USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 991 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 13 HIS :FLIP no HE2:sc= -1.56 F(o=-7.4,f=-6.7) USER MOD Set 1.2: A 86 ASN : amide:sc= -5.15! C(o=-6.7!,f=-9.5!) USER MOD Set 2.1: A 21 THR OG1 : rot -33:sc= 1.24 USER MOD Set 2.2: A 22 ASN :FLIP amide:sc= 0.43 F(o=2.6,f=3.3) USER MOD Set 2.3: A 117 THR OG1 : rot 42:sc= 1.63 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 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 22:sc= 0.14 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 51:sc= 1.27 USER MOD Single : A 10 SER OG : rot 180:sc= -0.192 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -5.49! C(o=-5.5!,f=-11!) USER MOD Single : A 15 ASN : amide:sc= -0.263 K(o=-0.26,f=-2.3!) USER MOD Single : A 17 ASN : amide:sc= -1.93 K(o=-1.9,f=-4.9!) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.116 K(o=-0.12,f=-0.83) USER MOD Single : A 31 GLN : amide:sc= -0.231 K(o=-0.23,f=-2.1!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -104:sc= 1.84 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 39 GLN : amide:sc= -0.273 K(o=-0.27,f=-1.6!) USER MOD Single : A 40 THR OG1 : rot 140:sc= -0.749 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -124:sc= 0.113 USER MOD Single : A 46 ASN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 49 ASN : amide:sc= -0.514 X(o=-0.51,f=-0.88) USER MOD Single : A 50 GLN :FLIP amide:sc= -0.695! F(o=-1.4,f=-0.7!) USER MOD Single : A 54 ASN : amide:sc= -0.214 X(o=-0.21,f=-0.39) USER MOD Single : A 55 SER OG : rot -74:sc= 0.291 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 180:sc= -0.0648 USER MOD Single : A 64 CYS SG : rot 100:sc= -1.13 USER MOD Single : A 65 GLN : amide:sc= -0.115 X(o=-0.11,f=0) USER MOD Single : A 71 SER OG : rot 114:sc= 0.0725 USER MOD Single : A 73 SER OG : rot 50:sc= 1.15 USER MOD Single : A 74 ASN : amide:sc= -0.144 K(o=-0.14,f=-2.2!) USER MOD Single : A 75 ASN : amide:sc= -0.151 K(o=-0.15,f=-1) USER MOD Single : A 76 ASN : amide:sc= -0.0892 X(o=-0.089,f=0) USER MOD Single : A 77 ASN : amide:sc= -0.207 X(o=-0.21,f=-0.039) USER MOD Single : A 78 HIS :FLIP no HD1:sc= -0.849 F(o=-2.9,f=-0.85) USER MOD Single : A 79 THR OG1 : rot 130:sc= -0.112 USER MOD Single : A 83 SER OG : rot -148:sc= -1.37 USER MOD Single : A 85 CYS SG : rot -85:sc= -11.5! USER MOD Single : A 88 SER OG : rot 180:sc= -0.0102 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl -110:sc= -4.47! (180deg=-10!) USER MOD Single : A 107 THR OG1 : rot -75:sc= -1.07 USER MOD Single : A 108 HIS : no HD1:sc= 0 X(o=0,f=-0.035) USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 THR OG1 : rot -84:sc= 1.24 USER MOD Single : A 112 GLN : amide:sc= -0.0534 K(o=-0.053,f=-1.4) USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0.024) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot -150:sc= 0.151 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot -60:sc= 0 USER MOD Single : A 131 SER OG : rot 53:sc= 1.14 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -11.854 27.716 10.008 1.00 0.00 N ATOM 2 CA GLY A 1 -10.834 26.687 9.663 1.00 0.00 C ATOM 3 C GLY A 1 -11.369 25.638 8.705 1.00 0.00 C ATOM 4 O GLY A 1 -11.344 24.445 9.004 1.00 0.00 O ATOM 0 H1 GLY A 1 -11.440 28.409 10.664 1.00 0.00 H new ATOM 0 H2 GLY A 1 -12.164 28.201 9.142 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.671 27.257 10.459 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -9.967 27.174 9.216 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -10.491 26.200 10.576 1.00 0.00 H new ATOM 10 N SER A 2 -11.853 26.087 7.552 1.00 0.00 N ATOM 11 CA SER A 2 -12.397 25.180 6.548 1.00 0.00 C ATOM 12 C SER A 2 -11.966 25.600 5.146 1.00 0.00 C ATOM 13 O SER A 2 -11.515 24.775 4.351 1.00 0.00 O ATOM 14 CB SER A 2 -13.923 25.144 6.635 1.00 0.00 C ATOM 15 OG SER A 2 -14.463 26.453 6.686 1.00 0.00 O ATOM 0 H SER A 2 -11.880 27.072 7.290 1.00 0.00 H new ATOM 0 HA SER A 2 -12.006 24.182 6.746 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.327 24.614 5.772 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.227 24.587 7.522 1.00 0.00 H new ATOM 0 HG SER A 2 -15.440 26.402 6.740 1.00 0.00 H new ATOM 21 N SER A 3 -12.108 26.887 4.850 1.00 0.00 N ATOM 22 CA SER A 3 -11.734 27.418 3.545 1.00 0.00 C ATOM 23 C SER A 3 -10.248 27.203 3.275 1.00 0.00 C ATOM 24 O SER A 3 -9.400 27.908 3.821 1.00 0.00 O ATOM 25 CB SER A 3 -12.068 28.909 3.461 1.00 0.00 C ATOM 26 OG SER A 3 -13.365 29.111 2.926 1.00 0.00 O ATOM 0 H SER A 3 -12.480 27.582 5.497 1.00 0.00 H new ATOM 0 HA SER A 3 -12.305 26.882 2.787 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.007 29.355 4.454 1.00 0.00 H new ATOM 0 HB3 SER A 3 -11.331 29.416 2.838 1.00 0.00 H new ATOM 0 HG SER A 3 -13.556 30.071 2.884 1.00 0.00 H new ATOM 32 N GLY A 4 -9.940 26.224 2.429 1.00 0.00 N ATOM 33 CA GLY A 4 -8.557 25.934 2.104 1.00 0.00 C ATOM 34 C GLY A 4 -8.424 24.998 0.918 1.00 0.00 C ATOM 35 O GLY A 4 -8.140 23.812 1.084 1.00 0.00 O ATOM 0 H GLY A 4 -10.624 25.627 1.964 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.035 26.866 1.888 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.069 25.489 2.971 1.00 0.00 H new ATOM 39 N SER A 5 -8.630 25.532 -0.281 1.00 0.00 N ATOM 40 CA SER A 5 -8.531 24.738 -1.500 1.00 0.00 C ATOM 41 C SER A 5 -7.692 25.456 -2.551 1.00 0.00 C ATOM 42 O SER A 5 -6.644 24.961 -2.967 1.00 0.00 O ATOM 43 CB SER A 5 -9.926 24.445 -2.057 1.00 0.00 C ATOM 44 OG SER A 5 -10.434 23.224 -1.546 1.00 0.00 O ATOM 0 H SER A 5 -8.867 26.512 -0.435 1.00 0.00 H new ATOM 0 HA SER A 5 -8.041 23.797 -1.252 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.602 25.260 -1.799 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.884 24.398 -3.145 1.00 0.00 H new ATOM 0 HG SER A 5 -11.327 23.061 -1.916 1.00 0.00 H new ATOM 50 N SER A 6 -8.158 26.626 -2.976 1.00 0.00 N ATOM 51 CA SER A 6 -7.449 27.413 -3.978 1.00 0.00 C ATOM 52 C SER A 6 -6.094 27.871 -3.450 1.00 0.00 C ATOM 53 O SER A 6 -5.996 28.418 -2.352 1.00 0.00 O ATOM 54 CB SER A 6 -8.286 28.626 -4.389 1.00 0.00 C ATOM 55 OG SER A 6 -8.466 29.514 -3.300 1.00 0.00 O ATOM 0 H SER A 6 -9.024 27.050 -2.642 1.00 0.00 H new ATOM 0 HA SER A 6 -7.284 26.781 -4.851 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.796 29.148 -5.211 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.257 28.294 -4.756 1.00 0.00 H new ATOM 0 HG SER A 6 -7.763 29.362 -2.634 1.00 0.00 H new ATOM 61 N GLY A 7 -5.049 27.643 -4.240 1.00 0.00 N ATOM 62 CA GLY A 7 -3.713 28.039 -3.836 1.00 0.00 C ATOM 63 C GLY A 7 -2.837 26.851 -3.486 1.00 0.00 C ATOM 64 O GLY A 7 -2.190 26.835 -2.440 1.00 0.00 O ATOM 0 H GLY A 7 -5.104 27.191 -5.153 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -3.246 28.606 -4.641 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.779 28.704 -2.975 1.00 0.00 H new ATOM 68 N SER A 8 -2.819 25.854 -4.365 1.00 0.00 N ATOM 69 CA SER A 8 -2.018 24.655 -4.145 1.00 0.00 C ATOM 70 C SER A 8 -1.420 24.151 -5.454 1.00 0.00 C ATOM 71 O SER A 8 -1.979 24.373 -6.529 1.00 0.00 O ATOM 72 CB SER A 8 -2.868 23.559 -3.503 1.00 0.00 C ATOM 73 OG SER A 8 -2.080 22.430 -3.171 1.00 0.00 O ATOM 0 H SER A 8 -3.350 25.853 -5.236 1.00 0.00 H new ATOM 0 HA SER A 8 -1.202 24.913 -3.470 1.00 0.00 H new ATOM 0 HB2 SER A 8 -3.349 23.947 -2.605 1.00 0.00 H new ATOM 0 HB3 SER A 8 -3.663 23.263 -4.188 1.00 0.00 H new ATOM 0 HG SER A 8 -2.647 21.744 -2.760 1.00 0.00 H new ATOM 79 N SER A 9 -0.282 23.472 -5.358 1.00 0.00 N ATOM 80 CA SER A 9 0.390 22.936 -6.535 1.00 0.00 C ATOM 81 C SER A 9 1.626 22.133 -6.138 1.00 0.00 C ATOM 82 O SER A 9 1.937 21.999 -4.955 1.00 0.00 O ATOM 83 CB SER A 9 0.789 24.070 -7.482 1.00 0.00 C ATOM 84 OG SER A 9 -0.211 24.291 -8.461 1.00 0.00 O ATOM 0 H SER A 9 0.194 23.280 -4.477 1.00 0.00 H new ATOM 0 HA SER A 9 -0.305 22.271 -7.047 1.00 0.00 H new ATOM 0 HB2 SER A 9 0.952 24.984 -6.911 1.00 0.00 H new ATOM 0 HB3 SER A 9 1.733 23.826 -7.970 1.00 0.00 H new ATOM 0 HG SER A 9 -1.082 24.389 -8.023 1.00 0.00 H new ATOM 90 N SER A 10 2.326 21.603 -7.135 1.00 0.00 N ATOM 91 CA SER A 10 3.530 20.813 -6.892 1.00 0.00 C ATOM 92 C SER A 10 3.193 19.517 -6.161 1.00 0.00 C ATOM 93 O SER A 10 3.892 19.118 -5.229 1.00 0.00 O ATOM 94 CB SER A 10 4.545 21.623 -6.082 1.00 0.00 C ATOM 95 OG SER A 10 4.371 23.014 -6.290 1.00 0.00 O ATOM 0 H SER A 10 2.081 21.706 -8.120 1.00 0.00 H new ATOM 0 HA SER A 10 3.968 20.560 -7.857 1.00 0.00 H new ATOM 0 HB2 SER A 10 4.435 21.394 -5.022 1.00 0.00 H new ATOM 0 HB3 SER A 10 5.556 21.333 -6.367 1.00 0.00 H new ATOM 0 HG SER A 10 5.030 23.509 -5.760 1.00 0.00 H new ATOM 101 N SER A 11 2.120 18.861 -6.593 1.00 0.00 N ATOM 102 CA SER A 11 1.693 17.608 -5.981 1.00 0.00 C ATOM 103 C SER A 11 2.239 16.413 -6.755 1.00 0.00 C ATOM 104 O SER A 11 2.956 16.577 -7.742 1.00 0.00 O ATOM 105 CB SER A 11 0.166 17.539 -5.924 1.00 0.00 C ATOM 106 OG SER A 11 -0.406 17.810 -7.192 1.00 0.00 O ATOM 0 H SER A 11 1.531 19.176 -7.364 1.00 0.00 H new ATOM 0 HA SER A 11 2.089 17.573 -4.966 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.144 16.550 -5.586 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.206 18.257 -5.193 1.00 0.00 H new ATOM 0 HG SER A 11 -1.383 17.758 -7.128 1.00 0.00 H new ATOM 111 N GLN A 12 1.897 15.211 -6.302 1.00 0.00 N ATOM 112 CA GLN A 12 2.357 13.991 -6.955 1.00 0.00 C ATOM 113 C GLN A 12 1.465 12.807 -6.595 1.00 0.00 C ATOM 114 O GLN A 12 1.156 12.579 -5.424 1.00 0.00 O ATOM 115 CB GLN A 12 3.805 13.692 -6.562 1.00 0.00 C ATOM 116 CG GLN A 12 4.061 13.787 -5.068 1.00 0.00 C ATOM 117 CD GLN A 12 5.252 14.666 -4.733 1.00 0.00 C ATOM 118 OE1 GLN A 12 5.130 15.638 -3.989 1.00 0.00 O ATOM 119 NE2 GLN A 12 6.411 14.327 -5.286 1.00 0.00 N ATOM 0 H GLN A 12 1.304 15.056 -5.487 1.00 0.00 H new ATOM 0 HA GLN A 12 2.304 14.146 -8.033 1.00 0.00 H new ATOM 0 HB2 GLN A 12 4.066 12.691 -6.904 1.00 0.00 H new ATOM 0 HB3 GLN A 12 4.465 14.388 -7.080 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.173 14.183 -4.576 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.229 12.787 -4.668 1.00 0.00 H new ATOM 0 HE21 GLN A 12 6.466 13.512 -5.897 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.247 14.881 -5.100 1.00 0.00 H new ATOM 128 N HIS A 13 1.055 12.055 -7.612 1.00 0.00 N ATOM 129 CA HIS A 13 0.202 10.890 -7.412 1.00 0.00 C ATOM 130 C HIS A 13 0.769 9.673 -8.136 1.00 0.00 C ATOM 131 O HIS A 13 0.884 9.667 -9.361 1.00 0.00 O ATOM 132 CB HIS A 13 -1.217 11.178 -7.909 1.00 0.00 C ATOM 133 CG HIS A 13 -1.933 12.220 -7.107 1.00 0.00 C ATOM 134 ND1 HIS A 13 -1.761 12.626 -5.826 1.00 0.00 N flip ATOM 135 CD2 HIS A 13 -2.966 12.981 -7.612 1.00 0.00 C flip ATOM 136 CE1 HIS A 13 -2.683 13.614 -5.586 1.00 0.00 C flip ATOM 137 NE2 HIS A 13 -3.397 13.810 -6.678 1.00 0.00 N flip ATOM 0 H HIS A 13 1.301 12.233 -8.586 1.00 0.00 H new ATOM 0 HA HIS A 13 0.168 10.674 -6.344 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -1.170 11.501 -8.949 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -1.795 10.254 -7.888 1.00 0.00 H new ATOM 0 HD1 HIS A 13 -1.075 12.265 -5.164 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -3.361 12.910 -8.615 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -2.804 14.145 -4.654 1.00 0.00 H new ATOM 146 N PHE A 14 1.125 8.647 -7.371 1.00 0.00 N ATOM 147 CA PHE A 14 1.684 7.427 -7.942 1.00 0.00 C ATOM 148 C PHE A 14 0.668 6.288 -7.903 1.00 0.00 C ATOM 149 O PHE A 14 0.329 5.783 -6.833 1.00 0.00 O ATOM 150 CB PHE A 14 2.951 7.021 -7.186 1.00 0.00 C ATOM 151 CG PHE A 14 4.188 7.731 -7.658 1.00 0.00 C ATOM 152 CD1 PHE A 14 4.832 7.330 -8.817 1.00 0.00 C ATOM 153 CD2 PHE A 14 4.706 8.798 -6.942 1.00 0.00 C ATOM 154 CE1 PHE A 14 5.971 7.981 -9.253 1.00 0.00 C ATOM 155 CE2 PHE A 14 5.844 9.453 -7.373 1.00 0.00 C ATOM 156 CZ PHE A 14 6.477 9.043 -8.531 1.00 0.00 C ATOM 0 H PHE A 14 1.037 8.636 -6.355 1.00 0.00 H new ATOM 0 HA PHE A 14 1.936 7.627 -8.983 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.810 7.222 -6.124 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.097 5.946 -7.290 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.440 6.500 -9.386 1.00 0.00 H new ATOM 0 HD2 PHE A 14 4.215 9.122 -6.036 1.00 0.00 H new ATOM 0 HE1 PHE A 14 6.465 7.659 -10.158 1.00 0.00 H new ATOM 0 HE2 PHE A 14 6.238 10.284 -6.806 1.00 0.00 H new ATOM 0 HZ PHE A 14 7.366 9.553 -8.871 1.00 0.00 H new ATOM 166 N ASN A 15 0.186 5.890 -9.078 1.00 0.00 N ATOM 167 CA ASN A 15 -0.790 4.809 -9.180 1.00 0.00 C ATOM 168 C ASN A 15 -0.268 3.541 -8.514 1.00 0.00 C ATOM 169 O ASN A 15 0.653 2.898 -9.018 1.00 0.00 O ATOM 170 CB ASN A 15 -1.120 4.531 -10.649 1.00 0.00 C ATOM 171 CG ASN A 15 -2.608 4.344 -10.881 1.00 0.00 C ATOM 172 OD1 ASN A 15 -3.396 4.308 -9.937 1.00 0.00 O ATOM 173 ND2 ASN A 15 -2.998 4.223 -12.145 1.00 0.00 N ATOM 0 H ASN A 15 0.456 6.300 -9.972 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.698 5.121 -8.663 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -0.760 5.357 -11.262 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -0.589 3.637 -10.975 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.986 4.094 -12.364 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -2.310 4.259 -12.897 1.00 0.00 H new ATOM 180 N LEU A 16 -0.861 3.189 -7.378 1.00 0.00 N ATOM 181 CA LEU A 16 -0.455 2.001 -6.639 1.00 0.00 C ATOM 182 C LEU A 16 -1.330 0.806 -7.003 1.00 0.00 C ATOM 183 O LEU A 16 -2.557 0.883 -6.948 1.00 0.00 O ATOM 184 CB LEU A 16 -0.530 2.265 -5.134 1.00 0.00 C ATOM 185 CG LEU A 16 0.095 1.183 -4.253 1.00 0.00 C ATOM 186 CD1 LEU A 16 1.613 1.296 -4.261 1.00 0.00 C ATOM 187 CD2 LEU A 16 -0.440 1.281 -2.831 1.00 0.00 C ATOM 0 H LEU A 16 -1.625 3.711 -6.949 1.00 0.00 H new ATOM 0 HA LEU A 16 0.574 1.767 -6.911 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.037 3.214 -4.922 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.577 2.381 -4.853 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.178 0.209 -4.659 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.039 0.517 -3.628 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.981 1.177 -5.280 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.907 2.274 -3.880 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.015 0.504 -2.217 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.196 2.260 -2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.522 1.150 -2.840 1.00 0.00 H new ATOM 199 N ASN A 17 -0.690 -0.298 -7.376 1.00 0.00 N ATOM 200 CA ASN A 17 -1.412 -1.508 -7.750 1.00 0.00 C ATOM 201 C ASN A 17 -0.623 -2.757 -7.370 1.00 0.00 C ATOM 202 O ASN A 17 0.601 -2.790 -7.488 1.00 0.00 O ATOM 203 CB ASN A 17 -1.698 -1.512 -9.254 1.00 0.00 C ATOM 204 CG ASN A 17 -2.898 -0.658 -9.616 1.00 0.00 C ATOM 205 OD1 ASN A 17 -2.906 0.551 -9.389 1.00 0.00 O ATOM 206 ND2 ASN A 17 -3.920 -1.288 -10.184 1.00 0.00 N ATOM 0 H ASN A 17 0.325 -0.379 -7.427 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.356 -1.518 -7.205 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.821 -1.147 -9.789 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.871 -2.536 -9.586 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -4.755 -0.767 -10.451 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -3.869 -2.293 -10.353 1.00 0.00 H new ATOM 213 N PHE A 18 -1.336 -3.782 -6.916 1.00 0.00 N ATOM 214 CA PHE A 18 -0.710 -5.038 -6.521 1.00 0.00 C ATOM 215 C PHE A 18 -1.765 -6.069 -6.131 1.00 0.00 C ATOM 216 O PHE A 18 -2.497 -5.886 -5.158 1.00 0.00 O ATOM 217 CB PHE A 18 0.257 -4.811 -5.358 1.00 0.00 C ATOM 218 CG PHE A 18 -0.404 -4.293 -4.113 1.00 0.00 C ATOM 219 CD1 PHE A 18 -0.830 -2.976 -4.036 1.00 0.00 C ATOM 220 CD2 PHE A 18 -0.598 -5.121 -3.020 1.00 0.00 C ATOM 221 CE1 PHE A 18 -1.437 -2.495 -2.892 1.00 0.00 C ATOM 222 CE2 PHE A 18 -1.205 -4.646 -1.873 1.00 0.00 C ATOM 223 CZ PHE A 18 -1.625 -3.332 -1.809 1.00 0.00 C ATOM 0 H PHE A 18 -2.351 -3.767 -6.812 1.00 0.00 H new ATOM 0 HA PHE A 18 -0.150 -5.421 -7.374 1.00 0.00 H new ATOM 0 HB2 PHE A 18 0.760 -5.750 -5.127 1.00 0.00 H new ATOM 0 HB3 PHE A 18 1.027 -4.105 -5.670 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -0.686 -2.318 -4.880 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.271 -6.149 -3.065 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -1.764 -1.467 -2.844 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.351 -5.302 -1.027 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.100 -2.959 -0.913 1.00 0.00 H new ATOM 233 N THR A 19 -1.841 -7.149 -6.901 1.00 0.00 N ATOM 234 CA THR A 19 -2.809 -8.207 -6.642 1.00 0.00 C ATOM 235 C THR A 19 -2.519 -8.907 -5.319 1.00 0.00 C ATOM 236 O THR A 19 -1.387 -9.308 -5.051 1.00 0.00 O ATOM 237 CB THR A 19 -2.799 -9.225 -7.784 1.00 0.00 C ATOM 238 OG1 THR A 19 -3.043 -8.590 -9.026 1.00 0.00 O ATOM 239 CG2 THR A 19 -3.829 -10.321 -7.618 1.00 0.00 C ATOM 0 H THR A 19 -1.243 -7.314 -7.710 1.00 0.00 H new ATOM 0 HA THR A 19 -3.796 -7.750 -6.577 1.00 0.00 H new ATOM 0 HB THR A 19 -1.806 -9.675 -7.760 1.00 0.00 H new ATOM 0 HG1 THR A 19 -3.031 -9.258 -9.743 1.00 0.00 H new ATOM 0 HG21 THR A 19 -3.768 -11.008 -8.462 1.00 0.00 H new ATOM 0 HG22 THR A 19 -3.636 -10.864 -6.693 1.00 0.00 H new ATOM 0 HG23 THR A 19 -4.826 -9.881 -7.580 1.00 0.00 H new ATOM 247 N ILE A 20 -3.554 -9.054 -4.497 1.00 0.00 N ATOM 248 CA ILE A 20 -3.415 -9.710 -3.202 1.00 0.00 C ATOM 249 C ILE A 20 -4.020 -11.110 -3.235 1.00 0.00 C ATOM 250 O ILE A 20 -5.226 -11.280 -3.057 1.00 0.00 O ATOM 251 CB ILE A 20 -4.092 -8.896 -2.082 1.00 0.00 C ATOM 252 CG1 ILE A 20 -3.635 -7.437 -2.132 1.00 0.00 C ATOM 253 CG2 ILE A 20 -3.786 -9.506 -0.723 1.00 0.00 C ATOM 254 CD1 ILE A 20 -4.460 -6.516 -1.260 1.00 0.00 C ATOM 0 H ILE A 20 -4.498 -8.728 -4.705 1.00 0.00 H new ATOM 0 HA ILE A 20 -2.348 -9.779 -2.992 1.00 0.00 H new ATOM 0 HB ILE A 20 -5.171 -8.924 -2.236 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -2.592 -7.380 -1.821 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -3.680 -7.085 -3.163 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -4.271 -8.919 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -4.158 -10.530 -0.692 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.708 -9.507 -0.559 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.080 -5.498 -1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.500 -6.543 -1.584 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.395 -6.843 -0.222 1.00 0.00 H new ATOM 266 N THR A 21 -3.175 -12.110 -3.466 1.00 0.00 N ATOM 267 CA THR A 21 -3.625 -13.496 -3.525 1.00 0.00 C ATOM 268 C THR A 21 -4.349 -13.896 -2.242 1.00 0.00 C ATOM 269 O THR A 21 -5.207 -14.778 -2.252 1.00 0.00 O ATOM 270 CB THR A 21 -2.436 -14.428 -3.764 1.00 0.00 C ATOM 271 OG1 THR A 21 -1.580 -14.449 -2.635 1.00 0.00 O ATOM 272 CG2 THR A 21 -1.602 -14.040 -4.966 1.00 0.00 C ATOM 0 H THR A 21 -2.174 -11.986 -3.616 1.00 0.00 H new ATOM 0 HA THR A 21 -4.326 -13.586 -4.355 1.00 0.00 H new ATOM 0 HB THR A 21 -2.872 -15.410 -3.947 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.584 -13.568 -2.205 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.776 -14.742 -5.078 1.00 0.00 H new ATOM 0 HG22 THR A 21 -2.222 -14.064 -5.862 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.207 -13.034 -4.825 1.00 0.00 H new ATOM 280 N ASN A 22 -3.999 -13.240 -1.140 1.00 0.00 N ATOM 281 CA ASN A 22 -4.617 -13.529 0.149 1.00 0.00 C ATOM 282 C ASN A 22 -6.061 -13.030 0.197 1.00 0.00 C ATOM 283 O ASN A 22 -6.832 -13.426 1.073 1.00 0.00 O ATOM 284 CB ASN A 22 -3.810 -12.888 1.279 1.00 0.00 C ATOM 285 CG ASN A 22 -3.839 -13.712 2.551 1.00 0.00 C ATOM 286 OD1 ASN A 22 -4.754 -13.376 3.453 1.00 0.00 O flip ATOM 287 ND2 ASN A 22 -3.050 -14.642 2.720 1.00 0.00 N flip ATOM 0 H ASN A 22 -3.292 -12.506 -1.114 1.00 0.00 H new ATOM 0 HA ASN A 22 -4.625 -14.611 0.279 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -2.777 -12.760 0.956 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -4.205 -11.893 1.485 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -2.363 -14.865 2.000 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -3.083 -15.189 3.580 1.00 0.00 H new ATOM 294 N LEU A 23 -6.423 -12.161 -0.742 1.00 0.00 N ATOM 295 CA LEU A 23 -7.774 -11.614 -0.796 1.00 0.00 C ATOM 296 C LEU A 23 -8.504 -12.077 -2.054 1.00 0.00 C ATOM 297 O LEU A 23 -8.416 -11.438 -3.102 1.00 0.00 O ATOM 298 CB LEU A 23 -7.728 -10.085 -0.757 1.00 0.00 C ATOM 299 CG LEU A 23 -9.025 -9.409 -0.308 1.00 0.00 C ATOM 300 CD1 LEU A 23 -10.102 -9.562 -1.370 1.00 0.00 C ATOM 301 CD2 LEU A 23 -9.497 -9.988 1.018 1.00 0.00 C ATOM 0 H LEU A 23 -5.800 -11.821 -1.475 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.320 -11.980 0.074 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.925 -9.778 -0.087 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.471 -9.719 -1.751 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.828 -8.346 -0.169 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.017 -9.075 -1.033 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.766 -9.100 -2.298 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.296 -10.621 -1.541 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.421 -9.495 1.322 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.676 -11.057 0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.733 -9.827 1.778 1.00 0.00 H new ATOM 313 N PRO A 24 -9.241 -13.200 -1.969 1.00 0.00 N ATOM 314 CA PRO A 24 -9.988 -13.741 -3.109 1.00 0.00 C ATOM 315 C PRO A 24 -11.020 -12.751 -3.640 1.00 0.00 C ATOM 316 O PRO A 24 -11.391 -11.799 -2.954 1.00 0.00 O ATOM 317 CB PRO A 24 -10.685 -14.981 -2.535 1.00 0.00 C ATOM 318 CG PRO A 24 -9.913 -15.328 -1.309 1.00 0.00 C ATOM 319 CD PRO A 24 -9.402 -14.027 -0.761 1.00 0.00 C ATOM 0 HA PRO A 24 -9.335 -13.961 -3.953 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -11.728 -14.772 -2.298 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -10.679 -15.803 -3.251 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.545 -15.837 -0.581 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -9.090 -16.003 -1.544 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -10.105 -13.581 -0.057 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -8.458 -14.155 -0.231 1.00 0.00 H new ATOM 327 N TYR A 25 -11.480 -12.981 -4.866 1.00 0.00 N ATOM 328 CA TYR A 25 -12.470 -12.107 -5.486 1.00 0.00 C ATOM 329 C TYR A 25 -13.773 -12.856 -5.745 1.00 0.00 C ATOM 330 O TYR A 25 -13.906 -13.563 -6.744 1.00 0.00 O ATOM 331 CB TYR A 25 -11.928 -11.536 -6.798 1.00 0.00 C ATOM 332 CG TYR A 25 -12.758 -10.402 -7.355 1.00 0.00 C ATOM 333 CD1 TYR A 25 -14.029 -10.632 -7.867 1.00 0.00 C ATOM 334 CD2 TYR A 25 -12.270 -9.101 -7.372 1.00 0.00 C ATOM 335 CE1 TYR A 25 -14.790 -9.597 -8.377 1.00 0.00 C ATOM 336 CE2 TYR A 25 -13.025 -8.062 -7.880 1.00 0.00 C ATOM 337 CZ TYR A 25 -14.284 -8.315 -8.381 1.00 0.00 C ATOM 338 OH TYR A 25 -15.039 -7.283 -8.889 1.00 0.00 O ATOM 0 H TYR A 25 -11.184 -13.764 -5.449 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.674 -11.287 -4.797 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -10.909 -11.184 -6.637 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.877 -12.335 -7.538 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -14.429 -11.635 -7.866 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -11.284 -8.899 -6.981 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -15.777 -9.792 -8.771 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -12.631 -7.056 -7.885 1.00 0.00 H new ATOM 0 HH TYR A 25 -14.537 -6.444 -8.816 1.00 0.00 H new ATOM 348 N SER A 26 -14.731 -12.696 -4.838 1.00 0.00 N ATOM 349 CA SER A 26 -16.024 -13.357 -4.968 1.00 0.00 C ATOM 350 C SER A 26 -17.061 -12.410 -5.565 1.00 0.00 C ATOM 351 O SER A 26 -16.745 -11.278 -5.928 1.00 0.00 O ATOM 352 CB SER A 26 -16.502 -13.861 -3.604 1.00 0.00 C ATOM 353 OG SER A 26 -16.064 -15.189 -3.369 1.00 0.00 O ATOM 0 H SER A 26 -14.636 -12.115 -4.005 1.00 0.00 H new ATOM 0 HA SER A 26 -15.904 -14.207 -5.640 1.00 0.00 H new ATOM 0 HB2 SER A 26 -16.125 -13.206 -2.818 1.00 0.00 H new ATOM 0 HB3 SER A 26 -17.590 -13.820 -3.559 1.00 0.00 H new ATOM 0 HG SER A 26 -16.381 -15.487 -2.491 1.00 0.00 H new ATOM 359 N GLN A 27 -18.298 -12.883 -5.664 1.00 0.00 N ATOM 360 CA GLN A 27 -19.382 -12.079 -6.218 1.00 0.00 C ATOM 361 C GLN A 27 -19.765 -10.949 -5.266 1.00 0.00 C ATOM 362 O GLN A 27 -20.226 -9.893 -5.696 1.00 0.00 O ATOM 363 CB GLN A 27 -20.601 -12.957 -6.504 1.00 0.00 C ATOM 364 CG GLN A 27 -21.269 -12.655 -7.836 1.00 0.00 C ATOM 365 CD GLN A 27 -22.758 -12.397 -7.697 1.00 0.00 C ATOM 366 OE1 GLN A 27 -23.212 -11.839 -6.699 1.00 0.00 O ATOM 367 NE2 GLN A 27 -23.525 -12.805 -8.701 1.00 0.00 N ATOM 0 H GLN A 27 -18.576 -13.819 -5.368 1.00 0.00 H new ATOM 0 HA GLN A 27 -19.033 -11.639 -7.152 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -20.296 -14.003 -6.489 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -21.329 -12.825 -5.704 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -20.794 -11.784 -8.287 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -21.111 -13.492 -8.516 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -23.105 -13.264 -9.510 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -24.534 -12.660 -8.664 1.00 0.00 H new ATOM 376 N ASP A 28 -19.572 -11.180 -3.970 1.00 0.00 N ATOM 377 CA ASP A 28 -19.898 -10.181 -2.959 1.00 0.00 C ATOM 378 C ASP A 28 -19.109 -8.896 -3.186 1.00 0.00 C ATOM 379 O ASP A 28 -19.676 -7.804 -3.212 1.00 0.00 O ATOM 380 CB ASP A 28 -19.611 -10.728 -1.560 1.00 0.00 C ATOM 381 CG ASP A 28 -20.572 -11.831 -1.163 1.00 0.00 C ATOM 382 OD1 ASP A 28 -20.452 -12.949 -1.707 1.00 0.00 O ATOM 383 OD2 ASP A 28 -21.446 -11.577 -0.306 1.00 0.00 O ATOM 0 H ASP A 28 -19.192 -12.050 -3.597 1.00 0.00 H new ATOM 0 HA ASP A 28 -20.960 -9.952 -3.042 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -18.590 -11.109 -1.524 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -19.674 -9.916 -0.835 1.00 0.00 H new ATOM 388 N ILE A 29 -17.797 -9.033 -3.353 1.00 0.00 N ATOM 389 CA ILE A 29 -16.932 -7.881 -3.581 1.00 0.00 C ATOM 390 C ILE A 29 -17.385 -7.088 -4.804 1.00 0.00 C ATOM 391 O ILE A 29 -17.186 -5.876 -4.879 1.00 0.00 O ATOM 392 CB ILE A 29 -15.462 -8.309 -3.769 1.00 0.00 C ATOM 393 CG1 ILE A 29 -14.995 -9.150 -2.579 1.00 0.00 C ATOM 394 CG2 ILE A 29 -14.567 -7.089 -3.942 1.00 0.00 C ATOM 395 CD1 ILE A 29 -15.056 -8.414 -1.258 1.00 0.00 C ATOM 0 H ILE A 29 -17.310 -9.929 -3.335 1.00 0.00 H new ATOM 0 HA ILE A 29 -17.005 -7.249 -2.696 1.00 0.00 H new ATOM 0 HB ILE A 29 -15.393 -8.916 -4.671 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -15.611 -10.047 -2.515 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.971 -9.478 -2.756 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.534 -7.411 -4.073 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -14.886 -6.525 -4.819 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -14.640 -6.456 -3.058 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.711 -9.071 -0.459 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -14.418 -7.531 -1.303 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -16.083 -8.109 -1.058 1.00 0.00 H new ATOM 407 N ALA A 30 -17.999 -7.781 -5.757 1.00 0.00 N ATOM 408 CA ALA A 30 -18.484 -7.140 -6.972 1.00 0.00 C ATOM 409 C ALA A 30 -19.512 -6.056 -6.654 1.00 0.00 C ATOM 410 O ALA A 30 -19.760 -5.166 -7.467 1.00 0.00 O ATOM 411 CB ALA A 30 -19.083 -8.177 -7.911 1.00 0.00 C ATOM 0 H ALA A 30 -18.172 -8.785 -5.711 1.00 0.00 H new ATOM 0 HA ALA A 30 -17.636 -6.664 -7.464 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -19.442 -7.685 -8.815 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -18.322 -8.911 -8.175 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -19.915 -8.678 -7.416 1.00 0.00 H new ATOM 417 N GLN A 31 -20.108 -6.137 -5.467 1.00 0.00 N ATOM 418 CA GLN A 31 -21.109 -5.162 -5.047 1.00 0.00 C ATOM 419 C GLN A 31 -20.765 -4.588 -3.672 1.00 0.00 C ATOM 420 O GLN A 31 -20.679 -5.326 -2.690 1.00 0.00 O ATOM 421 CB GLN A 31 -22.493 -5.812 -5.009 1.00 0.00 C ATOM 422 CG GLN A 31 -23.158 -5.907 -6.372 1.00 0.00 C ATOM 423 CD GLN A 31 -24.400 -5.044 -6.480 1.00 0.00 C ATOM 424 OE1 GLN A 31 -25.001 -4.672 -5.472 1.00 0.00 O ATOM 425 NE2 GLN A 31 -24.792 -4.720 -7.707 1.00 0.00 N ATOM 0 H GLN A 31 -19.915 -6.867 -4.781 1.00 0.00 H new ATOM 0 HA GLN A 31 -21.116 -4.346 -5.770 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -22.404 -6.813 -4.587 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -23.136 -5.240 -4.340 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -22.445 -5.608 -7.141 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -23.424 -6.945 -6.570 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -24.264 -5.050 -8.515 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -25.621 -4.141 -7.841 1.00 0.00 H new ATOM 434 N PRO A 32 -20.565 -3.260 -3.579 1.00 0.00 N ATOM 435 CA PRO A 32 -20.230 -2.601 -2.311 1.00 0.00 C ATOM 436 C PRO A 32 -21.249 -2.895 -1.215 1.00 0.00 C ATOM 437 O PRO A 32 -20.943 -2.791 -0.026 1.00 0.00 O ATOM 438 CB PRO A 32 -20.242 -1.111 -2.664 1.00 0.00 C ATOM 439 CG PRO A 32 -20.001 -1.064 -4.132 1.00 0.00 C ATOM 440 CD PRO A 32 -20.645 -2.299 -4.695 1.00 0.00 C ATOM 0 HA PRO A 32 -19.277 -2.950 -1.915 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -21.196 -0.651 -2.405 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -19.469 -0.569 -2.119 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -20.433 -0.164 -4.570 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -18.934 -1.045 -4.352 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -21.677 -2.114 -4.994 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -20.117 -2.662 -5.577 1.00 0.00 H new ATOM 448 N SER A 33 -22.462 -3.260 -1.620 1.00 0.00 N ATOM 449 CA SER A 33 -23.526 -3.568 -0.670 1.00 0.00 C ATOM 450 C SER A 33 -23.098 -4.665 0.300 1.00 0.00 C ATOM 451 O SER A 33 -23.565 -4.716 1.439 1.00 0.00 O ATOM 452 CB SER A 33 -24.792 -3.997 -1.415 1.00 0.00 C ATOM 453 OG SER A 33 -25.821 -4.354 -0.508 1.00 0.00 O ATOM 0 H SER A 33 -22.732 -3.350 -2.599 1.00 0.00 H new ATOM 0 HA SER A 33 -23.735 -2.666 -0.095 1.00 0.00 H new ATOM 0 HB2 SER A 33 -25.134 -3.184 -2.056 1.00 0.00 H new ATOM 0 HB3 SER A 33 -24.566 -4.842 -2.065 1.00 0.00 H new ATOM 0 HG SER A 33 -26.620 -4.623 -1.009 1.00 0.00 H new ATOM 459 N THR A 34 -22.209 -5.542 -0.156 1.00 0.00 N ATOM 460 CA THR A 34 -21.721 -6.637 0.675 1.00 0.00 C ATOM 461 C THR A 34 -20.787 -6.120 1.765 1.00 0.00 C ATOM 462 O THR A 34 -20.243 -5.021 1.662 1.00 0.00 O ATOM 463 CB THR A 34 -20.995 -7.672 -0.185 1.00 0.00 C ATOM 464 OG1 THR A 34 -19.890 -7.085 -0.849 1.00 0.00 O ATOM 465 CG2 THR A 34 -21.881 -8.305 -1.237 1.00 0.00 C ATOM 0 H THR A 34 -21.812 -5.516 -1.095 1.00 0.00 H new ATOM 0 HA THR A 34 -22.580 -7.108 1.152 1.00 0.00 H new ATOM 0 HB THR A 34 -20.672 -8.449 0.508 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.117 -6.932 -1.790 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.303 -9.029 -1.811 1.00 0.00 H new ATOM 0 HG22 THR A 34 -22.717 -8.810 -0.753 1.00 0.00 H new ATOM 0 HG23 THR A 34 -22.261 -7.532 -1.905 1.00 0.00 H new ATOM 473 N THR A 35 -20.608 -6.923 2.809 1.00 0.00 N ATOM 474 CA THR A 35 -19.741 -6.549 3.921 1.00 0.00 C ATOM 475 C THR A 35 -18.281 -6.864 3.606 1.00 0.00 C ATOM 476 O THR A 35 -17.372 -6.210 4.114 1.00 0.00 O ATOM 477 CB THR A 35 -20.168 -7.280 5.195 1.00 0.00 C ATOM 478 OG1 THR A 35 -21.576 -7.423 5.242 1.00 0.00 O ATOM 479 CG2 THR A 35 -19.735 -6.575 6.462 1.00 0.00 C ATOM 0 H THR A 35 -21.051 -7.836 2.908 1.00 0.00 H new ATOM 0 HA THR A 35 -19.836 -5.474 4.076 1.00 0.00 H new ATOM 0 HB THR A 35 -19.674 -8.251 5.152 1.00 0.00 H new ATOM 0 HG1 THR A 35 -21.830 -7.894 6.063 1.00 0.00 H new ATOM 0 HG21 THR A 35 -20.069 -7.146 7.328 1.00 0.00 H new ATOM 0 HG22 THR A 35 -18.648 -6.493 6.479 1.00 0.00 H new ATOM 0 HG23 THR A 35 -20.175 -5.578 6.492 1.00 0.00 H new ATOM 487 N LYS A 36 -18.065 -7.870 2.764 1.00 0.00 N ATOM 488 CA LYS A 36 -16.719 -8.270 2.380 1.00 0.00 C ATOM 489 C LYS A 36 -16.006 -7.136 1.648 1.00 0.00 C ATOM 490 O LYS A 36 -14.822 -6.884 1.876 1.00 0.00 O ATOM 491 CB LYS A 36 -16.781 -9.517 1.497 1.00 0.00 C ATOM 492 CG LYS A 36 -15.745 -10.573 1.851 1.00 0.00 C ATOM 493 CD LYS A 36 -14.329 -10.018 1.792 1.00 0.00 C ATOM 494 CE LYS A 36 -13.455 -10.817 0.837 1.00 0.00 C ATOM 495 NZ LYS A 36 -12.577 -11.779 1.559 1.00 0.00 N ATOM 0 H LYS A 36 -18.807 -8.423 2.335 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.152 -8.500 3.282 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -17.775 -9.957 1.575 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -16.644 -9.221 0.457 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -15.944 -10.956 2.852 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -15.834 -11.415 1.164 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -14.359 -8.976 1.474 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -13.889 -10.034 2.789 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.087 -11.360 0.134 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.840 -10.134 0.251 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -11.998 -12.303 0.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -11.955 -11.260 2.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -13.164 -12.447 2.098 1.00 0.00 H new ATOM 509 N TYR A 37 -16.735 -6.455 0.772 1.00 0.00 N ATOM 510 CA TYR A 37 -16.175 -5.346 0.009 1.00 0.00 C ATOM 511 C TYR A 37 -15.711 -4.226 0.936 1.00 0.00 C ATOM 512 O TYR A 37 -14.576 -3.759 0.843 1.00 0.00 O ATOM 513 CB TYR A 37 -17.211 -4.811 -0.983 1.00 0.00 C ATOM 514 CG TYR A 37 -16.739 -3.608 -1.771 1.00 0.00 C ATOM 515 CD1 TYR A 37 -16.920 -2.320 -1.282 1.00 0.00 C ATOM 516 CD2 TYR A 37 -16.114 -3.762 -3.001 1.00 0.00 C ATOM 517 CE1 TYR A 37 -16.491 -1.219 -1.999 1.00 0.00 C ATOM 518 CE2 TYR A 37 -15.683 -2.666 -3.724 1.00 0.00 C ATOM 519 CZ TYR A 37 -15.874 -1.397 -3.218 1.00 0.00 C ATOM 520 OH TYR A 37 -15.446 -0.302 -3.935 1.00 0.00 O ATOM 0 H TYR A 37 -17.716 -6.651 0.572 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.310 -5.715 -0.543 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.479 -5.607 -1.678 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -18.117 -4.544 -0.439 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -17.403 -2.177 -0.327 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -15.962 -4.754 -3.399 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -16.639 -0.224 -1.606 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -15.199 -2.802 -4.680 1.00 0.00 H new ATOM 0 HH TYR A 37 -15.031 -0.600 -4.771 1.00 0.00 H new ATOM 530 N GLN A 38 -16.598 -3.796 1.828 1.00 0.00 N ATOM 531 CA GLN A 38 -16.279 -2.728 2.770 1.00 0.00 C ATOM 532 C GLN A 38 -15.286 -3.205 3.825 1.00 0.00 C ATOM 533 O GLN A 38 -14.441 -2.438 4.288 1.00 0.00 O ATOM 534 CB GLN A 38 -17.555 -2.221 3.447 1.00 0.00 C ATOM 535 CG GLN A 38 -18.628 -1.781 2.466 1.00 0.00 C ATOM 536 CD GLN A 38 -19.936 -1.433 3.151 1.00 0.00 C ATOM 537 OE1 GLN A 38 -20.095 -1.643 4.353 1.00 0.00 O ATOM 538 NE2 GLN A 38 -20.881 -0.899 2.385 1.00 0.00 N ATOM 0 H GLN A 38 -17.543 -4.170 1.919 1.00 0.00 H new ATOM 0 HA GLN A 38 -15.820 -1.912 2.211 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -17.957 -3.009 4.083 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -17.303 -1.383 4.098 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -18.272 -0.915 1.908 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -18.802 -2.577 1.742 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -20.705 -0.743 1.393 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -21.782 -0.645 2.789 1.00 0.00 H new ATOM 547 N GLN A 39 -15.393 -4.475 4.203 1.00 0.00 N ATOM 548 CA GLN A 39 -14.504 -5.052 5.205 1.00 0.00 C ATOM 549 C GLN A 39 -13.046 -4.949 4.768 1.00 0.00 C ATOM 550 O GLN A 39 -12.235 -4.297 5.427 1.00 0.00 O ATOM 551 CB GLN A 39 -14.870 -6.515 5.459 1.00 0.00 C ATOM 552 CG GLN A 39 -15.868 -6.704 6.590 1.00 0.00 C ATOM 553 CD GLN A 39 -15.474 -7.822 7.536 1.00 0.00 C ATOM 554 OE1 GLN A 39 -14.291 -8.121 7.704 1.00 0.00 O ATOM 555 NE2 GLN A 39 -16.466 -8.445 8.162 1.00 0.00 N ATOM 0 H GLN A 39 -16.086 -5.124 3.831 1.00 0.00 H new ATOM 0 HA GLN A 39 -14.626 -4.487 6.129 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -15.284 -6.941 4.545 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -13.963 -7.073 5.689 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -15.957 -5.773 7.150 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -16.851 -6.918 6.170 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -17.432 -8.164 7.993 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -16.262 -9.204 8.812 1.00 0.00 H new ATOM 564 N THR A 40 -12.718 -5.597 3.655 1.00 0.00 N ATOM 565 CA THR A 40 -11.356 -5.580 3.132 1.00 0.00 C ATOM 566 C THR A 40 -10.918 -4.159 2.795 1.00 0.00 C ATOM 567 O THR A 40 -9.744 -3.813 2.928 1.00 0.00 O ATOM 568 CB THR A 40 -11.255 -6.465 1.889 1.00 0.00 C ATOM 569 OG1 THR A 40 -11.667 -7.790 2.181 1.00 0.00 O ATOM 570 CG2 THR A 40 -9.855 -6.537 1.318 1.00 0.00 C ATOM 0 H THR A 40 -13.377 -6.141 3.097 1.00 0.00 H new ATOM 0 HA THR A 40 -10.693 -5.970 3.904 1.00 0.00 H new ATOM 0 HB THR A 40 -11.909 -6.001 1.151 1.00 0.00 H new ATOM 0 HG1 THR A 40 -12.194 -8.141 1.433 1.00 0.00 H new ATOM 0 HG21 THR A 40 -9.853 -7.181 0.438 1.00 0.00 H new ATOM 0 HG22 THR A 40 -9.525 -5.537 1.037 1.00 0.00 H new ATOM 0 HG23 THR A 40 -9.177 -6.945 2.067 1.00 0.00 H new ATOM 578 N LYS A 41 -11.867 -3.338 2.358 1.00 0.00 N ATOM 579 CA LYS A 41 -11.577 -1.953 2.001 1.00 0.00 C ATOM 580 C LYS A 41 -10.959 -1.201 3.176 1.00 0.00 C ATOM 581 O LYS A 41 -10.002 -0.445 3.007 1.00 0.00 O ATOM 582 CB LYS A 41 -12.853 -1.244 1.543 1.00 0.00 C ATOM 583 CG LYS A 41 -12.596 0.106 0.890 1.00 0.00 C ATOM 584 CD LYS A 41 -13.876 0.705 0.331 1.00 0.00 C ATOM 585 CE LYS A 41 -13.597 1.581 -0.881 1.00 0.00 C ATOM 586 NZ LYS A 41 -13.272 2.981 -0.491 1.00 0.00 N ATOM 0 H LYS A 41 -12.844 -3.607 2.242 1.00 0.00 H new ATOM 0 HA LYS A 41 -10.858 -1.961 1.182 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -13.382 -1.885 0.838 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -13.510 -1.104 2.402 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -12.162 0.789 1.621 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -11.866 -0.009 0.089 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -14.562 -0.095 0.053 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -14.370 1.296 1.102 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.767 1.161 -1.450 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.467 1.580 -1.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.088 3.546 -1.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -14.073 3.391 0.030 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.427 2.985 0.115 1.00 0.00 H new ATOM 600 N ARG A 42 -11.511 -1.413 4.365 1.00 0.00 N ATOM 601 CA ARG A 42 -11.014 -0.754 5.568 1.00 0.00 C ATOM 602 C ARG A 42 -9.746 -1.431 6.079 1.00 0.00 C ATOM 603 O ARG A 42 -8.891 -0.789 6.689 1.00 0.00 O ATOM 604 CB ARG A 42 -12.086 -0.763 6.659 1.00 0.00 C ATOM 605 CG ARG A 42 -11.974 0.399 7.632 1.00 0.00 C ATOM 606 CD ARG A 42 -12.407 1.707 6.988 1.00 0.00 C ATOM 607 NE ARG A 42 -12.042 2.865 7.802 1.00 0.00 N ATOM 608 CZ ARG A 42 -12.005 4.112 7.340 1.00 0.00 C ATOM 609 NH1 ARG A 42 -12.309 4.369 6.074 1.00 0.00 N ATOM 610 NH2 ARG A 42 -11.664 5.108 8.147 1.00 0.00 N ATOM 0 H ARG A 42 -12.303 -2.036 4.522 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.773 0.278 5.312 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.070 -0.740 6.190 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.019 -1.699 7.214 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -12.591 0.202 8.509 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -10.945 0.486 7.980 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -11.947 1.796 6.004 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.486 1.696 6.836 1.00 0.00 H new ATOM 0 HE ARG A 42 -11.802 2.708 8.781 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -12.573 3.608 5.448 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -12.279 5.328 5.727 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.430 4.918 9.121 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -11.636 6.064 7.793 1.00 0.00 H new ATOM 624 N SER A 43 -9.631 -2.731 5.827 1.00 0.00 N ATOM 625 CA SER A 43 -8.468 -3.495 6.263 1.00 0.00 C ATOM 626 C SER A 43 -7.205 -3.026 5.546 1.00 0.00 C ATOM 627 O SER A 43 -6.170 -2.804 6.174 1.00 0.00 O ATOM 628 CB SER A 43 -8.687 -4.987 6.010 1.00 0.00 C ATOM 629 OG SER A 43 -7.742 -5.770 6.720 1.00 0.00 O ATOM 0 H SER A 43 -10.329 -3.277 5.323 1.00 0.00 H new ATOM 0 HA SER A 43 -8.338 -3.330 7.333 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.696 -5.266 6.313 1.00 0.00 H new ATOM 0 HB3 SER A 43 -8.606 -5.194 4.943 1.00 0.00 H new ATOM 0 HG SER A 43 -7.257 -6.346 6.093 1.00 0.00 H new ATOM 635 N ILE A 44 -7.298 -2.878 4.229 1.00 0.00 N ATOM 636 CA ILE A 44 -6.162 -2.436 3.427 1.00 0.00 C ATOM 637 C ILE A 44 -5.848 -0.965 3.682 1.00 0.00 C ATOM 638 O ILE A 44 -4.693 -0.595 3.894 1.00 0.00 O ATOM 639 CB ILE A 44 -6.419 -2.645 1.922 1.00 0.00 C ATOM 640 CG1 ILE A 44 -6.867 -4.083 1.653 1.00 0.00 C ATOM 641 CG2 ILE A 44 -5.172 -2.314 1.117 1.00 0.00 C ATOM 642 CD1 ILE A 44 -7.392 -4.301 0.251 1.00 0.00 C ATOM 0 H ILE A 44 -8.148 -3.057 3.694 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.308 -3.043 3.727 1.00 0.00 H new ATOM 0 HB ILE A 44 -7.217 -1.971 1.610 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -6.026 -4.755 1.826 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.643 -4.353 2.369 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.372 -2.467 0.057 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.895 -1.274 1.287 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.354 -2.963 1.429 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -7.691 -5.342 0.132 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -8.253 -3.655 0.080 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.611 -4.063 -0.471 1.00 0.00 H new ATOM 654 N GLU A 45 -6.883 -0.130 3.659 1.00 0.00 N ATOM 655 CA GLU A 45 -6.715 1.300 3.888 1.00 0.00 C ATOM 656 C GLU A 45 -6.087 1.564 5.255 1.00 0.00 C ATOM 657 O GLU A 45 -5.366 2.544 5.439 1.00 0.00 O ATOM 658 CB GLU A 45 -8.064 2.016 3.785 1.00 0.00 C ATOM 659 CG GLU A 45 -8.238 2.799 2.493 1.00 0.00 C ATOM 660 CD GLU A 45 -7.301 3.986 2.399 1.00 0.00 C ATOM 661 OE1 GLU A 45 -6.078 3.769 2.269 1.00 0.00 O ATOM 662 OE2 GLU A 45 -7.790 5.134 2.456 1.00 0.00 O ATOM 0 H GLU A 45 -7.845 -0.419 3.484 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.045 1.689 3.121 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.864 1.280 3.865 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.171 2.696 4.630 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -8.065 2.136 1.645 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -9.268 3.148 2.420 1.00 0.00 H new ATOM 669 N ASN A 46 -6.366 0.681 6.208 1.00 0.00 N ATOM 670 CA ASN A 46 -5.828 0.817 7.556 1.00 0.00 C ATOM 671 C ASN A 46 -4.394 0.299 7.623 1.00 0.00 C ATOM 672 O ASN A 46 -3.554 0.859 8.327 1.00 0.00 O ATOM 673 CB ASN A 46 -6.705 0.060 8.555 1.00 0.00 C ATOM 674 CG ASN A 46 -6.243 0.244 9.987 1.00 0.00 C ATOM 675 OD1 ASN A 46 -5.613 1.246 10.325 1.00 0.00 O ATOM 676 ND2 ASN A 46 -6.553 -0.728 10.837 1.00 0.00 N ATOM 0 H ASN A 46 -6.961 -0.136 6.072 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.825 1.876 7.816 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -7.735 0.403 8.462 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.699 -1.002 8.308 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -6.267 -0.662 11.814 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.077 -1.541 10.513 1.00 0.00 H new ATOM 683 N ALA A 47 -4.124 -0.773 6.887 1.00 0.00 N ATOM 684 CA ALA A 47 -2.792 -1.367 6.862 1.00 0.00 C ATOM 685 C ALA A 47 -1.816 -0.490 6.087 1.00 0.00 C ATOM 686 O ALA A 47 -0.629 -0.427 6.414 1.00 0.00 O ATOM 687 CB ALA A 47 -2.849 -2.762 6.255 1.00 0.00 C ATOM 0 H ALA A 47 -4.809 -1.249 6.300 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.434 -1.444 7.889 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.848 -3.194 6.242 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.509 -3.392 6.852 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.231 -2.700 5.236 1.00 0.00 H new ATOM 693 N LEU A 48 -2.320 0.185 5.060 1.00 0.00 N ATOM 694 CA LEU A 48 -1.492 1.059 4.237 1.00 0.00 C ATOM 695 C LEU A 48 -1.095 2.316 5.007 1.00 0.00 C ATOM 696 O LEU A 48 0.035 2.792 4.895 1.00 0.00 O ATOM 697 CB LEU A 48 -2.237 1.444 2.958 1.00 0.00 C ATOM 698 CG LEU A 48 -2.074 0.464 1.795 1.00 0.00 C ATOM 699 CD1 LEU A 48 -3.028 0.814 0.664 1.00 0.00 C ATOM 700 CD2 LEU A 48 -0.635 0.463 1.300 1.00 0.00 C ATOM 0 H LEU A 48 -3.299 0.144 4.777 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.585 0.516 3.972 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -3.298 1.538 3.188 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.892 2.427 2.636 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.317 -0.537 2.150 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -2.897 0.106 -0.154 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -4.055 0.765 1.026 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.816 1.822 0.308 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -0.535 -0.239 0.472 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.366 1.463 0.961 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.029 0.164 2.111 1.00 0.00 H new ATOM 712 N ASN A 49 -2.030 2.848 5.786 1.00 0.00 N ATOM 713 CA ASN A 49 -1.779 4.051 6.572 1.00 0.00 C ATOM 714 C ASN A 49 -0.597 3.850 7.516 1.00 0.00 C ATOM 715 O ASN A 49 0.399 4.568 7.441 1.00 0.00 O ATOM 716 CB ASN A 49 -3.026 4.432 7.372 1.00 0.00 C ATOM 717 CG ASN A 49 -2.991 5.872 7.848 1.00 0.00 C ATOM 718 OD1 ASN A 49 -2.114 6.262 8.619 1.00 0.00 O ATOM 719 ND2 ASN A 49 -3.948 6.669 7.389 1.00 0.00 N ATOM 0 H ASN A 49 -2.970 2.465 5.890 1.00 0.00 H new ATOM 0 HA ASN A 49 -1.536 4.860 5.883 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.911 4.278 6.755 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.118 3.770 8.233 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.977 7.648 7.674 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.655 6.302 6.751 1.00 0.00 H new ATOM 726 N GLN A 50 -0.716 2.869 8.405 1.00 0.00 N ATOM 727 CA GLN A 50 0.342 2.575 9.366 1.00 0.00 C ATOM 728 C GLN A 50 1.639 2.207 8.653 1.00 0.00 C ATOM 729 O GLN A 50 2.732 2.458 9.162 1.00 0.00 O ATOM 730 CB GLN A 50 -0.085 1.436 10.292 1.00 0.00 C ATOM 731 CG GLN A 50 -0.395 0.140 9.562 1.00 0.00 C ATOM 732 CD GLN A 50 -1.476 -0.673 10.247 1.00 0.00 C ATOM 733 OE1 GLN A 50 -1.116 -1.864 10.713 1.00 0.00 O flip ATOM 734 NE2 GLN A 50 -2.621 -0.236 10.360 1.00 0.00 N flip ATOM 0 H GLN A 50 -1.534 2.264 8.480 1.00 0.00 H new ATOM 0 HA GLN A 50 0.518 3.472 9.960 1.00 0.00 H new ATOM 0 HB2 GLN A 50 0.707 1.253 11.018 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -0.966 1.747 10.853 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -0.708 0.368 8.543 1.00 0.00 H new ATOM 0 HG3 GLN A 50 0.513 -0.458 9.490 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -2.855 0.684 9.987 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -3.336 -0.794 10.826 1.00 0.00 H new ATOM 743 N LEU A 51 1.512 1.609 7.472 1.00 0.00 N ATOM 744 CA LEU A 51 2.677 1.206 6.691 1.00 0.00 C ATOM 745 C LEU A 51 3.460 2.425 6.212 1.00 0.00 C ATOM 746 O LEU A 51 4.680 2.368 6.058 1.00 0.00 O ATOM 747 CB LEU A 51 2.245 0.359 5.493 1.00 0.00 C ATOM 748 CG LEU A 51 3.391 -0.279 4.705 1.00 0.00 C ATOM 749 CD1 LEU A 51 2.944 -1.591 4.079 1.00 0.00 C ATOM 750 CD2 LEU A 51 3.899 0.678 3.637 1.00 0.00 C ATOM 0 H LEU A 51 0.616 1.393 7.035 1.00 0.00 H new ATOM 0 HA LEU A 51 3.326 0.610 7.333 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.583 -0.431 5.846 1.00 0.00 H new ATOM 0 HB3 LEU A 51 1.663 0.984 4.816 1.00 0.00 H new ATOM 0 HG LEU A 51 4.208 -0.490 5.395 1.00 0.00 H new ATOM 0 HD11 LEU A 51 3.772 -2.030 3.523 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.628 -2.279 4.863 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.110 -1.406 3.402 1.00 0.00 H new ATOM 0 HD21 LEU A 51 4.714 0.209 3.086 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.088 0.920 2.950 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.259 1.592 4.109 1.00 0.00 H new ATOM 762 N PHE A 52 2.752 3.524 5.979 1.00 0.00 N ATOM 763 CA PHE A 52 3.382 4.755 5.517 1.00 0.00 C ATOM 764 C PHE A 52 4.130 5.445 6.655 1.00 0.00 C ATOM 765 O PHE A 52 5.184 6.044 6.444 1.00 0.00 O ATOM 766 CB PHE A 52 2.332 5.702 4.934 1.00 0.00 C ATOM 767 CG PHE A 52 1.493 5.080 3.853 1.00 0.00 C ATOM 768 CD1 PHE A 52 2.072 4.271 2.888 1.00 0.00 C ATOM 769 CD2 PHE A 52 0.127 5.304 3.803 1.00 0.00 C ATOM 770 CE1 PHE A 52 1.302 3.698 1.893 1.00 0.00 C ATOM 771 CE2 PHE A 52 -0.647 4.734 2.811 1.00 0.00 C ATOM 772 CZ PHE A 52 -0.059 3.929 1.855 1.00 0.00 C ATOM 0 H PHE A 52 1.742 3.588 6.102 1.00 0.00 H new ATOM 0 HA PHE A 52 4.100 4.496 4.739 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.679 6.045 5.737 1.00 0.00 H new ATOM 0 HB3 PHE A 52 2.833 6.583 4.532 1.00 0.00 H new ATOM 0 HD1 PHE A 52 3.136 4.086 2.914 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.338 5.932 4.548 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.765 3.070 1.146 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.711 4.918 2.783 1.00 0.00 H new ATOM 0 HZ PHE A 52 -0.662 3.481 1.079 1.00 0.00 H new ATOM 782 N ARG A 53 3.574 5.356 7.858 1.00 0.00 N ATOM 783 CA ARG A 53 4.187 5.972 9.031 1.00 0.00 C ATOM 784 C ARG A 53 5.384 5.160 9.524 1.00 0.00 C ATOM 785 O ARG A 53 6.169 5.636 10.345 1.00 0.00 O ATOM 786 CB ARG A 53 3.157 6.115 10.152 1.00 0.00 C ATOM 787 CG ARG A 53 2.261 7.334 10.001 1.00 0.00 C ATOM 788 CD ARG A 53 2.815 8.531 10.759 1.00 0.00 C ATOM 789 NE ARG A 53 2.878 9.727 9.923 1.00 0.00 N ATOM 790 CZ ARG A 53 3.580 10.814 10.234 1.00 0.00 C ATOM 791 NH1 ARG A 53 4.281 10.860 11.360 1.00 0.00 N ATOM 792 NH2 ARG A 53 3.582 11.859 9.417 1.00 0.00 N ATOM 0 H ARG A 53 2.701 4.864 8.047 1.00 0.00 H new ATOM 0 HA ARG A 53 4.544 6.960 8.741 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.537 5.219 10.181 1.00 0.00 H new ATOM 0 HB3 ARG A 53 3.678 6.173 11.108 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.162 7.585 8.945 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.262 7.100 10.368 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.190 8.730 11.629 1.00 0.00 H new ATOM 0 HD3 ARG A 53 3.812 8.295 11.130 1.00 0.00 H new ATOM 0 HE ARG A 53 2.353 9.729 9.049 1.00 0.00 H new ATOM 0 HH11 ARG A 53 4.284 10.060 11.992 1.00 0.00 H new ATOM 0 HH12 ARG A 53 4.817 11.696 11.593 1.00 0.00 H new ATOM 0 HH21 ARG A 53 3.045 11.830 8.550 1.00 0.00 H new ATOM 0 HH22 ARG A 53 4.120 12.692 9.656 1.00 0.00 H new ATOM 806 N ASN A 54 5.521 3.935 9.025 1.00 0.00 N ATOM 807 CA ASN A 54 6.625 3.069 9.421 1.00 0.00 C ATOM 808 C ASN A 54 7.622 2.899 8.278 1.00 0.00 C ATOM 809 O ASN A 54 8.275 1.862 8.161 1.00 0.00 O ATOM 810 CB ASN A 54 6.097 1.702 9.860 1.00 0.00 C ATOM 811 CG ASN A 54 5.248 1.784 11.113 1.00 0.00 C ATOM 812 OD1 ASN A 54 5.579 2.505 12.055 1.00 0.00 O ATOM 813 ND2 ASN A 54 4.146 1.044 11.131 1.00 0.00 N ATOM 0 H ASN A 54 4.882 3.521 8.347 1.00 0.00 H new ATOM 0 HA ASN A 54 7.139 3.539 10.260 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.507 1.267 9.053 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.938 1.031 10.038 1.00 0.00 H new ATOM 0 HD21 ASN A 54 3.535 1.059 11.948 1.00 0.00 H new ATOM 0 HD22 ASN A 54 3.910 0.461 10.328 1.00 0.00 H new ATOM 820 N SER A 55 7.734 3.923 7.440 1.00 0.00 N ATOM 821 CA SER A 55 8.652 3.886 6.307 1.00 0.00 C ATOM 822 C SER A 55 9.630 5.054 6.361 1.00 0.00 C ATOM 823 O SER A 55 9.470 5.976 7.161 1.00 0.00 O ATOM 824 CB SER A 55 7.872 3.922 4.991 1.00 0.00 C ATOM 825 OG SER A 55 7.484 5.244 4.662 1.00 0.00 O ATOM 0 H SER A 55 7.201 4.789 7.523 1.00 0.00 H new ATOM 0 HA SER A 55 9.219 2.957 6.362 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.486 3.510 4.190 1.00 0.00 H new ATOM 0 HB3 SER A 55 6.988 3.290 5.072 1.00 0.00 H new ATOM 0 HG SER A 55 6.746 5.523 5.244 1.00 0.00 H new ATOM 831 N SER A 56 10.647 5.008 5.505 1.00 0.00 N ATOM 832 CA SER A 56 11.653 6.061 5.456 1.00 0.00 C ATOM 833 C SER A 56 11.071 7.348 4.875 1.00 0.00 C ATOM 834 O SER A 56 11.530 8.445 5.191 1.00 0.00 O ATOM 835 CB SER A 56 12.854 5.610 4.623 1.00 0.00 C ATOM 836 OG SER A 56 13.918 6.541 4.713 1.00 0.00 O ATOM 0 H SER A 56 10.795 4.252 4.836 1.00 0.00 H new ATOM 0 HA SER A 56 11.981 6.261 6.476 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.192 4.633 4.967 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.555 5.495 3.581 1.00 0.00 H new ATOM 0 HG SER A 56 14.673 6.228 4.173 1.00 0.00 H new ATOM 842 N ILE A 57 10.058 7.204 4.026 1.00 0.00 N ATOM 843 CA ILE A 57 9.415 8.354 3.403 1.00 0.00 C ATOM 844 C ILE A 57 8.196 8.805 4.203 1.00 0.00 C ATOM 845 O ILE A 57 7.145 9.110 3.636 1.00 0.00 O ATOM 846 CB ILE A 57 8.982 8.040 1.957 1.00 0.00 C ATOM 847 CG1 ILE A 57 8.000 6.866 1.938 1.00 0.00 C ATOM 848 CG2 ILE A 57 10.197 7.736 1.094 1.00 0.00 C ATOM 849 CD1 ILE A 57 7.076 6.872 0.741 1.00 0.00 C ATOM 0 H ILE A 57 9.666 6.303 3.754 1.00 0.00 H new ATOM 0 HA ILE A 57 10.151 9.158 3.387 1.00 0.00 H new ATOM 0 HB ILE A 57 8.479 8.916 1.546 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.562 5.932 1.948 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.402 6.888 2.849 1.00 0.00 H new ATOM 0 HG21 ILE A 57 9.875 7.516 0.076 1.00 0.00 H new ATOM 0 HG22 ILE A 57 10.862 8.599 1.086 1.00 0.00 H new ATOM 0 HG23 ILE A 57 10.726 6.874 1.501 1.00 0.00 H new ATOM 0 HD11 ILE A 57 6.408 6.012 0.793 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.487 7.789 0.740 1.00 0.00 H new ATOM 0 HD13 ILE A 57 7.666 6.819 -0.174 1.00 0.00 H new ATOM 861 N LYS A 58 8.343 8.846 5.523 1.00 0.00 N ATOM 862 CA LYS A 58 7.254 9.259 6.400 1.00 0.00 C ATOM 863 C LYS A 58 7.345 10.750 6.715 1.00 0.00 C ATOM 864 O LYS A 58 7.209 11.162 7.867 1.00 0.00 O ATOM 865 CB LYS A 58 7.283 8.449 7.697 1.00 0.00 C ATOM 866 CG LYS A 58 8.545 8.659 8.518 1.00 0.00 C ATOM 867 CD LYS A 58 8.582 7.746 9.734 1.00 0.00 C ATOM 868 CE LYS A 58 8.735 8.537 11.024 1.00 0.00 C ATOM 869 NZ LYS A 58 7.430 8.741 11.711 1.00 0.00 N ATOM 0 H LYS A 58 9.205 8.598 6.009 1.00 0.00 H new ATOM 0 HA LYS A 58 6.312 9.072 5.884 1.00 0.00 H new ATOM 0 HB2 LYS A 58 6.417 8.717 8.302 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.188 7.390 7.456 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.420 8.472 7.895 1.00 0.00 H new ATOM 0 HG3 LYS A 58 8.600 9.698 8.841 1.00 0.00 H new ATOM 0 HD2 LYS A 58 7.666 7.156 9.775 1.00 0.00 H new ATOM 0 HD3 LYS A 58 9.410 7.043 9.637 1.00 0.00 H new ATOM 0 HE2 LYS A 58 9.418 8.013 11.692 1.00 0.00 H new ATOM 0 HE3 LYS A 58 9.184 9.505 10.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 7.579 9.284 12.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 6.786 9.264 11.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 7.012 7.818 11.944 1.00 0.00 H new ATOM 883 N SER A 59 7.577 11.555 5.682 1.00 0.00 N ATOM 884 CA SER A 59 7.687 12.999 5.850 1.00 0.00 C ATOM 885 C SER A 59 6.735 13.734 4.912 1.00 0.00 C ATOM 886 O SER A 59 6.076 14.695 5.311 1.00 0.00 O ATOM 887 CB SER A 59 9.124 13.453 5.593 1.00 0.00 C ATOM 888 OG SER A 59 9.965 13.132 6.687 1.00 0.00 O ATOM 0 H SER A 59 7.692 11.232 4.722 1.00 0.00 H new ATOM 0 HA SER A 59 7.412 13.241 6.877 1.00 0.00 H new ATOM 0 HB2 SER A 59 9.502 12.977 4.688 1.00 0.00 H new ATOM 0 HB3 SER A 59 9.143 14.529 5.419 1.00 0.00 H new ATOM 0 HG SER A 59 10.878 13.431 6.496 1.00 0.00 H new ATOM 894 N TYR A 60 6.670 13.282 3.665 1.00 0.00 N ATOM 895 CA TYR A 60 5.799 13.902 2.673 1.00 0.00 C ATOM 896 C TYR A 60 4.580 13.031 2.386 1.00 0.00 C ATOM 897 O TYR A 60 3.510 13.538 2.048 1.00 0.00 O ATOM 898 CB TYR A 60 6.571 14.158 1.377 1.00 0.00 C ATOM 899 CG TYR A 60 7.823 14.983 1.568 1.00 0.00 C ATOM 900 CD1 TYR A 60 7.747 16.324 1.920 1.00 0.00 C ATOM 901 CD2 TYR A 60 9.081 14.419 1.398 1.00 0.00 C ATOM 902 CE1 TYR A 60 8.890 17.082 2.096 1.00 0.00 C ATOM 903 CE2 TYR A 60 10.228 15.170 1.573 1.00 0.00 C ATOM 904 CZ TYR A 60 10.127 16.500 1.921 1.00 0.00 C ATOM 905 OH TYR A 60 11.267 17.251 2.096 1.00 0.00 O ATOM 0 H TYR A 60 7.209 12.489 3.317 1.00 0.00 H new ATOM 0 HA TYR A 60 5.452 14.852 3.080 1.00 0.00 H new ATOM 0 HB2 TYR A 60 6.842 13.201 0.931 1.00 0.00 H new ATOM 0 HB3 TYR A 60 5.916 14.666 0.669 1.00 0.00 H new ATOM 0 HD1 TYR A 60 6.779 16.783 2.059 1.00 0.00 H new ATOM 0 HD2 TYR A 60 9.164 13.377 1.125 1.00 0.00 H new ATOM 0 HE1 TYR A 60 8.814 18.124 2.369 1.00 0.00 H new ATOM 0 HE2 TYR A 60 11.199 14.717 1.438 1.00 0.00 H new ATOM 0 HH TYR A 60 12.055 16.691 1.936 1.00 0.00 H new ATOM 915 N PHE A 61 4.746 11.719 2.521 1.00 0.00 N ATOM 916 CA PHE A 61 3.654 10.784 2.273 1.00 0.00 C ATOM 917 C PHE A 61 2.458 11.090 3.169 1.00 0.00 C ATOM 918 O PHE A 61 2.591 11.183 4.389 1.00 0.00 O ATOM 919 CB PHE A 61 4.122 9.346 2.502 1.00 0.00 C ATOM 920 CG PHE A 61 3.231 8.319 1.863 1.00 0.00 C ATOM 921 CD1 PHE A 61 1.926 8.150 2.295 1.00 0.00 C ATOM 922 CD2 PHE A 61 3.700 7.522 0.831 1.00 0.00 C ATOM 923 CE1 PHE A 61 1.103 7.208 1.708 1.00 0.00 C ATOM 924 CE2 PHE A 61 2.883 6.577 0.240 1.00 0.00 C ATOM 925 CZ PHE A 61 1.582 6.420 0.680 1.00 0.00 C ATOM 0 H PHE A 61 5.623 11.280 2.800 1.00 0.00 H new ATOM 0 HA PHE A 61 3.344 10.897 1.234 1.00 0.00 H new ATOM 0 HB2 PHE A 61 5.133 9.234 2.109 1.00 0.00 H new ATOM 0 HB3 PHE A 61 4.173 9.155 3.574 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.547 8.762 3.100 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.716 7.641 0.484 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.087 7.088 2.053 1.00 0.00 H new ATOM 0 HE2 PHE A 61 3.260 5.962 -0.564 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.941 5.682 0.220 1.00 0.00 H new ATOM 935 N SER A 62 1.290 11.244 2.553 1.00 0.00 N ATOM 936 CA SER A 62 0.069 11.540 3.294 1.00 0.00 C ATOM 937 C SER A 62 -0.748 10.272 3.525 1.00 0.00 C ATOM 938 O SER A 62 -0.938 9.844 4.662 1.00 0.00 O ATOM 939 CB SER A 62 -0.771 12.572 2.540 1.00 0.00 C ATOM 940 OG SER A 62 -1.100 12.112 1.241 1.00 0.00 O ATOM 0 H SER A 62 1.163 11.169 1.544 1.00 0.00 H new ATOM 0 HA SER A 62 0.351 11.950 4.264 1.00 0.00 H new ATOM 0 HB2 SER A 62 -1.684 12.779 3.098 1.00 0.00 H new ATOM 0 HB3 SER A 62 -0.221 13.510 2.468 1.00 0.00 H new ATOM 0 HG SER A 62 -1.638 12.789 0.781 1.00 0.00 H new ATOM 946 N ASP A 63 -1.229 9.677 2.437 1.00 0.00 N ATOM 947 CA ASP A 63 -2.025 8.459 2.524 1.00 0.00 C ATOM 948 C ASP A 63 -2.251 7.855 1.141 1.00 0.00 C ATOM 949 O ASP A 63 -1.693 8.324 0.148 1.00 0.00 O ATOM 950 CB ASP A 63 -3.370 8.752 3.195 1.00 0.00 C ATOM 951 CG ASP A 63 -3.468 8.146 4.581 1.00 0.00 C ATOM 952 OD1 ASP A 63 -2.411 7.869 5.184 1.00 0.00 O ATOM 953 OD2 ASP A 63 -4.603 7.950 5.065 1.00 0.00 O ATOM 0 H ASP A 63 -1.081 10.018 1.487 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.475 7.737 3.128 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -3.512 9.831 3.262 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.176 8.362 2.573 1.00 0.00 H new ATOM 958 N CYS A 64 -3.074 6.814 1.084 1.00 0.00 N ATOM 959 CA CYS A 64 -3.376 6.144 -0.175 1.00 0.00 C ATOM 960 C CYS A 64 -4.859 6.263 -0.511 1.00 0.00 C ATOM 961 O CYS A 64 -5.687 6.501 0.367 1.00 0.00 O ATOM 962 CB CYS A 64 -2.971 4.670 -0.103 1.00 0.00 C ATOM 963 SG CYS A 64 -2.094 4.072 -1.566 1.00 0.00 S ATOM 0 H CYS A 64 -3.545 6.415 1.896 1.00 0.00 H new ATOM 0 HA CYS A 64 -2.804 6.631 -0.965 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.339 4.521 0.772 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.866 4.065 0.043 1.00 0.00 H new ATOM 0 HG CYS A 64 -0.816 4.051 -1.327 1.00 0.00 H new ATOM 969 N GLN A 65 -5.186 6.095 -1.788 1.00 0.00 N ATOM 970 CA GLN A 65 -6.569 6.184 -2.240 1.00 0.00 C ATOM 971 C GLN A 65 -6.992 4.900 -2.948 1.00 0.00 C ATOM 972 O GLN A 65 -6.739 4.724 -4.139 1.00 0.00 O ATOM 973 CB GLN A 65 -6.747 7.378 -3.179 1.00 0.00 C ATOM 974 CG GLN A 65 -8.198 7.783 -3.382 1.00 0.00 C ATOM 975 CD GLN A 65 -8.353 8.919 -4.373 1.00 0.00 C ATOM 976 OE1 GLN A 65 -8.023 10.068 -4.076 1.00 0.00 O ATOM 977 NE2 GLN A 65 -8.858 8.604 -5.561 1.00 0.00 N ATOM 0 H GLN A 65 -4.512 5.897 -2.528 1.00 0.00 H new ATOM 0 HA GLN A 65 -7.202 6.323 -1.364 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -6.194 8.228 -2.780 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -6.307 7.137 -4.147 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -8.766 6.921 -3.731 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -8.626 8.080 -2.424 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -9.118 7.639 -5.765 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -8.986 9.327 -6.269 1.00 0.00 H new ATOM 986 N VAL A 66 -7.637 4.007 -2.205 1.00 0.00 N ATOM 987 CA VAL A 66 -8.096 2.740 -2.762 1.00 0.00 C ATOM 988 C VAL A 66 -9.229 2.958 -3.759 1.00 0.00 C ATOM 989 O VAL A 66 -10.389 3.112 -3.376 1.00 0.00 O ATOM 990 CB VAL A 66 -8.568 1.778 -1.653 1.00 0.00 C ATOM 991 CG1 VAL A 66 -9.707 2.394 -0.855 1.00 0.00 C ATOM 992 CG2 VAL A 66 -8.983 0.438 -2.244 1.00 0.00 C ATOM 0 H VAL A 66 -7.854 4.137 -1.217 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.248 2.292 -3.279 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.734 1.605 -0.973 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.025 1.699 -0.078 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.368 3.322 -0.395 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -10.545 2.603 -1.519 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -9.313 -0.226 -1.445 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.800 0.589 -2.950 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -8.134 -0.010 -2.761 1.00 0.00 H new ATOM 1002 N LEU A 67 -8.885 2.972 -5.043 1.00 0.00 N ATOM 1003 CA LEU A 67 -9.872 3.173 -6.097 1.00 0.00 C ATOM 1004 C LEU A 67 -10.915 2.061 -6.083 1.00 0.00 C ATOM 1005 O LEU A 67 -12.095 2.306 -5.838 1.00 0.00 O ATOM 1006 CB LEU A 67 -9.185 3.228 -7.463 1.00 0.00 C ATOM 1007 CG LEU A 67 -7.962 4.144 -7.537 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -7.412 4.185 -8.955 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -8.316 5.544 -7.060 1.00 0.00 C ATOM 0 H LEU A 67 -7.930 2.846 -5.378 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.376 4.122 -5.914 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.881 2.219 -7.741 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.912 3.558 -8.205 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.190 3.743 -6.881 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.542 4.841 -8.989 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.121 3.180 -9.261 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.178 4.563 -9.632 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.434 6.182 -7.119 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.105 5.955 -7.691 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.663 5.500 -6.028 1.00 0.00 H new ATOM 1021 N ALA A 68 -10.470 0.837 -6.349 1.00 0.00 N ATOM 1022 CA ALA A 68 -11.365 -0.313 -6.367 1.00 0.00 C ATOM 1023 C ALA A 68 -10.581 -1.619 -6.418 1.00 0.00 C ATOM 1024 O ALA A 68 -9.349 -1.615 -6.406 1.00 0.00 O ATOM 1025 CB ALA A 68 -12.318 -0.221 -7.550 1.00 0.00 C ATOM 0 H ALA A 68 -9.496 0.617 -6.555 1.00 0.00 H new ATOM 0 HA ALA A 68 -11.945 -0.305 -5.444 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -12.981 -1.086 -7.551 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.911 0.690 -7.470 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -11.746 -0.201 -8.477 1.00 0.00 H new ATOM 1031 N PHE A 69 -11.301 -2.734 -6.475 1.00 0.00 N ATOM 1032 CA PHE A 69 -10.672 -4.049 -6.529 1.00 0.00 C ATOM 1033 C PHE A 69 -10.897 -4.705 -7.887 1.00 0.00 C ATOM 1034 O PHE A 69 -12.000 -4.658 -8.435 1.00 0.00 O ATOM 1035 CB PHE A 69 -11.220 -4.946 -5.418 1.00 0.00 C ATOM 1036 CG PHE A 69 -10.932 -4.434 -4.036 1.00 0.00 C ATOM 1037 CD1 PHE A 69 -9.626 -4.299 -3.593 1.00 0.00 C ATOM 1038 CD2 PHE A 69 -11.965 -4.089 -3.180 1.00 0.00 C ATOM 1039 CE1 PHE A 69 -9.356 -3.829 -2.322 1.00 0.00 C ATOM 1040 CE2 PHE A 69 -11.701 -3.618 -1.908 1.00 0.00 C ATOM 1041 CZ PHE A 69 -10.395 -3.488 -1.478 1.00 0.00 C ATOM 0 H PHE A 69 -12.321 -2.754 -6.485 1.00 0.00 H new ATOM 0 HA PHE A 69 -9.600 -3.917 -6.383 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -12.298 -5.046 -5.542 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.793 -5.943 -5.523 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.810 -4.564 -4.249 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -12.988 -4.189 -3.510 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -8.334 -3.728 -1.989 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -12.515 -3.352 -1.251 1.00 0.00 H new ATOM 0 HZ PHE A 69 -10.187 -3.121 -0.484 1.00 0.00 H new ATOM 1051 N ARG A 70 -9.848 -5.316 -8.425 1.00 0.00 N ATOM 1052 CA ARG A 70 -9.932 -5.982 -9.720 1.00 0.00 C ATOM 1053 C ARG A 70 -10.006 -7.496 -9.548 1.00 0.00 C ATOM 1054 O ARG A 70 -9.557 -8.039 -8.539 1.00 0.00 O ATOM 1055 CB ARG A 70 -8.728 -5.613 -10.587 1.00 0.00 C ATOM 1056 CG ARG A 70 -8.639 -4.130 -10.905 1.00 0.00 C ATOM 1057 CD ARG A 70 -9.737 -3.698 -11.864 1.00 0.00 C ATOM 1058 NE ARG A 70 -9.610 -4.343 -13.169 1.00 0.00 N ATOM 1059 CZ ARG A 70 -10.207 -3.905 -14.274 1.00 0.00 C ATOM 1060 NH1 ARG A 70 -10.975 -2.823 -14.237 1.00 0.00 N ATOM 1061 NH2 ARG A 70 -10.038 -4.550 -15.420 1.00 0.00 N ATOM 0 H ARG A 70 -8.929 -5.364 -7.985 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.843 -5.645 -10.216 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -7.815 -5.922 -10.077 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -8.777 -6.174 -11.520 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -8.713 -3.554 -9.983 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -7.665 -3.908 -11.342 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -10.709 -3.939 -11.434 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -9.703 -2.616 -11.990 1.00 0.00 H new ATOM 0 HE ARG A 70 -9.029 -5.179 -13.237 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -11.110 -2.323 -13.358 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -11.430 -2.492 -15.087 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -9.450 -5.383 -15.455 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -10.496 -4.214 -16.267 1.00 0.00 H new ATOM 1075 N SER A 71 -10.575 -8.172 -10.542 1.00 0.00 N ATOM 1076 CA SER A 71 -10.707 -9.624 -10.500 1.00 0.00 C ATOM 1077 C SER A 71 -9.860 -10.277 -11.587 1.00 0.00 C ATOM 1078 O SER A 71 -10.164 -10.168 -12.775 1.00 0.00 O ATOM 1079 CB SER A 71 -12.173 -10.028 -10.667 1.00 0.00 C ATOM 1080 OG SER A 71 -12.315 -11.438 -10.689 1.00 0.00 O ATOM 0 H SER A 71 -10.951 -7.738 -11.385 1.00 0.00 H new ATOM 0 HA SER A 71 -10.351 -9.970 -9.530 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.763 -9.613 -9.850 1.00 0.00 H new ATOM 0 HB3 SER A 71 -12.567 -9.605 -11.591 1.00 0.00 H new ATOM 0 HG SER A 71 -12.813 -11.729 -9.897 1.00 0.00 H new ATOM 1086 N VAL A 72 -8.795 -10.956 -11.173 1.00 0.00 N ATOM 1087 CA VAL A 72 -7.904 -11.627 -12.111 1.00 0.00 C ATOM 1088 C VAL A 72 -8.601 -12.804 -12.787 1.00 0.00 C ATOM 1089 O VAL A 72 -9.485 -13.432 -12.206 1.00 0.00 O ATOM 1090 CB VAL A 72 -6.630 -12.135 -11.410 1.00 0.00 C ATOM 1091 CG1 VAL A 72 -5.805 -10.968 -10.891 1.00 0.00 C ATOM 1092 CG2 VAL A 72 -6.985 -13.090 -10.279 1.00 0.00 C ATOM 0 H VAL A 72 -8.528 -11.056 -10.194 1.00 0.00 H new ATOM 0 HA VAL A 72 -7.627 -10.890 -12.865 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.030 -12.680 -12.139 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -4.909 -11.346 -10.399 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -5.518 -10.326 -11.724 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -6.396 -10.394 -10.177 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.072 -13.438 -9.796 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -7.607 -12.573 -9.548 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -7.530 -13.944 -10.681 1.00 0.00 H new ATOM 1102 N SER A 73 -8.196 -13.094 -14.019 1.00 0.00 N ATOM 1103 CA SER A 73 -8.782 -14.196 -14.777 1.00 0.00 C ATOM 1104 C SER A 73 -7.760 -15.306 -15.000 1.00 0.00 C ATOM 1105 O SER A 73 -7.166 -15.409 -16.073 1.00 0.00 O ATOM 1106 CB SER A 73 -9.308 -13.693 -16.122 1.00 0.00 C ATOM 1107 OG SER A 73 -8.250 -13.234 -16.945 1.00 0.00 O ATOM 0 H SER A 73 -7.465 -12.583 -14.514 1.00 0.00 H new ATOM 0 HA SER A 73 -9.612 -14.602 -14.199 1.00 0.00 H new ATOM 0 HB2 SER A 73 -9.845 -14.495 -16.629 1.00 0.00 H new ATOM 0 HB3 SER A 73 -10.022 -12.886 -15.958 1.00 0.00 H new ATOM 0 HG SER A 73 -7.544 -13.912 -16.978 1.00 0.00 H new ATOM 1112 N ASN A 74 -7.562 -16.134 -13.980 1.00 0.00 N ATOM 1113 CA ASN A 74 -6.613 -17.237 -14.064 1.00 0.00 C ATOM 1114 C ASN A 74 -6.862 -18.256 -12.957 1.00 0.00 C ATOM 1115 O ASN A 74 -7.255 -19.392 -13.222 1.00 0.00 O ATOM 1116 CB ASN A 74 -5.179 -16.711 -13.975 1.00 0.00 C ATOM 1117 CG ASN A 74 -4.157 -17.733 -14.434 1.00 0.00 C ATOM 1118 OD1 ASN A 74 -4.435 -18.932 -14.471 1.00 0.00 O ATOM 1119 ND2 ASN A 74 -2.967 -17.263 -14.787 1.00 0.00 N ATOM 0 H ASN A 74 -8.046 -16.062 -13.085 1.00 0.00 H new ATOM 0 HA ASN A 74 -6.753 -17.731 -15.025 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -5.087 -15.811 -14.583 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -4.964 -16.424 -12.946 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -2.239 -17.903 -15.105 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -2.780 -16.261 -14.741 1.00 0.00 H new ATOM 1126 N ASN A 75 -6.633 -17.840 -11.716 1.00 0.00 N ATOM 1127 CA ASN A 75 -6.834 -18.716 -10.567 1.00 0.00 C ATOM 1128 C ASN A 75 -8.178 -18.440 -9.898 1.00 0.00 C ATOM 1129 O ASN A 75 -8.753 -19.317 -9.254 1.00 0.00 O ATOM 1130 CB ASN A 75 -5.699 -18.533 -9.556 1.00 0.00 C ATOM 1131 CG ASN A 75 -5.139 -19.855 -9.070 1.00 0.00 C ATOM 1132 OD1 ASN A 75 -5.071 -20.828 -9.822 1.00 0.00 O ATOM 1133 ND2 ASN A 75 -4.736 -19.897 -7.806 1.00 0.00 N ATOM 0 H ASN A 75 -6.308 -16.902 -11.480 1.00 0.00 H new ATOM 0 HA ASN A 75 -6.832 -19.746 -10.923 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.900 -17.949 -10.013 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -6.064 -17.961 -8.703 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.351 -20.760 -7.422 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -4.811 -19.066 -7.219 1.00 0.00 H new ATOM 1140 N ASN A 76 -8.674 -17.215 -10.056 1.00 0.00 N ATOM 1141 CA ASN A 76 -9.951 -16.825 -9.467 1.00 0.00 C ATOM 1142 C ASN A 76 -9.879 -16.856 -7.943 1.00 0.00 C ATOM 1143 O ASN A 76 -10.883 -17.093 -7.271 1.00 0.00 O ATOM 1144 CB ASN A 76 -11.069 -17.746 -9.958 1.00 0.00 C ATOM 1145 CG ASN A 76 -12.339 -16.987 -10.290 1.00 0.00 C ATOM 1146 OD1 ASN A 76 -13.382 -17.199 -9.671 1.00 0.00 O ATOM 1147 ND2 ASN A 76 -12.257 -16.097 -11.273 1.00 0.00 N ATOM 0 H ASN A 76 -8.211 -16.477 -10.586 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.170 -15.805 -9.781 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -10.730 -18.285 -10.842 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -11.284 -18.492 -9.193 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -13.079 -15.557 -11.542 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -11.372 -15.954 -11.759 1.00 0.00 H new ATOM 1154 N ASN A 77 -8.688 -16.615 -7.406 1.00 0.00 N ATOM 1155 CA ASN A 77 -8.488 -16.614 -5.961 1.00 0.00 C ATOM 1156 C ASN A 77 -7.630 -15.428 -5.528 1.00 0.00 C ATOM 1157 O ASN A 77 -7.001 -15.459 -4.471 1.00 0.00 O ATOM 1158 CB ASN A 77 -7.831 -17.923 -5.517 1.00 0.00 C ATOM 1159 CG ASN A 77 -8.244 -18.329 -4.115 1.00 0.00 C ATOM 1160 OD1 ASN A 77 -7.399 -18.557 -3.249 1.00 0.00 O ATOM 1161 ND2 ASN A 77 -9.549 -18.422 -3.886 1.00 0.00 N ATOM 0 H ASN A 77 -7.847 -16.418 -7.949 1.00 0.00 H new ATOM 0 HA ASN A 77 -9.464 -16.524 -5.485 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -8.098 -18.716 -6.216 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -6.747 -17.814 -5.557 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -9.887 -18.692 -2.962 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -10.213 -18.224 -4.634 1.00 0.00 H new ATOM 1168 N HIS A 78 -7.610 -14.382 -6.350 1.00 0.00 N ATOM 1169 CA HIS A 78 -6.829 -13.187 -6.049 1.00 0.00 C ATOM 1170 C HIS A 78 -7.672 -11.930 -6.234 1.00 0.00 C ATOM 1171 O HIS A 78 -8.888 -12.008 -6.411 1.00 0.00 O ATOM 1172 CB HIS A 78 -5.590 -13.122 -6.945 1.00 0.00 C ATOM 1173 CG HIS A 78 -4.863 -14.426 -7.060 1.00 0.00 C ATOM 1174 ND1 HIS A 78 -4.586 -15.372 -6.131 1.00 0.00 N flip ATOM 1175 CD2 HIS A 78 -4.320 -14.883 -8.242 1.00 0.00 C flip ATOM 1176 CE1 HIS A 78 -3.891 -16.373 -6.765 1.00 0.00 C flip ATOM 1177 NE2 HIS A 78 -3.744 -16.054 -8.037 1.00 0.00 N flip ATOM 0 H HIS A 78 -8.126 -14.338 -7.229 1.00 0.00 H new ATOM 0 HA HIS A 78 -6.511 -13.241 -5.008 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -5.889 -12.793 -7.940 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -4.907 -12.369 -6.552 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.359 -14.364 -9.188 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -3.524 -17.275 -6.298 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -3.267 -16.616 -8.742 1.00 0.00 H new ATOM 1186 N THR A 79 -7.020 -10.772 -6.194 1.00 0.00 N ATOM 1187 CA THR A 79 -7.713 -9.499 -6.359 1.00 0.00 C ATOM 1188 C THR A 79 -6.726 -8.374 -6.654 1.00 0.00 C ATOM 1189 O THR A 79 -5.883 -8.041 -5.822 1.00 0.00 O ATOM 1190 CB THR A 79 -8.525 -9.171 -5.102 1.00 0.00 C ATOM 1191 OG1 THR A 79 -9.536 -10.141 -4.892 1.00 0.00 O ATOM 1192 CG2 THR A 79 -9.200 -7.816 -5.155 1.00 0.00 C ATOM 0 H THR A 79 -6.014 -10.689 -6.049 1.00 0.00 H new ATOM 0 HA THR A 79 -8.391 -9.589 -7.207 1.00 0.00 H new ATOM 0 HB THR A 79 -7.801 -9.166 -4.288 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.495 -10.462 -3.967 1.00 0.00 H new ATOM 0 HG21 THR A 79 -9.757 -7.651 -4.233 1.00 0.00 H new ATOM 0 HG22 THR A 79 -8.445 -7.038 -5.268 1.00 0.00 H new ATOM 0 HG23 THR A 79 -9.884 -7.783 -6.003 1.00 0.00 H new ATOM 1200 N GLY A 80 -6.840 -7.792 -7.843 1.00 0.00 N ATOM 1201 CA GLY A 80 -5.955 -6.708 -8.228 1.00 0.00 C ATOM 1202 C GLY A 80 -6.288 -5.411 -7.517 1.00 0.00 C ATOM 1203 O GLY A 80 -7.352 -4.831 -7.737 1.00 0.00 O ATOM 0 H GLY A 80 -7.530 -8.052 -8.548 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.925 -6.987 -8.006 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.019 -6.556 -9.305 1.00 0.00 H new ATOM 1207 N VAL A 81 -5.380 -4.956 -6.660 1.00 0.00 N ATOM 1208 CA VAL A 81 -5.587 -3.720 -5.913 1.00 0.00 C ATOM 1209 C VAL A 81 -5.344 -2.497 -6.792 1.00 0.00 C ATOM 1210 O VAL A 81 -4.360 -2.433 -7.528 1.00 0.00 O ATOM 1211 CB VAL A 81 -4.665 -3.644 -4.681 1.00 0.00 C ATOM 1212 CG1 VAL A 81 -4.968 -2.402 -3.856 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -4.803 -4.901 -3.835 1.00 0.00 C ATOM 0 H VAL A 81 -4.495 -5.424 -6.465 1.00 0.00 H new ATOM 0 HA VAL A 81 -6.625 -3.724 -5.580 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.634 -3.575 -5.028 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.305 -2.369 -2.991 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -4.812 -1.513 -4.467 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -6.004 -2.433 -3.518 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.145 -4.831 -2.969 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.835 -5.002 -3.499 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.528 -5.772 -4.430 1.00 0.00 H new ATOM 1223 N ASP A 82 -6.246 -1.526 -6.701 1.00 0.00 N ATOM 1224 CA ASP A 82 -6.132 -0.297 -7.478 1.00 0.00 C ATOM 1225 C ASP A 82 -6.140 0.918 -6.558 1.00 0.00 C ATOM 1226 O ASP A 82 -7.174 1.558 -6.366 1.00 0.00 O ATOM 1227 CB ASP A 82 -7.277 -0.198 -8.489 1.00 0.00 C ATOM 1228 CG ASP A 82 -6.831 0.395 -9.810 1.00 0.00 C ATOM 1229 OD1 ASP A 82 -5.978 1.307 -9.795 1.00 0.00 O ATOM 1230 OD2 ASP A 82 -7.335 -0.052 -10.862 1.00 0.00 O ATOM 0 H ASP A 82 -7.066 -1.566 -6.096 1.00 0.00 H new ATOM 0 HA ASP A 82 -5.186 -0.319 -8.019 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.693 -1.191 -8.661 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.076 0.414 -8.070 1.00 0.00 H new ATOM 1235 N SER A 83 -4.981 1.226 -5.985 1.00 0.00 N ATOM 1236 CA SER A 83 -4.853 2.361 -5.078 1.00 0.00 C ATOM 1237 C SER A 83 -4.019 3.475 -5.701 1.00 0.00 C ATOM 1238 O SER A 83 -3.552 3.356 -6.834 1.00 0.00 O ATOM 1239 CB SER A 83 -4.229 1.909 -3.755 1.00 0.00 C ATOM 1240 OG SER A 83 -3.357 0.808 -3.948 1.00 0.00 O ATOM 0 H SER A 83 -4.117 0.705 -6.133 1.00 0.00 H new ATOM 0 HA SER A 83 -5.851 2.756 -4.887 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.679 2.737 -3.308 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.017 1.634 -3.054 1.00 0.00 H new ATOM 0 HG SER A 83 -3.373 0.235 -3.153 1.00 0.00 H new ATOM 1246 N LEU A 84 -3.840 4.561 -4.955 1.00 0.00 N ATOM 1247 CA LEU A 84 -3.067 5.703 -5.434 1.00 0.00 C ATOM 1248 C LEU A 84 -2.160 6.252 -4.337 1.00 0.00 C ATOM 1249 O LEU A 84 -2.635 6.826 -3.357 1.00 0.00 O ATOM 1250 CB LEU A 84 -4.012 6.803 -5.930 1.00 0.00 C ATOM 1251 CG LEU A 84 -3.347 7.946 -6.701 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -2.530 8.823 -5.766 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -2.474 7.399 -7.820 1.00 0.00 C ATOM 0 H LEU A 84 -4.220 4.675 -4.015 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.438 5.367 -6.259 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -4.767 6.347 -6.570 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.534 7.223 -5.071 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.131 8.559 -7.145 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.066 9.629 -6.335 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.182 9.247 -5.002 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.755 8.223 -5.289 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.010 8.226 -8.357 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -1.699 6.760 -7.397 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.087 6.818 -8.509 1.00 0.00 H new ATOM 1265 N CYS A 85 -0.853 6.082 -4.511 1.00 0.00 N ATOM 1266 CA CYS A 85 0.115 6.573 -3.536 1.00 0.00 C ATOM 1267 C CYS A 85 0.097 8.098 -3.493 1.00 0.00 C ATOM 1268 O CYS A 85 0.948 8.756 -4.091 1.00 0.00 O ATOM 1269 CB CYS A 85 1.522 6.072 -3.881 1.00 0.00 C ATOM 1270 SG CYS A 85 1.822 4.350 -3.419 1.00 0.00 S ATOM 0 H CYS A 85 -0.441 5.609 -5.315 1.00 0.00 H new ATOM 0 HA CYS A 85 -0.161 6.191 -2.553 1.00 0.00 H new ATOM 0 HB2 CYS A 85 1.684 6.183 -4.953 1.00 0.00 H new ATOM 0 HB3 CYS A 85 2.255 6.705 -3.381 1.00 0.00 H new ATOM 0 HG CYS A 85 2.195 4.293 -2.175 1.00 0.00 H new ATOM 1276 N ASN A 86 -0.887 8.653 -2.790 1.00 0.00 N ATOM 1277 CA ASN A 86 -1.028 10.101 -2.676 1.00 0.00 C ATOM 1278 C ASN A 86 0.107 10.708 -1.857 1.00 0.00 C ATOM 1279 O ASN A 86 0.528 10.146 -0.847 1.00 0.00 O ATOM 1280 CB ASN A 86 -2.374 10.450 -2.038 1.00 0.00 C ATOM 1281 CG ASN A 86 -3.471 10.642 -3.067 1.00 0.00 C ATOM 1282 OD1 ASN A 86 -3.387 11.521 -3.924 1.00 0.00 O ATOM 1283 ND2 ASN A 86 -4.509 9.819 -2.986 1.00 0.00 N ATOM 0 H ASN A 86 -1.599 8.121 -2.290 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.983 10.521 -3.681 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.662 9.657 -1.348 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.268 11.361 -1.450 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -5.278 9.901 -3.651 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -4.537 9.104 -2.259 1.00 0.00 H new ATOM 1290 N PHE A 87 0.592 11.864 -2.302 1.00 0.00 N ATOM 1291 CA PHE A 87 1.674 12.557 -1.611 1.00 0.00 C ATOM 1292 C PHE A 87 1.308 14.016 -1.362 1.00 0.00 C ATOM 1293 O PHE A 87 0.375 14.545 -1.965 1.00 0.00 O ATOM 1294 CB PHE A 87 2.965 12.473 -2.426 1.00 0.00 C ATOM 1295 CG PHE A 87 3.806 11.276 -2.093 1.00 0.00 C ATOM 1296 CD1 PHE A 87 3.342 9.995 -2.345 1.00 0.00 C ATOM 1297 CD2 PHE A 87 5.060 11.431 -1.527 1.00 0.00 C ATOM 1298 CE1 PHE A 87 4.114 8.891 -2.038 1.00 0.00 C ATOM 1299 CE2 PHE A 87 5.837 10.331 -1.218 1.00 0.00 C ATOM 1300 CZ PHE A 87 5.363 9.060 -1.473 1.00 0.00 C ATOM 0 H PHE A 87 0.253 12.340 -3.138 1.00 0.00 H new ATOM 0 HA PHE A 87 1.831 12.070 -0.649 1.00 0.00 H new ATOM 0 HB2 PHE A 87 2.715 12.448 -3.487 1.00 0.00 H new ATOM 0 HB3 PHE A 87 3.551 13.377 -2.258 1.00 0.00 H new ATOM 0 HD1 PHE A 87 2.366 9.858 -2.786 1.00 0.00 H new ATOM 0 HD2 PHE A 87 5.435 12.423 -1.325 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.741 7.898 -2.239 1.00 0.00 H new ATOM 0 HE2 PHE A 87 6.814 10.466 -0.778 1.00 0.00 H new ATOM 0 HZ PHE A 87 5.968 8.199 -1.231 1.00 0.00 H new ATOM 1310 N SER A 88 2.051 14.664 -0.469 1.00 0.00 N ATOM 1311 CA SER A 88 1.802 16.063 -0.140 1.00 0.00 C ATOM 1312 C SER A 88 2.462 16.988 -1.161 1.00 0.00 C ATOM 1313 O SER A 88 3.506 16.659 -1.723 1.00 0.00 O ATOM 1314 CB SER A 88 2.322 16.378 1.263 1.00 0.00 C ATOM 1315 OG SER A 88 1.444 17.256 1.947 1.00 0.00 O ATOM 0 H SER A 88 2.829 14.243 0.039 1.00 0.00 H new ATOM 0 HA SER A 88 0.725 16.232 -0.167 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.431 15.453 1.830 1.00 0.00 H new ATOM 0 HB3 SER A 88 3.312 16.829 1.195 1.00 0.00 H new ATOM 0 HG SER A 88 1.798 17.441 2.842 1.00 0.00 H new ATOM 1321 N PRO A 89 1.859 18.163 -1.414 1.00 0.00 N ATOM 1322 CA PRO A 89 2.396 19.136 -2.372 1.00 0.00 C ATOM 1323 C PRO A 89 3.804 19.592 -2.007 1.00 0.00 C ATOM 1324 O PRO A 89 4.585 19.983 -2.874 1.00 0.00 O ATOM 1325 CB PRO A 89 1.419 20.311 -2.290 1.00 0.00 C ATOM 1326 CG PRO A 89 0.172 19.745 -1.701 1.00 0.00 C ATOM 1327 CD PRO A 89 0.612 18.637 -0.788 1.00 0.00 C ATOM 0 HA PRO A 89 2.481 18.709 -3.371 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.819 21.112 -1.669 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.231 20.736 -3.276 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -0.381 20.507 -1.152 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.492 19.369 -2.480 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.782 18.995 0.228 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.134 17.845 -0.726 1.00 0.00 H new ATOM 1335 N LEU A 90 4.122 19.541 -0.716 1.00 0.00 N ATOM 1336 CA LEU A 90 5.437 19.951 -0.236 1.00 0.00 C ATOM 1337 C LEU A 90 6.543 19.137 -0.902 1.00 0.00 C ATOM 1338 O LEU A 90 7.644 19.638 -1.131 1.00 0.00 O ATOM 1339 CB LEU A 90 5.519 19.797 1.283 1.00 0.00 C ATOM 1340 CG LEU A 90 4.708 20.818 2.083 1.00 0.00 C ATOM 1341 CD1 LEU A 90 3.248 20.402 2.154 1.00 0.00 C ATOM 1342 CD2 LEU A 90 5.288 20.981 3.480 1.00 0.00 C ATOM 0 H LEU A 90 3.487 19.220 0.015 1.00 0.00 H new ATOM 0 HA LEU A 90 5.578 21.000 -0.497 1.00 0.00 H new ATOM 0 HB2 LEU A 90 5.179 18.796 1.550 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.564 19.870 1.584 1.00 0.00 H new ATOM 0 HG LEU A 90 4.765 21.780 1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 90 2.687 21.140 2.727 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.839 20.337 1.146 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.170 19.430 2.640 1.00 0.00 H new ATOM 0 HD21 LEU A 90 4.699 21.711 4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.262 20.023 3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.319 21.326 3.408 1.00 0.00 H new ATOM 1354 N ALA A 91 6.241 17.880 -1.209 1.00 0.00 N ATOM 1355 CA ALA A 91 7.209 16.997 -1.848 1.00 0.00 C ATOM 1356 C ALA A 91 7.445 17.398 -3.300 1.00 0.00 C ATOM 1357 O ALA A 91 6.872 18.375 -3.786 1.00 0.00 O ATOM 1358 CB ALA A 91 6.739 15.553 -1.766 1.00 0.00 C ATOM 0 H ALA A 91 5.334 17.450 -1.026 1.00 0.00 H new ATOM 0 HA ALA A 91 8.156 17.090 -1.316 1.00 0.00 H new ATOM 0 HB1 ALA A 91 7.471 14.904 -2.247 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.630 15.265 -0.720 1.00 0.00 H new ATOM 0 HB3 ALA A 91 5.779 15.454 -2.272 1.00 0.00 H new ATOM 1364 N ARG A 92 8.290 16.638 -3.988 1.00 0.00 N ATOM 1365 CA ARG A 92 8.604 16.910 -5.387 1.00 0.00 C ATOM 1366 C ARG A 92 9.629 15.914 -5.919 1.00 0.00 C ATOM 1367 O ARG A 92 9.577 15.519 -7.084 1.00 0.00 O ATOM 1368 CB ARG A 92 9.130 18.339 -5.550 1.00 0.00 C ATOM 1369 CG ARG A 92 8.535 19.071 -6.741 1.00 0.00 C ATOM 1370 CD ARG A 92 9.549 19.997 -7.396 1.00 0.00 C ATOM 1371 NE ARG A 92 10.040 19.463 -8.665 1.00 0.00 N ATOM 1372 CZ ARG A 92 11.177 18.780 -8.800 1.00 0.00 C ATOM 1373 NH1 ARG A 92 11.949 18.537 -7.748 1.00 0.00 N ATOM 1374 NH2 ARG A 92 11.542 18.336 -9.995 1.00 0.00 N ATOM 0 H ARG A 92 8.771 15.827 -3.599 1.00 0.00 H new ATOM 0 HA ARG A 92 7.686 16.803 -5.964 1.00 0.00 H new ATOM 0 HB2 ARG A 92 8.915 18.903 -4.642 1.00 0.00 H new ATOM 0 HB3 ARG A 92 10.214 18.309 -5.657 1.00 0.00 H new ATOM 0 HG2 ARG A 92 8.178 18.346 -7.473 1.00 0.00 H new ATOM 0 HG3 ARG A 92 7.670 19.649 -6.417 1.00 0.00 H new ATOM 0 HD2 ARG A 92 9.093 20.972 -7.566 1.00 0.00 H new ATOM 0 HD3 ARG A 92 10.389 20.152 -6.719 1.00 0.00 H new ATOM 0 HE ARG A 92 9.477 19.623 -9.500 1.00 0.00 H new ATOM 0 HH11 ARG A 92 11.674 18.874 -6.825 1.00 0.00 H new ATOM 0 HH12 ARG A 92 12.817 18.013 -7.862 1.00 0.00 H new ATOM 0 HH21 ARG A 92 10.953 18.517 -10.808 1.00 0.00 H new ATOM 0 HH22 ARG A 92 12.411 17.813 -10.101 1.00 0.00 H new ATOM 1388 N ARG A 93 10.560 15.510 -5.060 1.00 0.00 N ATOM 1389 CA ARG A 93 11.597 14.560 -5.445 1.00 0.00 C ATOM 1390 C ARG A 93 11.193 13.132 -5.087 1.00 0.00 C ATOM 1391 O ARG A 93 12.026 12.328 -4.667 1.00 0.00 O ATOM 1392 CB ARG A 93 12.919 14.914 -4.764 1.00 0.00 C ATOM 1393 CG ARG A 93 13.576 16.166 -5.324 1.00 0.00 C ATOM 1394 CD ARG A 93 14.075 15.945 -6.743 1.00 0.00 C ATOM 1395 NE ARG A 93 15.196 16.821 -7.071 1.00 0.00 N ATOM 1396 CZ ARG A 93 15.575 17.109 -8.315 1.00 0.00 C ATOM 1397 NH1 ARG A 93 14.924 16.592 -9.350 1.00 0.00 N ATOM 1398 NH2 ARG A 93 16.606 17.915 -8.524 1.00 0.00 N ATOM 0 H ARG A 93 10.617 15.826 -4.092 1.00 0.00 H new ATOM 0 HA ARG A 93 11.724 14.620 -6.526 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.743 15.052 -3.697 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.607 14.075 -4.867 1.00 0.00 H new ATOM 0 HG2 ARG A 93 12.862 16.989 -5.312 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.410 16.458 -4.685 1.00 0.00 H new ATOM 0 HD2 ARG A 93 14.380 14.905 -6.862 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.260 16.120 -7.445 1.00 0.00 H new ATOM 0 HE ARG A 93 15.720 17.237 -6.301 1.00 0.00 H new ATOM 0 HH11 ARG A 93 14.130 15.971 -9.194 1.00 0.00 H new ATOM 0 HH12 ARG A 93 15.218 16.816 -10.301 1.00 0.00 H new ATOM 0 HH21 ARG A 93 17.109 18.315 -7.732 1.00 0.00 H new ATOM 0 HH22 ARG A 93 16.896 18.135 -9.477 1.00 0.00 H new ATOM 1412 N VAL A 94 9.912 12.823 -5.255 1.00 0.00 N ATOM 1413 CA VAL A 94 9.399 11.492 -4.952 1.00 0.00 C ATOM 1414 C VAL A 94 9.255 10.660 -6.222 1.00 0.00 C ATOM 1415 O VAL A 94 8.375 10.913 -7.045 1.00 0.00 O ATOM 1416 CB VAL A 94 8.035 11.564 -4.240 1.00 0.00 C ATOM 1417 CG1 VAL A 94 7.607 10.185 -3.764 1.00 0.00 C ATOM 1418 CG2 VAL A 94 8.090 12.544 -3.079 1.00 0.00 C ATOM 0 H VAL A 94 9.209 13.477 -5.600 1.00 0.00 H new ATOM 0 HA VAL A 94 10.121 11.017 -4.288 1.00 0.00 H new ATOM 0 HB VAL A 94 7.292 11.923 -4.953 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.641 10.256 -3.264 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.524 9.514 -4.619 1.00 0.00 H new ATOM 0 HG13 VAL A 94 8.349 9.794 -3.067 1.00 0.00 H new ATOM 0 HG21 VAL A 94 7.118 12.582 -2.588 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.845 12.219 -2.364 1.00 0.00 H new ATOM 0 HG23 VAL A 94 8.347 13.536 -3.452 1.00 0.00 H new ATOM 1428 N ASP A 95 10.124 9.668 -6.375 1.00 0.00 N ATOM 1429 CA ASP A 95 10.094 8.800 -7.547 1.00 0.00 C ATOM 1430 C ASP A 95 9.346 7.505 -7.250 1.00 0.00 C ATOM 1431 O ASP A 95 9.166 7.131 -6.090 1.00 0.00 O ATOM 1432 CB ASP A 95 11.517 8.485 -8.012 1.00 0.00 C ATOM 1433 CG ASP A 95 11.636 8.439 -9.522 1.00 0.00 C ATOM 1434 OD1 ASP A 95 11.896 9.499 -10.129 1.00 0.00 O ATOM 1435 OD2 ASP A 95 11.469 7.344 -10.098 1.00 0.00 O ATOM 0 H ASP A 95 10.858 9.444 -5.703 1.00 0.00 H new ATOM 0 HA ASP A 95 9.567 9.327 -8.342 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.199 9.239 -7.620 1.00 0.00 H new ATOM 0 HB3 ASP A 95 11.828 7.526 -7.597 1.00 0.00 H new ATOM 1440 N ARG A 96 8.912 6.824 -8.306 1.00 0.00 N ATOM 1441 CA ARG A 96 8.183 5.569 -8.162 1.00 0.00 C ATOM 1442 C ARG A 96 9.008 4.543 -7.391 1.00 0.00 C ATOM 1443 O ARG A 96 8.473 3.770 -6.597 1.00 0.00 O ATOM 1444 CB ARG A 96 7.811 5.008 -9.537 1.00 0.00 C ATOM 1445 CG ARG A 96 9.002 4.840 -10.469 1.00 0.00 C ATOM 1446 CD ARG A 96 8.567 4.727 -11.922 1.00 0.00 C ATOM 1447 NE ARG A 96 9.114 5.806 -12.744 1.00 0.00 N ATOM 1448 CZ ARG A 96 8.521 6.986 -12.915 1.00 0.00 C ATOM 1449 NH1 ARG A 96 7.360 7.248 -12.329 1.00 0.00 N ATOM 1450 NH2 ARG A 96 9.094 7.909 -13.677 1.00 0.00 N ATOM 0 H ARG A 96 9.053 7.121 -9.272 1.00 0.00 H new ATOM 0 HA ARG A 96 7.271 5.773 -7.600 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.324 4.042 -9.406 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.084 5.671 -10.006 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.676 5.689 -10.356 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.562 3.949 -10.186 1.00 0.00 H new ATOM 0 HD2 ARG A 96 8.890 3.766 -12.323 1.00 0.00 H new ATOM 0 HD3 ARG A 96 7.479 4.746 -11.977 1.00 0.00 H new ATOM 0 HE ARG A 96 10.004 5.645 -13.215 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.914 6.543 -11.742 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.913 8.155 -12.466 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.987 7.714 -14.130 1.00 0.00 H new ATOM 0 HH22 ARG A 96 8.642 8.814 -13.810 1.00 0.00 H new ATOM 1464 N VAL A 97 10.316 4.545 -7.629 1.00 0.00 N ATOM 1465 CA VAL A 97 11.217 3.615 -6.958 1.00 0.00 C ATOM 1466 C VAL A 97 11.167 3.801 -5.445 1.00 0.00 C ATOM 1467 O VAL A 97 11.361 2.851 -4.686 1.00 0.00 O ATOM 1468 CB VAL A 97 12.669 3.795 -7.439 1.00 0.00 C ATOM 1469 CG1 VAL A 97 13.566 2.714 -6.855 1.00 0.00 C ATOM 1470 CG2 VAL A 97 12.736 3.790 -8.959 1.00 0.00 C ATOM 0 H VAL A 97 10.775 5.180 -8.282 1.00 0.00 H new ATOM 0 HA VAL A 97 10.882 2.609 -7.210 1.00 0.00 H new ATOM 0 HB VAL A 97 13.029 4.762 -7.087 1.00 0.00 H new ATOM 0 HG11 VAL A 97 14.587 2.859 -7.207 1.00 0.00 H new ATOM 0 HG12 VAL A 97 13.546 2.773 -5.767 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.209 1.734 -7.172 1.00 0.00 H new ATOM 0 HG21 VAL A 97 13.770 3.918 -9.278 1.00 0.00 H new ATOM 0 HG22 VAL A 97 12.355 2.841 -9.337 1.00 0.00 H new ATOM 0 HG23 VAL A 97 12.131 4.607 -9.353 1.00 0.00 H new ATOM 1480 N ALA A 98 10.908 5.030 -5.012 1.00 0.00 N ATOM 1481 CA ALA A 98 10.834 5.341 -3.590 1.00 0.00 C ATOM 1482 C ALA A 98 9.724 4.548 -2.909 1.00 0.00 C ATOM 1483 O ALA A 98 9.983 3.731 -2.026 1.00 0.00 O ATOM 1484 CB ALA A 98 10.617 6.833 -3.388 1.00 0.00 C ATOM 0 H ALA A 98 10.746 5.828 -5.627 1.00 0.00 H new ATOM 0 HA ALA A 98 11.781 5.055 -3.132 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.564 7.052 -2.322 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.447 7.385 -3.830 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.685 7.133 -3.867 1.00 0.00 H new ATOM 1490 N ILE A 99 8.486 4.792 -3.327 1.00 0.00 N ATOM 1491 CA ILE A 99 7.337 4.098 -2.756 1.00 0.00 C ATOM 1492 C ILE A 99 7.354 2.613 -3.114 1.00 0.00 C ATOM 1493 O ILE A 99 6.666 1.807 -2.486 1.00 0.00 O ATOM 1494 CB ILE A 99 6.006 4.716 -3.232 1.00 0.00 C ATOM 1495 CG1 ILE A 99 6.024 6.234 -3.045 1.00 0.00 C ATOM 1496 CG2 ILE A 99 4.837 4.098 -2.477 1.00 0.00 C ATOM 1497 CD1 ILE A 99 5.188 6.978 -4.063 1.00 0.00 C ATOM 0 H ILE A 99 8.253 5.464 -4.058 1.00 0.00 H new ATOM 0 HA ILE A 99 7.411 4.209 -1.674 1.00 0.00 H new ATOM 0 HB ILE A 99 5.884 4.503 -4.294 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.662 6.473 -2.045 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.054 6.587 -3.104 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.904 4.543 -2.823 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.815 3.023 -2.657 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.954 4.284 -1.409 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.247 8.049 -3.870 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.563 6.769 -5.065 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.150 6.653 -3.989 1.00 0.00 H new ATOM 1509 N TYR A 100 8.145 2.255 -4.122 1.00 0.00 N ATOM 1510 CA TYR A 100 8.250 0.868 -4.558 1.00 0.00 C ATOM 1511 C TYR A 100 9.206 0.086 -3.662 1.00 0.00 C ATOM 1512 O TYR A 100 8.933 -1.057 -3.294 1.00 0.00 O ATOM 1513 CB TYR A 100 8.731 0.802 -6.008 1.00 0.00 C ATOM 1514 CG TYR A 100 8.653 -0.582 -6.612 1.00 0.00 C ATOM 1515 CD1 TYR A 100 7.440 -1.257 -6.696 1.00 0.00 C ATOM 1516 CD2 TYR A 100 9.790 -1.214 -7.099 1.00 0.00 C ATOM 1517 CE1 TYR A 100 7.365 -2.521 -7.247 1.00 0.00 C ATOM 1518 CE2 TYR A 100 9.722 -2.479 -7.651 1.00 0.00 C ATOM 1519 CZ TYR A 100 8.508 -3.129 -7.724 1.00 0.00 C ATOM 1520 OH TYR A 100 8.436 -4.387 -8.275 1.00 0.00 O ATOM 0 H TYR A 100 8.723 2.908 -4.652 1.00 0.00 H new ATOM 0 HA TYR A 100 7.260 0.417 -4.487 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.134 1.486 -6.611 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.762 1.152 -6.056 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.542 -0.785 -6.324 1.00 0.00 H new ATOM 0 HD2 TYR A 100 10.743 -0.708 -7.045 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.415 -3.032 -7.304 1.00 0.00 H new ATOM 0 HE2 TYR A 100 10.616 -2.957 -8.024 1.00 0.00 H new ATOM 0 HH TYR A 100 9.329 -4.670 -8.563 1.00 0.00 H new ATOM 1530 N GLU A 101 10.328 0.709 -3.318 1.00 0.00 N ATOM 1531 CA GLU A 101 11.326 0.072 -2.468 1.00 0.00 C ATOM 1532 C GLU A 101 10.924 0.145 -0.998 1.00 0.00 C ATOM 1533 O GLU A 101 11.269 -0.731 -0.206 1.00 0.00 O ATOM 1534 CB GLU A 101 12.691 0.733 -2.668 1.00 0.00 C ATOM 1535 CG GLU A 101 13.481 0.154 -3.832 1.00 0.00 C ATOM 1536 CD GLU A 101 14.896 -0.228 -3.444 1.00 0.00 C ATOM 1537 OE1 GLU A 101 15.529 0.532 -2.683 1.00 0.00 O ATOM 1538 OE2 GLU A 101 15.371 -1.290 -3.900 1.00 0.00 O ATOM 0 H GLU A 101 10.569 1.655 -3.615 1.00 0.00 H new ATOM 0 HA GLU A 101 11.390 -0.978 -2.754 1.00 0.00 H new ATOM 0 HB2 GLU A 101 12.548 1.801 -2.832 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.275 0.626 -1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 101 12.964 -0.725 -4.216 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.515 0.883 -4.642 1.00 0.00 H new ATOM 1545 N GLU A 102 10.192 1.194 -0.641 1.00 0.00 N ATOM 1546 CA GLU A 102 9.744 1.380 0.734 1.00 0.00 C ATOM 1547 C GLU A 102 8.599 0.429 1.068 1.00 0.00 C ATOM 1548 O GLU A 102 8.462 -0.018 2.207 1.00 0.00 O ATOM 1549 CB GLU A 102 9.303 2.827 0.958 1.00 0.00 C ATOM 1550 CG GLU A 102 10.459 3.781 1.212 1.00 0.00 C ATOM 1551 CD GLU A 102 11.284 3.386 2.420 1.00 0.00 C ATOM 1552 OE1 GLU A 102 10.704 2.846 3.385 1.00 0.00 O ATOM 1553 OE2 GLU A 102 12.512 3.617 2.402 1.00 0.00 O ATOM 0 H GLU A 102 9.896 1.928 -1.284 1.00 0.00 H new ATOM 0 HA GLU A 102 10.581 1.157 1.395 1.00 0.00 H new ATOM 0 HB2 GLU A 102 8.746 3.168 0.085 1.00 0.00 H new ATOM 0 HB3 GLU A 102 8.620 2.863 1.806 1.00 0.00 H new ATOM 0 HG2 GLU A 102 11.101 3.811 0.332 1.00 0.00 H new ATOM 0 HG3 GLU A 102 10.069 4.789 1.356 1.00 0.00 H new ATOM 1560 N PHE A 103 7.778 0.124 0.068 1.00 0.00 N ATOM 1561 CA PHE A 103 6.645 -0.773 0.256 1.00 0.00 C ATOM 1562 C PHE A 103 7.104 -2.226 0.316 1.00 0.00 C ATOM 1563 O PHE A 103 6.719 -2.973 1.217 1.00 0.00 O ATOM 1564 CB PHE A 103 5.632 -0.594 -0.877 1.00 0.00 C ATOM 1565 CG PHE A 103 4.391 -1.424 -0.710 1.00 0.00 C ATOM 1566 CD1 PHE A 103 3.400 -1.042 0.181 1.00 0.00 C ATOM 1567 CD2 PHE A 103 4.216 -2.587 -1.443 1.00 0.00 C ATOM 1568 CE1 PHE A 103 2.258 -1.803 0.336 1.00 0.00 C ATOM 1569 CE2 PHE A 103 3.075 -3.353 -1.292 1.00 0.00 C ATOM 1570 CZ PHE A 103 2.095 -2.961 -0.402 1.00 0.00 C ATOM 0 H PHE A 103 7.877 0.485 -0.881 1.00 0.00 H new ATOM 0 HA PHE A 103 6.169 -0.521 1.204 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.351 0.457 -0.939 1.00 0.00 H new ATOM 0 HB3 PHE A 103 6.108 -0.853 -1.823 1.00 0.00 H new ATOM 0 HD1 PHE A 103 3.522 -0.139 0.761 1.00 0.00 H new ATOM 0 HD2 PHE A 103 4.980 -2.899 -2.140 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.493 -1.494 1.033 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.950 -4.257 -1.870 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.203 -3.558 -0.282 1.00 0.00 H new ATOM 1580 N LEU A 104 7.928 -2.621 -0.649 1.00 0.00 N ATOM 1581 CA LEU A 104 8.439 -3.986 -0.707 1.00 0.00 C ATOM 1582 C LEU A 104 9.270 -4.310 0.531 1.00 0.00 C ATOM 1583 O LEU A 104 9.193 -5.415 1.070 1.00 0.00 O ATOM 1584 CB LEU A 104 9.282 -4.183 -1.969 1.00 0.00 C ATOM 1585 CG LEU A 104 8.527 -3.999 -3.286 1.00 0.00 C ATOM 1586 CD1 LEU A 104 9.500 -3.908 -4.451 1.00 0.00 C ATOM 1587 CD2 LEU A 104 7.542 -5.137 -3.498 1.00 0.00 C ATOM 0 H LEU A 104 8.256 -2.016 -1.401 1.00 0.00 H new ATOM 0 HA LEU A 104 7.587 -4.666 -0.737 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.115 -3.481 -1.944 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.709 -5.186 -1.950 1.00 0.00 H new ATOM 0 HG LEU A 104 7.967 -3.065 -3.235 1.00 0.00 H new ATOM 0 HD11 LEU A 104 8.944 -3.777 -5.380 1.00 0.00 H new ATOM 0 HD12 LEU A 104 10.166 -3.058 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.088 -4.824 -4.506 1.00 0.00 H new ATOM 0 HD21 LEU A 104 7.013 -4.990 -4.440 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.081 -6.084 -3.528 1.00 0.00 H new ATOM 0 HD23 LEU A 104 6.824 -5.154 -2.678 1.00 0.00 H new ATOM 1599 N ARG A 105 10.064 -3.342 0.976 1.00 0.00 N ATOM 1600 CA ARG A 105 10.908 -3.526 2.151 1.00 0.00 C ATOM 1601 C ARG A 105 10.068 -3.838 3.384 1.00 0.00 C ATOM 1602 O ARG A 105 10.466 -4.633 4.235 1.00 0.00 O ATOM 1603 CB ARG A 105 11.755 -2.275 2.397 1.00 0.00 C ATOM 1604 CG ARG A 105 13.107 -2.308 1.704 1.00 0.00 C ATOM 1605 CD ARG A 105 14.095 -1.363 2.368 1.00 0.00 C ATOM 1606 NE ARG A 105 14.222 -1.624 3.800 1.00 0.00 N ATOM 1607 CZ ARG A 105 14.883 -2.661 4.309 1.00 0.00 C ATOM 1608 NH1 ARG A 105 15.473 -3.540 3.508 1.00 0.00 N ATOM 1609 NH2 ARG A 105 14.952 -2.822 5.623 1.00 0.00 N ATOM 0 H ARG A 105 10.141 -2.423 0.541 1.00 0.00 H new ATOM 0 HA ARG A 105 11.569 -4.372 1.963 1.00 0.00 H new ATOM 0 HB2 ARG A 105 11.203 -1.400 2.055 1.00 0.00 H new ATOM 0 HB3 ARG A 105 11.909 -2.156 3.470 1.00 0.00 H new ATOM 0 HG2 ARG A 105 13.503 -3.323 1.724 1.00 0.00 H new ATOM 0 HG3 ARG A 105 12.987 -2.033 0.656 1.00 0.00 H new ATOM 0 HD2 ARG A 105 15.071 -1.465 1.893 1.00 0.00 H new ATOM 0 HD3 ARG A 105 13.772 -0.333 2.214 1.00 0.00 H new ATOM 0 HE ARG A 105 13.778 -0.973 4.448 1.00 0.00 H new ATOM 0 HH11 ARG A 105 15.421 -3.423 2.496 1.00 0.00 H new ATOM 0 HH12 ARG A 105 15.978 -4.333 3.904 1.00 0.00 H new ATOM 0 HH21 ARG A 105 14.499 -2.151 6.243 1.00 0.00 H new ATOM 0 HH22 ARG A 105 15.458 -3.617 6.014 1.00 0.00 H new ATOM 1623 N MET A 106 8.901 -3.206 3.474 1.00 0.00 N ATOM 1624 CA MET A 106 8.003 -3.415 4.605 1.00 0.00 C ATOM 1625 C MET A 106 7.186 -4.691 4.424 1.00 0.00 C ATOM 1626 O MET A 106 6.798 -5.334 5.399 1.00 0.00 O ATOM 1627 CB MET A 106 7.068 -2.217 4.767 1.00 0.00 C ATOM 1628 CG MET A 106 6.559 -2.032 6.188 1.00 0.00 C ATOM 1629 SD MET A 106 7.413 -0.708 7.065 1.00 0.00 S ATOM 1630 CE MET A 106 7.166 0.659 5.935 1.00 0.00 C ATOM 0 H MET A 106 8.556 -2.545 2.778 1.00 0.00 H new ATOM 0 HA MET A 106 8.610 -3.519 5.504 1.00 0.00 H new ATOM 0 HB2 MET A 106 7.592 -1.313 4.457 1.00 0.00 H new ATOM 0 HB3 MET A 106 6.216 -2.338 4.097 1.00 0.00 H new ATOM 0 HG2 MET A 106 5.491 -1.815 6.162 1.00 0.00 H new ATOM 0 HG3 MET A 106 6.682 -2.965 6.738 1.00 0.00 H new ATOM 0 HE1 MET A 106 8.115 0.920 5.467 1.00 0.00 H new ATOM 0 HE2 MET A 106 6.449 0.370 5.166 1.00 0.00 H new ATOM 0 HE3 MET A 106 6.783 1.520 6.483 1.00 0.00 H new ATOM 1640 N THR A 107 6.926 -5.050 3.171 1.00 0.00 N ATOM 1641 CA THR A 107 6.153 -6.249 2.866 1.00 0.00 C ATOM 1642 C THR A 107 7.067 -7.440 2.589 1.00 0.00 C ATOM 1643 O THR A 107 6.663 -8.404 1.939 1.00 0.00 O ATOM 1644 CB THR A 107 5.244 -5.997 1.662 1.00 0.00 C ATOM 1645 OG1 THR A 107 6.001 -5.570 0.543 1.00 0.00 O ATOM 1646 CG2 THR A 107 4.180 -4.953 1.924 1.00 0.00 C ATOM 0 H THR A 107 7.238 -4.529 2.352 1.00 0.00 H new ATOM 0 HA THR A 107 5.541 -6.486 3.736 1.00 0.00 H new ATOM 0 HB THR A 107 4.753 -6.950 1.465 1.00 0.00 H new ATOM 0 HG1 THR A 107 6.277 -4.638 0.671 1.00 0.00 H new ATOM 0 HG21 THR A 107 3.570 -4.823 1.030 1.00 0.00 H new ATOM 0 HG22 THR A 107 3.548 -5.277 2.750 1.00 0.00 H new ATOM 0 HG23 THR A 107 4.655 -4.006 2.181 1.00 0.00 H new ATOM 1654 N HIS A 108 8.298 -7.371 3.089 1.00 0.00 N ATOM 1655 CA HIS A 108 9.265 -8.447 2.895 1.00 0.00 C ATOM 1656 C HIS A 108 9.433 -8.778 1.415 1.00 0.00 C ATOM 1657 O HIS A 108 8.991 -9.829 0.949 1.00 0.00 O ATOM 1658 CB HIS A 108 8.829 -9.695 3.665 1.00 0.00 C ATOM 1659 CG HIS A 108 9.233 -9.681 5.107 1.00 0.00 C ATOM 1660 ND1 HIS A 108 9.135 -8.562 5.906 1.00 0.00 N ATOM 1661 CD2 HIS A 108 9.739 -10.660 5.895 1.00 0.00 C ATOM 1662 CE1 HIS A 108 9.565 -8.850 7.121 1.00 0.00 C ATOM 1663 NE2 HIS A 108 9.936 -10.117 7.141 1.00 0.00 N ATOM 0 H HIS A 108 8.649 -6.582 3.631 1.00 0.00 H new ATOM 0 HA HIS A 108 10.227 -8.107 3.278 1.00 0.00 H new ATOM 0 HB2 HIS A 108 7.745 -9.791 3.601 1.00 0.00 H new ATOM 0 HB3 HIS A 108 9.256 -10.576 3.185 1.00 0.00 H new ATOM 0 HD2 HIS A 108 9.948 -11.677 5.599 1.00 0.00 H new ATOM 0 HE1 HIS A 108 9.606 -8.166 7.956 1.00 0.00 H new ATOM 0 HE2 HIS A 108 10.309 -10.612 7.951 1.00 0.00 H new ATOM 1672 N ASN A 109 10.077 -7.877 0.681 1.00 0.00 N ATOM 1673 CA ASN A 109 10.306 -8.074 -0.746 1.00 0.00 C ATOM 1674 C ASN A 109 8.988 -8.257 -1.492 1.00 0.00 C ATOM 1675 O ASN A 109 8.920 -8.982 -2.483 1.00 0.00 O ATOM 1676 CB ASN A 109 11.206 -9.289 -0.975 1.00 0.00 C ATOM 1677 CG ASN A 109 12.131 -9.109 -2.162 1.00 0.00 C ATOM 1678 OD1 ASN A 109 13.126 -8.388 -2.087 1.00 0.00 O ATOM 1679 ND2 ASN A 109 11.806 -9.766 -3.270 1.00 0.00 N ATOM 0 H ASN A 109 10.450 -7.003 1.051 1.00 0.00 H new ATOM 0 HA ASN A 109 10.800 -7.183 -1.134 1.00 0.00 H new ATOM 0 HB2 ASN A 109 11.800 -9.471 -0.080 1.00 0.00 H new ATOM 0 HB3 ASN A 109 10.586 -10.172 -1.132 1.00 0.00 H new ATOM 0 HD21 ASN A 109 12.390 -9.683 -4.102 1.00 0.00 H new ATOM 0 HD22 ASN A 109 10.972 -10.353 -3.289 1.00 0.00 H new ATOM 1686 N GLY A 110 7.941 -7.596 -1.007 1.00 0.00 N ATOM 1687 CA GLY A 110 6.641 -7.700 -1.641 1.00 0.00 C ATOM 1688 C GLY A 110 6.127 -9.126 -1.680 1.00 0.00 C ATOM 1689 O GLY A 110 6.038 -9.731 -2.748 1.00 0.00 O ATOM 0 H GLY A 110 7.971 -6.991 -0.187 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.928 -7.074 -1.105 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.704 -7.312 -2.658 1.00 0.00 H new ATOM 1693 N THR A 111 5.790 -9.664 -0.513 1.00 0.00 N ATOM 1694 CA THR A 111 5.284 -11.027 -0.420 1.00 0.00 C ATOM 1695 C THR A 111 4.067 -11.098 0.497 1.00 0.00 C ATOM 1696 O THR A 111 3.062 -11.726 0.162 1.00 0.00 O ATOM 1697 CB THR A 111 6.378 -11.965 0.094 1.00 0.00 C ATOM 1698 OG1 THR A 111 6.878 -11.516 1.341 1.00 0.00 O ATOM 1699 CG2 THR A 111 7.551 -12.093 -0.853 1.00 0.00 C ATOM 0 H THR A 111 5.858 -9.177 0.381 1.00 0.00 H new ATOM 0 HA THR A 111 4.981 -11.343 -1.419 1.00 0.00 H new ATOM 0 HB THR A 111 5.901 -12.941 0.188 1.00 0.00 H new ATOM 0 HG1 THR A 111 7.572 -10.840 1.191 1.00 0.00 H new ATOM 0 HG21 THR A 111 8.290 -12.772 -0.428 1.00 0.00 H new ATOM 0 HG22 THR A 111 7.205 -12.486 -1.809 1.00 0.00 H new ATOM 0 HG23 THR A 111 8.004 -11.113 -1.005 1.00 0.00 H new ATOM 1707 N GLN A 112 4.163 -10.451 1.654 1.00 0.00 N ATOM 1708 CA GLN A 112 3.069 -10.446 2.616 1.00 0.00 C ATOM 1709 C GLN A 112 2.916 -9.074 3.267 1.00 0.00 C ATOM 1710 O GLN A 112 3.715 -8.688 4.120 1.00 0.00 O ATOM 1711 CB GLN A 112 3.303 -11.508 3.692 1.00 0.00 C ATOM 1712 CG GLN A 112 2.121 -11.698 4.628 1.00 0.00 C ATOM 1713 CD GLN A 112 2.336 -12.824 5.620 1.00 0.00 C ATOM 1714 OE1 GLN A 112 2.537 -13.976 5.235 1.00 0.00 O ATOM 1715 NE2 GLN A 112 2.297 -12.496 6.906 1.00 0.00 N ATOM 0 H GLN A 112 4.986 -9.925 1.947 1.00 0.00 H new ATOM 0 HA GLN A 112 2.149 -10.676 2.079 1.00 0.00 H new ATOM 0 HB2 GLN A 112 3.529 -12.459 3.209 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.179 -11.232 4.279 1.00 0.00 H new ATOM 0 HG2 GLN A 112 1.940 -10.770 5.171 1.00 0.00 H new ATOM 0 HG3 GLN A 112 1.226 -11.903 4.040 1.00 0.00 H new ATOM 0 HE21 GLN A 112 2.127 -11.528 7.181 1.00 0.00 H new ATOM 0 HE22 GLN A 112 2.437 -13.212 7.619 1.00 0.00 H new ATOM 1724 N LEU A 113 1.881 -8.345 2.862 1.00 0.00 N ATOM 1725 CA LEU A 113 1.618 -7.019 3.408 1.00 0.00 C ATOM 1726 C LEU A 113 0.948 -7.127 4.774 1.00 0.00 C ATOM 1727 O LEU A 113 -0.265 -7.311 4.869 1.00 0.00 O ATOM 1728 CB LEU A 113 0.736 -6.214 2.446 1.00 0.00 C ATOM 1729 CG LEU A 113 0.298 -4.828 2.940 1.00 0.00 C ATOM 1730 CD1 LEU A 113 -0.956 -4.934 3.794 1.00 0.00 C ATOM 1731 CD2 LEU A 113 1.416 -4.144 3.715 1.00 0.00 C ATOM 0 H LEU A 113 1.210 -8.651 2.157 1.00 0.00 H new ATOM 0 HA LEU A 113 2.569 -6.500 3.529 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.275 -6.090 1.507 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -0.157 -6.799 2.226 1.00 0.00 H new ATOM 0 HG LEU A 113 0.070 -4.217 2.066 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.250 -3.941 4.134 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.763 -5.369 3.204 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.756 -5.569 4.657 1.00 0.00 H new ATOM 0 HD21 LEU A 113 1.078 -3.164 4.053 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.685 -4.753 4.578 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.286 -4.025 3.069 1.00 0.00 H new ATOM 1743 N LEU A 114 1.752 -7.018 5.829 1.00 0.00 N ATOM 1744 CA LEU A 114 1.245 -7.108 7.195 1.00 0.00 C ATOM 1745 C LEU A 114 0.616 -8.475 7.454 1.00 0.00 C ATOM 1746 O LEU A 114 1.240 -9.353 8.050 1.00 0.00 O ATOM 1747 CB LEU A 114 0.224 -5.999 7.458 1.00 0.00 C ATOM 1748 CG LEU A 114 0.816 -4.594 7.589 1.00 0.00 C ATOM 1749 CD1 LEU A 114 -0.288 -3.561 7.763 1.00 0.00 C ATOM 1750 CD2 LEU A 114 1.796 -4.537 8.751 1.00 0.00 C ATOM 0 H LEU A 114 2.759 -6.867 5.763 1.00 0.00 H new ATOM 0 HA LEU A 114 2.086 -6.983 7.878 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -0.504 -5.996 6.647 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -0.319 -6.235 8.373 1.00 0.00 H new ATOM 0 HG LEU A 114 1.357 -4.360 6.672 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.153 -2.569 7.854 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.949 -3.586 6.897 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.860 -3.788 8.663 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.208 -3.531 8.830 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.279 -4.791 9.676 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.605 -5.248 8.580 1.00 0.00 H new ATOM 1762 N ASN A 115 -0.623 -8.649 7.001 1.00 0.00 N ATOM 1763 CA ASN A 115 -1.333 -9.909 7.184 1.00 0.00 C ATOM 1764 C ASN A 115 -2.063 -10.310 5.905 1.00 0.00 C ATOM 1765 O ASN A 115 -3.158 -10.870 5.953 1.00 0.00 O ATOM 1766 CB ASN A 115 -2.329 -9.794 8.341 1.00 0.00 C ATOM 1767 CG ASN A 115 -2.343 -11.033 9.215 1.00 0.00 C ATOM 1768 OD1 ASN A 115 -2.469 -12.154 8.722 1.00 0.00 O ATOM 1769 ND2 ASN A 115 -2.214 -10.836 10.522 1.00 0.00 N ATOM 0 H ASN A 115 -1.154 -7.933 6.505 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.601 -10.681 7.421 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.076 -8.926 8.950 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.329 -9.623 7.941 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -2.217 -11.632 11.160 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -2.112 -9.889 10.887 1.00 0.00 H new ATOM 1776 N PHE A 116 -1.448 -10.019 4.764 1.00 0.00 N ATOM 1777 CA PHE A 116 -2.039 -10.346 3.472 1.00 0.00 C ATOM 1778 C PHE A 116 -0.966 -10.762 2.470 1.00 0.00 C ATOM 1779 O PHE A 116 -0.196 -9.929 1.990 1.00 0.00 O ATOM 1780 CB PHE A 116 -2.825 -9.152 2.928 1.00 0.00 C ATOM 1781 CG PHE A 116 -4.184 -8.994 3.547 1.00 0.00 C ATOM 1782 CD1 PHE A 116 -4.343 -8.297 4.733 1.00 0.00 C ATOM 1783 CD2 PHE A 116 -5.303 -9.542 2.940 1.00 0.00 C ATOM 1784 CE1 PHE A 116 -5.593 -8.149 5.304 1.00 0.00 C ATOM 1785 CE2 PHE A 116 -6.555 -9.398 3.506 1.00 0.00 C ATOM 1786 CZ PHE A 116 -6.701 -8.700 4.689 1.00 0.00 C ATOM 0 H PHE A 116 -0.540 -9.557 4.708 1.00 0.00 H new ATOM 0 HA PHE A 116 -2.720 -11.185 3.616 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.250 -8.242 3.097 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -2.937 -9.262 1.849 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -3.480 -7.864 5.217 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -5.195 -10.088 2.014 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -5.704 -7.603 6.230 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -7.419 -9.831 3.024 1.00 0.00 H new ATOM 0 HZ PHE A 116 -7.679 -8.585 5.132 1.00 0.00 H new ATOM 1796 N THR A 117 -0.922 -12.052 2.157 1.00 0.00 N ATOM 1797 CA THR A 117 0.055 -12.577 1.210 1.00 0.00 C ATOM 1798 C THR A 117 -0.288 -12.155 -0.214 1.00 0.00 C ATOM 1799 O THR A 117 -1.310 -12.567 -0.766 1.00 0.00 O ATOM 1800 CB THR A 117 0.116 -14.102 1.301 1.00 0.00 C ATOM 1801 OG1 THR A 117 -1.057 -14.684 0.763 1.00 0.00 O ATOM 1802 CG2 THR A 117 0.273 -14.611 2.718 1.00 0.00 C ATOM 0 H THR A 117 -1.552 -12.754 2.545 1.00 0.00 H new ATOM 0 HA THR A 117 1.031 -12.165 1.467 1.00 0.00 H new ATOM 0 HB THR A 117 0.998 -14.390 0.729 1.00 0.00 H new ATOM 0 HG1 THR A 117 -1.307 -14.215 -0.060 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.309 -15.700 2.711 1.00 0.00 H new ATOM 0 HG22 THR A 117 1.196 -14.220 3.145 1.00 0.00 H new ATOM 0 HG23 THR A 117 -0.574 -14.280 3.319 1.00 0.00 H new ATOM 1810 N LEU A 118 0.571 -11.331 -0.808 1.00 0.00 N ATOM 1811 CA LEU A 118 0.355 -10.855 -2.170 1.00 0.00 C ATOM 1812 C LEU A 118 1.594 -11.083 -3.030 1.00 0.00 C ATOM 1813 O LEU A 118 2.696 -11.267 -2.513 1.00 0.00 O ATOM 1814 CB LEU A 118 -0.012 -9.369 -2.161 1.00 0.00 C ATOM 1815 CG LEU A 118 1.003 -8.452 -1.476 1.00 0.00 C ATOM 1816 CD1 LEU A 118 2.032 -7.955 -2.479 1.00 0.00 C ATOM 1817 CD2 LEU A 118 0.296 -7.282 -0.808 1.00 0.00 C ATOM 0 H LEU A 118 1.422 -10.980 -0.368 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.470 -11.422 -2.600 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.141 -9.037 -3.191 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.976 -9.252 -1.665 1.00 0.00 H new ATOM 0 HG LEU A 118 1.523 -9.023 -0.707 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.746 -7.304 -1.975 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.559 -8.806 -2.912 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.530 -7.399 -3.270 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.032 -6.639 -0.325 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.249 -6.709 -1.559 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.403 -7.658 -0.061 1.00 0.00 H new ATOM 1829 N ASP A 119 1.403 -11.073 -4.346 1.00 0.00 N ATOM 1830 CA ASP A 119 2.503 -11.280 -5.280 1.00 0.00 C ATOM 1831 C ASP A 119 3.306 -9.998 -5.474 1.00 0.00 C ATOM 1832 O ASP A 119 2.825 -8.903 -5.181 1.00 0.00 O ATOM 1833 CB ASP A 119 1.967 -11.774 -6.627 1.00 0.00 C ATOM 1834 CG ASP A 119 2.423 -13.184 -6.949 1.00 0.00 C ATOM 1835 OD1 ASP A 119 1.801 -14.140 -6.438 1.00 0.00 O ATOM 1836 OD2 ASP A 119 3.400 -13.333 -7.711 1.00 0.00 O ATOM 0 H ASP A 119 0.496 -10.924 -4.789 1.00 0.00 H new ATOM 0 HA ASP A 119 3.166 -12.037 -4.860 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.878 -11.741 -6.615 1.00 0.00 H new ATOM 0 HB3 ASP A 119 2.298 -11.099 -7.416 1.00 0.00 H new ATOM 1841 N ARG A 120 4.531 -10.141 -5.969 1.00 0.00 N ATOM 1842 CA ARG A 120 5.401 -8.995 -6.203 1.00 0.00 C ATOM 1843 C ARG A 120 5.336 -8.551 -7.661 1.00 0.00 C ATOM 1844 O ARG A 120 5.280 -7.357 -7.955 1.00 0.00 O ATOM 1845 CB ARG A 120 6.844 -9.337 -5.829 1.00 0.00 C ATOM 1846 CG ARG A 120 7.777 -8.136 -5.843 1.00 0.00 C ATOM 1847 CD ARG A 120 9.087 -8.454 -6.543 1.00 0.00 C ATOM 1848 NE ARG A 120 8.919 -8.578 -7.989 1.00 0.00 N ATOM 1849 CZ ARG A 120 9.922 -8.501 -8.862 1.00 0.00 C ATOM 1850 NH1 ARG A 120 11.164 -8.302 -8.439 1.00 0.00 N ATOM 1851 NH2 ARG A 120 9.682 -8.623 -10.160 1.00 0.00 N ATOM 0 H ARG A 120 4.944 -11.040 -6.216 1.00 0.00 H new ATOM 0 HA ARG A 120 5.054 -8.175 -5.575 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.857 -9.785 -4.835 1.00 0.00 H new ATOM 0 HB3 ARG A 120 7.222 -10.088 -6.522 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.289 -7.301 -6.345 1.00 0.00 H new ATOM 0 HG3 ARG A 120 7.978 -7.819 -4.820 1.00 0.00 H new ATOM 0 HD2 ARG A 120 9.813 -7.669 -6.328 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.495 -9.383 -6.144 1.00 0.00 H new ATOM 0 HE ARG A 120 7.978 -8.733 -8.351 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.354 -8.207 -7.441 1.00 0.00 H new ATOM 0 HH12 ARG A 120 11.929 -8.244 -9.112 1.00 0.00 H new ATOM 0 HH21 ARG A 120 8.729 -8.776 -10.490 1.00 0.00 H new ATOM 0 HH22 ARG A 120 10.450 -8.564 -10.828 1.00 0.00 H new ATOM 1865 N LYS A 121 5.344 -9.521 -8.571 1.00 0.00 N ATOM 1866 CA LYS A 121 5.286 -9.231 -10.000 1.00 0.00 C ATOM 1867 C LYS A 121 4.021 -8.453 -10.347 1.00 0.00 C ATOM 1868 O LYS A 121 4.019 -7.626 -11.259 1.00 0.00 O ATOM 1869 CB LYS A 121 5.343 -10.531 -10.807 1.00 0.00 C ATOM 1870 CG LYS A 121 6.563 -10.634 -11.707 1.00 0.00 C ATOM 1871 CD LYS A 121 7.070 -12.065 -11.800 1.00 0.00 C ATOM 1872 CE LYS A 121 8.289 -12.285 -10.918 1.00 0.00 C ATOM 1873 NZ LYS A 121 9.523 -12.513 -11.721 1.00 0.00 N ATOM 0 H LYS A 121 5.390 -10.514 -8.344 1.00 0.00 H new ATOM 0 HA LYS A 121 6.148 -8.615 -10.257 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.337 -11.377 -10.119 1.00 0.00 H new ATOM 0 HB3 LYS A 121 4.443 -10.610 -11.418 1.00 0.00 H new ATOM 0 HG2 LYS A 121 6.313 -10.270 -12.704 1.00 0.00 H new ATOM 0 HG3 LYS A 121 7.355 -9.991 -11.323 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.277 -12.752 -11.504 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.323 -12.296 -12.835 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.431 -11.418 -10.273 1.00 0.00 H new ATOM 0 HE3 LYS A 121 8.116 -13.142 -10.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 10.331 -12.659 -11.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 9.398 -13.355 -12.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 9.703 -11.685 -12.324 1.00 0.00 H new ATOM 1887 N SER A 122 2.946 -8.721 -9.611 1.00 0.00 N ATOM 1888 CA SER A 122 1.675 -8.043 -9.841 1.00 0.00 C ATOM 1889 C SER A 122 1.753 -6.580 -9.417 1.00 0.00 C ATOM 1890 O SER A 122 1.014 -5.736 -9.927 1.00 0.00 O ATOM 1891 CB SER A 122 0.554 -8.747 -9.075 1.00 0.00 C ATOM 1892 OG SER A 122 0.581 -8.406 -7.700 1.00 0.00 O ATOM 0 H SER A 122 2.930 -9.402 -8.852 1.00 0.00 H new ATOM 0 HA SER A 122 1.459 -8.082 -10.909 1.00 0.00 H new ATOM 0 HB2 SER A 122 -0.410 -8.472 -9.502 1.00 0.00 H new ATOM 0 HB3 SER A 122 0.656 -9.826 -9.187 1.00 0.00 H new ATOM 0 HG SER A 122 0.232 -9.153 -7.171 1.00 0.00 H new ATOM 1898 N VAL A 123 2.651 -6.284 -8.482 1.00 0.00 N ATOM 1899 CA VAL A 123 2.824 -4.921 -7.991 1.00 0.00 C ATOM 1900 C VAL A 123 3.159 -3.965 -9.131 1.00 0.00 C ATOM 1901 O VAL A 123 3.733 -4.367 -10.144 1.00 0.00 O ATOM 1902 CB VAL A 123 3.934 -4.845 -6.925 1.00 0.00 C ATOM 1903 CG1 VAL A 123 4.027 -3.441 -6.345 1.00 0.00 C ATOM 1904 CG2 VAL A 123 3.689 -5.866 -5.825 1.00 0.00 C ATOM 0 H VAL A 123 3.270 -6.970 -8.049 1.00 0.00 H new ATOM 0 HA VAL A 123 1.878 -4.624 -7.539 1.00 0.00 H new ATOM 0 HB VAL A 123 4.885 -5.079 -7.403 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.817 -3.409 -5.594 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.255 -2.733 -7.142 1.00 0.00 H new ATOM 0 HG13 VAL A 123 3.076 -3.174 -5.883 1.00 0.00 H new ATOM 0 HG21 VAL A 123 4.483 -5.797 -5.081 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.729 -5.666 -5.350 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.679 -6.868 -6.254 1.00 0.00 H new ATOM 1914 N PHE A 124 2.798 -2.698 -8.960 1.00 0.00 N ATOM 1915 CA PHE A 124 3.061 -1.684 -9.974 1.00 0.00 C ATOM 1916 C PHE A 124 2.778 -0.288 -9.432 1.00 0.00 C ATOM 1917 O PHE A 124 1.640 0.044 -9.101 1.00 0.00 O ATOM 1918 CB PHE A 124 2.207 -1.942 -11.217 1.00 0.00 C ATOM 1919 CG PHE A 124 2.833 -1.446 -12.490 1.00 0.00 C ATOM 1920 CD1 PHE A 124 3.288 -0.141 -12.591 1.00 0.00 C ATOM 1921 CD2 PHE A 124 2.963 -2.285 -13.585 1.00 0.00 C ATOM 1922 CE1 PHE A 124 3.864 0.318 -13.761 1.00 0.00 C ATOM 1923 CE2 PHE A 124 3.538 -1.831 -14.757 1.00 0.00 C ATOM 1924 CZ PHE A 124 3.989 -0.528 -14.845 1.00 0.00 C ATOM 0 H PHE A 124 2.322 -2.349 -8.128 1.00 0.00 H new ATOM 0 HA PHE A 124 4.115 -1.743 -10.246 1.00 0.00 H new ATOM 0 HB2 PHE A 124 2.023 -3.013 -11.305 1.00 0.00 H new ATOM 0 HB3 PHE A 124 1.237 -1.462 -11.088 1.00 0.00 H new ATOM 0 HD1 PHE A 124 3.192 0.525 -11.746 1.00 0.00 H new ATOM 0 HD2 PHE A 124 2.611 -3.304 -13.522 1.00 0.00 H new ATOM 0 HE1 PHE A 124 4.216 1.337 -13.827 1.00 0.00 H new ATOM 0 HE2 PHE A 124 3.635 -2.494 -15.604 1.00 0.00 H new ATOM 0 HZ PHE A 124 4.439 -0.172 -15.760 1.00 0.00 H new ATOM 1934 N VAL A 125 3.822 0.530 -9.345 1.00 0.00 N ATOM 1935 CA VAL A 125 3.688 1.891 -8.846 1.00 0.00 C ATOM 1936 C VAL A 125 4.129 2.906 -9.899 1.00 0.00 C ATOM 1937 O VAL A 125 5.245 3.423 -9.852 1.00 0.00 O ATOM 1938 CB VAL A 125 4.509 2.098 -7.556 1.00 0.00 C ATOM 1939 CG1 VAL A 125 5.987 1.829 -7.807 1.00 0.00 C ATOM 1940 CG2 VAL A 125 4.296 3.500 -6.999 1.00 0.00 C ATOM 0 H VAL A 125 4.771 0.272 -9.615 1.00 0.00 H new ATOM 0 HA VAL A 125 2.633 2.048 -8.619 1.00 0.00 H new ATOM 0 HB VAL A 125 4.159 1.383 -6.811 1.00 0.00 H new ATOM 0 HG11 VAL A 125 6.546 1.981 -6.884 1.00 0.00 H new ATOM 0 HG12 VAL A 125 6.117 0.801 -8.145 1.00 0.00 H new ATOM 0 HG13 VAL A 125 6.356 2.512 -8.572 1.00 0.00 H new ATOM 0 HG21 VAL A 125 4.884 3.624 -6.090 1.00 0.00 H new ATOM 0 HG22 VAL A 125 4.611 4.237 -7.738 1.00 0.00 H new ATOM 0 HG23 VAL A 125 3.240 3.644 -6.770 1.00 0.00 H new ATOM 1950 N ASP A 126 3.245 3.182 -10.851 1.00 0.00 N ATOM 1951 CA ASP A 126 3.541 4.131 -11.917 1.00 0.00 C ATOM 1952 C ASP A 126 2.963 5.507 -11.603 1.00 0.00 C ATOM 1953 O ASP A 126 1.917 5.620 -10.964 1.00 0.00 O ATOM 1954 CB ASP A 126 2.983 3.621 -13.249 1.00 0.00 C ATOM 1955 CG ASP A 126 3.941 3.843 -14.405 1.00 0.00 C ATOM 1956 OD1 ASP A 126 5.104 4.218 -14.152 1.00 0.00 O ATOM 1957 OD2 ASP A 126 3.526 3.638 -15.565 1.00 0.00 O ATOM 0 H ASP A 126 2.317 2.762 -10.906 1.00 0.00 H new ATOM 0 HA ASP A 126 4.624 4.225 -11.994 1.00 0.00 H new ATOM 0 HB2 ASP A 126 2.763 2.557 -13.163 1.00 0.00 H new ATOM 0 HB3 ASP A 126 2.040 4.125 -13.461 1.00 0.00 H new ATOM 1962 N SER A 127 3.650 6.550 -12.055 1.00 0.00 N ATOM 1963 CA SER A 127 3.204 7.919 -11.822 1.00 0.00 C ATOM 1964 C SER A 127 1.962 8.234 -12.650 1.00 0.00 C ATOM 1965 O SER A 127 2.059 8.564 -13.832 1.00 0.00 O ATOM 1966 CB SER A 127 4.322 8.906 -12.163 1.00 0.00 C ATOM 1967 OG SER A 127 3.861 10.245 -12.093 1.00 0.00 O ATOM 0 H SER A 127 4.518 6.474 -12.585 1.00 0.00 H new ATOM 0 HA SER A 127 2.950 8.018 -10.767 1.00 0.00 H new ATOM 0 HB2 SER A 127 5.155 8.769 -11.474 1.00 0.00 H new ATOM 0 HB3 SER A 127 4.700 8.700 -13.165 1.00 0.00 H new ATOM 0 HG SER A 127 4.595 10.856 -12.314 1.00 0.00 H new ATOM 1973 N GLY A 128 0.795 8.129 -12.022 1.00 0.00 N ATOM 1974 CA GLY A 128 -0.450 8.405 -12.714 1.00 0.00 C ATOM 1975 C GLY A 128 -0.613 7.567 -13.972 1.00 0.00 C ATOM 1976 O GLY A 128 -0.418 6.353 -13.935 1.00 0.00 O ATOM 0 H GLY A 128 0.690 7.857 -11.045 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -1.286 8.213 -12.042 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -0.489 9.462 -12.977 1.00 0.00 H new ATOM 1980 N PRO A 129 -0.970 8.189 -15.110 1.00 0.00 N ATOM 1981 CA PRO A 129 -1.150 7.468 -16.375 1.00 0.00 C ATOM 1982 C PRO A 129 0.164 6.909 -16.912 1.00 0.00 C ATOM 1983 O PRO A 129 0.247 5.736 -17.277 1.00 0.00 O ATOM 1984 CB PRO A 129 -1.703 8.535 -17.324 1.00 0.00 C ATOM 1985 CG PRO A 129 -1.250 9.832 -16.747 1.00 0.00 C ATOM 1986 CD PRO A 129 -1.223 9.634 -15.257 1.00 0.00 C ATOM 0 HA PRO A 129 -1.805 6.604 -16.260 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -1.323 8.399 -18.336 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -2.790 8.487 -17.382 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.263 10.103 -17.123 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -1.929 10.640 -17.021 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -0.440 10.229 -14.787 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -2.166 9.926 -14.795 1.00 0.00 H new ATOM 1994 N SER A 130 1.187 7.755 -16.955 1.00 0.00 N ATOM 1995 CA SER A 130 2.500 7.347 -17.444 1.00 0.00 C ATOM 1996 C SER A 130 2.408 6.807 -18.868 1.00 0.00 C ATOM 1997 O SER A 130 3.122 5.875 -19.237 1.00 0.00 O ATOM 1998 CB SER A 130 3.103 6.285 -16.522 1.00 0.00 C ATOM 1999 OG SER A 130 4.508 6.437 -16.420 1.00 0.00 O ATOM 0 H SER A 130 1.133 8.729 -16.657 1.00 0.00 H new ATOM 0 HA SER A 130 3.146 8.225 -17.449 1.00 0.00 H new ATOM 0 HB2 SER A 130 2.653 6.360 -15.532 1.00 0.00 H new ATOM 0 HB3 SER A 130 2.868 5.291 -16.904 1.00 0.00 H new ATOM 0 HG SER A 130 4.913 6.340 -17.307 1.00 0.00 H new ATOM 2005 N SER A 131 1.525 7.401 -19.665 1.00 0.00 N ATOM 2006 CA SER A 131 1.341 6.980 -21.049 1.00 0.00 C ATOM 2007 C SER A 131 2.425 7.570 -21.946 1.00 0.00 C ATOM 2008 O SER A 131 2.189 8.541 -22.666 1.00 0.00 O ATOM 2009 CB SER A 131 -0.040 7.402 -21.553 1.00 0.00 C ATOM 2010 OG SER A 131 -0.109 8.805 -21.741 1.00 0.00 O ATOM 0 H SER A 131 0.926 8.175 -19.376 1.00 0.00 H new ATOM 0 HA SER A 131 1.417 5.893 -21.085 1.00 0.00 H new ATOM 0 HB2 SER A 131 -0.258 6.895 -22.493 1.00 0.00 H new ATOM 0 HB3 SER A 131 -0.802 7.090 -20.839 1.00 0.00 H new ATOM 0 HG SER A 131 0.636 9.096 -22.308 1.00 0.00 H new ATOM 2016 N GLY A 132 3.613 6.978 -21.895 1.00 0.00 N ATOM 2017 CA GLY A 132 4.716 7.458 -22.707 1.00 0.00 C ATOM 2018 C GLY A 132 5.715 6.366 -23.032 1.00 0.00 C ATOM 0 H GLY A 132 3.832 6.175 -21.306 1.00 0.00 H new ATOM 0 HA2 GLY A 132 4.325 7.876 -23.635 1.00 0.00 H new ATOM 0 HA3 GLY A 132 5.224 8.267 -22.182 1.00 0.00 H new TER 2022 GLY A 132