USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 685 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 19:sc= 0.028 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -2.62! C(o=-2.6!,f=-3.7!) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0.101 (180deg=0.101) USER MOD Single : A 16 LYS NZ :NH3+ -161:sc= -0.0152 (180deg=-0.214) USER MOD Single : A 18 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0161) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -1.82! C(o=-1.8!,f=-7.4!) USER MOD Single : A 27 GLN : amide:sc= -2.51! C(o=-2.5!,f=-3.1!) USER MOD Single : A 29 SER OG : rot 35:sc= -1.11 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot 180:sc= -0.108 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.193 USER MOD Single : A 42 ASN : amide:sc= 0.389 X(o=0.39,f=0) USER MOD Single : A 47 GLN : amide:sc= -0.358 X(o=-0.36,f=-0.36) USER MOD Single : A 48 THR OG1 : rot -74:sc= 1.27 USER MOD Single : A 49 LYS NZ :NH3+ -121:sc= 1.09 (180deg=-0.0933) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.871 USER MOD Single : A 60 THR OG1 : rot 71:sc= 0.284 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 166:sc=-0.00504 (180deg=-0.134) USER MOD Single : A 69 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0299) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 ASN : amide:sc= -0.141 K(o=-0.14,f=-6.3!) USER MOD Single : A 82 SER OG : rot 180:sc= -0.104 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= -0.0502 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 31.944 2.891 18.014 1.00 0.00 N ATOM 2 CA GLY A 1 30.870 3.545 18.740 1.00 0.00 C ATOM 3 C GLY A 1 29.499 3.106 18.266 1.00 0.00 C ATOM 4 O GLY A 1 29.166 3.249 17.090 1.00 0.00 O ATOM 0 H1 GLY A 1 32.861 3.225 18.375 1.00 0.00 H new ATOM 0 H2 GLY A 1 31.875 1.862 18.144 1.00 0.00 H new ATOM 0 H3 GLY A 1 31.867 3.118 17.002 1.00 0.00 H new ATOM 0 HA2 GLY A 1 30.970 3.328 19.804 1.00 0.00 H new ATOM 0 HA3 GLY A 1 30.962 4.625 18.625 1.00 0.00 H new ATOM 8 N SER A 2 28.701 2.569 19.184 1.00 0.00 N ATOM 9 CA SER A 2 27.360 2.102 18.852 1.00 0.00 C ATOM 10 C SER A 2 26.301 2.975 19.518 1.00 0.00 C ATOM 11 O SER A 2 26.315 3.168 20.734 1.00 0.00 O ATOM 12 CB SER A 2 27.182 0.646 19.285 1.00 0.00 C ATOM 13 OG SER A 2 27.774 -0.240 18.350 1.00 0.00 O ATOM 0 H SER A 2 28.960 2.447 20.163 1.00 0.00 H new ATOM 0 HA SER A 2 27.236 2.170 17.771 1.00 0.00 H new ATOM 0 HB2 SER A 2 27.632 0.498 20.267 1.00 0.00 H new ATOM 0 HB3 SER A 2 26.120 0.420 19.383 1.00 0.00 H new ATOM 0 HG SER A 2 27.648 -1.164 18.650 1.00 0.00 H new ATOM 19 N SER A 3 25.384 3.501 18.712 1.00 0.00 N ATOM 20 CA SER A 3 24.319 4.357 19.222 1.00 0.00 C ATOM 21 C SER A 3 23.009 4.088 18.489 1.00 0.00 C ATOM 22 O SER A 3 22.989 3.915 17.271 1.00 0.00 O ATOM 23 CB SER A 3 24.706 5.830 19.075 1.00 0.00 C ATOM 24 OG SER A 3 25.571 6.238 20.121 1.00 0.00 O ATOM 0 H SER A 3 25.357 3.350 17.704 1.00 0.00 H new ATOM 0 HA SER A 3 24.177 4.130 20.279 1.00 0.00 H new ATOM 0 HB2 SER A 3 25.195 5.986 18.113 1.00 0.00 H new ATOM 0 HB3 SER A 3 23.808 6.447 19.080 1.00 0.00 H new ATOM 0 HG SER A 3 25.979 5.449 20.535 1.00 0.00 H new ATOM 30 N GLY A 4 21.913 4.055 19.242 1.00 0.00 N ATOM 31 CA GLY A 4 20.612 3.807 18.648 1.00 0.00 C ATOM 32 C GLY A 4 20.297 4.768 17.520 1.00 0.00 C ATOM 33 O GLY A 4 19.966 5.930 17.759 1.00 0.00 O ATOM 0 H GLY A 4 21.903 4.196 20.252 1.00 0.00 H new ATOM 0 HA2 GLY A 4 20.577 2.785 18.271 1.00 0.00 H new ATOM 0 HA3 GLY A 4 19.843 3.889 19.417 1.00 0.00 H new ATOM 37 N SER A 5 20.400 4.285 16.286 1.00 0.00 N ATOM 38 CA SER A 5 20.128 5.112 15.116 1.00 0.00 C ATOM 39 C SER A 5 18.661 5.528 15.073 1.00 0.00 C ATOM 40 O SER A 5 17.765 4.699 15.229 1.00 0.00 O ATOM 41 CB SER A 5 20.493 4.357 13.836 1.00 0.00 C ATOM 42 OG SER A 5 20.369 5.193 12.698 1.00 0.00 O ATOM 0 H SER A 5 20.670 3.325 16.070 1.00 0.00 H new ATOM 0 HA SER A 5 20.740 6.011 15.187 1.00 0.00 H new ATOM 0 HB2 SER A 5 21.515 3.985 13.908 1.00 0.00 H new ATOM 0 HB3 SER A 5 19.845 3.488 13.725 1.00 0.00 H new ATOM 0 HG SER A 5 20.609 4.688 11.893 1.00 0.00 H new ATOM 48 N SER A 6 18.425 6.819 14.862 1.00 0.00 N ATOM 49 CA SER A 6 17.067 7.348 14.803 1.00 0.00 C ATOM 50 C SER A 6 16.532 7.311 13.375 1.00 0.00 C ATOM 51 O SER A 6 15.553 6.624 13.085 1.00 0.00 O ATOM 52 CB SER A 6 17.032 8.782 15.336 1.00 0.00 C ATOM 53 OG SER A 6 17.436 8.831 16.693 1.00 0.00 O ATOM 0 H SER A 6 19.156 7.518 14.729 1.00 0.00 H new ATOM 0 HA SER A 6 16.431 6.720 15.427 1.00 0.00 H new ATOM 0 HB2 SER A 6 17.687 9.413 14.735 1.00 0.00 H new ATOM 0 HB3 SER A 6 16.024 9.185 15.238 1.00 0.00 H new ATOM 0 HG SER A 6 17.407 9.758 17.010 1.00 0.00 H new ATOM 59 N GLY A 7 17.181 8.056 12.486 1.00 0.00 N ATOM 60 CA GLY A 7 16.757 8.096 11.099 1.00 0.00 C ATOM 61 C GLY A 7 17.603 9.032 10.260 1.00 0.00 C ATOM 62 O GLY A 7 17.260 10.197 10.054 1.00 0.00 O ATOM 0 H GLY A 7 17.994 8.633 12.702 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.806 7.092 10.678 1.00 0.00 H new ATOM 0 HA3 GLY A 7 15.715 8.411 11.050 1.00 0.00 H new ATOM 66 N PRO A 8 18.739 8.523 9.761 1.00 0.00 N ATOM 67 CA PRO A 8 19.661 9.305 8.932 1.00 0.00 C ATOM 68 C PRO A 8 19.081 9.618 7.557 1.00 0.00 C ATOM 69 O PRO A 8 18.023 9.109 7.188 1.00 0.00 O ATOM 70 CB PRO A 8 20.883 8.393 8.802 1.00 0.00 C ATOM 71 CG PRO A 8 20.349 7.015 8.992 1.00 0.00 C ATOM 72 CD PRO A 8 19.210 7.143 9.966 1.00 0.00 C ATOM 0 HA PRO A 8 19.883 10.276 9.375 1.00 0.00 H new ATOM 0 HB2 PRO A 8 21.357 8.503 7.827 1.00 0.00 H new ATOM 0 HB3 PRO A 8 21.637 8.632 9.552 1.00 0.00 H new ATOM 0 HG2 PRO A 8 20.008 6.595 8.046 1.00 0.00 H new ATOM 0 HG3 PRO A 8 21.120 6.348 9.378 1.00 0.00 H new ATOM 0 HD2 PRO A 8 18.424 6.416 9.763 1.00 0.00 H new ATOM 0 HD3 PRO A 8 19.539 6.979 10.992 1.00 0.00 H new ATOM 80 N ASP A 9 19.781 10.458 6.802 1.00 0.00 N ATOM 81 CA ASP A 9 19.337 10.837 5.466 1.00 0.00 C ATOM 82 C ASP A 9 19.110 9.604 4.598 1.00 0.00 C ATOM 83 O ASP A 9 17.989 9.332 4.168 1.00 0.00 O ATOM 84 CB ASP A 9 20.364 11.759 4.806 1.00 0.00 C ATOM 85 CG ASP A 9 19.921 12.231 3.435 1.00 0.00 C ATOM 86 OD1 ASP A 9 19.189 13.240 3.362 1.00 0.00 O ATOM 87 OD2 ASP A 9 20.308 11.591 2.435 1.00 0.00 O ATOM 0 H ASP A 9 20.658 10.889 7.093 1.00 0.00 H new ATOM 0 HA ASP A 9 18.391 11.370 5.562 1.00 0.00 H new ATOM 0 HB2 ASP A 9 20.536 12.624 5.447 1.00 0.00 H new ATOM 0 HB3 ASP A 9 21.315 11.234 4.717 1.00 0.00 H new ATOM 92 N PHE A 10 20.182 8.861 4.343 1.00 0.00 N ATOM 93 CA PHE A 10 20.100 7.657 3.525 1.00 0.00 C ATOM 94 C PHE A 10 19.047 6.697 4.071 1.00 0.00 C ATOM 95 O PHE A 10 19.056 6.354 5.254 1.00 0.00 O ATOM 96 CB PHE A 10 21.461 6.959 3.469 1.00 0.00 C ATOM 97 CG PHE A 10 22.383 7.527 2.428 1.00 0.00 C ATOM 98 CD1 PHE A 10 22.014 7.545 1.092 1.00 0.00 C ATOM 99 CD2 PHE A 10 23.619 8.042 2.785 1.00 0.00 C ATOM 100 CE1 PHE A 10 22.861 8.066 0.132 1.00 0.00 C ATOM 101 CE2 PHE A 10 24.470 8.565 1.829 1.00 0.00 C ATOM 102 CZ PHE A 10 24.090 8.578 0.501 1.00 0.00 C ATOM 0 H PHE A 10 21.117 9.072 4.691 1.00 0.00 H new ATOM 0 HA PHE A 10 19.808 7.953 2.517 1.00 0.00 H new ATOM 0 HB2 PHE A 10 21.939 7.033 4.446 1.00 0.00 H new ATOM 0 HB3 PHE A 10 21.309 5.899 3.268 1.00 0.00 H new ATOM 0 HD1 PHE A 10 21.054 7.147 0.798 1.00 0.00 H new ATOM 0 HD2 PHE A 10 23.921 8.035 3.822 1.00 0.00 H new ATOM 0 HE1 PHE A 10 22.562 8.073 -0.906 1.00 0.00 H new ATOM 0 HE2 PHE A 10 25.431 8.963 2.120 1.00 0.00 H new ATOM 0 HZ PHE A 10 24.752 8.988 -0.247 1.00 0.00 H new ATOM 112 N THR A 11 18.138 6.268 3.201 1.00 0.00 N ATOM 113 CA THR A 11 17.076 5.351 3.595 1.00 0.00 C ATOM 114 C THR A 11 17.647 4.099 4.251 1.00 0.00 C ATOM 115 O THR A 11 18.721 3.615 3.893 1.00 0.00 O ATOM 116 CB THR A 11 16.215 4.936 2.387 1.00 0.00 C ATOM 117 OG1 THR A 11 17.052 4.447 1.333 1.00 0.00 O ATOM 118 CG2 THR A 11 15.389 6.110 1.883 1.00 0.00 C ATOM 0 H THR A 11 18.116 6.541 2.219 1.00 0.00 H new ATOM 0 HA THR A 11 16.450 5.882 4.313 1.00 0.00 H new ATOM 0 HB THR A 11 15.536 4.145 2.707 1.00 0.00 H new ATOM 0 HG1 THR A 11 16.497 4.184 0.570 1.00 0.00 H new ATOM 0 HG21 THR A 11 14.789 5.793 1.030 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.732 6.461 2.679 1.00 0.00 H new ATOM 0 HG23 THR A 11 16.054 6.919 1.579 1.00 0.00 H new ATOM 126 N PRO A 12 16.913 3.559 5.236 1.00 0.00 N ATOM 127 CA PRO A 12 17.327 2.355 5.962 1.00 0.00 C ATOM 128 C PRO A 12 17.261 1.103 5.094 1.00 0.00 C ATOM 129 O PRO A 12 16.342 0.941 4.291 1.00 0.00 O ATOM 130 CB PRO A 12 16.314 2.265 7.106 1.00 0.00 C ATOM 131 CG PRO A 12 15.109 2.982 6.603 1.00 0.00 C ATOM 132 CD PRO A 12 15.623 4.082 5.715 1.00 0.00 C ATOM 0 HA PRO A 12 18.363 2.416 6.295 1.00 0.00 H new ATOM 0 HB2 PRO A 12 16.084 1.228 7.350 1.00 0.00 H new ATOM 0 HB3 PRO A 12 16.700 2.728 8.014 1.00 0.00 H new ATOM 0 HG2 PRO A 12 14.456 2.307 6.050 1.00 0.00 H new ATOM 0 HG3 PRO A 12 14.523 3.388 7.428 1.00 0.00 H new ATOM 0 HD2 PRO A 12 14.940 4.284 4.890 1.00 0.00 H new ATOM 0 HD3 PRO A 12 15.747 5.016 6.263 1.00 0.00 H new ATOM 140 N GLN A 13 18.242 0.221 5.260 1.00 0.00 N ATOM 141 CA GLN A 13 18.294 -1.017 4.490 1.00 0.00 C ATOM 142 C GLN A 13 16.929 -1.697 4.459 1.00 0.00 C ATOM 143 O GLN A 13 16.464 -2.226 5.468 1.00 0.00 O ATOM 144 CB GLN A 13 19.337 -1.966 5.082 1.00 0.00 C ATOM 145 CG GLN A 13 19.452 -3.285 4.335 1.00 0.00 C ATOM 146 CD GLN A 13 18.325 -4.244 4.665 1.00 0.00 C ATOM 147 OE1 GLN A 13 17.943 -4.394 5.826 1.00 0.00 O ATOM 148 NE2 GLN A 13 17.786 -4.898 3.644 1.00 0.00 N ATOM 0 H GLN A 13 19.011 0.340 5.920 1.00 0.00 H new ATOM 0 HA GLN A 13 18.578 -0.768 3.468 1.00 0.00 H new ATOM 0 HB2 GLN A 13 20.308 -1.471 5.081 1.00 0.00 H new ATOM 0 HB3 GLN A 13 19.083 -2.168 6.123 1.00 0.00 H new ATOM 0 HG2 GLN A 13 19.456 -3.091 3.262 1.00 0.00 H new ATOM 0 HG3 GLN A 13 20.406 -3.754 4.578 1.00 0.00 H new ATOM 0 HE21 GLN A 13 18.134 -4.743 2.698 1.00 0.00 H new ATOM 0 HE22 GLN A 13 17.024 -5.556 3.805 1.00 0.00 H new ATOM 157 N LYS A 14 16.291 -1.678 3.294 1.00 0.00 N ATOM 158 CA LYS A 14 14.980 -2.293 3.129 1.00 0.00 C ATOM 159 C LYS A 14 14.938 -3.159 1.874 1.00 0.00 C ATOM 160 O LYS A 14 15.870 -3.147 1.069 1.00 0.00 O ATOM 161 CB LYS A 14 13.894 -1.217 3.055 1.00 0.00 C ATOM 162 CG LYS A 14 14.088 -0.235 1.912 1.00 0.00 C ATOM 163 CD LYS A 14 13.406 -0.716 0.642 1.00 0.00 C ATOM 164 CE LYS A 14 11.950 -0.280 0.593 1.00 0.00 C ATOM 165 NZ LYS A 14 11.323 -0.591 -0.722 1.00 0.00 N ATOM 0 H LYS A 14 16.661 -1.243 2.449 1.00 0.00 H new ATOM 0 HA LYS A 14 14.795 -2.929 3.994 1.00 0.00 H new ATOM 0 HB2 LYS A 14 12.923 -1.700 2.947 1.00 0.00 H new ATOM 0 HB3 LYS A 14 13.874 -0.667 3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 14 13.687 0.738 2.195 1.00 0.00 H new ATOM 0 HG3 LYS A 14 15.153 -0.099 1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 14 13.934 -0.323 -0.227 1.00 0.00 H new ATOM 0 HD3 LYS A 14 13.464 -1.803 0.586 1.00 0.00 H new ATOM 0 HE2 LYS A 14 11.394 -0.778 1.387 1.00 0.00 H new ATOM 0 HE3 LYS A 14 11.885 0.791 0.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 10.331 -0.279 -0.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 11.837 -0.095 -1.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 11.362 -1.616 -0.891 1.00 0.00 H new ATOM 179 N PHE A 15 13.852 -3.907 1.713 1.00 0.00 N ATOM 180 CA PHE A 15 13.690 -4.779 0.555 1.00 0.00 C ATOM 181 C PHE A 15 12.910 -4.074 -0.551 1.00 0.00 C ATOM 182 O PHE A 15 11.732 -3.756 -0.391 1.00 0.00 O ATOM 183 CB PHE A 15 12.972 -6.069 0.957 1.00 0.00 C ATOM 184 CG PHE A 15 11.852 -5.851 1.934 1.00 0.00 C ATOM 185 CD1 PHE A 15 10.571 -5.568 1.488 1.00 0.00 C ATOM 186 CD2 PHE A 15 12.080 -5.930 3.299 1.00 0.00 C ATOM 187 CE1 PHE A 15 9.538 -5.368 2.385 1.00 0.00 C ATOM 188 CE2 PHE A 15 11.051 -5.731 4.200 1.00 0.00 C ATOM 189 CZ PHE A 15 9.778 -5.448 3.742 1.00 0.00 C ATOM 0 H PHE A 15 13.071 -3.927 2.369 1.00 0.00 H new ATOM 0 HA PHE A 15 14.682 -5.026 0.176 1.00 0.00 H new ATOM 0 HB2 PHE A 15 12.575 -6.549 0.062 1.00 0.00 H new ATOM 0 HB3 PHE A 15 13.696 -6.758 1.393 1.00 0.00 H new ATOM 0 HD1 PHE A 15 10.377 -5.503 0.428 1.00 0.00 H new ATOM 0 HD2 PHE A 15 13.073 -6.150 3.663 1.00 0.00 H new ATOM 0 HE1 PHE A 15 8.544 -5.149 2.024 1.00 0.00 H new ATOM 0 HE2 PHE A 15 11.241 -5.797 5.261 1.00 0.00 H new ATOM 0 HZ PHE A 15 8.973 -5.290 4.444 1.00 0.00 H new ATOM 199 N LYS A 16 13.578 -3.831 -1.675 1.00 0.00 N ATOM 200 CA LYS A 16 12.950 -3.164 -2.809 1.00 0.00 C ATOM 201 C LYS A 16 12.984 -4.052 -4.049 1.00 0.00 C ATOM 202 O LYS A 16 13.242 -3.578 -5.155 1.00 0.00 O ATOM 203 CB LYS A 16 13.653 -1.837 -3.100 1.00 0.00 C ATOM 204 CG LYS A 16 15.072 -2.000 -3.616 1.00 0.00 C ATOM 205 CD LYS A 16 16.079 -2.028 -2.478 1.00 0.00 C ATOM 206 CE LYS A 16 16.468 -0.624 -2.043 1.00 0.00 C ATOM 207 NZ LYS A 16 17.309 0.061 -3.064 1.00 0.00 N ATOM 0 H LYS A 16 14.554 -4.086 -1.824 1.00 0.00 H new ATOM 0 HA LYS A 16 11.909 -2.968 -2.552 1.00 0.00 H new ATOM 0 HB2 LYS A 16 13.070 -1.280 -3.834 1.00 0.00 H new ATOM 0 HB3 LYS A 16 13.673 -1.239 -2.189 1.00 0.00 H new ATOM 0 HG2 LYS A 16 15.147 -2.922 -4.192 1.00 0.00 H new ATOM 0 HG3 LYS A 16 15.310 -1.180 -4.294 1.00 0.00 H new ATOM 0 HD2 LYS A 16 15.657 -2.569 -1.631 1.00 0.00 H new ATOM 0 HD3 LYS A 16 16.969 -2.572 -2.792 1.00 0.00 H new ATOM 0 HE2 LYS A 16 15.567 -0.037 -1.862 1.00 0.00 H new ATOM 0 HE3 LYS A 16 17.011 -0.674 -1.099 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 17.813 0.856 -2.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 17.999 -0.613 -3.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 16.703 0.419 -3.830 1.00 0.00 H new ATOM 221 N GLU A 17 12.722 -5.341 -3.856 1.00 0.00 N ATOM 222 CA GLU A 17 12.723 -6.294 -4.960 1.00 0.00 C ATOM 223 C GLU A 17 11.307 -6.774 -5.266 1.00 0.00 C ATOM 224 O GLU A 17 11.102 -7.910 -5.693 1.00 0.00 O ATOM 225 CB GLU A 17 13.618 -7.490 -4.631 1.00 0.00 C ATOM 226 CG GLU A 17 14.011 -8.310 -5.848 1.00 0.00 C ATOM 227 CD GLU A 17 14.456 -7.447 -7.013 1.00 0.00 C ATOM 228 OE1 GLU A 17 15.659 -7.117 -7.080 1.00 0.00 O ATOM 229 OE2 GLU A 17 13.603 -7.103 -7.857 1.00 0.00 O ATOM 0 H GLU A 17 12.507 -5.749 -2.946 1.00 0.00 H new ATOM 0 HA GLU A 17 13.115 -5.788 -5.842 1.00 0.00 H new ATOM 0 HB2 GLU A 17 14.522 -7.132 -4.138 1.00 0.00 H new ATOM 0 HB3 GLU A 17 13.101 -8.135 -3.920 1.00 0.00 H new ATOM 0 HG2 GLU A 17 14.817 -8.992 -5.577 1.00 0.00 H new ATOM 0 HG3 GLU A 17 13.165 -8.923 -6.157 1.00 0.00 H new ATOM 236 N LYS A 18 10.331 -5.900 -5.042 1.00 0.00 N ATOM 237 CA LYS A 18 8.934 -6.231 -5.294 1.00 0.00 C ATOM 238 C LYS A 18 8.518 -5.810 -6.699 1.00 0.00 C ATOM 239 O LYS A 18 9.180 -4.987 -7.333 1.00 0.00 O ATOM 240 CB LYS A 18 8.033 -5.552 -4.259 1.00 0.00 C ATOM 241 CG LYS A 18 8.455 -5.810 -2.823 1.00 0.00 C ATOM 242 CD LYS A 18 7.312 -5.564 -1.853 1.00 0.00 C ATOM 243 CE LYS A 18 7.629 -6.108 -0.468 1.00 0.00 C ATOM 244 NZ LYS A 18 6.393 -6.388 0.314 1.00 0.00 N ATOM 0 H LYS A 18 10.483 -4.956 -4.686 1.00 0.00 H new ATOM 0 HA LYS A 18 8.823 -7.312 -5.211 1.00 0.00 H new ATOM 0 HB2 LYS A 18 8.031 -4.477 -4.441 1.00 0.00 H new ATOM 0 HB3 LYS A 18 7.009 -5.901 -4.396 1.00 0.00 H new ATOM 0 HG2 LYS A 18 8.802 -6.838 -2.724 1.00 0.00 H new ATOM 0 HG3 LYS A 18 9.295 -5.164 -2.568 1.00 0.00 H new ATOM 0 HD2 LYS A 18 7.112 -4.494 -1.788 1.00 0.00 H new ATOM 0 HD3 LYS A 18 6.405 -6.035 -2.231 1.00 0.00 H new ATOM 0 HE2 LYS A 18 8.214 -7.023 -0.562 1.00 0.00 H new ATOM 0 HE3 LYS A 18 8.246 -5.389 0.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 6.650 -6.804 1.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 5.872 -5.501 0.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 5.793 -7.054 -0.213 1.00 0.00 H new ATOM 258 N THR A 19 7.417 -6.377 -7.182 1.00 0.00 N ATOM 259 CA THR A 19 6.914 -6.060 -8.512 1.00 0.00 C ATOM 260 C THR A 19 5.666 -5.188 -8.434 1.00 0.00 C ATOM 261 O THR A 19 4.916 -5.247 -7.461 1.00 0.00 O ATOM 262 CB THR A 19 6.584 -7.337 -9.308 1.00 0.00 C ATOM 263 OG1 THR A 19 6.146 -6.994 -10.627 1.00 0.00 O ATOM 264 CG2 THR A 19 5.507 -8.149 -8.605 1.00 0.00 C ATOM 0 H THR A 19 6.856 -7.059 -6.671 1.00 0.00 H new ATOM 0 HA THR A 19 7.705 -5.514 -9.027 1.00 0.00 H new ATOM 0 HB THR A 19 7.489 -7.942 -9.373 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.940 -7.812 -11.126 1.00 0.00 H new ATOM 0 HG21 THR A 19 5.291 -9.046 -9.185 1.00 0.00 H new ATOM 0 HG22 THR A 19 5.856 -8.434 -7.613 1.00 0.00 H new ATOM 0 HG23 THR A 19 4.601 -7.549 -8.512 1.00 0.00 H new ATOM 272 N ALA A 20 5.451 -4.378 -9.466 1.00 0.00 N ATOM 273 CA ALA A 20 4.292 -3.495 -9.515 1.00 0.00 C ATOM 274 C ALA A 20 3.034 -4.213 -9.039 1.00 0.00 C ATOM 275 O ALA A 20 2.344 -3.741 -8.136 1.00 0.00 O ATOM 276 CB ALA A 20 4.095 -2.961 -10.926 1.00 0.00 C ATOM 0 H ALA A 20 6.064 -4.315 -10.279 1.00 0.00 H new ATOM 0 HA ALA A 20 4.476 -2.657 -8.843 1.00 0.00 H new ATOM 0 HB1 ALA A 20 3.226 -2.303 -10.948 1.00 0.00 H new ATOM 0 HB2 ALA A 20 4.980 -2.403 -11.231 1.00 0.00 H new ATOM 0 HB3 ALA A 20 3.937 -3.794 -11.611 1.00 0.00 H new ATOM 282 N GLU A 21 2.742 -5.356 -9.653 1.00 0.00 N ATOM 283 CA GLU A 21 1.565 -6.137 -9.291 1.00 0.00 C ATOM 284 C GLU A 21 1.453 -6.283 -7.776 1.00 0.00 C ATOM 285 O GLU A 21 0.444 -5.908 -7.180 1.00 0.00 O ATOM 286 CB GLU A 21 1.623 -7.519 -9.945 1.00 0.00 C ATOM 287 CG GLU A 21 0.259 -8.164 -10.126 1.00 0.00 C ATOM 288 CD GLU A 21 0.350 -9.650 -10.416 1.00 0.00 C ATOM 289 OE1 GLU A 21 0.604 -10.013 -11.583 1.00 0.00 O ATOM 290 OE2 GLU A 21 0.168 -10.450 -9.474 1.00 0.00 O ATOM 0 H GLU A 21 3.304 -5.761 -10.402 1.00 0.00 H new ATOM 0 HA GLU A 21 0.684 -5.608 -9.653 1.00 0.00 H new ATOM 0 HB2 GLU A 21 2.106 -7.431 -10.918 1.00 0.00 H new ATOM 0 HB3 GLU A 21 2.247 -8.174 -9.337 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -0.334 -8.009 -9.225 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -0.267 -7.670 -10.943 1.00 0.00 H new ATOM 297 N GLN A 22 2.497 -6.830 -7.162 1.00 0.00 N ATOM 298 CA GLN A 22 2.516 -7.027 -5.717 1.00 0.00 C ATOM 299 C GLN A 22 2.185 -5.730 -4.987 1.00 0.00 C ATOM 300 O GLN A 22 1.304 -5.697 -4.126 1.00 0.00 O ATOM 301 CB GLN A 22 3.884 -7.544 -5.269 1.00 0.00 C ATOM 302 CG GLN A 22 4.129 -9.002 -5.622 1.00 0.00 C ATOM 303 CD GLN A 22 5.562 -9.430 -5.373 1.00 0.00 C ATOM 304 OE1 GLN A 22 6.484 -8.616 -5.431 1.00 0.00 O ATOM 305 NE2 GLN A 22 5.757 -10.713 -5.094 1.00 0.00 N ATOM 0 H GLN A 22 3.340 -7.145 -7.642 1.00 0.00 H new ATOM 0 HA GLN A 22 1.756 -7.768 -5.467 1.00 0.00 H new ATOM 0 HB2 GLN A 22 4.662 -6.932 -5.726 1.00 0.00 H new ATOM 0 HB3 GLN A 22 3.974 -7.420 -4.190 1.00 0.00 H new ATOM 0 HG2 GLN A 22 3.459 -9.631 -5.036 1.00 0.00 H new ATOM 0 HG3 GLN A 22 3.882 -9.164 -6.671 1.00 0.00 H new ATOM 0 HE21 GLN A 22 4.964 -11.353 -5.056 1.00 0.00 H new ATOM 0 HE22 GLN A 22 6.700 -11.059 -4.917 1.00 0.00 H new ATOM 314 N LEU A 23 2.896 -4.663 -5.335 1.00 0.00 N ATOM 315 CA LEU A 23 2.678 -3.362 -4.712 1.00 0.00 C ATOM 316 C LEU A 23 1.222 -2.928 -4.852 1.00 0.00 C ATOM 317 O LEU A 23 0.520 -2.747 -3.858 1.00 0.00 O ATOM 318 CB LEU A 23 3.598 -2.313 -5.340 1.00 0.00 C ATOM 319 CG LEU A 23 5.010 -2.226 -4.760 1.00 0.00 C ATOM 320 CD1 LEU A 23 5.824 -1.172 -5.496 1.00 0.00 C ATOM 321 CD2 LEU A 23 4.957 -1.918 -3.271 1.00 0.00 C ATOM 0 H LEU A 23 3.628 -4.673 -6.045 1.00 0.00 H new ATOM 0 HA LEU A 23 2.910 -3.451 -3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.677 -2.520 -6.407 1.00 0.00 H new ATOM 0 HB3 LEU A 23 3.125 -1.336 -5.239 1.00 0.00 H new ATOM 0 HG LEU A 23 5.498 -3.192 -4.893 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.826 -1.123 -5.070 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.891 -1.435 -6.552 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.339 -0.201 -5.394 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.971 -1.860 -2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 23 4.451 -0.965 -3.114 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.411 -2.708 -2.755 1.00 0.00 H new ATOM 333 N ARG A 24 0.776 -2.765 -6.093 1.00 0.00 N ATOM 334 CA ARG A 24 -0.596 -2.354 -6.364 1.00 0.00 C ATOM 335 C ARG A 24 -1.554 -2.944 -5.333 1.00 0.00 C ATOM 336 O ARG A 24 -2.495 -2.283 -4.894 1.00 0.00 O ATOM 337 CB ARG A 24 -1.013 -2.787 -7.771 1.00 0.00 C ATOM 338 CG ARG A 24 -2.478 -2.522 -8.080 1.00 0.00 C ATOM 339 CD ARG A 24 -2.752 -2.588 -9.575 1.00 0.00 C ATOM 340 NE ARG A 24 -3.921 -1.799 -9.952 1.00 0.00 N ATOM 341 CZ ARG A 24 -4.175 -1.410 -11.196 1.00 0.00 C ATOM 342 NH1 ARG A 24 -3.346 -1.735 -12.178 1.00 0.00 N ATOM 343 NH2 ARG A 24 -5.261 -0.694 -11.460 1.00 0.00 N ATOM 0 H ARG A 24 1.345 -2.911 -6.927 1.00 0.00 H new ATOM 0 HA ARG A 24 -0.643 -1.267 -6.298 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -0.396 -2.263 -8.501 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -0.812 -3.852 -7.889 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -3.098 -3.254 -7.562 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -2.759 -1.540 -7.700 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -1.880 -2.227 -10.120 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -2.905 -3.626 -9.870 1.00 0.00 H new ATOM 0 HE ARG A 24 -4.579 -1.532 -9.220 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -2.511 -2.285 -11.979 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -3.544 -1.435 -13.133 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -5.901 -0.442 -10.707 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -5.455 -0.396 -12.416 1.00 0.00 H new ATOM 357 N VAL A 25 -1.308 -4.194 -4.952 1.00 0.00 N ATOM 358 CA VAL A 25 -2.148 -4.874 -3.973 1.00 0.00 C ATOM 359 C VAL A 25 -1.807 -4.431 -2.555 1.00 0.00 C ATOM 360 O VAL A 25 -2.686 -4.035 -1.788 1.00 0.00 O ATOM 361 CB VAL A 25 -1.998 -6.404 -4.071 1.00 0.00 C ATOM 362 CG1 VAL A 25 -2.852 -7.093 -3.017 1.00 0.00 C ATOM 363 CG2 VAL A 25 -2.366 -6.886 -5.466 1.00 0.00 C ATOM 0 H VAL A 25 -0.534 -4.756 -5.306 1.00 0.00 H new ATOM 0 HA VAL A 25 -3.179 -4.602 -4.198 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.956 -6.663 -3.885 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -2.733 -8.173 -3.102 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -2.537 -6.770 -2.025 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -3.899 -6.830 -3.168 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -2.254 -7.969 -5.518 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -3.400 -6.617 -5.683 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -1.708 -6.418 -6.198 1.00 0.00 H new ATOM 373 N LEU A 26 -0.526 -4.499 -2.211 1.00 0.00 N ATOM 374 CA LEU A 26 -0.067 -4.104 -0.884 1.00 0.00 C ATOM 375 C LEU A 26 -0.483 -2.671 -0.568 1.00 0.00 C ATOM 376 O LEU A 26 -1.148 -2.415 0.436 1.00 0.00 O ATOM 377 CB LEU A 26 1.453 -4.238 -0.787 1.00 0.00 C ATOM 378 CG LEU A 26 1.999 -5.666 -0.731 1.00 0.00 C ATOM 379 CD1 LEU A 26 3.428 -5.712 -1.247 1.00 0.00 C ATOM 380 CD2 LEU A 26 1.924 -6.210 0.688 1.00 0.00 C ATOM 0 H LEU A 26 0.214 -4.824 -2.833 1.00 0.00 H new ATOM 0 HA LEU A 26 -0.531 -4.767 -0.154 1.00 0.00 H new ATOM 0 HB2 LEU A 26 1.898 -3.734 -1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 26 1.788 -3.707 0.104 1.00 0.00 H new ATOM 0 HG LEU A 26 1.383 -6.296 -1.373 1.00 0.00 H new ATOM 0 HD11 LEU A 26 3.799 -6.736 -1.199 1.00 0.00 H new ATOM 0 HD12 LEU A 26 3.453 -5.364 -2.280 1.00 0.00 H new ATOM 0 HD13 LEU A 26 4.058 -5.069 -0.632 1.00 0.00 H new ATOM 0 HD21 LEU A 26 2.316 -7.227 0.709 1.00 0.00 H new ATOM 0 HD22 LEU A 26 2.515 -5.579 1.351 1.00 0.00 H new ATOM 0 HD23 LEU A 26 0.886 -6.215 1.021 1.00 0.00 H new ATOM 392 N GLN A 27 -0.090 -1.741 -1.433 1.00 0.00 N ATOM 393 CA GLN A 27 -0.423 -0.334 -1.246 1.00 0.00 C ATOM 394 C GLN A 27 -1.929 -0.148 -1.089 1.00 0.00 C ATOM 395 O GLN A 27 -2.383 0.673 -0.293 1.00 0.00 O ATOM 396 CB GLN A 27 0.084 0.493 -2.428 1.00 0.00 C ATOM 397 CG GLN A 27 0.460 1.919 -2.056 1.00 0.00 C ATOM 398 CD GLN A 27 -0.705 2.881 -2.183 1.00 0.00 C ATOM 399 OE1 GLN A 27 -1.658 2.627 -2.920 1.00 0.00 O ATOM 400 NE2 GLN A 27 -0.634 3.994 -1.463 1.00 0.00 N ATOM 0 H GLN A 27 0.459 -1.937 -2.270 1.00 0.00 H new ATOM 0 HA GLN A 27 0.065 0.011 -0.334 1.00 0.00 H new ATOM 0 HB2 GLN A 27 0.953 -0.002 -2.861 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -0.685 0.518 -3.200 1.00 0.00 H new ATOM 0 HG2 GLN A 27 0.832 1.937 -1.031 1.00 0.00 H new ATOM 0 HG3 GLN A 27 1.275 2.255 -2.697 1.00 0.00 H new ATOM 0 HE21 GLN A 27 0.175 4.164 -0.865 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -1.388 4.679 -1.508 1.00 0.00 H new ATOM 409 N ALA A 28 -2.698 -0.916 -1.854 1.00 0.00 N ATOM 410 CA ALA A 28 -4.152 -0.837 -1.799 1.00 0.00 C ATOM 411 C ALA A 28 -4.685 -1.420 -0.494 1.00 0.00 C ATOM 412 O ALA A 28 -5.835 -1.187 -0.123 1.00 0.00 O ATOM 413 CB ALA A 28 -4.766 -1.558 -2.990 1.00 0.00 C ATOM 0 H ALA A 28 -2.338 -1.600 -2.519 1.00 0.00 H new ATOM 0 HA ALA A 28 -4.435 0.215 -1.839 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -5.853 -1.491 -2.935 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -4.420 -1.095 -3.914 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -4.466 -2.606 -2.975 1.00 0.00 H new ATOM 419 N SER A 29 -3.840 -2.178 0.198 1.00 0.00 N ATOM 420 CA SER A 29 -4.228 -2.798 1.460 1.00 0.00 C ATOM 421 C SER A 29 -3.783 -1.945 2.643 1.00 0.00 C ATOM 422 O SER A 29 -4.600 -1.527 3.464 1.00 0.00 O ATOM 423 CB SER A 29 -3.624 -4.199 1.571 1.00 0.00 C ATOM 424 OG SER A 29 -4.051 -4.847 2.756 1.00 0.00 O ATOM 0 H SER A 29 -2.883 -2.377 -0.094 1.00 0.00 H new ATOM 0 HA SER A 29 -5.315 -2.876 1.479 1.00 0.00 H new ATOM 0 HB2 SER A 29 -3.913 -4.793 0.704 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.536 -4.131 1.562 1.00 0.00 H new ATOM 0 HG SER A 29 -4.976 -4.590 2.954 1.00 0.00 H new ATOM 430 N PHE A 30 -2.481 -1.690 2.725 1.00 0.00 N ATOM 431 CA PHE A 30 -1.925 -0.887 3.808 1.00 0.00 C ATOM 432 C PHE A 30 -2.701 0.417 3.972 1.00 0.00 C ATOM 433 O PHE A 30 -2.919 0.886 5.089 1.00 0.00 O ATOM 434 CB PHE A 30 -0.449 -0.586 3.542 1.00 0.00 C ATOM 435 CG PHE A 30 0.082 0.567 4.345 1.00 0.00 C ATOM 436 CD1 PHE A 30 0.546 0.374 5.636 1.00 0.00 C ATOM 437 CD2 PHE A 30 0.117 1.844 3.809 1.00 0.00 C ATOM 438 CE1 PHE A 30 1.034 1.433 6.378 1.00 0.00 C ATOM 439 CE2 PHE A 30 0.604 2.907 4.545 1.00 0.00 C ATOM 440 CZ PHE A 30 1.064 2.701 5.831 1.00 0.00 C ATOM 0 H PHE A 30 -1.791 -2.028 2.054 1.00 0.00 H new ATOM 0 HA PHE A 30 -2.011 -1.459 4.732 1.00 0.00 H new ATOM 0 HB2 PHE A 30 0.141 -1.475 3.764 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -0.315 -0.372 2.482 1.00 0.00 H new ATOM 0 HD1 PHE A 30 0.526 -0.616 6.068 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.241 2.011 2.804 1.00 0.00 H new ATOM 0 HE1 PHE A 30 1.391 1.269 7.384 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.625 3.898 4.115 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.447 3.530 6.408 1.00 0.00 H new ATOM 450 N LEU A 31 -3.113 0.997 2.850 1.00 0.00 N ATOM 451 CA LEU A 31 -3.864 2.248 2.868 1.00 0.00 C ATOM 452 C LEU A 31 -5.105 2.126 3.746 1.00 0.00 C ATOM 453 O LEU A 31 -5.262 2.860 4.721 1.00 0.00 O ATOM 454 CB LEU A 31 -4.268 2.642 1.446 1.00 0.00 C ATOM 455 CG LEU A 31 -3.257 3.488 0.671 1.00 0.00 C ATOM 456 CD1 LEU A 31 -3.689 3.641 -0.779 1.00 0.00 C ATOM 457 CD2 LEU A 31 -3.089 4.851 1.326 1.00 0.00 C ATOM 0 H LEU A 31 -2.940 0.622 1.917 1.00 0.00 H new ATOM 0 HA LEU A 31 -3.222 3.023 3.286 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -4.460 1.731 0.879 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.208 3.191 1.496 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.294 2.977 0.690 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -2.957 4.246 -1.315 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.757 2.658 -1.244 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.663 4.129 -0.819 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -2.366 5.439 0.761 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.048 5.369 1.339 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -2.733 4.722 2.348 1.00 0.00 H new ATOM 469 N ASN A 32 -5.983 1.192 3.395 1.00 0.00 N ATOM 470 CA ASN A 32 -7.210 0.972 4.152 1.00 0.00 C ATOM 471 C ASN A 32 -6.930 0.969 5.652 1.00 0.00 C ATOM 472 O ASN A 32 -7.492 1.769 6.400 1.00 0.00 O ATOM 473 CB ASN A 32 -7.858 -0.351 3.741 1.00 0.00 C ATOM 474 CG ASN A 32 -9.149 -0.621 4.490 1.00 0.00 C ATOM 475 OD1 ASN A 32 -9.988 0.267 4.643 1.00 0.00 O ATOM 476 ND2 ASN A 32 -9.312 -1.851 4.963 1.00 0.00 N ATOM 0 H ASN A 32 -5.868 0.575 2.591 1.00 0.00 H new ATOM 0 HA ASN A 32 -7.896 1.789 3.929 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -8.059 -0.336 2.670 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -7.158 -1.167 3.923 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -10.160 -2.092 5.477 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -8.590 -2.555 4.812 1.00 0.00 H new ATOM 483 N SER A 33 -6.057 0.064 6.084 1.00 0.00 N ATOM 484 CA SER A 33 -5.704 -0.045 7.494 1.00 0.00 C ATOM 485 C SER A 33 -4.190 -0.116 7.672 1.00 0.00 C ATOM 486 O SER A 33 -3.585 -1.176 7.513 1.00 0.00 O ATOM 487 CB SER A 33 -6.360 -1.283 8.111 1.00 0.00 C ATOM 488 OG SER A 33 -7.773 -1.179 8.081 1.00 0.00 O ATOM 0 H SER A 33 -5.582 -0.604 5.477 1.00 0.00 H new ATOM 0 HA SER A 33 -6.071 0.845 8.005 1.00 0.00 H new ATOM 0 HB2 SER A 33 -6.046 -2.174 7.567 1.00 0.00 H new ATOM 0 HB3 SER A 33 -6.023 -1.402 9.141 1.00 0.00 H new ATOM 0 HG SER A 33 -8.169 -1.982 8.479 1.00 0.00 H new ATOM 494 N SER A 34 -3.586 1.021 8.002 1.00 0.00 N ATOM 495 CA SER A 34 -2.143 1.090 8.198 1.00 0.00 C ATOM 496 C SER A 34 -1.616 -0.201 8.817 1.00 0.00 C ATOM 497 O SER A 34 -0.744 -0.863 8.253 1.00 0.00 O ATOM 498 CB SER A 34 -1.784 2.281 9.090 1.00 0.00 C ATOM 499 OG SER A 34 -2.497 2.233 10.314 1.00 0.00 O ATOM 0 H SER A 34 -4.073 1.906 8.139 1.00 0.00 H new ATOM 0 HA SER A 34 -1.675 1.222 7.223 1.00 0.00 H new ATOM 0 HB2 SER A 34 -0.712 2.281 9.289 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.011 3.211 8.569 1.00 0.00 H new ATOM 0 HG SER A 34 -2.249 3.003 10.867 1.00 0.00 H new ATOM 505 N VAL A 35 -2.151 -0.553 9.981 1.00 0.00 N ATOM 506 CA VAL A 35 -1.737 -1.765 10.678 1.00 0.00 C ATOM 507 C VAL A 35 -2.203 -3.012 9.936 1.00 0.00 C ATOM 508 O VAL A 35 -3.252 -3.009 9.291 1.00 0.00 O ATOM 509 CB VAL A 35 -2.287 -1.801 12.116 1.00 0.00 C ATOM 510 CG1 VAL A 35 -1.387 -1.010 13.053 1.00 0.00 C ATOM 511 CG2 VAL A 35 -3.711 -1.268 12.155 1.00 0.00 C ATOM 0 H VAL A 35 -2.873 -0.016 10.462 1.00 0.00 H new ATOM 0 HA VAL A 35 -0.648 -1.753 10.714 1.00 0.00 H new ATOM 0 HB VAL A 35 -2.302 -2.837 12.455 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.792 -1.047 14.064 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -0.386 -1.442 13.047 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.337 0.027 12.720 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -4.084 -1.301 13.179 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -3.724 -0.239 11.797 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -4.347 -1.882 11.517 1.00 0.00 H new ATOM 521 N LEU A 36 -1.416 -4.078 10.030 1.00 0.00 N ATOM 522 CA LEU A 36 -1.747 -5.335 9.367 1.00 0.00 C ATOM 523 C LEU A 36 -2.373 -6.320 10.349 1.00 0.00 C ATOM 524 O LEU A 36 -1.898 -6.479 11.474 1.00 0.00 O ATOM 525 CB LEU A 36 -0.495 -5.949 8.739 1.00 0.00 C ATOM 526 CG LEU A 36 -0.734 -7.029 7.684 1.00 0.00 C ATOM 527 CD1 LEU A 36 -1.242 -6.409 6.392 1.00 0.00 C ATOM 528 CD2 LEU A 36 0.542 -7.820 7.433 1.00 0.00 C ATOM 0 H LEU A 36 -0.544 -4.097 10.559 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.472 -5.123 8.582 1.00 0.00 H new ATOM 0 HB2 LEU A 36 0.089 -5.149 8.285 1.00 0.00 H new ATOM 0 HB3 LEU A 36 0.115 -6.376 9.535 1.00 0.00 H new ATOM 0 HG LEU A 36 -1.495 -7.714 8.058 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.407 -7.193 5.652 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -2.180 -5.887 6.583 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -0.504 -5.702 6.013 1.00 0.00 H new ATOM 0 HD21 LEU A 36 0.354 -8.585 6.679 1.00 0.00 H new ATOM 0 HD22 LEU A 36 1.324 -7.147 7.080 1.00 0.00 H new ATOM 0 HD23 LEU A 36 0.864 -8.295 8.360 1.00 0.00 H new ATOM 540 N THR A 37 -3.441 -6.981 9.916 1.00 0.00 N ATOM 541 CA THR A 37 -4.132 -7.952 10.756 1.00 0.00 C ATOM 542 C THR A 37 -3.787 -9.379 10.345 1.00 0.00 C ATOM 543 O THR A 37 -3.807 -9.715 9.161 1.00 0.00 O ATOM 544 CB THR A 37 -5.659 -7.765 10.691 1.00 0.00 C ATOM 545 OG1 THR A 37 -6.134 -8.065 9.373 1.00 0.00 O ATOM 546 CG2 THR A 37 -6.047 -6.342 11.063 1.00 0.00 C ATOM 0 H THR A 37 -3.847 -6.862 8.988 1.00 0.00 H new ATOM 0 HA THR A 37 -3.796 -7.781 11.779 1.00 0.00 H new ATOM 0 HB THR A 37 -6.117 -8.448 11.406 1.00 0.00 H new ATOM 0 HG1 THR A 37 -7.106 -7.945 9.341 1.00 0.00 H new ATOM 0 HG21 THR A 37 -7.130 -6.235 11.010 1.00 0.00 H new ATOM 0 HG22 THR A 37 -5.710 -6.126 12.077 1.00 0.00 H new ATOM 0 HG23 THR A 37 -5.579 -5.644 10.369 1.00 0.00 H new ATOM 554 N ASP A 38 -3.473 -10.214 11.329 1.00 0.00 N ATOM 555 CA ASP A 38 -3.126 -11.606 11.069 1.00 0.00 C ATOM 556 C ASP A 38 -3.950 -12.165 9.914 1.00 0.00 C ATOM 557 O ASP A 38 -3.457 -12.960 9.115 1.00 0.00 O ATOM 558 CB ASP A 38 -3.345 -12.451 12.325 1.00 0.00 C ATOM 559 CG ASP A 38 -4.760 -12.340 12.858 1.00 0.00 C ATOM 560 OD1 ASP A 38 -5.112 -11.263 13.385 1.00 0.00 O ATOM 561 OD2 ASP A 38 -5.515 -13.328 12.748 1.00 0.00 O ATOM 0 H ASP A 38 -3.452 -9.951 12.314 1.00 0.00 H new ATOM 0 HA ASP A 38 -2.073 -11.647 10.792 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -3.125 -13.495 12.100 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -2.643 -12.137 13.098 1.00 0.00 H new ATOM 566 N GLU A 39 -5.209 -11.744 9.834 1.00 0.00 N ATOM 567 CA GLU A 39 -6.102 -12.205 8.777 1.00 0.00 C ATOM 568 C GLU A 39 -5.716 -11.593 7.433 1.00 0.00 C ATOM 569 O GLU A 39 -5.460 -12.308 6.465 1.00 0.00 O ATOM 570 CB GLU A 39 -7.552 -11.851 9.114 1.00 0.00 C ATOM 571 CG GLU A 39 -7.825 -11.757 10.605 1.00 0.00 C ATOM 572 CD GLU A 39 -9.250 -12.133 10.962 1.00 0.00 C ATOM 573 OE1 GLU A 39 -9.584 -13.334 10.880 1.00 0.00 O ATOM 574 OE2 GLU A 39 -10.030 -11.228 11.323 1.00 0.00 O ATOM 0 H GLU A 39 -5.633 -11.085 10.488 1.00 0.00 H new ATOM 0 HA GLU A 39 -6.008 -13.288 8.703 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -7.803 -10.899 8.647 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -8.211 -12.603 8.679 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -7.136 -12.412 11.139 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -7.626 -10.740 10.944 1.00 0.00 H new ATOM 581 N GLU A 40 -5.678 -10.265 7.384 1.00 0.00 N ATOM 582 CA GLU A 40 -5.325 -9.557 6.159 1.00 0.00 C ATOM 583 C GLU A 40 -3.992 -10.056 5.607 1.00 0.00 C ATOM 584 O GLU A 40 -3.861 -10.315 4.410 1.00 0.00 O ATOM 585 CB GLU A 40 -5.251 -8.051 6.417 1.00 0.00 C ATOM 586 CG GLU A 40 -4.456 -7.292 5.368 1.00 0.00 C ATOM 587 CD GLU A 40 -4.817 -5.820 5.315 1.00 0.00 C ATOM 588 OE1 GLU A 40 -5.835 -5.482 4.674 1.00 0.00 O ATOM 589 OE2 GLU A 40 -4.083 -5.007 5.913 1.00 0.00 O ATOM 0 H GLU A 40 -5.887 -9.659 8.177 1.00 0.00 H new ATOM 0 HA GLU A 40 -6.101 -9.754 5.420 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.263 -7.648 6.456 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -4.802 -7.880 7.395 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -3.392 -7.394 5.580 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -4.631 -7.741 4.390 1.00 0.00 H new ATOM 596 N LEU A 41 -3.006 -10.187 6.487 1.00 0.00 N ATOM 597 CA LEU A 41 -1.682 -10.654 6.090 1.00 0.00 C ATOM 598 C LEU A 41 -1.786 -11.865 5.168 1.00 0.00 C ATOM 599 O LEU A 41 -1.307 -11.839 4.036 1.00 0.00 O ATOM 600 CB LEU A 41 -0.853 -11.008 7.325 1.00 0.00 C ATOM 601 CG LEU A 41 0.644 -11.219 7.090 1.00 0.00 C ATOM 602 CD1 LEU A 41 1.391 -11.261 8.414 1.00 0.00 C ATOM 603 CD2 LEU A 41 0.885 -12.497 6.299 1.00 0.00 C ATOM 0 H LEU A 41 -3.098 -9.976 7.481 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.187 -9.849 5.547 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -0.977 -10.214 8.061 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -1.263 -11.917 7.765 1.00 0.00 H new ATOM 0 HG LEU A 41 1.023 -10.379 6.509 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.454 -11.412 8.227 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.246 -10.320 8.944 1.00 0.00 H new ATOM 0 HD13 LEU A 41 1.009 -12.082 9.021 1.00 0.00 H new ATOM 0 HD21 LEU A 41 1.955 -12.631 6.141 1.00 0.00 H new ATOM 0 HD22 LEU A 41 0.491 -13.348 6.854 1.00 0.00 H new ATOM 0 HD23 LEU A 41 0.382 -12.428 5.335 1.00 0.00 H new ATOM 615 N ASN A 42 -2.418 -12.925 5.662 1.00 0.00 N ATOM 616 CA ASN A 42 -2.586 -14.146 4.882 1.00 0.00 C ATOM 617 C ASN A 42 -3.081 -13.829 3.474 1.00 0.00 C ATOM 618 O ASN A 42 -2.480 -14.249 2.485 1.00 0.00 O ATOM 619 CB ASN A 42 -3.569 -15.090 5.579 1.00 0.00 C ATOM 620 CG ASN A 42 -2.887 -15.993 6.588 1.00 0.00 C ATOM 621 OD1 ASN A 42 -2.686 -17.182 6.337 1.00 0.00 O ATOM 622 ND2 ASN A 42 -2.526 -15.432 7.736 1.00 0.00 N ATOM 0 H ASN A 42 -2.822 -12.963 6.598 1.00 0.00 H new ATOM 0 HA ASN A 42 -1.615 -14.635 4.805 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -4.337 -14.503 6.082 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -4.074 -15.702 4.831 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -2.062 -15.990 8.453 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -2.713 -14.443 7.901 1.00 0.00 H new ATOM 629 N ARG A 43 -4.178 -13.084 3.392 1.00 0.00 N ATOM 630 CA ARG A 43 -4.754 -12.710 2.106 1.00 0.00 C ATOM 631 C ARG A 43 -3.671 -12.223 1.147 1.00 0.00 C ATOM 632 O ARG A 43 -3.525 -12.746 0.042 1.00 0.00 O ATOM 633 CB ARG A 43 -5.812 -11.621 2.294 1.00 0.00 C ATOM 634 CG ARG A 43 -7.202 -12.165 2.578 1.00 0.00 C ATOM 635 CD ARG A 43 -7.977 -12.412 1.294 1.00 0.00 C ATOM 636 NE ARG A 43 -7.715 -13.738 0.742 1.00 0.00 N ATOM 637 CZ ARG A 43 -8.139 -14.134 -0.453 1.00 0.00 C ATOM 638 NH1 ARG A 43 -8.840 -13.309 -1.218 1.00 0.00 N ATOM 639 NH2 ARG A 43 -7.860 -15.357 -0.885 1.00 0.00 N ATOM 0 H ARG A 43 -4.686 -12.727 4.201 1.00 0.00 H new ATOM 0 HA ARG A 43 -5.225 -13.594 1.676 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -5.510 -10.971 3.116 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -5.849 -11.004 1.397 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -7.122 -13.095 3.140 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -7.749 -11.460 3.204 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.044 -12.305 1.489 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -7.710 -11.654 0.558 1.00 0.00 H new ATOM 0 HE ARG A 43 -7.177 -14.397 1.305 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -9.055 -12.368 -0.889 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -9.164 -13.616 -2.135 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -7.320 -15.994 -0.299 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -8.186 -15.660 -1.803 1.00 0.00 H new ATOM 653 N LEU A 44 -2.916 -11.218 1.577 1.00 0.00 N ATOM 654 CA LEU A 44 -1.846 -10.659 0.757 1.00 0.00 C ATOM 655 C LEU A 44 -0.745 -11.689 0.523 1.00 0.00 C ATOM 656 O LEU A 44 -0.113 -11.706 -0.533 1.00 0.00 O ATOM 657 CB LEU A 44 -1.262 -9.414 1.426 1.00 0.00 C ATOM 658 CG LEU A 44 -2.221 -8.237 1.608 1.00 0.00 C ATOM 659 CD1 LEU A 44 -1.632 -7.210 2.562 1.00 0.00 C ATOM 660 CD2 LEU A 44 -2.541 -7.597 0.264 1.00 0.00 C ATOM 0 H LEU A 44 -3.025 -10.773 2.489 1.00 0.00 H new ATOM 0 HA LEU A 44 -2.269 -10.381 -0.208 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -0.878 -9.699 2.406 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.410 -9.075 0.836 1.00 0.00 H new ATOM 0 HG LEU A 44 -3.149 -8.613 2.040 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.329 -6.380 2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -1.455 -7.674 3.532 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.689 -6.838 2.160 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -3.225 -6.761 0.413 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -1.621 -7.236 -0.195 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -3.007 -8.335 -0.389 1.00 0.00 H new ATOM 672 N ARG A 45 -0.523 -12.546 1.514 1.00 0.00 N ATOM 673 CA ARG A 45 0.501 -13.579 1.415 1.00 0.00 C ATOM 674 C ARG A 45 0.271 -14.457 0.188 1.00 0.00 C ATOM 675 O ARG A 45 1.204 -15.059 -0.341 1.00 0.00 O ATOM 676 CB ARG A 45 0.508 -14.442 2.678 1.00 0.00 C ATOM 677 CG ARG A 45 1.875 -15.016 3.016 1.00 0.00 C ATOM 678 CD ARG A 45 1.837 -15.824 4.303 1.00 0.00 C ATOM 679 NE ARG A 45 1.377 -17.192 4.077 1.00 0.00 N ATOM 680 CZ ARG A 45 1.270 -18.100 5.040 1.00 0.00 C ATOM 681 NH1 ARG A 45 1.588 -17.787 6.289 1.00 0.00 N ATOM 682 NH2 ARG A 45 0.845 -19.324 4.756 1.00 0.00 N ATOM 0 H ARG A 45 -1.038 -12.546 2.394 1.00 0.00 H new ATOM 0 HA ARG A 45 1.469 -13.088 1.313 1.00 0.00 H new ATOM 0 HB2 ARG A 45 0.157 -13.844 3.519 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -0.200 -15.261 2.552 1.00 0.00 H new ATOM 0 HG2 ARG A 45 2.217 -15.649 2.198 1.00 0.00 H new ATOM 0 HG3 ARG A 45 2.597 -14.205 3.115 1.00 0.00 H new ATOM 0 HD2 ARG A 45 2.832 -15.845 4.747 1.00 0.00 H new ATOM 0 HD3 ARG A 45 1.178 -15.334 5.020 1.00 0.00 H new ATOM 0 HE ARG A 45 1.124 -17.465 3.127 1.00 0.00 H new ATOM 0 HH11 ARG A 45 1.916 -16.847 6.512 1.00 0.00 H new ATOM 0 HH12 ARG A 45 1.505 -18.486 7.027 1.00 0.00 H new ATOM 0 HH21 ARG A 45 0.600 -19.569 3.797 1.00 0.00 H new ATOM 0 HH22 ARG A 45 0.763 -20.020 5.497 1.00 0.00 H new ATOM 696 N ALA A 46 -0.979 -14.524 -0.259 1.00 0.00 N ATOM 697 CA ALA A 46 -1.332 -15.326 -1.424 1.00 0.00 C ATOM 698 C ALA A 46 -1.407 -14.466 -2.681 1.00 0.00 C ATOM 699 O ALA A 46 -0.900 -14.847 -3.736 1.00 0.00 O ATOM 700 CB ALA A 46 -2.654 -16.042 -1.192 1.00 0.00 C ATOM 0 H ALA A 46 -1.764 -14.032 0.168 1.00 0.00 H new ATOM 0 HA ALA A 46 -0.550 -16.071 -1.571 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -2.905 -16.637 -2.070 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -2.566 -16.696 -0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -3.440 -15.307 -1.015 1.00 0.00 H new ATOM 706 N GLN A 47 -2.043 -13.305 -2.560 1.00 0.00 N ATOM 707 CA GLN A 47 -2.185 -12.392 -3.688 1.00 0.00 C ATOM 708 C GLN A 47 -0.820 -11.972 -4.225 1.00 0.00 C ATOM 709 O GLN A 47 -0.534 -12.127 -5.412 1.00 0.00 O ATOM 710 CB GLN A 47 -2.985 -11.156 -3.273 1.00 0.00 C ATOM 711 CG GLN A 47 -4.465 -11.431 -3.062 1.00 0.00 C ATOM 712 CD GLN A 47 -5.088 -12.189 -4.217 1.00 0.00 C ATOM 713 OE1 GLN A 47 -5.424 -13.367 -4.093 1.00 0.00 O ATOM 714 NE2 GLN A 47 -5.246 -11.516 -5.351 1.00 0.00 N ATOM 0 H GLN A 47 -2.468 -12.975 -1.693 1.00 0.00 H new ATOM 0 HA GLN A 47 -2.721 -12.915 -4.480 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -2.564 -10.754 -2.352 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -2.872 -10.387 -4.037 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -4.597 -12.003 -2.144 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -4.991 -10.486 -2.927 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -4.954 -10.541 -5.410 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -5.660 -11.974 -6.163 1.00 0.00 H new ATOM 723 N THR A 48 0.019 -11.440 -3.342 1.00 0.00 N ATOM 724 CA THR A 48 1.353 -10.997 -3.727 1.00 0.00 C ATOM 725 C THR A 48 2.313 -12.176 -3.838 1.00 0.00 C ATOM 726 O THR A 48 3.378 -12.067 -4.446 1.00 0.00 O ATOM 727 CB THR A 48 1.921 -9.981 -2.717 1.00 0.00 C ATOM 728 OG1 THR A 48 2.109 -10.609 -1.444 1.00 0.00 O ATOM 729 CG2 THR A 48 0.988 -8.789 -2.567 1.00 0.00 C ATOM 0 H THR A 48 -0.202 -11.305 -2.355 1.00 0.00 H new ATOM 0 HA THR A 48 1.258 -10.516 -4.701 1.00 0.00 H new ATOM 0 HB THR A 48 2.881 -9.626 -3.092 1.00 0.00 H new ATOM 0 HG1 THR A 48 1.239 -10.743 -1.014 1.00 0.00 H new ATOM 0 HG21 THR A 48 1.409 -8.085 -1.849 1.00 0.00 H new ATOM 0 HG22 THR A 48 0.869 -8.296 -3.532 1.00 0.00 H new ATOM 0 HG23 THR A 48 0.016 -9.130 -2.212 1.00 0.00 H new ATOM 737 N LYS A 49 1.929 -13.303 -3.249 1.00 0.00 N ATOM 738 CA LYS A 49 2.755 -14.504 -3.284 1.00 0.00 C ATOM 739 C LYS A 49 4.108 -14.254 -2.625 1.00 0.00 C ATOM 740 O LYS A 49 5.121 -14.829 -3.027 1.00 0.00 O ATOM 741 CB LYS A 49 2.957 -14.968 -4.728 1.00 0.00 C ATOM 742 CG LYS A 49 1.657 -15.229 -5.470 1.00 0.00 C ATOM 743 CD LYS A 49 1.168 -16.652 -5.254 1.00 0.00 C ATOM 744 CE LYS A 49 0.162 -17.063 -6.318 1.00 0.00 C ATOM 745 NZ LYS A 49 -1.165 -16.422 -6.103 1.00 0.00 N ATOM 0 H LYS A 49 1.051 -13.410 -2.741 1.00 0.00 H new ATOM 0 HA LYS A 49 2.238 -15.286 -2.727 1.00 0.00 H new ATOM 0 HB2 LYS A 49 3.528 -14.212 -5.267 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.555 -15.879 -4.728 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.896 -14.526 -5.131 1.00 0.00 H new ATOM 0 HG3 LYS A 49 1.803 -15.051 -6.535 1.00 0.00 H new ATOM 0 HD2 LYS A 49 2.017 -17.336 -5.271 1.00 0.00 H new ATOM 0 HD3 LYS A 49 0.711 -16.735 -4.268 1.00 0.00 H new ATOM 0 HE2 LYS A 49 0.542 -16.790 -7.302 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.047 -18.147 -6.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.891 -17.157 -5.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.131 -15.831 -5.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.401 -15.829 -6.924 1.00 0.00 H new ATOM 759 N LEU A 50 4.118 -13.394 -1.613 1.00 0.00 N ATOM 760 CA LEU A 50 5.347 -13.069 -0.897 1.00 0.00 C ATOM 761 C LEU A 50 5.365 -13.725 0.480 1.00 0.00 C ATOM 762 O LEU A 50 4.467 -14.493 0.826 1.00 0.00 O ATOM 763 CB LEU A 50 5.491 -11.553 -0.755 1.00 0.00 C ATOM 764 CG LEU A 50 6.240 -10.841 -1.883 1.00 0.00 C ATOM 765 CD1 LEU A 50 6.182 -9.334 -1.693 1.00 0.00 C ATOM 766 CD2 LEU A 50 7.684 -11.318 -1.948 1.00 0.00 C ATOM 0 H LEU A 50 3.289 -12.909 -1.269 1.00 0.00 H new ATOM 0 HA LEU A 50 6.188 -13.455 -1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 50 4.494 -11.119 -0.677 1.00 0.00 H new ATOM 0 HB3 LEU A 50 6.004 -11.343 0.184 1.00 0.00 H new ATOM 0 HG LEU A 50 5.755 -11.086 -2.828 1.00 0.00 H new ATOM 0 HD11 LEU A 50 6.720 -8.844 -2.505 1.00 0.00 H new ATOM 0 HD12 LEU A 50 5.142 -9.007 -1.697 1.00 0.00 H new ATOM 0 HD13 LEU A 50 6.642 -9.069 -0.741 1.00 0.00 H new ATOM 0 HD21 LEU A 50 8.202 -10.801 -2.756 1.00 0.00 H new ATOM 0 HD22 LEU A 50 8.181 -11.103 -1.002 1.00 0.00 H new ATOM 0 HD23 LEU A 50 7.704 -12.392 -2.133 1.00 0.00 H new ATOM 778 N THR A 51 6.393 -13.414 1.264 1.00 0.00 N ATOM 779 CA THR A 51 6.527 -13.971 2.604 1.00 0.00 C ATOM 780 C THR A 51 5.828 -13.096 3.637 1.00 0.00 C ATOM 781 O THR A 51 5.655 -11.894 3.431 1.00 0.00 O ATOM 782 CB THR A 51 8.007 -14.130 3.000 1.00 0.00 C ATOM 783 OG1 THR A 51 8.726 -12.928 2.702 1.00 0.00 O ATOM 784 CG2 THR A 51 8.642 -15.301 2.265 1.00 0.00 C ATOM 0 H THR A 51 7.144 -12.779 0.994 1.00 0.00 H new ATOM 0 HA THR A 51 6.055 -14.953 2.586 1.00 0.00 H new ATOM 0 HB THR A 51 8.054 -14.325 4.071 1.00 0.00 H new ATOM 0 HG1 THR A 51 9.666 -13.037 2.958 1.00 0.00 H new ATOM 0 HG21 THR A 51 9.687 -15.393 2.561 1.00 0.00 H new ATOM 0 HG22 THR A 51 8.111 -16.219 2.516 1.00 0.00 H new ATOM 0 HG23 THR A 51 8.583 -15.131 1.190 1.00 0.00 H new ATOM 792 N ARG A 52 5.427 -13.704 4.748 1.00 0.00 N ATOM 793 CA ARG A 52 4.746 -12.979 5.814 1.00 0.00 C ATOM 794 C ARG A 52 5.605 -11.825 6.322 1.00 0.00 C ATOM 795 O ARG A 52 5.091 -10.764 6.676 1.00 0.00 O ATOM 796 CB ARG A 52 4.407 -13.924 6.968 1.00 0.00 C ATOM 797 CG ARG A 52 5.616 -14.647 7.537 1.00 0.00 C ATOM 798 CD ARG A 52 5.239 -16.013 8.089 1.00 0.00 C ATOM 799 NE ARG A 52 4.604 -16.856 7.079 1.00 0.00 N ATOM 800 CZ ARG A 52 5.281 -17.597 6.209 1.00 0.00 C ATOM 801 NH1 ARG A 52 6.607 -17.599 6.226 1.00 0.00 N ATOM 802 NH2 ARG A 52 4.632 -18.337 5.320 1.00 0.00 N ATOM 0 H ARG A 52 5.562 -14.698 4.934 1.00 0.00 H new ATOM 0 HA ARG A 52 3.822 -12.569 5.407 1.00 0.00 H new ATOM 0 HB2 ARG A 52 3.927 -13.355 7.764 1.00 0.00 H new ATOM 0 HB3 ARG A 52 3.683 -14.661 6.622 1.00 0.00 H new ATOM 0 HG2 ARG A 52 6.371 -14.763 6.760 1.00 0.00 H new ATOM 0 HG3 ARG A 52 6.063 -14.044 8.328 1.00 0.00 H new ATOM 0 HD2 ARG A 52 6.132 -16.510 8.467 1.00 0.00 H new ATOM 0 HD3 ARG A 52 4.562 -15.888 8.934 1.00 0.00 H new ATOM 0 HE ARG A 52 3.585 -16.877 7.040 1.00 0.00 H new ATOM 0 HH11 ARG A 52 7.109 -17.031 6.908 1.00 0.00 H new ATOM 0 HH12 ARG A 52 7.125 -18.169 5.557 1.00 0.00 H new ATOM 0 HH21 ARG A 52 3.612 -18.337 5.304 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.153 -18.906 4.652 1.00 0.00 H new ATOM 816 N ARG A 53 6.916 -12.041 6.357 1.00 0.00 N ATOM 817 CA ARG A 53 7.847 -11.021 6.824 1.00 0.00 C ATOM 818 C ARG A 53 7.881 -9.836 5.863 1.00 0.00 C ATOM 819 O ARG A 53 7.845 -8.681 6.287 1.00 0.00 O ATOM 820 CB ARG A 53 9.250 -11.610 6.973 1.00 0.00 C ATOM 821 CG ARG A 53 9.327 -12.756 7.969 1.00 0.00 C ATOM 822 CD ARG A 53 9.309 -12.251 9.403 1.00 0.00 C ATOM 823 NE ARG A 53 10.446 -11.381 9.691 1.00 0.00 N ATOM 824 CZ ARG A 53 10.703 -10.881 10.895 1.00 0.00 C ATOM 825 NH1 ARG A 53 9.908 -11.165 11.917 1.00 0.00 N ATOM 826 NH2 ARG A 53 11.757 -10.097 11.078 1.00 0.00 N ATOM 0 H ARG A 53 7.357 -12.914 6.067 1.00 0.00 H new ATOM 0 HA ARG A 53 7.503 -10.669 7.797 1.00 0.00 H new ATOM 0 HB2 ARG A 53 9.592 -11.962 6.000 1.00 0.00 H new ATOM 0 HB3 ARG A 53 9.935 -10.821 7.286 1.00 0.00 H new ATOM 0 HG2 ARG A 53 8.488 -13.434 7.811 1.00 0.00 H new ATOM 0 HG3 ARG A 53 10.238 -13.329 7.796 1.00 0.00 H new ATOM 0 HD2 ARG A 53 8.382 -11.708 9.584 1.00 0.00 H new ATOM 0 HD3 ARG A 53 9.320 -13.100 10.087 1.00 0.00 H new ATOM 0 HE ARG A 53 11.078 -11.144 8.926 1.00 0.00 H new ATOM 0 HH11 ARG A 53 9.097 -11.768 11.780 1.00 0.00 H new ATOM 0 HH12 ARG A 53 10.107 -10.780 12.840 1.00 0.00 H new ATOM 0 HH21 ARG A 53 12.371 -9.877 10.294 1.00 0.00 H new ATOM 0 HH22 ARG A 53 11.953 -9.714 12.003 1.00 0.00 H new ATOM 840 N GLU A 54 7.950 -10.131 4.569 1.00 0.00 N ATOM 841 CA GLU A 54 7.990 -9.089 3.550 1.00 0.00 C ATOM 842 C GLU A 54 6.793 -8.152 3.682 1.00 0.00 C ATOM 843 O GLU A 54 6.949 -6.932 3.726 1.00 0.00 O ATOM 844 CB GLU A 54 8.012 -9.713 2.152 1.00 0.00 C ATOM 845 CG GLU A 54 9.354 -10.317 1.776 1.00 0.00 C ATOM 846 CD GLU A 54 10.272 -9.320 1.096 1.00 0.00 C ATOM 847 OE1 GLU A 54 9.950 -8.889 -0.031 1.00 0.00 O ATOM 848 OE2 GLU A 54 11.314 -8.971 1.691 1.00 0.00 O ATOM 0 H GLU A 54 7.979 -11.082 4.202 1.00 0.00 H new ATOM 0 HA GLU A 54 8.901 -8.509 3.696 1.00 0.00 H new ATOM 0 HB2 GLU A 54 7.247 -10.487 2.097 1.00 0.00 H new ATOM 0 HB3 GLU A 54 7.748 -8.951 1.419 1.00 0.00 H new ATOM 0 HG2 GLU A 54 9.840 -10.700 2.673 1.00 0.00 H new ATOM 0 HG3 GLU A 54 9.193 -11.167 1.114 1.00 0.00 H new ATOM 855 N ILE A 55 5.599 -8.733 3.744 1.00 0.00 N ATOM 856 CA ILE A 55 4.376 -7.950 3.871 1.00 0.00 C ATOM 857 C ILE A 55 4.333 -7.211 5.204 1.00 0.00 C ATOM 858 O ILE A 55 4.317 -5.980 5.243 1.00 0.00 O ATOM 859 CB ILE A 55 3.124 -8.839 3.749 1.00 0.00 C ATOM 860 CG1 ILE A 55 3.132 -9.588 2.415 1.00 0.00 C ATOM 861 CG2 ILE A 55 1.863 -7.998 3.883 1.00 0.00 C ATOM 862 CD1 ILE A 55 2.139 -10.728 2.356 1.00 0.00 C ATOM 0 H ILE A 55 5.453 -9.742 3.708 1.00 0.00 H new ATOM 0 HA ILE A 55 4.378 -7.226 3.057 1.00 0.00 H new ATOM 0 HB ILE A 55 3.136 -9.572 4.556 1.00 0.00 H new ATOM 0 HG12 ILE A 55 2.914 -8.885 1.611 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.133 -9.979 2.233 1.00 0.00 H new ATOM 0 HG21 ILE A 55 0.986 -8.640 3.795 1.00 0.00 H new ATOM 0 HG22 ILE A 55 1.856 -7.506 4.855 1.00 0.00 H new ATOM 0 HG23 ILE A 55 1.842 -7.245 3.095 1.00 0.00 H new ATOM 0 HD11 ILE A 55 2.200 -11.214 1.382 1.00 0.00 H new ATOM 0 HD12 ILE A 55 2.369 -11.452 3.137 1.00 0.00 H new ATOM 0 HD13 ILE A 55 1.131 -10.341 2.506 1.00 0.00 H new ATOM 874 N ASP A 56 4.315 -7.969 6.295 1.00 0.00 N ATOM 875 CA ASP A 56 4.277 -7.387 7.631 1.00 0.00 C ATOM 876 C ASP A 56 5.315 -6.278 7.770 1.00 0.00 C ATOM 877 O ASP A 56 5.006 -5.178 8.227 1.00 0.00 O ATOM 878 CB ASP A 56 4.519 -8.465 8.688 1.00 0.00 C ATOM 879 CG ASP A 56 4.099 -8.021 10.075 1.00 0.00 C ATOM 880 OD1 ASP A 56 2.915 -7.665 10.252 1.00 0.00 O ATOM 881 OD2 ASP A 56 4.955 -8.028 10.985 1.00 0.00 O ATOM 0 H ASP A 56 4.326 -8.989 6.280 1.00 0.00 H new ATOM 0 HA ASP A 56 3.288 -6.956 7.784 1.00 0.00 H new ATOM 0 HB2 ASP A 56 3.969 -9.366 8.416 1.00 0.00 H new ATOM 0 HB3 ASP A 56 5.577 -8.728 8.699 1.00 0.00 H new ATOM 886 N ALA A 57 6.549 -6.577 7.375 1.00 0.00 N ATOM 887 CA ALA A 57 7.633 -5.605 7.455 1.00 0.00 C ATOM 888 C ALA A 57 7.338 -4.382 6.593 1.00 0.00 C ATOM 889 O ALA A 57 7.520 -3.246 7.029 1.00 0.00 O ATOM 890 CB ALA A 57 8.947 -6.246 7.035 1.00 0.00 C ATOM 0 H ALA A 57 6.822 -7.484 6.997 1.00 0.00 H new ATOM 0 HA ALA A 57 7.717 -5.275 8.490 1.00 0.00 H new ATOM 0 HB1 ALA A 57 9.748 -5.510 7.099 1.00 0.00 H new ATOM 0 HB2 ALA A 57 9.171 -7.084 7.695 1.00 0.00 H new ATOM 0 HB3 ALA A 57 8.865 -6.605 6.009 1.00 0.00 H new ATOM 896 N TRP A 58 6.885 -4.623 5.368 1.00 0.00 N ATOM 897 CA TRP A 58 6.566 -3.540 4.445 1.00 0.00 C ATOM 898 C TRP A 58 5.587 -2.556 5.076 1.00 0.00 C ATOM 899 O TRP A 58 5.884 -1.368 5.208 1.00 0.00 O ATOM 900 CB TRP A 58 5.978 -4.102 3.150 1.00 0.00 C ATOM 901 CG TRP A 58 5.799 -3.068 2.080 1.00 0.00 C ATOM 902 CD1 TRP A 58 6.739 -2.643 1.186 1.00 0.00 C ATOM 903 CD2 TRP A 58 4.607 -2.328 1.795 1.00 0.00 C ATOM 904 NE1 TRP A 58 6.204 -1.682 0.362 1.00 0.00 N ATOM 905 CE2 TRP A 58 4.897 -1.472 0.714 1.00 0.00 C ATOM 906 CE3 TRP A 58 3.323 -2.306 2.346 1.00 0.00 C ATOM 907 CZ2 TRP A 58 3.949 -0.605 0.177 1.00 0.00 C ATOM 908 CZ3 TRP A 58 2.384 -1.444 1.812 1.00 0.00 C ATOM 909 CH2 TRP A 58 2.700 -0.604 0.736 1.00 0.00 C ATOM 0 H TRP A 58 6.730 -5.558 4.991 1.00 0.00 H new ATOM 0 HA TRP A 58 7.490 -3.008 4.216 1.00 0.00 H new ATOM 0 HB2 TRP A 58 6.630 -4.892 2.776 1.00 0.00 H new ATOM 0 HB3 TRP A 58 5.013 -4.561 3.367 1.00 0.00 H new ATOM 0 HD1 TRP A 58 7.754 -3.008 1.134 1.00 0.00 H new ATOM 0 HE1 TRP A 58 6.700 -1.203 -0.390 1.00 0.00 H new ATOM 0 HE3 TRP A 58 3.069 -2.951 3.174 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 4.191 0.044 -0.652 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 1.389 -1.417 2.231 1.00 0.00 H new ATOM 0 HH2 TRP A 58 1.943 0.057 0.340 1.00 0.00 H new ATOM 920 N PHE A 59 4.420 -3.057 5.466 1.00 0.00 N ATOM 921 CA PHE A 59 3.397 -2.221 6.084 1.00 0.00 C ATOM 922 C PHE A 59 4.009 -1.299 7.134 1.00 0.00 C ATOM 923 O PHE A 59 3.684 -0.114 7.203 1.00 0.00 O ATOM 924 CB PHE A 59 2.314 -3.093 6.723 1.00 0.00 C ATOM 925 CG PHE A 59 1.238 -3.513 5.762 1.00 0.00 C ATOM 926 CD1 PHE A 59 1.556 -4.210 4.607 1.00 0.00 C ATOM 927 CD2 PHE A 59 -0.091 -3.212 6.014 1.00 0.00 C ATOM 928 CE1 PHE A 59 0.569 -4.597 3.721 1.00 0.00 C ATOM 929 CE2 PHE A 59 -1.083 -3.596 5.132 1.00 0.00 C ATOM 930 CZ PHE A 59 -0.753 -4.291 3.985 1.00 0.00 C ATOM 0 H PHE A 59 4.159 -4.038 5.365 1.00 0.00 H new ATOM 0 HA PHE A 59 2.946 -1.606 5.305 1.00 0.00 H new ATOM 0 HB2 PHE A 59 2.779 -3.983 7.147 1.00 0.00 H new ATOM 0 HB3 PHE A 59 1.859 -2.546 7.549 1.00 0.00 H new ATOM 0 HD1 PHE A 59 2.587 -4.453 4.397 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -0.355 -2.671 6.911 1.00 0.00 H new ATOM 0 HE1 PHE A 59 0.830 -5.138 2.823 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -2.115 -3.353 5.339 1.00 0.00 H new ATOM 0 HZ PHE A 59 -1.527 -4.595 3.295 1.00 0.00 H new ATOM 940 N THR A 60 4.899 -1.853 7.953 1.00 0.00 N ATOM 941 CA THR A 60 5.556 -1.082 9.001 1.00 0.00 C ATOM 942 C THR A 60 6.209 0.172 8.434 1.00 0.00 C ATOM 943 O THR A 60 5.787 1.290 8.728 1.00 0.00 O ATOM 944 CB THR A 60 6.625 -1.920 9.728 1.00 0.00 C ATOM 945 OG1 THR A 60 6.074 -3.183 10.120 1.00 0.00 O ATOM 946 CG2 THR A 60 7.147 -1.186 10.953 1.00 0.00 C ATOM 0 H THR A 60 5.181 -2.832 7.910 1.00 0.00 H new ATOM 0 HA THR A 60 4.783 -0.795 9.714 1.00 0.00 H new ATOM 0 HB THR A 60 7.456 -2.084 9.042 1.00 0.00 H new ATOM 0 HG1 THR A 60 5.931 -3.738 9.325 1.00 0.00 H new ATOM 0 HG21 THR A 60 7.900 -1.797 11.450 1.00 0.00 H new ATOM 0 HG22 THR A 60 7.592 -0.239 10.648 1.00 0.00 H new ATOM 0 HG23 THR A 60 6.323 -0.995 11.641 1.00 0.00 H new ATOM 954 N GLU A 61 7.242 -0.020 7.618 1.00 0.00 N ATOM 955 CA GLU A 61 7.953 1.098 7.010 1.00 0.00 C ATOM 956 C GLU A 61 6.974 2.118 6.437 1.00 0.00 C ATOM 957 O GLU A 61 7.076 3.315 6.709 1.00 0.00 O ATOM 958 CB GLU A 61 8.888 0.597 5.908 1.00 0.00 C ATOM 959 CG GLU A 61 8.282 0.667 4.516 1.00 0.00 C ATOM 960 CD GLU A 61 9.275 0.308 3.428 1.00 0.00 C ATOM 961 OE1 GLU A 61 10.492 0.315 3.709 1.00 0.00 O ATOM 962 OE2 GLU A 61 8.835 0.021 2.295 1.00 0.00 O ATOM 0 H GLU A 61 7.604 -0.939 7.363 1.00 0.00 H new ATOM 0 HA GLU A 61 8.545 1.584 7.785 1.00 0.00 H new ATOM 0 HB2 GLU A 61 9.805 1.186 5.926 1.00 0.00 H new ATOM 0 HB3 GLU A 61 9.168 -0.435 6.122 1.00 0.00 H new ATOM 0 HG2 GLU A 61 7.429 -0.009 4.461 1.00 0.00 H new ATOM 0 HG3 GLU A 61 7.903 1.674 4.339 1.00 0.00 H new ATOM 969 N LYS A 62 6.025 1.637 5.641 1.00 0.00 N ATOM 970 CA LYS A 62 5.026 2.504 5.028 1.00 0.00 C ATOM 971 C LYS A 62 4.514 3.535 6.029 1.00 0.00 C ATOM 972 O LYS A 62 4.259 4.687 5.675 1.00 0.00 O ATOM 973 CB LYS A 62 3.858 1.673 4.493 1.00 0.00 C ATOM 974 CG LYS A 62 4.067 1.175 3.073 1.00 0.00 C ATOM 975 CD LYS A 62 4.031 2.316 2.070 1.00 0.00 C ATOM 976 CE LYS A 62 2.620 2.565 1.559 1.00 0.00 C ATOM 977 NZ LYS A 62 2.405 3.993 1.198 1.00 0.00 N ATOM 0 H LYS A 62 5.927 0.650 5.405 1.00 0.00 H new ATOM 0 HA LYS A 62 5.498 3.031 4.199 1.00 0.00 H new ATOM 0 HB2 LYS A 62 3.701 0.817 5.150 1.00 0.00 H new ATOM 0 HB3 LYS A 62 2.949 2.274 4.529 1.00 0.00 H new ATOM 0 HG2 LYS A 62 5.025 0.660 3.005 1.00 0.00 H new ATOM 0 HG3 LYS A 62 3.295 0.447 2.825 1.00 0.00 H new ATOM 0 HD2 LYS A 62 4.416 3.223 2.536 1.00 0.00 H new ATOM 0 HD3 LYS A 62 4.687 2.085 1.231 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.434 1.938 0.687 1.00 0.00 H new ATOM 0 HE3 LYS A 62 1.900 2.271 2.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 1.432 4.121 0.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 2.558 4.590 2.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 3.075 4.267 0.451 1.00 0.00 H new ATOM 991 N LYS A 63 4.366 3.115 7.280 1.00 0.00 N ATOM 992 CA LYS A 63 3.886 4.002 8.334 1.00 0.00 C ATOM 993 C LYS A 63 4.831 5.184 8.521 1.00 0.00 C ATOM 994 O LYS A 63 4.415 6.341 8.456 1.00 0.00 O ATOM 995 CB LYS A 63 3.746 3.234 9.650 1.00 0.00 C ATOM 996 CG LYS A 63 2.767 2.075 9.577 1.00 0.00 C ATOM 997 CD LYS A 63 2.804 1.233 10.841 1.00 0.00 C ATOM 998 CE LYS A 63 1.761 0.127 10.805 1.00 0.00 C ATOM 999 NZ LYS A 63 2.178 -1.056 11.609 1.00 0.00 N ATOM 0 H LYS A 63 4.572 2.165 7.590 1.00 0.00 H new ATOM 0 HA LYS A 63 2.909 4.384 8.037 1.00 0.00 H new ATOM 0 HB2 LYS A 63 4.724 2.854 9.945 1.00 0.00 H new ATOM 0 HB3 LYS A 63 3.423 3.923 10.430 1.00 0.00 H new ATOM 0 HG2 LYS A 63 1.758 2.459 9.424 1.00 0.00 H new ATOM 0 HG3 LYS A 63 3.005 1.451 8.716 1.00 0.00 H new ATOM 0 HD2 LYS A 63 3.795 0.796 10.959 1.00 0.00 H new ATOM 0 HD3 LYS A 63 2.631 1.870 11.709 1.00 0.00 H new ATOM 0 HE2 LYS A 63 0.814 0.509 11.185 1.00 0.00 H new ATOM 0 HE3 LYS A 63 1.590 -0.178 9.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 1.440 -1.787 11.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 3.069 -1.436 11.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 2.316 -0.771 12.600 1.00 0.00 H new ATOM 1013 N LYS A 64 6.105 4.887 8.753 1.00 0.00 N ATOM 1014 CA LYS A 64 7.111 5.925 8.947 1.00 0.00 C ATOM 1015 C LYS A 64 6.902 7.075 7.968 1.00 0.00 C ATOM 1016 O LYS A 64 6.914 8.243 8.355 1.00 0.00 O ATOM 1017 CB LYS A 64 8.515 5.342 8.774 1.00 0.00 C ATOM 1018 CG LYS A 64 8.969 4.489 9.946 1.00 0.00 C ATOM 1019 CD LYS A 64 10.292 3.800 9.655 1.00 0.00 C ATOM 1020 CE LYS A 64 10.443 2.521 10.463 1.00 0.00 C ATOM 1021 NZ LYS A 64 11.850 2.031 10.468 1.00 0.00 N ATOM 0 H LYS A 64 6.466 3.935 8.811 1.00 0.00 H new ATOM 0 HA LYS A 64 7.007 6.311 9.961 1.00 0.00 H new ATOM 0 HB2 LYS A 64 8.540 4.739 7.866 1.00 0.00 H new ATOM 0 HB3 LYS A 64 9.223 6.158 8.634 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.070 5.113 10.834 1.00 0.00 H new ATOM 0 HG3 LYS A 64 8.209 3.740 10.168 1.00 0.00 H new ATOM 0 HD2 LYS A 64 10.357 3.570 8.592 1.00 0.00 H new ATOM 0 HD3 LYS A 64 11.115 4.477 9.886 1.00 0.00 H new ATOM 0 HE2 LYS A 64 10.116 2.698 11.488 1.00 0.00 H new ATOM 0 HE3 LYS A 64 9.792 1.751 10.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 11.911 1.158 11.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.154 1.838 9.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 12.468 2.755 10.886 1.00 0.00 H new ATOM 1035 N SER A 65 6.708 6.736 6.697 1.00 0.00 N ATOM 1036 CA SER A 65 6.498 7.741 5.662 1.00 0.00 C ATOM 1037 C SER A 65 5.439 8.751 6.092 1.00 0.00 C ATOM 1038 O SER A 65 5.577 9.952 5.858 1.00 0.00 O ATOM 1039 CB SER A 65 6.080 7.073 4.350 1.00 0.00 C ATOM 1040 OG SER A 65 7.192 6.479 3.703 1.00 0.00 O ATOM 0 H SER A 65 6.692 5.773 6.360 1.00 0.00 H new ATOM 0 HA SER A 65 7.438 8.270 5.508 1.00 0.00 H new ATOM 0 HB2 SER A 65 5.323 6.314 4.550 1.00 0.00 H new ATOM 0 HB3 SER A 65 5.624 7.812 3.691 1.00 0.00 H new ATOM 0 HG SER A 65 6.898 6.058 2.868 1.00 0.00 H new ATOM 1046 N LYS A 66 4.379 8.256 6.722 1.00 0.00 N ATOM 1047 CA LYS A 66 3.295 9.112 7.187 1.00 0.00 C ATOM 1048 C LYS A 66 3.815 10.175 8.150 1.00 0.00 C ATOM 1049 O LYS A 66 3.331 11.306 8.162 1.00 0.00 O ATOM 1050 CB LYS A 66 2.213 8.274 7.871 1.00 0.00 C ATOM 1051 CG LYS A 66 0.818 8.864 7.749 1.00 0.00 C ATOM 1052 CD LYS A 66 -0.249 7.783 7.783 1.00 0.00 C ATOM 1053 CE LYS A 66 -0.410 7.203 9.180 1.00 0.00 C ATOM 1054 NZ LYS A 66 -1.053 8.170 10.111 1.00 0.00 N ATOM 0 H LYS A 66 4.248 7.265 6.922 1.00 0.00 H new ATOM 0 HA LYS A 66 2.864 9.613 6.320 1.00 0.00 H new ATOM 0 HB2 LYS A 66 2.214 7.273 7.440 1.00 0.00 H new ATOM 0 HB3 LYS A 66 2.462 8.167 8.927 1.00 0.00 H new ATOM 0 HG2 LYS A 66 0.648 9.570 8.562 1.00 0.00 H new ATOM 0 HG3 LYS A 66 0.739 9.425 6.818 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -1.200 8.198 7.448 1.00 0.00 H new ATOM 0 HD3 LYS A 66 0.015 6.988 7.086 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -1.010 6.294 9.129 1.00 0.00 H new ATOM 0 HE3 LYS A 66 0.567 6.918 9.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -1.360 7.672 10.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -0.371 8.913 10.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -1.878 8.602 9.648 1.00 0.00 H new ATOM 1068 N ALA A 67 4.805 9.803 8.954 1.00 0.00 N ATOM 1069 CA ALA A 67 5.394 10.725 9.918 1.00 0.00 C ATOM 1070 C ALA A 67 5.540 12.121 9.323 1.00 0.00 C ATOM 1071 O ALA A 67 5.077 13.105 9.901 1.00 0.00 O ATOM 1072 CB ALA A 67 6.744 10.206 10.389 1.00 0.00 C ATOM 0 H ALA A 67 5.216 8.870 8.957 1.00 0.00 H new ATOM 0 HA ALA A 67 4.724 10.792 10.775 1.00 0.00 H new ATOM 0 HB1 ALA A 67 7.172 10.905 11.108 1.00 0.00 H new ATOM 0 HB2 ALA A 67 6.615 9.232 10.862 1.00 0.00 H new ATOM 0 HB3 ALA A 67 7.414 10.109 9.535 1.00 0.00 H new ATOM 1078 N LEU A 68 6.187 12.201 8.165 1.00 0.00 N ATOM 1079 CA LEU A 68 6.395 13.478 7.492 1.00 0.00 C ATOM 1080 C LEU A 68 5.096 14.274 7.420 1.00 0.00 C ATOM 1081 O LEU A 68 4.004 13.711 7.505 1.00 0.00 O ATOM 1082 CB LEU A 68 6.945 13.250 6.083 1.00 0.00 C ATOM 1083 CG LEU A 68 5.928 12.814 5.027 1.00 0.00 C ATOM 1084 CD1 LEU A 68 5.169 14.016 4.489 1.00 0.00 C ATOM 1085 CD2 LEU A 68 6.621 12.067 3.896 1.00 0.00 C ATOM 0 H LEU A 68 6.576 11.397 7.673 1.00 0.00 H new ATOM 0 HA LEU A 68 7.119 14.052 8.070 1.00 0.00 H new ATOM 0 HB2 LEU A 68 7.416 14.173 5.745 1.00 0.00 H new ATOM 0 HB3 LEU A 68 7.728 12.494 6.138 1.00 0.00 H new ATOM 0 HG LEU A 68 5.212 12.139 5.496 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.450 13.686 3.739 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.641 14.508 5.306 1.00 0.00 H new ATOM 0 HD13 LEU A 68 5.871 14.716 4.036 1.00 0.00 H new ATOM 0 HD21 LEU A 68 5.882 11.764 3.154 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.359 12.718 3.428 1.00 0.00 H new ATOM 0 HD23 LEU A 68 7.118 11.183 4.295 1.00 0.00 H new ATOM 1097 N LYS A 69 5.220 15.587 7.260 1.00 0.00 N ATOM 1098 CA LYS A 69 4.057 16.462 7.173 1.00 0.00 C ATOM 1099 C LYS A 69 2.941 15.804 6.367 1.00 0.00 C ATOM 1100 O LYS A 69 2.953 15.834 5.137 1.00 0.00 O ATOM 1101 CB LYS A 69 4.444 17.797 6.534 1.00 0.00 C ATOM 1102 CG LYS A 69 5.293 18.678 7.433 1.00 0.00 C ATOM 1103 CD LYS A 69 5.203 20.140 7.028 1.00 0.00 C ATOM 1104 CE LYS A 69 6.309 20.965 7.668 1.00 0.00 C ATOM 1105 NZ LYS A 69 7.621 20.748 6.999 1.00 0.00 N ATOM 0 H LYS A 69 6.116 16.069 7.188 1.00 0.00 H new ATOM 0 HA LYS A 69 3.693 16.643 8.184 1.00 0.00 H new ATOM 0 HB2 LYS A 69 4.989 17.604 5.610 1.00 0.00 H new ATOM 0 HB3 LYS A 69 3.537 18.337 6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 69 4.967 18.565 8.467 1.00 0.00 H new ATOM 0 HG3 LYS A 69 6.332 18.351 7.389 1.00 0.00 H new ATOM 0 HD2 LYS A 69 5.267 20.223 5.943 1.00 0.00 H new ATOM 0 HD3 LYS A 69 4.233 20.541 7.321 1.00 0.00 H new ATOM 0 HE2 LYS A 69 6.047 22.022 7.620 1.00 0.00 H new ATOM 0 HE3 LYS A 69 6.392 20.705 8.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.322 21.413 7.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 7.940 19.773 7.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.520 20.907 5.976 1.00 0.00 H new ATOM 1119 N GLU A 70 1.979 15.214 7.068 1.00 0.00 N ATOM 1120 CA GLU A 70 0.856 14.550 6.416 1.00 0.00 C ATOM 1121 C GLU A 70 0.074 15.531 5.548 1.00 0.00 C ATOM 1122 O GLU A 70 -0.025 16.716 5.868 1.00 0.00 O ATOM 1123 CB GLU A 70 -0.071 13.923 7.459 1.00 0.00 C ATOM 1124 CG GLU A 70 -1.423 13.511 6.903 1.00 0.00 C ATOM 1125 CD GLU A 70 -2.179 12.583 7.834 1.00 0.00 C ATOM 1126 OE1 GLU A 70 -1.927 12.635 9.056 1.00 0.00 O ATOM 1127 OE2 GLU A 70 -3.021 11.804 7.341 1.00 0.00 O ATOM 0 H GLU A 70 1.954 15.182 8.087 1.00 0.00 H new ATOM 0 HA GLU A 70 1.255 13.763 5.776 1.00 0.00 H new ATOM 0 HB2 GLU A 70 0.418 13.048 7.888 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -0.223 14.634 8.271 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -2.023 14.402 6.719 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -1.281 13.018 5.941 1.00 0.00 H new ATOM 1134 N GLU A 71 -0.480 15.029 4.449 1.00 0.00 N ATOM 1135 CA GLU A 71 -1.252 15.862 3.535 1.00 0.00 C ATOM 1136 C GLU A 71 -2.560 16.311 4.181 1.00 0.00 C ATOM 1137 O GLU A 71 -2.925 17.485 4.119 1.00 0.00 O ATOM 1138 CB GLU A 71 -1.545 15.101 2.240 1.00 0.00 C ATOM 1139 CG GLU A 71 -0.298 14.735 1.454 1.00 0.00 C ATOM 1140 CD GLU A 71 0.611 15.925 1.214 1.00 0.00 C ATOM 1141 OE1 GLU A 71 0.380 16.659 0.231 1.00 0.00 O ATOM 1142 OE2 GLU A 71 1.554 16.122 2.010 1.00 0.00 O ATOM 0 H GLU A 71 -0.409 14.050 4.170 1.00 0.00 H new ATOM 0 HA GLU A 71 -0.659 16.747 3.302 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -2.093 14.190 2.480 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -2.196 15.708 1.611 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.253 13.964 1.993 1.00 0.00 H new ATOM 0 HG3 GLU A 71 -0.590 14.307 0.495 1.00 0.00 H new ATOM 1149 N LYS A 72 -3.262 15.368 4.799 1.00 0.00 N ATOM 1150 CA LYS A 72 -4.528 15.663 5.458 1.00 0.00 C ATOM 1151 C LYS A 72 -4.296 16.298 6.825 1.00 0.00 C ATOM 1152 O LYS A 72 -4.774 15.796 7.842 1.00 0.00 O ATOM 1153 CB LYS A 72 -5.358 14.386 5.611 1.00 0.00 C ATOM 1154 CG LYS A 72 -5.819 13.799 4.289 1.00 0.00 C ATOM 1155 CD LYS A 72 -6.249 12.349 4.442 1.00 0.00 C ATOM 1156 CE LYS A 72 -6.473 11.688 3.091 1.00 0.00 C ATOM 1157 NZ LYS A 72 -7.825 11.989 2.544 1.00 0.00 N ATOM 0 H LYS A 72 -2.975 14.391 4.857 1.00 0.00 H new ATOM 0 HA LYS A 72 -5.075 16.372 4.836 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.768 13.641 6.144 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -6.231 14.602 6.227 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -6.650 14.387 3.899 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -5.012 13.865 3.559 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -5.488 11.799 4.995 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -7.167 12.301 5.028 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -5.713 12.030 2.389 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -6.353 10.609 3.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -7.939 11.521 1.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -8.551 11.640 3.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -7.931 13.017 2.425 1.00 0.00 H new ATOM 1171 N MET A 73 -3.560 17.405 6.842 1.00 0.00 N ATOM 1172 CA MET A 73 -3.267 18.109 8.084 1.00 0.00 C ATOM 1173 C MET A 73 -2.956 19.578 7.817 1.00 0.00 C ATOM 1174 O MET A 73 -2.296 19.912 6.834 1.00 0.00 O ATOM 1175 CB MET A 73 -2.089 17.449 8.804 1.00 0.00 C ATOM 1176 CG MET A 73 -2.402 16.061 9.337 1.00 0.00 C ATOM 1177 SD MET A 73 -1.392 15.620 10.764 1.00 0.00 S ATOM 1178 CE MET A 73 -2.650 15.441 12.027 1.00 0.00 C ATOM 0 H MET A 73 -3.156 17.833 6.009 1.00 0.00 H new ATOM 0 HA MET A 73 -4.150 18.053 8.720 1.00 0.00 H new ATOM 0 HB2 MET A 73 -1.245 17.384 8.117 1.00 0.00 H new ATOM 0 HB3 MET A 73 -1.778 18.085 9.632 1.00 0.00 H new ATOM 0 HG2 MET A 73 -3.455 16.011 9.613 1.00 0.00 H new ATOM 0 HG3 MET A 73 -2.245 15.328 8.545 1.00 0.00 H new ATOM 0 HE1 MET A 73 -2.180 15.168 12.972 1.00 0.00 H new ATOM 0 HE2 MET A 73 -3.183 16.384 12.145 1.00 0.00 H new ATOM 0 HE3 MET A 73 -3.353 14.661 11.733 1.00 0.00 H new ATOM 1188 N GLU A 74 -3.437 20.450 8.697 1.00 0.00 N ATOM 1189 CA GLU A 74 -3.210 21.884 8.553 1.00 0.00 C ATOM 1190 C GLU A 74 -1.934 22.308 9.274 1.00 0.00 C ATOM 1191 O GLU A 74 -1.877 22.315 10.504 1.00 0.00 O ATOM 1192 CB GLU A 74 -4.404 22.668 9.102 1.00 0.00 C ATOM 1193 CG GLU A 74 -4.217 24.176 9.050 1.00 0.00 C ATOM 1194 CD GLU A 74 -5.454 24.932 9.492 1.00 0.00 C ATOM 1195 OE1 GLU A 74 -6.566 24.379 9.363 1.00 0.00 O ATOM 1196 OE2 GLU A 74 -5.310 26.079 9.967 1.00 0.00 O ATOM 0 H GLU A 74 -3.986 20.190 9.516 1.00 0.00 H new ATOM 0 HA GLU A 74 -3.096 22.104 7.491 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -5.295 22.401 8.534 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -4.582 22.368 10.135 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.378 24.456 9.686 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -3.959 24.472 8.033 1.00 0.00 H new ATOM 1203 N ILE A 75 -0.913 22.660 8.500 1.00 0.00 N ATOM 1204 CA ILE A 75 0.361 23.085 9.064 1.00 0.00 C ATOM 1205 C ILE A 75 0.935 24.271 8.295 1.00 0.00 C ATOM 1206 O ILE A 75 1.256 24.159 7.112 1.00 0.00 O ATOM 1207 CB ILE A 75 1.390 21.939 9.060 1.00 0.00 C ATOM 1208 CG1 ILE A 75 0.770 20.666 9.639 1.00 0.00 C ATOM 1209 CG2 ILE A 75 2.630 22.337 9.847 1.00 0.00 C ATOM 1210 CD1 ILE A 75 0.536 20.734 11.132 1.00 0.00 C ATOM 0 H ILE A 75 -0.944 22.659 7.480 1.00 0.00 H new ATOM 0 HA ILE A 75 0.165 23.383 10.094 1.00 0.00 H new ATOM 0 HB ILE A 75 1.686 21.740 8.030 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.179 20.474 9.139 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.423 19.821 9.420 1.00 0.00 H new ATOM 0 HG21 ILE A 75 3.348 21.517 9.835 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.081 23.220 9.394 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.351 22.560 10.877 1.00 0.00 H new ATOM 0 HD11 ILE A 75 0.095 19.798 11.474 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.486 20.895 11.642 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.141 21.558 11.357 1.00 0.00 H new ATOM 1222 N ASP A 76 1.061 25.405 8.975 1.00 0.00 N ATOM 1223 CA ASP A 76 1.599 26.611 8.357 1.00 0.00 C ATOM 1224 C ASP A 76 3.058 26.413 7.957 1.00 0.00 C ATOM 1225 O ASP A 76 3.968 26.691 8.737 1.00 0.00 O ATOM 1226 CB ASP A 76 1.476 27.798 9.313 1.00 0.00 C ATOM 1227 CG ASP A 76 0.039 28.078 9.707 1.00 0.00 C ATOM 1228 OD1 ASP A 76 -0.860 27.852 8.870 1.00 0.00 O ATOM 1229 OD2 ASP A 76 -0.187 28.525 10.851 1.00 0.00 O ATOM 0 H ASP A 76 0.798 25.514 9.954 1.00 0.00 H new ATOM 0 HA ASP A 76 1.019 26.818 7.457 1.00 0.00 H new ATOM 0 HB2 ASP A 76 2.064 27.601 10.210 1.00 0.00 H new ATOM 0 HB3 ASP A 76 1.900 28.685 8.843 1.00 0.00 H new ATOM 1234 N GLU A 77 3.272 25.930 6.737 1.00 0.00 N ATOM 1235 CA GLU A 77 4.620 25.693 6.236 1.00 0.00 C ATOM 1236 C GLU A 77 5.317 27.010 5.904 1.00 0.00 C ATOM 1237 O GLU A 77 4.665 28.014 5.616 1.00 0.00 O ATOM 1238 CB GLU A 77 4.577 24.800 4.994 1.00 0.00 C ATOM 1239 CG GLU A 77 3.727 25.364 3.868 1.00 0.00 C ATOM 1240 CD GLU A 77 4.119 24.814 2.510 1.00 0.00 C ATOM 1241 OE1 GLU A 77 4.015 23.585 2.314 1.00 0.00 O ATOM 1242 OE2 GLU A 77 4.529 25.614 1.643 1.00 0.00 O ATOM 0 H GLU A 77 2.529 25.695 6.078 1.00 0.00 H new ATOM 0 HA GLU A 77 5.187 25.189 7.019 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.593 24.649 4.630 1.00 0.00 H new ATOM 0 HB3 GLU A 77 4.190 23.820 5.274 1.00 0.00 H new ATOM 0 HG2 GLU A 77 2.679 25.135 4.060 1.00 0.00 H new ATOM 0 HG3 GLU A 77 3.820 26.450 3.857 1.00 0.00 H new ATOM 1249 N SER A 78 6.645 26.997 5.948 1.00 0.00 N ATOM 1250 CA SER A 78 7.431 28.191 5.657 1.00 0.00 C ATOM 1251 C SER A 78 7.266 28.607 4.198 1.00 0.00 C ATOM 1252 O SER A 78 7.278 27.770 3.297 1.00 0.00 O ATOM 1253 CB SER A 78 8.909 27.942 5.964 1.00 0.00 C ATOM 1254 OG SER A 78 9.396 26.820 5.248 1.00 0.00 O ATOM 0 H SER A 78 7.200 26.174 6.182 1.00 0.00 H new ATOM 0 HA SER A 78 7.067 28.999 6.291 1.00 0.00 H new ATOM 0 HB2 SER A 78 9.492 28.825 5.703 1.00 0.00 H new ATOM 0 HB3 SER A 78 9.039 27.779 7.034 1.00 0.00 H new ATOM 0 HG SER A 78 10.343 26.683 5.460 1.00 0.00 H new ATOM 1260 N ASN A 79 7.111 29.908 3.975 1.00 0.00 N ATOM 1261 CA ASN A 79 6.943 30.438 2.627 1.00 0.00 C ATOM 1262 C ASN A 79 7.870 29.729 1.644 1.00 0.00 C ATOM 1263 O ASN A 79 8.958 29.286 2.011 1.00 0.00 O ATOM 1264 CB ASN A 79 7.217 31.943 2.609 1.00 0.00 C ATOM 1265 CG ASN A 79 6.428 32.662 1.533 1.00 0.00 C ATOM 1266 OD1 ASN A 79 6.258 32.152 0.426 1.00 0.00 O ATOM 1267 ND2 ASN A 79 5.940 33.855 1.855 1.00 0.00 N ATOM 0 H ASN A 79 7.098 30.615 4.711 1.00 0.00 H new ATOM 0 HA ASN A 79 5.912 30.260 2.320 1.00 0.00 H new ATOM 0 HB2 ASN A 79 6.968 32.366 3.582 1.00 0.00 H new ATOM 0 HB3 ASN A 79 8.282 32.114 2.450 1.00 0.00 H new ATOM 0 HD21 ASN A 79 5.400 34.386 1.172 1.00 0.00 H new ATOM 0 HD22 ASN A 79 6.105 34.240 2.785 1.00 0.00 H new ATOM 1274 N ALA A 80 7.431 29.625 0.394 1.00 0.00 N ATOM 1275 CA ALA A 80 8.223 28.973 -0.642 1.00 0.00 C ATOM 1276 C ALA A 80 7.944 29.583 -2.011 1.00 0.00 C ATOM 1277 O ALA A 80 6.791 29.786 -2.388 1.00 0.00 O ATOM 1278 CB ALA A 80 7.939 27.478 -0.660 1.00 0.00 C ATOM 0 H ALA A 80 6.531 29.984 0.074 1.00 0.00 H new ATOM 0 HA ALA A 80 9.277 29.129 -0.412 1.00 0.00 H new ATOM 0 HB1 ALA A 80 8.537 27.003 -1.438 1.00 0.00 H new ATOM 0 HB2 ALA A 80 8.195 27.047 0.308 1.00 0.00 H new ATOM 0 HB3 ALA A 80 6.881 27.311 -0.863 1.00 0.00 H new ATOM 1284 N GLY A 81 9.009 29.874 -2.752 1.00 0.00 N ATOM 1285 CA GLY A 81 8.857 30.459 -4.071 1.00 0.00 C ATOM 1286 C GLY A 81 9.659 29.724 -5.127 1.00 0.00 C ATOM 1287 O GLY A 81 10.877 29.879 -5.212 1.00 0.00 O ATOM 0 H GLY A 81 9.974 29.715 -2.462 1.00 0.00 H new ATOM 0 HA2 GLY A 81 7.803 30.452 -4.349 1.00 0.00 H new ATOM 0 HA3 GLY A 81 9.172 31.502 -4.041 1.00 0.00 H new ATOM 1291 N SER A 82 8.974 28.920 -5.934 1.00 0.00 N ATOM 1292 CA SER A 82 9.630 28.153 -6.987 1.00 0.00 C ATOM 1293 C SER A 82 10.990 27.643 -6.519 1.00 0.00 C ATOM 1294 O SER A 82 11.970 27.685 -7.263 1.00 0.00 O ATOM 1295 CB SER A 82 9.799 29.011 -8.242 1.00 0.00 C ATOM 1296 OG SER A 82 10.534 30.190 -7.960 1.00 0.00 O ATOM 0 H SER A 82 7.965 28.783 -5.879 1.00 0.00 H new ATOM 0 HA SER A 82 9.001 27.295 -7.224 1.00 0.00 H new ATOM 0 HB2 SER A 82 10.311 28.436 -9.013 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.819 29.276 -8.640 1.00 0.00 H new ATOM 0 HG SER A 82 10.629 30.720 -8.779 1.00 0.00 H new ATOM 1302 N SER A 83 11.040 27.161 -5.281 1.00 0.00 N ATOM 1303 CA SER A 83 12.280 26.645 -4.712 1.00 0.00 C ATOM 1304 C SER A 83 12.444 25.161 -5.022 1.00 0.00 C ATOM 1305 O SER A 83 11.840 24.309 -4.370 1.00 0.00 O ATOM 1306 CB SER A 83 12.301 26.867 -3.198 1.00 0.00 C ATOM 1307 OG SER A 83 13.535 26.452 -2.639 1.00 0.00 O ATOM 0 H SER A 83 10.237 27.117 -4.653 1.00 0.00 H new ATOM 0 HA SER A 83 13.111 27.186 -5.164 1.00 0.00 H new ATOM 0 HB2 SER A 83 12.136 27.922 -2.980 1.00 0.00 H new ATOM 0 HB3 SER A 83 11.484 26.314 -2.735 1.00 0.00 H new ATOM 0 HG SER A 83 13.524 26.606 -1.671 1.00 0.00 H new ATOM 1313 N SER A 84 13.265 24.859 -6.022 1.00 0.00 N ATOM 1314 CA SER A 84 13.507 23.478 -6.423 1.00 0.00 C ATOM 1315 C SER A 84 13.816 22.606 -5.209 1.00 0.00 C ATOM 1316 O SER A 84 14.214 23.105 -4.157 1.00 0.00 O ATOM 1317 CB SER A 84 14.664 23.409 -7.421 1.00 0.00 C ATOM 1318 OG SER A 84 14.913 22.073 -7.822 1.00 0.00 O ATOM 0 H SER A 84 13.774 25.552 -6.570 1.00 0.00 H new ATOM 0 HA SER A 84 12.602 23.101 -6.900 1.00 0.00 H new ATOM 0 HB2 SER A 84 14.431 24.017 -8.295 1.00 0.00 H new ATOM 0 HB3 SER A 84 15.563 23.830 -6.970 1.00 0.00 H new ATOM 0 HG SER A 84 15.656 22.056 -8.461 1.00 0.00 H new ATOM 1324 N GLY A 85 13.628 21.299 -5.364 1.00 0.00 N ATOM 1325 CA GLY A 85 13.890 20.378 -4.274 1.00 0.00 C ATOM 1326 C GLY A 85 14.550 19.097 -4.743 1.00 0.00 C ATOM 1327 O GLY A 85 14.305 18.616 -5.850 1.00 0.00 O ATOM 0 H GLY A 85 13.299 20.862 -6.225 1.00 0.00 H new ATOM 0 HA2 GLY A 85 14.530 20.864 -3.538 1.00 0.00 H new ATOM 0 HA3 GLY A 85 12.953 20.138 -3.772 1.00 0.00 H new ATOM 1331 N PRO A 86 15.412 18.523 -3.890 1.00 0.00 N ATOM 1332 CA PRO A 86 16.128 17.283 -4.202 1.00 0.00 C ATOM 1333 C PRO A 86 15.203 16.072 -4.236 1.00 0.00 C ATOM 1334 O PRO A 86 14.459 15.820 -3.288 1.00 0.00 O ATOM 1335 CB PRO A 86 17.134 17.156 -3.056 1.00 0.00 C ATOM 1336 CG PRO A 86 16.520 17.910 -1.927 1.00 0.00 C ATOM 1337 CD PRO A 86 15.752 19.041 -2.554 1.00 0.00 C ATOM 0 HA PRO A 86 16.588 17.316 -5.189 1.00 0.00 H new ATOM 0 HB2 PRO A 86 17.301 16.112 -2.790 1.00 0.00 H new ATOM 0 HB3 PRO A 86 18.102 17.574 -3.331 1.00 0.00 H new ATOM 0 HG2 PRO A 86 15.861 17.268 -1.342 1.00 0.00 H new ATOM 0 HG3 PRO A 86 17.285 18.287 -1.248 1.00 0.00 H new ATOM 0 HD2 PRO A 86 14.859 19.288 -1.979 1.00 0.00 H new ATOM 0 HD3 PRO A 86 16.352 19.949 -2.616 1.00 0.00 H new ATOM 1345 N SER A 87 15.254 15.324 -5.334 1.00 0.00 N ATOM 1346 CA SER A 87 14.417 14.140 -5.492 1.00 0.00 C ATOM 1347 C SER A 87 15.174 13.032 -6.218 1.00 0.00 C ATOM 1348 O SER A 87 15.748 13.254 -7.284 1.00 0.00 O ATOM 1349 CB SER A 87 13.142 14.490 -6.260 1.00 0.00 C ATOM 1350 OG SER A 87 12.073 13.635 -5.892 1.00 0.00 O ATOM 0 H SER A 87 15.866 15.517 -6.127 1.00 0.00 H new ATOM 0 HA SER A 87 14.147 13.781 -4.499 1.00 0.00 H new ATOM 0 HB2 SER A 87 12.868 15.526 -6.062 1.00 0.00 H new ATOM 0 HB3 SER A 87 13.325 14.408 -7.331 1.00 0.00 H new ATOM 0 HG SER A 87 11.269 13.881 -6.396 1.00 0.00 H new ATOM 1356 N SER A 88 15.172 11.839 -5.631 1.00 0.00 N ATOM 1357 CA SER A 88 15.861 10.697 -6.219 1.00 0.00 C ATOM 1358 C SER A 88 15.255 10.333 -7.571 1.00 0.00 C ATOM 1359 O SER A 88 14.122 10.704 -7.876 1.00 0.00 O ATOM 1360 CB SER A 88 15.795 9.494 -5.277 1.00 0.00 C ATOM 1361 OG SER A 88 16.809 9.562 -4.290 1.00 0.00 O ATOM 0 H SER A 88 14.701 11.639 -4.749 1.00 0.00 H new ATOM 0 HA SER A 88 16.904 10.973 -6.371 1.00 0.00 H new ATOM 0 HB2 SER A 88 14.817 9.458 -4.796 1.00 0.00 H new ATOM 0 HB3 SER A 88 15.903 8.573 -5.850 1.00 0.00 H new ATOM 0 HG SER A 88 16.744 8.782 -3.700 1.00 0.00 H new ATOM 1367 N GLY A 89 16.019 9.604 -8.379 1.00 0.00 N ATOM 1368 CA GLY A 89 15.541 9.202 -9.689 1.00 0.00 C ATOM 1369 C GLY A 89 16.243 7.962 -10.206 1.00 0.00 C ATOM 1370 O GLY A 89 15.600 7.040 -10.708 1.00 0.00 O ATOM 0 H GLY A 89 16.960 9.285 -8.150 1.00 0.00 H new ATOM 0 HA2 GLY A 89 14.468 9.015 -9.639 1.00 0.00 H new ATOM 0 HA3 GLY A 89 15.689 10.020 -10.394 1.00 0.00 H new TER 1374 GLY A 89