USER MOD reduce.3.24.130724 H: found=0, std=0, add=660, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 658 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 140 HIS : no HD1:sc= -0.951 K(o=-0.18,f=-3.1!) USER MOD Set 1.2: A 141 ASN : amide:sc= 0.772 K(o=-0.18,f=-5.4!) USER MOD Set 2.1: A 82 SER OG : rot -170:sc= 0 USER MOD Set 2.2: A 85 HIS : no HD1:sc= -2.38 K(o=-1.8,f=-4.5) USER MOD Set 2.3: A 95 LYS NZ :NH3+ -171:sc= 0.546 (180deg=0) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 29:sc= 0.241 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 166:sc= -0.401 (180deg=-0.658) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 120:sc= -0.0229 USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 101 THR OG1 : rot 72:sc= 0.78 USER MOD Single : A 104 MET CE :methyl 135:sc= -0.861 (180deg=-2.11!) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 SER OG : rot 71:sc= 0.0751 USER MOD Single : A 116 LYS NZ :NH3+ -164:sc= -0.0207 (180deg=-0.235) USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 119 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.078) USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 ASN : amide:sc= -0.721 K(o=-0.72,f=-5.5!) USER MOD Single : A 123 ASN : amide:sc= -1.03 K(o=-1,f=-7.8!) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.245 K(o=-0.24,f=-2.4) USER MOD Single : A 127 TYR OH : rot 180:sc= -0.0611 USER MOD Single : A 131 GLN : amide:sc= -2.05! C(o=-2.1!,f=-2.1!) USER MOD Single : A 132 LYS NZ :NH3+ -153:sc= 0.971 (180deg=0.271) USER MOD Single : A 133 CYS SG : rot -91:sc= -0.85 USER MOD Single : A 138 MET CE :methyl -132:sc= -0.297 (180deg=-3.63!) USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot 33:sc= 0.93 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 32:sc= 0.889 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 65 17.795 9.318 -23.880 1.00 0.00 N ATOM 2 CA GLY A 65 17.853 10.482 -24.744 1.00 0.00 C ATOM 3 C GLY A 65 17.821 11.784 -23.968 1.00 0.00 C ATOM 4 O GLY A 65 18.821 12.499 -23.901 1.00 0.00 O ATOM 0 HA2 GLY A 65 18.764 10.442 -25.342 1.00 0.00 H new ATOM 0 HA3 GLY A 65 17.014 10.457 -25.439 1.00 0.00 H new ATOM 8 N SER A 66 16.670 12.093 -23.380 1.00 0.00 N ATOM 9 CA SER A 66 16.511 13.320 -22.609 1.00 0.00 C ATOM 10 C SER A 66 16.153 13.008 -21.159 1.00 0.00 C ATOM 11 O SER A 66 15.398 12.076 -20.881 1.00 0.00 O ATOM 12 CB SER A 66 15.429 14.203 -23.234 1.00 0.00 C ATOM 13 OG SER A 66 15.208 15.366 -22.455 1.00 0.00 O ATOM 0 H SER A 66 15.834 11.510 -23.423 1.00 0.00 H new ATOM 0 HA SER A 66 17.461 13.855 -22.624 1.00 0.00 H new ATOM 0 HB2 SER A 66 15.726 14.488 -24.243 1.00 0.00 H new ATOM 0 HB3 SER A 66 14.501 13.639 -23.322 1.00 0.00 H new ATOM 0 HG SER A 66 14.514 15.915 -22.876 1.00 0.00 H new ATOM 19 N SER A 67 16.702 13.794 -20.238 1.00 0.00 N ATOM 20 CA SER A 67 16.446 13.600 -18.816 1.00 0.00 C ATOM 21 C SER A 67 14.957 13.731 -18.510 1.00 0.00 C ATOM 22 O SER A 67 14.335 14.747 -18.819 1.00 0.00 O ATOM 23 CB SER A 67 17.239 14.614 -17.990 1.00 0.00 C ATOM 24 OG SER A 67 16.926 15.942 -18.375 1.00 0.00 O ATOM 0 H SER A 67 17.327 14.571 -20.452 1.00 0.00 H new ATOM 0 HA SER A 67 16.768 12.594 -18.548 1.00 0.00 H new ATOM 0 HB2 SER A 67 17.018 14.477 -16.931 1.00 0.00 H new ATOM 0 HB3 SER A 67 18.307 14.437 -18.119 1.00 0.00 H new ATOM 0 HG SER A 67 16.010 15.975 -18.722 1.00 0.00 H new ATOM 30 N GLY A 68 14.391 12.694 -17.900 1.00 0.00 N ATOM 31 CA GLY A 68 12.979 12.713 -17.561 1.00 0.00 C ATOM 32 C GLY A 68 12.634 13.811 -16.576 1.00 0.00 C ATOM 33 O GLY A 68 13.213 14.897 -16.618 1.00 0.00 O ATOM 0 H GLY A 68 14.884 11.842 -17.635 1.00 0.00 H new ATOM 0 HA2 GLY A 68 12.392 12.847 -18.470 1.00 0.00 H new ATOM 0 HA3 GLY A 68 12.697 11.749 -17.139 1.00 0.00 H new ATOM 37 N SER A 69 11.686 13.530 -15.688 1.00 0.00 N ATOM 38 CA SER A 69 11.259 14.505 -14.691 1.00 0.00 C ATOM 39 C SER A 69 11.419 13.946 -13.280 1.00 0.00 C ATOM 40 O SER A 69 11.444 12.731 -13.082 1.00 0.00 O ATOM 41 CB SER A 69 9.803 14.908 -14.930 1.00 0.00 C ATOM 42 OG SER A 69 8.914 13.899 -14.481 1.00 0.00 O ATOM 0 H SER A 69 11.199 12.635 -15.638 1.00 0.00 H new ATOM 0 HA SER A 69 11.893 15.387 -14.788 1.00 0.00 H new ATOM 0 HB2 SER A 69 9.591 15.842 -14.410 1.00 0.00 H new ATOM 0 HB3 SER A 69 9.643 15.092 -15.992 1.00 0.00 H new ATOM 0 HG SER A 69 7.990 14.181 -14.643 1.00 0.00 H new ATOM 48 N SER A 70 11.526 14.841 -12.304 1.00 0.00 N ATOM 49 CA SER A 70 11.687 14.438 -10.912 1.00 0.00 C ATOM 50 C SER A 70 10.824 15.298 -9.994 1.00 0.00 C ATOM 51 O SER A 70 10.899 16.526 -10.024 1.00 0.00 O ATOM 52 CB SER A 70 13.156 14.541 -10.495 1.00 0.00 C ATOM 53 OG SER A 70 13.384 13.882 -9.262 1.00 0.00 O ATOM 0 H SER A 70 11.504 15.850 -12.451 1.00 0.00 H new ATOM 0 HA SER A 70 11.363 13.401 -10.820 1.00 0.00 H new ATOM 0 HB2 SER A 70 13.788 14.103 -11.267 1.00 0.00 H new ATOM 0 HB3 SER A 70 13.440 15.590 -10.408 1.00 0.00 H new ATOM 0 HG SER A 70 14.330 13.961 -9.019 1.00 0.00 H new ATOM 59 N GLY A 71 10.005 14.644 -9.176 1.00 0.00 N ATOM 60 CA GLY A 71 9.139 15.363 -8.261 1.00 0.00 C ATOM 61 C GLY A 71 8.034 14.491 -7.701 1.00 0.00 C ATOM 62 O GLY A 71 7.744 14.535 -6.506 1.00 0.00 O ATOM 0 H GLY A 71 9.926 13.628 -9.131 1.00 0.00 H new ATOM 0 HA2 GLY A 71 9.735 15.761 -7.440 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.698 16.216 -8.778 1.00 0.00 H new ATOM 66 N MET A 72 7.413 13.696 -8.568 1.00 0.00 N ATOM 67 CA MET A 72 6.332 12.810 -8.153 1.00 0.00 C ATOM 68 C MET A 72 6.621 11.370 -8.564 1.00 0.00 C ATOM 69 O MET A 72 7.002 11.106 -9.704 1.00 0.00 O ATOM 70 CB MET A 72 5.005 13.270 -8.760 1.00 0.00 C ATOM 71 CG MET A 72 4.263 14.282 -7.903 1.00 0.00 C ATOM 72 SD MET A 72 5.242 15.757 -7.565 1.00 0.00 S ATOM 73 CE MET A 72 5.223 15.774 -5.774 1.00 0.00 C ATOM 0 H MET A 72 7.640 13.648 -9.561 1.00 0.00 H new ATOM 0 HA MET A 72 6.259 12.851 -7.066 1.00 0.00 H new ATOM 0 HB2 MET A 72 5.195 13.707 -9.740 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.366 12.401 -8.917 1.00 0.00 H new ATOM 0 HG2 MET A 72 3.340 14.571 -8.406 1.00 0.00 H new ATOM 0 HG3 MET A 72 3.979 13.815 -6.960 1.00 0.00 H new ATOM 0 HE1 MET A 72 5.979 16.469 -5.409 1.00 0.00 H new ATOM 0 HE2 MET A 72 4.241 16.090 -5.424 1.00 0.00 H new ATOM 0 HE3 MET A 72 5.438 14.774 -5.398 1.00 0.00 H new ATOM 83 N GLU A 73 6.439 10.443 -7.629 1.00 0.00 N ATOM 84 CA GLU A 73 6.682 9.031 -7.896 1.00 0.00 C ATOM 85 C GLU A 73 5.749 8.152 -7.068 1.00 0.00 C ATOM 86 O GLU A 73 5.477 8.441 -5.902 1.00 0.00 O ATOM 87 CB GLU A 73 8.139 8.675 -7.592 1.00 0.00 C ATOM 88 CG GLU A 73 9.078 8.907 -8.763 1.00 0.00 C ATOM 89 CD GLU A 73 10.502 9.188 -8.322 1.00 0.00 C ATOM 90 OE1 GLU A 73 11.198 8.231 -7.921 1.00 0.00 O ATOM 91 OE2 GLU A 73 10.919 10.363 -8.378 1.00 0.00 O ATOM 0 H GLU A 73 6.124 10.645 -6.680 1.00 0.00 H new ATOM 0 HA GLU A 73 6.483 8.848 -8.952 1.00 0.00 H new ATOM 0 HB2 GLU A 73 8.479 9.266 -6.742 1.00 0.00 H new ATOM 0 HB3 GLU A 73 8.194 7.628 -7.295 1.00 0.00 H new ATOM 0 HG2 GLU A 73 9.068 8.030 -9.411 1.00 0.00 H new ATOM 0 HG3 GLU A 73 8.713 9.746 -9.356 1.00 0.00 H new ATOM 98 N CYS A 74 5.260 7.078 -7.679 1.00 0.00 N ATOM 99 CA CYS A 74 4.357 6.156 -7.000 1.00 0.00 C ATOM 100 C CYS A 74 5.060 5.462 -5.838 1.00 0.00 C ATOM 101 O CYS A 74 5.948 4.633 -6.042 1.00 0.00 O ATOM 102 CB CYS A 74 3.825 5.113 -7.985 1.00 0.00 C ATOM 103 SG CYS A 74 2.778 3.834 -7.219 1.00 0.00 S ATOM 0 H CYS A 74 5.474 6.825 -8.644 1.00 0.00 H new ATOM 0 HA CYS A 74 3.521 6.732 -6.603 1.00 0.00 H new ATOM 0 HB2 CYS A 74 3.251 5.620 -8.761 1.00 0.00 H new ATOM 0 HB3 CYS A 74 4.669 4.630 -8.477 1.00 0.00 H new ATOM 108 N ARG A 75 4.658 5.806 -4.619 1.00 0.00 N ATOM 109 CA ARG A 75 5.249 5.216 -3.424 1.00 0.00 C ATOM 110 C ARG A 75 5.261 3.693 -3.517 1.00 0.00 C ATOM 111 O ARG A 75 6.176 3.037 -3.019 1.00 0.00 O ATOM 112 CB ARG A 75 4.479 5.656 -2.178 1.00 0.00 C ATOM 113 CG ARG A 75 4.579 7.145 -1.893 1.00 0.00 C ATOM 114 CD ARG A 75 5.827 7.477 -1.091 1.00 0.00 C ATOM 115 NE ARG A 75 5.679 8.718 -0.336 1.00 0.00 N ATOM 116 CZ ARG A 75 5.778 9.926 -0.880 1.00 0.00 C ATOM 117 NH1 ARG A 75 6.025 10.054 -2.176 1.00 0.00 N ATOM 118 NH2 ARG A 75 5.631 11.008 -0.126 1.00 0.00 N ATOM 0 H ARG A 75 3.925 6.491 -4.433 1.00 0.00 H new ATOM 0 HA ARG A 75 6.279 5.565 -3.349 1.00 0.00 H new ATOM 0 HB2 ARG A 75 3.429 5.387 -2.297 1.00 0.00 H new ATOM 0 HB3 ARG A 75 4.854 5.104 -1.316 1.00 0.00 H new ATOM 0 HG2 ARG A 75 4.592 7.696 -2.833 1.00 0.00 H new ATOM 0 HG3 ARG A 75 3.695 7.472 -1.345 1.00 0.00 H new ATOM 0 HD2 ARG A 75 6.045 6.659 -0.404 1.00 0.00 H new ATOM 0 HD3 ARG A 75 6.679 7.563 -1.765 1.00 0.00 H new ATOM 0 HE ARG A 75 5.489 8.654 0.664 1.00 0.00 H new ATOM 0 HH11 ARG A 75 6.139 9.224 -2.758 1.00 0.00 H new ATOM 0 HH12 ARG A 75 6.101 10.982 -2.592 1.00 0.00 H new ATOM 0 HH21 ARG A 75 5.442 10.912 0.872 1.00 0.00 H new ATOM 0 HH22 ARG A 75 5.707 11.935 -0.544 1.00 0.00 H new ATOM 132 N VAL A 76 4.239 3.137 -4.159 1.00 0.00 N ATOM 133 CA VAL A 76 4.131 1.692 -4.319 1.00 0.00 C ATOM 134 C VAL A 76 5.294 1.141 -5.137 1.00 0.00 C ATOM 135 O VAL A 76 6.180 0.471 -4.606 1.00 0.00 O ATOM 136 CB VAL A 76 2.807 1.299 -5.000 1.00 0.00 C ATOM 137 CG1 VAL A 76 2.572 -0.199 -4.887 1.00 0.00 C ATOM 138 CG2 VAL A 76 1.647 2.076 -4.396 1.00 0.00 C ATOM 0 H VAL A 76 3.473 3.666 -4.577 1.00 0.00 H new ATOM 0 HA VAL A 76 4.158 1.261 -3.318 1.00 0.00 H new ATOM 0 HB VAL A 76 2.873 1.553 -6.058 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.632 -0.458 -5.374 1.00 0.00 H new ATOM 0 HG12 VAL A 76 3.390 -0.733 -5.371 1.00 0.00 H new ATOM 0 HG13 VAL A 76 2.526 -0.482 -3.835 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.719 1.786 -4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 76 1.577 1.855 -3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 76 1.813 3.144 -4.535 1.00 0.00 H new ATOM 148 N CYS A 77 5.285 1.429 -6.435 1.00 0.00 N ATOM 149 CA CYS A 77 6.339 0.963 -7.329 1.00 0.00 C ATOM 150 C CYS A 77 7.387 2.050 -7.546 1.00 0.00 C ATOM 151 O CYS A 77 8.588 1.791 -7.482 1.00 0.00 O ATOM 152 CB CYS A 77 5.744 0.537 -8.672 1.00 0.00 C ATOM 153 SG CYS A 77 5.057 1.911 -9.651 1.00 0.00 S ATOM 0 H CYS A 77 4.560 1.983 -6.891 1.00 0.00 H new ATOM 0 HA CYS A 77 6.823 0.104 -6.865 1.00 0.00 H new ATOM 0 HB2 CYS A 77 6.516 0.039 -9.258 1.00 0.00 H new ATOM 0 HB3 CYS A 77 4.957 -0.196 -8.493 1.00 0.00 H new ATOM 158 N GLY A 78 6.924 3.270 -7.803 1.00 0.00 N ATOM 159 CA GLY A 78 7.834 4.378 -8.026 1.00 0.00 C ATOM 160 C GLY A 78 7.527 5.132 -9.305 1.00 0.00 C ATOM 161 O GLY A 78 7.669 6.354 -9.362 1.00 0.00 O ATOM 0 H GLY A 78 5.934 3.510 -7.861 1.00 0.00 H new ATOM 0 HA2 GLY A 78 7.780 5.065 -7.181 1.00 0.00 H new ATOM 0 HA3 GLY A 78 8.856 4.002 -8.066 1.00 0.00 H new ATOM 165 N ASP A 79 7.107 4.404 -10.333 1.00 0.00 N ATOM 166 CA ASP A 79 6.780 5.012 -11.618 1.00 0.00 C ATOM 167 C ASP A 79 6.003 6.310 -11.422 1.00 0.00 C ATOM 168 O ASP A 79 5.382 6.524 -10.381 1.00 0.00 O ATOM 169 CB ASP A 79 5.967 4.040 -12.474 1.00 0.00 C ATOM 170 CG ASP A 79 6.108 4.317 -13.957 1.00 0.00 C ATOM 171 OD1 ASP A 79 6.482 5.454 -14.315 1.00 0.00 O ATOM 172 OD2 ASP A 79 5.843 3.398 -14.761 1.00 0.00 O ATOM 0 H ASP A 79 6.985 3.392 -10.302 1.00 0.00 H new ATOM 0 HA ASP A 79 7.713 5.242 -12.132 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.290 3.020 -12.266 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.916 4.105 -12.194 1.00 0.00 H new ATOM 177 N LYS A 80 6.042 7.174 -12.431 1.00 0.00 N ATOM 178 CA LYS A 80 5.342 8.452 -12.371 1.00 0.00 C ATOM 179 C LYS A 80 4.023 8.315 -11.618 1.00 0.00 C ATOM 180 O LYS A 80 3.243 7.398 -11.875 1.00 0.00 O ATOM 181 CB LYS A 80 5.083 8.981 -13.784 1.00 0.00 C ATOM 182 CG LYS A 80 3.991 8.227 -14.524 1.00 0.00 C ATOM 183 CD LYS A 80 4.097 8.426 -16.027 1.00 0.00 C ATOM 184 CE LYS A 80 2.754 8.225 -16.712 1.00 0.00 C ATOM 185 NZ LYS A 80 2.902 8.056 -18.184 1.00 0.00 N ATOM 0 H LYS A 80 6.551 7.012 -13.300 1.00 0.00 H new ATOM 0 HA LYS A 80 5.974 9.160 -11.835 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.809 10.034 -13.724 1.00 0.00 H new ATOM 0 HB3 LYS A 80 6.007 8.924 -14.360 1.00 0.00 H new ATOM 0 HG2 LYS A 80 4.059 7.164 -14.291 1.00 0.00 H new ATOM 0 HG3 LYS A 80 3.015 8.567 -14.179 1.00 0.00 H new ATOM 0 HD2 LYS A 80 4.467 9.430 -16.237 1.00 0.00 H new ATOM 0 HD3 LYS A 80 4.824 7.726 -16.437 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.261 7.348 -16.294 1.00 0.00 H new ATOM 0 HE3 LYS A 80 2.110 9.081 -16.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 1.965 7.922 -18.614 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 3.350 8.904 -18.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 3.495 7.225 -18.380 1.00 0.00 H new ATOM 199 N ALA A 81 3.780 9.233 -10.689 1.00 0.00 N ATOM 200 CA ALA A 81 2.553 9.217 -9.901 1.00 0.00 C ATOM 201 C ALA A 81 1.425 9.941 -10.627 1.00 0.00 C ATOM 202 O ALA A 81 1.333 11.168 -10.585 1.00 0.00 O ATOM 203 CB ALA A 81 2.794 9.844 -8.536 1.00 0.00 C ATOM 0 H ALA A 81 4.416 9.998 -10.463 1.00 0.00 H new ATOM 0 HA ALA A 81 2.253 8.178 -9.763 1.00 0.00 H new ATOM 0 HB1 ALA A 81 1.870 9.825 -7.959 1.00 0.00 H new ATOM 0 HB2 ALA A 81 3.563 9.281 -8.008 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.122 10.876 -8.662 1.00 0.00 H new ATOM 209 N SER A 82 0.567 9.174 -11.293 1.00 0.00 N ATOM 210 CA SER A 82 -0.553 9.744 -12.032 1.00 0.00 C ATOM 211 C SER A 82 -1.221 10.858 -11.233 1.00 0.00 C ATOM 212 O SER A 82 -1.430 11.961 -11.738 1.00 0.00 O ATOM 213 CB SER A 82 -1.577 8.657 -12.366 1.00 0.00 C ATOM 214 OG SER A 82 -2.805 9.225 -12.786 1.00 0.00 O ATOM 0 H SER A 82 0.626 8.157 -11.336 1.00 0.00 H new ATOM 0 HA SER A 82 -0.166 10.167 -12.959 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.184 8.012 -13.151 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.744 8.029 -11.491 1.00 0.00 H new ATOM 0 HG SER A 82 -3.488 8.524 -12.841 1.00 0.00 H new ATOM 220 N GLY A 83 -1.553 10.562 -9.980 1.00 0.00 N ATOM 221 CA GLY A 83 -2.194 11.549 -9.130 1.00 0.00 C ATOM 222 C GLY A 83 -2.206 11.136 -7.671 1.00 0.00 C ATOM 223 O GLY A 83 -1.357 10.361 -7.230 1.00 0.00 O ATOM 0 H GLY A 83 -1.390 9.657 -9.538 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -1.675 12.502 -9.230 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -3.218 11.706 -9.469 1.00 0.00 H new ATOM 227 N PHE A 84 -3.170 11.657 -6.919 1.00 0.00 N ATOM 228 CA PHE A 84 -3.288 11.340 -5.500 1.00 0.00 C ATOM 229 C PHE A 84 -4.511 10.467 -5.237 1.00 0.00 C ATOM 230 O PHE A 84 -5.609 10.971 -5.001 1.00 0.00 O ATOM 231 CB PHE A 84 -3.378 12.626 -4.675 1.00 0.00 C ATOM 232 CG PHE A 84 -2.924 12.459 -3.253 1.00 0.00 C ATOM 233 CD1 PHE A 84 -1.731 11.816 -2.964 1.00 0.00 C ATOM 234 CD2 PHE A 84 -3.690 12.944 -2.206 1.00 0.00 C ATOM 235 CE1 PHE A 84 -1.311 11.660 -1.657 1.00 0.00 C ATOM 236 CE2 PHE A 84 -3.275 12.791 -0.896 1.00 0.00 C ATOM 237 CZ PHE A 84 -2.084 12.150 -0.621 1.00 0.00 C ATOM 0 H PHE A 84 -3.880 12.300 -7.268 1.00 0.00 H new ATOM 0 HA PHE A 84 -2.398 10.786 -5.202 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -2.774 13.398 -5.153 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -4.409 12.980 -4.680 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -1.123 11.432 -3.770 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -4.622 13.448 -2.415 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -0.380 11.156 -1.445 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -3.882 13.173 -0.089 1.00 0.00 H new ATOM 0 HZ PHE A 84 -1.757 12.032 0.401 1.00 0.00 H new ATOM 247 N HIS A 85 -4.313 9.153 -5.281 1.00 0.00 N ATOM 248 CA HIS A 85 -5.399 8.208 -5.047 1.00 0.00 C ATOM 249 C HIS A 85 -5.252 7.537 -3.685 1.00 0.00 C ATOM 250 O HIS A 85 -4.148 7.176 -3.276 1.00 0.00 O ATOM 251 CB HIS A 85 -5.428 7.149 -6.150 1.00 0.00 C ATOM 252 CG HIS A 85 -5.356 7.722 -7.532 1.00 0.00 C ATOM 253 ND1 HIS A 85 -6.428 8.330 -8.151 1.00 0.00 N ATOM 254 CD2 HIS A 85 -4.332 7.778 -8.415 1.00 0.00 C ATOM 255 CE1 HIS A 85 -6.067 8.734 -9.356 1.00 0.00 C ATOM 256 NE2 HIS A 85 -4.799 8.411 -9.541 1.00 0.00 N ATOM 0 H HIS A 85 -3.411 8.719 -5.476 1.00 0.00 H new ATOM 0 HA HIS A 85 -6.338 8.761 -5.060 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -4.593 6.463 -6.006 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -6.342 6.563 -6.056 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -3.333 7.396 -8.263 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -6.700 9.242 -10.068 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -4.255 8.601 -10.383 1.00 0.00 H new ATOM 264 N TYR A 86 -6.370 7.373 -2.987 1.00 0.00 N ATOM 265 CA TYR A 86 -6.365 6.749 -1.670 1.00 0.00 C ATOM 266 C TYR A 86 -5.458 7.511 -0.709 1.00 0.00 C ATOM 267 O TYR A 86 -4.776 6.916 0.124 1.00 0.00 O ATOM 268 CB TYR A 86 -5.907 5.293 -1.774 1.00 0.00 C ATOM 269 CG TYR A 86 -6.523 4.546 -2.936 1.00 0.00 C ATOM 270 CD1 TYR A 86 -7.747 3.903 -2.802 1.00 0.00 C ATOM 271 CD2 TYR A 86 -5.881 4.482 -4.166 1.00 0.00 C ATOM 272 CE1 TYR A 86 -8.314 3.218 -3.860 1.00 0.00 C ATOM 273 CE2 TYR A 86 -6.440 3.802 -5.230 1.00 0.00 C ATOM 274 CZ TYR A 86 -7.657 3.171 -5.072 1.00 0.00 C ATOM 275 OH TYR A 86 -8.217 2.491 -6.129 1.00 0.00 O ATOM 0 H TYR A 86 -7.292 7.664 -3.312 1.00 0.00 H new ATOM 0 HA TYR A 86 -7.382 6.776 -1.280 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -4.822 5.268 -1.871 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -6.156 4.776 -0.847 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -8.264 3.939 -1.855 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -4.927 4.973 -4.293 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -9.266 2.722 -3.739 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -5.928 3.764 -6.180 1.00 0.00 H new ATOM 0 HH TYR A 86 -8.366 3.110 -6.874 1.00 0.00 H new ATOM 285 N GLY A 87 -5.458 8.835 -0.831 1.00 0.00 N ATOM 286 CA GLY A 87 -4.632 9.660 0.032 1.00 0.00 C ATOM 287 C GLY A 87 -3.158 9.332 -0.090 1.00 0.00 C ATOM 288 O GLY A 87 -2.368 9.649 0.799 1.00 0.00 O ATOM 0 H GLY A 87 -6.015 9.351 -1.512 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -4.789 10.710 -0.215 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -4.946 9.526 1.067 1.00 0.00 H new ATOM 292 N VAL A 88 -2.784 8.694 -1.195 1.00 0.00 N ATOM 293 CA VAL A 88 -1.394 8.322 -1.430 1.00 0.00 C ATOM 294 C VAL A 88 -1.012 8.524 -2.892 1.00 0.00 C ATOM 295 O VAL A 88 -1.787 8.212 -3.797 1.00 0.00 O ATOM 296 CB VAL A 88 -1.132 6.855 -1.040 1.00 0.00 C ATOM 297 CG1 VAL A 88 -2.151 5.937 -1.697 1.00 0.00 C ATOM 298 CG2 VAL A 88 0.285 6.450 -1.418 1.00 0.00 C ATOM 0 H VAL A 88 -3.425 8.424 -1.941 1.00 0.00 H new ATOM 0 HA VAL A 88 -0.782 8.971 -0.804 1.00 0.00 H new ATOM 0 HB VAL A 88 -1.238 6.759 0.041 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -1.950 4.905 -1.410 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -3.154 6.215 -1.372 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -2.081 6.032 -2.781 1.00 0.00 H new ATOM 0 HG21 VAL A 88 0.454 5.411 -1.136 1.00 0.00 H new ATOM 0 HG22 VAL A 88 0.420 6.560 -2.494 1.00 0.00 H new ATOM 0 HG23 VAL A 88 0.997 7.088 -0.896 1.00 0.00 H new ATOM 308 N HIS A 89 0.189 9.047 -3.117 1.00 0.00 N ATOM 309 CA HIS A 89 0.676 9.290 -4.471 1.00 0.00 C ATOM 310 C HIS A 89 1.013 7.977 -5.171 1.00 0.00 C ATOM 311 O HIS A 89 2.137 7.485 -5.081 1.00 0.00 O ATOM 312 CB HIS A 89 1.909 10.194 -4.437 1.00 0.00 C ATOM 313 CG HIS A 89 1.580 11.655 -4.465 1.00 0.00 C ATOM 314 ND1 HIS A 89 1.809 12.498 -3.397 1.00 0.00 N ATOM 315 CD2 HIS A 89 1.040 12.423 -5.439 1.00 0.00 C ATOM 316 CE1 HIS A 89 1.421 13.720 -3.713 1.00 0.00 C ATOM 317 NE2 HIS A 89 0.951 13.702 -4.948 1.00 0.00 N ATOM 0 H HIS A 89 0.843 9.311 -2.380 1.00 0.00 H new ATOM 0 HA HIS A 89 -0.115 9.788 -5.032 1.00 0.00 H new ATOM 0 HB2 HIS A 89 2.484 9.976 -3.537 1.00 0.00 H new ATOM 0 HB3 HIS A 89 2.547 9.957 -5.288 1.00 0.00 H new ATOM 0 HD2 HIS A 89 0.735 12.091 -6.421 1.00 0.00 H new ATOM 0 HE1 HIS A 89 1.478 14.587 -3.071 1.00 0.00 H new ATOM 0 HE2 HIS A 89 0.582 14.507 -5.454 1.00 0.00 H new ATOM 325 N ALA A 90 0.030 7.414 -5.866 1.00 0.00 N ATOM 326 CA ALA A 90 0.223 6.159 -6.582 1.00 0.00 C ATOM 327 C ALA A 90 0.053 6.352 -8.085 1.00 0.00 C ATOM 328 O ALA A 90 -0.364 7.418 -8.541 1.00 0.00 O ATOM 329 CB ALA A 90 -0.748 5.105 -6.071 1.00 0.00 C ATOM 0 H ALA A 90 -0.908 7.807 -5.948 1.00 0.00 H new ATOM 0 HA ALA A 90 1.242 5.818 -6.399 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -0.593 4.173 -6.615 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -0.577 4.938 -5.008 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -1.771 5.448 -6.224 1.00 0.00 H new ATOM 335 N CYS A 91 0.377 5.316 -8.851 1.00 0.00 N ATOM 336 CA CYS A 91 0.262 5.372 -10.303 1.00 0.00 C ATOM 337 C CYS A 91 -0.982 4.628 -10.779 1.00 0.00 C ATOM 338 O CYS A 91 -1.637 3.933 -10.002 1.00 0.00 O ATOM 339 CB CYS A 91 1.509 4.774 -10.958 1.00 0.00 C ATOM 340 SG CYS A 91 1.645 2.966 -10.785 1.00 0.00 S ATOM 0 H CYS A 91 0.722 4.427 -8.490 1.00 0.00 H new ATOM 0 HA CYS A 91 0.173 6.418 -10.595 1.00 0.00 H new ATOM 0 HB2 CYS A 91 1.507 5.028 -12.018 1.00 0.00 H new ATOM 0 HB3 CYS A 91 2.394 5.238 -10.521 1.00 0.00 H new ATOM 345 N GLU A 92 -1.302 4.779 -12.061 1.00 0.00 N ATOM 346 CA GLU A 92 -2.468 4.121 -12.639 1.00 0.00 C ATOM 347 C GLU A 92 -2.371 2.606 -12.484 1.00 0.00 C ATOM 348 O GLU A 92 -3.313 1.956 -12.033 1.00 0.00 O ATOM 349 CB GLU A 92 -2.605 4.486 -14.119 1.00 0.00 C ATOM 350 CG GLU A 92 -3.411 5.750 -14.362 1.00 0.00 C ATOM 351 CD GLU A 92 -4.906 5.493 -14.386 1.00 0.00 C ATOM 352 OE1 GLU A 92 -5.383 4.696 -13.551 1.00 0.00 O ATOM 353 OE2 GLU A 92 -5.597 6.088 -15.238 1.00 0.00 O ATOM 0 H GLU A 92 -0.771 5.350 -12.718 1.00 0.00 H new ATOM 0 HA GLU A 92 -3.352 4.467 -12.103 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.610 4.611 -14.547 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -3.077 3.657 -14.647 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -3.184 6.477 -13.582 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -3.107 6.194 -15.310 1.00 0.00 H new ATOM 360 N GLY A 93 -1.223 2.051 -12.863 1.00 0.00 N ATOM 361 CA GLY A 93 -1.024 0.617 -12.759 1.00 0.00 C ATOM 362 C GLY A 93 -1.389 0.078 -11.390 1.00 0.00 C ATOM 363 O GLY A 93 -2.407 -0.596 -11.231 1.00 0.00 O ATOM 0 H GLY A 93 -0.429 2.568 -13.240 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -1.626 0.114 -13.516 1.00 0.00 H new ATOM 0 HA3 GLY A 93 0.019 0.382 -12.972 1.00 0.00 H new ATOM 367 N CYS A 94 -0.555 0.374 -10.398 1.00 0.00 N ATOM 368 CA CYS A 94 -0.794 -0.087 -9.036 1.00 0.00 C ATOM 369 C CYS A 94 -2.269 0.040 -8.669 1.00 0.00 C ATOM 370 O CYS A 94 -2.908 -0.935 -8.271 1.00 0.00 O ATOM 371 CB CYS A 94 0.059 0.712 -8.048 1.00 0.00 C ATOM 372 SG CYS A 94 1.848 0.398 -8.186 1.00 0.00 S ATOM 0 H CYS A 94 0.292 0.931 -10.512 1.00 0.00 H new ATOM 0 HA CYS A 94 -0.514 -1.139 -8.981 1.00 0.00 H new ATOM 0 HB2 CYS A 94 -0.125 1.775 -8.203 1.00 0.00 H new ATOM 0 HB3 CYS A 94 -0.263 0.477 -7.034 1.00 0.00 H new ATOM 377 N LYS A 95 -2.806 1.247 -8.806 1.00 0.00 N ATOM 378 CA LYS A 95 -4.206 1.503 -8.491 1.00 0.00 C ATOM 379 C LYS A 95 -5.079 0.317 -8.887 1.00 0.00 C ATOM 380 O LYS A 95 -5.868 -0.181 -8.085 1.00 0.00 O ATOM 381 CB LYS A 95 -4.689 2.766 -9.208 1.00 0.00 C ATOM 382 CG LYS A 95 -6.195 2.955 -9.160 1.00 0.00 C ATOM 383 CD LYS A 95 -6.638 4.127 -10.020 1.00 0.00 C ATOM 384 CE LYS A 95 -6.570 5.438 -9.252 1.00 0.00 C ATOM 385 NZ LYS A 95 -7.825 5.704 -8.496 1.00 0.00 N ATOM 0 H LYS A 95 -2.292 2.065 -9.134 1.00 0.00 H new ATOM 0 HA LYS A 95 -4.289 1.649 -7.414 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -4.208 3.635 -8.759 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -4.369 2.727 -10.249 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.688 2.045 -9.502 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.509 3.120 -8.129 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -6.006 4.190 -10.906 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -7.658 3.960 -10.368 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -5.728 5.410 -8.560 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -6.384 6.257 -9.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -7.801 6.670 -8.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -8.641 5.605 -9.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -7.911 5.023 -7.715 1.00 0.00 H new ATOM 399 N GLY A 96 -4.930 -0.133 -10.130 1.00 0.00 N ATOM 400 CA GLY A 96 -5.710 -1.259 -10.609 1.00 0.00 C ATOM 401 C GLY A 96 -5.549 -2.489 -9.738 1.00 0.00 C ATOM 402 O GLY A 96 -6.532 -3.135 -9.376 1.00 0.00 O ATOM 0 H GLY A 96 -4.283 0.262 -10.813 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -6.763 -0.979 -10.645 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -5.409 -1.498 -11.629 1.00 0.00 H new ATOM 406 N PHE A 97 -4.305 -2.816 -9.403 1.00 0.00 N ATOM 407 CA PHE A 97 -4.019 -3.979 -8.571 1.00 0.00 C ATOM 408 C PHE A 97 -4.690 -3.850 -7.207 1.00 0.00 C ATOM 409 O PHE A 97 -5.453 -4.724 -6.793 1.00 0.00 O ATOM 410 CB PHE A 97 -2.508 -4.146 -8.394 1.00 0.00 C ATOM 411 CG PHE A 97 -2.135 -5.193 -7.385 1.00 0.00 C ATOM 412 CD1 PHE A 97 -2.073 -6.530 -7.744 1.00 0.00 C ATOM 413 CD2 PHE A 97 -1.845 -4.841 -6.076 1.00 0.00 C ATOM 414 CE1 PHE A 97 -1.731 -7.496 -6.816 1.00 0.00 C ATOM 415 CE2 PHE A 97 -1.501 -5.802 -5.144 1.00 0.00 C ATOM 416 CZ PHE A 97 -1.443 -7.131 -5.515 1.00 0.00 C ATOM 0 H PHE A 97 -3.480 -2.292 -9.695 1.00 0.00 H new ATOM 0 HA PHE A 97 -4.420 -4.860 -9.072 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -2.064 -4.405 -9.355 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -2.078 -3.191 -8.091 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.294 -6.821 -8.760 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -1.888 -3.803 -5.781 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -1.689 -8.535 -7.108 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -1.278 -5.514 -4.127 1.00 0.00 H new ATOM 0 HZ PHE A 97 -1.173 -7.884 -4.789 1.00 0.00 H new ATOM 426 N PHE A 98 -4.400 -2.756 -6.511 1.00 0.00 N ATOM 427 CA PHE A 98 -4.973 -2.513 -5.193 1.00 0.00 C ATOM 428 C PHE A 98 -6.494 -2.640 -5.229 1.00 0.00 C ATOM 429 O PHE A 98 -7.073 -3.488 -4.549 1.00 0.00 O ATOM 430 CB PHE A 98 -4.579 -1.123 -4.690 1.00 0.00 C ATOM 431 CG PHE A 98 -5.281 -0.721 -3.424 1.00 0.00 C ATOM 432 CD1 PHE A 98 -4.930 -1.291 -2.211 1.00 0.00 C ATOM 433 CD2 PHE A 98 -6.293 0.225 -3.448 1.00 0.00 C ATOM 434 CE1 PHE A 98 -5.574 -0.924 -1.044 1.00 0.00 C ATOM 435 CE2 PHE A 98 -6.940 0.596 -2.285 1.00 0.00 C ATOM 436 CZ PHE A 98 -6.581 0.020 -1.082 1.00 0.00 C ATOM 0 H PHE A 98 -3.771 -2.023 -6.838 1.00 0.00 H new ATOM 0 HA PHE A 98 -4.579 -3.265 -4.509 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -3.502 -1.098 -4.522 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -4.798 -0.389 -5.466 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -4.144 -2.031 -2.177 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.579 0.677 -4.386 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -5.290 -1.375 -0.105 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.726 1.336 -2.316 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.087 0.308 -0.172 1.00 0.00 H new ATOM 446 N ARG A 99 -7.134 -1.792 -6.027 1.00 0.00 N ATOM 447 CA ARG A 99 -8.586 -1.808 -6.152 1.00 0.00 C ATOM 448 C ARG A 99 -9.088 -3.210 -6.483 1.00 0.00 C ATOM 449 O ARG A 99 -9.962 -3.744 -5.801 1.00 0.00 O ATOM 450 CB ARG A 99 -9.037 -0.824 -7.233 1.00 0.00 C ATOM 451 CG ARG A 99 -10.547 -0.736 -7.385 1.00 0.00 C ATOM 452 CD ARG A 99 -10.959 0.515 -8.144 1.00 0.00 C ATOM 453 NE ARG A 99 -11.116 1.666 -7.258 1.00 0.00 N ATOM 454 CZ ARG A 99 -11.272 2.912 -7.692 1.00 0.00 C ATOM 455 NH1 ARG A 99 -11.293 3.166 -8.993 1.00 0.00 N ATOM 456 NH2 ARG A 99 -11.409 3.906 -6.824 1.00 0.00 N ATOM 0 H ARG A 99 -6.669 -1.085 -6.597 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.011 -1.506 -5.195 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -8.646 0.166 -6.998 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -8.601 -1.120 -8.187 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -10.913 -1.618 -7.910 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -11.013 -0.735 -6.400 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -10.210 0.741 -8.903 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -11.897 0.329 -8.667 1.00 0.00 H new ATOM 0 HE ARG A 99 -11.105 1.504 -6.251 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -11.189 2.404 -9.663 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -11.413 4.123 -9.324 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -11.395 3.714 -5.822 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -11.529 4.862 -7.158 1.00 0.00 H new ATOM 470 N ARG A 100 -8.529 -3.800 -7.535 1.00 0.00 N ATOM 471 CA ARG A 100 -8.922 -5.139 -7.958 1.00 0.00 C ATOM 472 C ARG A 100 -8.982 -6.090 -6.766 1.00 0.00 C ATOM 473 O ARG A 100 -9.954 -6.826 -6.593 1.00 0.00 O ATOM 474 CB ARG A 100 -7.940 -5.675 -9.002 1.00 0.00 C ATOM 475 CG ARG A 100 -8.203 -7.118 -9.401 1.00 0.00 C ATOM 476 CD ARG A 100 -7.522 -7.466 -10.715 1.00 0.00 C ATOM 477 NE ARG A 100 -8.015 -6.648 -11.820 1.00 0.00 N ATOM 478 CZ ARG A 100 -7.951 -7.019 -13.094 1.00 0.00 C ATOM 479 NH1 ARG A 100 -7.417 -8.187 -13.422 1.00 0.00 N ATOM 480 NH2 ARG A 100 -8.421 -6.220 -14.043 1.00 0.00 N ATOM 0 H ARG A 100 -7.803 -3.372 -8.110 1.00 0.00 H new ATOM 0 HA ARG A 100 -9.916 -5.076 -8.401 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -7.989 -5.046 -9.891 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -6.926 -5.594 -8.610 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -7.845 -7.785 -8.617 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -9.277 -7.281 -9.492 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -6.446 -7.327 -10.613 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -7.688 -8.519 -10.941 1.00 0.00 H new ATOM 0 HE ARG A 100 -8.431 -5.743 -11.602 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -7.054 -8.804 -12.695 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -7.369 -8.469 -14.401 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -8.832 -5.320 -13.795 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -8.371 -6.506 -15.021 1.00 0.00 H new ATOM 494 N THR A 101 -7.937 -6.068 -5.945 1.00 0.00 N ATOM 495 CA THR A 101 -7.870 -6.929 -4.770 1.00 0.00 C ATOM 496 C THR A 101 -9.013 -6.633 -3.806 1.00 0.00 C ATOM 497 O THR A 101 -9.565 -7.543 -3.186 1.00 0.00 O ATOM 498 CB THR A 101 -6.531 -6.762 -4.027 1.00 0.00 C ATOM 499 OG1 THR A 101 -5.440 -6.924 -4.940 1.00 0.00 O ATOM 500 CG2 THR A 101 -6.409 -7.775 -2.898 1.00 0.00 C ATOM 0 H THR A 101 -7.125 -5.463 -6.072 1.00 0.00 H new ATOM 0 HA THR A 101 -7.954 -7.956 -5.125 1.00 0.00 H new ATOM 0 HB THR A 101 -6.500 -5.760 -3.600 1.00 0.00 H new ATOM 0 HG1 THR A 101 -5.386 -6.141 -5.527 1.00 0.00 H new ATOM 0 HG21 THR A 101 -5.456 -7.638 -2.388 1.00 0.00 H new ATOM 0 HG22 THR A 101 -7.224 -7.630 -2.189 1.00 0.00 H new ATOM 0 HG23 THR A 101 -6.460 -8.784 -3.307 1.00 0.00 H new ATOM 508 N ILE A 102 -9.365 -5.358 -3.686 1.00 0.00 N ATOM 509 CA ILE A 102 -10.444 -4.944 -2.798 1.00 0.00 C ATOM 510 C ILE A 102 -11.803 -5.347 -3.360 1.00 0.00 C ATOM 511 O ILE A 102 -12.522 -6.146 -2.760 1.00 0.00 O ATOM 512 CB ILE A 102 -10.429 -3.421 -2.565 1.00 0.00 C ATOM 513 CG1 ILE A 102 -9.044 -2.969 -2.098 1.00 0.00 C ATOM 514 CG2 ILE A 102 -11.491 -3.030 -1.548 1.00 0.00 C ATOM 515 CD1 ILE A 102 -8.740 -3.337 -0.663 1.00 0.00 C ATOM 0 H ILE A 102 -8.919 -4.593 -4.193 1.00 0.00 H new ATOM 0 HA ILE A 102 -10.282 -5.451 -1.847 1.00 0.00 H new ATOM 0 HB ILE A 102 -10.655 -2.922 -3.507 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -8.288 -3.413 -2.746 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -8.966 -1.888 -2.212 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -11.468 -1.951 -1.394 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -12.474 -3.323 -1.917 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -11.293 -3.536 -0.603 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.742 -2.985 -0.401 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -9.473 -2.871 -0.005 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -8.785 -4.420 -0.548 1.00 0.00 H new ATOM 527 N ARG A 103 -12.148 -4.790 -4.517 1.00 0.00 N ATOM 528 CA ARG A 103 -13.420 -5.093 -5.161 1.00 0.00 C ATOM 529 C ARG A 103 -13.618 -6.600 -5.295 1.00 0.00 C ATOM 530 O ARG A 103 -14.726 -7.108 -5.125 1.00 0.00 O ATOM 531 CB ARG A 103 -13.487 -4.435 -6.541 1.00 0.00 C ATOM 532 CG ARG A 103 -12.519 -5.033 -7.548 1.00 0.00 C ATOM 533 CD ARG A 103 -12.636 -4.354 -8.904 1.00 0.00 C ATOM 534 NE ARG A 103 -12.198 -5.224 -9.992 1.00 0.00 N ATOM 535 CZ ARG A 103 -12.214 -4.867 -11.271 1.00 0.00 C ATOM 536 NH1 ARG A 103 -12.643 -3.662 -11.621 1.00 0.00 N ATOM 537 NH2 ARG A 103 -11.800 -5.715 -12.204 1.00 0.00 N ATOM 0 H ARG A 103 -11.564 -4.127 -5.027 1.00 0.00 H new ATOM 0 HA ARG A 103 -14.218 -4.694 -4.536 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -14.502 -4.525 -6.928 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -13.278 -3.370 -6.437 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -11.499 -4.934 -7.177 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -12.717 -6.099 -7.656 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -13.671 -4.057 -9.072 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -12.038 -3.443 -8.906 1.00 0.00 H new ATOM 0 HE ARG A 103 -11.861 -6.158 -9.757 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -12.962 -3.007 -10.907 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -12.654 -3.390 -12.604 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -11.469 -6.643 -11.939 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -11.813 -5.439 -13.186 1.00 0.00 H new ATOM 551 N MET A 104 -12.536 -7.308 -5.600 1.00 0.00 N ATOM 552 CA MET A 104 -12.590 -8.757 -5.756 1.00 0.00 C ATOM 553 C MET A 104 -12.372 -9.456 -4.418 1.00 0.00 C ATOM 554 O MET A 104 -12.575 -10.665 -4.296 1.00 0.00 O ATOM 555 CB MET A 104 -11.540 -9.223 -6.766 1.00 0.00 C ATOM 556 CG MET A 104 -11.709 -8.609 -8.146 1.00 0.00 C ATOM 557 SD MET A 104 -10.801 -9.504 -9.421 1.00 0.00 S ATOM 558 CE MET A 104 -11.495 -11.145 -9.241 1.00 0.00 C ATOM 0 H MET A 104 -11.611 -6.902 -5.744 1.00 0.00 H new ATOM 0 HA MET A 104 -13.581 -9.021 -6.126 1.00 0.00 H new ATOM 0 HB2 MET A 104 -10.548 -8.976 -6.387 1.00 0.00 H new ATOM 0 HB3 MET A 104 -11.587 -10.309 -6.852 1.00 0.00 H new ATOM 0 HG2 MET A 104 -12.768 -8.591 -8.404 1.00 0.00 H new ATOM 0 HG3 MET A 104 -11.369 -7.574 -8.123 1.00 0.00 H new ATOM 0 HE1 MET A 104 -11.726 -11.552 -10.225 1.00 0.00 H new ATOM 0 HE2 MET A 104 -10.775 -11.792 -8.740 1.00 0.00 H new ATOM 0 HE3 MET A 104 -12.408 -11.091 -8.648 1.00 0.00 H new ATOM 568 N LYS A 105 -11.956 -8.689 -3.416 1.00 0.00 N ATOM 569 CA LYS A 105 -11.710 -9.234 -2.086 1.00 0.00 C ATOM 570 C LYS A 105 -10.832 -10.479 -2.161 1.00 0.00 C ATOM 571 O LYS A 105 -11.149 -11.512 -1.570 1.00 0.00 O ATOM 572 CB LYS A 105 -13.035 -9.573 -1.398 1.00 0.00 C ATOM 573 CG LYS A 105 -13.753 -8.361 -0.832 1.00 0.00 C ATOM 574 CD LYS A 105 -14.862 -8.766 0.124 1.00 0.00 C ATOM 575 CE LYS A 105 -14.309 -9.157 1.486 1.00 0.00 C ATOM 576 NZ LYS A 105 -15.382 -9.251 2.515 1.00 0.00 N ATOM 0 H LYS A 105 -11.782 -7.687 -3.500 1.00 0.00 H new ATOM 0 HA LYS A 105 -11.187 -8.477 -1.502 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -13.689 -10.071 -2.113 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -12.845 -10.282 -0.592 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -13.038 -7.723 -0.312 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -14.172 -7.771 -1.648 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -15.564 -7.940 0.239 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -15.419 -9.603 -0.297 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.796 -10.116 1.408 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -13.567 -8.423 1.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -14.964 -9.520 3.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.855 -8.330 2.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -16.077 -9.969 2.227 1.00 0.00 H new ATOM 590 N LEU A 106 -9.726 -10.374 -2.890 1.00 0.00 N ATOM 591 CA LEU A 106 -8.800 -11.491 -3.042 1.00 0.00 C ATOM 592 C LEU A 106 -7.818 -11.546 -1.876 1.00 0.00 C ATOM 593 O LEU A 106 -7.735 -10.613 -1.078 1.00 0.00 O ATOM 594 CB LEU A 106 -8.036 -11.370 -4.361 1.00 0.00 C ATOM 595 CG LEU A 106 -8.891 -11.282 -5.626 1.00 0.00 C ATOM 596 CD1 LEU A 106 -8.034 -10.903 -6.824 1.00 0.00 C ATOM 597 CD2 LEU A 106 -9.609 -12.599 -5.877 1.00 0.00 C ATOM 0 H LEU A 106 -9.449 -9.526 -3.385 1.00 0.00 H new ATOM 0 HA LEU A 106 -9.380 -12.414 -3.049 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -7.404 -10.484 -4.312 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -7.373 -12.230 -4.454 1.00 0.00 H new ATOM 0 HG LEU A 106 -9.641 -10.504 -5.481 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -8.659 -10.845 -7.715 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -7.567 -9.935 -6.645 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -7.261 -11.657 -6.972 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -10.213 -12.518 -6.781 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -8.875 -13.396 -6.001 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -10.254 -12.829 -5.029 1.00 0.00 H new ATOM 609 N GLU A 107 -7.076 -12.645 -1.785 1.00 0.00 N ATOM 610 CA GLU A 107 -6.099 -12.821 -0.717 1.00 0.00 C ATOM 611 C GLU A 107 -4.875 -13.582 -1.219 1.00 0.00 C ATOM 612 O GLU A 107 -4.936 -14.278 -2.232 1.00 0.00 O ATOM 613 CB GLU A 107 -6.728 -13.565 0.463 1.00 0.00 C ATOM 614 CG GLU A 107 -7.459 -12.656 1.436 1.00 0.00 C ATOM 615 CD GLU A 107 -8.311 -13.426 2.426 1.00 0.00 C ATOM 616 OE1 GLU A 107 -7.736 -14.100 3.307 1.00 0.00 O ATOM 617 OE2 GLU A 107 -9.554 -13.355 2.321 1.00 0.00 O ATOM 0 H GLU A 107 -7.133 -13.427 -2.438 1.00 0.00 H new ATOM 0 HA GLU A 107 -5.780 -11.833 -0.385 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -7.426 -14.310 0.081 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.947 -14.104 0.999 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.732 -12.053 1.980 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -8.092 -11.966 0.878 1.00 0.00 H new ATOM 624 N TYR A 108 -3.765 -13.443 -0.502 1.00 0.00 N ATOM 625 CA TYR A 108 -2.526 -14.115 -0.875 1.00 0.00 C ATOM 626 C TYR A 108 -1.800 -14.643 0.358 1.00 0.00 C ATOM 627 O TYR A 108 -2.173 -14.336 1.490 1.00 0.00 O ATOM 628 CB TYR A 108 -1.615 -13.158 -1.647 1.00 0.00 C ATOM 629 CG TYR A 108 -2.297 -12.484 -2.815 1.00 0.00 C ATOM 630 CD1 TYR A 108 -2.442 -13.137 -4.033 1.00 0.00 C ATOM 631 CD2 TYR A 108 -2.798 -11.192 -2.702 1.00 0.00 C ATOM 632 CE1 TYR A 108 -3.063 -12.524 -5.103 1.00 0.00 C ATOM 633 CE2 TYR A 108 -3.423 -10.572 -3.767 1.00 0.00 C ATOM 634 CZ TYR A 108 -3.552 -11.242 -4.965 1.00 0.00 C ATOM 635 OH TYR A 108 -4.173 -10.628 -6.029 1.00 0.00 O ATOM 0 H TYR A 108 -3.698 -12.871 0.340 1.00 0.00 H new ATOM 0 HA TYR A 108 -2.779 -14.961 -1.515 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -1.243 -12.394 -0.964 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -0.748 -13.709 -2.012 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -2.062 -14.142 -4.145 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -2.697 -10.664 -1.765 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.165 -13.046 -6.043 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -3.808 -9.569 -3.662 1.00 0.00 H new ATOM 0 HH TYR A 108 -4.460 -9.729 -5.766 1.00 0.00 H new ATOM 645 N GLU A 109 -0.759 -15.438 0.129 1.00 0.00 N ATOM 646 CA GLU A 109 0.020 -16.008 1.222 1.00 0.00 C ATOM 647 C GLU A 109 0.976 -14.973 1.807 1.00 0.00 C ATOM 648 O GLU A 109 1.641 -14.241 1.075 1.00 0.00 O ATOM 649 CB GLU A 109 0.807 -17.227 0.734 1.00 0.00 C ATOM 650 CG GLU A 109 1.966 -16.875 -0.184 1.00 0.00 C ATOM 651 CD GLU A 109 2.346 -18.016 -1.107 1.00 0.00 C ATOM 652 OE1 GLU A 109 3.132 -18.888 -0.682 1.00 0.00 O ATOM 653 OE2 GLU A 109 1.856 -18.037 -2.256 1.00 0.00 O ATOM 0 H GLU A 109 -0.436 -15.701 -0.802 1.00 0.00 H new ATOM 0 HA GLU A 109 -0.672 -16.320 2.004 1.00 0.00 H new ATOM 0 HB2 GLU A 109 1.190 -17.771 1.597 1.00 0.00 H new ATOM 0 HB3 GLU A 109 0.129 -17.900 0.208 1.00 0.00 H new ATOM 0 HG2 GLU A 109 1.700 -16.003 -0.781 1.00 0.00 H new ATOM 0 HG3 GLU A 109 2.831 -16.597 0.419 1.00 0.00 H new ATOM 660 N LYS A 110 1.038 -14.917 3.133 1.00 0.00 N ATOM 661 CA LYS A 110 1.912 -13.973 3.820 1.00 0.00 C ATOM 662 C LYS A 110 3.355 -14.127 3.350 1.00 0.00 C ATOM 663 O LYS A 110 3.849 -15.242 3.182 1.00 0.00 O ATOM 664 CB LYS A 110 1.833 -14.182 5.334 1.00 0.00 C ATOM 665 CG LYS A 110 2.192 -12.944 6.138 1.00 0.00 C ATOM 666 CD LYS A 110 1.973 -13.162 7.625 1.00 0.00 C ATOM 667 CE LYS A 110 0.501 -13.055 7.994 1.00 0.00 C ATOM 668 NZ LYS A 110 0.311 -12.801 9.449 1.00 0.00 N ATOM 0 H LYS A 110 0.493 -15.515 3.754 1.00 0.00 H new ATOM 0 HA LYS A 110 1.576 -12.964 3.580 1.00 0.00 H new ATOM 0 HB2 LYS A 110 0.823 -14.495 5.597 1.00 0.00 H new ATOM 0 HB3 LYS A 110 2.502 -14.995 5.616 1.00 0.00 H new ATOM 0 HG2 LYS A 110 3.234 -12.682 5.958 1.00 0.00 H new ATOM 0 HG3 LYS A 110 1.588 -12.102 5.800 1.00 0.00 H new ATOM 0 HD2 LYS A 110 2.350 -14.145 7.909 1.00 0.00 H new ATOM 0 HD3 LYS A 110 2.545 -12.426 8.190 1.00 0.00 H new ATOM 0 HE2 LYS A 110 0.041 -12.250 7.422 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -0.011 -13.976 7.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -0.705 -12.735 9.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 0.728 -13.582 9.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 0.778 -11.909 9.709 1.00 0.00 H new ATOM 682 N CYS A 111 4.027 -13.000 3.140 1.00 0.00 N ATOM 683 CA CYS A 111 5.414 -13.008 2.691 1.00 0.00 C ATOM 684 C CYS A 111 6.297 -12.200 3.637 1.00 0.00 C ATOM 685 O CYS A 111 6.178 -10.978 3.722 1.00 0.00 O ATOM 686 CB CYS A 111 5.516 -12.442 1.273 1.00 0.00 C ATOM 687 SG CYS A 111 7.181 -12.559 0.544 1.00 0.00 S ATOM 0 H CYS A 111 3.633 -12.069 3.274 1.00 0.00 H new ATOM 0 HA CYS A 111 5.763 -14.041 2.689 1.00 0.00 H new ATOM 0 HB2 CYS A 111 4.812 -12.971 0.631 1.00 0.00 H new ATOM 0 HB3 CYS A 111 5.210 -11.396 1.288 1.00 0.00 H new ATOM 692 N GLU A 112 7.184 -12.892 4.346 1.00 0.00 N ATOM 693 CA GLU A 112 8.087 -12.239 5.286 1.00 0.00 C ATOM 694 C GLU A 112 9.214 -11.521 4.549 1.00 0.00 C ATOM 695 O GLU A 112 9.643 -10.440 4.952 1.00 0.00 O ATOM 696 CB GLU A 112 8.671 -13.263 6.262 1.00 0.00 C ATOM 697 CG GLU A 112 7.661 -13.793 7.266 1.00 0.00 C ATOM 698 CD GLU A 112 8.312 -14.570 8.393 1.00 0.00 C ATOM 699 OE1 GLU A 112 8.939 -15.613 8.111 1.00 0.00 O ATOM 700 OE2 GLU A 112 8.194 -14.136 9.558 1.00 0.00 O ATOM 0 H GLU A 112 7.296 -13.904 4.287 1.00 0.00 H new ATOM 0 HA GLU A 112 7.514 -11.500 5.846 1.00 0.00 H new ATOM 0 HB2 GLU A 112 9.081 -14.099 5.696 1.00 0.00 H new ATOM 0 HB3 GLU A 112 9.501 -12.806 6.801 1.00 0.00 H new ATOM 0 HG2 GLU A 112 7.097 -12.959 7.683 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.946 -14.436 6.752 1.00 0.00 H new ATOM 707 N ARG A 113 9.689 -12.132 3.469 1.00 0.00 N ATOM 708 CA ARG A 113 10.767 -11.553 2.676 1.00 0.00 C ATOM 709 C ARG A 113 10.543 -10.059 2.463 1.00 0.00 C ATOM 710 O ARG A 113 11.490 -9.304 2.243 1.00 0.00 O ATOM 711 CB ARG A 113 10.872 -12.261 1.324 1.00 0.00 C ATOM 712 CG ARG A 113 11.508 -13.639 1.406 1.00 0.00 C ATOM 713 CD ARG A 113 11.950 -14.131 0.037 1.00 0.00 C ATOM 714 NE ARG A 113 13.004 -13.295 -0.532 1.00 0.00 N ATOM 715 CZ ARG A 113 14.286 -13.402 -0.201 1.00 0.00 C ATOM 716 NH1 ARG A 113 14.671 -14.305 0.690 1.00 0.00 N ATOM 717 NH2 ARG A 113 15.186 -12.604 -0.762 1.00 0.00 N ATOM 0 H ARG A 113 9.345 -13.028 3.123 1.00 0.00 H new ATOM 0 HA ARG A 113 11.700 -11.689 3.223 1.00 0.00 H new ATOM 0 HB2 ARG A 113 9.875 -12.355 0.894 1.00 0.00 H new ATOM 0 HB3 ARG A 113 11.455 -11.641 0.643 1.00 0.00 H new ATOM 0 HG2 ARG A 113 12.367 -13.605 2.076 1.00 0.00 H new ATOM 0 HG3 ARG A 113 10.796 -14.344 1.835 1.00 0.00 H new ATOM 0 HD2 ARG A 113 12.306 -15.158 0.119 1.00 0.00 H new ATOM 0 HD3 ARG A 113 11.094 -14.144 -0.637 1.00 0.00 H new ATOM 0 HE ARG A 113 12.741 -12.590 -1.221 1.00 0.00 H new ATOM 0 HH11 ARG A 113 13.982 -14.920 1.123 1.00 0.00 H new ATOM 0 HH12 ARG A 113 15.656 -14.385 0.942 1.00 0.00 H new ATOM 0 HH21 ARG A 113 14.893 -11.908 -1.448 1.00 0.00 H new ATOM 0 HH22 ARG A 113 16.170 -12.687 -0.507 1.00 0.00 H new ATOM 731 N SER A 114 9.284 -9.638 2.530 1.00 0.00 N ATOM 732 CA SER A 114 8.935 -8.235 2.341 1.00 0.00 C ATOM 733 C SER A 114 9.536 -7.696 1.046 1.00 0.00 C ATOM 734 O SER A 114 10.104 -6.604 1.019 1.00 0.00 O ATOM 735 CB SER A 114 9.421 -7.402 3.528 1.00 0.00 C ATOM 736 OG SER A 114 8.545 -7.530 4.634 1.00 0.00 O ATOM 0 H SER A 114 8.488 -10.249 2.714 1.00 0.00 H new ATOM 0 HA SER A 114 7.849 -8.162 2.276 1.00 0.00 H new ATOM 0 HB2 SER A 114 10.423 -7.722 3.815 1.00 0.00 H new ATOM 0 HB3 SER A 114 9.492 -6.354 3.236 1.00 0.00 H new ATOM 0 HG SER A 114 8.636 -8.426 5.021 1.00 0.00 H new ATOM 742 N CYS A 115 9.406 -8.470 -0.026 1.00 0.00 N ATOM 743 CA CYS A 115 9.936 -8.073 -1.325 1.00 0.00 C ATOM 744 C CYS A 115 9.764 -6.573 -1.547 1.00 0.00 C ATOM 745 O CYS A 115 8.856 -5.953 -0.995 1.00 0.00 O ATOM 746 CB CYS A 115 9.237 -8.849 -2.443 1.00 0.00 C ATOM 747 SG CYS A 115 9.062 -10.632 -2.113 1.00 0.00 S ATOM 0 H CYS A 115 8.938 -9.376 -0.021 1.00 0.00 H new ATOM 0 HA CYS A 115 11.001 -8.305 -1.342 1.00 0.00 H new ATOM 0 HB2 CYS A 115 8.247 -8.421 -2.604 1.00 0.00 H new ATOM 0 HB3 CYS A 115 9.797 -8.715 -3.369 1.00 0.00 H new ATOM 752 N LYS A 116 10.642 -5.997 -2.361 1.00 0.00 N ATOM 753 CA LYS A 116 10.588 -4.571 -2.659 1.00 0.00 C ATOM 754 C LYS A 116 9.876 -4.318 -3.983 1.00 0.00 C ATOM 755 O LYS A 116 10.412 -4.611 -5.053 1.00 0.00 O ATOM 756 CB LYS A 116 12.001 -3.985 -2.708 1.00 0.00 C ATOM 757 CG LYS A 116 12.542 -3.587 -1.346 1.00 0.00 C ATOM 758 CD LYS A 116 13.513 -2.422 -1.450 1.00 0.00 C ATOM 759 CE LYS A 116 13.899 -1.894 -0.077 1.00 0.00 C ATOM 760 NZ LYS A 116 12.749 -1.247 0.613 1.00 0.00 N ATOM 0 H LYS A 116 11.400 -6.496 -2.826 1.00 0.00 H new ATOM 0 HA LYS A 116 10.025 -4.081 -1.865 1.00 0.00 H new ATOM 0 HB2 LYS A 116 12.673 -4.716 -3.157 1.00 0.00 H new ATOM 0 HB3 LYS A 116 12.000 -3.111 -3.359 1.00 0.00 H new ATOM 0 HG2 LYS A 116 11.715 -3.315 -0.690 1.00 0.00 H new ATOM 0 HG3 LYS A 116 13.044 -4.440 -0.889 1.00 0.00 H new ATOM 0 HD2 LYS A 116 14.409 -2.740 -1.984 1.00 0.00 H new ATOM 0 HD3 LYS A 116 13.061 -1.621 -2.035 1.00 0.00 H new ATOM 0 HE2 LYS A 116 14.275 -2.714 0.535 1.00 0.00 H new ATOM 0 HE3 LYS A 116 14.712 -1.175 -0.180 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 13.099 -0.671 1.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 12.239 -0.639 -0.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 12.105 -1.979 0.975 1.00 0.00 H new ATOM 774 N ILE A 117 8.667 -3.772 -3.905 1.00 0.00 N ATOM 775 CA ILE A 117 7.883 -3.478 -5.098 1.00 0.00 C ATOM 776 C ILE A 117 8.489 -2.320 -5.883 1.00 0.00 C ATOM 777 O ILE A 117 8.444 -1.171 -5.445 1.00 0.00 O ATOM 778 CB ILE A 117 6.424 -3.136 -4.743 1.00 0.00 C ATOM 779 CG1 ILE A 117 5.807 -4.251 -3.897 1.00 0.00 C ATOM 780 CG2 ILE A 117 5.610 -2.911 -6.009 1.00 0.00 C ATOM 781 CD1 ILE A 117 5.643 -5.556 -4.645 1.00 0.00 C ATOM 0 H ILE A 117 8.209 -3.524 -3.028 1.00 0.00 H new ATOM 0 HA ILE A 117 7.897 -4.377 -5.714 1.00 0.00 H new ATOM 0 HB ILE A 117 6.414 -2.216 -4.159 1.00 0.00 H new ATOM 0 HG12 ILE A 117 6.433 -4.420 -3.021 1.00 0.00 H new ATOM 0 HG13 ILE A 117 4.832 -3.924 -3.535 1.00 0.00 H new ATOM 0 HG21 ILE A 117 4.581 -2.670 -5.742 1.00 0.00 H new ATOM 0 HG22 ILE A 117 6.040 -2.086 -6.576 1.00 0.00 H new ATOM 0 HG23 ILE A 117 5.625 -3.816 -6.617 1.00 0.00 H new ATOM 0 HD11 ILE A 117 5.200 -6.301 -3.984 1.00 0.00 H new ATOM 0 HD12 ILE A 117 4.993 -5.403 -5.506 1.00 0.00 H new ATOM 0 HD13 ILE A 117 6.618 -5.906 -4.984 1.00 0.00 H new ATOM 793 N GLN A 118 9.055 -2.630 -7.045 1.00 0.00 N ATOM 794 CA GLN A 118 9.669 -1.614 -7.891 1.00 0.00 C ATOM 795 C GLN A 118 9.048 -1.618 -9.284 1.00 0.00 C ATOM 796 O GLN A 118 8.418 -2.593 -9.692 1.00 0.00 O ATOM 797 CB GLN A 118 11.178 -1.847 -7.991 1.00 0.00 C ATOM 798 CG GLN A 118 11.945 -1.408 -6.754 1.00 0.00 C ATOM 799 CD GLN A 118 13.447 -1.451 -6.953 1.00 0.00 C ATOM 800 OE1 GLN A 118 13.964 -0.986 -7.969 1.00 0.00 O ATOM 801 NE2 GLN A 118 14.157 -2.011 -5.981 1.00 0.00 N ATOM 0 H GLN A 118 9.101 -3.577 -7.422 1.00 0.00 H new ATOM 0 HA GLN A 118 9.489 -0.640 -7.436 1.00 0.00 H new ATOM 0 HB2 GLN A 118 11.363 -2.907 -8.166 1.00 0.00 H new ATOM 0 HB3 GLN A 118 11.564 -1.309 -8.857 1.00 0.00 H new ATOM 0 HG2 GLN A 118 11.647 -0.394 -6.487 1.00 0.00 H new ATOM 0 HG3 GLN A 118 11.675 -2.051 -5.916 1.00 0.00 H new ATOM 0 HE21 GLN A 118 13.687 -2.384 -5.156 1.00 0.00 H new ATOM 0 HE22 GLN A 118 15.172 -2.068 -6.059 1.00 0.00 H new ATOM 810 N LYS A 119 9.231 -0.520 -10.010 1.00 0.00 N ATOM 811 CA LYS A 119 8.690 -0.396 -11.359 1.00 0.00 C ATOM 812 C LYS A 119 8.807 -1.715 -12.115 1.00 0.00 C ATOM 813 O LYS A 119 7.831 -2.205 -12.684 1.00 0.00 O ATOM 814 CB LYS A 119 9.422 0.709 -12.124 1.00 0.00 C ATOM 815 CG LYS A 119 8.762 1.076 -13.442 1.00 0.00 C ATOM 816 CD LYS A 119 9.705 1.861 -14.338 1.00 0.00 C ATOM 817 CE LYS A 119 10.559 0.938 -15.194 1.00 0.00 C ATOM 818 NZ LYS A 119 9.776 0.331 -16.306 1.00 0.00 N ATOM 0 H LYS A 119 9.750 0.297 -9.687 1.00 0.00 H new ATOM 0 HA LYS A 119 7.635 -0.136 -11.278 1.00 0.00 H new ATOM 0 HB2 LYS A 119 9.479 1.598 -11.496 1.00 0.00 H new ATOM 0 HB3 LYS A 119 10.446 0.389 -12.317 1.00 0.00 H new ATOM 0 HG2 LYS A 119 8.442 0.169 -13.955 1.00 0.00 H new ATOM 0 HG3 LYS A 119 7.866 1.666 -13.249 1.00 0.00 H new ATOM 0 HD2 LYS A 119 9.128 2.525 -14.982 1.00 0.00 H new ATOM 0 HD3 LYS A 119 10.350 2.491 -13.726 1.00 0.00 H new ATOM 0 HE2 LYS A 119 11.399 1.498 -15.605 1.00 0.00 H new ATOM 0 HE3 LYS A 119 10.977 0.148 -14.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 10.426 -0.109 -16.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 9.134 -0.392 -15.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 9.221 1.070 -16.783 1.00 0.00 H new ATOM 832 N LYS A 120 10.006 -2.287 -12.117 1.00 0.00 N ATOM 833 CA LYS A 120 10.250 -3.551 -12.801 1.00 0.00 C ATOM 834 C LYS A 120 9.787 -4.729 -11.950 1.00 0.00 C ATOM 835 O LYS A 120 9.094 -5.622 -12.434 1.00 0.00 O ATOM 836 CB LYS A 120 11.738 -3.698 -13.129 1.00 0.00 C ATOM 837 CG LYS A 120 12.252 -2.656 -14.106 1.00 0.00 C ATOM 838 CD LYS A 120 11.975 -3.057 -15.546 1.00 0.00 C ATOM 839 CE LYS A 120 13.002 -2.463 -16.497 1.00 0.00 C ATOM 840 NZ LYS A 120 12.940 -3.093 -17.845 1.00 0.00 N ATOM 0 H LYS A 120 10.825 -1.895 -11.652 1.00 0.00 H new ATOM 0 HA LYS A 120 9.678 -3.550 -13.729 1.00 0.00 H new ATOM 0 HB2 LYS A 120 12.313 -3.632 -12.205 1.00 0.00 H new ATOM 0 HB3 LYS A 120 11.913 -4.691 -13.544 1.00 0.00 H new ATOM 0 HG2 LYS A 120 11.780 -1.696 -13.897 1.00 0.00 H new ATOM 0 HG3 LYS A 120 13.324 -2.521 -13.965 1.00 0.00 H new ATOM 0 HD2 LYS A 120 11.985 -4.144 -15.631 1.00 0.00 H new ATOM 0 HD3 LYS A 120 10.977 -2.724 -15.832 1.00 0.00 H new ATOM 0 HE2 LYS A 120 12.833 -1.390 -16.590 1.00 0.00 H new ATOM 0 HE3 LYS A 120 14.001 -2.594 -16.081 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 13.656 -2.661 -18.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 13.126 -4.113 -17.761 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 11.995 -2.946 -18.254 1.00 0.00 H new ATOM 854 N ASN A 121 10.175 -4.723 -10.678 1.00 0.00 N ATOM 855 CA ASN A 121 9.799 -5.791 -9.759 1.00 0.00 C ATOM 856 C ASN A 121 8.401 -5.554 -9.194 1.00 0.00 C ATOM 857 O ASN A 121 8.172 -5.710 -7.994 1.00 0.00 O ATOM 858 CB ASN A 121 10.813 -5.891 -8.618 1.00 0.00 C ATOM 859 CG ASN A 121 12.235 -5.645 -9.084 1.00 0.00 C ATOM 860 OD1 ASN A 121 12.706 -4.508 -9.102 1.00 0.00 O ATOM 861 ND2 ASN A 121 12.925 -6.714 -9.466 1.00 0.00 N ATOM 0 H ASN A 121 10.749 -3.990 -10.261 1.00 0.00 H new ATOM 0 HA ASN A 121 9.794 -6.729 -10.313 1.00 0.00 H new ATOM 0 HB2 ASN A 121 10.557 -5.168 -7.844 1.00 0.00 H new ATOM 0 HB3 ASN A 121 10.748 -6.880 -8.164 1.00 0.00 H new ATOM 0 HD21 ASN A 121 13.886 -6.611 -9.791 1.00 0.00 H new ATOM 0 HD22 ASN A 121 12.493 -7.638 -9.434 1.00 0.00 H new ATOM 868 N ARG A 122 7.472 -5.178 -10.066 1.00 0.00 N ATOM 869 CA ARG A 122 6.097 -4.920 -9.654 1.00 0.00 C ATOM 870 C ARG A 122 5.300 -6.219 -9.577 1.00 0.00 C ATOM 871 O ARG A 122 4.646 -6.498 -8.573 1.00 0.00 O ATOM 872 CB ARG A 122 5.424 -3.952 -10.629 1.00 0.00 C ATOM 873 CG ARG A 122 4.161 -3.312 -10.076 1.00 0.00 C ATOM 874 CD ARG A 122 3.443 -2.491 -11.136 1.00 0.00 C ATOM 875 NE ARG A 122 2.905 -3.329 -12.205 1.00 0.00 N ATOM 876 CZ ARG A 122 1.964 -2.926 -13.051 1.00 0.00 C ATOM 877 NH1 ARG A 122 1.459 -1.704 -12.953 1.00 0.00 N ATOM 878 NH2 ARG A 122 1.526 -3.746 -13.998 1.00 0.00 N ATOM 0 H ARG A 122 7.646 -5.045 -11.062 1.00 0.00 H new ATOM 0 HA ARG A 122 6.119 -4.469 -8.662 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.132 -3.167 -10.896 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.179 -4.486 -11.547 1.00 0.00 H new ATOM 0 HG2 ARG A 122 3.493 -4.087 -9.700 1.00 0.00 H new ATOM 0 HG3 ARG A 122 4.416 -2.673 -9.230 1.00 0.00 H new ATOM 0 HD2 ARG A 122 2.632 -1.930 -10.672 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.134 -1.762 -11.560 1.00 0.00 H new ATOM 0 HE ARG A 122 3.272 -4.275 -12.307 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.793 -1.071 -12.226 1.00 0.00 H new ATOM 0 HH12 ARG A 122 0.736 -1.397 -13.604 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.912 -4.687 -14.077 1.00 0.00 H new ATOM 0 HH22 ARG A 122 0.803 -3.435 -14.647 1.00 0.00 H new ATOM 892 N ASN A 123 5.359 -7.008 -10.645 1.00 0.00 N ATOM 893 CA ASN A 123 4.641 -8.276 -10.698 1.00 0.00 C ATOM 894 C ASN A 123 5.515 -9.417 -10.187 1.00 0.00 C ATOM 895 O ASN A 123 5.496 -10.521 -10.732 1.00 0.00 O ATOM 896 CB ASN A 123 4.187 -8.569 -12.130 1.00 0.00 C ATOM 897 CG ASN A 123 3.442 -7.403 -12.750 1.00 0.00 C ATOM 898 OD1 ASN A 123 3.897 -6.260 -12.694 1.00 0.00 O ATOM 899 ND2 ASN A 123 2.289 -7.687 -13.345 1.00 0.00 N ATOM 0 H ASN A 123 5.896 -6.792 -11.485 1.00 0.00 H new ATOM 0 HA ASN A 123 3.765 -8.196 -10.055 1.00 0.00 H new ATOM 0 HB2 ASN A 123 5.057 -8.808 -12.742 1.00 0.00 H new ATOM 0 HB3 ASN A 123 3.544 -9.449 -12.132 1.00 0.00 H new ATOM 0 HD21 ASN A 123 1.742 -6.943 -13.779 1.00 0.00 H new ATOM 0 HD22 ASN A 123 1.950 -8.649 -13.368 1.00 0.00 H new ATOM 906 N LYS A 124 6.279 -9.144 -9.135 1.00 0.00 N ATOM 907 CA LYS A 124 7.159 -10.147 -8.547 1.00 0.00 C ATOM 908 C LYS A 124 6.446 -10.911 -7.436 1.00 0.00 C ATOM 909 O LYS A 124 6.342 -12.138 -7.480 1.00 0.00 O ATOM 910 CB LYS A 124 8.424 -9.485 -7.994 1.00 0.00 C ATOM 911 CG LYS A 124 9.494 -10.476 -7.570 1.00 0.00 C ATOM 912 CD LYS A 124 10.608 -9.795 -6.793 1.00 0.00 C ATOM 913 CE LYS A 124 11.910 -10.575 -6.888 1.00 0.00 C ATOM 914 NZ LYS A 124 11.997 -11.638 -5.849 1.00 0.00 N ATOM 0 H LYS A 124 6.307 -8.236 -8.672 1.00 0.00 H new ATOM 0 HA LYS A 124 7.438 -10.853 -9.329 1.00 0.00 H new ATOM 0 HB2 LYS A 124 8.837 -8.820 -8.752 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.155 -8.865 -7.139 1.00 0.00 H new ATOM 0 HG2 LYS A 124 9.045 -11.257 -6.956 1.00 0.00 H new ATOM 0 HG3 LYS A 124 9.910 -10.964 -8.452 1.00 0.00 H new ATOM 0 HD2 LYS A 124 10.758 -8.786 -7.178 1.00 0.00 H new ATOM 0 HD3 LYS A 124 10.317 -9.697 -5.747 1.00 0.00 H new ATOM 0 HE2 LYS A 124 11.992 -11.026 -7.877 1.00 0.00 H new ATOM 0 HE3 LYS A 124 12.752 -9.891 -6.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 12.899 -12.147 -5.947 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 11.945 -11.206 -4.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 11.208 -12.305 -5.968 1.00 0.00 H new ATOM 928 N CYS A 125 5.956 -10.180 -6.441 1.00 0.00 N ATOM 929 CA CYS A 125 5.251 -10.789 -5.319 1.00 0.00 C ATOM 930 C CYS A 125 3.803 -10.313 -5.264 1.00 0.00 C ATOM 931 O CYS A 125 3.503 -9.166 -5.595 1.00 0.00 O ATOM 932 CB CYS A 125 5.959 -10.456 -4.004 1.00 0.00 C ATOM 933 SG CYS A 125 5.332 -11.382 -2.566 1.00 0.00 S ATOM 0 H CYS A 125 6.034 -9.164 -6.388 1.00 0.00 H new ATOM 0 HA CYS A 125 5.255 -11.869 -5.463 1.00 0.00 H new ATOM 0 HB2 CYS A 125 7.024 -10.658 -4.116 1.00 0.00 H new ATOM 0 HB3 CYS A 125 5.856 -9.389 -3.808 1.00 0.00 H new ATOM 938 N GLN A 126 2.909 -11.203 -4.843 1.00 0.00 N ATOM 939 CA GLN A 126 1.492 -10.874 -4.745 1.00 0.00 C ATOM 940 C GLN A 126 1.170 -10.252 -3.390 1.00 0.00 C ATOM 941 O GLN A 126 0.572 -9.179 -3.315 1.00 0.00 O ATOM 942 CB GLN A 126 0.640 -12.126 -4.960 1.00 0.00 C ATOM 943 CG GLN A 126 0.309 -12.394 -6.419 1.00 0.00 C ATOM 944 CD GLN A 126 -0.312 -13.759 -6.636 1.00 0.00 C ATOM 945 OE1 GLN A 126 -0.376 -14.578 -5.719 1.00 0.00 O ATOM 946 NE2 GLN A 126 -0.774 -14.013 -7.855 1.00 0.00 N ATOM 0 H GLN A 126 3.141 -12.156 -4.565 1.00 0.00 H new ATOM 0 HA GLN A 126 1.259 -10.147 -5.523 1.00 0.00 H new ATOM 0 HB2 GLN A 126 1.167 -12.988 -4.551 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -0.289 -12.024 -4.398 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -0.376 -11.626 -6.779 1.00 0.00 H new ATOM 0 HG3 GLN A 126 1.219 -12.314 -7.014 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -0.701 -13.305 -8.586 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -1.202 -14.916 -8.060 1.00 0.00 H new ATOM 955 N TYR A 127 1.570 -10.934 -2.322 1.00 0.00 N ATOM 956 CA TYR A 127 1.321 -10.450 -0.969 1.00 0.00 C ATOM 957 C TYR A 127 1.939 -9.070 -0.762 1.00 0.00 C ATOM 958 O TYR A 127 1.230 -8.082 -0.571 1.00 0.00 O ATOM 959 CB TYR A 127 1.885 -11.433 0.058 1.00 0.00 C ATOM 960 CG TYR A 127 1.234 -11.326 1.419 1.00 0.00 C ATOM 961 CD1 TYR A 127 0.012 -11.936 1.676 1.00 0.00 C ATOM 962 CD2 TYR A 127 1.841 -10.616 2.447 1.00 0.00 C ATOM 963 CE1 TYR A 127 -0.587 -11.841 2.917 1.00 0.00 C ATOM 964 CE2 TYR A 127 1.250 -10.517 3.692 1.00 0.00 C ATOM 965 CZ TYR A 127 0.036 -11.131 3.922 1.00 0.00 C ATOM 966 OH TYR A 127 -0.557 -11.035 5.160 1.00 0.00 O ATOM 0 H TYR A 127 2.068 -11.823 -2.367 1.00 0.00 H new ATOM 0 HA TYR A 127 0.243 -10.370 -0.831 1.00 0.00 H new ATOM 0 HB2 TYR A 127 1.760 -12.449 -0.317 1.00 0.00 H new ATOM 0 HB3 TYR A 127 2.956 -11.262 0.162 1.00 0.00 H new ATOM 0 HD1 TYR A 127 -0.478 -12.494 0.892 1.00 0.00 H new ATOM 0 HD2 TYR A 127 2.791 -10.133 2.270 1.00 0.00 H new ATOM 0 HE1 TYR A 127 -1.538 -12.320 3.099 1.00 0.00 H new ATOM 0 HE2 TYR A 127 1.736 -9.962 4.481 1.00 0.00 H new ATOM 0 HH TYR A 127 0.011 -10.502 5.754 1.00 0.00 H new ATOM 976 N CYS A 128 3.266 -9.011 -0.803 1.00 0.00 N ATOM 977 CA CYS A 128 3.982 -7.754 -0.621 1.00 0.00 C ATOM 978 C CYS A 128 3.280 -6.616 -1.356 1.00 0.00 C ATOM 979 O CYS A 128 3.143 -5.513 -0.828 1.00 0.00 O ATOM 980 CB CYS A 128 5.422 -7.887 -1.120 1.00 0.00 C ATOM 981 SG CYS A 128 6.479 -8.934 -0.070 1.00 0.00 S ATOM 0 H CYS A 128 3.867 -9.820 -0.961 1.00 0.00 H new ATOM 0 HA CYS A 128 3.993 -7.522 0.444 1.00 0.00 H new ATOM 0 HB2 CYS A 128 5.409 -8.299 -2.129 1.00 0.00 H new ATOM 0 HB3 CYS A 128 5.865 -6.893 -1.187 1.00 0.00 H new ATOM 986 N ARG A 129 2.836 -6.894 -2.578 1.00 0.00 N ATOM 987 CA ARG A 129 2.149 -5.894 -3.386 1.00 0.00 C ATOM 988 C ARG A 129 0.940 -5.331 -2.644 1.00 0.00 C ATOM 989 O ARG A 129 0.748 -4.117 -2.580 1.00 0.00 O ATOM 990 CB ARG A 129 1.705 -6.502 -4.718 1.00 0.00 C ATOM 991 CG ARG A 129 1.576 -5.484 -5.839 1.00 0.00 C ATOM 992 CD ARG A 129 1.629 -6.150 -7.205 1.00 0.00 C ATOM 993 NE ARG A 129 1.034 -5.314 -8.245 1.00 0.00 N ATOM 994 CZ ARG A 129 1.101 -5.596 -9.542 1.00 0.00 C ATOM 995 NH1 ARG A 129 1.733 -6.685 -9.955 1.00 0.00 N ATOM 996 NH2 ARG A 129 0.534 -4.786 -10.427 1.00 0.00 N ATOM 0 H ARG A 129 2.940 -7.803 -3.029 1.00 0.00 H new ATOM 0 HA ARG A 129 2.846 -5.079 -3.580 1.00 0.00 H new ATOM 0 HB2 ARG A 129 2.421 -7.268 -5.015 1.00 0.00 H new ATOM 0 HB3 ARG A 129 0.745 -7.000 -4.579 1.00 0.00 H new ATOM 0 HG2 ARG A 129 0.636 -4.942 -5.733 1.00 0.00 H new ATOM 0 HG3 ARG A 129 2.378 -4.750 -5.759 1.00 0.00 H new ATOM 0 HD2 ARG A 129 2.666 -6.366 -7.463 1.00 0.00 H new ATOM 0 HD3 ARG A 129 1.105 -7.105 -7.163 1.00 0.00 H new ATOM 0 HE ARG A 129 0.540 -4.468 -7.960 1.00 0.00 H new ATOM 0 HH11 ARG A 129 2.170 -7.309 -9.277 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.783 -6.899 -10.951 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.047 -3.947 -10.112 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.585 -5.002 -11.422 1.00 0.00 H new ATOM 1010 N PHE A 130 0.129 -6.222 -2.083 1.00 0.00 N ATOM 1011 CA PHE A 130 -1.062 -5.815 -1.346 1.00 0.00 C ATOM 1012 C PHE A 130 -0.684 -5.184 -0.009 1.00 0.00 C ATOM 1013 O PHE A 130 -1.230 -4.151 0.377 1.00 0.00 O ATOM 1014 CB PHE A 130 -1.980 -7.017 -1.115 1.00 0.00 C ATOM 1015 CG PHE A 130 -3.335 -6.643 -0.585 1.00 0.00 C ATOM 1016 CD1 PHE A 130 -4.072 -5.632 -1.181 1.00 0.00 C ATOM 1017 CD2 PHE A 130 -3.871 -7.301 0.510 1.00 0.00 C ATOM 1018 CE1 PHE A 130 -5.319 -5.285 -0.696 1.00 0.00 C ATOM 1019 CE2 PHE A 130 -5.117 -6.959 0.999 1.00 0.00 C ATOM 1020 CZ PHE A 130 -5.842 -5.950 0.397 1.00 0.00 C ATOM 0 H PHE A 130 0.275 -7.231 -2.125 1.00 0.00 H new ATOM 0 HA PHE A 130 -1.592 -5.072 -1.942 1.00 0.00 H new ATOM 0 HB2 PHE A 130 -2.102 -7.557 -2.054 1.00 0.00 H new ATOM 0 HB3 PHE A 130 -1.501 -7.701 -0.415 1.00 0.00 H new ATOM 0 HD1 PHE A 130 -3.667 -5.109 -2.035 1.00 0.00 H new ATOM 0 HD2 PHE A 130 -3.308 -8.090 0.987 1.00 0.00 H new ATOM 0 HE1 PHE A 130 -5.884 -4.496 -1.170 1.00 0.00 H new ATOM 0 HE2 PHE A 130 -5.524 -7.481 1.852 1.00 0.00 H new ATOM 0 HZ PHE A 130 -6.816 -5.681 0.779 1.00 0.00 H new ATOM 1030 N GLN A 131 0.252 -5.814 0.692 1.00 0.00 N ATOM 1031 CA GLN A 131 0.702 -5.316 1.987 1.00 0.00 C ATOM 1032 C GLN A 131 1.174 -3.869 1.879 1.00 0.00 C ATOM 1033 O GLN A 131 0.723 -3.000 2.625 1.00 0.00 O ATOM 1034 CB GLN A 131 1.830 -6.194 2.531 1.00 0.00 C ATOM 1035 CG GLN A 131 1.397 -7.617 2.842 1.00 0.00 C ATOM 1036 CD GLN A 131 0.200 -7.674 3.771 1.00 0.00 C ATOM 1037 OE1 GLN A 131 -0.940 -7.806 3.325 1.00 0.00 O ATOM 1038 NE2 GLN A 131 0.454 -7.575 5.070 1.00 0.00 N ATOM 0 H GLN A 131 0.714 -6.670 0.386 1.00 0.00 H new ATOM 0 HA GLN A 131 -0.142 -5.354 2.676 1.00 0.00 H new ATOM 0 HB2 GLN A 131 2.641 -6.221 1.804 1.00 0.00 H new ATOM 0 HB3 GLN A 131 2.229 -5.738 3.437 1.00 0.00 H new ATOM 0 HG2 GLN A 131 1.154 -8.130 1.912 1.00 0.00 H new ATOM 0 HG3 GLN A 131 2.230 -8.155 3.295 1.00 0.00 H new ATOM 0 HE21 GLN A 131 1.415 -7.467 5.395 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -0.312 -7.607 5.743 1.00 0.00 H new ATOM 1047 N LYS A 132 2.085 -3.618 0.945 1.00 0.00 N ATOM 1048 CA LYS A 132 2.619 -2.277 0.738 1.00 0.00 C ATOM 1049 C LYS A 132 1.497 -1.244 0.699 1.00 0.00 C ATOM 1050 O LYS A 132 1.453 -0.330 1.524 1.00 0.00 O ATOM 1051 CB LYS A 132 3.422 -2.221 -0.564 1.00 0.00 C ATOM 1052 CG LYS A 132 4.284 -0.977 -0.694 1.00 0.00 C ATOM 1053 CD LYS A 132 5.510 -1.235 -1.554 1.00 0.00 C ATOM 1054 CE LYS A 132 6.408 -0.010 -1.625 1.00 0.00 C ATOM 1055 NZ LYS A 132 7.651 -0.278 -2.401 1.00 0.00 N ATOM 0 H LYS A 132 2.469 -4.326 0.319 1.00 0.00 H new ATOM 0 HA LYS A 132 3.277 -2.042 1.575 1.00 0.00 H new ATOM 0 HB2 LYS A 132 4.060 -3.103 -0.626 1.00 0.00 H new ATOM 0 HB3 LYS A 132 2.734 -2.266 -1.408 1.00 0.00 H new ATOM 0 HG2 LYS A 132 3.696 -0.170 -1.130 1.00 0.00 H new ATOM 0 HG3 LYS A 132 4.596 -0.645 0.296 1.00 0.00 H new ATOM 0 HD2 LYS A 132 6.071 -2.076 -1.147 1.00 0.00 H new ATOM 0 HD3 LYS A 132 5.198 -1.517 -2.559 1.00 0.00 H new ATOM 0 HE2 LYS A 132 5.863 0.814 -2.086 1.00 0.00 H new ATOM 0 HE3 LYS A 132 6.671 0.307 -0.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 8.410 0.352 -2.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 7.939 -1.268 -2.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 7.474 -0.105 -3.411 1.00 0.00 H new ATOM 1069 N CYS A 133 0.591 -1.397 -0.260 1.00 0.00 N ATOM 1070 CA CYS A 133 -0.532 -0.478 -0.405 1.00 0.00 C ATOM 1071 C CYS A 133 -1.132 -0.134 0.955 1.00 0.00 C ATOM 1072 O CYS A 133 -1.222 1.037 1.327 1.00 0.00 O ATOM 1073 CB CYS A 133 -1.604 -1.088 -1.309 1.00 0.00 C ATOM 1074 SG CYS A 133 -1.221 -0.997 -3.074 1.00 0.00 S ATOM 0 H CYS A 133 0.612 -2.149 -0.949 1.00 0.00 H new ATOM 0 HA CYS A 133 -0.162 0.440 -0.861 1.00 0.00 H new ATOM 0 HB2 CYS A 133 -1.746 -2.133 -1.032 1.00 0.00 H new ATOM 0 HB3 CYS A 133 -2.550 -0.579 -1.127 1.00 0.00 H new ATOM 0 HG CYS A 133 -1.718 0.097 -3.570 1.00 0.00 H new ATOM 1080 N LEU A 134 -1.542 -1.160 1.691 1.00 0.00 N ATOM 1081 CA LEU A 134 -2.135 -0.967 3.010 1.00 0.00 C ATOM 1082 C LEU A 134 -1.190 -0.193 3.924 1.00 0.00 C ATOM 1083 O LEU A 134 -1.586 0.787 4.555 1.00 0.00 O ATOM 1084 CB LEU A 134 -2.478 -2.318 3.640 1.00 0.00 C ATOM 1085 CG LEU A 134 -3.452 -3.197 2.854 1.00 0.00 C ATOM 1086 CD1 LEU A 134 -3.356 -4.643 3.314 1.00 0.00 C ATOM 1087 CD2 LEU A 134 -4.876 -2.681 3.005 1.00 0.00 C ATOM 0 H LEU A 134 -1.475 -2.135 1.397 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.050 -0.387 2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -1.552 -2.875 3.784 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -2.899 -2.139 4.629 1.00 0.00 H new ATOM 0 HG LEU A 134 -3.181 -3.154 1.799 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.056 -5.253 2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -2.342 -5.009 3.154 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -3.601 -4.705 4.374 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -5.556 -3.318 2.439 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.158 -2.694 4.058 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.935 -1.661 2.626 1.00 0.00 H new ATOM 1099 N ALA A 135 0.060 -0.638 3.987 1.00 0.00 N ATOM 1100 CA ALA A 135 1.062 0.016 4.820 1.00 0.00 C ATOM 1101 C ALA A 135 1.131 1.511 4.525 1.00 0.00 C ATOM 1102 O ALA A 135 1.334 2.324 5.428 1.00 0.00 O ATOM 1103 CB ALA A 135 2.424 -0.629 4.611 1.00 0.00 C ATOM 0 H ALA A 135 0.403 -1.448 3.472 1.00 0.00 H new ATOM 0 HA ALA A 135 0.769 -0.108 5.863 1.00 0.00 H new ATOM 0 HB1 ALA A 135 3.163 -0.131 5.239 1.00 0.00 H new ATOM 0 HB2 ALA A 135 2.372 -1.684 4.879 1.00 0.00 H new ATOM 0 HB3 ALA A 135 2.715 -0.535 3.565 1.00 0.00 H new ATOM 1109 N LEU A 136 0.963 1.866 3.256 1.00 0.00 N ATOM 1110 CA LEU A 136 1.006 3.264 2.841 1.00 0.00 C ATOM 1111 C LEU A 136 -0.187 4.035 3.396 1.00 0.00 C ATOM 1112 O LEU A 136 -0.135 5.254 3.551 1.00 0.00 O ATOM 1113 CB LEU A 136 1.027 3.363 1.315 1.00 0.00 C ATOM 1114 CG LEU A 136 2.323 2.926 0.631 1.00 0.00 C ATOM 1115 CD1 LEU A 136 2.129 2.838 -0.875 1.00 0.00 C ATOM 1116 CD2 LEU A 136 3.455 3.885 0.970 1.00 0.00 C ATOM 0 H LEU A 136 0.796 1.206 2.497 1.00 0.00 H new ATOM 0 HA LEU A 136 1.918 3.707 3.240 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.210 2.759 0.921 1.00 0.00 H new ATOM 0 HB3 LEU A 136 0.823 4.397 1.035 1.00 0.00 H new ATOM 0 HG LEU A 136 2.590 1.936 1.000 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.062 2.526 -1.344 1.00 0.00 H new ATOM 0 HD12 LEU A 136 1.349 2.111 -1.099 1.00 0.00 H new ATOM 0 HD13 LEU A 136 1.837 3.814 -1.262 1.00 0.00 H new ATOM 0 HD21 LEU A 136 4.369 3.558 0.475 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.196 4.888 0.630 1.00 0.00 H new ATOM 0 HD23 LEU A 136 3.611 3.897 2.049 1.00 0.00 H new ATOM 1128 N GLY A 137 -1.264 3.313 3.695 1.00 0.00 N ATOM 1129 CA GLY A 137 -2.455 3.945 4.232 1.00 0.00 C ATOM 1130 C GLY A 137 -3.564 4.058 3.205 1.00 0.00 C ATOM 1131 O GLY A 137 -4.389 4.968 3.271 1.00 0.00 O ATOM 0 H GLY A 137 -1.332 2.302 3.575 1.00 0.00 H new ATOM 0 HA2 GLY A 137 -2.813 3.372 5.087 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -2.201 4.939 4.599 1.00 0.00 H new ATOM 1135 N MET A 138 -3.583 3.131 2.253 1.00 0.00 N ATOM 1136 CA MET A 138 -4.599 3.131 1.207 1.00 0.00 C ATOM 1137 C MET A 138 -5.965 2.763 1.777 1.00 0.00 C ATOM 1138 O MET A 138 -6.215 1.607 2.119 1.00 0.00 O ATOM 1139 CB MET A 138 -4.217 2.153 0.095 1.00 0.00 C ATOM 1140 CG MET A 138 -3.250 2.737 -0.922 1.00 0.00 C ATOM 1141 SD MET A 138 -3.032 1.674 -2.363 1.00 0.00 S ATOM 1142 CE MET A 138 -2.925 2.894 -3.670 1.00 0.00 C ATOM 0 H MET A 138 -2.907 2.371 2.184 1.00 0.00 H new ATOM 0 HA MET A 138 -4.657 4.137 0.791 1.00 0.00 H new ATOM 0 HB2 MET A 138 -3.770 1.265 0.541 1.00 0.00 H new ATOM 0 HB3 MET A 138 -5.122 1.830 -0.420 1.00 0.00 H new ATOM 0 HG2 MET A 138 -3.614 3.712 -1.246 1.00 0.00 H new ATOM 0 HG3 MET A 138 -2.283 2.900 -0.446 1.00 0.00 H new ATOM 0 HE1 MET A 138 -3.584 2.608 -4.490 1.00 0.00 H new ATOM 0 HE2 MET A 138 -3.227 3.868 -3.284 1.00 0.00 H new ATOM 0 HE3 MET A 138 -1.899 2.950 -4.032 1.00 0.00 H new ATOM 1152 N SER A 139 -6.847 3.753 1.877 1.00 0.00 N ATOM 1153 CA SER A 139 -8.186 3.533 2.409 1.00 0.00 C ATOM 1154 C SER A 139 -9.075 2.846 1.377 1.00 0.00 C ATOM 1155 O SER A 139 -9.116 3.245 0.213 1.00 0.00 O ATOM 1156 CB SER A 139 -8.813 4.862 2.836 1.00 0.00 C ATOM 1157 OG SER A 139 -7.940 5.589 3.683 1.00 0.00 O ATOM 0 H SER A 139 -6.658 4.715 1.596 1.00 0.00 H new ATOM 0 HA SER A 139 -8.102 2.883 3.280 1.00 0.00 H new ATOM 0 HB2 SER A 139 -9.048 5.457 1.953 1.00 0.00 H new ATOM 0 HB3 SER A 139 -9.754 4.674 3.353 1.00 0.00 H new ATOM 0 HG SER A 139 -8.363 6.435 3.940 1.00 0.00 H new ATOM 1163 N HIS A 140 -9.787 1.811 1.813 1.00 0.00 N ATOM 1164 CA HIS A 140 -10.677 1.068 0.927 1.00 0.00 C ATOM 1165 C HIS A 140 -12.014 1.786 0.774 1.00 0.00 C ATOM 1166 O HIS A 140 -12.552 1.887 -0.328 1.00 0.00 O ATOM 1167 CB HIS A 140 -10.902 -0.345 1.465 1.00 0.00 C ATOM 1168 CG HIS A 140 -11.060 -0.401 2.954 1.00 0.00 C ATOM 1169 ND1 HIS A 140 -12.169 0.085 3.612 1.00 0.00 N ATOM 1170 CD2 HIS A 140 -10.240 -0.892 3.913 1.00 0.00 C ATOM 1171 CE1 HIS A 140 -12.025 -0.103 4.912 1.00 0.00 C ATOM 1172 NE2 HIS A 140 -10.863 -0.694 5.121 1.00 0.00 N ATOM 0 H HIS A 140 -9.765 1.468 2.773 1.00 0.00 H new ATOM 0 HA HIS A 140 -10.205 1.005 -0.053 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -11.792 -0.766 0.997 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -10.061 -0.974 1.173 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -9.276 -1.353 3.757 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -12.737 0.179 5.674 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -10.489 -0.960 6.032 1.00 0.00 H new ATOM 1180 N ASN A 141 -12.545 2.283 1.886 1.00 0.00 N ATOM 1181 CA ASN A 141 -13.820 2.991 1.875 1.00 0.00 C ATOM 1182 C ASN A 141 -13.985 3.794 0.588 1.00 0.00 C ATOM 1183 O ASN A 141 -15.067 3.831 0.003 1.00 0.00 O ATOM 1184 CB ASN A 141 -13.922 3.921 3.086 1.00 0.00 C ATOM 1185 CG ASN A 141 -13.387 3.281 4.353 1.00 0.00 C ATOM 1186 OD1 ASN A 141 -12.203 2.954 4.444 1.00 0.00 O ATOM 1187 ND2 ASN A 141 -14.258 3.100 5.338 1.00 0.00 N ATOM 0 H ASN A 141 -12.112 2.209 2.807 1.00 0.00 H new ATOM 0 HA ASN A 141 -14.618 2.251 1.926 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -13.369 4.838 2.884 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -14.964 4.204 3.237 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -13.956 2.675 6.214 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -15.230 3.386 5.219 1.00 0.00 H new ATOM 1194 N ALA A 142 -12.905 4.434 0.154 1.00 0.00 N ATOM 1195 CA ALA A 142 -12.929 5.233 -1.065 1.00 0.00 C ATOM 1196 C ALA A 142 -13.601 4.475 -2.205 1.00 0.00 C ATOM 1197 O ALA A 142 -14.648 4.888 -2.705 1.00 0.00 O ATOM 1198 CB ALA A 142 -11.517 5.639 -1.458 1.00 0.00 C ATOM 0 H ALA A 142 -12.002 4.415 0.628 1.00 0.00 H new ATOM 0 HA ALA A 142 -13.512 6.133 -0.869 1.00 0.00 H new ATOM 0 HB1 ALA A 142 -11.550 6.235 -2.370 1.00 0.00 H new ATOM 0 HB2 ALA A 142 -11.071 6.227 -0.656 1.00 0.00 H new ATOM 0 HB3 ALA A 142 -10.916 4.746 -1.630 1.00 0.00 H new ATOM 1204 N ILE A 143 -12.991 3.367 -2.613 1.00 0.00 N ATOM 1205 CA ILE A 143 -13.531 2.552 -3.694 1.00 0.00 C ATOM 1206 C ILE A 143 -15.052 2.484 -3.624 1.00 0.00 C ATOM 1207 O ILE A 143 -15.617 1.995 -2.645 1.00 0.00 O ATOM 1208 CB ILE A 143 -12.961 1.122 -3.659 1.00 0.00 C ATOM 1209 CG1 ILE A 143 -11.439 1.152 -3.809 1.00 0.00 C ATOM 1210 CG2 ILE A 143 -13.590 0.275 -4.756 1.00 0.00 C ATOM 1211 CD1 ILE A 143 -10.702 1.184 -2.488 1.00 0.00 C ATOM 0 H ILE A 143 -12.123 3.013 -2.211 1.00 0.00 H new ATOM 0 HA ILE A 143 -13.234 3.029 -4.628 1.00 0.00 H new ATOM 0 HB ILE A 143 -13.203 0.673 -2.696 1.00 0.00 H new ATOM 0 HG12 ILE A 143 -11.120 0.275 -4.373 1.00 0.00 H new ATOM 0 HG13 ILE A 143 -11.157 2.027 -4.395 1.00 0.00 H new ATOM 0 HG21 ILE A 143 -13.177 -0.733 -4.719 1.00 0.00 H new ATOM 0 HG22 ILE A 143 -14.669 0.231 -4.608 1.00 0.00 H new ATOM 0 HG23 ILE A 143 -13.375 0.720 -5.728 1.00 0.00 H new ATOM 0 HD11 ILE A 143 -9.628 1.204 -2.671 1.00 0.00 H new ATOM 0 HD12 ILE A 143 -10.992 2.075 -1.931 1.00 0.00 H new ATOM 0 HD13 ILE A 143 -10.955 0.296 -1.909 1.00 0.00 H new ATOM 1223 N ARG A 144 -15.710 2.974 -4.669 1.00 0.00 N ATOM 1224 CA ARG A 144 -17.167 2.968 -4.726 1.00 0.00 C ATOM 1225 C ARG A 144 -17.692 1.576 -5.065 1.00 0.00 C ATOM 1226 O ARG A 144 -16.957 0.732 -5.579 1.00 0.00 O ATOM 1227 CB ARG A 144 -17.663 3.978 -5.763 1.00 0.00 C ATOM 1228 CG ARG A 144 -17.624 5.418 -5.278 1.00 0.00 C ATOM 1229 CD ARG A 144 -18.697 6.261 -5.949 1.00 0.00 C ATOM 1230 NE ARG A 144 -20.042 5.776 -5.649 1.00 0.00 N ATOM 1231 CZ ARG A 144 -21.139 6.508 -5.806 1.00 0.00 C ATOM 1232 NH1 ARG A 144 -21.052 7.751 -6.258 1.00 0.00 N ATOM 1233 NH2 ARG A 144 -22.327 5.996 -5.511 1.00 0.00 N ATOM 0 H ARG A 144 -15.258 3.380 -5.488 1.00 0.00 H new ATOM 0 HA ARG A 144 -17.545 3.251 -3.744 1.00 0.00 H new ATOM 0 HB2 ARG A 144 -17.055 3.890 -6.663 1.00 0.00 H new ATOM 0 HB3 ARG A 144 -18.686 3.726 -6.043 1.00 0.00 H new ATOM 0 HG2 ARG A 144 -17.763 5.443 -4.197 1.00 0.00 H new ATOM 0 HG3 ARG A 144 -16.643 5.846 -5.483 1.00 0.00 H new ATOM 0 HD2 ARG A 144 -18.603 7.296 -5.620 1.00 0.00 H new ATOM 0 HD3 ARG A 144 -18.541 6.254 -7.028 1.00 0.00 H new ATOM 0 HE ARG A 144 -20.144 4.823 -5.300 1.00 0.00 H new ATOM 0 HH11 ARG A 144 -20.141 8.148 -6.486 1.00 0.00 H new ATOM 0 HH12 ARG A 144 -21.896 8.311 -6.377 1.00 0.00 H new ATOM 0 HH21 ARG A 144 -22.398 5.040 -5.163 1.00 0.00 H new ATOM 0 HH22 ARG A 144 -23.169 6.559 -5.632 1.00 0.00 H new ATOM 1247 N PHE A 145 -18.967 1.342 -4.772 1.00 0.00 N ATOM 1248 CA PHE A 145 -19.590 0.052 -5.044 1.00 0.00 C ATOM 1249 C PHE A 145 -19.278 -0.414 -6.464 1.00 0.00 C ATOM 1250 O PHE A 145 -18.687 -1.473 -6.665 1.00 0.00 O ATOM 1251 CB PHE A 145 -21.104 0.141 -4.845 1.00 0.00 C ATOM 1252 CG PHE A 145 -21.504 0.931 -3.632 1.00 0.00 C ATOM 1253 CD1 PHE A 145 -20.979 0.627 -2.387 1.00 0.00 C ATOM 1254 CD2 PHE A 145 -22.405 1.979 -3.737 1.00 0.00 C ATOM 1255 CE1 PHE A 145 -21.346 1.352 -1.269 1.00 0.00 C ATOM 1256 CE2 PHE A 145 -22.775 2.708 -2.623 1.00 0.00 C ATOM 1257 CZ PHE A 145 -22.244 2.394 -1.387 1.00 0.00 C ATOM 0 H PHE A 145 -19.589 2.029 -4.346 1.00 0.00 H new ATOM 0 HA PHE A 145 -19.181 -0.676 -4.344 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -21.552 0.595 -5.729 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -21.511 -0.867 -4.763 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -20.275 -0.186 -2.289 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -22.823 2.229 -4.701 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -20.931 1.104 -0.304 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -23.478 3.522 -2.718 1.00 0.00 H new ATOM 0 HZ PHE A 145 -22.531 2.963 -0.515 1.00 0.00 H new ATOM 1267 N GLY A 146 -19.683 0.387 -7.445 1.00 0.00 N ATOM 1268 CA GLY A 146 -19.439 0.041 -8.833 1.00 0.00 C ATOM 1269 C GLY A 146 -20.403 0.728 -9.780 1.00 0.00 C ATOM 1270 O GLY A 146 -21.619 0.590 -9.646 1.00 0.00 O ATOM 0 H GLY A 146 -20.175 1.269 -7.303 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -18.418 0.314 -9.098 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -19.522 -1.039 -8.955 1.00 0.00 H new ATOM 1274 N SER A 147 -19.860 1.471 -10.739 1.00 0.00 N ATOM 1275 CA SER A 147 -20.681 2.186 -11.709 1.00 0.00 C ATOM 1276 C SER A 147 -20.609 1.519 -13.079 1.00 0.00 C ATOM 1277 O SER A 147 -19.618 1.652 -13.795 1.00 0.00 O ATOM 1278 CB SER A 147 -20.229 3.644 -11.814 1.00 0.00 C ATOM 1279 OG SER A 147 -18.892 3.731 -12.276 1.00 0.00 O ATOM 0 H SER A 147 -18.855 1.594 -10.865 1.00 0.00 H new ATOM 0 HA SER A 147 -21.715 2.157 -11.365 1.00 0.00 H new ATOM 0 HB2 SER A 147 -20.888 4.184 -12.494 1.00 0.00 H new ATOM 0 HB3 SER A 147 -20.312 4.125 -10.839 1.00 0.00 H new ATOM 0 HG SER A 147 -18.712 2.995 -12.898 1.00 0.00 H new ATOM 1285 N GLY A 148 -21.669 0.800 -13.437 1.00 0.00 N ATOM 1286 CA GLY A 148 -21.707 0.122 -14.719 1.00 0.00 C ATOM 1287 C GLY A 148 -22.347 -1.249 -14.631 1.00 0.00 C ATOM 1288 O GLY A 148 -23.507 -1.393 -14.245 1.00 0.00 O ATOM 0 H GLY A 148 -22.502 0.675 -12.862 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -22.260 0.732 -15.433 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -20.692 0.022 -15.104 1.00 0.00 H new ATOM 1292 N PRO A 149 -21.582 -2.288 -14.997 1.00 0.00 N ATOM 1293 CA PRO A 149 -22.060 -3.673 -14.968 1.00 0.00 C ATOM 1294 C PRO A 149 -22.253 -4.190 -13.546 1.00 0.00 C ATOM 1295 O PRO A 149 -21.309 -4.229 -12.757 1.00 0.00 O ATOM 1296 CB PRO A 149 -20.945 -4.449 -15.672 1.00 0.00 C ATOM 1297 CG PRO A 149 -19.723 -3.620 -15.475 1.00 0.00 C ATOM 1298 CD PRO A 149 -20.190 -2.190 -15.468 1.00 0.00 C ATOM 0 HA PRO A 149 -23.035 -3.777 -15.443 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -20.822 -5.443 -15.242 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -21.165 -4.585 -16.731 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -19.226 -3.873 -14.538 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -19.002 -3.791 -16.274 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -19.584 -1.573 -14.805 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -20.132 -1.743 -16.461 1.00 0.00 H new ATOM 1306 N SER A 150 -23.481 -4.586 -13.226 1.00 0.00 N ATOM 1307 CA SER A 150 -23.797 -5.097 -11.898 1.00 0.00 C ATOM 1308 C SER A 150 -24.117 -6.588 -11.952 1.00 0.00 C ATOM 1309 O SER A 150 -23.500 -7.392 -11.252 1.00 0.00 O ATOM 1310 CB SER A 150 -24.980 -4.332 -11.302 1.00 0.00 C ATOM 1311 OG SER A 150 -24.559 -3.102 -10.737 1.00 0.00 O ATOM 0 H SER A 150 -24.273 -4.563 -13.868 1.00 0.00 H new ATOM 0 HA SER A 150 -22.923 -4.953 -11.263 1.00 0.00 H new ATOM 0 HB2 SER A 150 -25.723 -4.144 -12.077 1.00 0.00 H new ATOM 0 HB3 SER A 150 -25.463 -4.941 -10.538 1.00 0.00 H new ATOM 0 HG SER A 150 -25.333 -2.631 -10.364 1.00 0.00 H new ATOM 1317 N SER A 151 -25.085 -6.950 -12.787 1.00 0.00 N ATOM 1318 CA SER A 151 -25.490 -8.343 -12.931 1.00 0.00 C ATOM 1319 C SER A 151 -24.495 -9.112 -13.794 1.00 0.00 C ATOM 1320 O SER A 151 -24.357 -8.848 -14.988 1.00 0.00 O ATOM 1321 CB SER A 151 -26.888 -8.429 -13.546 1.00 0.00 C ATOM 1322 OG SER A 151 -26.893 -7.931 -14.873 1.00 0.00 O ATOM 0 H SER A 151 -25.604 -6.297 -13.375 1.00 0.00 H new ATOM 0 HA SER A 151 -25.509 -8.794 -11.939 1.00 0.00 H new ATOM 0 HB2 SER A 151 -27.228 -9.465 -13.542 1.00 0.00 H new ATOM 0 HB3 SER A 151 -27.592 -7.860 -12.938 1.00 0.00 H new ATOM 0 HG SER A 151 -26.023 -8.103 -15.290 1.00 0.00 H new ATOM 1328 N GLY A 152 -23.802 -10.067 -13.180 1.00 0.00 N ATOM 1329 CA GLY A 152 -22.828 -10.860 -13.906 1.00 0.00 C ATOM 1330 C GLY A 152 -23.473 -11.784 -14.921 1.00 0.00 C ATOM 1331 O GLY A 152 -24.673 -12.048 -14.855 1.00 0.00 O ATOM 0 H GLY A 152 -23.898 -10.305 -12.193 1.00 0.00 H new ATOM 0 HA2 GLY A 152 -22.130 -10.195 -14.416 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -22.246 -11.451 -13.199 1.00 0.00 H new TER 1335 GLY A 152 HETATM 1336 ZN ZN A 200 2.879 2.341 -9.013 1.00 0.00 ZN HETATM 1337 ZN ZN A 300 7.036 -10.873 -1.063 1.00 0.00 ZN