM 492 CA PHE A 35 -3.674 -10.640 -0.496 1.00 0.00 C ATOM 493 C PHE A 35 -2.490 -11.333 0.172 1.00 0.00 C ATOM 494 O PHE A 35 -2.520 -12.540 0.418 1.00 0.00 O ATOM 495 CB PHE A 35 -3.366 -10.390 -1.974 1.00 0.00 C ATOM 496 CG PHE A 35 -2.499 -11.448 -2.593 1.00 0.00 C ATOM 497 CD1 PHE A 35 -2.985 -12.731 -2.793 1.00 0.00 C ATOM 498 CD2 PHE A 35 -1.199 -11.162 -2.974 1.00 0.00 C ATOM 499 CE1 PHE A 35 -2.190 -13.708 -3.362 1.00 0.00 C ATOM 500 CE2 PHE A 35 -0.400 -12.133 -3.546 1.00 0.00 C ATOM 501 CZ PHE A 35 -0.896 -13.408 -3.739 1.00 0.00 C ATOM 0 H PHE A 35 -4.185 -8.607 -0.454 1.00 0.00 H new ATOM 0 HA PHE A 35 -4.545 -11.291 -0.419 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -4.303 -10.330 -2.527 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -2.874 -9.423 -2.076 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -3.997 -12.970 -2.501 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -0.805 -10.168 -2.822 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.580 -14.704 -3.511 1.00 0.00 H new ATOM 0 HE2 PHE A 35 0.611 -11.896 -3.842 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.272 -14.169 -4.184 1.00 0.00 H new ATOM 511 N LEU A 36 -1.448 -10.563 0.461 1.00 0.00 N ATOM 512 CA LEU A 36 -0.251 -11.102 1.100 1.00 0.00 C ATOM 513 C LEU A 36 -0.548 -11.536 2.531 1.00 0.00 C ATOM 514 O LEU A 36 -0.165 -12.628 2.953 1.00 0.00 O ATOM 515 CB LEU A 36 0.867 -10.059 1.093 1.00 0.00 C ATOM 516 CG LEU A 36 1.346 -9.598 -0.284 1.00 0.00 C ATOM 517 CD1 LEU A 36 2.131 -8.300 -0.170 1.00 0.00 C ATOM 518 CD2 LEU A 36 2.191 -10.678 -0.945 1.00 0.00 C ATOM 0 H LEU A 36 -1.406 -9.563 0.264 1.00 0.00 H new ATOM 0 HA LEU A 36 0.072 -11.976 0.534 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.525 -9.185 1.648 1.00 0.00 H new ATOM 0 HB3 LEU A 36 1.720 -10.467 1.635 1.00 0.00 H new ATOM 0 HG LEU A 36 0.471 -9.416 -0.909 1.00 0.00 H new ATOM 0 HD11 LEU A 36 2.464 -7.988 -1.160 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.495 -7.526 0.260 1.00 0.00 H new ATOM 0 HD13 LEU A 36 2.998 -8.454 0.472 1.00 0.00 H new ATOM 0 HD21 LEU A 36 2.523 -10.332 -1.924 1.00 0.00 H new ATOM 0 HD22 LEU A 36 3.060 -10.892 -0.322 1.00 0.00 H new ATOM 0 HD23 LEU A 36 1.596 -11.584 -1.063 1.00 0.00 H new ATOM 530 N LYS A 37 -1.235 -10.675 3.276 1.00 0.00 N ATOM 531 CA LYS A 37 -1.586 -10.970 4.660 1.00 0.00 C ATOM 532 C LYS A 37 -2.102 -12.399 4.797 1.00 0.00 C ATOM 533 O LYS A 37 -1.658 -13.150 5.667 1.00 0.00 O ATOM 534 CB LYS A 37 -2.645 -9.984 5.160 1.00 0.00 C ATOM 535 CG LYS A 37 -2.123 -8.568 5.333 1.00 0.00 C ATOM 536 CD LYS A 37 -2.886 -7.820 6.413 1.00 0.00 C ATOM 537 CE LYS A 37 -2.032 -6.736 7.051 1.00 0.00 C ATOM 538 NZ LYS A 37 -2.765 -6.011 8.125 1.00 0.00 N ATOM 0 H LYS A 37 -1.560 -9.767 2.944 1.00 0.00 H new ATOM 0 HA LYS A 37 -0.687 -10.867 5.267 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -3.479 -9.972 4.458 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -3.037 -10.337 6.114 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -1.064 -8.599 5.589 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.207 -8.030 4.388 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.782 -7.372 5.983 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.216 -8.522 7.179 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -1.129 -7.183 7.466 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -1.714 -6.027 6.286 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.148 -5.281 8.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -3.614 -5.563 7.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -3.046 -6.683 8.868 1.00 0.00 H new ATOM 552 N THR A 38 -3.042 -12.770 3.933 1.00 0.00 N ATOM 553 CA THR A 38 -3.618 -14.108 3.959 1.00 0.00 C ATOM 554 C THR A 38 -2.536 -15.175 3.841 1.00 0.00 C ATOM 555 O THR A 38 -2.596 -16.209 4.504 1.00 0.00 O ATOM 556 CB THR A 38 -4.638 -14.302 2.821 1.00 0.00 C ATOM 557 OG1 THR A 38 -3.989 -14.175 1.552 1.00 0.00 O ATOM 558 CG2 THR A 38 -5.764 -13.283 2.926 1.00 0.00 C ATOM 0 H THR A 38 -3.420 -12.162 3.207 1.00 0.00 H new ATOM 0 HA THR A 38 -4.127 -14.214 4.917 1.00 0.00 H new ATOM 0 HB THR A 38 -5.063 -15.302 2.910 1.00 0.00 H new ATOM 0 HG1 THR A 38 -3.512 -13.320 1.512 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.473 -13.439 2.112 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.276 -13.403 3.881 1.00 0.00 H new ATOM 0 HG23 THR A 38 -5.351 -12.276 2.860 1.00 0.00 H new ATOM 566 N GLU A 39 -1.545 -14.915 2.993 1.00 0.00 N ATOM 567 CA GLU A 39 -0.449 -15.855 2.790 1.00 0.00 C ATOM 568 C GLU A 39 0.729 -15.523 3.701 1.00 0.00 C ATOM 569 O GLU A 39 1.834 -16.036 3.519 1.00 0.00 O ATOM 570 CB GLU A 39 0.004 -15.838 1.328 1.00 0.00 C ATOM 571 CG GLU A 39 -1.127 -16.069 0.339 1.00 0.00 C ATOM 572 CD GLU A 39 -1.337 -17.537 0.025 1.00 0.00 C ATOM 573 OE1 GLU A 39 -1.791 -18.276 0.924 1.00 0.00 O ATOM 574 OE2 GLU A 39 -1.046 -17.948 -1.118 1.00 0.00 O ATOM 0 H GLU A 39 -1.479 -14.063 2.437 1.00 0.00 H new ATOM 0 HA GLU A 39 -0.810 -16.853 3.040 1.00 0.00 H new ATOM 0 HB2 GLU A 39 0.474 -14.878 1.113 1.00 0.00 H new ATOM 0 HB3 GLU A 39 0.765 -16.605 1.183 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -2.049 -15.652 0.744 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -0.913 -15.531 -0.584 1.00 0.00 H new ATOM 581 N PHE A 40 0.485 -14.660 4.683 1.00 0.00 N ATOM 582 CA PHE A 40 1.525 -14.258 5.622 1.00 0.00 C ATOM 583 C PHE A 40 2.766 -13.767 4.883 1.00 0.00 C ATOM 584 O PHE A 40 3.894 -14.012 5.311 1.00 0.00 O ATOM 585 CB PHE A 40 1.892 -15.425 6.540 1.00 0.00 C ATOM 586 CG PHE A 40 0.702 -16.092 7.167 1.00 0.00 C ATOM 587 CD1 PHE A 40 0.170 -15.618 8.356 1.00 0.00 C ATOM 588 CD2 PHE A 40 0.114 -17.195 6.567 1.00 0.00 C ATOM 589 CE1 PHE A 40 -0.926 -16.230 8.935 1.00 0.00 C ATOM 590 CE2 PHE A 40 -0.983 -17.810 7.141 1.00 0.00 C ATOM 591 CZ PHE A 40 -1.503 -17.328 8.327 1.00 0.00 C ATOM 0 H PHE A 40 -0.423 -14.226 4.848 1.00 0.00 H new ATOM 0 HA PHE A 40 1.136 -13.438 6.226 1.00 0.00 H new ATOM 0 HB2 PHE A 40 2.453 -16.164 5.968 1.00 0.00 H new ATOM 0 HB3 PHE A 40 2.553 -15.063 7.328 1.00 0.00 H new ATOM 0 HD1 PHE A 40 0.617 -14.760 8.836 1.00 0.00 H new ATOM 0 HD2 PHE A 40 0.517 -17.578 5.641 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -1.331 -15.850 9.862 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -1.434 -18.667 6.663 1.00 0.00 H new ATOM 0 HZ PHE A 40 -2.359 -17.809 8.778 1.00 0.00 H new ATOM 601 N SER A 41 2.550 -13.074 3.770 1.00 0.00 N ATOM 602 CA SER A 41 3.650 -12.553 2.968 1.00 0.00 C ATOM 603 C SER A 41 3.624 -11.028 2.935 1.00 0.00 C ATOM 604 O SER A 41 4.313 -10.402 2.130 1.00 0.00 O ATOM 605 CB SER A 41 3.576 -13.105 1.542 1.00 0.00 C ATOM 606 OG SER A 41 4.306 -14.314 1.425 1.00 0.00 O ATOM 0 H SER A 41 1.623 -12.860 3.403 1.00 0.00 H new ATOM 0 HA SER A 41 4.585 -12.874 3.427 1.00 0.00 H new ATOM 0 HB2 SER A 41 2.535 -13.277 1.269 1.00 0.00 H new ATOM 0 HB3 SER A 41 3.971 -12.368 0.843 1.00 0.00 H new ATOM 0 HG SER A 41 4.242 -14.647 0.506 1.00 0.00 H new ATOM 612 N GLU A 42 2.826 -10.437 3.819 1.00 0.00 N ATOM 613 CA GLU A 42 2.710 -8.985 3.892 1.00 0.00 C ATOM 614 C GLU A 42 4.057 -8.349 4.227 1.00 0.00 C ATOM 615 O GLU A 42 4.418 -7.311 3.672 1.00 0.00 O ATOM 616 CB GLU A 42 1.669 -8.587 4.942 1.00 0.00 C ATOM 617 CG GLU A 42 2.085 -8.916 6.365 1.00 0.00 C ATOM 618 CD GLU A 42 2.204 -10.409 6.608 1.00 0.00 C ATOM 619 OE1 GLU A 42 1.257 -11.143 6.257 1.00 0.00 O ATOM 620 OE2 GLU A 42 3.242 -10.841 7.148 1.00 0.00 O ATOM 0 H GLU A 42 2.251 -10.941 4.494 1.00 0.00 H new ATOM 0 HA GLU A 42 2.388 -8.621 2.916 1.00 0.00 H new ATOM 0 HB2 GLU A 42 1.479 -7.516 4.866 1.00 0.00 H new ATOM 0 HB3 GLU A 42 0.730 -9.094 4.721 1.00 0.00 H new ATOM 0 HG2 GLU A 42 3.042 -8.439 6.579 1.00 0.00 H new ATOM 0 HG3 GLU A 42 1.357 -8.496 7.059 1.00 0.00 H new ATOM 627 N GLU A 43 4.791 -8.978 5.139 1.00 0.00 N ATOM 628 CA GLU A 43 6.096 -8.472 5.548 1.00 0.00 C ATOM 629 C GLU A 43 6.869 -7.927 4.350 1.00 0.00 C ATOM 630 O GLU A 43 7.520 -6.887 4.438 1.00 0.00 O ATOM 631 CB GLU A 43 6.905 -9.576 6.232 1.00 0.00 C ATOM 632 CG GLU A 43 7.360 -10.673 5.283 1.00 0.00 C ATOM 633 CD GLU A 43 7.846 -11.910 6.013 1.00 0.00 C ATOM 634 OE1 GLU A 43 8.228 -11.790 7.195 1.00 0.00 O ATOM 635 OE2 GLU A 43 7.842 -12.998 5.401 1.00 0.00 O ATOM 0 H GLU A 43 4.505 -9.837 5.608 1.00 0.00 H new ATOM 0 HA GLU A 43 5.936 -7.658 6.255 1.00 0.00 H new ATOM 0 HB2 GLU A 43 7.780 -9.133 6.708 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.302 -10.019 7.024 1.00 0.00 H new ATOM 0 HG2 GLU A 43 6.535 -10.945 4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 43 8.161 -10.291 4.649 1.00 0.00 H new ATOM 642 N ASN A 44 6.792 -8.640 3.231 1.00 0.00 N ATOM 643 CA ASN A 44 7.486 -8.229 2.015 1.00 0.00 C ATOM 644 C ASN A 44 7.153 -6.783 1.660 1.00 0.00 C ATOM 645 O ASN A 44 8.047 -5.958 1.471 1.00 0.00 O ATOM 646 CB ASN A 44 7.109 -9.150 0.853 1.00 0.00 C ATOM 647 CG ASN A 44 7.657 -10.553 1.025 1.00 0.00 C ATOM 648 OD1 ASN A 44 8.081 -10.936 2.117 1.00 0.00 O ATOM 649 ND2 ASN A 44 7.651 -11.328 -0.053 1.00 0.00 N ATOM 0 H ASN A 44 6.257 -9.504 3.141 1.00 0.00 H new ATOM 0 HA ASN A 44 8.558 -8.302 2.196 1.00 0.00 H new ATOM 0 HB2 ASN A 44 6.023 -9.195 0.767 1.00 0.00 H new ATOM 0 HB3 ASN A 44 7.486 -8.728 -0.079 1.00 0.00 H new ATOM 0 HD21 ASN A 44 8.007 -12.282 0.003 1.00 0.00 H new ATOM 0 HD22 ASN A 44 7.290 -10.969 -0.937 1.00 0.00 H new ATOM 656 N ILE A 45 5.861 -6.484 1.573 1.00 0.00 N ATOM 657 CA ILE A 45 5.410 -5.137 1.244 1.00 0.00 C ATOM 658 C ILE A 45 5.651 -4.178 2.405 1.00 0.00 C ATOM 659 O ILE A 45 5.962 -3.005 2.199 1.00 0.00 O ATOM 660 CB ILE A 45 3.915 -5.118 0.877 1.00 0.00 C ATOM 661 CG1 ILE A 45 3.467 -3.694 0.542 1.00 0.00 C ATOM 662 CG2 ILE A 45 3.083 -5.685 2.017 1.00 0.00 C ATOM 663 CD1 ILE A 45 4.073 -3.154 -0.735 1.00 0.00 C ATOM 0 H ILE A 45 5.109 -7.156 1.726 1.00 0.00 H new ATOM 0 HA ILE A 45 5.991 -4.811 0.381 1.00 0.00 H new ATOM 0 HB ILE A 45 3.765 -5.743 -0.003 1.00 0.00 H new ATOM 0 HG12 ILE A 45 2.381 -3.675 0.456 1.00 0.00 H new ATOM 0 HG13 ILE A 45 3.733 -3.034 1.368 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.028 -5.665 1.743 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.387 -6.713 2.213 1.00 0.00 H new ATOM 0 HG23 ILE A 45 3.236 -5.084 2.913 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.711 -2.141 -0.909 1.00 0.00 H new ATOM 0 HD12 ILE A 45 5.159 -3.141 -0.645 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.786 -3.791 -1.572 1.00 0.00 H new ATOM 675 N GLU A 46 5.504 -4.685 3.625 1.00 0.00 N ATOM 676 CA GLU A 46 5.706 -3.872 4.818 1.00 0.00 C ATOM 677 C GLU A 46 7.026 -3.110 4.742 1.00 0.00 C ATOM 678 O GLU A 46 7.095 -1.929 5.083 1.00 0.00 O ATOM 679 CB GLU A 46 5.684 -4.751 6.071 1.00 0.00 C ATOM 680 CG GLU A 46 4.285 -5.049 6.582 1.00 0.00 C ATOM 681 CD GLU A 46 3.809 -4.034 7.603 1.00 0.00 C ATOM 682 OE1 GLU A 46 3.383 -2.934 7.193 1.00 0.00 O ATOM 683 OE2 GLU A 46 3.862 -4.341 8.812 1.00 0.00 O ATOM 0 H GLU A 46 5.246 -5.654 3.813 1.00 0.00 H new ATOM 0 HA GLU A 46 4.892 -3.149 4.875 1.00 0.00 H new ATOM 0 HB2 GLU A 46 6.190 -5.692 5.853 1.00 0.00 H new ATOM 0 HB3 GLU A 46 6.252 -4.258 6.860 1.00 0.00 H new ATOM 0 HG2 GLU A 46 3.591 -5.066 5.742 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.269 -6.043 7.029 1.00 0.00 H new ATOM 690 N PHE A 47 8.072 -3.795 4.291 1.00 0.00 N ATOM 691 CA PHE A 47 9.390 -3.184 4.170 1.00 0.00 C ATOM 692 C PHE A 47 9.388 -2.090 3.105 1.00 0.00 C ATOM 693 O PHE A 47 9.978 -1.027 3.293 1.00 0.00 O ATOM 694 CB PHE A 47 10.437 -4.245 3.824 1.00 0.00 C ATOM 695 CG PHE A 47 11.690 -3.677 3.221 1.00 0.00 C ATOM 696 CD1 PHE A 47 12.686 -3.152 4.028 1.00 0.00 C ATOM 697 CD2 PHE A 47 11.872 -3.670 1.847 1.00 0.00 C ATOM 698 CE1 PHE A 47 13.840 -2.627 3.476 1.00 0.00 C ATOM 699 CE2 PHE A 47 13.024 -3.147 1.290 1.00 0.00 C ATOM 700 CZ PHE A 47 14.010 -2.626 2.105 1.00 0.00 C ATOM 0 H PHE A 47 8.032 -4.773 4.004 1.00 0.00 H new ATOM 0 HA PHE A 47 9.642 -2.732 5.129 1.00 0.00 H new ATOM 0 HB2 PHE A 47 10.696 -4.797 4.728 1.00 0.00 H new ATOM 0 HB3 PHE A 47 10.001 -4.961 3.128 1.00 0.00 H new ATOM 0 HD1 PHE A 47 12.560 -3.153 5.101 1.00 0.00 H new ATOM 0 HD2 PHE A 47 11.105 -4.078 1.205 1.00 0.00 H new ATOM 0 HE1 PHE A 47 14.608 -2.218 4.116 1.00 0.00 H new ATOM 0 HE2 PHE A 47 13.153 -3.146 0.218 1.00 0.00 H new ATOM 0 HZ PHE A 47 14.912 -2.219 1.672 1.00 0.00 H new ATOM 710 N TRP A 48 8.721 -2.361 1.989 1.00 0.00 N ATOM 711 CA TRP A 48 8.642 -1.401 0.895 1.00 0.00 C ATOM 712 C TRP A 48 8.042 -0.083 1.369 1.00 0.00 C ATOM 713 O TRP A 48 8.516 0.993 1.003 1.00 0.00 O ATOM 714 CB TRP A 48 7.807 -1.972 -0.253 1.00 0.00 C ATOM 715 CG TRP A 48 7.691 -1.043 -1.423 1.00 0.00 C ATOM 716 CD1 TRP A 48 8.348 -1.142 -2.616 1.00 0.00 C ATOM 717 CD2 TRP A 48 6.870 0.126 -1.511 1.00 0.00 C ATOM 718 NE1 TRP A 48 7.985 -0.103 -3.440 1.00 0.00 N ATOM 719 CE2 TRP A 48 7.079 0.688 -2.785 1.00 0.00 C ATOM 720 CE3 TRP A 48 5.977 0.754 -0.637 1.00 0.00 C ATOM 721 CZ2 TRP A 48 6.427 1.845 -3.206 1.00 0.00 C ATOM 722 CZ3 TRP A 48 5.332 1.901 -1.055 1.00 0.00 C ATOM 723 CH2 TRP A 48 5.559 2.437 -2.329 1.00 0.00 C ATOM 0 H TRP A 48 8.227 -3.237 1.818 1.00 0.00 H new ATOM 0 HA TRP A 48 9.654 -1.210 0.539 1.00 0.00 H new ATOM 0 HB2 TRP A 48 8.253 -2.909 -0.586 1.00 0.00 H new ATOM 0 HB3 TRP A 48 6.808 -2.207 0.116 1.00 0.00 H new ATOM 0 HD1 TRP A 48 9.049 -1.922 -2.874 1.00 0.00 H new ATOM 0 HE1 TRP A 48 8.334 0.053 -4.386 1.00 0.00 H new ATOM 0 HE3 TRP A 48 5.795 0.349 0.348 1.00 0.00 H new ATOM 0 HZ2 TRP A 48 6.600 2.259 -4.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 48 4.640 2.394 -0.388 1.00 0.00 H new ATOM 0 HH2 TRP A 48 5.038 3.336 -2.625 1.00 0.00 H new ATOM 734 N ILE A 49 6.997 -0.173 2.184 1.00 0.00 N ATOM 735 CA ILE A 49 6.334 1.014 2.710 1.00 0.00 C ATOM 736 C ILE A 49 7.263 1.803 3.626 1.00 0.00 C ATOM 737 O ILE A 49 7.463 3.003 3.440 1.00 0.00 O ATOM 738 CB ILE A 49 5.055 0.648 3.487 1.00 0.00 C ATOM 739 CG1 ILE A 49 4.077 -0.100 2.578 1.00 0.00 C ATOM 740 CG2 ILE A 49 4.405 1.900 4.058 1.00 0.00 C ATOM 741 CD1 ILE A 49 3.174 -1.059 3.320 1.00 0.00 C ATOM 0 H ILE A 49 6.591 -1.056 2.495 1.00 0.00 H new ATOM 0 HA ILE A 49 6.064 1.630 1.852 1.00 0.00 H new ATOM 0 HB ILE A 49 5.325 -0.007 4.315 1.00 0.00 H new ATOM 0 HG12 ILE A 49 3.463 0.625 2.044 1.00 0.00 H new ATOM 0 HG13 ILE A 49 4.642 -0.653 1.827 1.00 0.00 H new ATOM 0 HG21 ILE A 49 3.503 1.625 4.604 1.00 0.00 H new ATOM 0 HG22 ILE A 49 5.102 2.395 4.734 1.00 0.00 H new ATOM 0 HG23 ILE A 49 4.145 2.578 3.245 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.508 -1.553 2.612 1.00 0.00 H new ATOM 0 HD12 ILE A 49 3.780 -1.807 3.832 1.00 0.00 H new ATOM 0 HD13 ILE A 49 2.582 -0.509 4.052 1.00 0.00 H new ATOM 753 N ALA A 50 7.829 1.120 4.616 1.00 0.00 N ATOM 754 CA ALA A 50 8.740 1.756 5.560 1.00 0.00 C ATOM 755 C ALA A 50 9.720 2.676 4.841 1.00 0.00 C ATOM 756 O ALA A 50 9.980 3.794 5.290 1.00 0.00 O ATOM 757 CB ALA A 50 9.492 0.701 6.359 1.00 0.00 C ATOM 0 H ALA A 50 7.673 0.126 4.785 1.00 0.00 H new ATOM 0 HA ALA A 50 8.149 2.363 6.246 1.00 0.00 H new ATOM 0 HB1 ALA A 50 10.169 1.189 7.060 1.00 0.00 H new ATOM 0 HB2 ALA A 50 8.780 0.086 6.910 1.00 0.00 H new ATOM 0 HB3 ALA A 50 10.066 0.071 5.680 1.00 0.00 H new ATOM 763 N CYS A 51 10.262 2.200 3.725 1.00 0.00 N ATOM 764 CA CYS A 51 11.216 2.980 2.945 1.00 0.00 C ATOM 765 C CYS A 51 10.662 4.369 2.641 1.00 0.00 C ATOM 766 O CYS A 51 11.307 5.379 2.920 1.00 0.00 O ATOM 767 CB CYS A 51 11.554 2.256 1.641 1.00 0.00 C ATOM 768 SG CYS A 51 12.452 0.704 1.870 1.00 0.00 S ATOM 0 H CYS A 51 10.057 1.278 3.340 1.00 0.00 H new ATOM 0 HA CYS A 51 12.125 3.092 3.536 1.00 0.00 H new ATOM 0 HB2 CYS A 51 10.629 2.052 1.101 1.00 0.00 H new ATOM 0 HB3 CYS A 51 12.150 2.919 1.014 1.00 0.00 H new ATOM 0 HG CYS A 51 11.672 -0.170 2.433 1.00 0.00 H new ATOM 774 N GLU A 52 9.464 4.410 2.067 1.00 0.00 N ATOM 775 CA GLU A 52 8.826 5.675 1.723 1.00 0.00 C ATOM 776 C GLU A 52 8.796 6.614 2.926 1.00 0.00 C ATOM 777 O GLU A 52 9.156 7.787 2.820 1.00 0.00 O ATOM 778 CB GLU A 52 7.403 5.433 1.216 1.00 0.00 C ATOM 779 CG GLU A 52 7.343 4.606 -0.057 1.00 0.00 C ATOM 780 CD GLU A 52 7.650 5.422 -1.298 1.00 0.00 C ATOM 781 OE1 GLU A 52 6.895 6.374 -1.583 1.00 0.00 O ATOM 782 OE2 GLU A 52 8.647 5.107 -1.982 1.00 0.00 O ATOM 0 H GLU A 52 8.916 3.583 1.831 1.00 0.00 H new ATOM 0 HA GLU A 52 9.411 6.144 0.932 1.00 0.00 H new ATOM 0 HB2 GLU A 52 6.830 4.929 1.994 1.00 0.00 H new ATOM 0 HB3 GLU A 52 6.921 6.394 1.038 1.00 0.00 H new ATOM 0 HG2 GLU A 52 8.052 3.782 0.016 1.00 0.00 H new ATOM 0 HG3 GLU A 52 6.351 4.165 -0.153 1.00 0.00 H new ATOM 789 N ASP A 53 8.363 6.090 4.067 1.00 0.00 N ATOM 790 CA ASP A 53 8.287 6.880 5.291 1.00 0.00 C ATOM 791 C ASP A 53 9.676 7.332 5.733 1.00 0.00 C ATOM 792 O ASP A 53 9.855 8.460 6.195 1.00 0.00 O ATOM 793 CB ASP A 53 7.621 6.071 6.404 1.00 0.00 C ATOM 794 CG ASP A 53 7.279 6.921 7.613 1.00 0.00 C ATOM 795 OD1 ASP A 53 6.954 8.113 7.427 1.00 0.00 O ATOM 796 OD2 ASP A 53 7.336 6.395 8.743 1.00 0.00 O ATOM 0 H ASP A 53 8.059 5.122 4.170 1.00 0.00 H new ATOM 0 HA ASP A 53 7.685 7.765 5.087 1.00 0.00 H new ATOM 0 HB2 ASP A 53 6.712 5.609 6.019 1.00 0.00 H new ATOM 0 HB3 ASP A 53 8.285 5.262 6.708 1.00 0.00 H new ATOM 801 N PHE A 54 10.654 6.445 5.591 1.00 0.00 N ATOM 802 CA PHE A 54 12.026 6.752 5.979 1.00 0.00 C ATOM 803 C PHE A 54 12.552 7.960 5.209 1.00 0.00 C ATOM 804 O PHE A 54 13.210 8.833 5.774 1.00 0.00 O ATOM 805 CB PHE A 54 12.931 5.543 5.731 1.00 0.00 C ATOM 806 CG PHE A 54 14.396 5.870 5.785 1.00 0.00 C ATOM 807 CD1 PHE A 54 15.062 5.935 6.999 1.00 0.00 C ATOM 808 CD2 PHE A 54 15.108 6.111 4.622 1.00 0.00 C ATOM 809 CE1 PHE A 54 16.409 6.235 7.052 1.00 0.00 C ATOM 810 CE2 PHE A 54 16.456 6.412 4.668 1.00 0.00 C ATOM 811 CZ PHE A 54 17.108 6.474 5.885 1.00 0.00 C ATOM 0 H PHE A 54 10.523 5.508 5.210 1.00 0.00 H new ATOM 0 HA PHE A 54 12.031 6.990 7.043 1.00 0.00 H new ATOM 0 HB2 PHE A 54 12.711 4.776 6.473 1.00 0.00 H new ATOM 0 HB3 PHE A 54 12.697 5.118 4.755 1.00 0.00 H new ATOM 0 HD1 PHE A 54 14.521 5.749 7.915 1.00 0.00 H new ATOM 0 HD2 PHE A 54 14.604 6.063 3.668 1.00 0.00 H new ATOM 0 HE1 PHE A 54 16.915 6.283 8.005 1.00 0.00 H new ATOM 0 HE2 PHE A 54 17.000 6.599 3.754 1.00 0.00 H new ATOM 0 HZ PHE A 54 18.161 6.709 5.923 1.00 0.00 H new ATOM 821 N LYS A 55 12.256 8.003 3.913 1.00 0.00 N ATOM 822 CA LYS A 55 12.696 9.103 3.064 1.00 0.00 C ATOM 823 C LYS A 55 12.053 10.417 3.498 1.00 0.00 C ATOM 824 O LYS A 55 12.720 11.447 3.588 1.00 0.00 O ATOM 825 CB LYS A 55 12.354 8.813 1.601 1.00 0.00 C ATOM 826 CG LYS A 55 13.055 7.587 1.044 1.00 0.00 C ATOM 827 CD LYS A 55 12.738 7.383 -0.429 1.00 0.00 C ATOM 828 CE LYS A 55 11.382 6.722 -0.619 1.00 0.00 C ATOM 829 NZ LYS A 55 11.223 6.169 -1.994 1.00 0.00 N ATOM 0 H LYS A 55 11.713 7.288 3.429 1.00 0.00 H new ATOM 0 HA LYS A 55 13.777 9.198 3.166 1.00 0.00 H new ATOM 0 HB2 LYS A 55 11.276 8.678 1.508 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.620 9.680 0.996 1.00 0.00 H new ATOM 0 HG2 LYS A 55 14.132 7.692 1.174 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.751 6.705 1.608 1.00 0.00 H new ATOM 0 HD2 LYS A 55 12.751 8.345 -0.942 1.00 0.00 H new ATOM 0 HD3 LYS A 55 13.512 6.767 -0.887 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.263 5.921 0.111 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.593 7.449 -0.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 10.280 5.742 -2.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.329 6.934 -2.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.950 5.445 -2.163 1.00 0.00 H new ATOM 843 N LYS A 56 10.752 10.373 3.766 1.00 0.00 N ATOM 844 CA LYS A 56 10.018 11.558 4.192 1.00 0.00 C ATOM 845 C LYS A 56 10.858 12.406 5.142 1.00 0.00 C ATOM 846 O LYS A 56 10.809 13.634 5.101 1.00 0.00 O ATOM 847 CB LYS A 56 8.709 11.155 4.874 1.00 0.00 C ATOM 848 CG LYS A 56 7.612 10.760 3.900 1.00 0.00 C ATOM 849 CD LYS A 56 6.449 10.088 4.610 1.00 0.00 C ATOM 850 CE LYS A 56 5.444 11.109 5.121 1.00 0.00 C ATOM 851 NZ LYS A 56 5.898 11.748 6.386 1.00 0.00 N ATOM 0 H LYS A 56 10.184 9.528 3.695 1.00 0.00 H new ATOM 0 HA LYS A 56 9.791 12.152 3.306 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.902 10.321 5.548 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.358 11.985 5.487 1.00 0.00 H new ATOM 0 HG2 LYS A 56 7.255 11.646 3.374 1.00 0.00 H new ATOM 0 HG3 LYS A 56 8.019 10.085 3.147 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.953 9.398 3.927 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.824 9.495 5.445 1.00 0.00 H new ATOM 0 HE2 LYS A 56 5.288 11.876 4.362 1.00 0.00 H new ATOM 0 HE3 LYS A 56 4.483 10.622 5.285 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 5.074 11.953 6.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 6.542 11.104 6.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 6.396 12.635 6.168 1.00 0.00 H new ATOM 865 N SER A 57 11.629 11.740 5.997 1.00 0.00 N ATOM 866 CA SER A 57 12.478 12.432 6.960 1.00 0.00 C ATOM 867 C SER A 57 13.358 13.467 6.263 1.00 0.00 C ATOM 868 O SER A 57 13.746 13.291 5.107 1.00 0.00 O ATOM 869 CB SER A 57 13.351 11.429 7.715 1.00 0.00 C ATOM 870 OG SER A 57 14.421 12.081 8.377 1.00 0.00 O ATOM 0 H SER A 57 11.683 10.722 6.042 1.00 0.00 H new ATOM 0 HA SER A 57 11.833 12.948 7.671 1.00 0.00 H new ATOM 0 HB2 SER A 57 12.744 10.889 8.442 1.00 0.00 H new ATOM 0 HB3 SER A 57 13.747 10.690 7.018 1.00 0.00 H new ATOM 0 HG SER A 57 15.197 12.125 7.780 1.00 0.00 H new ATOM 876 N LYS A 58 13.670 14.544 6.974 1.00 0.00 N ATOM 877 CA LYS A 58 14.504 15.607 6.428 1.00 0.00 C ATOM 878 C LYS A 58 15.834 15.690 7.169 1.00 0.00 C ATOM 879 O LYS A 58 16.879 15.936 6.567 1.00 0.00 O ATOM 880 CB LYS A 58 13.775 16.950 6.512 1.00 0.00 C ATOM 881 CG LYS A 58 13.730 17.530 7.916 1.00 0.00 C ATOM 882 CD LYS A 58 12.524 18.434 8.106 1.00 0.00 C ATOM 883 CE LYS A 58 12.782 19.493 9.167 1.00 0.00 C ATOM 884 NZ LYS A 58 11.902 20.680 8.993 1.00 0.00 N ATOM 0 H LYS A 58 13.357 14.704 7.932 1.00 0.00 H new ATOM 0 HA LYS A 58 14.705 15.376 5.382 1.00 0.00 H new ATOM 0 HB2 LYS A 58 14.266 17.663 5.849 1.00 0.00 H new ATOM 0 HB3 LYS A 58 12.756 16.824 6.147 1.00 0.00 H new ATOM 0 HG2 LYS A 58 13.697 16.720 8.645 1.00 0.00 H new ATOM 0 HG3 LYS A 58 14.643 18.094 8.107 1.00 0.00 H new ATOM 0 HD2 LYS A 58 12.278 18.917 7.161 1.00 0.00 H new ATOM 0 HD3 LYS A 58 11.660 17.834 8.392 1.00 0.00 H new ATOM 0 HE2 LYS A 58 12.620 19.063 10.156 1.00 0.00 H new ATOM 0 HE3 LYS A 58 13.825 19.805 9.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 12.109 21.378 9.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 12.074 21.106 8.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 10.906 20.387 9.062 1.00 0.00 H new ATOM 898 N GLY A 59 15.789 15.484 8.483 1.00 0.00 N ATOM 899 CA GLY A 59 16.997 15.539 9.284 1.00 0.00 C ATOM 900 C GLY A 59 17.659 14.183 9.429 1.00 0.00 C ATOM 901 O GLY A 59 17.067 13.145 9.132 1.00 0.00 O ATOM 0 H GLY A 59 14.937 15.280 9.006 1.00 0.00 H new ATOM 0 HA2 GLY A 59 17.700 16.236 8.828 1.00 0.00 H new ATOM 0 HA3 GLY A 59 16.756 15.930 10.273 1.00 0.00 H new ATOM 905 N PRO A 60 18.916 14.180 9.897 1.00 0.00 N ATOM 906 CA PRO A 60 19.686 12.948 10.089 1.00 0.00 C ATOM 907 C PRO A 60 19.153 12.107 11.244 1.00 0.00 C ATOM 908 O PRO A 60 19.170 10.877 11.186 1.00 0.00 O ATOM 909 CB PRO A 60 21.095 13.457 10.406 1.00 0.00 C ATOM 910 CG PRO A 60 20.888 14.818 10.972 1.00 0.00 C ATOM 911 CD PRO A 60 19.683 15.380 10.271 1.00 0.00 C ATOM 0 HA PRO A 60 19.639 12.297 9.216 1.00 0.00 H new ATOM 0 HB2 PRO A 60 21.600 12.805 11.118 1.00 0.00 H new ATOM 0 HB3 PRO A 60 21.714 13.491 9.510 1.00 0.00 H new ATOM 0 HG2 PRO A 60 20.727 14.772 12.049 1.00 0.00 H new ATOM 0 HG3 PRO A 60 21.763 15.446 10.807 1.00 0.00 H new ATOM 0 HD2 PRO A 60 19.108 16.037 10.924 1.00 0.00 H new ATOM 0 HD3 PRO A 60 19.964 15.966 9.396 1.00 0.00 H new ATOM 919 N GLN A 61 18.679 12.776 12.289 1.00 0.00 N ATOM 920 CA GLN A 61 18.141 12.088 13.456 1.00 0.00 C ATOM 921 C GLN A 61 17.232 10.938 13.039 1.00 0.00 C ATOM 922 O GLN A 61 17.559 9.769 13.245 1.00 0.00 O ATOM 923 CB GLN A 61 17.369 13.068 14.342 1.00 0.00 C ATOM 924 CG GLN A 61 17.424 12.724 15.822 1.00 0.00 C ATOM 925 CD GLN A 61 16.320 11.775 16.242 1.00 0.00 C ATOM 926 OE1 GLN A 61 15.832 10.978 15.439 1.00 0.00 O ATOM 927 NE2 GLN A 61 15.921 11.853 17.505 1.00 0.00 N ATOM 0 H GLN A 61 18.656 13.794 12.352 1.00 0.00 H new ATOM 0 HA GLN A 61 18.978 11.679 14.022 1.00 0.00 H new ATOM 0 HB2 GLN A 61 17.770 14.071 14.196 1.00 0.00 H new ATOM 0 HB3 GLN A 61 16.327 13.092 14.021 1.00 0.00 H new ATOM 0 HG2 GLN A 61 18.390 12.275 16.051 1.00 0.00 H new ATOM 0 HG3 GLN A 61 17.352 13.641 16.407 1.00 0.00 H new ATOM 0 HE21 GLN A 61 16.353 12.528 18.136 1.00 0.00 H new ATOM 0 HE22 GLN A 61 15.182 11.238 17.845 1.00 0.00 H new ATOM 936 N GLN A 62 16.088 11.277 12.451 1.00 0.00 N ATOM 937 CA GLN A 62 15.131 10.270 12.007 1.00 0.00 C ATOM 938 C GLN A 62 15.826 9.176 11.203 1.00 0.00 C ATOM 939 O GLN A 62 15.634 7.987 11.461 1.00 0.00 O ATOM 940 CB GLN A 62 14.034 10.920 11.162 1.00 0.00 C ATOM 941 CG GLN A 62 12.876 11.466 11.982 1.00 0.00 C ATOM 942 CD GLN A 62 13.325 12.462 13.033 1.00 0.00 C ATOM 943 OE1 GLN A 62 13.645 13.610 12.719 1.00 0.00 O ATOM 944 NE2 GLN A 62 13.351 12.030 14.288 1.00 0.00 N ATOM 0 H GLN A 62 15.802 12.240 12.272 1.00 0.00 H new ATOM 0 HA GLN A 62 14.681 9.816 12.890 1.00 0.00 H new ATOM 0 HB2 GLN A 62 14.469 11.731 10.579 1.00 0.00 H new ATOM 0 HB3 GLN A 62 13.651 10.187 10.452 1.00 0.00 H new ATOM 0 HG2 GLN A 62 12.158 11.945 11.316 1.00 0.00 H new ATOM 0 HG3 GLN A 62 12.358 10.639 12.468 1.00 0.00 H new ATOM 0 HE21 GLN A 62 13.078 11.071 14.503 1.00 0.00 H new ATOM 0 HE22 GLN A 62 13.644 12.657 15.037 1.00 0.00 H new ATOM 953 N ILE A 63 16.633 9.584 10.231 1.00 0.00 N ATOM 954 CA ILE A 63 17.357 8.637 9.390 1.00 0.00 C ATOM 955 C ILE A 63 18.065 7.583 10.235 1.00 0.00 C ATOM 956 O ILE A 63 18.062 6.398 9.899 1.00 0.00 O ATOM 957 CB ILE A 63 18.395 9.350 8.504 1.00 0.00 C ATOM 958 CG1 ILE A 63 17.702 10.334 7.560 1.00 0.00 C ATOM 959 CG2 ILE A 63 19.206 8.332 7.715 1.00 0.00 C ATOM 960 CD1 ILE A 63 18.607 11.443 7.070 1.00 0.00 C ATOM 0 H ILE A 63 16.803 10.564 10.005 1.00 0.00 H new ATOM 0 HA ILE A 63 16.618 8.153 8.751 1.00 0.00 H new ATOM 0 HB ILE A 63 19.076 9.910 9.146 1.00 0.00 H new ATOM 0 HG12 ILE A 63 17.313 9.788 6.701 1.00 0.00 H new ATOM 0 HG13 ILE A 63 16.846 10.774 8.072 1.00 0.00 H new ATOM 0 HG21 ILE A 63 19.936 8.851 7.093 1.00 0.00 H new ATOM 0 HG22 ILE A 63 19.725 7.667 8.405 1.00 0.00 H new ATOM 0 HG23 ILE A 63 18.539 7.748 7.081 1.00 0.00 H new ATOM 0 HD11 ILE A 63 18.048 12.102 6.406 1.00 0.00 H new ATOM 0 HD12 ILE A 63 18.976 12.015 7.922 1.00 0.00 H new ATOM 0 HD13 ILE A 63 19.450 11.013 6.529 1.00 0.00 H new ATOM 972 N HIS A 64 18.669 8.022 11.336 1.00 0.00 N ATOM 973 CA HIS A 64 19.380 7.116 12.231 1.00 0.00 C ATOM 974 C HIS A 64 18.402 6.216 12.980 1.00 0.00 C ATOM 975 O HIS A 64 18.476 4.989 12.890 1.00 0.00 O ATOM 976 CB HIS A 64 20.227 7.909 13.227 1.00 0.00 C ATOM 977 CG HIS A 64 21.621 8.173 12.748 1.00 0.00 C ATOM 978 ND1 HIS A 64 22.725 7.513 13.246 1.00 0.00 N ATOM 979 CD2 HIS A 64 22.088 9.032 11.811 1.00 0.00 C ATOM 980 CE1 HIS A 64 23.811 7.956 12.636 1.00 0.00 C ATOM 981 NE2 HIS A 64 23.452 8.877 11.761 1.00 0.00 N ATOM 0 H HIS A 64 18.680 8.999 11.629 1.00 0.00 H new ATOM 0 HA HIS A 64 20.036 6.488 11.628 1.00 0.00 H new ATOM 0 HB2 HIS A 64 19.736 8.860 13.433 1.00 0.00 H new ATOM 0 HB3 HIS A 64 20.272 7.363 14.169 1.00 0.00 H new ATOM 0 HD2 HIS A 64 21.498 9.712 11.214 1.00 0.00 H new ATOM 0 HE1 HIS A 64 24.821 7.621 12.822 1.00 0.00 H new ATOM 0 HE2 HIS A 64 24.085 9.390 11.147 1.00 0.00 H new ATOM 989 N LEU A 65 17.486 6.831 13.720 1.00 0.00 N ATOM 990 CA LEU A 65 16.494 6.086 14.486 1.00 0.00 C ATOM 991 C LEU A 65 15.728 5.119 13.590 1.00 0.00 C ATOM 992 O LEU A 65 15.759 3.905 13.797 1.00 0.00 O ATOM 993 CB LEU A 65 15.519 7.048 15.168 1.00 0.00 C ATOM 994 CG LEU A 65 16.007 7.687 16.468 1.00 0.00 C ATOM 995 CD1 LEU A 65 17.245 8.533 16.216 1.00 0.00 C ATOM 996 CD2 LEU A 65 14.904 8.527 17.095 1.00 0.00 C ATOM 0 H LEU A 65 17.410 7.845 13.806 1.00 0.00 H new ATOM 0 HA LEU A 65 17.018 5.509 15.248 1.00 0.00 H new ATOM 0 HB2 LEU A 65 15.274 7.844 14.465 1.00 0.00 H new ATOM 0 HB3 LEU A 65 14.594 6.510 15.376 1.00 0.00 H new ATOM 0 HG LEU A 65 16.272 6.891 17.164 1.00 0.00 H new ATOM 0 HD11 LEU A 65 17.577 8.980 17.153 1.00 0.00 H new ATOM 0 HD12 LEU A 65 18.039 7.905 15.812 1.00 0.00 H new ATOM 0 HD13 LEU A 65 17.007 9.322 15.502 1.00 0.00 H new ATOM 0 HD21 LEU A 65 15.269 8.975 18.020 1.00 0.00 H new ATOM 0 HD22 LEU A 65 14.608 9.315 16.402 1.00 0.00 H new ATOM 0 HD23 LEU A 65 14.044 7.894 17.313 1.00 0.00 H new ATOM 1008 N LYS A 66 15.042 5.663 12.590 1.00 0.00 N ATOM 1009 CA LYS A 66 14.271 4.849 11.658 1.00 0.00 C ATOM 1010 C LYS A 66 15.129 3.733 11.071 1.00 0.00 C ATOM 1011 O LYS A 66 14.697 2.584 10.985 1.00 0.00 O ATOM 1012 CB LYS A 66 13.708 5.721 10.534 1.00 0.00 C ATOM 1013 CG LYS A 66 12.431 6.451 10.911 1.00 0.00 C ATOM 1014 CD LYS A 66 12.153 7.609 9.968 1.00 0.00 C ATOM 1015 CE LYS A 66 11.372 8.716 10.660 1.00 0.00 C ATOM 1016 NZ LYS A 66 9.901 8.525 10.525 1.00 0.00 N ATOM 0 H LYS A 66 15.005 6.665 12.404 1.00 0.00 H new ATOM 0 HA LYS A 66 13.445 4.396 12.206 1.00 0.00 H new ATOM 0 HB2 LYS A 66 14.461 6.452 10.241 1.00 0.00 H new ATOM 0 HB3 LYS A 66 13.515 5.095 9.662 1.00 0.00 H new ATOM 0 HG2 LYS A 66 11.593 5.754 10.891 1.00 0.00 H new ATOM 0 HG3 LYS A 66 12.511 6.823 11.932 1.00 0.00 H new ATOM 0 HD2 LYS A 66 13.095 8.007 9.592 1.00 0.00 H new ATOM 0 HD3 LYS A 66 11.591 7.250 9.105 1.00 0.00 H new ATOM 0 HE2 LYS A 66 11.639 8.743 11.716 1.00 0.00 H new ATOM 0 HE3 LYS A 66 11.654 9.679 10.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 9.404 9.300 11.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 9.642 8.524 9.518 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 9.628 7.617 10.953 1.00 0.00 H new ATOM 1030 N ALA A 67 16.348 4.080 10.669 1.00 0.00 N ATOM 1031 CA ALA A 67 17.267 3.107 10.093 1.00 0.00 C ATOM 1032 C ALA A 67 17.300 1.825 10.920 1.00 0.00 C ATOM 1033 O ALA A 67 17.048 0.735 10.407 1.00 0.00 O ATOM 1034 CB ALA A 67 18.663 3.701 9.981 1.00 0.00 C ATOM 0 H ALA A 67 16.721 5.027 10.732 1.00 0.00 H new ATOM 0 HA ALA A 67 16.910 2.855 9.094 1.00 0.00 H new ATOM 0 HB1 ALA A 67 19.339 2.963 9.549 1.00 0.00 H new ATOM 0 HB2 ALA A 67 18.633 4.583 9.342 1.00 0.00 H new ATOM 0 HB3 ALA A 67 19.019 3.983 10.972 1.00 0.00 H new ATOM 1040 N LYS A 68 17.613 1.964 12.204 1.00 0.00 N ATOM 1041 CA LYS A 68 17.679 0.818 13.104 1.00 0.00 C ATOM 1042 C LYS A 68 16.338 0.095 13.162 1.00 0.00 C ATOM 1043 O LYS A 68 16.238 -1.077 12.797 1.00 0.00 O ATOM 1044 CB LYS A 68 18.088 1.270 14.508 1.00 0.00 C ATOM 1045 CG LYS A 68 19.581 1.166 14.769 1.00 0.00 C ATOM 1046 CD LYS A 68 20.061 2.266 15.701 1.00 0.00 C ATOM 1047 CE LYS A 68 21.568 2.450 15.616 1.00 0.00 C ATOM 1048 NZ LYS A 68 21.950 3.420 14.552 1.00 0.00 N ATOM 0 H LYS A 68 17.825 2.859 12.645 1.00 0.00 H new ATOM 0 HA LYS A 68 18.428 0.127 12.719 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.773 2.303 14.654 1.00 0.00 H new ATOM 0 HB3 LYS A 68 17.556 0.667 15.244 1.00 0.00 H new ATOM 0 HG2 LYS A 68 19.808 0.193 15.205 1.00 0.00 H new ATOM 0 HG3 LYS A 68 20.122 1.226 13.824 1.00 0.00 H new ATOM 0 HD2 LYS A 68 19.564 3.202 15.447 1.00 0.00 H new ATOM 0 HD3 LYS A 68 19.780 2.024 16.726 1.00 0.00 H new ATOM 0 HE2 LYS A 68 21.946 2.798 16.577 1.00 0.00 H new ATOM 0 HE3 LYS A 68 22.041 1.488 15.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 22.985 3.517 14.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 21.612 3.076 13.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 21.520 4.345 14.755 1.00 0.00 H new ATOM 1062 N ALA A 69 15.309 0.799 13.620 1.00 0.00 N ATOM 1063 CA ALA A 69 13.974 0.225 13.721 1.00 0.00 C ATOM 1064 C ALA A 69 13.649 -0.630 12.501 1.00 0.00 C ATOM 1065 O ALA A 69 13.359 -1.820 12.624 1.00 0.00 O ATOM 1066 CB ALA A 69 12.936 1.326 13.888 1.00 0.00 C ATOM 0 H ALA A 69 15.375 1.769 13.927 1.00 0.00 H new ATOM 0 HA ALA A 69 13.949 -0.419 14.600 1.00 0.00 H new ATOM 0 HB1 ALA A 69 11.943 0.882 13.962 1.00 0.00 H new ATOM 0 HB2 ALA A 69 13.149 1.892 14.795 1.00 0.00 H new ATOM 0 HB3 ALA A 69 12.972 1.993 13.027 1.00 0.00 H new ATOM 1072 N ILE A 70 13.700 -0.015 11.323 1.00 0.00 N ATOM 1073 CA ILE A 70 13.412 -0.720 10.080 1.00 0.00 C ATOM 1074 C ILE A 70 14.425 -1.833 9.833 1.00 0.00 C ATOM 1075 O ILE A 70 14.066 -2.929 9.399 1.00 0.00 O ATOM 1076 CB ILE A 70 13.416 0.238 8.875 1.00 0.00 C ATOM 1077 CG1 ILE A 70 12.259 1.233 8.984 1.00 0.00 C ATOM 1078 CG2 ILE A 70 13.326 -0.546 7.575 1.00 0.00 C ATOM 1079 CD1 ILE A 70 12.493 2.518 8.222 1.00 0.00 C ATOM 0 H ILE A 70 13.938 0.970 11.204 1.00 0.00 H new ATOM 0 HA ILE A 70 12.417 -1.153 10.186 1.00 0.00 H new ATOM 0 HB ILE A 70 14.352 0.796 8.876 1.00 0.00 H new ATOM 0 HG12 ILE A 70 11.349 0.761 8.614 1.00 0.00 H new ATOM 0 HG13 ILE A 70 12.091 1.469 10.035 1.00 0.00 H new ATOM 0 HG21 ILE A 70 13.330 0.145 6.732 1.00 0.00 H new ATOM 0 HG22 ILE A 70 14.180 -1.219 7.496 1.00 0.00 H new ATOM 0 HG23 ILE A 70 12.404 -1.127 7.564 1.00 0.00 H new ATOM 0 HD11 ILE A 70 11.632 3.175 8.344 1.00 0.00 H new ATOM 0 HD12 ILE A 70 13.385 3.012 8.607 1.00 0.00 H new ATOM 0 HD13 ILE A 70 12.631 2.294 7.164 1.00 0.00 H new ATOM 1091 N TYR A 71 15.691 -1.548 10.114 1.00 0.00 N ATOM 1092 CA TYR A 71 16.756 -2.524 9.922 1.00 0.00 C ATOM 1093 C TYR A 71 16.478 -3.798 10.714 1.00 0.00 C ATOM 1094 O TYR A 71 16.352 -4.881 10.143 1.00 0.00 O ATOM 1095 CB TYR A 71 18.102 -1.932 10.345 1.00 0.00 C ATOM 1096 CG TYR A 71 19.052 -2.949 10.935 1.00 0.00 C ATOM 1097 CD1 TYR A 71 19.541 -4.000 10.169 1.00 0.00 C ATOM 1098 CD2 TYR A 71 19.462 -2.858 12.260 1.00 0.00 C ATOM 1099 CE1 TYR A 71 20.408 -4.932 10.705 1.00 0.00 C ATOM 1100 CE2 TYR A 71 20.331 -3.784 12.804 1.00 0.00 C ATOM 1101 CZ TYR A 71 20.800 -4.819 12.023 1.00 0.00 C ATOM 1102 OH TYR A 71 21.666 -5.745 12.560 1.00 0.00 O ATOM 0 H TYR A 71 16.005 -0.648 10.476 1.00 0.00 H new ATOM 0 HA TYR A 71 16.794 -2.777 8.862 1.00 0.00 H new ATOM 0 HB2 TYR A 71 18.573 -1.467 9.479 1.00 0.00 H new ATOM 0 HB3 TYR A 71 17.928 -1.142 11.076 1.00 0.00 H new ATOM 0 HD1 TYR A 71 19.238 -4.090 9.136 1.00 0.00 H new ATOM 0 HD2 TYR A 71 19.095 -2.050 12.875 1.00 0.00 H new ATOM 0 HE1 TYR A 71 20.777 -5.744 10.096 1.00 0.00 H new ATOM 0 HE2 TYR A 71 20.641 -3.698 13.835 1.00 0.00 H new ATOM 0 HH TYR A 71 21.843 -5.522 13.498 1.00 0.00 H new ATOM 1112 N GLU A 72 16.382 -3.658 12.033 1.00 0.00 N ATOM 1113 CA GLU A 72 16.118 -4.798 12.904 1.00 0.00 C ATOM 1114 C GLU A 72 14.722 -5.361 12.654 1.00 0.00 C ATOM 1115 O GLU A 72 14.317 -6.345 13.273 1.00 0.00 O ATOM 1116 CB GLU A 72 16.260 -4.390 14.371 1.00 0.00 C ATOM 1117 CG GLU A 72 17.644 -3.874 14.728 1.00 0.00 C ATOM 1118 CD GLU A 72 17.722 -3.345 16.147 1.00 0.00 C ATOM 1119 OE1 GLU A 72 16.836 -2.558 16.537 1.00 0.00 O ATOM 1120 OE2 GLU A 72 18.672 -3.721 16.868 1.00 0.00 O ATOM 0 H GLU A 72 16.483 -2.768 12.521 1.00 0.00 H new ATOM 0 HA GLU A 72 16.850 -5.573 12.678 1.00 0.00 H new ATOM 0 HB2 GLU A 72 15.524 -3.618 14.598 1.00 0.00 H new ATOM 0 HB3 GLU A 72 16.027 -5.248 15.002 1.00 0.00 H new ATOM 0 HG2 GLU A 72 18.370 -4.677 14.603 1.00 0.00 H new ATOM 0 HG3 GLU A 72 17.923 -3.082 14.033 1.00 0.00 H new ATOM 1127 N LYS A 73 13.989 -4.729 11.744 1.00 0.00 N ATOM 1128 CA LYS A 73 12.638 -5.166 11.409 1.00 0.00 C ATOM 1129 C LYS A 73 12.644 -6.055 10.171 1.00 0.00 C ATOM 1130 O LYS A 73 12.378 -7.254 10.254 1.00 0.00 O ATOM 1131 CB LYS A 73 11.731 -3.955 11.177 1.00 0.00 C ATOM 1132 CG LYS A 73 10.255 -4.304 11.115 1.00 0.00 C ATOM 1133 CD LYS A 73 9.385 -3.122 11.511 1.00 0.00 C ATOM 1134 CE LYS A 73 7.921 -3.519 11.621 1.00 0.00 C ATOM 1135 NZ LYS A 73 7.244 -3.514 10.295 1.00 0.00 N ATOM 0 H LYS A 73 14.308 -3.911 11.224 1.00 0.00 H new ATOM 0 HA LYS A 73 12.253 -5.746 12.248 1.00 0.00 H new ATOM 0 HB2 LYS A 73 11.892 -3.233 11.977 1.00 0.00 H new ATOM 0 HB3 LYS A 73 12.020 -3.468 10.246 1.00 0.00 H new ATOM 0 HG2 LYS A 73 9.998 -4.624 10.105 1.00 0.00 H new ATOM 0 HG3 LYS A 73 10.051 -5.145 11.777 1.00 0.00 H new ATOM 0 HD2 LYS A 73 9.727 -2.721 12.465 1.00 0.00 H new ATOM 0 HD3 LYS A 73 9.493 -2.326 10.774 1.00 0.00 H new ATOM 0 HE2 LYS A 73 7.846 -4.513 12.063 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.408 -2.832 12.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.483 -4.223 10.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.841 -2.572 10.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 7.934 -3.743 9.552 1.00 0.00 H new ATOM 1149 N PHE A 74 12.951 -5.461 9.023 1.00 0.00 N ATOM 1150 CA PHE A 74 12.992 -6.199 7.765 1.00 0.00 C ATOM 1151 C PHE A 74 14.423 -6.596 7.415 1.00 0.00 C ATOM 1152 O PHE A 74 14.749 -7.782 7.339 1.00 0.00 O ATOM 1153 CB PHE A 74 12.393 -5.360 6.636 1.00 0.00 C ATOM 1154 CG PHE A 74 11.159 -4.604 7.040 1.00 0.00 C ATOM 1155 CD1 PHE A 74 9.964 -5.271 7.259 1.00 0.00 C ATOM 1156 CD2 PHE A 74 11.194 -3.229 7.202 1.00 0.00 C ATOM 1157 CE1 PHE A 74 8.827 -4.578 7.630 1.00 0.00 C ATOM 1158 CE2 PHE A 74 10.060 -2.531 7.574 1.00 0.00 C ATOM 1159 CZ PHE A 74 8.875 -3.207 7.789 1.00 0.00 C ATOM 0 H PHE A 74 13.175 -4.470 8.937 1.00 0.00 H new ATOM 0 HA PHE A 74 12.400 -7.106 7.886 1.00 0.00 H new ATOM 0 HB2 PHE A 74 13.143 -4.653 6.283 1.00 0.00 H new ATOM 0 HB3 PHE A 74 12.151 -6.013 5.798 1.00 0.00 H new ATOM 0 HD1 PHE A 74 9.921 -6.343 7.139 1.00 0.00 H new ATOM 0 HD2 PHE A 74 12.118 -2.696 7.036 1.00 0.00 H new ATOM 0 HE1 PHE A 74 7.901 -5.109 7.796 1.00 0.00 H new ATOM 0 HE2 PHE A 74 10.101 -1.459 7.696 1.00 0.00 H new ATOM 0 HZ PHE A 74 7.988 -2.665 8.081 1.00 0.00 H new ATOM 1169 N ILE A 75 15.273 -5.597 7.202 1.00 0.00 N ATOM 1170 CA ILE A 75 16.669 -5.842 6.860 1.00 0.00 C ATOM 1171 C ILE A 75 17.179 -7.120 7.517 1.00 0.00 C ATOM 1172 O ILE A 75 17.375 -8.136 6.849 1.00 0.00 O ATOM 1173 CB ILE A 75 17.567 -4.665 7.287 1.00 0.00 C ATOM 1174 CG1 ILE A 75 17.109 -3.374 6.607 1.00 0.00 C ATOM 1175 CG2 ILE A 75 19.021 -4.961 6.950 1.00 0.00 C ATOM 1176 CD1 ILE A 75 17.133 -3.444 5.096 1.00 0.00 C ATOM 0 H ILE A 75 15.020 -4.611 7.260 1.00 0.00 H new ATOM 0 HA ILE A 75 16.715 -5.950 5.776 1.00 0.00 H new ATOM 0 HB ILE A 75 17.483 -4.534 8.366 1.00 0.00 H new ATOM 0 HG12 ILE A 75 16.096 -3.140 6.935 1.00 0.00 H new ATOM 0 HG13 ILE A 75 17.748 -2.554 6.935 1.00 0.00 H new ATOM 0 HG21 ILE A 75 19.644 -4.121 7.257 1.00 0.00 H new ATOM 0 HG22 ILE A 75 19.340 -5.861 7.476 1.00 0.00 H new ATOM 0 HG23 ILE A 75 19.122 -5.113 5.875 1.00 0.00 H new ATOM 0 HD11 ILE A 75 16.796 -2.494 4.682 1.00 0.00 H new ATOM 0 HD12 ILE A 75 18.149 -3.647 4.757 1.00 0.00 H new ATOM 0 HD13 ILE A 75 16.472 -4.242 4.758 1.00 0.00 H new ATOM 1188 N GLN A 76 17.391 -7.062 8.827 1.00 0.00 N ATOM 1189 CA GLN A 76 17.878 -8.218 9.573 1.00 0.00 C ATOM 1190 C GLN A 76 16.982 -9.430 9.345 1.00 0.00 C ATOM 1191 O GLN A 76 15.823 -9.295 8.952 1.00 0.00 O ATOM 1192 CB GLN A 76 17.948 -7.893 11.066 1.00 0.00 C ATOM 1193 CG GLN A 76 16.628 -8.090 11.794 1.00 0.00 C ATOM 1194 CD GLN A 76 16.773 -8.000 13.300 1.00 0.00 C ATOM 1195 OE1 GLN A 76 15.947 -8.752 14.020 1.00 0.00 O flip ATOM 1196 NE2 GLN A 76 17.617 -7.264 13.813 1.00 0.00 N flip ATOM 0 H GLN A 76 17.234 -6.229 9.394 1.00 0.00 H new ATOM 0 HA GLN A 76 18.878 -8.457 9.213 1.00 0.00 H new ATOM 0 HB2 GLN A 76 18.707 -8.522 11.531 1.00 0.00 H new ATOM 0 HB3 GLN A 76 18.271 -6.859 11.190 1.00 0.00 H new ATOM 0 HG2 GLN A 76 15.915 -7.338 11.456 1.00 0.00 H new ATOM 0 HG3 GLN A 76 16.214 -9.063 11.530 1.00 0.00 H new ATOM 0 HE21 GLN A 76 18.231 -6.703 13.222 1.00 0.00 H new ATOM 0 HE22 GLN A 76 17.702 -7.215 14.828 1.00 0.00 H new ATOM 1205 N THR A 77 17.526 -10.618 9.595 1.00 0.00 N ATOM 1206 CA THR A 77 16.777 -11.854 9.416 1.00 0.00 C ATOM 1207 C THR A 77 16.135 -12.303 10.723 1.00 0.00 C ATOM 1208 O THR A 77 15.061 -12.905 10.724 1.00 0.00 O ATOM 1209 CB THR A 77 17.678 -12.985 8.884 1.00 0.00 C ATOM 1210 OG1 THR A 77 17.943 -12.787 7.491 1.00 0.00 O ATOM 1211 CG2 THR A 77 17.023 -14.342 9.094 1.00 0.00 C ATOM 0 H THR A 77 18.483 -10.749 9.922 1.00 0.00 H new ATOM 0 HA THR A 77 15.996 -11.647 8.684 1.00 0.00 H new ATOM 0 HB THR A 77 18.617 -12.963 9.438 1.00 0.00 H new ATOM 0 HG1 THR A 77 18.518 -13.509 7.161 1.00 0.00 H new ATOM 0 HG21 THR A 77 17.677 -15.125 8.711 1.00 0.00 H new ATOM 0 HG22 THR A 77 16.850 -14.502 10.158 1.00 0.00 H new ATOM 0 HG23 THR A 77 16.071 -14.373 8.564 1.00 0.00 H new ATOM 1219 N ASP A 78 16.798 -12.004 11.835 1.00 0.00 N ATOM 1220 CA ASP A 78 16.291 -12.377 13.151 1.00 0.00 C ATOM 1221 C ASP A 78 15.088 -11.518 13.531 1.00 0.00 C ATOM 1222 O ASP A 78 14.719 -11.435 14.703 1.00 0.00 O ATOM 1223 CB ASP A 78 17.391 -12.231 14.204 1.00 0.00 C ATOM 1224 CG ASP A 78 16.874 -12.445 15.614 1.00 0.00 C ATOM 1225 OD1 ASP A 78 15.915 -13.228 15.781 1.00 0.00 O ATOM 1226 OD2 ASP A 78 17.428 -11.831 16.549 1.00 0.00 O ATOM 0 H ASP A 78 17.687 -11.505 11.852 1.00 0.00 H new ATOM 0 HA ASP A 78 15.974 -13.419 13.111 1.00 0.00 H new ATOM 0 HB2 ASP A 78 18.185 -12.949 13.998 1.00 0.00 H new ATOM 0 HB3 ASP A 78 17.833 -11.237 14.129 1.00 0.00 H new ATOM 1231 N ALA A 79 14.482 -10.883 12.534 1.00 0.00 N ATOM 1232 CA ALA A 79 13.321 -10.032 12.764 1.00 0.00 C ATOM 1233 C ALA A 79 12.033 -10.738 12.354 1.00 0.00 C ATOM 1234 O ALA A 79 12.035 -11.658 11.534 1.00 0.00 O ATOM 1235 CB ALA A 79 13.469 -8.721 12.008 1.00 0.00 C ATOM 0 H ALA A 79 14.776 -10.942 11.559 1.00 0.00 H new ATOM 0 HA ALA A 79 13.264 -9.819 13.831 1.00 0.00 H new ATOM 0 HB1 ALA A 79 12.595 -8.096 12.189 1.00 0.00 H new ATOM 0 HB2 ALA A 79 14.364 -8.202 12.352 1.00 0.00 H new ATOM 0 HB3 ALA A 79 13.555 -8.924 10.941 1.00 0.00 H new ATOM 1241 N PRO A 80 10.906 -10.303 12.937 1.00 0.00 N ATOM 1242 CA PRO A 80 9.590 -10.881 12.647 1.00 0.00 C ATOM 1243 C PRO A 80 9.108 -10.546 11.240 1.00 0.00 C ATOM 1244 O PRO A 80 8.405 -11.335 10.609 1.00 0.00 O ATOM 1245 CB PRO A 80 8.680 -10.231 13.693 1.00 0.00 C ATOM 1246 CG PRO A 80 9.354 -8.949 14.038 1.00 0.00 C ATOM 1247 CD PRO A 80 10.830 -9.213 13.924 1.00 0.00 C ATOM 0 HA PRO A 80 9.604 -11.970 12.691 1.00 0.00 H new ATOM 0 HB2 PRO A 80 7.680 -10.058 13.295 1.00 0.00 H new ATOM 0 HB3 PRO A 80 8.568 -10.868 14.570 1.00 0.00 H new ATOM 0 HG2 PRO A 80 9.047 -8.152 13.361 1.00 0.00 H new ATOM 0 HG3 PRO A 80 9.092 -8.629 15.046 1.00 0.00 H new ATOM 0 HD2 PRO A 80 11.372 -8.329 13.589 1.00 0.00 H new ATOM 0 HD3 PRO A 80 11.261 -9.507 14.881 1.00 0.00 H new ATOM 1255 N LYS A 81 9.490 -9.370 10.752 1.00 0.00 N ATOM 1256 CA LYS A 81 9.099 -8.931 9.418 1.00 0.00 C ATOM 1257 C LYS A 81 10.251 -9.093 8.432 1.00 0.00 C ATOM 1258 O LYS A 81 10.249 -8.494 7.357 1.00 0.00 O ATOM 1259 CB LYS A 81 8.645 -7.471 9.453 1.00 0.00 C ATOM 1260 CG LYS A 81 7.525 -7.205 10.445 1.00 0.00 C ATOM 1261 CD LYS A 81 6.191 -7.718 9.930 1.00 0.00 C ATOM 1262 CE LYS A 81 5.192 -7.905 11.062 1.00 0.00 C ATOM 1263 NZ LYS A 81 4.383 -6.677 11.296 1.00 0.00 N ATOM 0 H LYS A 81 10.070 -8.704 11.261 1.00 0.00 H new ATOM 0 HA LYS A 81 8.270 -9.555 9.086 1.00 0.00 H new ATOM 0 HB2 LYS A 81 9.498 -6.840 9.703 1.00 0.00 H new ATOM 0 HB3 LYS A 81 8.314 -7.178 8.457 1.00 0.00 H new ATOM 0 HG2 LYS A 81 7.758 -7.685 11.396 1.00 0.00 H new ATOM 0 HG3 LYS A 81 7.455 -6.134 10.637 1.00 0.00 H new ATOM 0 HD2 LYS A 81 5.788 -7.017 9.199 1.00 0.00 H new ATOM 0 HD3 LYS A 81 6.339 -8.666 9.414 1.00 0.00 H new ATOM 0 HE2 LYS A 81 4.529 -8.738 10.827 1.00 0.00 H new ATOM 0 HE3 LYS A 81 5.724 -8.169 11.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 3.714 -6.845 12.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 5.013 -5.888 11.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 3.855 -6.439 10.432 1.00 0.00 H new ATOM 1277 N GLU A 82 11.233 -9.909 8.804 1.00 0.00 N ATOM 1278 CA GLU A 82 12.390 -10.149 7.950 1.00 0.00 C ATOM 1279 C GLU A 82 11.955 -10.559 6.546 1.00 0.00 C ATOM 1280 O GLU A 82 11.279 -11.572 6.365 1.00 0.00 O ATOM 1281 CB GLU A 82 13.282 -11.234 8.557 1.00 0.00 C ATOM 1282 CG GLU A 82 12.635 -12.608 8.588 1.00 0.00 C ATOM 1283 CD GLU A 82 12.893 -13.402 7.321 1.00 0.00 C ATOM 1284 OE1 GLU A 82 13.893 -13.113 6.632 1.00 0.00 O ATOM 1285 OE2 GLU A 82 12.093 -14.313 7.020 1.00 0.00 O ATOM 0 H GLU A 82 11.250 -10.414 9.690 1.00 0.00 H new ATOM 0 HA GLU A 82 12.956 -9.220 7.879 1.00 0.00 H new ATOM 0 HB2 GLU A 82 14.209 -11.291 7.987 1.00 0.00 H new ATOM 0 HB3 GLU A 82 13.550 -10.945 9.573 1.00 0.00 H new ATOM 0 HG2 GLU A 82 13.014 -13.165 9.445 1.00 0.00 H new ATOM 0 HG3 GLU A 82 11.560 -12.496 8.730 1.00 0.00 H new ATOM 1292 N VAL A 83 12.348 -9.765 5.556 1.00 0.00 N ATOM 1293 CA VAL A 83 12.000 -10.044 4.168 1.00 0.00 C ATOM 1294 C VAL A 83 13.196 -10.602 3.403 1.00 0.00 C ATOM 1295 O VAL A 83 14.301 -10.688 3.936 1.00 0.00 O ATOM 1296 CB VAL A 83 11.490 -8.780 3.451 1.00 0.00 C ATOM 1297 CG1 VAL A 83 10.248 -8.238 4.142 1.00 0.00 C ATOM 1298 CG2 VAL A 83 12.583 -7.723 3.396 1.00 0.00 C ATOM 0 H VAL A 83 12.908 -8.923 5.689 1.00 0.00 H new ATOM 0 HA VAL A 83 11.204 -10.788 4.185 1.00 0.00 H new ATOM 0 HB VAL A 83 11.220 -9.046 2.429 1.00 0.00 H new ATOM 0 HG11 VAL A 83 9.902 -7.345 3.621 1.00 0.00 H new ATOM 0 HG12 VAL A 83 9.463 -8.994 4.126 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.487 -7.986 5.175 1.00 0.00 H new ATOM 0 HG21 VAL A 83 12.206 -6.836 2.886 1.00 0.00 H new ATOM 0 HG22 VAL A 83 12.885 -7.458 4.409 1.00 0.00 H new ATOM 0 HG23 VAL A 83 13.442 -8.116 2.853 1.00 0.00 H new ATOM 1308 N ASN A 84 12.964 -10.980 2.150 1.00 0.00 N ATOM 1309 CA ASN A 84 14.023 -11.530 1.311 1.00 0.00 C ATOM 1310 C ASN A 84 14.929 -10.423 0.781 1.00 0.00 C ATOM 1311 O ASN A 84 14.540 -9.657 -0.101 1.00 0.00 O ATOM 1312 CB ASN A 84 13.421 -12.314 0.142 1.00 0.00 C ATOM 1313 CG ASN A 84 12.130 -11.699 -0.362 1.00 0.00 C ATOM 1314 OD1 ASN A 84 11.975 -10.477 -0.376 1.00 0.00 O ATOM 1315 ND2 ASN A 84 11.194 -12.545 -0.777 1.00 0.00 N ATOM 0 H ASN A 84 12.054 -10.916 1.694 1.00 0.00 H new ATOM 0 HA ASN A 84 14.623 -12.204 1.923 1.00 0.00 H new ATOM 0 HB2 ASN A 84 14.143 -12.356 -0.674 1.00 0.00 H new ATOM 0 HB3 ASN A 84 13.233 -13.341 0.455 1.00 0.00 H new ATOM 0 HD21 ASN A 84 10.304 -12.190 -1.125 1.00 0.00 H new ATOM 0 HD22 ASN A 84 11.366 -13.550 -0.748 1.00 0.00 H new ATOM 1322 N LEU A 85 16.138 -10.345 1.326 1.00 0.00 N ATOM 1323 CA LEU A 85 17.100 -9.331 0.908 1.00 0.00 C ATOM 1324 C LEU A 85 18.448 -9.964 0.577 1.00 0.00 C ATOM 1325 O LEU A 85 18.789 -11.028 1.092 1.00 0.00 O ATOM 1326 CB LEU A 85 17.274 -8.281 2.008 1.00 0.00 C ATOM 1327 CG LEU A 85 16.159 -7.242 2.124 1.00 0.00 C ATOM 1328 CD1 LEU A 85 16.358 -6.382 3.362 1.00 0.00 C ATOM 1329 CD2 LEU A 85 16.103 -6.375 0.874 1.00 0.00 C ATOM 0 H LEU A 85 16.475 -10.971 2.057 1.00 0.00 H new ATOM 0 HA LEU A 85 16.715 -8.848 0.010 1.00 0.00 H new ATOM 0 HB2 LEU A 85 17.364 -8.797 2.964 1.00 0.00 H new ATOM 0 HB3 LEU A 85 18.215 -7.758 1.838 1.00 0.00 H new ATOM 0 HG LEU A 85 15.209 -7.767 2.220 1.00 0.00 H new ATOM 0 HD11 LEU A 85 15.555 -5.648 3.428 1.00 0.00 H new ATOM 0 HD12 LEU A 85 16.346 -7.014 4.250 1.00 0.00 H new ATOM 0 HD13 LEU A 85 17.316 -5.866 3.297 1.00 0.00 H new ATOM 0 HD21 LEU A 85 15.303 -5.642 0.975 1.00 0.00 H new ATOM 0 HD22 LEU A 85 17.055 -5.859 0.746 1.00 0.00 H new ATOM 0 HD23 LEU A 85 15.911 -7.003 0.004 1.00 0.00 H new ATOM 1341 N ASP A 86 19.211 -9.300 -0.285 1.00 0.00 N ATOM 1342 CA ASP A 86 20.524 -9.796 -0.683 1.00 0.00 C ATOM 1343 C ASP A 86 21.491 -9.782 0.497 1.00 0.00 C ATOM 1344 O ASP A 86 21.404 -8.923 1.374 1.00 0.00 O ATOM 1345 CB ASP A 86 21.085 -8.952 -1.829 1.00 0.00 C ATOM 1346 CG ASP A 86 20.609 -9.429 -3.186 1.00 0.00 C ATOM 1347 OD1 ASP A 86 19.535 -10.062 -3.249 1.00 0.00 O ATOM 1348 OD2 ASP A 86 21.312 -9.171 -4.186 1.00 0.00 O ATOM 0 H ASP A 86 18.943 -8.418 -0.721 1.00 0.00 H new ATOM 0 HA ASP A 86 20.409 -10.825 -1.023 1.00 0.00 H new ATOM 0 HB2 ASP A 86 20.790 -7.912 -1.689 1.00 0.00 H new ATOM 0 HB3 ASP A 86 22.174 -8.981 -1.798 1.00 0.00 H new ATOM 1353 N PHE A 87 22.410 -10.741 0.512 1.00 0.00 N ATOM 1354 CA PHE A 87 23.393 -10.840 1.585 1.00 0.00 C ATOM 1355 C PHE A 87 24.177 -9.539 1.728 1.00 0.00 C ATOM 1356 O PHE A 87 24.256 -8.965 2.815 1.00 0.00 O ATOM 1357 CB PHE A 87 24.354 -12.001 1.320 1.00 0.00 C ATOM 1358 CG PHE A 87 25.580 -11.975 2.188 1.00 0.00 C ATOM 1359 CD1 PHE A 87 25.466 -11.931 3.568 1.00 0.00 C ATOM 1360 CD2 PHE A 87 26.845 -11.997 1.624 1.00 0.00 C ATOM 1361 CE1 PHE A 87 26.593 -11.905 4.368 1.00 0.00 C ATOM 1362 CE2 PHE A 87 27.975 -11.973 2.419 1.00 0.00 C ATOM 1363 CZ PHE A 87 27.848 -11.928 3.794 1.00 0.00 C ATOM 0 H PHE A 87 22.495 -11.460 -0.206 1.00 0.00 H new ATOM 0 HA PHE A 87 22.858 -11.025 2.517 1.00 0.00 H new ATOM 0 HB2 PHE A 87 23.827 -12.942 1.478 1.00 0.00 H new ATOM 0 HB3 PHE A 87 24.659 -11.978 0.274 1.00 0.00 H new ATOM 0 HD1 PHE A 87 24.487 -11.917 4.023 1.00 0.00 H new ATOM 0 HD2 PHE A 87 26.949 -12.033 0.550 1.00 0.00 H new ATOM 0 HE1 PHE A 87 26.491 -11.867 5.443 1.00 0.00 H new ATOM 0 HE2 PHE A 87 28.955 -11.989 1.966 1.00 0.00 H new ATOM 0 HZ PHE A 87 28.729 -11.911 4.418 1.00 0.00 H new ATOM 1373 N HIS A 88 24.755 -9.079 0.624 1.00 0.00 N ATOM 1374 CA HIS A 88 25.534 -7.845 0.625 1.00 0.00 C ATOM 1375 C HIS A 88 24.700 -6.679 1.146 1.00 0.00 C ATOM 1376 O HIS A 88 25.177 -5.865 1.938 1.00 0.00 O ATOM 1377 CB HIS A 88 26.039 -7.536 -0.784 1.00 0.00 C ATOM 1378 CG HIS A 88 26.243 -6.074 -1.040 1.00 0.00 C ATOM 1379 ND1 HIS A 88 27.368 -5.388 -0.634 1.00 0.00 N ATOM 1380 CD2 HIS A 88 25.457 -5.168 -1.666 1.00 0.00 C ATOM 1381 CE1 HIS A 88 27.265 -4.122 -0.998 1.00 0.00 C ATOM 1382 NE2 HIS A 88 26.115 -3.963 -1.627 1.00 0.00 N ATOM 0 H HIS A 88 24.699 -9.542 -0.283 1.00 0.00 H new ATOM 0 HA HIS A 88 26.389 -7.983 1.287 1.00 0.00 H new ATOM 0 HB2 HIS A 88 26.981 -8.060 -0.946 1.00 0.00 H new ATOM 0 HB3 HIS A 88 25.327 -7.928 -1.510 1.00 0.00 H new ATOM 0 HD2 HIS A 88 24.492 -5.357 -2.113 1.00 0.00 H new ATOM 0 HE1 HIS A 88 27.996 -3.349 -0.813 1.00 0.00 H new ATOM 0 HE2 HIS A 88 25.771 -3.087 -2.020 1.00 0.00 H new ATOM 1390 N THR A 89 23.452 -6.601 0.696 1.00 0.00 N ATOM 1391 CA THR A 89 22.552 -5.533 1.114 1.00 0.00 C ATOM 1392 C THR A 89 22.292 -5.591 2.615 1.00 0.00 C ATOM 1393 O THR A 89 22.257 -4.562 3.290 1.00 0.00 O ATOM 1394 CB THR A 89 21.208 -5.605 0.367 1.00 0.00 C ATOM 1395 OG1 THR A 89 21.435 -5.717 -1.042 1.00 0.00 O ATOM 1396 CG2 THR A 89 20.362 -4.373 0.654 1.00 0.00 C ATOM 0 H THR A 89 23.041 -7.266 0.041 1.00 0.00 H new ATOM 0 HA THR A 89 23.043 -4.591 0.869 1.00 0.00 H new ATOM 0 HB THR A 89 20.670 -6.485 0.718 1.00 0.00 H new ATOM 0 HG1 THR A 89 20.575 -5.748 -1.511 1.00 0.00 H new ATOM 0 HG21 THR A 89 19.417 -4.447 0.115 1.00 0.00 H new ATOM 0 HG22 THR A 89 20.165 -4.308 1.724 1.00 0.00 H new ATOM 0 HG23 THR A 89 20.897 -3.481 0.328 1.00 0.00 H new ATOM 1404 N LYS A 90 22.109 -6.801 3.132 1.00 0.00 N ATOM 1405 CA LYS A 90 21.853 -6.994 4.555 1.00 0.00 C ATOM 1406 C LYS A 90 23.098 -6.686 5.379 1.00 0.00 C ATOM 1407 O LYS A 90 23.020 -6.031 6.417 1.00 0.00 O ATOM 1408 CB LYS A 90 21.394 -8.430 4.821 1.00 0.00 C ATOM 1409 CG LYS A 90 19.889 -8.616 4.727 1.00 0.00 C ATOM 1410 CD LYS A 90 19.526 -10.038 4.333 1.00 0.00 C ATOM 1411 CE LYS A 90 18.163 -10.436 4.877 1.00 0.00 C ATOM 1412 NZ LYS A 90 17.525 -11.499 4.052 1.00 0.00 N ATOM 0 H LYS A 90 22.133 -7.663 2.587 1.00 0.00 H new ATOM 0 HA LYS A 90 21.063 -6.305 4.853 1.00 0.00 H new ATOM 0 HB2 LYS A 90 21.879 -9.096 4.107 1.00 0.00 H new ATOM 0 HB3 LYS A 90 21.727 -8.731 5.814 1.00 0.00 H new ATOM 0 HG2 LYS A 90 19.431 -8.375 5.686 1.00 0.00 H new ATOM 0 HG3 LYS A 90 19.480 -7.919 3.995 1.00 0.00 H new ATOM 0 HD2 LYS A 90 19.525 -10.127 3.247 1.00 0.00 H new ATOM 0 HD3 LYS A 90 20.284 -10.726 4.709 1.00 0.00 H new ATOM 0 HE2 LYS A 90 18.270 -10.788 5.903 1.00 0.00 H new ATOM 0 HE3 LYS A 90 17.514 -9.561 4.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.508 -11.302 3.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 17.963 -11.516 3.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 17.658 -12.422 4.512 1.00 0.00 H new ATOM 1426 N GLU A 91 24.247 -7.163 4.908 1.00 0.00 N ATOM 1427 CA GLU A 91 25.509 -6.937 5.602 1.00 0.00 C ATOM 1428 C GLU A 91 25.909 -5.466 5.540 1.00 0.00 C ATOM 1429 O GLU A 91 26.076 -4.812 6.568 1.00 0.00 O ATOM 1430 CB GLU A 91 26.614 -7.804 4.995 1.00 0.00 C ATOM 1431 CG GLU A 91 27.801 -8.013 5.919 1.00 0.00 C ATOM 1432 CD GLU A 91 27.415 -8.689 7.221 1.00 0.00 C ATOM 1433 OE1 GLU A 91 26.859 -9.807 7.166 1.00 0.00 O ATOM 1434 OE2 GLU A 91 27.668 -8.103 8.293 1.00 0.00 O ATOM 0 H GLU A 91 24.329 -7.708 4.050 1.00 0.00 H new ATOM 0 HA GLU A 91 25.373 -7.215 6.647 1.00 0.00 H new ATOM 0 HB2 GLU A 91 26.197 -8.775 4.728 1.00 0.00 H new ATOM 0 HB3 GLU A 91 26.961 -7.341 4.071 1.00 0.00 H new ATOM 0 HG2 GLU A 91 28.552 -8.617 5.409 1.00 0.00 H new ATOM 0 HG3 GLU A 91 28.261 -7.049 6.137 1.00 0.00 H new ATOM 1441 N VAL A 92 26.062 -4.952 4.322 1.00 0.00 N ATOM 1442 CA VAL A 92 26.441 -3.559 4.124 1.00 0.00 C ATOM 1443 C VAL A 92 25.678 -2.640 5.070 1.00 0.00 C ATOM 1444 O VAL A 92 26.264 -1.771 5.715 1.00 0.00 O ATOM 1445 CB VAL A 92 26.188 -3.109 2.672 1.00 0.00 C ATOM 1446 CG1 VAL A 92 24.755 -2.628 2.505 1.00 0.00 C ATOM 1447 CG2 VAL A 92 27.174 -2.023 2.270 1.00 0.00 C ATOM 0 H VAL A 92 25.929 -5.480 3.459 1.00 0.00 H new ATOM 0 HA VAL A 92 27.508 -3.489 4.338 1.00 0.00 H new ATOM 0 HB VAL A 92 26.338 -3.965 2.014 1.00 0.00 H new ATOM 0 HG11 VAL A 92 24.594 -2.314 1.474 1.00 0.00 H new ATOM 0 HG12 VAL A 92 24.068 -3.439 2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 92 24.574 -1.786 3.173 1.00 0.00 H new ATOM 0 HG21 VAL A 92 26.980 -1.718 1.242 1.00 0.00 H new ATOM 0 HG22 VAL A 92 27.059 -1.164 2.931 1.00 0.00 H new ATOM 0 HG23 VAL A 92 28.191 -2.408 2.349 1.00 0.00 H new ATOM 1457 N ILE A 93 24.366 -2.840 5.147 1.00 0.00 N ATOM 1458 CA ILE A 93 23.521 -2.030 6.016 1.00 0.00 C ATOM 1459 C ILE A 93 23.879 -2.240 7.483 1.00 0.00 C ATOM 1460 O ILE A 93 23.944 -1.288 8.261 1.00 0.00 O ATOM 1461 CB ILE A 93 22.030 -2.354 5.812 1.00 0.00 C ATOM 1462 CG1 ILE A 93 21.585 -1.951 4.404 1.00 0.00 C ATOM 1463 CG2 ILE A 93 21.185 -1.648 6.863 1.00 0.00 C ATOM 1464 CD1 ILE A 93 20.182 -2.399 4.062 1.00 0.00 C ATOM 0 H ILE A 93 23.866 -3.555 4.619 1.00 0.00 H new ATOM 0 HA ILE A 93 23.699 -0.989 5.747 1.00 0.00 H new ATOM 0 HB ILE A 93 21.889 -3.429 5.923 1.00 0.00 H new ATOM 0 HG12 ILE A 93 21.645 -0.867 4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 93 22.280 -2.373 3.678 1.00 0.00 H new ATOM 0 HG21 ILE A 93 20.133 -1.887 6.705 1.00 0.00 H new ATOM 0 HG22 ILE A 93 21.487 -1.980 7.856 1.00 0.00 H new ATOM 0 HG23 ILE A 93 21.328 -0.571 6.781 1.00 0.00 H new ATOM 0 HD11 ILE A 93 19.934 -2.079 3.050 1.00 0.00 H new ATOM 0 HD12 ILE A 93 20.122 -3.486 4.124 1.00 0.00 H new ATOM 0 HD13 ILE A 93 19.477 -1.956 4.765 1.00 0.00 H new ATOM 1476 N THR A 94 24.114 -3.495 7.855 1.00 0.00 N ATOM 1477 CA THR A 94 24.467 -3.831 9.229 1.00 0.00 C ATOM 1478 C THR A 94 25.642 -2.991 9.716 1.00 0.00 C ATOM 1479 O THR A 94 25.649 -2.516 10.851 1.00 0.00 O ATOM 1480 CB THR A 94 24.825 -5.323 9.368 1.00 0.00 C ATOM 1481 OG1 THR A 94 23.707 -6.132 8.987 1.00 0.00 O ATOM 1482 CG2 THR A 94 25.231 -5.651 10.796 1.00 0.00 C ATOM 0 H THR A 94 24.066 -4.295 7.224 1.00 0.00 H new ATOM 0 HA THR A 94 23.592 -3.616 9.842 1.00 0.00 H new ATOM 0 HB THR A 94 25.668 -5.535 8.710 1.00 0.00 H new ATOM 0 HG1 THR A 94 23.615 -6.124 8.011 1.00 0.00 H new ATOM 0 HG21 THR A 94 25.479 -6.710 10.870 1.00 0.00 H new ATOM 0 HG22 THR A 94 26.100 -5.054 11.073 1.00 0.00 H new ATOM 0 HG23 THR A 94 24.405 -5.424 11.470 1.00 0.00 H new ATOM 1490 N ASN A 95 26.634 -2.812 8.850 1.00 0.00 N ATOM 1491 CA ASN A 95 27.816 -2.027 9.194 1.00 0.00 C ATOM 1492 C ASN A 95 27.584 -0.545 8.916 1.00 0.00 C ATOM 1493 O ASN A 95 28.074 0.317 9.645 1.00 0.00 O ATOM 1494 CB ASN A 95 29.029 -2.522 8.404 1.00 0.00 C ATOM 1495 CG ASN A 95 29.257 -4.013 8.569 1.00 0.00 C ATOM 1496 OD1 ASN A 95 29.587 -4.484 9.658 1.00 0.00 O ATOM 1497 ND2 ASN A 95 29.085 -4.761 7.486 1.00 0.00 N ATOM 0 H ASN A 95 26.644 -3.199 7.906 1.00 0.00 H new ATOM 0 HA ASN A 95 28.008 -2.153 10.259 1.00 0.00 H new ATOM 0 HB2 ASN A 95 28.889 -2.293 7.347 1.00 0.00 H new ATOM 0 HB3 ASN A 95 29.918 -1.983 8.732 1.00 0.00 H new ATOM 0 HD21 ASN A 95 29.227 -5.770 7.535 1.00 0.00 H new ATOM 0 HD22 ASN A 95 28.811 -4.327 6.605 1.00 0.00 H new ATOM 1504 N SER A 96 26.834 -0.258 7.857 1.00 0.00 N ATOM 1505 CA SER A 96 26.541 1.120 7.481 1.00 0.00 C ATOM 1506 C SER A 96 25.250 1.599 8.139 1.00 0.00 C ATOM 1507 O SER A 96 24.652 2.587 7.711 1.00 0.00 O ATOM 1508 CB SER A 96 26.426 1.243 5.960 1.00 0.00 C ATOM 1509 OG SER A 96 26.555 2.592 5.546 1.00 0.00 O ATOM 0 H SER A 96 26.419 -0.960 7.245 1.00 0.00 H new ATOM 0 HA SER A 96 27.362 1.748 7.828 1.00 0.00 H new ATOM 0 HB2 SER A 96 27.197 0.638 5.484 1.00 0.00 H new ATOM 0 HB3 SER A 96 25.464 0.849 5.632 1.00 0.00 H new ATOM 0 HG SER A 96 25.961 3.157 6.083 1.00 0.00 H new ATOM 1515 N ILE A 97 24.827 0.892 9.181 1.00 0.00 N ATOM 1516 CA ILE A 97 23.609 1.246 9.899 1.00 0.00 C ATOM 1517 C ILE A 97 23.784 2.547 10.675 1.00 0.00 C ATOM 1518 O ILE A 97 22.822 3.101 11.207 1.00 0.00 O ATOM 1519 CB ILE A 97 23.188 0.132 10.877 1.00 0.00 C ATOM 1520 CG1 ILE A 97 21.749 0.353 11.347 1.00 0.00 C ATOM 1521 CG2 ILE A 97 24.138 0.082 12.064 1.00 0.00 C ATOM 1522 CD1 ILE A 97 20.721 0.171 10.254 1.00 0.00 C ATOM 0 H ILE A 97 25.309 0.071 9.547 1.00 0.00 H new ATOM 0 HA ILE A 97 22.829 1.376 9.149 1.00 0.00 H new ATOM 0 HB ILE A 97 23.237 -0.825 10.358 1.00 0.00 H new ATOM 0 HG12 ILE A 97 21.530 -0.340 12.159 1.00 0.00 H new ATOM 0 HG13 ILE A 97 21.659 1.360 11.755 1.00 0.00 H new ATOM 0 HG21 ILE A 97 23.827 -0.710 12.746 1.00 0.00 H new ATOM 0 HG22 ILE A 97 25.150 -0.119 11.712 1.00 0.00 H new ATOM 0 HG23 ILE A 97 24.119 1.039 12.586 1.00 0.00 H new ATOM 0 HD11 ILE A 97 19.724 0.343 10.660 1.00 0.00 H new ATOM 0 HD12 ILE A 97 20.914 0.882 9.451 1.00 0.00 H new ATOM 0 HD13 ILE A 97 20.783 -0.844 9.862 1.00 0.00 H new ATOM 1534 N THR A 98 25.021 3.032 10.734 1.00 0.00 N ATOM 1535 CA THR A 98 25.324 4.268 11.443 1.00 0.00 C ATOM 1536 C THR A 98 25.607 5.405 10.469 1.00 0.00 C ATOM 1537 O THR A 98 25.603 6.575 10.849 1.00 0.00 O ATOM 1538 CB THR A 98 26.536 4.096 12.379 1.00 0.00 C ATOM 1539 OG1 THR A 98 26.816 5.330 13.049 1.00 0.00 O ATOM 1540 CG2 THR A 98 27.762 3.645 11.601 1.00 0.00 C ATOM 0 H THR A 98 25.829 2.587 10.299 1.00 0.00 H new ATOM 0 HA THR A 98 24.445 4.514 12.039 1.00 0.00 H new ATOM 0 HB THR A 98 26.292 3.330 13.116 1.00 0.00 H new ATOM 0 HG1 THR A 98 26.479 6.077 12.512 1.00 0.00 H new ATOM 0 HG21 THR A 98 28.604 3.531 12.283 1.00 0.00 H new ATOM 0 HG22 THR A 98 27.555 2.691 11.117 1.00 0.00 H new ATOM 0 HG23 THR A 98 28.007 4.390 10.844 1.00 0.00 H new ATOM 1548 N GLN A 99 25.852 5.053 9.210 1.00 0.00 N ATOM 1549 CA GLN A 99 26.137 6.047 8.182 1.00 0.00 C ATOM 1550 C GLN A 99 25.080 6.011 7.083 1.00 0.00 C ATOM 1551 O GLN A 99 25.335 6.362 5.931 1.00 0.00 O ATOM 1552 CB GLN A 99 27.523 5.806 7.581 1.00 0.00 C ATOM 1553 CG GLN A 99 28.661 6.053 8.558 1.00 0.00 C ATOM 1554 CD GLN A 99 29.036 7.520 8.658 1.00 0.00 C ATOM 1555 OE1 GLN A 99 28.887 8.139 9.711 1.00 0.00 O ATOM 1556 NE2 GLN A 99 29.524 8.082 7.558 1.00 0.00 N ATOM 0 H GLN A 99 25.859 4.088 8.878 1.00 0.00 H new ATOM 0 HA GLN A 99 26.117 7.032 8.648 1.00 0.00 H new ATOM 0 HB2 GLN A 99 27.580 4.779 7.222 1.00 0.00 H new ATOM 0 HB3 GLN A 99 27.652 6.455 6.714 1.00 0.00 H new ATOM 0 HG2 GLN A 99 28.374 5.687 9.544 1.00 0.00 H new ATOM 0 HG3 GLN A 99 29.534 5.479 8.246 1.00 0.00 H new ATOM 0 HE21 GLN A 99 29.630 7.530 6.707 1.00 0.00 H new ATOM 0 HE22 GLN A 99 29.793 9.066 7.564 1.00 0.00 H new ATOM 1565 N PRO A 100 23.864 5.576 7.445 1.00 0.00 N ATOM 1566 CA PRO A 100 22.743 5.485 6.503 1.00 0.00 C ATOM 1567 C PRO A 100 22.233 6.856 6.074 1.00 0.00 C ATOM 1568 O PRO A 100 22.302 7.822 6.835 1.00 0.00 O ATOM 1569 CB PRO A 100 21.670 4.740 7.302 1.00 0.00 C ATOM 1570 CG PRO A 100 21.991 5.029 8.728 1.00 0.00 C ATOM 1571 CD PRO A 100 23.488 5.142 8.801 1.00 0.00 C ATOM 0 HA PRO A 100 23.028 4.986 5.576 1.00 0.00 H new ATOM 0 HB2 PRO A 100 20.670 5.088 7.043 1.00 0.00 H new ATOM 0 HB3 PRO A 100 21.697 3.669 7.099 1.00 0.00 H new ATOM 0 HG2 PRO A 100 21.514 5.952 9.056 1.00 0.00 H new ATOM 0 HG3 PRO A 100 21.628 4.234 9.379 1.00 0.00 H new ATOM 0 HD2 PRO A 100 23.800 5.864 9.555 1.00 0.00 H new ATOM 0 HD3 PRO A 100 23.951 4.190 9.061 1.00 0.00 H new ATOM 1579 N THR A 101 21.720 6.935 4.850 1.00 0.00 N ATOM 1580 CA THR A 101 21.199 8.188 4.318 1.00 0.00 C ATOM 1581 C THR A 101 19.847 7.980 3.648 1.00 0.00 C ATOM 1582 O THR A 101 19.346 6.857 3.570 1.00 0.00 O ATOM 1583 CB THR A 101 22.172 8.815 3.303 1.00 0.00 C ATOM 1584 OG1 THR A 101 22.499 7.862 2.285 1.00 0.00 O ATOM 1585 CG2 THR A 101 23.445 9.286 3.991 1.00 0.00 C ATOM 0 H THR A 101 21.654 6.145 4.208 1.00 0.00 H new ATOM 0 HA THR A 101 21.082 8.866 5.163 1.00 0.00 H new ATOM 0 HB THR A 101 21.683 9.677 2.850 1.00 0.00 H new ATOM 0 HG1 THR A 101 23.451 7.935 2.062 1.00 0.00 H new ATOM 0 HG21 THR A 101 24.116 9.725 3.253 1.00 0.00 H new ATOM 0 HG22 THR A 101 23.196 10.033 4.745 1.00 0.00 H new ATOM 0 HG23 THR A 101 23.936 8.438 4.469 1.00 0.00 H new ATOM 1593 N LEU A 102 19.258 9.069 3.165 1.00 0.00 N ATOM 1594 CA LEU A 102 17.962 9.006 2.499 1.00 0.00 C ATOM 1595 C LEU A 102 18.062 8.243 1.183 1.00 0.00 C ATOM 1596 O LEU A 102 17.086 7.651 0.720 1.00 0.00 O ATOM 1597 CB LEU A 102 17.427 10.416 2.245 1.00 0.00 C ATOM 1598 CG LEU A 102 16.959 11.189 3.479 1.00 0.00 C ATOM 1599 CD1 LEU A 102 16.709 12.648 3.131 1.00 0.00 C ATOM 1600 CD2 LEU A 102 15.704 10.555 4.060 1.00 0.00 C ATOM 0 H LEU A 102 19.658 10.006 3.222 1.00 0.00 H new ATOM 0 HA LEU A 102 17.271 8.475 3.154 1.00 0.00 H new ATOM 0 HB2 LEU A 102 18.207 10.996 1.752 1.00 0.00 H new ATOM 0 HB3 LEU A 102 16.593 10.346 1.547 1.00 0.00 H new ATOM 0 HG LEU A 102 17.746 11.146 4.232 1.00 0.00 H new ATOM 0 HD11 LEU A 102 16.377 13.183 4.021 1.00 0.00 H new ATOM 0 HD12 LEU A 102 17.631 13.097 2.761 1.00 0.00 H new ATOM 0 HD13 LEU A 102 15.940 12.712 2.361 1.00 0.00 H new ATOM 0 HD21 LEU A 102 15.385 11.118 4.937 1.00 0.00 H new ATOM 0 HD22 LEU A 102 14.911 10.567 3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 102 15.916 9.525 4.347 1.00 0.00 H new ATOM 1612 N HIS A 103 19.249 8.258 0.584 1.00 0.00 N ATOM 1613 CA HIS A 103 19.478 7.565 -0.679 1.00 0.00 C ATOM 1614 C HIS A 103 20.184 6.234 -0.447 1.00 0.00 C ATOM 1615 O HIS A 103 20.757 5.655 -1.371 1.00 0.00 O ATOM 1616 CB HIS A 103 20.307 8.439 -1.621 1.00 0.00 C ATOM 1617 CG HIS A 103 21.669 8.765 -1.091 1.00 0.00 C ATOM 1618 ND1 HIS A 103 22.724 7.878 -1.129 1.00 0.00 N ATOM 1619 CD2 HIS A 103 22.147 9.891 -0.510 1.00 0.00 C ATOM 1620 CE1 HIS A 103 23.791 8.442 -0.593 1.00 0.00 C ATOM 1621 NE2 HIS A 103 23.468 9.664 -0.210 1.00 0.00 N ATOM 0 H HIS A 103 20.067 8.743 0.953 1.00 0.00 H new ATOM 0 HA HIS A 103 18.509 7.367 -1.138 1.00 0.00 H new ATOM 0 HB2 HIS A 103 20.411 7.929 -2.579 1.00 0.00 H new ATOM 0 HB3 HIS A 103 19.768 9.367 -1.811 1.00 0.00 H new ATOM 0 HD1 HIS A 103 22.686 6.933 -1.512 1.00 0.00 H new ATOM 0 HD2 HIS A 103 21.593 10.798 -0.318 1.00 0.00 H new ATOM 0 HE1 HIS A 103 24.762 7.982 -0.486 1.00 0.00 H new ATOM 1629 N SER A 104 20.140 5.753 0.791 1.00 0.00 N ATOM 1630 CA SER A 104 20.779 4.492 1.146 1.00 0.00 C ATOM 1631 C SER A 104 19.816 3.323 0.959 1.00 0.00 C ATOM 1632 O SER A 104 20.017 2.469 0.095 1.00 0.00 O ATOM 1633 CB SER A 104 21.273 4.534 2.593 1.00 0.00 C ATOM 1634 OG SER A 104 22.530 5.184 2.685 1.00 0.00 O ATOM 0 H SER A 104 19.668 6.218 1.566 1.00 0.00 H new ATOM 0 HA SER A 104 21.632 4.347 0.483 1.00 0.00 H new ATOM 0 HB2 SER A 104 20.544 5.055 3.214 1.00 0.00 H new ATOM 0 HB3 SER A 104 21.356 3.519 2.982 1.00 0.00 H new ATOM 0 HG SER A 104 22.425 6.132 2.462 1.00 0.00 H new ATOM 1640 N PHE A 105 18.768 3.292 1.776 1.00 0.00 N ATOM 1641 CA PHE A 105 17.773 2.229 1.703 1.00 0.00 C ATOM 1642 C PHE A 105 17.328 1.998 0.262 1.00 0.00 C ATOM 1643 O PHE A 105 17.086 0.864 -0.151 1.00 0.00 O ATOM 1644 CB PHE A 105 16.563 2.573 2.574 1.00 0.00 C ATOM 1645 CG PHE A 105 16.694 2.106 3.995 1.00 0.00 C ATOM 1646 CD1 PHE A 105 16.873 0.761 4.282 1.00 0.00 C ATOM 1647 CD2 PHE A 105 16.640 3.009 5.043 1.00 0.00 C ATOM 1648 CE1 PHE A 105 16.993 0.329 5.590 1.00 0.00 C ATOM 1649 CE2 PHE A 105 16.761 2.583 6.353 1.00 0.00 C ATOM 1650 CZ PHE A 105 16.938 1.240 6.626 1.00 0.00 C ATOM 0 H PHE A 105 18.586 3.991 2.496 1.00 0.00 H new ATOM 0 HA PHE A 105 18.230 1.312 2.075 1.00 0.00 H new ATOM 0 HB2 PHE A 105 16.416 3.653 2.567 1.00 0.00 H new ATOM 0 HB3 PHE A 105 15.671 2.127 2.134 1.00 0.00 H new ATOM 0 HD1 PHE A 105 16.919 0.044 3.476 1.00 0.00 H new ATOM 0 HD2 PHE A 105 16.502 4.060 4.835 1.00 0.00 H new ATOM 0 HE1 PHE A 105 17.130 -0.721 5.801 1.00 0.00 H new ATOM 0 HE2 PHE A 105 16.717 3.298 7.161 1.00 0.00 H new ATOM 0 HZ PHE A 105 17.033 0.904 7.648 1.00 0.00 H new ATOM 1660 N ASP A 106 17.222 3.082 -0.499 1.00 0.00 N ATOM 1661 CA ASP A 106 16.807 3.000 -1.894 1.00 0.00 C ATOM 1662 C ASP A 106 17.283 1.695 -2.527 1.00 0.00 C ATOM 1663 O ASP A 106 16.523 1.013 -3.212 1.00 0.00 O ATOM 1664 CB ASP A 106 17.352 4.192 -2.682 1.00 0.00 C ATOM 1665 CG ASP A 106 16.645 4.380 -4.009 1.00 0.00 C ATOM 1666 OD1 ASP A 106 15.610 5.079 -4.036 1.00 0.00 O ATOM 1667 OD2 ASP A 106 17.125 3.828 -5.022 1.00 0.00 O ATOM 0 H ASP A 106 17.418 4.028 -0.173 1.00 0.00 H new ATOM 0 HA ASP A 106 15.718 3.022 -1.925 1.00 0.00 H new ATOM 0 HB2 ASP A 106 17.245 5.098 -2.085 1.00 0.00 H new ATOM 0 HB3 ASP A 106 18.418 4.050 -2.858 1.00 0.00 H new ATOM 1672 N ALA A 107 18.546 1.357 -2.291 1.00 0.00 N ATOM 1673 CA ALA A 107 19.123 0.134 -2.838 1.00 0.00 C ATOM 1674 C ALA A 107 18.306 -1.087 -2.432 1.00 0.00 C ATOM 1675 O ALA A 107 17.845 -1.848 -3.282 1.00 0.00 O ATOM 1676 CB ALA A 107 20.566 -0.017 -2.380 1.00 0.00 C ATOM 0 H ALA A 107 19.189 1.911 -1.726 1.00 0.00 H new ATOM 0 HA ALA A 107 19.104 0.205 -3.925 1.00 0.00 H new ATOM 0 HB1 ALA A 107 20.985 -0.934 -2.795 1.00 0.00 H new ATOM 0 HB2 ALA A 107 21.149 0.837 -2.725 1.00 0.00 H new ATOM 0 HB3 ALA A 107 20.599 -0.063 -1.291 1.00 0.00 H new ATOM 1682 N ALA A 108 18.132 -1.270 -1.127 1.00 0.00 N ATOM 1683 CA ALA A 108 17.369 -2.399 -0.609 1.00 0.00 C ATOM 1684 C ALA A 108 15.928 -2.364 -1.109 1.00 0.00 C ATOM 1685 O ALA A 108 15.359 -3.397 -1.459 1.00 0.00 O ATOM 1686 CB ALA A 108 17.401 -2.405 0.912 1.00 0.00 C ATOM 0 H ALA A 108 18.509 -0.651 -0.409 1.00 0.00 H new ATOM 0 HA ALA A 108 17.831 -3.316 -0.975 1.00 0.00 H new ATOM 0 HB1 ALA A 108 16.827 -3.253 1.285 1.00 0.00 H new ATOM 0 HB2 ALA A 108 18.433 -2.486 1.254 1.00 0.00 H new ATOM 0 HB3 ALA A 108 16.966 -1.479 1.289 1.00 0.00 H new ATOM 1692 N GLN A 109 15.346 -1.170 -1.139 1.00 0.00 N ATOM 1693 CA GLN A 109 13.971 -1.002 -1.595 1.00 0.00 C ATOM 1694 C GLN A 109 13.780 -1.607 -2.982 1.00 0.00 C ATOM 1695 O GLN A 109 12.783 -2.281 -3.244 1.00 0.00 O ATOM 1696 CB GLN A 109 13.596 0.481 -1.616 1.00 0.00 C ATOM 1697 CG GLN A 109 12.155 0.738 -2.023 1.00 0.00 C ATOM 1698 CD GLN A 109 11.805 2.213 -2.033 1.00 0.00 C ATOM 1699 OE1 GLN A 109 12.684 3.070 -2.121 1.00 0.00 O ATOM 1700 NE2 GLN A 109 10.516 2.517 -1.943 1.00 0.00 N ATOM 0 H GLN A 109 15.805 -0.305 -0.853 1.00 0.00 H new ATOM 0 HA GLN A 109 13.317 -1.525 -0.897 1.00 0.00 H new ATOM 0 HB2 GLN A 109 13.766 0.904 -0.626 1.00 0.00 H new ATOM 0 HB3 GLN A 109 14.258 1.005 -2.305 1.00 0.00 H new ATOM 0 HG2 GLN A 109 11.982 0.321 -3.015 1.00 0.00 H new ATOM 0 HG3 GLN A 109 11.489 0.215 -1.337 1.00 0.00 H new ATOM 0 HE21 GLN A 109 9.821 1.774 -1.872 1.00 0.00 H new ATOM 0 HE22 GLN A 109 10.221 3.493 -1.945 1.00 0.00 H new ATOM 1709 N SER A 110 14.742 -1.363 -3.866 1.00 0.00 N ATOM 1710 CA SER A 110 14.676 -1.880 -5.228 1.00 0.00 C ATOM 1711 C SER A 110 14.620 -3.405 -5.227 1.00 0.00 C ATOM 1712 O SER A 110 13.911 -4.011 -6.032 1.00 0.00 O ATOM 1713 CB SER A 110 15.885 -1.404 -6.036 1.00 0.00 C ATOM 1714 OG SER A 110 15.617 -1.442 -7.427 1.00 0.00 O ATOM 0 H SER A 110 15.576 -0.811 -3.664 1.00 0.00 H new ATOM 0 HA SER A 110 13.766 -1.500 -5.691 1.00 0.00 H new ATOM 0 HB2 SER A 110 16.146 -0.388 -5.741 1.00 0.00 H new ATOM 0 HB3 SER A 110 16.747 -2.033 -5.811 1.00 0.00 H new ATOM 0 HG SER A 110 16.405 -1.132 -7.921 1.00 0.00 H new ATOM 1720 N ARG A 111 15.372 -4.019 -4.320 1.00 0.00 N ATOM 1721 CA ARG A 111 15.410 -5.472 -4.215 1.00 0.00 C ATOM 1722 C ARG A 111 14.013 -6.035 -3.971 1.00 0.00 C ATOM 1723 O ARG A 111 13.500 -6.820 -4.769 1.00 0.00 O ATOM 1724 CB ARG A 111 16.348 -5.899 -3.084 1.00 0.00 C ATOM 1725 CG ARG A 111 16.305 -7.388 -2.787 1.00 0.00 C ATOM 1726 CD ARG A 111 17.113 -8.183 -3.802 1.00 0.00 C ATOM 1727 NE ARG A 111 16.700 -9.583 -3.854 1.00 0.00 N ATOM 1728 CZ ARG A 111 16.173 -10.154 -4.931 1.00 0.00 C ATOM 1729 NH1 ARG A 111 15.995 -9.449 -6.040 1.00 0.00 N ATOM 1730 NH2 ARG A 111 15.823 -11.434 -4.901 1.00 0.00 N ATOM 0 H ARG A 111 15.964 -3.532 -3.647 1.00 0.00 H new ATOM 0 HA ARG A 111 15.785 -5.870 -5.158 1.00 0.00 H new ATOM 0 HB2 ARG A 111 17.369 -5.618 -3.344 1.00 0.00 H new ATOM 0 HB3 ARG A 111 16.087 -5.349 -2.180 1.00 0.00 H new ATOM 0 HG2 ARG A 111 16.695 -7.572 -1.786 1.00 0.00 H new ATOM 0 HG3 ARG A 111 15.271 -7.732 -2.794 1.00 0.00 H new ATOM 0 HD2 ARG A 111 16.998 -7.734 -4.789 1.00 0.00 H new ATOM 0 HD3 ARG A 111 18.171 -8.126 -3.547 1.00 0.00 H new ATOM 0 HE ARG A 111 16.823 -10.153 -3.017 1.00 0.00 H new ATOM 0 HH11 ARG A 111 16.263 -8.465 -6.068 1.00 0.00 H new ATOM 0 HH12 ARG A 111 15.590 -9.891 -6.866 1.00 0.00 H new ATOM 0 HH21 ARG A 111 15.959 -11.980 -4.050 1.00 0.00 H new ATOM 0 HH22 ARG A 111 15.418 -11.872 -5.729 1.00 0.00 H new ATOM 1744 N VAL A 112 13.402 -5.631 -2.861 1.00 0.00 N ATOM 1745 CA VAL A 112 12.065 -6.094 -2.511 1.00 0.00 C ATOM 1746 C VAL A 112 11.043 -5.664 -3.558 1.00 0.00 C ATOM 1747 O VAL A 112 10.282 -6.485 -4.072 1.00 0.00 O ATOM 1748 CB VAL A 112 11.628 -5.561 -1.134 1.00 0.00 C ATOM 1749 CG1 VAL A 112 10.209 -6.004 -0.815 1.00 0.00 C ATOM 1750 CG2 VAL A 112 12.595 -6.022 -0.054 1.00 0.00 C ATOM 0 H VAL A 112 13.813 -4.983 -2.189 1.00 0.00 H new ATOM 0 HA VAL A 112 12.107 -7.183 -2.474 1.00 0.00 H new ATOM 0 HB VAL A 112 11.644 -4.472 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 112 9.918 -5.618 0.162 1.00 0.00 H new ATOM 0 HG12 VAL A 112 9.528 -5.620 -1.575 1.00 0.00 H new ATOM 0 HG13 VAL A 112 10.162 -7.093 -0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 112 12.271 -5.636 0.913 1.00 0.00 H new ATOM 0 HG22 VAL A 112 12.613 -7.111 -0.023 1.00 0.00 H new ATOM 0 HG23 VAL A 112 13.595 -5.649 -0.277 1.00 0.00 H new ATOM 1760 N TYR A 113 11.033 -4.373 -3.871 1.00 0.00 N ATOM 1761 CA TYR A 113 10.103 -3.833 -4.855 1.00 0.00 C ATOM 1762 C TYR A 113 9.965 -4.773 -6.048 1.00 0.00 C ATOM 1763 O TYR A 113 8.857 -5.127 -6.448 1.00 0.00 O ATOM 1764 CB TYR A 113 10.572 -2.455 -5.329 1.00 0.00 C ATOM 1765 CG TYR A 113 9.870 -1.973 -6.577 1.00 0.00 C ATOM 1766 CD1 TYR A 113 8.584 -1.452 -6.519 1.00 0.00 C ATOM 1767 CD2 TYR A 113 10.493 -2.040 -7.818 1.00 0.00 C ATOM 1768 CE1 TYR A 113 7.938 -1.011 -7.658 1.00 0.00 C ATOM 1769 CE2 TYR A 113 9.857 -1.600 -8.963 1.00 0.00 C ATOM 1770 CZ TYR A 113 8.579 -1.087 -8.877 1.00 0.00 C ATOM 1771 OH TYR A 113 7.941 -0.648 -10.015 1.00 0.00 O ATOM 0 H TYR A 113 11.658 -3.681 -3.458 1.00 0.00 H new ATOM 0 HA TYR A 113 9.128 -3.734 -4.379 1.00 0.00 H new ATOM 0 HB2 TYR A 113 10.412 -1.731 -4.530 1.00 0.00 H new ATOM 0 HB3 TYR A 113 11.645 -2.490 -5.517 1.00 0.00 H new ATOM 0 HD1 TYR A 113 8.080 -1.390 -5.566 1.00 0.00 H new ATOM 0 HD2 TYR A 113 11.492 -2.443 -7.888 1.00 0.00 H new ATOM 0 HE1 TYR A 113 6.938 -0.609 -7.594 1.00 0.00 H new ATOM 0 HE2 TYR A 113 10.357 -1.657 -9.919 1.00 0.00 H new ATOM 0 HH TYR A 113 7.747 -1.412 -10.597 1.00 0.00 H new ATOM 1781 N GLN A 114 11.101 -5.173 -6.612 1.00 0.00 N ATOM 1782 CA GLN A 114 11.107 -6.073 -7.760 1.00 0.00 C ATOM 1783 C GLN A 114 10.572 -7.448 -7.376 1.00 0.00 C ATOM 1784 O GLN A 114 9.613 -7.941 -7.970 1.00 0.00 O ATOM 1785 CB GLN A 114 12.524 -6.202 -8.324 1.00 0.00 C ATOM 1786 CG GLN A 114 12.967 -4.997 -9.138 1.00 0.00 C ATOM 1787 CD GLN A 114 12.200 -4.858 -10.439 1.00 0.00 C ATOM 1788 OE1 GLN A 114 11.584 -3.825 -10.702 1.00 0.00 O ATOM 1789 NE2 GLN A 114 12.236 -5.900 -11.261 1.00 0.00 N ATOM 0 H GLN A 114 12.027 -4.889 -6.293 1.00 0.00 H new ATOM 0 HA GLN A 114 10.455 -5.651 -8.525 1.00 0.00 H new ATOM 0 HB2 GLN A 114 13.222 -6.350 -7.500 1.00 0.00 H new ATOM 0 HB3 GLN A 114 12.577 -7.093 -8.950 1.00 0.00 H new ATOM 0 HG2 GLN A 114 12.834 -4.093 -8.544 1.00 0.00 H new ATOM 0 HG3 GLN A 114 14.032 -5.082 -9.355 1.00 0.00 H new ATOM 0 HE21 GLN A 114 12.760 -6.736 -11.002 1.00 0.00 H new ATOM 0 HE22 GLN A 114 11.740 -5.864 -12.152 1.00 0.00 H new ATOM 1798 N LEU A 115 11.200 -8.064 -6.380 1.00 0.00 N ATOM 1799 CA LEU A 115 10.786 -9.385 -5.917 1.00 0.00 C ATOM 1800 C LEU A 115 9.272 -9.543 -6.002 1.00 0.00 C ATOM 1801 O LEU A 115 8.770 -10.518 -6.562 1.00 0.00 O ATOM 1802 CB LEU A 115 11.254 -9.612 -4.479 1.00 0.00 C ATOM 1803 CG LEU A 115 12.621 -10.278 -4.314 1.00 0.00 C ATOM 1804 CD1 LEU A 115 13.215 -9.948 -2.953 1.00 0.00 C ATOM 1805 CD2 LEU A 115 12.505 -11.784 -4.497 1.00 0.00 C ATOM 0 H LEU A 115 11.996 -7.671 -5.878 1.00 0.00 H new ATOM 0 HA LEU A 115 11.247 -10.131 -6.565 1.00 0.00 H new ATOM 0 HB2 LEU A 115 11.278 -8.649 -3.970 1.00 0.00 H new ATOM 0 HB3 LEU A 115 10.510 -10.224 -3.969 1.00 0.00 H new ATOM 0 HG LEU A 115 13.289 -9.889 -5.082 1.00 0.00 H new ATOM 0 HD11 LEU A 115 14.187 -10.430 -2.854 1.00 0.00 H new ATOM 0 HD12 LEU A 115 13.334 -8.869 -2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 115 12.549 -10.308 -2.169 1.00 0.00 H new ATOM 0 HD21 LEU A 115 13.487 -12.242 -4.376 1.00 0.00 H new ATOM 0 HD22 LEU A 115 11.821 -12.190 -3.751 1.00 0.00 H new ATOM 0 HD23 LEU A 115 12.124 -12.001 -5.495 1.00 0.00 H new ATOM 1817 N MET A 116 8.549 -8.577 -5.444 1.00 0.00 N ATOM 1818 CA MET A 116 7.091 -8.608 -5.460 1.00 0.00 C ATOM 1819 C MET A 116 6.560 -8.457 -6.882 1.00 0.00 C ATOM 1820 O MET A 116 5.901 -9.355 -7.406 1.00 0.00 O ATOM 1821 CB MET A 116 6.526 -7.497 -4.573 1.00 0.00 C ATOM 1822 CG MET A 116 6.920 -7.628 -3.111 1.00 0.00 C ATOM 1823 SD MET A 116 6.406 -6.210 -2.123 1.00 0.00 S ATOM 1824 CE MET A 116 7.342 -4.897 -2.903 1.00 0.00 C ATOM 0 H MET A 116 8.949 -7.764 -4.976 1.00 0.00 H new ATOM 0 HA MET A 116 6.769 -9.574 -5.070 1.00 0.00 H new ATOM 0 HB2 MET A 116 6.870 -6.533 -4.949 1.00 0.00 H new ATOM 0 HB3 MET A 116 5.439 -7.500 -4.650 1.00 0.00 H new ATOM 0 HG2 MET A 116 6.475 -8.534 -2.699 1.00 0.00 H new ATOM 0 HG3 MET A 116 8.002 -7.743 -3.039 1.00 0.00 H new ATOM 0 HE1 MET A 116 7.784 -4.261 -2.137 1.00 0.00 H new ATOM 0 HE2 MET A 116 8.133 -5.329 -3.517 1.00 0.00 H new ATOM 0 HE3 MET A 116 6.679 -4.302 -3.531 1.00 0.00 H new ATOM 1834 N GLU A 117 6.852 -7.318 -7.502 1.00 0.00 N ATOM 1835 CA GLU A 117 6.402 -7.051 -8.863 1.00 0.00 C ATOM 1836 C GLU A 117 6.513 -8.304 -9.727 1.00 0.00 C ATOM 1837 O GLU A 117 5.765 -8.473 -10.690 1.00 0.00 O ATOM 1838 CB GLU A 117 7.221 -5.917 -9.482 1.00 0.00 C ATOM 1839 CG GLU A 117 6.933 -5.693 -10.957 1.00 0.00 C ATOM 1840 CD GLU A 117 7.838 -4.645 -11.575 1.00 0.00 C ATOM 1841 OE1 GLU A 117 8.934 -5.011 -12.047 1.00 0.00 O ATOM 1842 OE2 GLU A 117 7.449 -3.458 -11.587 1.00 0.00 O ATOM 0 H GLU A 117 7.398 -6.565 -7.083 1.00 0.00 H new ATOM 0 HA GLU A 117 5.355 -6.751 -8.820 1.00 0.00 H new ATOM 0 HB2 GLU A 117 7.019 -4.995 -8.937 1.00 0.00 H new ATOM 0 HB3 GLU A 117 8.281 -6.136 -9.357 1.00 0.00 H new ATOM 0 HG2 GLU A 117 7.053 -6.634 -11.494 1.00 0.00 H new ATOM 0 HG3 GLU A 117 5.894 -5.387 -11.078 1.00 0.00 H new ATOM 1849 N GLN A 118 7.452 -9.177 -9.376 1.00 0.00 N ATOM 1850 CA GLN A 118 7.662 -10.413 -10.121 1.00 0.00 C ATOM 1851 C GLN A 118 6.499 -11.378 -9.913 1.00 0.00 C ATOM 1852 O GLN A 118 5.749 -11.671 -10.845 1.00 0.00 O ATOM 1853 CB GLN A 118 8.972 -11.076 -9.691 1.00 0.00 C ATOM 1854 CG GLN A 118 10.210 -10.282 -10.077 1.00 0.00 C ATOM 1855 CD GLN A 118 10.104 -9.670 -11.460 1.00 0.00 C ATOM 1856 OE1 GLN A 118 9.594 -10.296 -12.390 1.00 0.00 O ATOM 1857 NE2 GLN A 118 10.587 -8.442 -11.603 1.00 0.00 N ATOM 0 H GLN A 118 8.079 -9.051 -8.581 1.00 0.00 H new ATOM 0 HA GLN A 118 7.719 -10.164 -11.181 1.00 0.00 H new ATOM 0 HB2 GLN A 118 8.962 -11.215 -8.610 1.00 0.00 H new ATOM 0 HB3 GLN A 118 9.032 -12.068 -10.139 1.00 0.00 H new ATOM 0 HG2 GLN A 118 10.372 -9.491 -9.345 1.00 0.00 H new ATOM 0 HG3 GLN A 118 11.082 -10.935 -10.039 1.00 0.00 H new ATOM 0 HE21 GLN A 118 11.001 -7.961 -10.805 1.00 0.00 H new ATOM 0 HE22 GLN A 118 10.544 -7.980 -12.511 1.00 0.00 H new ATOM 1866 N ASP A 119 6.354 -11.868 -8.687 1.00 0.00 N ATOM 1867 CA ASP A 119 5.281 -12.799 -8.357 1.00 0.00 C ATOM 1868 C ASP A 119 4.107 -12.069 -7.712 1.00 0.00 C ATOM 1869 O ASP A 119 3.005 -12.039 -8.260 1.00 0.00 O ATOM 1870 CB ASP A 119 5.796 -13.891 -7.418 1.00 0.00 C ATOM 1871 CG ASP A 119 6.830 -14.782 -8.079 1.00 0.00 C ATOM 1872 OD1 ASP A 119 7.936 -14.286 -8.380 1.00 0.00 O ATOM 1873 OD2 ASP A 119 6.532 -15.976 -8.295 1.00 0.00 O ATOM 0 H ASP A 119 6.966 -11.636 -7.905 1.00 0.00 H new ATOM 0 HA ASP A 119 4.935 -13.259 -9.283 1.00 0.00 H new ATOM 0 HB2 ASP A 119 6.232 -13.429 -6.532 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.958 -14.501 -7.080 1.00 0.00 H new ATOM 1878 N SER A 120 4.351 -11.482 -6.545 1.00 0.00 N ATOM 1879 CA SER A 120 3.312 -10.756 -5.823 1.00 0.00 C ATOM 1880 C SER A 120 2.330 -10.107 -6.792 1.00 0.00 C ATOM 1881 O SER A 120 1.124 -10.350 -6.728 1.00 0.00 O ATOM 1882 CB SER A 120 3.938 -9.689 -4.922 1.00 0.00 C ATOM 1883 OG SER A 120 4.293 -10.230 -3.662 1.00 0.00 O ATOM 0 H SER A 120 5.258 -11.495 -6.079 1.00 0.00 H new ATOM 0 HA SER A 120 2.767 -11.470 -5.205 1.00 0.00 H new ATOM 0 HB2 SER A 120 4.822 -9.274 -5.405 1.00 0.00 H new ATOM 0 HB3 SER A 120 3.235 -8.867 -4.784 1.00 0.00 H new ATOM 0 HG SER A 120 4.542 -9.504 -3.053 1.00 0.00 H new ATOM 1889 N TYR A 121 2.852 -9.280 -7.690 1.00 0.00 N ATOM 1890 CA TYR A 121 2.022 -8.593 -8.673 1.00 0.00 C ATOM 1891 C TYR A 121 1.225 -9.592 -9.506 1.00 0.00 C ATOM 1892 O TYR A 121 -0.001 -9.656 -9.416 1.00 0.00 O ATOM 1893 CB TYR A 121 2.889 -7.725 -9.586 1.00 0.00 C ATOM 1894 CG TYR A 121 2.090 -6.868 -10.542 1.00 0.00 C ATOM 1895 CD1 TYR A 121 1.130 -5.980 -10.073 1.00 0.00 C ATOM 1896 CD2 TYR A 121 2.297 -6.944 -11.914 1.00 0.00 C ATOM 1897 CE1 TYR A 121 0.397 -5.194 -10.941 1.00 0.00 C ATOM 1898 CE2 TYR A 121 1.570 -6.161 -12.790 1.00 0.00 C ATOM 1899 CZ TYR A 121 0.621 -5.289 -12.299 1.00 0.00 C ATOM 1900 OH TYR A 121 -0.105 -4.508 -13.169 1.00 0.00 O ATOM 0 H TYR A 121 3.848 -9.068 -7.758 1.00 0.00 H new ATOM 0 HA TYR A 121 1.320 -7.954 -8.136 1.00 0.00 H new ATOM 0 HB2 TYR A 121 3.517 -7.080 -8.971 1.00 0.00 H new ATOM 0 HB3 TYR A 121 3.557 -8.369 -10.159 1.00 0.00 H new ATOM 0 HD1 TYR A 121 0.954 -5.903 -9.010 1.00 0.00 H new ATOM 0 HD2 TYR A 121 3.039 -7.627 -12.302 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -0.346 -4.510 -10.559 1.00 0.00 H new ATOM 0 HE2 TYR A 121 1.744 -6.231 -13.854 1.00 0.00 H new ATOM 0 HH TYR A 121 0.506 -3.957 -13.702 1.00 0.00 H new ATOM 1910 N THR A 122 1.932 -10.371 -10.319 1.00 0.00 N ATOM 1911 CA THR A 122 1.293 -11.368 -11.170 1.00 0.00 C ATOM 1912 C THR A 122 0.195 -12.109 -10.418 1.00 0.00 C ATOM 1913 O THR A 122 -0.903 -12.308 -10.940 1.00 0.00 O ATOM 1914 CB THR A 122 2.315 -12.389 -11.704 1.00 0.00 C ATOM 1915 OG1 THR A 122 3.014 -12.998 -10.612 1.00 0.00 O ATOM 1916 CG2 THR A 122 3.309 -11.721 -12.640 1.00 0.00 C ATOM 0 H THR A 122 2.947 -10.331 -10.406 1.00 0.00 H new ATOM 0 HA THR A 122 0.854 -10.832 -12.011 1.00 0.00 H new ATOM 0 HB THR A 122 1.775 -13.154 -12.261 1.00 0.00 H new ATOM 0 HG1 THR A 122 3.069 -12.366 -9.865 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.021 -12.462 -13.004 1.00 0.00 H new ATOM 0 HG22 THR A 122 2.776 -11.284 -13.484 1.00 0.00 H new ATOM 0 HG23 THR A 122 3.844 -10.937 -12.103 1.00 0.00 H new ATOM 1924 N ARG A 123 0.497 -12.517 -9.190 1.00 0.00 N ATOM 1925 CA ARG A 123 -0.467 -13.238 -8.366 1.00 0.00 C ATOM 1926 C ARG A 123 -1.585 -12.312 -7.900 1.00 0.00 C ATOM 1927 O ARG A 123 -2.736 -12.728 -7.766 1.00 0.00 O ATOM 1928 CB ARG A 123 0.231 -13.861 -7.156 1.00 0.00 C ATOM 1929 CG ARG A 123 -0.478 -15.090 -6.609 1.00 0.00 C ATOM 1930 CD ARG A 123 0.505 -16.073 -5.994 1.00 0.00 C ATOM 1931 NE ARG A 123 1.388 -15.431 -5.024 1.00 0.00 N ATOM 1932 CZ ARG A 123 2.108 -16.099 -4.131 1.00 0.00 C ATOM 1933 NH1 ARG A 123 2.052 -17.424 -4.085 1.00 0.00 N ATOM 1934 NH2 ARG A 123 2.888 -15.443 -3.280 1.00 0.00 N ATOM 0 H ARG A 123 1.401 -12.361 -8.743 1.00 0.00 H new ATOM 0 HA ARG A 123 -0.905 -14.030 -8.973 1.00 0.00 H new ATOM 0 HB2 ARG A 123 1.249 -14.133 -7.435 1.00 0.00 H new ATOM 0 HB3 ARG A 123 0.306 -13.114 -6.366 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -1.208 -14.786 -5.859 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -1.030 -15.580 -7.411 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -0.045 -16.878 -5.506 1.00 0.00 H new ATOM 0 HD3 ARG A 123 1.104 -16.528 -6.783 1.00 0.00 H new ATOM 0 HE ARG A 123 1.455 -14.413 -5.033 1.00 0.00 H new ATOM 0 HH11 ARG A 123 1.454 -17.932 -4.737 1.00 0.00 H new ATOM 0 HH12 ARG A 123 2.607 -17.934 -3.398 1.00 0.00 H new ATOM 0 HH21 ARG A 123 2.934 -14.425 -3.312 1.00 0.00 H new ATOM 0 HH22 ARG A 123 3.441 -15.957 -2.594 1.00 0.00 H new ATOM 1948 N PHE A 124 -1.240 -11.052 -7.655 1.00 0.00 N ATOM 1949 CA PHE A 124 -2.214 -10.066 -7.201 1.00 0.00 C ATOM 1950 C PHE A 124 -3.238 -9.772 -8.294 1.00 0.00 C ATOM 1951 O PHE A 124 -4.438 -9.688 -8.030 1.00 0.00 O ATOM 1952 CB PHE A 124 -1.509 -8.773 -6.787 1.00 0.00 C ATOM 1953 CG PHE A 124 -2.441 -7.607 -6.623 1.00 0.00 C ATOM 1954 CD1 PHE A 124 -3.320 -7.552 -5.553 1.00 0.00 C ATOM 1955 CD2 PHE A 124 -2.440 -6.567 -7.537 1.00 0.00 C ATOM 1956 CE1 PHE A 124 -4.180 -6.481 -5.400 1.00 0.00 C ATOM 1957 CE2 PHE A 124 -3.296 -5.493 -7.389 1.00 0.00 C ATOM 1958 CZ PHE A 124 -4.167 -5.449 -6.318 1.00 0.00 C ATOM 0 H PHE A 124 -0.293 -10.690 -7.763 1.00 0.00 H new ATOM 0 HA PHE A 124 -2.736 -10.479 -6.338 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -0.982 -8.941 -5.848 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -0.756 -8.524 -7.535 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -3.333 -8.355 -4.831 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -1.761 -6.596 -8.377 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -4.862 -6.451 -4.563 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -3.284 -4.689 -8.110 1.00 0.00 H new ATOM 0 HZ PHE A 124 -4.836 -4.610 -6.199 1.00 0.00 H new ATOM 1968 N LEU A 125 -2.756 -9.617 -9.522 1.00 0.00 N ATOM 1969 CA LEU A 125 -3.628 -9.332 -10.657 1.00 0.00 C ATOM 1970 C LEU A 125 -4.702 -10.406 -10.801 1.00 0.00 C ATOM 1971 O LEU A 125 -5.842 -10.115 -11.163 1.00 0.00 O ATOM 1972 CB LEU A 125 -2.808 -9.237 -11.944 1.00 0.00 C ATOM 1973 CG LEU A 125 -2.153 -7.883 -12.224 1.00 0.00 C ATOM 1974 CD1 LEU A 125 -1.319 -7.947 -13.494 1.00 0.00 C ATOM 1975 CD2 LEU A 125 -3.207 -6.792 -12.330 1.00 0.00 C ATOM 0 H LEU A 125 -1.766 -9.684 -9.758 1.00 0.00 H new ATOM 0 HA LEU A 125 -4.119 -8.376 -10.476 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -2.027 -9.996 -11.910 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -3.457 -9.485 -12.784 1.00 0.00 H new ATOM 0 HG LEU A 125 -1.492 -7.641 -11.391 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -0.861 -6.975 -13.678 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -0.539 -8.700 -13.380 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -1.958 -8.212 -14.336 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -2.722 -5.836 -12.529 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -3.894 -7.027 -13.143 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -3.761 -6.729 -11.394 1.00 0.00 H new ATOM 1987 N LYS A 126 -4.329 -11.649 -10.516 1.00 0.00 N ATOM 1988 CA LYS A 126 -5.259 -12.767 -10.611 1.00 0.00 C ATOM 1989 C LYS A 126 -5.861 -13.092 -9.248 1.00 0.00 C ATOM 1990 O LYS A 126 -6.437 -14.162 -9.052 1.00 0.00 O ATOM 1991 CB LYS A 126 -4.550 -14.001 -11.174 1.00 0.00 C ATOM 1992 CG LYS A 126 -3.514 -14.591 -10.232 1.00 0.00 C ATOM 1993 CD LYS A 126 -2.415 -15.312 -10.992 1.00 0.00 C ATOM 1994 CE LYS A 126 -2.844 -16.714 -11.398 1.00 0.00 C ATOM 1995 NZ LYS A 126 -1.720 -17.488 -11.993 1.00 0.00 N ATOM 0 H LYS A 126 -3.389 -11.907 -10.217 1.00 0.00 H new ATOM 0 HA LYS A 126 -6.065 -12.479 -11.286 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -5.294 -14.763 -11.405 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -4.065 -13.734 -12.113 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -3.078 -13.797 -9.626 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -3.999 -15.285 -9.546 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -2.151 -14.740 -11.881 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -1.520 -15.370 -10.372 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -3.227 -17.243 -10.526 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -3.661 -16.650 -12.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -2.053 -18.437 -12.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -1.370 -16.997 -12.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -0.950 -17.572 -11.299 1.00 0.00 H new ATOM 2009 N SER A 127 -5.726 -12.161 -8.310 1.00 0.00 N ATOM 2010 CA SER A 127 -6.254 -12.349 -6.964 1.00 0.00 C ATOM 2011 C SER A 127 -7.683 -11.827 -6.864 1.00 0.00 C ATOM 2012 O SER A 127 -7.973 -10.698 -7.260 1.00 0.00 O ATOM 2013 CB SER A 127 -5.366 -11.638 -5.940 1.00 0.00 C ATOM 2014 OG SER A 127 -5.667 -10.254 -5.879 1.00 0.00 O ATOM 0 H SER A 127 -5.255 -11.268 -8.457 1.00 0.00 H new ATOM 0 HA SER A 127 -6.260 -13.418 -6.749 1.00 0.00 H new ATOM 0 HB2 SER A 127 -5.507 -12.088 -4.957 1.00 0.00 H new ATOM 0 HB3 SER A 127 -4.318 -11.774 -6.206 1.00 0.00 H new ATOM 0 HG SER A 127 -5.016 -9.754 -6.414 1.00 0.00 H new ATOM 2020 N ASP A 128 -8.574 -12.656 -6.330 1.00 0.00 N ATOM 2021 CA ASP A 128 -9.974 -12.280 -6.176 1.00 0.00 C ATOM 2022 C ASP A 128 -10.099 -10.922 -5.492 1.00 0.00 C ATOM 2023 O ASP A 128 -10.937 -10.101 -5.868 1.00 0.00 O ATOM 2024 CB ASP A 128 -10.725 -13.342 -5.371 1.00 0.00 C ATOM 2025 CG ASP A 128 -10.255 -14.748 -5.689 1.00 0.00 C ATOM 2026 OD1 ASP A 128 -10.490 -15.209 -6.824 1.00 0.00 O ATOM 2027 OD2 ASP A 128 -9.654 -15.387 -4.800 1.00 0.00 O ATOM 0 H ASP A 128 -8.351 -13.594 -5.996 1.00 0.00 H new ATOM 0 HA ASP A 128 -10.417 -12.209 -7.169 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -10.591 -13.149 -4.307 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -11.792 -13.263 -5.578 1.00 0.00 H new ATOM 2032 N ILE A 129 -9.263 -10.693 -4.485 1.00 0.00 N ATOM 2033 CA ILE A 129 -9.280 -9.435 -3.748 1.00 0.00 C ATOM 2034 C ILE A 129 -9.278 -8.243 -4.698 1.00 0.00 C ATOM 2035 O ILE A 129 -10.110 -7.341 -4.581 1.00 0.00 O ATOM 2036 CB ILE A 129 -8.073 -9.322 -2.798 1.00 0.00 C ATOM 2037 CG1 ILE A 129 -8.145 -10.402 -1.715 1.00 0.00 C ATOM 2038 CG2 ILE A 129 -8.021 -7.938 -2.171 1.00 0.00 C ATOM 2039 CD1 ILE A 129 -6.867 -10.546 -0.920 1.00 0.00 C ATOM 0 H ILE A 129 -8.565 -11.362 -4.161 1.00 0.00 H new ATOM 0 HA ILE A 129 -10.197 -9.426 -3.159 1.00 0.00 H new ATOM 0 HB ILE A 129 -7.160 -9.473 -3.374 1.00 0.00 H new ATOM 0 HG12 ILE A 129 -8.963 -10.168 -1.034 1.00 0.00 H new ATOM 0 HG13 ILE A 129 -8.383 -11.358 -2.182 1.00 0.00 H new ATOM 0 HG21 ILE A 129 -7.163 -7.874 -1.502 1.00 0.00 H new ATOM 0 HG22 ILE A 129 -7.927 -7.187 -2.955 1.00 0.00 H new ATOM 0 HG23 ILE A 129 -8.936 -7.760 -1.606 1.00 0.00 H new ATOM 0 HD11 ILE A 129 -6.990 -11.329 -0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 129 -6.049 -10.811 -1.590 1.00 0.00 H new ATOM 0 HD13 ILE A 129 -6.639 -9.602 -0.424 1.00 0.00 H new ATOM 2051 N TYR A 130 -8.341 -8.244 -5.639 1.00 0.00 N ATOM 2052 CA TYR A 130 -8.231 -7.160 -6.609 1.00 0.00 C ATOM 2053 C TYR A 130 -9.490 -7.066 -7.466 1.00 0.00 C ATOM 2054 O TYR A 130 -10.193 -6.056 -7.450 1.00 0.00 O ATOM 2055 CB TYR A 130 -7.007 -7.371 -7.503 1.00 0.00 C ATOM 2056 CG TYR A 130 -7.127 -6.711 -8.858 1.00 0.00 C ATOM 2057 CD1 TYR A 130 -7.135 -5.327 -8.981 1.00 0.00 C ATOM 2058 CD2 TYR A 130 -7.233 -7.472 -10.017 1.00 0.00 C ATOM 2059 CE1 TYR A 130 -7.244 -4.720 -10.217 1.00 0.00 C ATOM 2060 CE2 TYR A 130 -7.341 -6.873 -11.256 1.00 0.00 C ATOM 2061 CZ TYR A 130 -7.347 -5.497 -11.352 1.00 0.00 C ATOM 2062 OH TYR A 130 -7.456 -4.897 -12.585 1.00 0.00 O ATOM 0 H TYR A 130 -7.647 -8.983 -5.751 1.00 0.00 H new ATOM 0 HA TYR A 130 -8.116 -6.225 -6.060 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -6.125 -6.981 -6.995 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -6.849 -8.440 -7.642 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -7.055 -4.715 -8.095 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -7.231 -8.550 -9.947 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -7.249 -3.643 -10.294 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -7.420 -7.479 -12.146 1.00 0.00 H new ATOM 0 HH TYR A 130 -7.518 -5.586 -13.280 1.00 0.00 H new ATOM 2072 N LEU A 131 -9.769 -8.129 -8.214 1.00 0.00 N ATOM 2073 CA LEU A 131 -10.944 -8.169 -9.078 1.00 0.00 C ATOM 2074 C LEU A 131 -12.202 -7.786 -8.305 1.00 0.00 C ATOM 2075 O LEU A 131 -13.138 -7.216 -8.865 1.00 0.00 O ATOM 2076 CB LEU A 131 -11.109 -9.564 -9.684 1.00 0.00 C ATOM 2077 CG LEU A 131 -9.924 -10.085 -10.498 1.00 0.00 C ATOM 2078 CD1 LEU A 131 -9.869 -11.605 -10.446 1.00 0.00 C ATOM 2079 CD2 LEU A 131 -10.012 -9.602 -11.938 1.00 0.00 C ATOM 0 H LEU A 131 -9.198 -8.974 -8.239 1.00 0.00 H new ATOM 0 HA LEU A 131 -10.799 -7.446 -9.881 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -11.307 -10.268 -8.876 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -11.990 -9.558 -10.325 1.00 0.00 H new ATOM 0 HG LEU A 131 -9.006 -9.693 -10.060 1.00 0.00 H new ATOM 0 HD11 LEU A 131 -9.020 -11.959 -11.031 1.00 0.00 H new ATOM 0 HD12 LEU A 131 -9.758 -11.930 -9.411 1.00 0.00 H new ATOM 0 HD13 LEU A 131 -10.790 -12.017 -10.859 1.00 0.00 H new ATOM 0 HD21 LEU A 131 -9.160 -9.983 -12.502 1.00 0.00 H new ATOM 0 HD22 LEU A 131 -10.936 -9.965 -12.388 1.00 0.00 H new ATOM 0 HD23 LEU A 131 -10.002 -8.512 -11.957 1.00 0.00 H new ATOM 2091 N ASP A 132 -12.216 -8.102 -7.014 1.00 0.00 N ATOM 2092 CA ASP A 132 -13.357 -7.787 -6.163 1.00 0.00 C ATOM 2093 C ASP A 132 -13.398 -6.298 -5.835 1.00 0.00 C ATOM 2094 O ASP A 132 -14.377 -5.612 -6.134 1.00 0.00 O ATOM 2095 CB ASP A 132 -13.298 -8.604 -4.871 1.00 0.00 C ATOM 2096 CG ASP A 132 -14.355 -8.185 -3.871 1.00 0.00 C ATOM 2097 OD1 ASP A 132 -15.527 -8.025 -4.276 1.00 0.00 O ATOM 2098 OD2 ASP A 132 -14.013 -8.016 -2.682 1.00 0.00 O ATOM 0 H ASP A 132 -11.450 -8.576 -6.535 1.00 0.00 H new ATOM 0 HA ASP A 132 -14.265 -8.046 -6.707 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -13.424 -9.661 -5.107 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -12.312 -8.494 -4.420 1.00 0.00 H new ATOM 2103 N LEU A 133 -12.330 -5.804 -5.219 1.00 0.00 N ATOM 2104 CA LEU A 133 -12.243 -4.396 -4.850 1.00 0.00 C ATOM 2105 C LEU A 133 -12.828 -3.508 -5.943 1.00 0.00 C ATOM 2106 O LEU A 133 -13.476 -2.502 -5.660 1.00 0.00 O ATOM 2107 CB LEU A 133 -10.788 -4.006 -4.585 1.00 0.00 C ATOM 2108 CG LEU A 133 -10.009 -3.467 -5.785 1.00 0.00 C ATOM 2109 CD1 LEU A 133 -10.296 -1.987 -5.987 1.00 0.00 C ATOM 2110 CD2 LEU A 133 -8.517 -3.701 -5.601 1.00 0.00 C ATOM 0 H LEU A 133 -11.512 -6.358 -4.965 1.00 0.00 H new ATOM 0 HA LEU A 133 -12.824 -4.249 -3.939 1.00 0.00 H new ATOM 0 HB2 LEU A 133 -10.772 -3.252 -3.798 1.00 0.00 H new ATOM 0 HB3 LEU A 133 -10.263 -4.880 -4.199 1.00 0.00 H new ATOM 0 HG LEU A 133 -10.334 -4.005 -6.676 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -9.733 -1.621 -6.845 1.00 0.00 H new ATOM 0 HD12 LEU A 133 -11.362 -1.844 -6.165 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -9.999 -1.434 -5.096 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -7.978 -3.311 -6.465 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -8.177 -3.190 -4.700 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -8.325 -4.770 -5.506 1.00 0.00 H new ATOM 2122 N MET A 134 -12.596 -3.890 -7.195 1.00 0.00 N ATOM 2123 CA MET A 134 -13.104 -3.131 -8.333 1.00 0.00 C ATOM 2124 C MET A 134 -14.471 -3.649 -8.766 1.00 0.00 C ATOM 2125 O MET A 134 -15.334 -2.878 -9.185 1.00 0.00 O ATOM 2126 CB MET A 134 -12.121 -3.208 -9.504 1.00 0.00 C ATOM 2127 CG MET A 134 -11.830 -4.629 -9.960 1.00 0.00 C ATOM 2128 SD MET A 134 -11.477 -4.733 -11.725 1.00 0.00 S ATOM 2129 CE MET A 134 -10.231 -3.458 -11.897 1.00 0.00 C ATOM 0 H MET A 134 -12.060 -4.720 -7.447 1.00 0.00 H new ATOM 0 HA MET A 134 -13.211 -2.091 -8.026 1.00 0.00 H new ATOM 0 HB2 MET A 134 -12.523 -2.641 -10.343 1.00 0.00 H new ATOM 0 HB3 MET A 134 -11.186 -2.729 -9.215 1.00 0.00 H new ATOM 0 HG2 MET A 134 -10.980 -5.019 -9.400 1.00 0.00 H new ATOM 0 HG3 MET A 134 -12.685 -5.264 -9.726 1.00 0.00 H new ATOM 0 HE1 MET A 134 -9.652 -3.635 -12.803 1.00 0.00 H new ATOM 0 HE2 MET A 134 -10.714 -2.483 -11.960 1.00 0.00 H new ATOM 0 HE3 MET A 134 -9.567 -3.479 -11.032 1.00 0.00 H new ATOM 2139 N SER A 135 -14.662 -4.962 -8.663 1.00 0.00 N ATOM 2140 CA SER A 135 -15.924 -5.582 -9.048 1.00 0.00 C ATOM 2141 C SER A 135 -16.312 -5.188 -10.471 1.00 0.00 C ATOM 2142 O SER A 135 -17.472 -4.889 -10.749 1.00 0.00 O ATOM 2143 CB SER A 135 -17.032 -5.180 -8.075 1.00 0.00 C ATOM 2144 OG SER A 135 -18.146 -6.050 -8.183 1.00 0.00 O ATOM 0 H SER A 135 -13.959 -5.615 -8.317 1.00 0.00 H new ATOM 0 HA SER A 135 -15.794 -6.664 -9.012 1.00 0.00 H new ATOM 0 HB2 SER A 135 -16.649 -5.199 -7.055 1.00 0.00 H new ATOM 0 HB3 SER A 135 -17.345 -4.156 -8.279 1.00 0.00 H new ATOM 0 HG SER A 135 -18.475 -6.048 -9.106 1.00 0.00 H new ATOM 2150 N GLY A 136 -15.330 -5.191 -11.367 1.00 0.00 N ATOM 2151 CA GLY A 136 -15.587 -4.832 -12.750 1.00 0.00 C ATOM 2152 C GLY A 136 -15.348 -5.986 -13.703 1.00 0.00 C ATOM 2153 O GLY A 136 -14.438 -6.795 -13.516 1.00 0.00 O ATOM 0 H GLY A 136 -14.362 -5.435 -11.160 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -16.618 -4.491 -12.848 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.947 -3.995 -13.030 1.00 0.00 H new ATOM 2157 N PRO A 137 -16.179 -6.076 -14.751 1.00 0.00 N ATOM 2158 CA PRO A 137 -16.074 -7.137 -15.756 1.00 0.00 C ATOM 2159 C PRO A 137 -14.834 -6.988 -16.629 1.00 0.00 C ATOM 2160 O PRO A 137 -14.645 -5.965 -17.287 1.00 0.00 O ATOM 2161 CB PRO A 137 -17.342 -6.958 -16.595 1.00 0.00 C ATOM 2162 CG PRO A 137 -17.707 -5.522 -16.429 1.00 0.00 C ATOM 2163 CD PRO A 137 -17.286 -5.146 -15.035 1.00 0.00 C ATOM 0 HA PRO A 137 -15.984 -8.123 -15.299 1.00 0.00 H new ATOM 0 HB2 PRO A 137 -17.162 -7.202 -17.642 1.00 0.00 H new ATOM 0 HB3 PRO A 137 -18.142 -7.612 -16.248 1.00 0.00 H new ATOM 0 HG2 PRO A 137 -17.201 -4.903 -17.170 1.00 0.00 H new ATOM 0 HG3 PRO A 137 -18.778 -5.373 -16.567 1.00 0.00 H new ATOM 0 HD2 PRO A 137 -16.962 -4.107 -14.979 1.00 0.00 H new ATOM 0 HD3 PRO A 137 -18.103 -5.264 -14.323 1.00 0.00 H new ATOM 2171 N SER A 138 -13.990 -8.015 -16.631 1.00 0.00 N ATOM 2172 CA SER A 138 -12.764 -7.996 -17.421 1.00 0.00 C ATOM 2173 C SER A 138 -13.059 -8.293 -18.888 1.00 0.00 C ATOM 2174 O SER A 138 -13.777 -9.239 -19.209 1.00 0.00 O ATOM 2175 CB SER A 138 -11.764 -9.017 -16.873 1.00 0.00 C ATOM 2176 OG SER A 138 -11.112 -8.521 -15.717 1.00 0.00 O ATOM 0 H SER A 138 -14.133 -8.871 -16.094 1.00 0.00 H new ATOM 0 HA SER A 138 -12.330 -6.999 -17.350 1.00 0.00 H new ATOM 0 HB2 SER A 138 -12.282 -9.945 -16.632 1.00 0.00 H new ATOM 0 HB3 SER A 138 -11.025 -9.254 -17.638 1.00 0.00 H new ATOM 0 HG SER A 138 -10.480 -9.192 -15.385 1.00 0.00 H new ATOM 2182 N SER A 139 -12.499 -7.477 -19.774 1.00 0.00 N ATOM 2183 CA SER A 139 -12.704 -7.648 -21.208 1.00 0.00 C ATOM 2184 C SER A 139 -11.654 -8.584 -21.799 1.00 0.00 C ATOM 2185 O SER A 139 -11.980 -9.650 -22.321 1.00 0.00 O ATOM 2186 CB SER A 139 -12.652 -6.293 -21.917 1.00 0.00 C ATOM 2187 OG SER A 139 -13.161 -6.389 -23.237 1.00 0.00 O ATOM 0 H SER A 139 -11.899 -6.690 -19.525 1.00 0.00 H new ATOM 0 HA SER A 139 -13.688 -8.092 -21.359 1.00 0.00 H new ATOM 0 HB2 SER A 139 -13.230 -5.561 -21.353 1.00 0.00 H new ATOM 0 HB3 SER A 139 -11.624 -5.933 -21.946 1.00 0.00 H new ATOM 0 HG SER A 139 -13.119 -5.510 -23.669 1.00 0.00 H new ATOM 2193 N GLY A 140 -10.391 -8.177 -21.713 1.00 0.00 N ATOM 2194 CA GLY A 140 -9.312 -8.990 -22.243 1.00 0.00 C ATOM 2195 C GLY A 140 -8.627 -8.343 -23.429 1.00 0.00 C ATOM 2196 O GLY A 140 -7.715 -8.922 -24.020 1.00 0.00 O ATOM 0 H GLY A 140 -10.096 -7.299 -21.286 1.00 0.00 H new ATOM 0 HA2 GLY A 140 -8.578 -9.171 -21.458 1.00 0.00 H new ATOM 0 HA3 GLY A 140 -9.706 -9.962 -22.541 1.00 0.00 H new TER 2200 GLY A 140