USER MOD reduce.3.24.130724 H: found=0, std=0, add=1108, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1108 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 53 ASN : amide:sc= -0.17 K(o=0.9,f=-2.4) USER MOD Set 1.2: A 103 TYR OH : rot 141:sc= 1.07 USER MOD Set 2.1: A 30 SER OG : rot 98:sc= -1.55 USER MOD Set 2.2: A 100 MET CE :methyl -138:sc= -1.03 (180deg=-2.3) USER MOD Set 2.3: A 105 ASN : amide:sc= -2.25! X(o=-4.8!,f=-5.2) USER MOD Set 3.1: A 36 GLN : amide:sc= 0.0615 K(o=2.1,f=-4!) USER MOD Set 3.2: A 43 LYS NZ :NH3+ -155:sc= 2.04 (180deg=0.589) USER MOD Set 4.1: A 23 MET CE :methyl 164:sc= -0.0759 (180deg=-0.515) USER MOD Set 4.2: A 76 LYS NZ :NH3+ 146:sc= 1.25 (180deg=0.121) USER MOD Set 4.3: A 126 THR OG1 : rot 172:sc= 0.315 USER MOD Set 5.1: A 10 HIS : no HD1:sc= 0.171 K(o=1.2,f=-7.1!) USER MOD Set 5.2: A 12 SER OG : rot 99:sc= 1.06 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 145:sc= 0.325 (180deg=-0.164!) USER MOD Single : A 3 SER OG : rot 26:sc= 0.13 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc=-0.00164 X(o=-0.0016,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.00024) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0198 USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0538 USER MOD Single : A 48 TYR OH : rot 15:sc= -1.38 USER MOD Single : A 50 ASN : amide:sc= -0.0772 K(o=-0.077,f=-0.81) USER MOD Single : A 54 TYR OH : rot -129:sc= 0.0952 USER MOD Single : A 58 ASN : amide:sc= -2.64 K(o=-2.6,f=-12!) USER MOD Single : A 63 ASN : amide:sc= 0.98 K(o=0.98,f=-0.029) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 74 LYS NZ :NH3+ -173:sc= 0.917 (180deg=0.883) USER MOD Single : A 77 THR OG1 : rot -175:sc= 1.33 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 153:sc= 0.924 (180deg=0.0936) USER MOD Single : A 93 LYS NZ :NH3+ -159:sc= 1.17 (180deg=0.567) USER MOD Single : A 95 MET CE :methyl -106:sc= -0.967 (180deg=-4.76!) USER MOD Single : A 106 MET CE :methyl -136:sc= -1.44! (180deg=-2.62) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 53:sc= 1.1 USER MOD Single : A 115 THR OG1 : rot -0:sc= 0.581 USER MOD Single : A 117 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 121 LYS NZ :NH3+ -172:sc= 1.12 (180deg=1.07) USER MOD Single : A 124 LYS NZ :NH3+ -117:sc= 1.27 (180deg=0.323) USER MOD Single : A 129 LYS NZ :NH3+ -161:sc= -4.96! (180deg=-6.07!) USER MOD Single : A 130 THR OG1 : rot 120:sc= 0.0217 USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.886 54.414 34.901 1.00 13.31 N ATOM 2 CA MET A 1 0.879 53.366 35.244 1.00 1.13 C ATOM 3 C MET A 1 0.955 52.176 34.271 1.00 64.33 C ATOM 4 O MET A 1 0.729 52.330 33.068 1.00 71.25 O ATOM 5 CB MET A 1 -0.539 53.958 35.226 1.00 71.13 C ATOM 6 CG MET A 1 -0.740 55.111 36.201 1.00 23.12 C ATOM 7 SD MET A 1 0.330 56.519 35.838 1.00 51.42 S ATOM 8 CE MET A 1 -0.171 57.673 37.115 1.00 65.53 C ATOM 0 H1 MET A 1 1.491 55.355 35.103 1.00 13.31 H new ATOM 0 H2 MET A 1 2.745 54.270 35.470 1.00 13.31 H new ATOM 0 H3 MET A 1 2.125 54.348 33.891 1.00 13.31 H new ATOM 0 HA MET A 1 1.108 53.006 36.247 1.00 1.13 H new ATOM 0 HB2 MET A 1 -0.764 54.305 34.217 1.00 71.13 H new ATOM 0 HB3 MET A 1 -1.254 53.169 35.459 1.00 71.13 H new ATOM 0 HG2 MET A 1 -1.781 55.432 36.169 1.00 23.12 H new ATOM 0 HG3 MET A 1 -0.545 54.763 37.215 1.00 23.12 H new ATOM 0 HE1 MET A 1 0.405 58.594 37.020 1.00 65.53 H new ATOM 0 HE2 MET A 1 -1.233 57.896 37.008 1.00 65.53 H new ATOM 0 HE3 MET A 1 0.010 57.232 38.095 1.00 65.53 H new ATOM 20 N GLY A 2 1.280 50.991 34.792 1.00 42.53 N ATOM 21 CA GLY A 2 1.340 49.789 33.959 1.00 54.41 C ATOM 22 C GLY A 2 2.254 48.709 34.537 1.00 2.34 C ATOM 23 O GLY A 2 3.393 48.545 34.098 1.00 15.23 O ATOM 0 H GLY A 2 1.503 50.839 35.776 1.00 42.53 H new ATOM 0 HA2 GLY A 2 0.335 49.383 33.843 1.00 54.41 H new ATOM 0 HA3 GLY A 2 1.691 50.060 32.963 1.00 54.41 H new ATOM 27 N SER A 3 1.754 47.970 35.524 1.00 15.52 N ATOM 28 CA SER A 3 2.540 46.917 36.184 1.00 73.54 C ATOM 29 C SER A 3 2.638 45.649 35.320 1.00 62.24 C ATOM 30 O SER A 3 1.626 45.097 34.881 1.00 12.34 O ATOM 31 CB SER A 3 1.929 46.571 37.547 1.00 63.31 C ATOM 32 OG SER A 3 0.600 46.093 37.422 1.00 30.14 O ATOM 0 H SER A 3 0.807 48.077 35.889 1.00 15.52 H new ATOM 0 HA SER A 3 3.549 47.305 36.325 1.00 73.54 H new ATOM 0 HB2 SER A 3 2.542 45.816 38.039 1.00 63.31 H new ATOM 0 HB3 SER A 3 1.939 47.455 38.185 1.00 63.31 H new ATOM 0 HG SER A 3 0.478 45.693 36.536 1.00 30.14 H new ATOM 38 N SER A 4 3.864 45.190 35.077 1.00 12.12 N ATOM 39 CA SER A 4 4.101 43.991 34.256 1.00 20.23 C ATOM 40 C SER A 4 3.969 42.700 35.082 1.00 32.04 C ATOM 41 O SER A 4 4.213 42.692 36.293 1.00 31.21 O ATOM 42 CB SER A 4 5.493 44.050 33.607 1.00 61.32 C ATOM 43 OG SER A 4 5.598 45.149 32.710 1.00 12.41 O ATOM 0 H SER A 4 4.714 45.627 35.435 1.00 12.12 H new ATOM 0 HA SER A 4 3.338 43.975 33.478 1.00 20.23 H new ATOM 0 HB2 SER A 4 6.255 44.136 34.382 1.00 61.32 H new ATOM 0 HB3 SER A 4 5.687 43.121 33.071 1.00 61.32 H new ATOM 0 HG SER A 4 6.494 45.163 32.313 1.00 12.41 H new ATOM 49 N HIS A 5 3.581 41.609 34.417 1.00 3.33 N ATOM 50 CA HIS A 5 3.419 40.305 35.076 1.00 65.20 C ATOM 51 C HIS A 5 3.510 39.156 34.057 1.00 13.51 C ATOM 52 O HIS A 5 2.961 39.248 32.960 1.00 73.11 O ATOM 53 CB HIS A 5 2.077 40.248 35.821 1.00 0.34 C ATOM 54 CG HIS A 5 0.881 40.458 34.941 1.00 61.31 C ATOM 55 ND1 HIS A 5 0.134 39.420 34.427 1.00 14.33 N ATOM 56 CD2 HIS A 5 0.299 41.595 34.488 1.00 12.30 C ATOM 57 CE1 HIS A 5 -0.849 39.904 33.696 1.00 4.15 C ATOM 58 NE2 HIS A 5 -0.772 41.217 33.717 1.00 43.04 N ATOM 0 H HIS A 5 3.372 41.600 33.419 1.00 3.33 H new ATOM 0 HA HIS A 5 4.229 40.186 35.796 1.00 65.20 H new ATOM 0 HB2 HIS A 5 1.987 39.280 36.313 1.00 0.34 H new ATOM 0 HB3 HIS A 5 2.076 41.005 36.605 1.00 0.34 H new ATOM 0 HD2 HIS A 5 0.617 42.606 34.694 1.00 12.30 H new ATOM 0 HE1 HIS A 5 -1.591 39.322 33.169 1.00 4.15 H new ATOM 0 HE2 HIS A 5 -1.408 41.854 33.236 1.00 43.04 H new ATOM 67 N HIS A 6 4.194 38.074 34.430 1.00 11.25 N ATOM 68 CA HIS A 6 4.378 36.923 33.530 1.00 55.21 C ATOM 69 C HIS A 6 3.800 35.629 34.126 1.00 21.32 C ATOM 70 O HIS A 6 3.858 35.407 35.337 1.00 70.50 O ATOM 71 CB HIS A 6 5.868 36.742 33.184 1.00 71.23 C ATOM 72 CG HIS A 6 6.789 36.780 34.370 1.00 14.13 C ATOM 73 ND1 HIS A 6 7.687 37.802 34.588 1.00 35.43 N ATOM 74 CD2 HIS A 6 6.958 35.915 35.400 1.00 63.51 C ATOM 75 CE1 HIS A 6 8.363 37.567 35.691 1.00 62.43 C ATOM 76 NE2 HIS A 6 7.942 36.430 36.207 1.00 62.33 N ATOM 0 H HIS A 6 4.631 37.965 35.345 1.00 11.25 H new ATOM 0 HA HIS A 6 3.826 37.133 32.614 1.00 55.21 H new ATOM 0 HB2 HIS A 6 5.996 35.789 32.670 1.00 71.23 H new ATOM 0 HB3 HIS A 6 6.164 37.524 32.484 1.00 71.23 H new ATOM 0 HD2 HIS A 6 6.419 34.992 35.557 1.00 63.51 H new ATOM 0 HE1 HIS A 6 9.134 38.200 36.105 1.00 62.43 H new ATOM 0 HE2 HIS A 6 8.290 36.003 37.065 1.00 62.33 H new ATOM 85 N HIS A 7 3.251 34.776 33.261 1.00 4.20 N ATOM 86 CA HIS A 7 2.636 33.512 33.686 1.00 22.22 C ATOM 87 C HIS A 7 3.690 32.396 33.820 1.00 11.21 C ATOM 88 O HIS A 7 4.739 32.437 33.171 1.00 63.14 O ATOM 89 CB HIS A 7 1.553 33.085 32.683 1.00 34.22 C ATOM 90 CG HIS A 7 0.484 34.116 32.465 1.00 61.54 C ATOM 91 ND1 HIS A 7 -0.763 34.052 33.050 1.00 54.34 N ATOM 92 CD2 HIS A 7 0.474 35.239 31.703 1.00 34.41 C ATOM 93 CE1 HIS A 7 -1.487 35.079 32.661 1.00 13.43 C ATOM 94 NE2 HIS A 7 -0.761 35.814 31.846 1.00 61.30 N ATOM 0 H HIS A 7 3.218 34.937 32.254 1.00 4.20 H new ATOM 0 HA HIS A 7 2.181 33.674 34.663 1.00 22.22 H new ATOM 0 HB2 HIS A 7 2.026 32.859 31.727 1.00 34.22 H new ATOM 0 HB3 HIS A 7 1.089 32.164 33.035 1.00 34.22 H new ATOM 0 HD2 HIS A 7 1.288 35.610 31.097 1.00 34.41 H new ATOM 0 HE1 HIS A 7 -2.504 35.284 32.960 1.00 13.43 H new ATOM 0 HE2 HIS A 7 -1.069 36.675 31.393 1.00 61.30 H new ATOM 103 N HIS A 8 3.402 31.396 34.653 1.00 14.14 N ATOM 104 CA HIS A 8 4.338 30.285 34.890 1.00 51.42 C ATOM 105 C HIS A 8 3.686 28.918 34.617 1.00 4.11 C ATOM 106 O HIS A 8 2.505 28.714 34.898 1.00 63.54 O ATOM 107 CB HIS A 8 4.865 30.339 36.332 1.00 43.22 C ATOM 108 CG HIS A 8 3.791 30.391 37.378 1.00 12.23 C ATOM 109 ND1 HIS A 8 3.351 31.567 37.944 1.00 11.45 N ATOM 110 CD2 HIS A 8 3.066 29.406 37.961 1.00 13.51 C ATOM 111 CE1 HIS A 8 2.408 31.308 38.823 1.00 25.32 C ATOM 112 NE2 HIS A 8 2.215 30.007 38.855 1.00 54.01 N ATOM 0 H HIS A 8 2.530 31.328 35.177 1.00 14.14 H new ATOM 0 HA HIS A 8 5.169 30.399 34.194 1.00 51.42 H new ATOM 0 HB2 HIS A 8 5.489 29.464 36.512 1.00 43.22 H new ATOM 0 HB3 HIS A 8 5.505 31.215 36.440 1.00 43.22 H new ATOM 0 HD2 HIS A 8 3.143 28.348 37.760 1.00 13.51 H new ATOM 0 HE1 HIS A 8 1.881 32.039 39.418 1.00 25.32 H new ATOM 0 HE2 HIS A 8 1.541 29.523 39.449 1.00 54.01 H new ATOM 121 N HIS A 9 4.464 27.985 34.068 1.00 63.41 N ATOM 122 CA HIS A 9 3.979 26.621 33.808 1.00 74.40 C ATOM 123 C HIS A 9 5.139 25.612 33.777 1.00 62.41 C ATOM 124 O HIS A 9 6.270 25.966 33.443 1.00 32.02 O ATOM 125 CB HIS A 9 3.204 26.560 32.480 1.00 34.23 C ATOM 126 CG HIS A 9 4.060 26.710 31.257 1.00 63.53 C ATOM 127 ND1 HIS A 9 4.323 25.668 30.393 1.00 71.50 N ATOM 128 CD2 HIS A 9 4.697 27.788 30.742 1.00 1.32 C ATOM 129 CE1 HIS A 9 5.082 26.095 29.407 1.00 71.52 C ATOM 130 NE2 HIS A 9 5.324 27.377 29.589 1.00 4.24 N ATOM 0 H HIS A 9 5.433 28.145 33.793 1.00 63.41 H new ATOM 0 HA HIS A 9 3.308 26.353 34.624 1.00 74.40 H new ATOM 0 HB2 HIS A 9 2.676 25.608 32.425 1.00 34.23 H new ATOM 0 HB3 HIS A 9 2.448 27.345 32.478 1.00 34.23 H new ATOM 0 HD2 HIS A 9 4.710 28.784 31.159 1.00 1.32 H new ATOM 0 HE1 HIS A 9 5.446 25.495 28.586 1.00 71.52 H new ATOM 0 HE2 HIS A 9 5.885 27.968 28.975 1.00 4.24 H new ATOM 139 N HIS A 10 4.854 24.357 34.123 1.00 14.53 N ATOM 140 CA HIS A 10 5.858 23.285 34.044 1.00 75.13 C ATOM 141 C HIS A 10 5.469 22.243 32.982 1.00 41.43 C ATOM 142 O HIS A 10 4.444 21.571 33.097 1.00 43.40 O ATOM 143 CB HIS A 10 6.057 22.609 35.416 1.00 21.13 C ATOM 144 CG HIS A 10 4.821 21.966 35.984 1.00 44.01 C ATOM 145 ND1 HIS A 10 4.417 20.685 35.664 1.00 54.43 N ATOM 146 CD2 HIS A 10 3.902 22.433 36.863 1.00 54.21 C ATOM 147 CE1 HIS A 10 3.311 20.397 36.319 1.00 70.42 C ATOM 148 NE2 HIS A 10 2.975 21.437 37.051 1.00 40.41 N ATOM 0 H HIS A 10 3.940 24.054 34.460 1.00 14.53 H new ATOM 0 HA HIS A 10 6.804 23.739 33.748 1.00 75.13 H new ATOM 0 HB2 HIS A 10 6.835 21.851 35.323 1.00 21.13 H new ATOM 0 HB3 HIS A 10 6.421 23.354 36.124 1.00 21.13 H new ATOM 0 HD2 HIS A 10 3.899 23.407 37.329 1.00 54.21 H new ATOM 0 HE1 HIS A 10 2.771 19.463 36.264 1.00 70.42 H new ATOM 0 HE2 HIS A 10 2.158 21.494 37.660 1.00 40.41 H new ATOM 157 N SER A 11 6.292 22.114 31.944 1.00 42.20 N ATOM 158 CA SER A 11 6.026 21.157 30.860 1.00 5.10 C ATOM 159 C SER A 11 6.368 19.726 31.293 1.00 64.12 C ATOM 160 O SER A 11 7.530 19.320 31.274 1.00 1.01 O ATOM 161 CB SER A 11 6.825 21.535 29.602 1.00 4.32 C ATOM 162 OG SER A 11 6.466 22.828 29.132 1.00 3.34 O ATOM 0 H SER A 11 7.148 22.656 31.826 1.00 42.20 H new ATOM 0 HA SER A 11 4.962 21.199 30.628 1.00 5.10 H new ATOM 0 HB2 SER A 11 7.892 21.510 29.825 1.00 4.32 H new ATOM 0 HB3 SER A 11 6.645 20.798 28.819 1.00 4.32 H new ATOM 0 HG SER A 11 6.991 23.043 28.333 1.00 3.34 H new ATOM 168 N SER A 12 5.351 18.975 31.708 1.00 74.02 N ATOM 169 CA SER A 12 5.537 17.591 32.174 1.00 22.54 C ATOM 170 C SER A 12 5.047 16.577 31.125 1.00 32.12 C ATOM 171 O SER A 12 3.880 16.594 30.730 1.00 52.23 O ATOM 172 CB SER A 12 4.785 17.376 33.499 1.00 34.44 C ATOM 173 OG SER A 12 5.221 18.294 34.496 1.00 32.54 O ATOM 0 H SER A 12 4.384 19.297 31.733 1.00 74.02 H new ATOM 0 HA SER A 12 6.604 17.429 32.330 1.00 22.54 H new ATOM 0 HB2 SER A 12 3.714 17.495 33.335 1.00 34.44 H new ATOM 0 HB3 SER A 12 4.943 16.355 33.848 1.00 34.44 H new ATOM 0 HG SER A 12 4.588 19.040 34.553 1.00 32.54 H new ATOM 179 N GLY A 13 5.940 15.693 30.676 1.00 3.21 N ATOM 180 CA GLY A 13 5.575 14.679 29.684 1.00 72.52 C ATOM 181 C GLY A 13 6.132 13.294 30.005 1.00 1.42 C ATOM 182 O GLY A 13 6.540 13.025 31.137 1.00 24.01 O ATOM 0 H GLY A 13 6.913 15.658 30.980 1.00 3.21 H new ATOM 0 HA2 GLY A 13 4.489 14.620 29.617 1.00 72.52 H new ATOM 0 HA3 GLY A 13 5.938 14.991 28.705 1.00 72.52 H new ATOM 186 N ARG A 14 6.135 12.407 29.009 1.00 22.42 N ATOM 187 CA ARG A 14 6.671 11.048 29.174 1.00 3.24 C ATOM 188 C ARG A 14 7.867 10.792 28.240 1.00 35.02 C ATOM 189 O ARG A 14 8.301 11.683 27.503 1.00 15.44 O ATOM 190 CB ARG A 14 5.571 10.005 28.924 1.00 63.55 C ATOM 191 CG ARG A 14 4.413 10.088 29.916 1.00 4.33 C ATOM 192 CD ARG A 14 3.395 8.973 29.698 1.00 25.51 C ATOM 193 NE ARG A 14 2.268 9.074 30.625 1.00 22.33 N ATOM 194 CZ ARG A 14 1.350 8.157 30.781 1.00 2.44 C ATOM 195 NH1 ARG A 14 1.406 7.041 30.124 1.00 32.31 N ATOM 196 NH2 ARG A 14 0.378 8.360 31.608 1.00 63.15 N ATOM 0 H ARG A 14 5.772 12.603 28.076 1.00 22.42 H new ATOM 0 HA ARG A 14 7.024 10.956 30.201 1.00 3.24 H new ATOM 0 HB2 ARG A 14 5.183 10.134 27.914 1.00 63.55 H new ATOM 0 HB3 ARG A 14 6.009 9.008 28.973 1.00 63.55 H new ATOM 0 HG2 ARG A 14 4.801 10.031 30.933 1.00 4.33 H new ATOM 0 HG3 ARG A 14 3.919 11.055 29.817 1.00 4.33 H new ATOM 0 HD2 ARG A 14 3.027 9.013 28.673 1.00 25.51 H new ATOM 0 HD3 ARG A 14 3.883 8.006 29.824 1.00 25.51 H new ATOM 0 HE ARG A 14 2.193 9.920 31.190 1.00 22.33 H new ATOM 0 HH11 ARG A 14 2.174 6.869 29.475 1.00 32.31 H new ATOM 0 HH12 ARG A 14 0.682 6.335 30.256 1.00 32.31 H new ATOM 0 HH21 ARG A 14 0.330 9.232 32.135 1.00 63.15 H new ATOM 0 HH22 ARG A 14 -0.341 7.648 31.734 1.00 63.15 H new ATOM 210 N GLU A 15 8.384 9.565 28.271 1.00 32.11 N ATOM 211 CA GLU A 15 9.592 9.200 27.513 1.00 4.14 C ATOM 212 C GLU A 15 9.266 8.436 26.217 1.00 13.24 C ATOM 213 O GLU A 15 8.128 8.031 25.981 1.00 11.41 O ATOM 214 CB GLU A 15 10.544 8.358 28.384 1.00 72.10 C ATOM 215 CG GLU A 15 9.957 7.040 28.898 1.00 74.44 C ATOM 216 CD GLU A 15 8.998 7.226 30.066 1.00 61.45 C ATOM 217 OE1 GLU A 15 9.477 7.402 31.208 1.00 41.34 O ATOM 218 OE2 GLU A 15 7.767 7.208 29.848 1.00 51.30 O ATOM 0 H GLU A 15 7.987 8.799 28.815 1.00 32.11 H new ATOM 0 HA GLU A 15 10.079 10.134 27.233 1.00 4.14 H new ATOM 0 HB2 GLU A 15 11.441 8.137 27.806 1.00 72.10 H new ATOM 0 HB3 GLU A 15 10.855 8.958 29.239 1.00 72.10 H new ATOM 0 HG2 GLU A 15 9.434 6.540 28.083 1.00 74.44 H new ATOM 0 HG3 GLU A 15 10.770 6.383 29.205 1.00 74.44 H new ATOM 225 N ASN A 16 10.288 8.243 25.379 1.00 53.43 N ATOM 226 CA ASN A 16 10.139 7.514 24.111 1.00 25.13 C ATOM 227 C ASN A 16 10.769 6.112 24.203 1.00 55.00 C ATOM 228 O ASN A 16 11.988 5.977 24.345 1.00 61.53 O ATOM 229 CB ASN A 16 10.791 8.302 22.968 1.00 14.14 C ATOM 230 CG ASN A 16 10.213 9.698 22.822 1.00 63.22 C ATOM 231 OD1 ASN A 16 10.715 10.656 23.404 1.00 35.23 O ATOM 232 ND2 ASN A 16 9.152 9.828 22.050 1.00 73.53 N ATOM 0 H ASN A 16 11.234 8.583 25.555 1.00 53.43 H new ATOM 0 HA ASN A 16 9.074 7.401 23.909 1.00 25.13 H new ATOM 0 HB2 ASN A 16 11.864 8.373 23.146 1.00 14.14 H new ATOM 0 HB3 ASN A 16 10.658 7.757 22.033 1.00 14.14 H new ATOM 0 HD21 ASN A 16 8.724 10.745 21.922 1.00 73.53 H new ATOM 0 HD22 ASN A 16 8.760 9.012 21.581 1.00 73.53 H new ATOM 239 N LEU A 17 9.934 5.076 24.119 1.00 43.25 N ATOM 240 CA LEU A 17 10.400 3.684 24.216 1.00 72.21 C ATOM 241 C LEU A 17 11.033 3.193 22.901 1.00 31.33 C ATOM 242 O LEU A 17 10.822 3.779 21.838 1.00 70.33 O ATOM 243 CB LEU A 17 9.250 2.758 24.620 1.00 1.22 C ATOM 244 CG LEU A 17 8.751 2.935 26.064 1.00 44.43 C ATOM 245 CD1 LEU A 17 7.938 4.218 26.219 1.00 33.14 C ATOM 246 CD2 LEU A 17 7.950 1.717 26.502 1.00 23.32 C ATOM 0 H LEU A 17 8.927 5.171 23.984 1.00 43.25 H new ATOM 0 HA LEU A 17 11.171 3.658 24.986 1.00 72.21 H new ATOM 0 HB2 LEU A 17 8.414 2.923 23.940 1.00 1.22 H new ATOM 0 HB3 LEU A 17 9.571 1.725 24.486 1.00 1.22 H new ATOM 0 HG LEU A 17 9.621 3.024 26.715 1.00 44.43 H new ATOM 0 HD11 LEU A 17 7.601 4.312 27.251 1.00 33.14 H new ATOM 0 HD12 LEU A 17 8.559 5.076 25.960 1.00 33.14 H new ATOM 0 HD13 LEU A 17 7.073 4.183 25.556 1.00 33.14 H new ATOM 0 HD21 LEU A 17 7.604 1.858 27.526 1.00 23.32 H new ATOM 0 HD22 LEU A 17 7.091 1.590 25.843 1.00 23.32 H new ATOM 0 HD23 LEU A 17 8.581 0.829 26.451 1.00 23.32 H new ATOM 258 N TYR A 18 11.805 2.109 22.979 1.00 61.14 N ATOM 259 CA TYR A 18 12.476 1.543 21.801 1.00 25.24 C ATOM 260 C TYR A 18 11.635 0.443 21.128 1.00 31.11 C ATOM 261 O TYR A 18 11.232 -0.533 21.765 1.00 31.34 O ATOM 262 CB TYR A 18 13.849 0.975 22.189 1.00 34.12 C ATOM 263 CG TYR A 18 14.862 2.030 22.600 1.00 22.30 C ATOM 264 CD1 TYR A 18 15.625 2.695 21.645 1.00 31.23 C ATOM 265 CD2 TYR A 18 15.063 2.355 23.939 1.00 43.52 C ATOM 266 CE1 TYR A 18 16.552 3.652 22.011 1.00 14.42 C ATOM 267 CE2 TYR A 18 15.990 3.312 24.310 1.00 23.25 C ATOM 268 CZ TYR A 18 16.732 3.955 23.342 1.00 64.11 C ATOM 269 OH TYR A 18 17.660 4.904 23.704 1.00 23.23 O ATOM 0 H TYR A 18 11.984 1.602 23.846 1.00 61.14 H new ATOM 0 HA TYR A 18 12.602 2.355 21.084 1.00 25.24 H new ATOM 0 HB2 TYR A 18 13.720 0.271 23.011 1.00 34.12 H new ATOM 0 HB3 TYR A 18 14.249 0.411 21.346 1.00 34.12 H new ATOM 0 HD1 TYR A 18 15.490 2.459 20.600 1.00 31.23 H new ATOM 0 HD2 TYR A 18 14.486 1.852 24.700 1.00 43.52 H new ATOM 0 HE1 TYR A 18 17.133 4.160 21.256 1.00 14.42 H new ATOM 0 HE2 TYR A 18 16.132 3.554 25.353 1.00 23.25 H new ATOM 0 HH TYR A 18 17.664 5.002 24.679 1.00 23.23 H new ATOM 279 N PHE A 19 11.382 0.610 19.832 1.00 73.24 N ATOM 280 CA PHE A 19 10.669 -0.395 19.033 1.00 70.45 C ATOM 281 C PHE A 19 11.633 -1.112 18.072 1.00 5.23 C ATOM 282 O PHE A 19 12.548 -0.494 17.522 1.00 54.43 O ATOM 283 CB PHE A 19 9.533 0.270 18.247 1.00 72.41 C ATOM 284 CG PHE A 19 8.491 0.905 19.134 1.00 50.33 C ATOM 285 CD1 PHE A 19 7.467 0.141 19.678 1.00 13.32 C ATOM 286 CD2 PHE A 19 8.538 2.261 19.433 1.00 21.51 C ATOM 287 CE1 PHE A 19 6.515 0.716 20.497 1.00 33.34 C ATOM 288 CE2 PHE A 19 7.587 2.839 20.253 1.00 23.51 C ATOM 289 CZ PHE A 19 6.575 2.065 20.785 1.00 12.44 C ATOM 0 H PHE A 19 11.661 1.438 19.305 1.00 73.24 H new ATOM 0 HA PHE A 19 10.246 -1.138 19.709 1.00 70.45 H new ATOM 0 HB2 PHE A 19 9.952 1.030 17.588 1.00 72.41 H new ATOM 0 HB3 PHE A 19 9.055 -0.475 17.611 1.00 72.41 H new ATOM 0 HD1 PHE A 19 7.414 -0.915 19.458 1.00 13.32 H new ATOM 0 HD2 PHE A 19 9.327 2.871 19.020 1.00 21.51 H new ATOM 0 HE1 PHE A 19 5.723 0.110 20.912 1.00 33.34 H new ATOM 0 HE2 PHE A 19 7.636 3.894 20.477 1.00 23.51 H new ATOM 0 HZ PHE A 19 5.831 2.514 21.426 1.00 12.44 H new ATOM 299 N GLN A 20 11.435 -2.412 17.880 1.00 2.24 N ATOM 300 CA GLN A 20 12.303 -3.203 17.002 1.00 35.04 C ATOM 301 C GLN A 20 11.689 -3.346 15.597 1.00 51.55 C ATOM 302 O GLN A 20 10.861 -4.226 15.352 1.00 61.24 O ATOM 303 CB GLN A 20 12.570 -4.581 17.629 1.00 23.24 C ATOM 304 CG GLN A 20 13.581 -5.432 16.866 1.00 61.22 C ATOM 305 CD GLN A 20 13.952 -6.702 17.614 1.00 65.54 C ATOM 306 OE1 GLN A 20 13.317 -7.742 17.458 1.00 34.21 O ATOM 307 NE2 GLN A 20 14.981 -6.630 18.435 1.00 60.50 N ATOM 0 H GLN A 20 10.683 -2.944 18.318 1.00 2.24 H new ATOM 0 HA GLN A 20 13.253 -2.680 16.892 1.00 35.04 H new ATOM 0 HB2 GLN A 20 12.927 -4.440 18.649 1.00 23.24 H new ATOM 0 HB3 GLN A 20 11.629 -5.127 17.694 1.00 23.24 H new ATOM 0 HG2 GLN A 20 13.169 -5.695 15.892 1.00 61.22 H new ATOM 0 HG3 GLN A 20 14.481 -4.845 16.683 1.00 61.22 H new ATOM 0 HE21 GLN A 20 15.488 -5.751 18.542 1.00 60.50 H new ATOM 0 HE22 GLN A 20 15.271 -7.453 18.963 1.00 60.50 H new ATOM 316 N GLY A 21 12.092 -2.460 14.687 1.00 32.34 N ATOM 317 CA GLY A 21 11.556 -2.470 13.327 1.00 71.12 C ATOM 318 C GLY A 21 11.808 -1.160 12.580 1.00 73.41 C ATOM 319 O GLY A 21 11.256 -0.117 12.931 1.00 32.10 O ATOM 0 H GLY A 21 12.783 -1.731 14.865 1.00 32.34 H new ATOM 0 HA2 GLY A 21 12.006 -3.292 12.770 1.00 71.12 H new ATOM 0 HA3 GLY A 21 10.483 -2.660 13.366 1.00 71.12 H new ATOM 323 N HIS A 22 12.645 -1.213 11.547 1.00 51.45 N ATOM 324 CA HIS A 22 12.993 -0.022 10.761 1.00 44.23 C ATOM 325 C HIS A 22 12.136 0.096 9.487 1.00 42.14 C ATOM 326 O HIS A 22 12.253 -0.719 8.568 1.00 50.32 O ATOM 327 CB HIS A 22 14.486 -0.053 10.396 1.00 61.43 C ATOM 328 CG HIS A 22 14.899 0.993 9.399 1.00 14.30 C ATOM 329 ND1 HIS A 22 15.105 2.319 9.723 1.00 24.51 N ATOM 330 CD2 HIS A 22 15.143 0.896 8.069 1.00 21.25 C ATOM 331 CE1 HIS A 22 15.457 2.985 8.641 1.00 43.22 C ATOM 332 NE2 HIS A 22 15.490 2.148 7.625 1.00 61.23 N ATOM 0 H HIS A 22 13.099 -2.070 11.230 1.00 51.45 H new ATOM 0 HA HIS A 22 12.787 0.854 11.376 1.00 44.23 H new ATOM 0 HB2 HIS A 22 15.073 0.076 11.305 1.00 61.43 H new ATOM 0 HB3 HIS A 22 14.730 -1.037 9.996 1.00 61.43 H new ATOM 0 HD2 HIS A 22 15.077 -0.000 7.470 1.00 21.25 H new ATOM 0 HE1 HIS A 22 15.681 4.041 8.596 1.00 43.22 H new ATOM 0 HE2 HIS A 22 15.734 2.390 6.665 1.00 61.23 H new ATOM 341 N MET A 23 11.295 1.128 9.435 1.00 25.12 N ATOM 342 CA MET A 23 10.465 1.400 8.254 1.00 3.01 C ATOM 343 C MET A 23 11.266 2.141 7.169 1.00 51.25 C ATOM 344 O MET A 23 12.366 2.638 7.420 1.00 53.11 O ATOM 345 CB MET A 23 9.225 2.225 8.636 1.00 51.12 C ATOM 346 CG MET A 23 9.545 3.522 9.372 1.00 63.43 C ATOM 347 SD MET A 23 8.122 4.629 9.500 1.00 14.21 S ATOM 348 CE MET A 23 6.835 3.490 10.004 1.00 43.03 C ATOM 0 H MET A 23 11.168 1.793 10.198 1.00 25.12 H new ATOM 0 HA MET A 23 10.143 0.439 7.853 1.00 3.01 H new ATOM 0 HB2 MET A 23 8.666 2.462 7.731 1.00 51.12 H new ATOM 0 HB3 MET A 23 8.574 1.615 9.262 1.00 51.12 H new ATOM 0 HG2 MET A 23 9.906 3.286 10.373 1.00 63.43 H new ATOM 0 HG3 MET A 23 10.354 4.037 8.854 1.00 63.43 H new ATOM 0 HE1 MET A 23 5.985 4.050 10.394 1.00 43.03 H new ATOM 0 HE2 MET A 23 6.516 2.898 9.146 1.00 43.03 H new ATOM 0 HE3 MET A 23 7.219 2.827 10.779 1.00 43.03 H new ATOM 358 N LEU A 24 10.710 2.209 5.963 1.00 71.30 N ATOM 359 CA LEU A 24 11.355 2.922 4.855 1.00 60.40 C ATOM 360 C LEU A 24 10.466 4.038 4.303 1.00 15.31 C ATOM 361 O LEU A 24 9.300 3.816 3.963 1.00 74.42 O ATOM 362 CB LEU A 24 11.743 1.941 3.745 1.00 23.21 C ATOM 363 CG LEU A 24 13.027 1.151 4.026 1.00 40.20 C ATOM 364 CD1 LEU A 24 13.116 -0.082 3.139 1.00 62.30 C ATOM 365 CD2 LEU A 24 14.253 2.039 3.829 1.00 45.55 C ATOM 0 H LEU A 24 9.815 1.781 5.724 1.00 71.30 H new ATOM 0 HA LEU A 24 12.259 3.390 5.244 1.00 60.40 H new ATOM 0 HB2 LEU A 24 10.923 1.239 3.593 1.00 23.21 H new ATOM 0 HB3 LEU A 24 11.866 2.494 2.814 1.00 23.21 H new ATOM 0 HG LEU A 24 12.999 0.819 5.064 1.00 40.20 H new ATOM 0 HD11 LEU A 24 14.036 -0.623 3.359 1.00 62.30 H new ATOM 0 HD12 LEU A 24 12.260 -0.729 3.329 1.00 62.30 H new ATOM 0 HD13 LEU A 24 13.116 0.222 2.092 1.00 62.30 H new ATOM 0 HD21 LEU A 24 15.156 1.463 4.032 1.00 45.55 H new ATOM 0 HD22 LEU A 24 14.278 2.402 2.802 1.00 45.55 H new ATOM 0 HD23 LEU A 24 14.202 2.887 4.512 1.00 45.55 H new ATOM 377 N GLU A 25 11.028 5.237 4.235 1.00 52.42 N ATOM 378 CA GLU A 25 10.337 6.397 3.702 1.00 2.31 C ATOM 379 C GLU A 25 10.181 6.293 2.175 1.00 41.44 C ATOM 380 O GLU A 25 11.168 6.292 1.434 1.00 32.44 O ATOM 381 CB GLU A 25 11.119 7.661 4.072 1.00 64.53 C ATOM 382 CG GLU A 25 10.294 8.919 3.946 1.00 63.23 C ATOM 383 CD GLU A 25 11.099 10.189 4.162 1.00 25.03 C ATOM 384 OE1 GLU A 25 11.236 10.624 5.324 1.00 61.52 O ATOM 385 OE2 GLU A 25 11.594 10.763 3.170 1.00 51.04 O ATOM 0 H GLU A 25 11.979 5.430 4.550 1.00 52.42 H new ATOM 0 HA GLU A 25 9.338 6.444 4.135 1.00 2.31 H new ATOM 0 HB2 GLU A 25 11.482 7.571 5.096 1.00 64.53 H new ATOM 0 HB3 GLU A 25 11.996 7.741 3.429 1.00 64.53 H new ATOM 0 HG2 GLU A 25 9.839 8.949 2.956 1.00 63.23 H new ATOM 0 HG3 GLU A 25 9.480 8.885 4.670 1.00 63.23 H new ATOM 392 N VAL A 26 8.938 6.206 1.708 1.00 63.14 N ATOM 393 CA VAL A 26 8.652 5.985 0.284 1.00 15.03 C ATOM 394 C VAL A 26 7.655 7.011 -0.284 1.00 31.14 C ATOM 395 O VAL A 26 6.915 7.651 0.457 1.00 11.13 O ATOM 396 CB VAL A 26 8.084 4.560 0.051 1.00 52.43 C ATOM 397 CG1 VAL A 26 9.122 3.493 0.402 1.00 23.31 C ATOM 398 CG2 VAL A 26 6.800 4.356 0.856 1.00 4.12 C ATOM 0 H VAL A 26 8.107 6.285 2.294 1.00 63.14 H new ATOM 0 HA VAL A 26 9.602 6.103 -0.238 1.00 15.03 H new ATOM 0 HB VAL A 26 7.844 4.458 -1.007 1.00 52.43 H new ATOM 0 HG11 VAL A 26 8.699 2.503 0.230 1.00 23.31 H new ATOM 0 HG12 VAL A 26 10.005 3.624 -0.224 1.00 23.31 H new ATOM 0 HG13 VAL A 26 9.403 3.590 1.451 1.00 23.31 H new ATOM 0 HG21 VAL A 26 6.416 3.351 0.680 1.00 4.12 H new ATOM 0 HG22 VAL A 26 7.012 4.483 1.918 1.00 4.12 H new ATOM 0 HG23 VAL A 26 6.055 5.089 0.545 1.00 4.12 H new ATOM 408 N GLU A 27 7.644 7.159 -1.608 1.00 1.10 N ATOM 409 CA GLU A 27 6.656 8.008 -2.286 1.00 54.13 C ATOM 410 C GLU A 27 5.511 7.158 -2.858 1.00 33.22 C ATOM 411 O GLU A 27 5.724 6.310 -3.725 1.00 42.33 O ATOM 412 CB GLU A 27 7.320 8.826 -3.402 1.00 61.10 C ATOM 413 CG GLU A 27 6.354 9.750 -4.142 1.00 41.15 C ATOM 414 CD GLU A 27 7.052 10.761 -5.043 1.00 34.33 C ATOM 415 OE1 GLU A 27 8.132 10.450 -5.583 1.00 32.22 O ATOM 416 OE2 GLU A 27 6.523 11.882 -5.202 1.00 63.13 O ATOM 0 H GLU A 27 8.307 6.703 -2.236 1.00 1.10 H new ATOM 0 HA GLU A 27 6.241 8.698 -1.551 1.00 54.13 H new ATOM 0 HB2 GLU A 27 8.124 9.424 -2.973 1.00 61.10 H new ATOM 0 HB3 GLU A 27 7.777 8.143 -4.118 1.00 61.10 H new ATOM 0 HG2 GLU A 27 5.675 9.146 -4.744 1.00 41.15 H new ATOM 0 HG3 GLU A 27 5.744 10.284 -3.413 1.00 41.15 H new ATOM 423 N VAL A 28 4.301 7.393 -2.359 1.00 44.33 N ATOM 424 CA VAL A 28 3.126 6.598 -2.734 1.00 15.24 C ATOM 425 C VAL A 28 2.361 7.217 -3.919 1.00 43.35 C ATOM 426 O VAL A 28 1.703 8.250 -3.783 1.00 33.34 O ATOM 427 CB VAL A 28 2.160 6.452 -1.532 1.00 23.11 C ATOM 428 CG1 VAL A 28 0.992 5.532 -1.877 1.00 50.50 C ATOM 429 CG2 VAL A 28 2.905 5.951 -0.296 1.00 33.35 C ATOM 0 H VAL A 28 4.103 8.134 -1.687 1.00 44.33 H new ATOM 0 HA VAL A 28 3.495 5.618 -3.037 1.00 15.24 H new ATOM 0 HB VAL A 28 1.752 7.437 -1.305 1.00 23.11 H new ATOM 0 HG11 VAL A 28 0.329 5.447 -1.016 1.00 50.50 H new ATOM 0 HG12 VAL A 28 0.440 5.946 -2.721 1.00 50.50 H new ATOM 0 HG13 VAL A 28 1.372 4.545 -2.141 1.00 50.50 H new ATOM 0 HG21 VAL A 28 2.207 5.856 0.536 1.00 33.35 H new ATOM 0 HG22 VAL A 28 3.351 4.979 -0.509 1.00 33.35 H new ATOM 0 HG23 VAL A 28 3.690 6.660 -0.032 1.00 33.35 H new ATOM 439 N ILE A 29 2.449 6.577 -5.081 1.00 2.41 N ATOM 440 CA ILE A 29 1.734 7.032 -6.286 1.00 55.42 C ATOM 441 C ILE A 29 0.480 6.193 -6.562 1.00 54.32 C ATOM 442 O ILE A 29 0.449 4.994 -6.290 1.00 61.41 O ATOM 443 CB ILE A 29 2.654 6.991 -7.532 1.00 0.50 C ATOM 444 CG1 ILE A 29 3.492 5.705 -7.536 1.00 24.22 C ATOM 445 CG2 ILE A 29 3.548 8.224 -7.593 1.00 13.43 C ATOM 446 CD1 ILE A 29 4.766 5.821 -8.337 1.00 75.05 C ATOM 0 H ILE A 29 3.010 5.737 -5.222 1.00 2.41 H new ATOM 0 HA ILE A 29 1.429 8.060 -6.092 1.00 55.42 H new ATOM 0 HB ILE A 29 2.025 6.994 -8.422 1.00 0.50 H new ATOM 0 HG12 ILE A 29 3.741 5.439 -6.509 1.00 24.22 H new ATOM 0 HG13 ILE A 29 2.891 4.890 -7.939 1.00 24.22 H new ATOM 0 HG21 ILE A 29 4.183 8.169 -8.477 1.00 13.43 H new ATOM 0 HG22 ILE A 29 2.929 9.120 -7.646 1.00 13.43 H new ATOM 0 HG23 ILE A 29 4.172 8.266 -6.700 1.00 13.43 H new ATOM 0 HD11 ILE A 29 5.308 4.876 -8.297 1.00 75.05 H new ATOM 0 HD12 ILE A 29 4.524 6.056 -9.373 1.00 75.05 H new ATOM 0 HD13 ILE A 29 5.387 6.614 -7.920 1.00 75.05 H new ATOM 458 N SER A 30 -0.548 6.837 -7.115 1.00 1.40 N ATOM 459 CA SER A 30 -1.807 6.156 -7.449 1.00 4.43 C ATOM 460 C SER A 30 -1.957 5.954 -8.959 1.00 2.41 C ATOM 461 O SER A 30 -2.253 6.893 -9.700 1.00 54.25 O ATOM 462 CB SER A 30 -3.009 6.941 -6.913 1.00 2.25 C ATOM 463 OG SER A 30 -3.018 6.954 -5.498 1.00 73.43 O ATOM 0 H SER A 30 -0.537 7.831 -7.343 1.00 1.40 H new ATOM 0 HA SER A 30 -1.777 5.176 -6.973 1.00 4.43 H new ATOM 0 HB2 SER A 30 -2.977 7.964 -7.289 1.00 2.25 H new ATOM 0 HB3 SER A 30 -3.933 6.495 -7.282 1.00 2.25 H new ATOM 0 HG SER A 30 -2.627 7.793 -5.176 1.00 73.43 H new ATOM 469 N GLY A 31 -1.746 4.722 -9.410 1.00 25.22 N ATOM 470 CA GLY A 31 -1.894 4.408 -10.825 1.00 4.52 C ATOM 471 C GLY A 31 -3.348 4.373 -11.275 1.00 0.02 C ATOM 472 O GLY A 31 -4.026 3.356 -11.126 1.00 40.21 O ATOM 0 H GLY A 31 -1.475 3.933 -8.823 1.00 25.22 H new ATOM 0 HA2 GLY A 31 -1.354 5.149 -11.415 1.00 4.52 H new ATOM 0 HA3 GLY A 31 -1.433 3.441 -11.028 1.00 4.52 H new ATOM 476 N ARG A 32 -3.836 5.492 -11.803 1.00 11.44 N ATOM 477 CA ARG A 32 -5.215 5.576 -12.297 1.00 72.32 C ATOM 478 C ARG A 32 -5.418 4.719 -13.561 1.00 51.02 C ATOM 479 O ARG A 32 -5.211 5.175 -14.684 1.00 70.30 O ATOM 480 CB ARG A 32 -5.612 7.043 -12.545 1.00 22.53 C ATOM 481 CG ARG A 32 -4.600 7.846 -13.361 1.00 2.00 C ATOM 482 CD ARG A 32 -5.073 9.278 -13.599 1.00 40.53 C ATOM 483 NE ARG A 32 -5.324 9.997 -12.348 1.00 20.14 N ATOM 484 CZ ARG A 32 -6.063 11.071 -12.257 1.00 3.30 C ATOM 485 NH1 ARG A 32 -6.621 11.584 -13.305 1.00 55.41 N ATOM 486 NH2 ARG A 32 -6.237 11.640 -11.111 1.00 32.35 N ATOM 0 H ARG A 32 -3.301 6.355 -11.902 1.00 11.44 H new ATOM 0 HA ARG A 32 -5.872 5.171 -11.527 1.00 72.32 H new ATOM 0 HB2 ARG A 32 -6.573 7.064 -13.060 1.00 22.53 H new ATOM 0 HB3 ARG A 32 -5.755 7.535 -11.583 1.00 22.53 H new ATOM 0 HG2 ARG A 32 -3.643 7.861 -12.840 1.00 2.00 H new ATOM 0 HG3 ARG A 32 -4.433 7.354 -14.319 1.00 2.00 H new ATOM 0 HD2 ARG A 32 -4.322 9.814 -14.179 1.00 40.53 H new ATOM 0 HD3 ARG A 32 -5.985 9.262 -14.195 1.00 40.53 H new ATOM 0 HE ARG A 32 -4.896 9.637 -11.495 1.00 20.14 H new ATOM 0 HH11 ARG A 32 -6.487 11.150 -14.218 1.00 55.41 H new ATOM 0 HH12 ARG A 32 -7.195 12.423 -13.218 1.00 55.41 H new ATOM 0 HH21 ARG A 32 -5.798 11.251 -10.277 1.00 32.35 H new ATOM 0 HH22 ARG A 32 -6.814 12.478 -11.040 1.00 32.35 H new ATOM 500 N THR A 33 -5.787 3.454 -13.353 1.00 23.34 N ATOM 501 CA THR A 33 -6.058 2.516 -14.456 1.00 23.24 C ATOM 502 C THR A 33 -7.554 2.185 -14.545 1.00 20.24 C ATOM 503 O THR A 33 -8.334 2.579 -13.677 1.00 4.31 O ATOM 504 CB THR A 33 -5.278 1.189 -14.281 1.00 53.53 C ATOM 505 OG1 THR A 33 -5.756 0.482 -13.122 1.00 42.10 O ATOM 506 CG2 THR A 33 -3.778 1.440 -14.136 1.00 22.42 C ATOM 0 H THR A 33 -5.907 3.048 -12.425 1.00 23.34 H new ATOM 0 HA THR A 33 -5.731 3.011 -15.370 1.00 23.24 H new ATOM 0 HB THR A 33 -5.444 0.588 -15.175 1.00 53.53 H new ATOM 0 HG1 THR A 33 -5.258 -0.356 -13.021 1.00 42.10 H new ATOM 0 HG21 THR A 33 -3.260 0.489 -14.015 1.00 22.42 H new ATOM 0 HG22 THR A 33 -3.406 1.945 -15.027 1.00 22.42 H new ATOM 0 HG23 THR A 33 -3.597 2.066 -13.262 1.00 22.42 H new ATOM 514 N LEU A 34 -7.940 1.456 -15.600 1.00 2.32 N ATOM 515 CA LEU A 34 -9.331 1.016 -15.815 1.00 4.25 C ATOM 516 C LEU A 34 -10.248 2.177 -16.256 1.00 40.33 C ATOM 517 O LEU A 34 -10.992 2.042 -17.226 1.00 71.02 O ATOM 518 CB LEU A 34 -9.889 0.321 -14.558 1.00 14.41 C ATOM 519 CG LEU A 34 -11.263 -0.351 -14.718 1.00 15.52 C ATOM 520 CD1 LEU A 34 -11.217 -1.431 -15.798 1.00 41.11 C ATOM 521 CD2 LEU A 34 -11.732 -0.936 -13.387 1.00 31.44 C ATOM 0 H LEU A 34 -7.298 1.152 -16.332 1.00 2.32 H new ATOM 0 HA LEU A 34 -9.315 0.293 -16.630 1.00 4.25 H new ATOM 0 HB2 LEU A 34 -9.172 -0.434 -14.235 1.00 14.41 H new ATOM 0 HB3 LEU A 34 -9.957 1.059 -13.758 1.00 14.41 H new ATOM 0 HG LEU A 34 -11.980 0.408 -15.030 1.00 15.52 H new ATOM 0 HD11 LEU A 34 -12.200 -1.892 -15.893 1.00 41.11 H new ATOM 0 HD12 LEU A 34 -10.933 -0.982 -16.750 1.00 41.11 H new ATOM 0 HD13 LEU A 34 -10.485 -2.190 -15.522 1.00 41.11 H new ATOM 0 HD21 LEU A 34 -12.706 -1.407 -13.520 1.00 31.44 H new ATOM 0 HD22 LEU A 34 -11.013 -1.679 -13.043 1.00 31.44 H new ATOM 0 HD23 LEU A 34 -11.812 -0.139 -12.648 1.00 31.44 H new ATOM 533 N ASN A 35 -10.192 3.304 -15.539 1.00 63.50 N ATOM 534 CA ASN A 35 -10.981 4.501 -15.873 1.00 20.12 C ATOM 535 C ASN A 35 -12.495 4.216 -15.836 1.00 32.00 C ATOM 536 O ASN A 35 -13.085 3.728 -16.803 1.00 40.42 O ATOM 537 CB ASN A 35 -10.562 5.055 -17.242 1.00 73.41 C ATOM 538 CG ASN A 35 -9.089 5.431 -17.282 1.00 0.11 C ATOM 539 OD1 ASN A 35 -8.515 5.851 -16.282 1.00 51.02 O ATOM 540 ND2 ASN A 35 -8.460 5.267 -18.429 1.00 3.42 N ATOM 0 H ASN A 35 -9.602 3.415 -14.714 1.00 63.50 H new ATOM 0 HA ASN A 35 -10.775 5.256 -15.114 1.00 20.12 H new ATOM 0 HB2 ASN A 35 -10.766 4.311 -18.012 1.00 73.41 H new ATOM 0 HB3 ASN A 35 -11.166 5.931 -17.478 1.00 73.41 H new ATOM 0 HD21 ASN A 35 -7.468 5.491 -18.503 1.00 3.42 H new ATOM 0 HD22 ASN A 35 -8.966 4.916 -19.242 1.00 3.42 H new ATOM 547 N GLN A 36 -13.112 4.512 -14.696 1.00 72.01 N ATOM 548 CA GLN A 36 -14.533 4.213 -14.470 1.00 12.41 C ATOM 549 C GLN A 36 -15.271 5.400 -13.835 1.00 3.22 C ATOM 550 O GLN A 36 -16.317 5.824 -14.321 1.00 51.52 O ATOM 551 CB GLN A 36 -14.663 2.980 -13.562 1.00 50.45 C ATOM 552 CG GLN A 36 -14.101 1.698 -14.172 1.00 61.20 C ATOM 553 CD GLN A 36 -14.994 1.112 -15.254 1.00 34.34 C ATOM 554 OE1 GLN A 36 -16.213 1.235 -15.204 1.00 60.52 O ATOM 555 NE2 GLN A 36 -14.397 0.477 -16.243 1.00 5.01 N ATOM 0 H GLN A 36 -12.651 4.962 -13.905 1.00 72.01 H new ATOM 0 HA GLN A 36 -14.991 4.014 -15.439 1.00 12.41 H new ATOM 0 HB2 GLN A 36 -14.149 3.178 -12.621 1.00 50.45 H new ATOM 0 HB3 GLN A 36 -15.715 2.826 -13.324 1.00 50.45 H new ATOM 0 HG2 GLN A 36 -13.117 1.904 -14.593 1.00 61.20 H new ATOM 0 HG3 GLN A 36 -13.962 0.958 -13.384 1.00 61.20 H new ATOM 0 HE21 GLN A 36 -13.381 0.392 -16.255 1.00 5.01 H new ATOM 0 HE22 GLN A 36 -14.951 0.070 -16.996 1.00 5.01 H new ATOM 564 N GLY A 37 -14.724 5.923 -12.739 1.00 42.41 N ATOM 565 CA GLY A 37 -15.377 7.013 -12.015 1.00 23.21 C ATOM 566 C GLY A 37 -16.479 6.543 -11.068 1.00 34.32 C ATOM 567 O GLY A 37 -17.010 7.332 -10.284 1.00 53.11 O ATOM 0 H GLY A 37 -13.840 5.614 -12.336 1.00 42.41 H new ATOM 0 HA2 GLY A 37 -14.627 7.559 -11.443 1.00 23.21 H new ATOM 0 HA3 GLY A 37 -15.802 7.713 -12.735 1.00 23.21 H new ATOM 571 N ALA A 38 -16.816 5.254 -11.131 1.00 63.12 N ATOM 572 CA ALA A 38 -17.874 4.672 -10.295 1.00 15.21 C ATOM 573 C ALA A 38 -17.380 4.387 -8.872 1.00 61.10 C ATOM 574 O ALA A 38 -16.218 4.030 -8.669 1.00 31.10 O ATOM 575 CB ALA A 38 -18.388 3.383 -10.931 1.00 74.14 C ATOM 0 H ALA A 38 -16.368 4.585 -11.758 1.00 63.12 H new ATOM 0 HA ALA A 38 -18.683 5.399 -10.229 1.00 15.21 H new ATOM 0 HB1 ALA A 38 -19.172 2.956 -10.306 1.00 74.14 H new ATOM 0 HB2 ALA A 38 -18.791 3.601 -11.920 1.00 74.14 H new ATOM 0 HB3 ALA A 38 -17.568 2.670 -11.022 1.00 74.14 H new ATOM 581 N THR A 39 -18.263 4.556 -7.887 1.00 42.13 N ATOM 582 CA THR A 39 -17.954 4.172 -6.501 1.00 72.24 C ATOM 583 C THR A 39 -17.677 2.668 -6.398 1.00 50.30 C ATOM 584 O THR A 39 -18.183 1.880 -7.201 1.00 61.24 O ATOM 585 CB THR A 39 -19.103 4.527 -5.528 1.00 22.33 C ATOM 586 OG1 THR A 39 -18.769 4.105 -4.196 1.00 61.22 O ATOM 587 CG2 THR A 39 -20.418 3.870 -5.954 1.00 31.52 C ATOM 0 H THR A 39 -19.193 4.953 -8.017 1.00 42.13 H new ATOM 0 HA THR A 39 -17.066 4.737 -6.218 1.00 72.24 H new ATOM 0 HB THR A 39 -19.235 5.609 -5.551 1.00 22.33 H new ATOM 0 HG1 THR A 39 -19.501 4.335 -3.587 1.00 61.22 H new ATOM 0 HG21 THR A 39 -21.205 4.140 -5.249 1.00 31.52 H new ATOM 0 HG22 THR A 39 -20.691 4.215 -6.951 1.00 31.52 H new ATOM 0 HG23 THR A 39 -20.297 2.787 -5.965 1.00 31.52 H new ATOM 595 N VAL A 40 -16.893 2.263 -5.400 1.00 62.04 N ATOM 596 CA VAL A 40 -16.542 0.849 -5.237 1.00 32.44 C ATOM 597 C VAL A 40 -17.801 -0.028 -5.107 1.00 75.15 C ATOM 598 O VAL A 40 -17.810 -1.184 -5.535 1.00 72.42 O ATOM 599 CB VAL A 40 -15.620 0.614 -4.011 1.00 11.02 C ATOM 600 CG1 VAL A 40 -14.411 1.547 -4.050 1.00 52.40 C ATOM 601 CG2 VAL A 40 -16.383 0.781 -2.703 1.00 43.35 C ATOM 0 H VAL A 40 -16.491 2.885 -4.698 1.00 62.04 H new ATOM 0 HA VAL A 40 -15.997 0.562 -6.136 1.00 32.44 H new ATOM 0 HB VAL A 40 -15.262 -0.414 -4.062 1.00 11.02 H new ATOM 0 HG11 VAL A 40 -13.781 1.362 -3.180 1.00 52.40 H new ATOM 0 HG12 VAL A 40 -13.838 1.363 -4.959 1.00 52.40 H new ATOM 0 HG13 VAL A 40 -14.750 2.583 -4.039 1.00 52.40 H new ATOM 0 HG21 VAL A 40 -15.709 0.610 -1.864 1.00 43.35 H new ATOM 0 HG22 VAL A 40 -16.787 1.792 -2.644 1.00 43.35 H new ATOM 0 HG23 VAL A 40 -17.200 0.061 -2.664 1.00 43.35 H new ATOM 611 N GLU A 41 -18.865 0.548 -4.534 1.00 32.30 N ATOM 612 CA GLU A 41 -20.139 -0.158 -4.346 1.00 63.34 C ATOM 613 C GLU A 41 -20.748 -0.607 -5.685 1.00 1.10 C ATOM 614 O GLU A 41 -21.404 -1.649 -5.762 1.00 21.43 O ATOM 615 CB GLU A 41 -21.142 0.735 -3.599 1.00 4.22 C ATOM 616 CG GLU A 41 -22.515 0.089 -3.414 1.00 34.03 C ATOM 617 CD GLU A 41 -23.526 1.013 -2.752 1.00 62.32 C ATOM 618 OE1 GLU A 41 -23.926 2.012 -3.385 1.00 5.21 O ATOM 619 OE2 GLU A 41 -23.954 0.728 -1.615 1.00 15.30 O ATOM 0 H GLU A 41 -18.868 1.508 -4.190 1.00 32.30 H new ATOM 0 HA GLU A 41 -19.929 -1.048 -3.753 1.00 63.34 H new ATOM 0 HB2 GLU A 41 -20.733 0.987 -2.620 1.00 4.22 H new ATOM 0 HB3 GLU A 41 -21.260 1.671 -4.146 1.00 4.22 H new ATOM 0 HG2 GLU A 41 -22.898 -0.221 -4.386 1.00 34.03 H new ATOM 0 HG3 GLU A 41 -22.407 -0.813 -2.811 1.00 34.03 H new ATOM 626 N GLU A 42 -20.531 0.188 -6.734 1.00 43.41 N ATOM 627 CA GLU A 42 -21.045 -0.126 -8.075 1.00 24.10 C ATOM 628 C GLU A 42 -20.559 -1.510 -8.527 1.00 55.23 C ATOM 629 O GLU A 42 -21.322 -2.305 -9.083 1.00 15.11 O ATOM 630 CB GLU A 42 -20.593 0.966 -9.070 1.00 23.31 C ATOM 631 CG GLU A 42 -21.253 0.912 -10.458 1.00 43.41 C ATOM 632 CD GLU A 42 -20.551 -0.017 -11.447 1.00 24.03 C ATOM 633 OE1 GLU A 42 -19.553 0.410 -12.063 1.00 23.14 O ATOM 634 OE2 GLU A 42 -21.006 -1.162 -11.639 1.00 61.45 O ATOM 0 H GLU A 42 -20.001 1.058 -6.684 1.00 43.41 H new ATOM 0 HA GLU A 42 -22.134 -0.147 -8.045 1.00 24.10 H new ATOM 0 HB2 GLU A 42 -20.796 1.942 -8.628 1.00 23.31 H new ATOM 0 HB3 GLU A 42 -19.513 0.892 -9.197 1.00 23.31 H new ATOM 0 HG2 GLU A 42 -22.288 0.589 -10.344 1.00 43.41 H new ATOM 0 HG3 GLU A 42 -21.278 1.918 -10.876 1.00 43.41 H new ATOM 641 N LYS A 43 -19.295 -1.807 -8.234 1.00 42.15 N ATOM 642 CA LYS A 43 -18.650 -3.034 -8.713 1.00 54.45 C ATOM 643 C LYS A 43 -18.498 -4.094 -7.605 1.00 14.23 C ATOM 644 O LYS A 43 -19.097 -5.163 -7.692 1.00 35.02 O ATOM 645 CB LYS A 43 -17.305 -2.675 -9.340 1.00 24.53 C ATOM 646 CG LYS A 43 -17.444 -1.610 -10.422 1.00 33.14 C ATOM 647 CD LYS A 43 -16.111 -1.234 -11.056 1.00 32.13 C ATOM 648 CE LYS A 43 -16.283 -0.117 -12.079 1.00 43.43 C ATOM 649 NZ LYS A 43 -17.256 -0.479 -13.144 1.00 31.21 N ATOM 0 H LYS A 43 -18.692 -1.213 -7.664 1.00 42.15 H new ATOM 0 HA LYS A 43 -19.291 -3.490 -9.467 1.00 54.45 H new ATOM 0 HB2 LYS A 43 -16.628 -2.317 -8.564 1.00 24.53 H new ATOM 0 HB3 LYS A 43 -16.855 -3.570 -9.769 1.00 24.53 H new ATOM 0 HG2 LYS A 43 -18.120 -1.972 -11.197 1.00 33.14 H new ATOM 0 HG3 LYS A 43 -17.900 -0.719 -9.991 1.00 33.14 H new ATOM 0 HD2 LYS A 43 -15.413 -0.917 -10.281 1.00 32.13 H new ATOM 0 HD3 LYS A 43 -15.675 -2.109 -11.539 1.00 32.13 H new ATOM 0 HE2 LYS A 43 -16.619 0.788 -11.574 1.00 43.43 H new ATOM 0 HE3 LYS A 43 -15.318 0.111 -12.532 1.00 43.43 H new ATOM 0 HZ1 LYS A 43 -17.048 0.067 -14.005 1.00 31.21 H new ATOM 0 HZ2 LYS A 43 -17.181 -1.495 -13.352 1.00 31.21 H new ATOM 0 HZ3 LYS A 43 -18.221 -0.262 -12.821 1.00 31.21 H new ATOM 663 N LEU A 44 -17.691 -3.804 -6.577 1.00 25.55 N ATOM 664 CA LEU A 44 -17.468 -4.742 -5.450 1.00 73.04 C ATOM 665 C LEU A 44 -17.142 -6.183 -5.911 1.00 14.35 C ATOM 666 O LEU A 44 -17.287 -7.137 -5.143 1.00 13.31 O ATOM 667 CB LEU A 44 -18.689 -4.762 -4.510 1.00 72.44 C ATOM 668 CG LEU A 44 -18.903 -3.488 -3.674 1.00 11.41 C ATOM 669 CD1 LEU A 44 -20.146 -3.615 -2.796 1.00 12.12 C ATOM 670 CD2 LEU A 44 -17.672 -3.191 -2.817 1.00 41.02 C ATOM 0 H LEU A 44 -17.177 -2.927 -6.495 1.00 25.55 H new ATOM 0 HA LEU A 44 -16.594 -4.370 -4.915 1.00 73.04 H new ATOM 0 HB2 LEU A 44 -19.583 -4.937 -5.108 1.00 72.44 H new ATOM 0 HB3 LEU A 44 -18.589 -5.609 -3.831 1.00 72.44 H new ATOM 0 HG LEU A 44 -19.054 -2.656 -4.361 1.00 11.41 H new ATOM 0 HD11 LEU A 44 -20.276 -2.702 -2.215 1.00 12.12 H new ATOM 0 HD12 LEU A 44 -21.022 -3.772 -3.426 1.00 12.12 H new ATOM 0 HD13 LEU A 44 -20.029 -4.462 -2.120 1.00 12.12 H new ATOM 0 HD21 LEU A 44 -17.844 -2.286 -2.234 1.00 41.02 H new ATOM 0 HD22 LEU A 44 -17.487 -4.028 -2.143 1.00 41.02 H new ATOM 0 HD23 LEU A 44 -16.805 -3.047 -3.462 1.00 41.02 H new ATOM 682 N THR A 45 -16.685 -6.332 -7.153 1.00 35.23 N ATOM 683 CA THR A 45 -16.347 -7.655 -7.700 1.00 71.33 C ATOM 684 C THR A 45 -14.963 -8.118 -7.234 1.00 43.02 C ATOM 685 O THR A 45 -14.112 -7.299 -6.882 1.00 24.13 O ATOM 686 CB THR A 45 -16.384 -7.660 -9.252 1.00 34.01 C ATOM 687 OG1 THR A 45 -16.004 -8.950 -9.759 1.00 52.32 O ATOM 688 CG2 THR A 45 -15.460 -6.591 -9.830 1.00 74.12 C ATOM 0 H THR A 45 -16.539 -5.559 -7.802 1.00 35.23 H new ATOM 0 HA THR A 45 -17.102 -8.345 -7.324 1.00 71.33 H new ATOM 0 HB THR A 45 -17.406 -7.438 -9.559 1.00 34.01 H new ATOM 0 HG1 THR A 45 -16.034 -8.938 -10.738 1.00 52.32 H new ATOM 0 HG21 THR A 45 -15.507 -6.619 -10.919 1.00 74.12 H new ATOM 0 HG22 THR A 45 -15.775 -5.609 -9.478 1.00 74.12 H new ATOM 0 HG23 THR A 45 -14.437 -6.781 -9.506 1.00 74.12 H new ATOM 696 N GLU A 46 -14.741 -9.433 -7.239 1.00 73.10 N ATOM 697 CA GLU A 46 -13.441 -10.008 -6.854 1.00 75.41 C ATOM 698 C GLU A 46 -12.281 -9.320 -7.597 1.00 20.25 C ATOM 699 O GLU A 46 -11.216 -9.075 -7.027 1.00 41.31 O ATOM 700 CB GLU A 46 -13.428 -11.515 -7.148 1.00 63.34 C ATOM 701 CG GLU A 46 -12.087 -12.190 -6.872 1.00 55.40 C ATOM 702 CD GLU A 46 -12.082 -13.662 -7.252 1.00 73.21 C ATOM 703 OE1 GLU A 46 -12.441 -13.980 -8.408 1.00 64.52 O ATOM 704 OE2 GLU A 46 -11.712 -14.507 -6.408 1.00 1.15 O ATOM 0 H GLU A 46 -15.442 -10.125 -7.505 1.00 73.10 H new ATOM 0 HA GLU A 46 -13.303 -9.843 -5.785 1.00 75.41 H new ATOM 0 HB2 GLU A 46 -14.197 -11.999 -6.546 1.00 63.34 H new ATOM 0 HB3 GLU A 46 -13.694 -11.673 -8.193 1.00 63.34 H new ATOM 0 HG2 GLU A 46 -11.304 -11.673 -7.427 1.00 55.40 H new ATOM 0 HG3 GLU A 46 -11.846 -12.091 -5.814 1.00 55.40 H new ATOM 711 N GLU A 47 -12.507 -9.004 -8.871 1.00 34.53 N ATOM 712 CA GLU A 47 -11.509 -8.300 -9.682 1.00 11.21 C ATOM 713 C GLU A 47 -11.181 -6.920 -9.087 1.00 1.13 C ATOM 714 O GLU A 47 -10.031 -6.489 -9.098 1.00 52.43 O ATOM 715 CB GLU A 47 -12.005 -8.147 -11.126 1.00 71.12 C ATOM 716 CG GLU A 47 -10.972 -7.531 -12.064 1.00 2.41 C ATOM 717 CD GLU A 47 -11.521 -7.285 -13.460 1.00 72.43 C ATOM 718 OE1 GLU A 47 -12.064 -6.187 -13.706 1.00 51.04 O ATOM 719 OE2 GLU A 47 -11.416 -8.187 -14.318 1.00 70.13 O ATOM 0 H GLU A 47 -13.371 -9.223 -9.366 1.00 34.53 H new ATOM 0 HA GLU A 47 -10.597 -8.896 -9.681 1.00 11.21 H new ATOM 0 HB2 GLU A 47 -12.292 -9.126 -11.508 1.00 71.12 H new ATOM 0 HB3 GLU A 47 -12.902 -7.528 -11.130 1.00 71.12 H new ATOM 0 HG2 GLU A 47 -10.622 -6.588 -11.644 1.00 2.41 H new ATOM 0 HG3 GLU A 47 -10.107 -8.191 -12.129 1.00 2.41 H new ATOM 726 N TYR A 48 -12.199 -6.237 -8.552 1.00 72.11 N ATOM 727 CA TYR A 48 -12.004 -4.926 -7.918 1.00 5.25 C ATOM 728 C TYR A 48 -10.991 -5.048 -6.767 1.00 43.10 C ATOM 729 O TYR A 48 -10.134 -4.185 -6.575 1.00 21.51 O ATOM 730 CB TYR A 48 -13.347 -4.381 -7.388 1.00 22.11 C ATOM 731 CG TYR A 48 -13.411 -2.861 -7.289 1.00 33.22 C ATOM 732 CD1 TYR A 48 -12.536 -2.149 -6.471 1.00 41.32 C ATOM 733 CD2 TYR A 48 -14.342 -2.138 -8.030 1.00 60.20 C ATOM 734 CE1 TYR A 48 -12.579 -0.768 -6.406 1.00 64.14 C ATOM 735 CE2 TYR A 48 -14.395 -0.758 -7.964 1.00 62.45 C ATOM 736 CZ TYR A 48 -13.512 -0.079 -7.154 1.00 51.41 C ATOM 737 OH TYR A 48 -13.560 1.294 -7.096 1.00 70.41 O ATOM 0 H TYR A 48 -13.164 -6.568 -8.545 1.00 72.11 H new ATOM 0 HA TYR A 48 -11.616 -4.230 -8.661 1.00 5.25 H new ATOM 0 HB2 TYR A 48 -14.149 -4.725 -8.041 1.00 22.11 H new ATOM 0 HB3 TYR A 48 -13.535 -4.806 -6.402 1.00 22.11 H new ATOM 0 HD1 TYR A 48 -11.811 -2.685 -5.877 1.00 41.32 H new ATOM 0 HD2 TYR A 48 -15.036 -2.665 -8.668 1.00 60.20 H new ATOM 0 HE1 TYR A 48 -11.887 -0.232 -5.774 1.00 64.14 H new ATOM 0 HE2 TYR A 48 -15.126 -0.215 -8.545 1.00 62.45 H new ATOM 0 HH TYR A 48 -12.738 1.633 -6.683 1.00 70.41 H new ATOM 747 N PHE A 49 -11.100 -6.142 -6.021 1.00 5.31 N ATOM 748 CA PHE A 49 -10.169 -6.446 -4.935 1.00 23.23 C ATOM 749 C PHE A 49 -8.754 -6.679 -5.494 1.00 60.11 C ATOM 750 O PHE A 49 -7.826 -5.917 -5.221 1.00 75.30 O ATOM 751 CB PHE A 49 -10.667 -7.690 -4.173 1.00 50.32 C ATOM 752 CG PHE A 49 -9.889 -8.025 -2.918 1.00 53.11 C ATOM 753 CD1 PHE A 49 -8.766 -8.841 -2.969 1.00 10.33 C ATOM 754 CD2 PHE A 49 -10.296 -7.534 -1.684 1.00 33.31 C ATOM 755 CE1 PHE A 49 -8.066 -9.156 -1.819 1.00 24.13 C ATOM 756 CE2 PHE A 49 -9.601 -7.850 -0.530 1.00 44.12 C ATOM 757 CZ PHE A 49 -8.485 -8.661 -0.598 1.00 40.14 C ATOM 0 H PHE A 49 -11.832 -6.841 -6.149 1.00 5.31 H new ATOM 0 HA PHE A 49 -10.124 -5.602 -4.247 1.00 23.23 H new ATOM 0 HB2 PHE A 49 -11.713 -7.539 -3.905 1.00 50.32 H new ATOM 0 HB3 PHE A 49 -10.631 -8.548 -4.845 1.00 50.32 H new ATOM 0 HD1 PHE A 49 -8.435 -9.234 -3.919 1.00 10.33 H new ATOM 0 HD2 PHE A 49 -11.166 -6.897 -1.625 1.00 33.31 H new ATOM 0 HE1 PHE A 49 -7.192 -9.788 -1.875 1.00 24.13 H new ATOM 0 HE2 PHE A 49 -9.931 -7.463 0.423 1.00 44.12 H new ATOM 0 HZ PHE A 49 -7.940 -8.908 0.301 1.00 40.14 H new ATOM 767 N ASN A 50 -8.618 -7.703 -6.332 1.00 65.12 N ATOM 768 CA ASN A 50 -7.315 -8.102 -6.891 1.00 4.21 C ATOM 769 C ASN A 50 -6.695 -7.027 -7.807 1.00 50.13 C ATOM 770 O ASN A 50 -5.576 -7.192 -8.291 1.00 74.32 O ATOM 771 CB ASN A 50 -7.468 -9.416 -7.665 1.00 52.02 C ATOM 772 CG ASN A 50 -7.903 -10.567 -6.776 1.00 71.34 C ATOM 773 OD1 ASN A 50 -7.551 -10.634 -5.602 1.00 35.34 O ATOM 774 ND2 ASN A 50 -8.677 -11.481 -7.323 1.00 4.44 N ATOM 0 H ASN A 50 -9.398 -8.281 -6.646 1.00 65.12 H new ATOM 0 HA ASN A 50 -6.634 -8.231 -6.050 1.00 4.21 H new ATOM 0 HB2 ASN A 50 -8.198 -9.281 -8.463 1.00 52.02 H new ATOM 0 HB3 ASN A 50 -6.520 -9.667 -8.140 1.00 52.02 H new ATOM 0 HD21 ASN A 50 -9.001 -12.273 -6.768 1.00 4.44 H new ATOM 0 HD22 ASN A 50 -8.952 -11.397 -8.302 1.00 4.44 H new ATOM 781 N ALA A 51 -7.422 -5.938 -8.053 1.00 24.51 N ATOM 782 CA ALA A 51 -6.917 -4.850 -8.899 1.00 34.20 C ATOM 783 C ALA A 51 -6.202 -3.752 -8.088 1.00 41.44 C ATOM 784 O ALA A 51 -5.249 -3.143 -8.571 1.00 15.24 O ATOM 785 CB ALA A 51 -8.054 -4.239 -9.713 1.00 51.25 C ATOM 0 H ALA A 51 -8.359 -5.783 -7.682 1.00 24.51 H new ATOM 0 HA ALA A 51 -6.179 -5.289 -9.571 1.00 34.20 H new ATOM 0 HB1 ALA A 51 -7.664 -3.434 -10.335 1.00 51.25 H new ATOM 0 HB2 ALA A 51 -8.499 -5.005 -10.348 1.00 51.25 H new ATOM 0 HB3 ALA A 51 -8.812 -3.841 -9.038 1.00 51.25 H new ATOM 791 N VAL A 52 -6.658 -3.505 -6.855 1.00 64.42 N ATOM 792 CA VAL A 52 -6.133 -2.385 -6.045 1.00 63.11 C ATOM 793 C VAL A 52 -5.708 -2.811 -4.624 1.00 40.43 C ATOM 794 O VAL A 52 -5.580 -1.971 -3.733 1.00 13.13 O ATOM 795 CB VAL A 52 -7.181 -1.242 -5.935 1.00 13.44 C ATOM 796 CG1 VAL A 52 -7.493 -0.654 -7.311 1.00 23.20 C ATOM 797 CG2 VAL A 52 -8.456 -1.737 -5.253 1.00 21.30 C ATOM 0 H VAL A 52 -7.382 -4.056 -6.394 1.00 64.42 H new ATOM 0 HA VAL A 52 -5.244 -2.033 -6.568 1.00 63.11 H new ATOM 0 HB VAL A 52 -6.754 -0.451 -5.319 1.00 13.44 H new ATOM 0 HG11 VAL A 52 -8.229 0.144 -7.208 1.00 23.20 H new ATOM 0 HG12 VAL A 52 -6.580 -0.251 -7.750 1.00 23.20 H new ATOM 0 HG13 VAL A 52 -7.893 -1.435 -7.958 1.00 23.20 H new ATOM 0 HG21 VAL A 52 -9.174 -0.920 -5.187 1.00 21.30 H new ATOM 0 HG22 VAL A 52 -8.886 -2.553 -5.834 1.00 21.30 H new ATOM 0 HG23 VAL A 52 -8.218 -2.092 -4.250 1.00 21.30 H new ATOM 807 N ASN A 53 -5.461 -4.103 -4.419 1.00 52.10 N ATOM 808 CA ASN A 53 -5.093 -4.620 -3.086 1.00 62.05 C ATOM 809 C ASN A 53 -3.590 -4.917 -2.947 1.00 32.53 C ATOM 810 O ASN A 53 -3.182 -5.661 -2.057 1.00 13.04 O ATOM 811 CB ASN A 53 -5.913 -5.880 -2.776 1.00 61.33 C ATOM 812 CG ASN A 53 -7.207 -5.558 -2.057 1.00 62.03 C ATOM 813 OD1 ASN A 53 -7.325 -5.757 -0.853 1.00 5.02 O ATOM 814 ND2 ASN A 53 -8.173 -5.009 -2.767 1.00 41.13 N ATOM 0 H ASN A 53 -5.506 -4.814 -5.149 1.00 52.10 H new ATOM 0 HA ASN A 53 -5.322 -3.836 -2.364 1.00 62.05 H new ATOM 0 HB2 ASN A 53 -6.136 -6.404 -3.705 1.00 61.33 H new ATOM 0 HB3 ASN A 53 -5.318 -6.557 -2.164 1.00 61.33 H new ATOM 0 HD21 ASN A 53 -9.047 -4.738 -2.316 1.00 41.13 H new ATOM 0 HD22 ASN A 53 -8.047 -4.855 -3.767 1.00 41.13 H new ATOM 821 N TYR A 54 -2.763 -4.306 -3.785 1.00 52.34 N ATOM 822 CA TYR A 54 -1.316 -4.569 -3.764 1.00 31.35 C ATOM 823 C TYR A 54 -0.492 -3.292 -3.989 1.00 64.14 C ATOM 824 O TYR A 54 -0.979 -2.310 -4.549 1.00 43.54 O ATOM 825 CB TYR A 54 -0.963 -5.611 -4.834 1.00 52.33 C ATOM 826 CG TYR A 54 -1.410 -5.216 -6.230 1.00 64.23 C ATOM 827 CD1 TYR A 54 -0.598 -4.443 -7.054 1.00 70.41 C ATOM 828 CD2 TYR A 54 -2.654 -5.600 -6.713 1.00 5.43 C ATOM 829 CE1 TYR A 54 -1.017 -4.063 -8.315 1.00 64.33 C ATOM 830 CE2 TYR A 54 -3.075 -5.230 -7.972 1.00 71.15 C ATOM 831 CZ TYR A 54 -2.257 -4.461 -8.768 1.00 13.53 C ATOM 832 OH TYR A 54 -2.690 -4.080 -10.018 1.00 41.42 O ATOM 0 H TYR A 54 -3.059 -3.628 -4.487 1.00 52.34 H new ATOM 0 HA TYR A 54 -1.065 -4.951 -2.774 1.00 31.35 H new ATOM 0 HB2 TYR A 54 0.116 -5.767 -4.836 1.00 52.33 H new ATOM 0 HB3 TYR A 54 -1.423 -6.563 -4.569 1.00 52.33 H new ATOM 0 HD1 TYR A 54 0.376 -4.135 -6.702 1.00 70.41 H new ATOM 0 HD2 TYR A 54 -3.303 -6.199 -6.091 1.00 5.43 H new ATOM 0 HE1 TYR A 54 -0.378 -3.459 -8.941 1.00 64.33 H new ATOM 0 HE2 TYR A 54 -4.044 -5.543 -8.333 1.00 71.15 H new ATOM 0 HH TYR A 54 -3.585 -3.688 -9.949 1.00 41.42 H new ATOM 842 N ALA A 55 0.765 -3.328 -3.557 1.00 20.04 N ATOM 843 CA ALA A 55 1.702 -2.221 -3.774 1.00 72.51 C ATOM 844 C ALA A 55 3.022 -2.731 -4.367 1.00 11.24 C ATOM 845 O ALA A 55 3.523 -3.779 -3.964 1.00 4.40 O ATOM 846 CB ALA A 55 1.960 -1.486 -2.462 1.00 13.25 C ATOM 0 H ALA A 55 1.165 -4.118 -3.050 1.00 20.04 H new ATOM 0 HA ALA A 55 1.255 -1.527 -4.486 1.00 72.51 H new ATOM 0 HB1 ALA A 55 2.657 -0.666 -2.635 1.00 13.25 H new ATOM 0 HB2 ALA A 55 1.021 -1.089 -2.077 1.00 13.25 H new ATOM 0 HB3 ALA A 55 2.387 -2.177 -1.735 1.00 13.25 H new ATOM 852 N GLU A 56 3.575 -2.000 -5.330 1.00 33.34 N ATOM 853 CA GLU A 56 4.854 -2.373 -5.945 1.00 4.25 C ATOM 854 C GLU A 56 6.035 -1.671 -5.252 1.00 40.11 C ATOM 855 O GLU A 56 6.182 -0.451 -5.344 1.00 22.33 O ATOM 856 CB GLU A 56 4.854 -2.032 -7.444 1.00 33.11 C ATOM 857 CG GLU A 56 3.801 -2.782 -8.256 1.00 2.30 C ATOM 858 CD GLU A 56 3.964 -2.598 -9.761 1.00 61.34 C ATOM 859 OE1 GLU A 56 4.741 -3.359 -10.384 1.00 62.12 O ATOM 860 OE2 GLU A 56 3.316 -1.696 -10.334 1.00 71.40 O ATOM 0 H GLU A 56 3.162 -1.146 -5.704 1.00 33.34 H new ATOM 0 HA GLU A 56 4.974 -3.449 -5.823 1.00 4.25 H new ATOM 0 HB2 GLU A 56 4.692 -0.961 -7.561 1.00 33.11 H new ATOM 0 HB3 GLU A 56 5.839 -2.253 -7.855 1.00 33.11 H new ATOM 0 HG2 GLU A 56 3.856 -3.844 -8.018 1.00 2.30 H new ATOM 0 HG3 GLU A 56 2.810 -2.439 -7.959 1.00 2.30 H new ATOM 867 N ILE A 57 6.876 -2.452 -4.570 1.00 55.25 N ATOM 868 CA ILE A 57 8.050 -1.918 -3.865 1.00 11.30 C ATOM 869 C ILE A 57 9.354 -2.341 -4.575 1.00 50.55 C ATOM 870 O ILE A 57 9.434 -3.434 -5.139 1.00 13.24 O ATOM 871 CB ILE A 57 8.111 -2.403 -2.384 1.00 12.01 C ATOM 872 CG1 ILE A 57 6.796 -2.102 -1.630 1.00 30.01 C ATOM 873 CG2 ILE A 57 9.294 -1.768 -1.658 1.00 20.42 C ATOM 874 CD1 ILE A 57 5.704 -3.127 -1.854 1.00 53.21 C ATOM 0 H ILE A 57 6.767 -3.463 -4.489 1.00 55.25 H new ATOM 0 HA ILE A 57 7.953 -0.832 -3.877 1.00 11.30 H new ATOM 0 HB ILE A 57 8.246 -3.484 -2.400 1.00 12.01 H new ATOM 0 HG12 ILE A 57 7.008 -2.041 -0.563 1.00 30.01 H new ATOM 0 HG13 ILE A 57 6.429 -1.123 -1.939 1.00 30.01 H new ATOM 0 HG21 ILE A 57 9.319 -2.119 -0.626 1.00 20.42 H new ATOM 0 HG22 ILE A 57 10.221 -2.047 -2.159 1.00 20.42 H new ATOM 0 HG23 ILE A 57 9.188 -0.683 -1.670 1.00 20.42 H new ATOM 0 HD11 ILE A 57 4.816 -2.842 -1.290 1.00 53.21 H new ATOM 0 HD12 ILE A 57 5.461 -3.173 -2.915 1.00 53.21 H new ATOM 0 HD13 ILE A 57 6.048 -4.105 -1.518 1.00 53.21 H new ATOM 886 N ASN A 58 10.365 -1.473 -4.548 1.00 30.45 N ATOM 887 CA ASN A 58 11.658 -1.759 -5.187 1.00 53.34 C ATOM 888 C ASN A 58 12.411 -2.886 -4.453 1.00 4.23 C ATOM 889 O ASN A 58 12.364 -2.981 -3.227 1.00 22.20 O ATOM 890 CB ASN A 58 12.502 -0.475 -5.222 1.00 72.31 C ATOM 891 CG ASN A 58 13.815 -0.624 -5.986 1.00 14.04 C ATOM 892 OD1 ASN A 58 14.488 -1.648 -5.925 1.00 62.32 O ATOM 893 ND2 ASN A 58 14.175 0.392 -6.736 1.00 24.34 N ATOM 0 H ASN A 58 10.317 -0.563 -4.090 1.00 30.45 H new ATOM 0 HA ASN A 58 11.476 -2.102 -6.206 1.00 53.34 H new ATOM 0 HB2 ASN A 58 11.915 0.323 -5.678 1.00 72.31 H new ATOM 0 HB3 ASN A 58 12.720 -0.166 -4.200 1.00 72.31 H new ATOM 0 HD21 ASN A 58 15.033 0.341 -7.286 1.00 24.34 H new ATOM 0 HD22 ASN A 58 13.597 1.232 -6.769 1.00 24.34 H new ATOM 900 N GLU A 59 13.118 -3.721 -5.222 1.00 74.42 N ATOM 901 CA GLU A 59 13.901 -4.845 -4.681 1.00 61.11 C ATOM 902 C GLU A 59 14.776 -4.424 -3.483 1.00 2.01 C ATOM 903 O GLU A 59 14.904 -5.158 -2.501 1.00 44.33 O ATOM 904 CB GLU A 59 14.789 -5.421 -5.789 1.00 51.24 C ATOM 905 CG GLU A 59 15.632 -6.613 -5.357 1.00 4.32 C ATOM 906 CD GLU A 59 14.807 -7.864 -5.101 1.00 71.23 C ATOM 907 OE1 GLU A 59 14.257 -8.005 -3.993 1.00 31.11 O ATOM 908 OE2 GLU A 59 14.701 -8.713 -6.008 1.00 51.24 O ATOM 0 H GLU A 59 13.166 -3.639 -6.238 1.00 74.42 H new ATOM 0 HA GLU A 59 13.199 -5.598 -4.323 1.00 61.11 H new ATOM 0 HB2 GLU A 59 14.158 -5.721 -6.626 1.00 51.24 H new ATOM 0 HB3 GLU A 59 15.451 -4.636 -6.154 1.00 51.24 H new ATOM 0 HG2 GLU A 59 16.373 -6.825 -6.128 1.00 4.32 H new ATOM 0 HG3 GLU A 59 16.180 -6.354 -4.451 1.00 4.32 H new ATOM 915 N GLU A 60 15.374 -3.240 -3.573 1.00 41.15 N ATOM 916 CA GLU A 60 16.226 -2.716 -2.500 1.00 10.15 C ATOM 917 C GLU A 60 15.455 -2.607 -1.174 1.00 74.23 C ATOM 918 O GLU A 60 15.870 -3.154 -0.149 1.00 15.15 O ATOM 919 CB GLU A 60 16.787 -1.342 -2.894 1.00 23.12 C ATOM 920 CG GLU A 60 17.452 -1.314 -4.265 1.00 4.23 C ATOM 921 CD GLU A 60 18.493 -2.405 -4.436 1.00 21.02 C ATOM 922 OE1 GLU A 60 19.601 -2.268 -3.874 1.00 30.12 O ATOM 923 OE2 GLU A 60 18.211 -3.404 -5.135 1.00 22.32 O ATOM 0 H GLU A 60 15.287 -2.621 -4.379 1.00 41.15 H new ATOM 0 HA GLU A 60 17.050 -3.415 -2.356 1.00 10.15 H new ATOM 0 HB2 GLU A 60 15.977 -0.613 -2.879 1.00 23.12 H new ATOM 0 HB3 GLU A 60 17.512 -1.028 -2.143 1.00 23.12 H new ATOM 0 HG2 GLU A 60 16.689 -1.422 -5.036 1.00 4.23 H new ATOM 0 HG3 GLU A 60 17.922 -0.342 -4.416 1.00 4.23 H new ATOM 930 N ASP A 61 14.321 -1.908 -1.208 1.00 73.21 N ATOM 931 CA ASP A 61 13.472 -1.748 -0.024 1.00 31.41 C ATOM 932 C ASP A 61 12.860 -3.098 0.401 1.00 61.33 C ATOM 933 O ASP A 61 12.670 -3.368 1.589 1.00 34.22 O ATOM 934 CB ASP A 61 12.363 -0.728 -0.308 1.00 15.44 C ATOM 935 CG ASP A 61 12.912 0.604 -0.794 1.00 31.21 C ATOM 936 OD1 ASP A 61 13.540 1.324 0.011 1.00 51.30 O ATOM 937 OD2 ASP A 61 12.732 0.931 -1.985 1.00 5.10 O ATOM 0 H ASP A 61 13.967 -1.442 -2.043 1.00 73.21 H new ATOM 0 HA ASP A 61 14.090 -1.383 0.796 1.00 31.41 H new ATOM 0 HB2 ASP A 61 11.684 -1.133 -1.058 1.00 15.44 H new ATOM 0 HB3 ASP A 61 11.779 -0.568 0.598 1.00 15.44 H new ATOM 942 N TRP A 62 12.573 -3.941 -0.592 1.00 4.42 N ATOM 943 CA TRP A 62 12.023 -5.282 -0.368 1.00 60.23 C ATOM 944 C TRP A 62 12.899 -6.094 0.601 1.00 71.22 C ATOM 945 O TRP A 62 12.416 -6.598 1.622 1.00 5.51 O ATOM 946 CB TRP A 62 11.910 -6.009 -1.719 1.00 22.52 C ATOM 947 CG TRP A 62 11.264 -7.361 -1.648 1.00 12.02 C ATOM 948 CD1 TRP A 62 11.871 -8.555 -1.373 1.00 52.10 C ATOM 949 CD2 TRP A 62 9.883 -7.655 -1.877 1.00 73.44 C ATOM 950 NE1 TRP A 62 10.948 -9.569 -1.408 1.00 70.23 N ATOM 951 CE2 TRP A 62 9.722 -9.042 -1.717 1.00 2.01 C ATOM 952 CE3 TRP A 62 8.763 -6.877 -2.198 1.00 73.24 C ATOM 953 CZ2 TRP A 62 8.490 -9.668 -1.867 1.00 60.11 C ATOM 954 CZ3 TRP A 62 7.542 -7.503 -2.345 1.00 41.23 C ATOM 955 CH2 TRP A 62 7.414 -8.885 -2.181 1.00 65.54 C ATOM 0 H TRP A 62 12.715 -3.714 -1.576 1.00 4.42 H new ATOM 0 HA TRP A 62 11.037 -5.184 0.086 1.00 60.23 H new ATOM 0 HB2 TRP A 62 11.340 -5.384 -2.407 1.00 22.52 H new ATOM 0 HB3 TRP A 62 12.908 -6.120 -2.142 1.00 22.52 H new ATOM 0 HD1 TRP A 62 12.922 -8.681 -1.160 1.00 52.10 H new ATOM 0 HE1 TRP A 62 11.143 -10.555 -1.233 1.00 70.23 H new ATOM 0 HE3 TRP A 62 8.853 -5.809 -2.328 1.00 73.24 H new ATOM 0 HZ2 TRP A 62 8.386 -10.735 -1.740 1.00 60.11 H new ATOM 0 HZ3 TRP A 62 6.670 -6.915 -2.591 1.00 41.23 H new ATOM 0 HH2 TRP A 62 6.444 -9.344 -2.305 1.00 65.54 H new ATOM 966 N ASN A 63 14.189 -6.204 0.287 1.00 42.03 N ATOM 967 CA ASN A 63 15.133 -6.926 1.149 1.00 71.42 C ATOM 968 C ASN A 63 15.384 -6.177 2.468 1.00 64.33 C ATOM 969 O ASN A 63 15.531 -6.796 3.524 1.00 2.02 O ATOM 970 CB ASN A 63 16.459 -7.162 0.413 1.00 65.23 C ATOM 971 CG ASN A 63 16.314 -8.147 -0.732 1.00 74.40 C ATOM 972 OD1 ASN A 63 16.471 -9.349 -0.554 1.00 73.41 O ATOM 973 ND2 ASN A 63 16.010 -7.649 -1.909 1.00 44.41 N ATOM 0 H ASN A 63 14.606 -5.805 -0.554 1.00 42.03 H new ATOM 0 HA ASN A 63 14.685 -7.889 1.393 1.00 71.42 H new ATOM 0 HB2 ASN A 63 16.832 -6.213 0.028 1.00 65.23 H new ATOM 0 HB3 ASN A 63 17.202 -7.534 1.118 1.00 65.23 H new ATOM 0 HD21 ASN A 63 15.897 -8.269 -2.711 1.00 44.41 H new ATOM 0 HD22 ASN A 63 15.887 -6.643 -2.021 1.00 44.41 H new ATOM 980 N ALA A 64 15.419 -4.845 2.406 1.00 71.12 N ATOM 981 CA ALA A 64 15.626 -4.014 3.600 1.00 55.51 C ATOM 982 C ALA A 64 14.530 -4.244 4.656 1.00 1.04 C ATOM 983 O ALA A 64 14.786 -4.183 5.859 1.00 55.24 O ATOM 984 CB ALA A 64 15.685 -2.542 3.213 1.00 5.40 C ATOM 0 H ALA A 64 15.307 -4.315 1.542 1.00 71.12 H new ATOM 0 HA ALA A 64 16.577 -4.308 4.045 1.00 55.51 H new ATOM 0 HB1 ALA A 64 15.839 -1.937 4.106 1.00 5.40 H new ATOM 0 HB2 ALA A 64 16.510 -2.381 2.519 1.00 5.40 H new ATOM 0 HB3 ALA A 64 14.748 -2.253 2.736 1.00 5.40 H new ATOM 990 N LEU A 65 13.306 -4.496 4.196 1.00 41.33 N ATOM 991 CA LEU A 65 12.182 -4.794 5.093 1.00 74.31 C ATOM 992 C LEU A 65 12.045 -6.304 5.353 1.00 71.32 C ATOM 993 O LEU A 65 11.311 -6.721 6.251 1.00 24.34 O ATOM 994 CB LEU A 65 10.879 -4.248 4.497 1.00 71.35 C ATOM 995 CG LEU A 65 10.824 -2.719 4.335 1.00 11.31 C ATOM 996 CD1 LEU A 65 9.569 -2.297 3.577 1.00 23.51 C ATOM 997 CD2 LEU A 65 10.890 -2.032 5.698 1.00 42.00 C ATOM 0 H LEU A 65 13.063 -4.501 3.205 1.00 41.33 H new ATOM 0 HA LEU A 65 12.382 -4.308 6.048 1.00 74.31 H new ATOM 0 HB2 LEU A 65 10.724 -4.707 3.520 1.00 71.35 H new ATOM 0 HB3 LEU A 65 10.049 -4.560 5.131 1.00 71.35 H new ATOM 0 HG LEU A 65 11.690 -2.407 3.752 1.00 11.31 H new ATOM 0 HD11 LEU A 65 9.553 -1.212 3.475 1.00 23.51 H new ATOM 0 HD12 LEU A 65 9.571 -2.754 2.588 1.00 23.51 H new ATOM 0 HD13 LEU A 65 8.686 -2.623 4.126 1.00 23.51 H new ATOM 0 HD21 LEU A 65 10.850 -0.951 5.563 1.00 42.00 H new ATOM 0 HD22 LEU A 65 10.046 -2.353 6.309 1.00 42.00 H new ATOM 0 HD23 LEU A 65 11.821 -2.301 6.196 1.00 42.00 H new ATOM 1009 N GLY A 66 12.756 -7.117 4.570 1.00 43.34 N ATOM 1010 CA GLY A 66 12.658 -8.570 4.702 1.00 62.13 C ATOM 1011 C GLY A 66 11.314 -9.114 4.227 1.00 54.31 C ATOM 1012 O GLY A 66 10.681 -9.929 4.901 1.00 70.12 O ATOM 0 H GLY A 66 13.399 -6.798 3.845 1.00 43.34 H new ATOM 0 HA2 GLY A 66 13.458 -9.038 4.128 1.00 62.13 H new ATOM 0 HA3 GLY A 66 12.810 -8.847 5.745 1.00 62.13 H new ATOM 1016 N LEU A 67 10.876 -8.657 3.062 1.00 41.42 N ATOM 1017 CA LEU A 67 9.580 -9.059 2.511 1.00 73.40 C ATOM 1018 C LEU A 67 9.676 -10.358 1.700 1.00 51.12 C ATOM 1019 O LEU A 67 10.748 -10.755 1.241 1.00 32.50 O ATOM 1020 CB LEU A 67 9.007 -7.937 1.637 1.00 34.13 C ATOM 1021 CG LEU A 67 8.670 -6.634 2.379 1.00 64.13 C ATOM 1022 CD1 LEU A 67 8.152 -5.574 1.410 1.00 13.32 C ATOM 1023 CD2 LEU A 67 7.655 -6.898 3.491 1.00 23.23 C ATOM 0 H LEU A 67 11.398 -8.006 2.475 1.00 41.42 H new ATOM 0 HA LEU A 67 8.912 -9.245 3.352 1.00 73.40 H new ATOM 0 HB2 LEU A 67 9.724 -7.711 0.848 1.00 34.13 H new ATOM 0 HB3 LEU A 67 8.103 -8.303 1.151 1.00 34.13 H new ATOM 0 HG LEU A 67 9.585 -6.253 2.834 1.00 64.13 H new ATOM 0 HD11 LEU A 67 7.920 -4.661 1.959 1.00 13.32 H new ATOM 0 HD12 LEU A 67 8.914 -5.363 0.660 1.00 13.32 H new ATOM 0 HD13 LEU A 67 7.251 -5.940 0.918 1.00 13.32 H new ATOM 0 HD21 LEU A 67 7.428 -5.964 4.006 1.00 23.23 H new ATOM 0 HD22 LEU A 67 6.741 -7.306 3.060 1.00 23.23 H new ATOM 0 HD23 LEU A 67 8.071 -7.612 4.202 1.00 23.23 H new ATOM 1035 N GLN A 68 8.533 -11.004 1.534 1.00 74.41 N ATOM 1036 CA GLN A 68 8.416 -12.237 0.762 1.00 44.34 C ATOM 1037 C GLN A 68 7.109 -12.207 -0.037 1.00 4.21 C ATOM 1038 O GLN A 68 6.059 -11.839 0.491 1.00 13.33 O ATOM 1039 CB GLN A 68 8.439 -13.455 1.698 1.00 2.11 C ATOM 1040 CG GLN A 68 8.320 -14.796 0.982 1.00 22.44 C ATOM 1041 CD GLN A 68 8.260 -15.976 1.940 1.00 35.45 C ATOM 1042 OE1 GLN A 68 8.819 -15.948 3.031 1.00 13.54 O ATOM 1043 NE2 GLN A 68 7.565 -17.020 1.547 1.00 3.31 N ATOM 0 H GLN A 68 7.650 -10.686 1.934 1.00 74.41 H new ATOM 0 HA GLN A 68 9.259 -12.317 0.076 1.00 44.34 H new ATOM 0 HB2 GLN A 68 9.367 -13.442 2.270 1.00 2.11 H new ATOM 0 HB3 GLN A 68 7.622 -13.364 2.414 1.00 2.11 H new ATOM 0 HG2 GLN A 68 7.424 -14.792 0.362 1.00 22.44 H new ATOM 0 HG3 GLN A 68 9.171 -14.921 0.312 1.00 22.44 H new ATOM 0 HE21 GLN A 68 7.110 -17.016 0.634 1.00 3.31 H new ATOM 0 HE22 GLN A 68 7.480 -17.835 2.155 1.00 3.31 H new ATOM 1052 N GLU A 69 7.172 -12.581 -1.305 1.00 64.22 N ATOM 1053 CA GLU A 69 6.014 -12.470 -2.193 1.00 12.35 C ATOM 1054 C GLU A 69 4.795 -13.215 -1.645 1.00 13.41 C ATOM 1055 O GLU A 69 4.666 -14.432 -1.783 1.00 4.22 O ATOM 1056 CB GLU A 69 6.384 -12.954 -3.593 1.00 12.23 C ATOM 1057 CG GLU A 69 7.403 -12.048 -4.261 1.00 11.13 C ATOM 1058 CD GLU A 69 7.938 -12.608 -5.567 1.00 60.22 C ATOM 1059 OE1 GLU A 69 7.249 -12.482 -6.600 1.00 51.10 O ATOM 1060 OE2 GLU A 69 9.045 -13.191 -5.563 1.00 74.05 O ATOM 0 H GLU A 69 8.008 -12.964 -1.746 1.00 64.22 H new ATOM 0 HA GLU A 69 5.731 -11.419 -2.250 1.00 12.35 H new ATOM 0 HB2 GLU A 69 6.785 -13.966 -3.532 1.00 12.23 H new ATOM 0 HB3 GLU A 69 5.485 -13.003 -4.208 1.00 12.23 H new ATOM 0 HG2 GLU A 69 6.947 -11.076 -4.450 1.00 11.13 H new ATOM 0 HG3 GLU A 69 8.235 -11.882 -3.577 1.00 11.13 H new ATOM 1067 N GLY A 70 3.915 -12.459 -0.999 1.00 54.24 N ATOM 1068 CA GLY A 70 2.729 -13.039 -0.389 1.00 15.03 C ATOM 1069 C GLY A 70 2.330 -12.387 0.936 1.00 32.13 C ATOM 1070 O GLY A 70 1.166 -12.472 1.335 1.00 21.42 O ATOM 0 H GLY A 70 4.001 -11.449 -0.885 1.00 54.24 H new ATOM 0 HA2 GLY A 70 1.896 -12.957 -1.088 1.00 15.03 H new ATOM 0 HA3 GLY A 70 2.902 -14.102 -0.222 1.00 15.03 H new ATOM 1074 N ASP A 71 3.274 -11.735 1.633 1.00 34.24 N ATOM 1075 CA ASP A 71 2.947 -11.129 2.941 1.00 1.33 C ATOM 1076 C ASP A 71 2.373 -9.708 2.808 1.00 42.41 C ATOM 1077 O ASP A 71 2.250 -9.167 1.704 1.00 52.23 O ATOM 1078 CB ASP A 71 4.136 -11.155 3.924 1.00 34.04 C ATOM 1079 CG ASP A 71 5.390 -10.459 3.439 1.00 4.33 C ATOM 1080 OD1 ASP A 71 5.428 -9.218 3.422 1.00 45.02 O ATOM 1081 OD2 ASP A 71 6.375 -11.160 3.150 1.00 71.42 O ATOM 0 H ASP A 71 4.240 -11.614 1.329 1.00 34.24 H new ATOM 0 HA ASP A 71 2.164 -11.758 3.364 1.00 1.33 H new ATOM 0 HB2 ASP A 71 3.823 -10.693 4.860 1.00 34.04 H new ATOM 0 HB3 ASP A 71 4.380 -12.194 4.147 1.00 34.04 H new ATOM 1086 N ARG A 72 2.017 -9.117 3.948 1.00 35.43 N ATOM 1087 CA ARG A 72 1.258 -7.863 3.974 1.00 40.32 C ATOM 1088 C ARG A 72 2.113 -6.683 4.458 1.00 11.41 C ATOM 1089 O ARG A 72 2.895 -6.806 5.405 1.00 64.12 O ATOM 1090 CB ARG A 72 0.040 -8.013 4.895 1.00 3.45 C ATOM 1091 CG ARG A 72 -0.684 -9.348 4.754 1.00 2.15 C ATOM 1092 CD ARG A 72 -1.966 -9.385 5.578 1.00 45.33 C ATOM 1093 NE ARG A 72 -2.553 -10.723 5.662 1.00 65.33 N ATOM 1094 CZ ARG A 72 -3.369 -11.239 4.779 1.00 14.31 C ATOM 1095 NH1 ARG A 72 -3.637 -10.618 3.676 1.00 42.33 N ATOM 1096 NH2 ARG A 72 -3.896 -12.396 4.993 1.00 43.21 N ATOM 0 H ARG A 72 2.243 -9.487 4.871 1.00 35.43 H new ATOM 0 HA ARG A 72 0.939 -7.653 2.953 1.00 40.32 H new ATOM 0 HB2 ARG A 72 0.363 -7.894 5.929 1.00 3.45 H new ATOM 0 HB3 ARG A 72 -0.663 -7.206 4.685 1.00 3.45 H new ATOM 0 HG2 ARG A 72 -0.921 -9.524 3.705 1.00 2.15 H new ATOM 0 HG3 ARG A 72 -0.024 -10.155 5.072 1.00 2.15 H new ATOM 0 HD2 ARG A 72 -1.755 -9.023 6.584 1.00 45.33 H new ATOM 0 HD3 ARG A 72 -2.693 -8.702 5.139 1.00 45.33 H new ATOM 0 HE ARG A 72 -2.308 -11.296 6.469 1.00 65.33 H new ATOM 0 HH11 ARG A 72 -3.210 -9.712 3.484 1.00 42.33 H new ATOM 0 HH12 ARG A 72 -4.275 -11.035 2.998 1.00 42.33 H new ATOM 0 HH21 ARG A 72 -3.676 -12.906 5.849 1.00 43.21 H new ATOM 0 HH22 ARG A 72 -4.533 -12.801 4.307 1.00 43.21 H new ATOM 1110 N VAL A 73 1.932 -5.533 3.817 1.00 20.03 N ATOM 1111 CA VAL A 73 2.630 -4.303 4.199 1.00 33.31 C ATOM 1112 C VAL A 73 1.637 -3.169 4.493 1.00 3.03 C ATOM 1113 O VAL A 73 0.623 -3.017 3.803 1.00 33.43 O ATOM 1114 CB VAL A 73 3.619 -3.844 3.093 1.00 54.15 C ATOM 1115 CG1 VAL A 73 4.748 -4.856 2.927 1.00 10.44 C ATOM 1116 CG2 VAL A 73 2.894 -3.618 1.760 1.00 61.43 C ATOM 0 H VAL A 73 1.302 -5.424 3.022 1.00 20.03 H new ATOM 0 HA VAL A 73 3.193 -4.528 5.104 1.00 33.31 H new ATOM 0 HB VAL A 73 4.051 -2.893 3.404 1.00 54.15 H new ATOM 0 HG11 VAL A 73 5.430 -4.516 2.148 1.00 10.44 H new ATOM 0 HG12 VAL A 73 5.291 -4.953 3.867 1.00 10.44 H new ATOM 0 HG13 VAL A 73 4.331 -5.824 2.647 1.00 10.44 H new ATOM 0 HG21 VAL A 73 3.612 -3.297 1.005 1.00 61.43 H new ATOM 0 HG22 VAL A 73 2.422 -4.547 1.440 1.00 61.43 H new ATOM 0 HG23 VAL A 73 2.132 -2.849 1.886 1.00 61.43 H new ATOM 1126 N LYS A 74 1.923 -2.383 5.529 1.00 14.22 N ATOM 1127 CA LYS A 74 1.093 -1.223 5.872 1.00 73.51 C ATOM 1128 C LYS A 74 1.818 0.090 5.532 1.00 25.03 C ATOM 1129 O LYS A 74 2.981 0.282 5.890 1.00 42.13 O ATOM 1130 CB LYS A 74 0.718 -1.229 7.362 1.00 44.23 C ATOM 1131 CG LYS A 74 -0.207 -0.074 7.751 1.00 14.41 C ATOM 1132 CD LYS A 74 -0.389 0.059 9.262 1.00 13.30 C ATOM 1133 CE LYS A 74 -1.169 -1.098 9.868 1.00 61.52 C ATOM 1134 NZ LYS A 74 -1.522 -0.824 11.286 1.00 24.12 N ATOM 0 H LYS A 74 2.722 -2.526 6.147 1.00 14.22 H new ATOM 0 HA LYS A 74 0.181 -1.291 5.280 1.00 73.51 H new ATOM 0 HB2 LYS A 74 0.232 -2.174 7.605 1.00 44.23 H new ATOM 0 HB3 LYS A 74 1.628 -1.176 7.960 1.00 44.23 H new ATOM 0 HG2 LYS A 74 0.197 0.858 7.355 1.00 14.41 H new ATOM 0 HG3 LYS A 74 -1.181 -0.222 7.284 1.00 14.41 H new ATOM 0 HD2 LYS A 74 0.590 0.119 9.737 1.00 13.30 H new ATOM 0 HD3 LYS A 74 -0.907 0.993 9.480 1.00 13.30 H new ATOM 0 HE2 LYS A 74 -2.078 -1.269 9.291 1.00 61.52 H new ATOM 0 HE3 LYS A 74 -0.576 -2.011 9.808 1.00 61.52 H new ATOM 0 HZ1 LYS A 74 -1.947 -1.674 11.708 1.00 24.12 H new ATOM 0 HZ2 LYS A 74 -0.664 -0.568 11.814 1.00 24.12 H new ATOM 0 HZ3 LYS A 74 -2.202 -0.039 11.329 1.00 24.12 H new ATOM 1148 N VAL A 75 1.121 0.989 4.844 1.00 41.41 N ATOM 1149 CA VAL A 75 1.676 2.300 4.490 1.00 13.24 C ATOM 1150 C VAL A 75 1.044 3.415 5.341 1.00 54.10 C ATOM 1151 O VAL A 75 -0.178 3.485 5.471 1.00 41.21 O ATOM 1152 CB VAL A 75 1.451 2.613 2.988 1.00 23.53 C ATOM 1153 CG1 VAL A 75 2.081 3.952 2.607 1.00 22.41 C ATOM 1154 CG2 VAL A 75 1.993 1.486 2.109 1.00 2.05 C ATOM 0 H VAL A 75 0.167 0.837 4.517 1.00 41.41 H new ATOM 0 HA VAL A 75 2.747 2.262 4.690 1.00 13.24 H new ATOM 0 HB VAL A 75 0.377 2.687 2.818 1.00 23.53 H new ATOM 0 HG11 VAL A 75 1.909 4.147 1.549 1.00 22.41 H new ATOM 0 HG12 VAL A 75 1.631 4.748 3.201 1.00 22.41 H new ATOM 0 HG13 VAL A 75 3.153 3.918 2.800 1.00 22.41 H new ATOM 0 HG21 VAL A 75 1.823 1.729 1.060 1.00 2.05 H new ATOM 0 HG22 VAL A 75 3.062 1.369 2.286 1.00 2.05 H new ATOM 0 HG23 VAL A 75 1.481 0.556 2.353 1.00 2.05 H new ATOM 1164 N LYS A 76 1.883 4.270 5.933 1.00 2.25 N ATOM 1165 CA LYS A 76 1.406 5.414 6.730 1.00 31.15 C ATOM 1166 C LYS A 76 1.840 6.747 6.107 1.00 4.44 C ATOM 1167 O LYS A 76 3.020 6.958 5.815 1.00 13.40 O ATOM 1168 CB LYS A 76 1.917 5.350 8.186 1.00 54.43 C ATOM 1169 CG LYS A 76 1.224 4.306 9.064 1.00 32.33 C ATOM 1170 CD LYS A 76 1.652 2.882 8.730 1.00 32.01 C ATOM 1171 CE LYS A 76 3.106 2.624 9.093 1.00 2.34 C ATOM 1172 NZ LYS A 76 3.337 2.701 10.561 1.00 11.32 N ATOM 0 H LYS A 76 2.899 4.195 5.878 1.00 2.25 H new ATOM 0 HA LYS A 76 0.318 5.355 6.735 1.00 31.15 H new ATOM 0 HB2 LYS A 76 2.987 5.140 8.172 1.00 54.43 H new ATOM 0 HB3 LYS A 76 1.791 6.331 8.644 1.00 54.43 H new ATOM 0 HG2 LYS A 76 1.446 4.512 10.111 1.00 32.33 H new ATOM 0 HG3 LYS A 76 0.144 4.395 8.944 1.00 32.33 H new ATOM 0 HD2 LYS A 76 1.015 2.177 9.264 1.00 32.01 H new ATOM 0 HD3 LYS A 76 1.506 2.700 7.665 1.00 32.01 H new ATOM 0 HE2 LYS A 76 3.401 1.639 8.731 1.00 2.34 H new ATOM 0 HE3 LYS A 76 3.740 3.352 8.588 1.00 2.34 H new ATOM 0 HZ1 LYS A 76 4.072 2.017 10.833 1.00 11.32 H new ATOM 0 HZ2 LYS A 76 3.647 3.661 10.814 1.00 11.32 H new ATOM 0 HZ3 LYS A 76 2.454 2.479 11.064 1.00 11.32 H new ATOM 1186 N THR A 77 0.879 7.644 5.902 1.00 0.43 N ATOM 1187 CA THR A 77 1.167 8.998 5.408 1.00 40.31 C ATOM 1188 C THR A 77 0.375 10.040 6.202 1.00 62.13 C ATOM 1189 O THR A 77 -0.286 9.718 7.191 1.00 42.40 O ATOM 1190 CB THR A 77 0.812 9.173 3.908 1.00 53.41 C ATOM 1191 OG1 THR A 77 -0.615 9.222 3.742 1.00 44.13 O ATOM 1192 CG2 THR A 77 1.388 8.046 3.055 1.00 23.13 C ATOM 0 H THR A 77 -0.111 7.462 6.069 1.00 0.43 H new ATOM 0 HA THR A 77 2.240 9.143 5.536 1.00 40.31 H new ATOM 0 HB THR A 77 1.255 10.110 3.572 1.00 53.41 H new ATOM 0 HG1 THR A 77 -0.832 9.249 2.787 1.00 44.13 H new ATOM 0 HG21 THR A 77 1.117 8.205 2.011 1.00 23.13 H new ATOM 0 HG22 THR A 77 2.474 8.036 3.151 1.00 23.13 H new ATOM 0 HG23 THR A 77 0.985 7.091 3.393 1.00 23.13 H new ATOM 1200 N GLU A 78 0.430 11.290 5.752 1.00 63.20 N ATOM 1201 CA GLU A 78 -0.327 12.382 6.374 1.00 63.33 C ATOM 1202 C GLU A 78 -1.842 12.265 6.098 1.00 41.51 C ATOM 1203 O GLU A 78 -2.638 13.046 6.621 1.00 13.45 O ATOM 1204 CB GLU A 78 0.212 13.723 5.857 1.00 14.14 C ATOM 1205 CG GLU A 78 0.198 13.841 4.336 1.00 75.32 C ATOM 1206 CD GLU A 78 1.006 15.023 3.831 1.00 20.52 C ATOM 1207 OE1 GLU A 78 2.244 14.897 3.721 1.00 42.34 O ATOM 1208 OE2 GLU A 78 0.412 16.079 3.537 1.00 44.24 O ATOM 0 H GLU A 78 0.995 11.578 4.953 1.00 63.20 H new ATOM 0 HA GLU A 78 -0.196 12.320 7.454 1.00 63.33 H new ATOM 0 HB2 GLU A 78 -0.383 14.532 6.281 1.00 14.14 H new ATOM 0 HB3 GLU A 78 1.233 13.857 6.214 1.00 14.14 H new ATOM 0 HG2 GLU A 78 0.594 12.923 3.901 1.00 75.32 H new ATOM 0 HG3 GLU A 78 -0.832 13.938 3.993 1.00 75.32 H new ATOM 1215 N PHE A 79 -2.228 11.294 5.265 1.00 44.20 N ATOM 1216 CA PHE A 79 -3.647 11.043 4.958 1.00 43.02 C ATOM 1217 C PHE A 79 -4.214 9.865 5.771 1.00 30.02 C ATOM 1218 O PHE A 79 -5.431 9.744 5.937 1.00 31.10 O ATOM 1219 CB PHE A 79 -3.827 10.791 3.453 1.00 34.04 C ATOM 1220 CG PHE A 79 -3.571 12.013 2.607 1.00 12.03 C ATOM 1221 CD1 PHE A 79 -4.598 12.904 2.329 1.00 21.23 C ATOM 1222 CD2 PHE A 79 -2.305 12.281 2.100 1.00 42.43 C ATOM 1223 CE1 PHE A 79 -4.370 14.033 1.566 1.00 35.01 C ATOM 1224 CE2 PHE A 79 -2.075 13.412 1.339 1.00 33.04 C ATOM 1225 CZ PHE A 79 -3.107 14.287 1.071 1.00 51.55 C ATOM 0 H PHE A 79 -1.580 10.666 4.789 1.00 44.20 H new ATOM 0 HA PHE A 79 -4.207 11.933 5.243 1.00 43.02 H new ATOM 0 HB2 PHE A 79 -3.151 9.995 3.142 1.00 34.04 H new ATOM 0 HB3 PHE A 79 -4.842 10.437 3.270 1.00 34.04 H new ATOM 0 HD1 PHE A 79 -5.589 12.712 2.714 1.00 21.23 H new ATOM 0 HD2 PHE A 79 -1.493 11.599 2.303 1.00 42.43 H new ATOM 0 HE1 PHE A 79 -5.180 14.716 1.357 1.00 35.01 H new ATOM 0 HE2 PHE A 79 -1.086 13.611 0.954 1.00 33.04 H new ATOM 0 HZ PHE A 79 -2.927 15.169 0.475 1.00 51.55 H new ATOM 1235 N GLY A 80 -3.338 8.996 6.277 1.00 23.41 N ATOM 1236 CA GLY A 80 -3.784 7.860 7.081 1.00 11.54 C ATOM 1237 C GLY A 80 -2.912 6.618 6.904 1.00 1.00 C ATOM 1238 O GLY A 80 -1.722 6.724 6.609 1.00 43.44 O ATOM 0 H GLY A 80 -2.328 9.056 6.146 1.00 23.41 H new ATOM 0 HA2 GLY A 80 -3.788 8.147 8.133 1.00 11.54 H new ATOM 0 HA3 GLY A 80 -4.812 7.615 6.814 1.00 11.54 H new ATOM 1242 N GLU A 81 -3.509 5.438 7.089 1.00 24.31 N ATOM 1243 CA GLU A 81 -2.791 4.161 6.934 1.00 35.14 C ATOM 1244 C GLU A 81 -3.666 3.101 6.244 1.00 41.33 C ATOM 1245 O GLU A 81 -4.888 3.107 6.381 1.00 44.34 O ATOM 1246 CB GLU A 81 -2.324 3.624 8.300 1.00 53.34 C ATOM 1247 CG GLU A 81 -3.458 3.304 9.275 1.00 24.22 C ATOM 1248 CD GLU A 81 -2.985 2.536 10.505 1.00 10.31 C ATOM 1249 OE1 GLU A 81 -2.319 3.139 11.371 1.00 54.13 O ATOM 1250 OE2 GLU A 81 -3.269 1.321 10.607 1.00 21.21 O ATOM 0 H GLU A 81 -4.490 5.336 7.347 1.00 24.31 H new ATOM 0 HA GLU A 81 -1.922 4.358 6.307 1.00 35.14 H new ATOM 0 HB2 GLU A 81 -1.734 2.722 8.139 1.00 53.34 H new ATOM 0 HB3 GLU A 81 -1.663 4.359 8.759 1.00 53.34 H new ATOM 0 HG2 GLU A 81 -3.930 4.234 9.593 1.00 24.22 H new ATOM 0 HG3 GLU A 81 -4.220 2.720 8.759 1.00 24.22 H new ATOM 1257 N VAL A 82 -3.029 2.189 5.511 1.00 62.24 N ATOM 1258 CA VAL A 82 -3.743 1.090 4.842 1.00 73.22 C ATOM 1259 C VAL A 82 -2.857 -0.167 4.739 1.00 5.30 C ATOM 1260 O VAL A 82 -1.632 -0.067 4.640 1.00 64.22 O ATOM 1261 CB VAL A 82 -4.223 1.505 3.425 1.00 74.22 C ATOM 1262 CG1 VAL A 82 -3.037 1.768 2.496 1.00 54.23 C ATOM 1263 CG2 VAL A 82 -5.170 0.455 2.836 1.00 10.10 C ATOM 0 H VAL A 82 -2.020 2.185 5.362 1.00 62.24 H new ATOM 0 HA VAL A 82 -4.616 0.859 5.452 1.00 73.22 H new ATOM 0 HB VAL A 82 -4.780 2.437 3.520 1.00 74.22 H new ATOM 0 HG11 VAL A 82 -3.403 2.057 1.511 1.00 54.23 H new ATOM 0 HG12 VAL A 82 -2.425 2.572 2.906 1.00 54.23 H new ATOM 0 HG13 VAL A 82 -2.436 0.863 2.409 1.00 54.23 H new ATOM 0 HG21 VAL A 82 -5.491 0.771 1.843 1.00 10.10 H new ATOM 0 HG22 VAL A 82 -4.652 -0.502 2.763 1.00 10.10 H new ATOM 0 HG23 VAL A 82 -6.041 0.348 3.482 1.00 10.10 H new ATOM 1273 N VAL A 83 -3.481 -1.348 4.777 1.00 41.41 N ATOM 1274 CA VAL A 83 -2.748 -2.621 4.683 1.00 54.44 C ATOM 1275 C VAL A 83 -3.060 -3.351 3.365 1.00 53.34 C ATOM 1276 O VAL A 83 -4.208 -3.739 3.118 1.00 4.14 O ATOM 1277 CB VAL A 83 -3.093 -3.563 5.864 1.00 5.31 C ATOM 1278 CG1 VAL A 83 -2.205 -4.808 5.843 1.00 73.22 C ATOM 1279 CG2 VAL A 83 -2.982 -2.836 7.202 1.00 5.22 C ATOM 0 H VAL A 83 -4.491 -1.453 4.872 1.00 41.41 H new ATOM 0 HA VAL A 83 -1.688 -2.371 4.718 1.00 54.44 H new ATOM 0 HB VAL A 83 -4.128 -3.882 5.745 1.00 5.31 H new ATOM 0 HG11 VAL A 83 -2.465 -5.455 6.681 1.00 73.22 H new ATOM 0 HG12 VAL A 83 -2.357 -5.347 4.908 1.00 73.22 H new ATOM 0 HG13 VAL A 83 -1.160 -4.511 5.925 1.00 73.22 H new ATOM 0 HG21 VAL A 83 -3.230 -3.523 8.011 1.00 5.22 H new ATOM 0 HG22 VAL A 83 -1.963 -2.472 7.335 1.00 5.22 H new ATOM 0 HG23 VAL A 83 -3.673 -1.993 7.217 1.00 5.22 H new ATOM 1289 N VAL A 84 -2.031 -3.546 2.537 1.00 55.55 N ATOM 1290 CA VAL A 84 -2.177 -4.213 1.230 1.00 43.22 C ATOM 1291 C VAL A 84 -1.136 -5.338 1.045 1.00 44.45 C ATOM 1292 O VAL A 84 -0.277 -5.551 1.904 1.00 44.15 O ATOM 1293 CB VAL A 84 -2.037 -3.199 0.062 1.00 53.14 C ATOM 1294 CG1 VAL A 84 -3.147 -2.148 0.112 1.00 12.14 C ATOM 1295 CG2 VAL A 84 -0.661 -2.534 0.085 1.00 30.44 C ATOM 0 H VAL A 84 -1.077 -3.250 2.746 1.00 55.55 H new ATOM 0 HA VAL A 84 -3.176 -4.649 1.213 1.00 43.22 H new ATOM 0 HB VAL A 84 -2.136 -3.748 -0.874 1.00 53.14 H new ATOM 0 HG11 VAL A 84 -3.025 -1.451 -0.717 1.00 12.14 H new ATOM 0 HG12 VAL A 84 -4.117 -2.639 0.034 1.00 12.14 H new ATOM 0 HG13 VAL A 84 -3.091 -1.604 1.055 1.00 12.14 H new ATOM 0 HG21 VAL A 84 -0.584 -1.828 -0.742 1.00 30.44 H new ATOM 0 HG22 VAL A 84 -0.529 -2.004 1.028 1.00 30.44 H new ATOM 0 HG23 VAL A 84 0.113 -3.295 -0.015 1.00 30.44 H new ATOM 1305 N PHE A 85 -1.223 -6.060 -0.076 1.00 21.43 N ATOM 1306 CA PHE A 85 -0.263 -7.131 -0.391 1.00 62.33 C ATOM 1307 C PHE A 85 1.052 -6.564 -0.956 1.00 13.15 C ATOM 1308 O PHE A 85 1.055 -5.559 -1.677 1.00 24.04 O ATOM 1309 CB PHE A 85 -0.867 -8.123 -1.397 1.00 74.51 C ATOM 1310 CG PHE A 85 -2.063 -8.881 -0.874 1.00 21.32 C ATOM 1311 CD1 PHE A 85 -1.898 -9.950 -0.004 1.00 54.11 C ATOM 1312 CD2 PHE A 85 -3.352 -8.529 -1.253 1.00 21.51 C ATOM 1313 CE1 PHE A 85 -2.991 -10.648 0.473 1.00 11.04 C ATOM 1314 CE2 PHE A 85 -4.446 -9.224 -0.776 1.00 60.50 C ATOM 1315 CZ PHE A 85 -4.266 -10.283 0.088 1.00 33.24 C ATOM 0 H PHE A 85 -1.946 -5.925 -0.782 1.00 21.43 H new ATOM 0 HA PHE A 85 -0.043 -7.651 0.542 1.00 62.33 H new ATOM 0 HB2 PHE A 85 -1.159 -7.580 -2.296 1.00 74.51 H new ATOM 0 HB3 PHE A 85 -0.099 -8.837 -1.692 1.00 74.51 H new ATOM 0 HD1 PHE A 85 -0.904 -10.239 0.304 1.00 54.11 H new ATOM 0 HD2 PHE A 85 -3.501 -7.701 -1.930 1.00 21.51 H new ATOM 0 HE1 PHE A 85 -2.848 -11.479 1.147 1.00 11.04 H new ATOM 0 HE2 PHE A 85 -5.442 -8.938 -1.080 1.00 60.50 H new ATOM 0 HZ PHE A 85 -5.121 -10.826 0.463 1.00 33.24 H new ATOM 1325 N ALA A 86 2.163 -7.225 -0.637 1.00 45.13 N ATOM 1326 CA ALA A 86 3.488 -6.776 -1.080 1.00 21.44 C ATOM 1327 C ALA A 86 3.882 -7.357 -2.455 1.00 74.32 C ATOM 1328 O ALA A 86 4.034 -8.571 -2.613 1.00 60.04 O ATOM 1329 CB ALA A 86 4.536 -7.142 -0.030 1.00 32.03 C ATOM 0 H ALA A 86 2.175 -8.075 -0.073 1.00 45.13 H new ATOM 0 HA ALA A 86 3.443 -5.693 -1.196 1.00 21.44 H new ATOM 0 HB1 ALA A 86 5.518 -6.807 -0.364 1.00 32.03 H new ATOM 0 HB2 ALA A 86 4.289 -6.658 0.915 1.00 32.03 H new ATOM 0 HB3 ALA A 86 4.550 -8.223 0.109 1.00 32.03 H new ATOM 1335 N LYS A 87 4.038 -6.477 -3.448 1.00 63.25 N ATOM 1336 CA LYS A 87 4.578 -6.856 -4.763 1.00 13.24 C ATOM 1337 C LYS A 87 5.932 -6.208 -5.010 1.00 30.42 C ATOM 1338 O LYS A 87 6.276 -5.186 -4.417 1.00 64.23 O ATOM 1339 CB LYS A 87 3.631 -6.460 -5.910 1.00 30.32 C ATOM 1340 CG LYS A 87 2.400 -7.335 -6.079 1.00 61.52 C ATOM 1341 CD LYS A 87 1.796 -7.135 -7.468 1.00 35.24 C ATOM 1342 CE LYS A 87 0.533 -7.949 -7.674 1.00 25.21 C ATOM 1343 NZ LYS A 87 0.112 -7.960 -9.103 1.00 63.45 N ATOM 0 H LYS A 87 3.797 -5.489 -3.368 1.00 63.25 H new ATOM 0 HA LYS A 87 4.684 -7.941 -4.747 1.00 13.24 H new ATOM 0 HB2 LYS A 87 3.305 -5.433 -5.749 1.00 30.32 H new ATOM 0 HB3 LYS A 87 4.194 -6.473 -6.843 1.00 30.32 H new ATOM 0 HG2 LYS A 87 2.667 -8.382 -5.938 1.00 61.52 H new ATOM 0 HG3 LYS A 87 1.662 -7.089 -5.315 1.00 61.52 H new ATOM 0 HD2 LYS A 87 1.572 -6.078 -7.615 1.00 35.24 H new ATOM 0 HD3 LYS A 87 2.531 -7.413 -8.224 1.00 35.24 H new ATOM 0 HE2 LYS A 87 0.700 -8.972 -7.336 1.00 25.21 H new ATOM 0 HE3 LYS A 87 -0.269 -7.538 -7.061 1.00 25.21 H new ATOM 0 HZ1 LYS A 87 -0.755 -8.526 -9.205 1.00 63.45 H new ATOM 0 HZ2 LYS A 87 -0.071 -6.986 -9.418 1.00 63.45 H new ATOM 0 HZ3 LYS A 87 0.868 -8.376 -9.684 1.00 63.45 H new ATOM 1357 N LYS A 88 6.696 -6.815 -5.898 1.00 3.13 N ATOM 1358 CA LYS A 88 8.002 -6.307 -6.259 1.00 53.32 C ATOM 1359 C LYS A 88 7.933 -5.537 -7.587 1.00 52.43 C ATOM 1360 O LYS A 88 7.681 -6.120 -8.644 1.00 61.23 O ATOM 1361 CB LYS A 88 8.984 -7.473 -6.354 1.00 53.11 C ATOM 1362 CG LYS A 88 10.419 -7.013 -6.425 1.00 1.20 C ATOM 1363 CD LYS A 88 11.406 -8.177 -6.428 1.00 44.11 C ATOM 1364 CE LYS A 88 11.347 -8.970 -5.127 1.00 62.54 C ATOM 1365 NZ LYS A 88 12.364 -10.054 -5.088 1.00 10.21 N ATOM 0 H LYS A 88 6.429 -7.670 -6.386 1.00 3.13 H new ATOM 0 HA LYS A 88 8.347 -5.613 -5.493 1.00 53.32 H new ATOM 0 HB2 LYS A 88 8.856 -8.123 -5.489 1.00 53.11 H new ATOM 0 HB3 LYS A 88 8.752 -8.068 -7.237 1.00 53.11 H new ATOM 0 HG2 LYS A 88 10.562 -6.417 -7.326 1.00 1.20 H new ATOM 0 HG3 LYS A 88 10.631 -6.363 -5.576 1.00 1.20 H new ATOM 0 HD2 LYS A 88 11.187 -8.838 -7.267 1.00 44.11 H new ATOM 0 HD3 LYS A 88 12.417 -7.797 -6.577 1.00 44.11 H new ATOM 0 HE2 LYS A 88 11.503 -8.296 -4.285 1.00 62.54 H new ATOM 0 HE3 LYS A 88 10.353 -9.401 -5.010 1.00 62.54 H new ATOM 0 HZ1 LYS A 88 12.615 -10.259 -4.100 1.00 10.21 H new ATOM 0 HZ2 LYS A 88 11.975 -10.911 -5.531 1.00 10.21 H new ATOM 0 HZ3 LYS A 88 13.214 -9.752 -5.606 1.00 10.21 H new ATOM 1379 N GLY A 89 8.145 -4.226 -7.524 1.00 73.14 N ATOM 1380 CA GLY A 89 7.986 -3.379 -8.700 1.00 53.44 C ATOM 1381 C GLY A 89 9.298 -2.865 -9.280 1.00 35.13 C ATOM 1382 O GLY A 89 10.364 -3.021 -8.685 1.00 3.30 O ATOM 0 H GLY A 89 8.425 -3.730 -6.678 1.00 73.14 H new ATOM 0 HA2 GLY A 89 7.456 -3.940 -9.470 1.00 53.44 H new ATOM 0 HA3 GLY A 89 7.359 -2.527 -8.438 1.00 53.44 H new ATOM 1386 N ASP A 90 9.207 -2.233 -10.446 1.00 4.30 N ATOM 1387 CA ASP A 90 10.374 -1.689 -11.146 1.00 30.33 C ATOM 1388 C ASP A 90 10.557 -0.195 -10.822 1.00 25.43 C ATOM 1389 O ASP A 90 11.255 0.534 -11.531 1.00 2.22 O ATOM 1390 CB ASP A 90 10.188 -1.889 -12.655 1.00 4.31 C ATOM 1391 CG ASP A 90 9.791 -3.316 -13.004 1.00 43.50 C ATOM 1392 OD1 ASP A 90 10.689 -4.154 -13.219 1.00 10.12 O ATOM 1393 OD2 ASP A 90 8.575 -3.606 -13.062 1.00 34.43 O ATOM 0 H ASP A 90 8.325 -2.082 -10.935 1.00 4.30 H new ATOM 0 HA ASP A 90 11.269 -2.215 -10.814 1.00 30.33 H new ATOM 0 HB2 ASP A 90 9.424 -1.202 -13.019 1.00 4.31 H new ATOM 0 HB3 ASP A 90 11.115 -1.636 -13.170 1.00 4.31 H new ATOM 1398 N VAL A 91 9.928 0.244 -9.736 1.00 21.41 N ATOM 1399 CA VAL A 91 9.952 1.651 -9.322 1.00 71.40 C ATOM 1400 C VAL A 91 11.267 2.020 -8.607 1.00 22.03 C ATOM 1401 O VAL A 91 11.944 1.151 -8.054 1.00 11.32 O ATOM 1402 CB VAL A 91 8.756 1.956 -8.384 1.00 0.34 C ATOM 1403 CG1 VAL A 91 7.428 1.764 -9.120 1.00 21.33 C ATOM 1404 CG2 VAL A 91 8.814 1.081 -7.128 1.00 31.15 C ATOM 0 H VAL A 91 9.388 -0.360 -9.117 1.00 21.41 H new ATOM 0 HA VAL A 91 9.877 2.253 -10.227 1.00 71.40 H new ATOM 0 HB VAL A 91 8.824 2.999 -8.074 1.00 0.34 H new ATOM 0 HG11 VAL A 91 6.602 1.983 -8.443 1.00 21.33 H new ATOM 0 HG12 VAL A 91 7.385 2.438 -9.975 1.00 21.33 H new ATOM 0 HG13 VAL A 91 7.350 0.733 -9.466 1.00 21.33 H new ATOM 0 HG21 VAL A 91 7.965 1.312 -6.484 1.00 31.15 H new ATOM 0 HG22 VAL A 91 8.777 0.030 -7.415 1.00 31.15 H new ATOM 0 HG23 VAL A 91 9.741 1.278 -6.590 1.00 31.15 H new ATOM 1414 N PRO A 92 11.655 3.318 -8.612 1.00 53.11 N ATOM 1415 CA PRO A 92 12.867 3.786 -7.904 1.00 75.34 C ATOM 1416 C PRO A 92 12.820 3.492 -6.393 1.00 22.23 C ATOM 1417 O PRO A 92 11.745 3.404 -5.805 1.00 53.03 O ATOM 1418 CB PRO A 92 12.864 5.305 -8.149 1.00 55.51 C ATOM 1419 CG PRO A 92 12.002 5.505 -9.352 1.00 11.14 C ATOM 1420 CD PRO A 92 10.958 4.422 -9.301 1.00 20.11 C ATOM 0 HA PRO A 92 13.763 3.281 -8.265 1.00 75.34 H new ATOM 0 HB2 PRO A 92 12.468 5.842 -7.287 1.00 55.51 H new ATOM 0 HB3 PRO A 92 13.874 5.678 -8.321 1.00 55.51 H new ATOM 0 HG2 PRO A 92 11.540 6.492 -9.341 1.00 11.14 H new ATOM 0 HG3 PRO A 92 12.589 5.438 -10.268 1.00 11.14 H new ATOM 0 HD2 PRO A 92 10.071 4.742 -8.754 1.00 20.11 H new ATOM 0 HD3 PRO A 92 10.630 4.131 -10.299 1.00 20.11 H new ATOM 1428 N LYS A 93 13.987 3.348 -5.764 1.00 71.11 N ATOM 1429 CA LYS A 93 14.046 3.067 -4.323 1.00 62.44 C ATOM 1430 C LYS A 93 13.433 4.219 -3.507 1.00 60.31 C ATOM 1431 O LYS A 93 13.513 5.382 -3.906 1.00 75.04 O ATOM 1432 CB LYS A 93 15.489 2.830 -3.871 1.00 55.34 C ATOM 1433 CG LYS A 93 15.582 2.326 -2.437 1.00 71.33 C ATOM 1434 CD LYS A 93 17.016 2.207 -1.952 1.00 73.21 C ATOM 1435 CE LYS A 93 17.074 1.554 -0.577 1.00 40.02 C ATOM 1436 NZ LYS A 93 16.194 2.244 0.408 1.00 23.02 N ATOM 0 H LYS A 93 14.896 3.420 -6.220 1.00 71.11 H new ATOM 0 HA LYS A 93 13.465 2.162 -4.144 1.00 62.44 H new ATOM 0 HB2 LYS A 93 15.960 2.107 -4.537 1.00 55.34 H new ATOM 0 HB3 LYS A 93 16.051 3.760 -3.962 1.00 55.34 H new ATOM 0 HG2 LYS A 93 15.036 3.004 -1.781 1.00 71.33 H new ATOM 0 HG3 LYS A 93 15.096 1.353 -2.366 1.00 71.33 H new ATOM 0 HD2 LYS A 93 17.597 1.619 -2.663 1.00 73.21 H new ATOM 0 HD3 LYS A 93 17.472 3.196 -1.909 1.00 73.21 H new ATOM 0 HE2 LYS A 93 16.776 0.509 -0.659 1.00 40.02 H new ATOM 0 HE3 LYS A 93 18.102 1.564 -0.214 1.00 40.02 H new ATOM 0 HZ1 LYS A 93 16.512 2.021 1.373 1.00 23.02 H new ATOM 0 HZ2 LYS A 93 16.242 3.272 0.256 1.00 23.02 H new ATOM 0 HZ3 LYS A 93 15.213 1.921 0.283 1.00 23.02 H new ATOM 1450 N GLY A 94 12.839 3.901 -2.356 1.00 74.31 N ATOM 1451 CA GLY A 94 12.131 4.917 -1.581 1.00 3.34 C ATOM 1452 C GLY A 94 10.891 5.441 -2.303 1.00 53.13 C ATOM 1453 O GLY A 94 10.463 6.577 -2.093 1.00 72.30 O ATOM 0 H GLY A 94 12.834 2.967 -1.947 1.00 74.31 H new ATOM 0 HA2 GLY A 94 11.838 4.497 -0.619 1.00 3.34 H new ATOM 0 HA3 GLY A 94 12.806 5.748 -1.374 1.00 3.34 H new ATOM 1457 N MET A 95 10.317 4.604 -3.157 1.00 12.33 N ATOM 1458 CA MET A 95 9.122 4.947 -3.914 1.00 63.23 C ATOM 1459 C MET A 95 8.294 3.680 -4.173 1.00 45.33 C ATOM 1460 O MET A 95 8.850 2.634 -4.497 1.00 35.12 O ATOM 1461 CB MET A 95 9.540 5.603 -5.237 1.00 34.12 C ATOM 1462 CG MET A 95 8.406 6.261 -5.996 1.00 43.21 C ATOM 1463 SD MET A 95 8.986 7.150 -7.458 1.00 53.04 S ATOM 1464 CE MET A 95 7.513 8.063 -7.908 1.00 51.12 C ATOM 0 H MET A 95 10.669 3.665 -3.344 1.00 12.33 H new ATOM 0 HA MET A 95 8.508 5.648 -3.349 1.00 63.23 H new ATOM 0 HB2 MET A 95 10.305 6.351 -5.031 1.00 34.12 H new ATOM 0 HB3 MET A 95 9.997 4.847 -5.875 1.00 34.12 H new ATOM 0 HG2 MET A 95 7.685 5.502 -6.298 1.00 43.21 H new ATOM 0 HG3 MET A 95 7.883 6.953 -5.336 1.00 43.21 H new ATOM 0 HE1 MET A 95 7.061 7.612 -8.791 1.00 51.12 H new ATOM 0 HE2 MET A 95 6.802 8.036 -7.082 1.00 51.12 H new ATOM 0 HE3 MET A 95 7.778 9.098 -8.125 1.00 51.12 H new ATOM 1474 N ILE A 96 6.971 3.759 -4.015 1.00 23.21 N ATOM 1475 CA ILE A 96 6.105 2.585 -4.215 1.00 43.21 C ATOM 1476 C ILE A 96 4.883 2.917 -5.085 1.00 55.21 C ATOM 1477 O ILE A 96 4.291 3.994 -4.973 1.00 72.24 O ATOM 1478 CB ILE A 96 5.619 1.975 -2.869 1.00 62.04 C ATOM 1479 CG1 ILE A 96 4.765 2.983 -2.080 1.00 24.22 C ATOM 1480 CG2 ILE A 96 6.810 1.509 -2.031 1.00 24.03 C ATOM 1481 CD1 ILE A 96 4.197 2.423 -0.788 1.00 30.04 C ATOM 0 H ILE A 96 6.476 4.611 -3.752 1.00 23.21 H new ATOM 0 HA ILE A 96 6.721 1.848 -4.731 1.00 43.21 H new ATOM 0 HB ILE A 96 4.995 1.111 -3.097 1.00 62.04 H new ATOM 0 HG12 ILE A 96 5.372 3.859 -1.850 1.00 24.22 H new ATOM 0 HG13 ILE A 96 3.943 3.322 -2.711 1.00 24.22 H new ATOM 0 HG21 ILE A 96 6.451 1.085 -1.093 1.00 24.03 H new ATOM 0 HG22 ILE A 96 7.368 0.752 -2.582 1.00 24.03 H new ATOM 0 HG23 ILE A 96 7.461 2.358 -1.820 1.00 24.03 H new ATOM 0 HD11 ILE A 96 3.607 3.191 -0.287 1.00 30.04 H new ATOM 0 HD12 ILE A 96 3.562 1.565 -1.011 1.00 30.04 H new ATOM 0 HD13 ILE A 96 5.013 2.111 -0.137 1.00 30.04 H new ATOM 1493 N PHE A 97 4.511 1.978 -5.948 1.00 14.11 N ATOM 1494 CA PHE A 97 3.387 2.168 -6.867 1.00 44.23 C ATOM 1495 C PHE A 97 2.130 1.438 -6.372 1.00 33.20 C ATOM 1496 O PHE A 97 2.124 0.215 -6.235 1.00 14.20 O ATOM 1497 CB PHE A 97 3.765 1.664 -8.267 1.00 55.34 C ATOM 1498 CG PHE A 97 2.702 1.909 -9.309 1.00 73.21 C ATOM 1499 CD1 PHE A 97 1.701 0.973 -9.536 1.00 51.33 C ATOM 1500 CD2 PHE A 97 2.703 3.077 -10.056 1.00 34.14 C ATOM 1501 CE1 PHE A 97 0.725 1.198 -10.486 1.00 22.11 C ATOM 1502 CE2 PHE A 97 1.730 3.306 -11.007 1.00 72.12 C ATOM 1503 CZ PHE A 97 0.741 2.366 -11.223 1.00 50.33 C ATOM 0 H PHE A 97 4.972 1.072 -6.033 1.00 14.11 H new ATOM 0 HA PHE A 97 3.164 3.234 -6.910 1.00 44.23 H new ATOM 0 HB2 PHE A 97 4.688 2.151 -8.581 1.00 55.34 H new ATOM 0 HB3 PHE A 97 3.970 0.595 -8.215 1.00 55.34 H new ATOM 0 HD1 PHE A 97 1.686 0.058 -8.962 1.00 51.33 H new ATOM 0 HD2 PHE A 97 3.474 3.816 -9.892 1.00 34.14 H new ATOM 0 HE1 PHE A 97 -0.049 0.463 -10.652 1.00 22.11 H new ATOM 0 HE2 PHE A 97 1.742 4.220 -11.582 1.00 72.12 H new ATOM 0 HZ PHE A 97 -0.020 2.544 -11.968 1.00 50.33 H new ATOM 1513 N ILE A 98 1.070 2.193 -6.103 1.00 33.10 N ATOM 1514 CA ILE A 98 -0.217 1.610 -5.709 1.00 35.21 C ATOM 1515 C ILE A 98 -1.317 2.000 -6.710 1.00 71.32 C ATOM 1516 O ILE A 98 -1.531 3.181 -6.977 1.00 35.02 O ATOM 1517 CB ILE A 98 -0.637 2.066 -4.284 1.00 54.03 C ATOM 1518 CG1 ILE A 98 0.432 1.663 -3.251 1.00 14.02 C ATOM 1519 CG2 ILE A 98 -2.000 1.475 -3.910 1.00 51.15 C ATOM 1520 CD1 ILE A 98 0.073 2.015 -1.820 1.00 0.51 C ATOM 0 H ILE A 98 1.072 3.212 -6.149 1.00 33.10 H new ATOM 0 HA ILE A 98 -0.093 0.527 -5.706 1.00 35.21 H new ATOM 0 HB ILE A 98 -0.723 3.153 -4.282 1.00 54.03 H new ATOM 0 HG12 ILE A 98 0.600 0.588 -3.318 1.00 14.02 H new ATOM 0 HG13 ILE A 98 1.373 2.150 -3.509 1.00 14.02 H new ATOM 0 HG21 ILE A 98 -2.277 1.805 -2.909 1.00 51.15 H new ATOM 0 HG22 ILE A 98 -2.751 1.812 -4.624 1.00 51.15 H new ATOM 0 HG23 ILE A 98 -1.943 0.387 -3.930 1.00 51.15 H new ATOM 0 HD11 ILE A 98 0.876 1.698 -1.155 1.00 0.51 H new ATOM 0 HD12 ILE A 98 -0.066 3.093 -1.734 1.00 0.51 H new ATOM 0 HD13 ILE A 98 -0.850 1.507 -1.541 1.00 0.51 H new ATOM 1532 N PRO A 99 -2.020 1.013 -7.298 1.00 63.51 N ATOM 1533 CA PRO A 99 -3.147 1.286 -8.205 1.00 25.35 C ATOM 1534 C PRO A 99 -4.228 2.164 -7.545 1.00 52.34 C ATOM 1535 O PRO A 99 -4.589 1.963 -6.382 1.00 71.43 O ATOM 1536 CB PRO A 99 -3.695 -0.113 -8.545 1.00 0.33 C ATOM 1537 CG PRO A 99 -3.087 -1.039 -7.537 1.00 11.22 C ATOM 1538 CD PRO A 99 -1.771 -0.430 -7.144 1.00 70.01 C ATOM 0 HA PRO A 99 -2.835 1.847 -9.086 1.00 25.35 H new ATOM 0 HB2 PRO A 99 -4.783 -0.132 -8.489 1.00 0.33 H new ATOM 0 HB3 PRO A 99 -3.423 -0.405 -9.559 1.00 0.33 H new ATOM 0 HG2 PRO A 99 -3.738 -1.151 -6.670 1.00 11.22 H new ATOM 0 HG3 PRO A 99 -2.944 -2.034 -7.959 1.00 11.22 H new ATOM 0 HD2 PRO A 99 -1.496 -0.686 -6.121 1.00 70.01 H new ATOM 0 HD3 PRO A 99 -0.959 -0.771 -7.787 1.00 70.01 H new ATOM 1546 N MET A 100 -4.740 3.140 -8.299 1.00 21.31 N ATOM 1547 CA MET A 100 -5.711 4.110 -7.774 1.00 72.23 C ATOM 1548 C MET A 100 -6.972 3.399 -7.253 1.00 1.54 C ATOM 1549 O MET A 100 -7.816 2.956 -8.032 1.00 1.41 O ATOM 1550 CB MET A 100 -6.092 5.119 -8.870 1.00 2.02 C ATOM 1551 CG MET A 100 -6.584 6.478 -8.364 1.00 52.34 C ATOM 1552 SD MET A 100 -7.865 6.368 -7.091 1.00 22.40 S ATOM 1553 CE MET A 100 -6.884 6.508 -5.595 1.00 44.33 C ATOM 0 H MET A 100 -4.498 3.282 -9.280 1.00 21.31 H new ATOM 0 HA MET A 100 -5.248 4.640 -6.942 1.00 72.23 H new ATOM 0 HB2 MET A 100 -5.225 5.280 -9.510 1.00 2.02 H new ATOM 0 HB3 MET A 100 -6.870 4.678 -9.493 1.00 2.02 H new ATOM 0 HG2 MET A 100 -5.736 7.034 -7.965 1.00 52.34 H new ATOM 0 HG3 MET A 100 -6.972 7.050 -9.207 1.00 52.34 H new ATOM 0 HE1 MET A 100 -7.245 5.794 -4.855 1.00 44.33 H new ATOM 0 HE2 MET A 100 -5.839 6.297 -5.824 1.00 44.33 H new ATOM 0 HE3 MET A 100 -6.971 7.519 -5.196 1.00 44.33 H new ATOM 1563 N GLY A 101 -7.083 3.281 -5.934 1.00 4.44 N ATOM 1564 CA GLY A 101 -8.232 2.597 -5.343 1.00 41.54 C ATOM 1565 C GLY A 101 -8.561 3.095 -3.944 1.00 10.31 C ATOM 1566 O GLY A 101 -7.914 4.018 -3.448 1.00 75.43 O ATOM 0 H GLY A 101 -6.406 3.642 -5.262 1.00 4.44 H new ATOM 0 HA2 GLY A 101 -9.101 2.735 -5.986 1.00 41.54 H new ATOM 0 HA3 GLY A 101 -8.031 1.526 -5.304 1.00 41.54 H new ATOM 1570 N PRO A 102 -9.555 2.484 -3.260 1.00 42.44 N ATOM 1571 CA PRO A 102 -9.956 2.918 -1.909 1.00 14.52 C ATOM 1572 C PRO A 102 -8.807 2.764 -0.907 1.00 52.43 C ATOM 1573 O PRO A 102 -8.709 3.507 0.067 1.00 14.10 O ATOM 1574 CB PRO A 102 -11.142 1.999 -1.558 1.00 54.11 C ATOM 1575 CG PRO A 102 -11.022 0.825 -2.477 1.00 64.00 C ATOM 1576 CD PRO A 102 -10.341 1.321 -3.728 1.00 33.21 C ATOM 0 HA PRO A 102 -10.225 3.974 -1.872 1.00 14.52 H new ATOM 0 HB2 PRO A 102 -11.101 1.687 -0.515 1.00 54.11 H new ATOM 0 HB3 PRO A 102 -12.093 2.513 -1.700 1.00 54.11 H new ATOM 0 HG2 PRO A 102 -10.443 0.027 -2.012 1.00 64.00 H new ATOM 0 HG3 PRO A 102 -12.004 0.413 -2.709 1.00 64.00 H new ATOM 0 HD2 PRO A 102 -9.701 0.555 -4.166 1.00 33.21 H new ATOM 0 HD3 PRO A 102 -11.064 1.607 -4.491 1.00 33.21 H new ATOM 1584 N TYR A 103 -7.927 1.806 -1.184 1.00 73.11 N ATOM 1585 CA TYR A 103 -6.725 1.582 -0.381 1.00 24.34 C ATOM 1586 C TYR A 103 -5.767 2.768 -0.524 1.00 72.21 C ATOM 1587 O TYR A 103 -5.296 3.331 0.464 1.00 33.10 O ATOM 1588 CB TYR A 103 -6.044 0.282 -0.832 1.00 31.50 C ATOM 1589 CG TYR A 103 -6.953 -0.927 -0.736 1.00 64.32 C ATOM 1590 CD1 TYR A 103 -8.054 -1.058 -1.579 1.00 2.03 C ATOM 1591 CD2 TYR A 103 -6.731 -1.925 0.206 1.00 4.11 C ATOM 1592 CE1 TYR A 103 -8.898 -2.138 -1.490 1.00 0.40 C ATOM 1593 CE2 TYR A 103 -7.575 -3.011 0.299 1.00 71.23 C ATOM 1594 CZ TYR A 103 -8.657 -3.110 -0.552 1.00 25.53 C ATOM 1595 OH TYR A 103 -9.501 -4.192 -0.467 1.00 73.31 O ATOM 0 H TYR A 103 -8.025 1.163 -1.970 1.00 73.11 H new ATOM 0 HA TYR A 103 -7.003 1.491 0.669 1.00 24.34 H new ATOM 0 HB2 TYR A 103 -5.705 0.394 -1.862 1.00 31.50 H new ATOM 0 HB3 TYR A 103 -5.157 0.112 -0.222 1.00 31.50 H new ATOM 0 HD1 TYR A 103 -8.248 -0.295 -2.318 1.00 2.03 H new ATOM 0 HD2 TYR A 103 -5.886 -1.848 0.874 1.00 4.11 H new ATOM 0 HE1 TYR A 103 -9.746 -2.222 -2.154 1.00 0.40 H new ATOM 0 HE2 TYR A 103 -7.390 -3.780 1.034 1.00 71.23 H new ATOM 0 HH TYR A 103 -8.978 -5.002 -0.292 1.00 73.31 H new ATOM 1605 N ALA A 104 -5.502 3.152 -1.768 1.00 60.24 N ATOM 1606 CA ALA A 104 -4.697 4.337 -2.059 1.00 12.23 C ATOM 1607 C ALA A 104 -5.315 5.604 -1.438 1.00 2.32 C ATOM 1608 O ALA A 104 -4.604 6.435 -0.885 1.00 20.04 O ATOM 1609 CB ALA A 104 -4.531 4.501 -3.568 1.00 73.32 C ATOM 0 H ALA A 104 -5.834 2.658 -2.596 1.00 60.24 H new ATOM 0 HA ALA A 104 -3.714 4.198 -1.609 1.00 12.23 H new ATOM 0 HB1 ALA A 104 -3.930 5.387 -3.774 1.00 73.32 H new ATOM 0 HB2 ALA A 104 -4.033 3.622 -3.977 1.00 73.32 H new ATOM 0 HB3 ALA A 104 -5.511 4.612 -4.032 1.00 73.32 H new ATOM 1615 N ASN A 105 -6.645 5.720 -1.496 1.00 72.41 N ATOM 1616 CA ASN A 105 -7.356 6.901 -0.966 1.00 43.33 C ATOM 1617 C ASN A 105 -7.041 7.138 0.514 1.00 3.14 C ATOM 1618 O ASN A 105 -7.153 8.257 1.020 1.00 50.14 O ATOM 1619 CB ASN A 105 -8.867 6.728 -1.138 1.00 41.54 C ATOM 1620 CG ASN A 105 -9.310 6.831 -2.582 1.00 0.53 C ATOM 1621 OD1 ASN A 105 -8.738 7.573 -3.372 1.00 25.12 O ATOM 1622 ND2 ASN A 105 -10.331 6.086 -2.933 1.00 1.51 N ATOM 0 H ASN A 105 -7.257 5.013 -1.904 1.00 72.41 H new ATOM 0 HA ASN A 105 -7.013 7.767 -1.532 1.00 43.33 H new ATOM 0 HB2 ASN A 105 -9.164 5.758 -0.740 1.00 41.54 H new ATOM 0 HB3 ASN A 105 -9.384 7.486 -0.549 1.00 41.54 H new ATOM 0 HD21 ASN A 105 -10.675 6.112 -3.893 1.00 1.51 H new ATOM 0 HD22 ASN A 105 -10.781 5.481 -2.246 1.00 1.51 H new ATOM 1629 N MET A 106 -6.664 6.071 1.204 1.00 60.52 N ATOM 1630 CA MET A 106 -6.326 6.147 2.630 1.00 1.31 C ATOM 1631 C MET A 106 -4.964 6.825 2.873 1.00 43.01 C ATOM 1632 O MET A 106 -4.703 7.324 3.966 1.00 73.01 O ATOM 1633 CB MET A 106 -6.306 4.742 3.244 1.00 63.24 C ATOM 1634 CG MET A 106 -7.490 3.883 2.832 1.00 12.40 C ATOM 1635 SD MET A 106 -7.575 2.321 3.732 1.00 61.44 S ATOM 1636 CE MET A 106 -7.816 2.890 5.412 1.00 63.15 C ATOM 0 H MET A 106 -6.582 5.137 0.803 1.00 60.52 H new ATOM 0 HA MET A 106 -7.094 6.756 3.107 1.00 1.31 H new ATOM 0 HB2 MET A 106 -5.384 4.240 2.952 1.00 63.24 H new ATOM 0 HB3 MET A 106 -6.291 4.829 4.330 1.00 63.24 H new ATOM 0 HG2 MET A 106 -8.412 4.441 2.996 1.00 12.40 H new ATOM 0 HG3 MET A 106 -7.428 3.677 1.763 1.00 12.40 H new ATOM 0 HE1 MET A 106 -7.173 2.322 6.084 1.00 63.15 H new ATOM 0 HE2 MET A 106 -7.564 3.948 5.477 1.00 63.15 H new ATOM 0 HE3 MET A 106 -8.858 2.747 5.699 1.00 63.15 H new ATOM 1646 N VAL A 107 -4.098 6.845 1.854 1.00 70.42 N ATOM 1647 CA VAL A 107 -2.717 7.331 2.024 1.00 23.21 C ATOM 1648 C VAL A 107 -2.266 8.300 0.912 1.00 11.33 C ATOM 1649 O VAL A 107 -1.177 8.872 0.995 1.00 42.05 O ATOM 1650 CB VAL A 107 -1.711 6.150 2.092 1.00 1.30 C ATOM 1651 CG1 VAL A 107 -1.950 5.299 3.339 1.00 2.10 C ATOM 1652 CG2 VAL A 107 -1.789 5.295 0.824 1.00 71.32 C ATOM 0 H VAL A 107 -4.323 6.534 0.909 1.00 70.42 H new ATOM 0 HA VAL A 107 -2.721 7.880 2.966 1.00 23.21 H new ATOM 0 HB VAL A 107 -0.706 6.567 2.158 1.00 1.30 H new ATOM 0 HG11 VAL A 107 -1.232 4.479 3.363 1.00 2.10 H new ATOM 0 HG12 VAL A 107 -1.826 5.915 4.229 1.00 2.10 H new ATOM 0 HG13 VAL A 107 -2.962 4.895 3.315 1.00 2.10 H new ATOM 0 HG21 VAL A 107 -1.075 4.474 0.894 1.00 71.32 H new ATOM 0 HG22 VAL A 107 -2.796 4.892 0.718 1.00 71.32 H new ATOM 0 HG23 VAL A 107 -1.551 5.909 -0.044 1.00 71.32 H new ATOM 1662 N ILE A 108 -3.088 8.496 -0.116 1.00 12.34 N ATOM 1663 CA ILE A 108 -2.708 9.369 -1.239 1.00 65.54 C ATOM 1664 C ILE A 108 -3.554 10.657 -1.270 1.00 23.13 C ATOM 1665 O ILE A 108 -4.519 10.802 -0.517 1.00 35.42 O ATOM 1666 CB ILE A 108 -2.805 8.624 -2.607 1.00 35.41 C ATOM 1667 CG1 ILE A 108 -4.267 8.434 -3.061 1.00 20.31 C ATOM 1668 CG2 ILE A 108 -2.101 7.270 -2.536 1.00 70.52 C ATOM 1669 CD1 ILE A 108 -4.752 9.504 -4.010 1.00 22.04 C ATOM 0 H ILE A 108 -4.011 8.071 -0.201 1.00 12.34 H new ATOM 0 HA ILE A 108 -1.667 9.650 -1.079 1.00 65.54 H new ATOM 0 HB ILE A 108 -2.305 9.250 -3.346 1.00 35.41 H new ATOM 0 HG12 ILE A 108 -4.365 7.461 -3.543 1.00 20.31 H new ATOM 0 HG13 ILE A 108 -4.912 8.420 -2.182 1.00 20.31 H new ATOM 0 HG21 ILE A 108 -2.181 6.768 -3.500 1.00 70.52 H new ATOM 0 HG22 ILE A 108 -1.050 7.419 -2.290 1.00 70.52 H new ATOM 0 HG23 ILE A 108 -2.570 6.656 -1.767 1.00 70.52 H new ATOM 0 HD11 ILE A 108 -5.787 9.304 -4.285 1.00 22.04 H new ATOM 0 HD12 ILE A 108 -4.687 10.478 -3.524 1.00 22.04 H new ATOM 0 HD13 ILE A 108 -4.132 9.504 -4.906 1.00 22.04 H new ATOM 1681 N ASP A 109 -3.187 11.582 -2.156 1.00 50.20 N ATOM 1682 CA ASP A 109 -3.861 12.884 -2.264 1.00 62.22 C ATOM 1683 C ASP A 109 -4.925 12.883 -3.382 1.00 1.02 C ATOM 1684 O ASP A 109 -4.612 12.645 -4.551 1.00 13.11 O ATOM 1685 CB ASP A 109 -2.815 13.978 -2.521 1.00 70.21 C ATOM 1686 CG ASP A 109 -3.430 15.357 -2.684 1.00 15.24 C ATOM 1687 OD1 ASP A 109 -3.842 15.697 -3.809 1.00 31.20 O ATOM 1688 OD2 ASP A 109 -3.501 16.106 -1.689 1.00 14.12 O ATOM 0 H ASP A 109 -2.420 11.456 -2.817 1.00 50.20 H new ATOM 0 HA ASP A 109 -4.378 13.083 -1.325 1.00 62.22 H new ATOM 0 HB2 ASP A 109 -2.106 13.997 -1.693 1.00 70.21 H new ATOM 0 HB3 ASP A 109 -2.250 13.729 -3.419 1.00 70.21 H new ATOM 1693 N PRO A 110 -6.203 13.140 -3.038 1.00 32.51 N ATOM 1694 CA PRO A 110 -7.292 13.188 -4.022 1.00 30.05 C ATOM 1695 C PRO A 110 -7.468 14.574 -4.673 1.00 61.03 C ATOM 1696 O PRO A 110 -8.364 14.775 -5.498 1.00 22.50 O ATOM 1697 CB PRO A 110 -8.509 12.830 -3.167 1.00 71.24 C ATOM 1698 CG PRO A 110 -8.205 13.416 -1.825 1.00 41.25 C ATOM 1699 CD PRO A 110 -6.699 13.374 -1.663 1.00 4.11 C ATOM 0 HA PRO A 110 -7.116 12.524 -4.868 1.00 30.05 H new ATOM 0 HB2 PRO A 110 -9.425 13.248 -3.585 1.00 71.24 H new ATOM 0 HB3 PRO A 110 -8.649 11.751 -3.107 1.00 71.24 H new ATOM 0 HG2 PRO A 110 -8.573 14.440 -1.757 1.00 41.25 H new ATOM 0 HG3 PRO A 110 -8.695 12.848 -1.034 1.00 41.25 H new ATOM 0 HD2 PRO A 110 -6.315 14.308 -1.252 1.00 4.11 H new ATOM 0 HD3 PRO A 110 -6.391 12.577 -0.986 1.00 4.11 H new ATOM 1707 N SER A 111 -6.610 15.527 -4.310 1.00 2.40 N ATOM 1708 CA SER A 111 -6.692 16.897 -4.844 1.00 21.44 C ATOM 1709 C SER A 111 -5.928 17.034 -6.165 1.00 53.31 C ATOM 1710 O SER A 111 -5.873 18.117 -6.758 1.00 33.21 O ATOM 1711 CB SER A 111 -6.150 17.904 -3.822 1.00 23.21 C ATOM 1712 OG SER A 111 -6.871 17.832 -2.600 1.00 1.41 O ATOM 0 H SER A 111 -5.848 15.381 -3.648 1.00 2.40 H new ATOM 0 HA SER A 111 -7.743 17.110 -5.037 1.00 21.44 H new ATOM 0 HB2 SER A 111 -5.094 17.706 -3.637 1.00 23.21 H new ATOM 0 HB3 SER A 111 -6.219 18.913 -4.229 1.00 23.21 H new ATOM 0 HG SER A 111 -6.505 18.483 -1.965 1.00 1.41 H new ATOM 1718 N THR A 112 -5.329 15.933 -6.613 1.00 33.35 N ATOM 1719 CA THR A 112 -4.641 15.888 -7.908 1.00 4.51 C ATOM 1720 C THR A 112 -5.642 16.002 -9.067 1.00 30.42 C ATOM 1721 O THR A 112 -6.072 14.999 -9.644 1.00 60.24 O ATOM 1722 CB THR A 112 -3.814 14.585 -8.072 1.00 52.04 C ATOM 1723 OG1 THR A 112 -4.684 13.439 -8.114 1.00 65.21 O ATOM 1724 CG2 THR A 112 -2.825 14.424 -6.921 1.00 13.35 C ATOM 0 H THR A 112 -5.305 15.053 -6.097 1.00 33.35 H new ATOM 0 HA THR A 112 -3.960 16.739 -7.934 1.00 4.51 H new ATOM 0 HB THR A 112 -3.262 14.655 -9.009 1.00 52.04 H new ATOM 0 HG1 THR A 112 -5.373 13.576 -8.797 1.00 65.21 H new ATOM 0 HG21 THR A 112 -2.256 13.504 -7.056 1.00 13.35 H new ATOM 0 HG22 THR A 112 -2.143 15.274 -6.906 1.00 13.35 H new ATOM 0 HG23 THR A 112 -3.369 14.379 -5.978 1.00 13.35 H new ATOM 1732 N ASP A 113 -6.025 17.234 -9.389 1.00 31.14 N ATOM 1733 CA ASP A 113 -7.028 17.486 -10.425 1.00 40.44 C ATOM 1734 C ASP A 113 -6.502 17.065 -11.814 1.00 31.11 C ATOM 1735 O ASP A 113 -5.555 17.654 -12.335 1.00 60.24 O ATOM 1736 CB ASP A 113 -7.424 18.969 -10.413 1.00 20.14 C ATOM 1737 CG ASP A 113 -8.803 19.196 -11.000 1.00 75.34 C ATOM 1738 OD1 ASP A 113 -8.915 19.375 -12.227 1.00 43.03 O ATOM 1739 OD2 ASP A 113 -9.788 19.188 -10.231 1.00 11.43 O ATOM 0 H ASP A 113 -5.657 18.077 -8.948 1.00 31.14 H new ATOM 0 HA ASP A 113 -7.913 16.886 -10.213 1.00 40.44 H new ATOM 0 HB2 ASP A 113 -7.401 19.342 -9.389 1.00 20.14 H new ATOM 0 HB3 ASP A 113 -6.691 19.544 -10.978 1.00 20.14 H new ATOM 1744 N GLY A 114 -7.123 16.040 -12.402 1.00 24.34 N ATOM 1745 CA GLY A 114 -6.639 15.469 -13.658 1.00 61.33 C ATOM 1746 C GLY A 114 -6.888 16.349 -14.882 1.00 1.01 C ATOM 1747 O GLY A 114 -7.785 16.075 -15.682 1.00 74.04 O ATOM 0 H GLY A 114 -7.959 15.591 -12.029 1.00 24.34 H new ATOM 0 HA2 GLY A 114 -5.569 15.282 -13.571 1.00 61.33 H new ATOM 0 HA3 GLY A 114 -7.120 14.503 -13.815 1.00 61.33 H new ATOM 1751 N THR A 115 -6.088 17.403 -15.029 1.00 20.52 N ATOM 1752 CA THR A 115 -6.155 18.287 -16.207 1.00 52.30 C ATOM 1753 C THR A 115 -4.787 18.393 -16.899 1.00 65.10 C ATOM 1754 O THR A 115 -4.417 19.444 -17.426 1.00 54.14 O ATOM 1755 CB THR A 115 -6.642 19.710 -15.824 1.00 71.53 C ATOM 1756 OG1 THR A 115 -5.788 20.279 -14.819 1.00 24.34 O ATOM 1757 CG2 THR A 115 -8.081 19.682 -15.316 1.00 15.13 C ATOM 0 H THR A 115 -5.379 17.673 -14.347 1.00 20.52 H new ATOM 0 HA THR A 115 -6.873 17.841 -16.895 1.00 52.30 H new ATOM 0 HB THR A 115 -6.603 20.326 -16.722 1.00 71.53 H new ATOM 0 HG1 THR A 115 -5.083 19.638 -14.587 1.00 24.34 H new ATOM 0 HG21 THR A 115 -8.395 20.693 -15.055 1.00 15.13 H new ATOM 0 HG22 THR A 115 -8.734 19.289 -16.095 1.00 15.13 H new ATOM 0 HG23 THR A 115 -8.143 19.044 -14.434 1.00 15.13 H new ATOM 1765 N GLY A 116 -4.053 17.279 -16.926 1.00 34.53 N ATOM 1766 CA GLY A 116 -2.710 17.265 -17.507 1.00 4.14 C ATOM 1767 C GLY A 116 -1.608 17.045 -16.474 1.00 43.20 C ATOM 1768 O GLY A 116 -0.423 17.192 -16.776 1.00 72.42 O ATOM 0 H GLY A 116 -4.363 16.381 -16.555 1.00 34.53 H new ATOM 0 HA2 GLY A 116 -2.655 16.478 -18.260 1.00 4.14 H new ATOM 0 HA3 GLY A 116 -2.534 18.210 -18.020 1.00 4.14 H new ATOM 1772 N MET A 117 -2.000 16.690 -15.254 1.00 33.13 N ATOM 1773 CA MET A 117 -1.048 16.448 -14.163 1.00 11.12 C ATOM 1774 C MET A 117 -0.203 15.184 -14.398 1.00 11.24 C ATOM 1775 O MET A 117 -0.674 14.204 -14.981 1.00 45.15 O ATOM 1776 CB MET A 117 -1.798 16.360 -12.828 1.00 22.40 C ATOM 1777 CG MET A 117 -2.238 17.720 -12.311 1.00 73.42 C ATOM 1778 SD MET A 117 -3.158 18.659 -13.546 1.00 63.44 S ATOM 1779 CE MET A 117 -3.042 20.310 -12.862 1.00 1.41 C ATOM 0 H MET A 117 -2.977 16.562 -14.990 1.00 33.13 H new ATOM 0 HA MET A 117 -0.355 17.289 -14.133 1.00 11.12 H new ATOM 0 HB2 MET A 117 -2.673 15.722 -12.949 1.00 22.40 H new ATOM 0 HB3 MET A 117 -1.156 15.884 -12.086 1.00 22.40 H new ATOM 0 HG2 MET A 117 -2.858 17.586 -11.424 1.00 73.42 H new ATOM 0 HG3 MET A 117 -1.361 18.290 -12.004 1.00 73.42 H new ATOM 0 HE1 MET A 117 -3.564 21.011 -13.513 1.00 1.41 H new ATOM 0 HE2 MET A 117 -3.497 20.326 -11.872 1.00 1.41 H new ATOM 0 HE3 MET A 117 -1.994 20.599 -12.784 1.00 1.41 H new ATOM 1789 N PRO A 118 1.064 15.198 -13.931 1.00 54.31 N ATOM 1790 CA PRO A 118 2.011 14.091 -14.163 1.00 1.04 C ATOM 1791 C PRO A 118 1.673 12.823 -13.362 1.00 31.31 C ATOM 1792 O PRO A 118 1.634 12.838 -12.126 1.00 11.23 O ATOM 1793 CB PRO A 118 3.356 14.681 -13.717 1.00 51.54 C ATOM 1794 CG PRO A 118 3.006 15.732 -12.716 1.00 43.14 C ATOM 1795 CD PRO A 118 1.666 16.288 -13.131 1.00 22.42 C ATOM 0 HA PRO A 118 1.996 13.759 -15.201 1.00 1.04 H new ATOM 0 HB2 PRO A 118 3.996 13.916 -13.278 1.00 51.54 H new ATOM 0 HB3 PRO A 118 3.900 15.106 -14.561 1.00 51.54 H new ATOM 0 HG2 PRO A 118 2.957 15.311 -11.712 1.00 43.14 H new ATOM 0 HG3 PRO A 118 3.762 16.517 -12.696 1.00 43.14 H new ATOM 0 HD2 PRO A 118 1.051 16.536 -12.266 1.00 22.42 H new ATOM 0 HD3 PRO A 118 1.776 17.201 -13.717 1.00 22.42 H new ATOM 1803 N GLN A 119 1.458 11.716 -14.073 1.00 71.33 N ATOM 1804 CA GLN A 119 1.109 10.430 -13.449 1.00 33.34 C ATOM 1805 C GLN A 119 2.368 9.717 -12.907 1.00 44.22 C ATOM 1806 O GLN A 119 2.525 8.500 -13.023 1.00 35.23 O ATOM 1807 CB GLN A 119 0.358 9.556 -14.477 1.00 3.41 C ATOM 1808 CG GLN A 119 -0.283 8.293 -13.900 1.00 24.05 C ATOM 1809 CD GLN A 119 -1.170 7.568 -14.906 1.00 63.33 C ATOM 1810 OE1 GLN A 119 -1.774 8.181 -15.779 1.00 4.54 O ATOM 1811 NE2 GLN A 119 -1.256 6.257 -14.798 1.00 54.31 N ATOM 0 H GLN A 119 1.519 11.680 -15.091 1.00 71.33 H new ATOM 0 HA GLN A 119 0.455 10.607 -12.595 1.00 33.34 H new ATOM 0 HB2 GLN A 119 -0.419 10.159 -14.946 1.00 3.41 H new ATOM 0 HB3 GLN A 119 1.055 9.266 -15.264 1.00 3.41 H new ATOM 0 HG2 GLN A 119 0.501 7.616 -13.560 1.00 24.05 H new ATOM 0 HG3 GLN A 119 -0.876 8.559 -13.025 1.00 24.05 H new ATOM 0 HE21 GLN A 119 -0.743 5.771 -14.062 1.00 54.31 H new ATOM 0 HE22 GLN A 119 -1.835 5.728 -15.450 1.00 54.31 H new ATOM 1820 N PHE A 120 3.248 10.506 -12.290 1.00 3.12 N ATOM 1821 CA PHE A 120 4.501 10.013 -11.707 1.00 51.40 C ATOM 1822 C PHE A 120 4.762 10.644 -10.327 1.00 13.31 C ATOM 1823 O PHE A 120 5.618 10.180 -9.573 1.00 72.01 O ATOM 1824 CB PHE A 120 5.673 10.324 -12.646 1.00 62.51 C ATOM 1825 CG PHE A 120 5.714 9.468 -13.887 1.00 73.32 C ATOM 1826 CD1 PHE A 120 6.382 8.252 -13.884 1.00 31.43 C ATOM 1827 CD2 PHE A 120 5.090 9.880 -15.056 1.00 20.30 C ATOM 1828 CE1 PHE A 120 6.425 7.466 -15.019 1.00 54.14 C ATOM 1829 CE2 PHE A 120 5.129 9.096 -16.193 1.00 34.14 C ATOM 1830 CZ PHE A 120 5.798 7.889 -16.175 1.00 62.32 C ATOM 0 H PHE A 120 3.113 11.511 -12.179 1.00 3.12 H new ATOM 0 HA PHE A 120 4.410 8.934 -11.578 1.00 51.40 H new ATOM 0 HB2 PHE A 120 5.619 11.372 -12.942 1.00 62.51 H new ATOM 0 HB3 PHE A 120 6.607 10.196 -12.098 1.00 62.51 H new ATOM 0 HD1 PHE A 120 6.874 7.916 -12.983 1.00 31.43 H new ATOM 0 HD2 PHE A 120 4.568 10.825 -15.077 1.00 20.30 H new ATOM 0 HE1 PHE A 120 6.948 6.521 -15.003 1.00 54.14 H new ATOM 0 HE2 PHE A 120 4.636 9.427 -17.095 1.00 34.14 H new ATOM 0 HZ PHE A 120 5.831 7.276 -17.064 1.00 62.32 H new ATOM 1840 N LYS A 121 4.033 11.713 -10.006 1.00 71.45 N ATOM 1841 CA LYS A 121 4.159 12.374 -8.701 1.00 45.22 C ATOM 1842 C LYS A 121 3.231 11.725 -7.671 1.00 22.22 C ATOM 1843 O LYS A 121 2.027 11.586 -7.907 1.00 2.31 O ATOM 1844 CB LYS A 121 3.830 13.870 -8.815 1.00 21.24 C ATOM 1845 CG LYS A 121 3.930 14.627 -7.490 1.00 44.25 C ATOM 1846 CD LYS A 121 5.299 14.451 -6.838 1.00 14.44 C ATOM 1847 CE LYS A 121 5.332 15.008 -5.420 1.00 51.01 C ATOM 1848 NZ LYS A 121 6.598 14.659 -4.724 1.00 53.10 N ATOM 0 H LYS A 121 3.349 12.142 -10.629 1.00 71.45 H new ATOM 0 HA LYS A 121 5.191 12.260 -8.370 1.00 45.22 H new ATOM 0 HB2 LYS A 121 4.507 14.327 -9.536 1.00 21.24 H new ATOM 0 HB3 LYS A 121 2.821 13.981 -9.211 1.00 21.24 H new ATOM 0 HG2 LYS A 121 3.743 15.687 -7.662 1.00 44.25 H new ATOM 0 HG3 LYS A 121 3.155 14.273 -6.810 1.00 44.25 H new ATOM 0 HD2 LYS A 121 5.557 13.392 -6.818 1.00 14.44 H new ATOM 0 HD3 LYS A 121 6.055 14.952 -7.442 1.00 14.44 H new ATOM 0 HE2 LYS A 121 5.220 16.092 -5.452 1.00 51.01 H new ATOM 0 HE3 LYS A 121 4.486 14.617 -4.855 1.00 51.01 H new ATOM 0 HZ1 LYS A 121 6.531 14.935 -3.723 1.00 53.10 H new ATOM 0 HZ2 LYS A 121 6.760 13.634 -4.791 1.00 53.10 H new ATOM 0 HZ3 LYS A 121 7.390 15.164 -5.170 1.00 53.10 H new ATOM 1862 N GLY A 122 3.787 11.343 -6.525 1.00 74.02 N ATOM 1863 CA GLY A 122 2.993 10.688 -5.498 1.00 23.23 C ATOM 1864 C GLY A 122 3.040 11.385 -4.144 1.00 73.43 C ATOM 1865 O GLY A 122 3.733 12.390 -3.968 1.00 33.53 O ATOM 0 H GLY A 122 4.770 11.474 -6.289 1.00 74.02 H new ATOM 0 HA2 GLY A 122 1.957 10.634 -5.832 1.00 23.23 H new ATOM 0 HA3 GLY A 122 3.343 9.663 -5.380 1.00 23.23 H new ATOM 1869 N VAL A 123 2.292 10.853 -3.183 1.00 53.30 N ATOM 1870 CA VAL A 123 2.321 11.359 -1.804 1.00 24.30 C ATOM 1871 C VAL A 123 3.311 10.564 -0.949 1.00 24.24 C ATOM 1872 O VAL A 123 3.167 9.355 -0.787 1.00 22.01 O ATOM 1873 CB VAL A 123 0.928 11.286 -1.144 1.00 50.14 C ATOM 1874 CG1 VAL A 123 0.969 11.826 0.287 1.00 33.51 C ATOM 1875 CG2 VAL A 123 -0.097 12.036 -1.986 1.00 15.30 C ATOM 0 H VAL A 123 1.655 10.070 -3.328 1.00 53.30 H new ATOM 0 HA VAL A 123 2.636 12.401 -1.858 1.00 24.30 H new ATOM 0 HB VAL A 123 0.627 10.240 -1.091 1.00 50.14 H new ATOM 0 HG11 VAL A 123 -0.026 11.763 0.728 1.00 33.51 H new ATOM 0 HG12 VAL A 123 1.667 11.234 0.879 1.00 33.51 H new ATOM 0 HG13 VAL A 123 1.295 12.866 0.274 1.00 33.51 H new ATOM 0 HG21 VAL A 123 -1.075 11.976 -1.508 1.00 15.30 H new ATOM 0 HG22 VAL A 123 0.200 13.081 -2.075 1.00 15.30 H new ATOM 0 HG23 VAL A 123 -0.150 11.588 -2.978 1.00 15.30 H new ATOM 1885 N LYS A 124 4.308 11.241 -0.396 1.00 44.13 N ATOM 1886 CA LYS A 124 5.335 10.563 0.395 1.00 53.02 C ATOM 1887 C LYS A 124 4.828 10.123 1.775 1.00 31.11 C ATOM 1888 O LYS A 124 3.912 10.713 2.354 1.00 51.23 O ATOM 1889 CB LYS A 124 6.586 11.435 0.556 1.00 52.34 C ATOM 1890 CG LYS A 124 7.396 11.592 -0.726 1.00 12.35 C ATOM 1891 CD LYS A 124 8.816 12.073 -0.442 1.00 24.33 C ATOM 1892 CE LYS A 124 9.595 11.064 0.399 1.00 11.44 C ATOM 1893 NZ LYS A 124 10.999 11.494 0.636 1.00 31.03 N ATOM 0 H LYS A 124 4.431 12.250 -0.477 1.00 44.13 H new ATOM 0 HA LYS A 124 5.596 9.664 -0.164 1.00 53.02 H new ATOM 0 HB2 LYS A 124 6.287 12.422 0.909 1.00 52.34 H new ATOM 0 HB3 LYS A 124 7.223 11.001 1.326 1.00 52.34 H new ATOM 0 HG2 LYS A 124 7.433 10.638 -1.252 1.00 12.35 H new ATOM 0 HG3 LYS A 124 6.897 12.301 -1.387 1.00 12.35 H new ATOM 0 HD2 LYS A 124 9.338 12.243 -1.384 1.00 24.33 H new ATOM 0 HD3 LYS A 124 8.779 13.030 0.079 1.00 24.33 H new ATOM 0 HE2 LYS A 124 9.092 10.927 1.356 1.00 11.44 H new ATOM 0 HE3 LYS A 124 9.593 10.097 -0.103 1.00 11.44 H new ATOM 0 HZ1 LYS A 124 11.650 10.810 0.199 1.00 31.03 H new ATOM 0 HZ2 LYS A 124 11.150 12.433 0.216 1.00 31.03 H new ATOM 0 HZ3 LYS A 124 11.180 11.540 1.659 1.00 31.03 H new ATOM 1907 N GLY A 125 5.467 9.081 2.284 1.00 41.13 N ATOM 1908 CA GLY A 125 5.129 8.508 3.576 1.00 11.41 C ATOM 1909 C GLY A 125 6.104 7.403 3.965 1.00 10.10 C ATOM 1910 O GLY A 125 7.268 7.432 3.564 1.00 44.35 O ATOM 0 H GLY A 125 6.237 8.608 1.811 1.00 41.13 H new ATOM 0 HA2 GLY A 125 5.139 9.289 4.336 1.00 11.41 H new ATOM 0 HA3 GLY A 125 4.116 8.107 3.544 1.00 11.41 H new ATOM 1914 N THR A 126 5.642 6.420 4.729 1.00 41.01 N ATOM 1915 CA THR A 126 6.499 5.298 5.141 1.00 31.40 C ATOM 1916 C THR A 126 5.809 3.949 4.936 1.00 34.42 C ATOM 1917 O THR A 126 4.589 3.830 5.073 1.00 50.42 O ATOM 1918 CB THR A 126 6.924 5.408 6.624 1.00 53.30 C ATOM 1919 OG1 THR A 126 5.764 5.531 7.464 1.00 60.10 O ATOM 1920 CG2 THR A 126 7.850 6.599 6.844 1.00 55.32 C ATOM 0 H THR A 126 4.685 6.371 5.078 1.00 41.01 H new ATOM 0 HA THR A 126 7.383 5.354 4.506 1.00 31.40 H new ATOM 0 HB THR A 126 7.466 4.499 6.887 1.00 53.30 H new ATOM 0 HG1 THR A 126 6.033 5.470 8.404 1.00 60.10 H new ATOM 0 HG21 THR A 126 8.132 6.651 7.896 1.00 55.32 H new ATOM 0 HG22 THR A 126 8.745 6.482 6.233 1.00 55.32 H new ATOM 0 HG23 THR A 126 7.335 7.517 6.561 1.00 55.32 H new ATOM 1928 N VAL A 127 6.601 2.930 4.611 1.00 32.15 N ATOM 1929 CA VAL A 127 6.083 1.572 4.440 1.00 23.51 C ATOM 1930 C VAL A 127 6.780 0.595 5.398 1.00 64.12 C ATOM 1931 O VAL A 127 7.975 0.725 5.685 1.00 62.51 O ATOM 1932 CB VAL A 127 6.258 1.080 2.977 1.00 22.45 C ATOM 1933 CG1 VAL A 127 7.738 0.967 2.607 1.00 62.14 C ATOM 1934 CG2 VAL A 127 5.534 -0.248 2.760 1.00 51.14 C ATOM 0 H VAL A 127 7.606 3.018 4.460 1.00 32.15 H new ATOM 0 HA VAL A 127 5.018 1.601 4.673 1.00 23.51 H new ATOM 0 HB VAL A 127 5.807 1.821 2.317 1.00 22.45 H new ATOM 0 HG11 VAL A 127 7.830 0.621 1.578 1.00 62.14 H new ATOM 0 HG12 VAL A 127 8.213 1.943 2.705 1.00 62.14 H new ATOM 0 HG13 VAL A 127 8.227 0.257 3.274 1.00 62.14 H new ATOM 0 HG21 VAL A 127 5.671 -0.573 1.728 1.00 51.14 H new ATOM 0 HG22 VAL A 127 5.943 -1.000 3.434 1.00 51.14 H new ATOM 0 HG23 VAL A 127 4.471 -0.120 2.962 1.00 51.14 H new ATOM 1944 N GLU A 128 6.020 -0.372 5.894 1.00 43.42 N ATOM 1945 CA GLU A 128 6.547 -1.402 6.791 1.00 11.34 C ATOM 1946 C GLU A 128 5.776 -2.719 6.622 1.00 72.01 C ATOM 1947 O GLU A 128 4.607 -2.717 6.237 1.00 32.42 O ATOM 1948 CB GLU A 128 6.432 -0.933 8.249 1.00 25.01 C ATOM 1949 CG GLU A 128 5.012 -0.525 8.639 1.00 41.34 C ATOM 1950 CD GLU A 128 4.828 -0.295 10.131 1.00 72.53 C ATOM 1951 OE1 GLU A 128 5.192 0.794 10.622 1.00 11.54 O ATOM 1952 OE2 GLU A 128 4.287 -1.188 10.815 1.00 32.10 O ATOM 0 H GLU A 128 5.025 -0.468 5.690 1.00 43.42 H new ATOM 0 HA GLU A 128 7.594 -1.571 6.538 1.00 11.34 H new ATOM 0 HB2 GLU A 128 6.768 -1.733 8.909 1.00 25.01 H new ATOM 0 HB3 GLU A 128 7.102 -0.088 8.406 1.00 25.01 H new ATOM 0 HG2 GLU A 128 4.746 0.387 8.105 1.00 41.34 H new ATOM 0 HG3 GLU A 128 4.318 -1.300 8.312 1.00 41.34 H new ATOM 1959 N LYS A 129 6.435 -3.841 6.900 1.00 1.52 N ATOM 1960 CA LYS A 129 5.741 -5.130 6.967 1.00 21.40 C ATOM 1961 C LYS A 129 4.901 -5.189 8.248 1.00 1.22 C ATOM 1962 O LYS A 129 5.383 -4.842 9.327 1.00 63.31 O ATOM 1963 CB LYS A 129 6.737 -6.293 6.953 1.00 62.01 C ATOM 1964 CG LYS A 129 6.070 -7.669 6.976 1.00 34.03 C ATOM 1965 CD LYS A 129 7.042 -8.765 7.400 1.00 0.31 C ATOM 1966 CE LYS A 129 8.149 -9.000 6.379 1.00 52.53 C ATOM 1967 NZ LYS A 129 7.661 -9.736 5.183 1.00 21.14 N ATOM 0 H LYS A 129 7.438 -3.888 7.081 1.00 1.52 H new ATOM 0 HA LYS A 129 5.096 -5.221 6.093 1.00 21.40 H new ATOM 0 HB2 LYS A 129 7.361 -6.216 6.063 1.00 62.01 H new ATOM 0 HB3 LYS A 129 7.399 -6.204 7.815 1.00 62.01 H new ATOM 0 HG2 LYS A 129 5.223 -7.650 7.661 1.00 34.03 H new ATOM 0 HG3 LYS A 129 5.675 -7.897 5.986 1.00 34.03 H new ATOM 0 HD2 LYS A 129 7.488 -8.498 8.358 1.00 0.31 H new ATOM 0 HD3 LYS A 129 6.492 -9.693 7.553 1.00 0.31 H new ATOM 0 HE2 LYS A 129 8.565 -8.041 6.069 1.00 52.53 H new ATOM 0 HE3 LYS A 129 8.958 -9.563 6.845 1.00 52.53 H new ATOM 0 HZ1 LYS A 129 8.469 -10.153 4.678 1.00 21.14 H new ATOM 0 HZ2 LYS A 129 7.012 -10.492 5.481 1.00 21.14 H new ATOM 0 HZ3 LYS A 129 7.160 -9.079 4.552 1.00 21.14 H new ATOM 1981 N THR A 130 3.660 -5.649 8.149 1.00 65.31 N ATOM 1982 CA THR A 130 2.742 -5.576 9.295 1.00 40.11 C ATOM 1983 C THR A 130 2.117 -6.928 9.649 1.00 72.52 C ATOM 1984 O THR A 130 2.062 -7.846 8.832 1.00 65.10 O ATOM 1985 CB THR A 130 1.606 -4.552 9.060 1.00 54.52 C ATOM 1986 OG1 THR A 130 0.758 -4.481 10.220 1.00 42.05 O ATOM 1987 CG2 THR A 130 0.770 -4.920 7.839 1.00 12.30 C ATOM 0 H THR A 130 3.265 -6.070 7.308 1.00 65.31 H new ATOM 0 HA THR A 130 3.361 -5.252 10.132 1.00 40.11 H new ATOM 0 HB THR A 130 2.065 -3.580 8.881 1.00 54.52 H new ATOM 0 HG1 THR A 130 0.766 -3.568 10.575 1.00 42.05 H new ATOM 0 HG21 THR A 130 -0.019 -4.181 7.702 1.00 12.30 H new ATOM 0 HG22 THR A 130 1.407 -4.939 6.954 1.00 12.30 H new ATOM 0 HG23 THR A 130 0.324 -5.904 7.986 1.00 12.30 H new ATOM 1995 N ASP A 131 1.651 -7.026 10.888 1.00 0.41 N ATOM 1996 CA ASP A 131 0.979 -8.224 11.390 1.00 42.53 C ATOM 1997 C ASP A 131 -0.524 -8.198 11.044 1.00 44.21 C ATOM 1998 O ASP A 131 -1.211 -9.223 11.095 1.00 54.55 O ATOM 1999 CB ASP A 131 1.194 -8.300 12.908 1.00 43.33 C ATOM 2000 CG ASP A 131 0.514 -9.491 13.557 1.00 50.45 C ATOM 2001 OD1 ASP A 131 1.000 -10.625 13.381 1.00 51.45 O ATOM 2002 OD2 ASP A 131 -0.498 -9.292 14.261 1.00 74.52 O ATOM 0 H ASP A 131 1.727 -6.277 11.576 1.00 0.41 H new ATOM 0 HA ASP A 131 1.401 -9.110 10.915 1.00 42.53 H new ATOM 0 HB2 ASP A 131 2.263 -8.346 13.114 1.00 43.33 H new ATOM 0 HB3 ASP A 131 0.820 -7.384 13.366 1.00 43.33 H new ATOM 2007 N GLU A 132 -1.016 -7.018 10.672 1.00 31.35 N ATOM 2008 CA GLU A 132 -2.435 -6.828 10.357 1.00 25.44 C ATOM 2009 C GLU A 132 -2.825 -7.439 9.008 1.00 62.41 C ATOM 2010 O GLU A 132 -1.994 -7.614 8.117 1.00 14.32 O ATOM 2011 CB GLU A 132 -2.787 -5.336 10.366 1.00 14.20 C ATOM 2012 CG GLU A 132 -2.722 -4.700 11.747 1.00 43.24 C ATOM 2013 CD GLU A 132 -3.720 -5.311 12.719 1.00 73.54 C ATOM 2014 OE1 GLU A 132 -4.877 -4.848 12.760 1.00 75.43 O ATOM 2015 OE2 GLU A 132 -3.357 -6.261 13.445 1.00 43.23 O ATOM 0 H GLU A 132 -0.451 -6.173 10.580 1.00 31.35 H new ATOM 0 HA GLU A 132 -3.001 -7.348 11.130 1.00 25.44 H new ATOM 0 HB2 GLU A 132 -2.105 -4.807 9.700 1.00 14.20 H new ATOM 0 HB3 GLU A 132 -3.791 -5.206 9.963 1.00 14.20 H new ATOM 0 HG2 GLU A 132 -1.715 -4.812 12.148 1.00 43.24 H new ATOM 0 HG3 GLU A 132 -2.913 -3.630 11.660 1.00 43.24 H new ATOM 2022 N LYS A 133 -4.110 -7.750 8.876 1.00 33.32 N ATOM 2023 CA LYS A 133 -4.654 -8.324 7.642 1.00 35.42 C ATOM 2024 C LYS A 133 -4.853 -7.246 6.565 1.00 21.54 C ATOM 2025 O LYS A 133 -4.987 -6.061 6.877 1.00 34.42 O ATOM 2026 CB LYS A 133 -5.998 -9.030 7.922 1.00 3.35 C ATOM 2027 CG LYS A 133 -7.211 -8.092 8.008 1.00 61.04 C ATOM 2028 CD LYS A 133 -7.114 -7.100 9.171 1.00 75.43 C ATOM 2029 CE LYS A 133 -8.246 -6.078 9.141 1.00 1.00 C ATOM 2030 NZ LYS A 133 -8.199 -5.153 10.304 1.00 65.44 N ATOM 0 H LYS A 133 -4.802 -7.614 9.613 1.00 33.32 H new ATOM 0 HA LYS A 133 -3.933 -9.053 7.272 1.00 35.42 H new ATOM 0 HB2 LYS A 133 -6.178 -9.763 7.136 1.00 3.35 H new ATOM 0 HB3 LYS A 133 -5.915 -9.581 8.859 1.00 3.35 H new ATOM 0 HG2 LYS A 133 -7.305 -7.540 7.073 1.00 61.04 H new ATOM 0 HG3 LYS A 133 -8.117 -8.687 8.119 1.00 61.04 H new ATOM 0 HD2 LYS A 133 -7.140 -7.644 10.115 1.00 75.43 H new ATOM 0 HD3 LYS A 133 -6.156 -6.582 9.128 1.00 75.43 H new ATOM 0 HE2 LYS A 133 -8.188 -5.501 8.218 1.00 1.00 H new ATOM 0 HE3 LYS A 133 -9.203 -6.599 9.132 1.00 1.00 H new ATOM 0 HZ1 LYS A 133 -8.987 -4.477 10.242 1.00 65.44 H new ATOM 0 HZ2 LYS A 133 -8.281 -5.699 11.185 1.00 65.44 H new ATOM 0 HZ3 LYS A 133 -7.297 -4.635 10.300 1.00 65.44 H new ATOM 2044 N VAL A 134 -4.880 -7.659 5.299 1.00 71.44 N ATOM 2045 CA VAL A 134 -5.211 -6.738 4.209 1.00 33.32 C ATOM 2046 C VAL A 134 -6.690 -6.356 4.283 1.00 42.42 C ATOM 2047 O VAL A 134 -7.557 -7.225 4.428 1.00 43.20 O ATOM 2048 CB VAL A 134 -4.897 -7.342 2.815 1.00 61.41 C ATOM 2049 CG1 VAL A 134 -5.435 -6.451 1.692 1.00 61.13 C ATOM 2050 CG2 VAL A 134 -3.395 -7.551 2.654 1.00 14.54 C ATOM 0 H VAL A 134 -4.679 -8.614 5.003 1.00 71.44 H new ATOM 0 HA VAL A 134 -4.589 -5.851 4.331 1.00 33.32 H new ATOM 0 HB VAL A 134 -5.396 -8.308 2.746 1.00 61.41 H new ATOM 0 HG11 VAL A 134 -5.200 -6.900 0.727 1.00 61.13 H new ATOM 0 HG12 VAL A 134 -6.516 -6.352 1.792 1.00 61.13 H new ATOM 0 HG13 VAL A 134 -4.973 -5.466 1.756 1.00 61.13 H new ATOM 0 HG21 VAL A 134 -3.190 -7.975 1.671 1.00 14.54 H new ATOM 0 HG22 VAL A 134 -2.882 -6.594 2.750 1.00 14.54 H new ATOM 0 HG23 VAL A 134 -3.038 -8.233 3.425 1.00 14.54 H new ATOM 2060 N LEU A 135 -6.975 -5.062 4.207 1.00 53.15 N ATOM 2061 CA LEU A 135 -8.350 -4.577 4.330 1.00 13.45 C ATOM 2062 C LEU A 135 -9.247 -5.094 3.200 1.00 71.45 C ATOM 2063 O LEU A 135 -8.882 -5.047 2.030 1.00 51.23 O ATOM 2064 CB LEU A 135 -8.383 -3.040 4.365 1.00 70.20 C ATOM 2065 CG LEU A 135 -8.238 -2.415 5.763 1.00 22.32 C ATOM 2066 CD1 LEU A 135 -8.200 -0.893 5.679 1.00 11.51 C ATOM 2067 CD2 LEU A 135 -9.382 -2.870 6.667 1.00 12.44 C ATOM 0 H LEU A 135 -6.279 -4.331 4.062 1.00 53.15 H new ATOM 0 HA LEU A 135 -8.742 -4.966 5.270 1.00 13.45 H new ATOM 0 HB2 LEU A 135 -7.583 -2.661 3.730 1.00 70.20 H new ATOM 0 HB3 LEU A 135 -9.323 -2.702 3.929 1.00 70.20 H new ATOM 0 HG LEU A 135 -7.295 -2.754 6.192 1.00 22.32 H new ATOM 0 HD11 LEU A 135 -8.097 -0.476 6.681 1.00 11.51 H new ATOM 0 HD12 LEU A 135 -7.352 -0.583 5.068 1.00 11.51 H new ATOM 0 HD13 LEU A 135 -9.124 -0.530 5.228 1.00 11.51 H new ATOM 0 HD21 LEU A 135 -9.267 -2.420 7.653 1.00 12.44 H new ATOM 0 HD22 LEU A 135 -10.333 -2.559 6.235 1.00 12.44 H new ATOM 0 HD23 LEU A 135 -9.363 -3.956 6.759 1.00 12.44 H new ATOM 2079 N SER A 136 -10.420 -5.601 3.565 1.00 20.20 N ATOM 2080 CA SER A 136 -11.440 -5.952 2.574 1.00 35.10 C ATOM 2081 C SER A 136 -12.112 -4.676 2.062 1.00 61.42 C ATOM 2082 O SER A 136 -12.279 -3.726 2.819 1.00 21.23 O ATOM 2083 CB SER A 136 -12.483 -6.902 3.179 1.00 33.02 C ATOM 2084 OG SER A 136 -11.917 -8.171 3.475 1.00 24.32 O ATOM 0 H SER A 136 -10.690 -5.778 4.532 1.00 20.20 H new ATOM 0 HA SER A 136 -10.962 -6.467 1.741 1.00 35.10 H new ATOM 0 HB2 SER A 136 -12.893 -6.463 4.089 1.00 33.02 H new ATOM 0 HB3 SER A 136 -13.313 -7.025 2.483 1.00 33.02 H new ATOM 0 HG SER A 136 -12.604 -8.754 3.860 1.00 24.32 H new ATOM 2090 N VAL A 137 -12.501 -4.661 0.790 1.00 22.54 N ATOM 2091 CA VAL A 137 -13.014 -3.442 0.143 1.00 62.34 C ATOM 2092 C VAL A 137 -14.063 -2.702 1.003 1.00 52.33 C ATOM 2093 O VAL A 137 -13.950 -1.497 1.233 1.00 73.12 O ATOM 2094 CB VAL A 137 -13.616 -3.757 -1.250 1.00 12.30 C ATOM 2095 CG1 VAL A 137 -14.174 -2.494 -1.911 1.00 31.54 C ATOM 2096 CG2 VAL A 137 -12.573 -4.422 -2.152 1.00 23.21 C ATOM 0 H VAL A 137 -12.473 -5.478 0.180 1.00 22.54 H new ATOM 0 HA VAL A 137 -12.155 -2.782 0.027 1.00 62.34 H new ATOM 0 HB VAL A 137 -14.443 -4.453 -1.107 1.00 12.30 H new ATOM 0 HG11 VAL A 137 -14.589 -2.747 -2.887 1.00 31.54 H new ATOM 0 HG12 VAL A 137 -14.957 -2.070 -1.282 1.00 31.54 H new ATOM 0 HG13 VAL A 137 -13.374 -1.765 -2.036 1.00 31.54 H new ATOM 0 HG21 VAL A 137 -13.016 -4.635 -3.125 1.00 23.21 H new ATOM 0 HG22 VAL A 137 -11.722 -3.753 -2.279 1.00 23.21 H new ATOM 0 HG23 VAL A 137 -12.237 -5.353 -1.695 1.00 23.21 H new ATOM 2106 N LYS A 138 -15.080 -3.421 1.479 1.00 62.31 N ATOM 2107 CA LYS A 138 -16.123 -2.810 2.316 1.00 64.21 C ATOM 2108 C LYS A 138 -15.605 -2.491 3.731 1.00 54.11 C ATOM 2109 O LYS A 138 -15.940 -1.454 4.306 1.00 51.12 O ATOM 2110 CB LYS A 138 -17.353 -3.721 2.407 1.00 30.24 C ATOM 2111 CG LYS A 138 -18.547 -3.047 3.077 1.00 2.11 C ATOM 2112 CD LYS A 138 -19.728 -3.995 3.245 1.00 41.23 C ATOM 2113 CE LYS A 138 -19.414 -5.128 4.215 1.00 51.30 C ATOM 2114 NZ LYS A 138 -20.606 -5.976 4.479 1.00 13.04 N ATOM 0 H LYS A 138 -15.207 -4.418 1.304 1.00 62.31 H new ATOM 0 HA LYS A 138 -16.407 -1.872 1.838 1.00 64.21 H new ATOM 0 HB2 LYS A 138 -17.638 -4.038 1.404 1.00 30.24 H new ATOM 0 HB3 LYS A 138 -17.091 -4.621 2.964 1.00 30.24 H new ATOM 0 HG2 LYS A 138 -18.246 -2.668 4.054 1.00 2.11 H new ATOM 0 HG3 LYS A 138 -18.856 -2.187 2.483 1.00 2.11 H new ATOM 0 HD2 LYS A 138 -20.593 -3.438 3.606 1.00 41.23 H new ATOM 0 HD3 LYS A 138 -20.000 -4.412 2.275 1.00 41.23 H new ATOM 0 HE2 LYS A 138 -18.613 -5.744 3.807 1.00 51.30 H new ATOM 0 HE3 LYS A 138 -19.049 -4.712 5.154 1.00 51.30 H new ATOM 0 HZ1 LYS A 138 -20.352 -6.735 5.143 1.00 13.04 H new ATOM 0 HZ2 LYS A 138 -21.362 -5.393 4.892 1.00 13.04 H new ATOM 0 HZ3 LYS A 138 -20.939 -6.394 3.587 1.00 13.04 H new ATOM 2128 N GLU A 139 -14.782 -3.384 4.280 1.00 11.44 N ATOM 2129 CA GLU A 139 -14.195 -3.196 5.611 1.00 73.32 C ATOM 2130 C GLU A 139 -13.384 -1.893 5.649 1.00 35.15 C ATOM 2131 O GLU A 139 -13.388 -1.154 6.638 1.00 61.41 O ATOM 2132 CB GLU A 139 -13.307 -4.408 5.932 1.00 11.25 C ATOM 2133 CG GLU A 139 -12.502 -4.294 7.220 1.00 0.11 C ATOM 2134 CD GLU A 139 -11.667 -5.537 7.486 1.00 41.23 C ATOM 2135 OE1 GLU A 139 -10.742 -5.818 6.691 1.00 14.23 O ATOM 2136 OE2 GLU A 139 -11.944 -6.256 8.473 1.00 73.23 O ATOM 0 H GLU A 139 -14.504 -4.252 3.821 1.00 11.44 H new ATOM 0 HA GLU A 139 -14.982 -3.120 6.362 1.00 73.32 H new ATOM 0 HB2 GLU A 139 -13.937 -5.295 5.993 1.00 11.25 H new ATOM 0 HB3 GLU A 139 -12.617 -4.563 5.103 1.00 11.25 H new ATOM 0 HG2 GLU A 139 -11.848 -3.424 7.162 1.00 0.11 H new ATOM 0 HG3 GLU A 139 -13.180 -4.128 8.057 1.00 0.11 H new ATOM 2143 N LEU A 140 -12.711 -1.622 4.540 1.00 61.11 N ATOM 2144 CA LEU A 140 -11.990 -0.382 4.333 1.00 55.12 C ATOM 2145 C LEU A 140 -12.941 0.821 4.422 1.00 4.11 C ATOM 2146 O LEU A 140 -12.617 1.836 5.041 1.00 2.51 O ATOM 2147 CB LEU A 140 -11.311 -0.444 2.961 1.00 3.10 C ATOM 2148 CG LEU A 140 -10.125 0.499 2.774 1.00 42.41 C ATOM 2149 CD1 LEU A 140 -9.216 -0.014 1.672 1.00 14.54 C ATOM 2150 CD2 LEU A 140 -10.575 1.924 2.465 1.00 54.03 C ATOM 0 H LEU A 140 -12.652 -2.267 3.752 1.00 61.11 H new ATOM 0 HA LEU A 140 -11.236 -0.256 5.110 1.00 55.12 H new ATOM 0 HB2 LEU A 140 -10.972 -1.465 2.788 1.00 3.10 H new ATOM 0 HB3 LEU A 140 -12.055 -0.221 2.196 1.00 3.10 H new ATOM 0 HG LEU A 140 -9.574 0.524 3.714 1.00 42.41 H new ATOM 0 HD11 LEU A 140 -8.374 0.667 1.548 1.00 14.54 H new ATOM 0 HD12 LEU A 140 -8.846 -1.004 1.937 1.00 14.54 H new ATOM 0 HD13 LEU A 140 -9.775 -0.074 0.738 1.00 14.54 H new ATOM 0 HD21 LEU A 140 -9.701 2.562 2.339 1.00 54.03 H new ATOM 0 HD22 LEU A 140 -11.163 1.929 1.547 1.00 54.03 H new ATOM 0 HD23 LEU A 140 -11.183 2.300 3.288 1.00 54.03 H new ATOM 2162 N LEU A 141 -14.122 0.689 3.813 1.00 0.35 N ATOM 2163 CA LEU A 141 -15.140 1.745 3.858 1.00 52.50 C ATOM 2164 C LEU A 141 -15.514 2.066 5.312 1.00 25.32 C ATOM 2165 O LEU A 141 -15.566 3.229 5.716 1.00 35.15 O ATOM 2166 CB LEU A 141 -16.401 1.323 3.082 1.00 22.30 C ATOM 2167 CG LEU A 141 -16.167 0.833 1.641 1.00 70.12 C ATOM 2168 CD1 LEU A 141 -17.492 0.478 0.968 1.00 23.33 C ATOM 2169 CD2 LEU A 141 -15.401 1.870 0.824 1.00 73.14 C ATOM 0 H LEU A 141 -14.398 -0.138 3.283 1.00 0.35 H new ATOM 0 HA LEU A 141 -14.721 2.636 3.390 1.00 52.50 H new ATOM 0 HB2 LEU A 141 -16.899 0.530 3.639 1.00 22.30 H new ATOM 0 HB3 LEU A 141 -17.086 2.170 3.051 1.00 22.30 H new ATOM 0 HG LEU A 141 -15.557 -0.069 1.688 1.00 70.12 H new ATOM 0 HD11 LEU A 141 -17.303 0.134 -0.049 1.00 23.33 H new ATOM 0 HD12 LEU A 141 -17.986 -0.313 1.532 1.00 23.33 H new ATOM 0 HD13 LEU A 141 -18.133 1.359 0.940 1.00 23.33 H new ATOM 0 HD21 LEU A 141 -15.251 1.496 -0.189 1.00 73.14 H new ATOM 0 HD22 LEU A 141 -15.971 2.798 0.787 1.00 73.14 H new ATOM 0 HD23 LEU A 141 -14.433 2.057 1.289 1.00 73.14 H new ATOM 2181 N GLU A 142 -15.756 1.018 6.096 1.00 31.33 N ATOM 2182 CA GLU A 142 -16.081 1.167 7.518 1.00 11.44 C ATOM 2183 C GLU A 142 -14.922 1.827 8.287 1.00 24.33 C ATOM 2184 O GLU A 142 -15.140 2.592 9.229 1.00 74.34 O ATOM 2185 CB GLU A 142 -16.434 -0.202 8.125 1.00 54.25 C ATOM 2186 CG GLU A 142 -17.617 -0.886 7.434 1.00 13.24 C ATOM 2187 CD GLU A 142 -17.995 -2.222 8.066 1.00 23.11 C ATOM 2188 OE1 GLU A 142 -17.454 -3.264 7.644 1.00 33.23 O ATOM 2189 OE2 GLU A 142 -18.850 -2.234 8.979 1.00 33.25 O ATOM 0 H GLU A 142 -15.734 0.051 5.772 1.00 31.33 H new ATOM 0 HA GLU A 142 -16.948 1.822 7.606 1.00 11.44 H new ATOM 0 HB2 GLU A 142 -15.562 -0.853 8.066 1.00 54.25 H new ATOM 0 HB3 GLU A 142 -16.665 -0.074 9.183 1.00 54.25 H new ATOM 0 HG2 GLU A 142 -18.480 -0.221 7.464 1.00 13.24 H new ATOM 0 HG3 GLU A 142 -17.373 -1.045 6.384 1.00 13.24 H new ATOM 2196 N ALA A 143 -13.690 1.544 7.861 1.00 2.34 N ATOM 2197 CA ALA A 143 -12.493 2.123 8.486 1.00 2.45 C ATOM 2198 C ALA A 143 -12.320 3.620 8.158 1.00 14.32 C ATOM 2199 O ALA A 143 -12.033 4.424 9.043 1.00 42.54 O ATOM 2200 CB ALA A 143 -11.252 1.344 8.061 1.00 54.10 C ATOM 0 H ALA A 143 -13.491 0.915 7.083 1.00 2.34 H new ATOM 0 HA ALA A 143 -12.624 2.045 9.565 1.00 2.45 H new ATOM 0 HB1 ALA A 143 -10.370 1.781 8.529 1.00 54.10 H new ATOM 0 HB2 ALA A 143 -11.351 0.304 8.372 1.00 54.10 H new ATOM 0 HB3 ALA A 143 -11.147 1.390 6.977 1.00 54.10 H new ATOM 2206 N ILE A 144 -12.501 3.996 6.887 1.00 43.41 N ATOM 2207 CA ILE A 144 -12.297 5.393 6.457 1.00 75.52 C ATOM 2208 C ILE A 144 -13.438 6.324 6.893 1.00 12.41 C ATOM 2209 O ILE A 144 -13.343 7.544 6.742 1.00 41.11 O ATOM 2210 CB ILE A 144 -12.084 5.505 4.918 1.00 4.15 C ATOM 2211 CG1 ILE A 144 -13.230 4.845 4.121 1.00 31.44 C ATOM 2212 CG2 ILE A 144 -10.746 4.888 4.532 1.00 51.00 C ATOM 2213 CD1 ILE A 144 -14.474 5.700 3.965 1.00 54.40 C ATOM 0 H ILE A 144 -12.786 3.362 6.140 1.00 43.41 H new ATOM 0 HA ILE A 144 -11.388 5.721 6.961 1.00 75.52 H new ATOM 0 HB ILE A 144 -12.083 6.565 4.662 1.00 4.15 H new ATOM 0 HG12 ILE A 144 -12.860 4.583 3.130 1.00 31.44 H new ATOM 0 HG13 ILE A 144 -13.507 3.913 4.614 1.00 31.44 H new ATOM 0 HG21 ILE A 144 -10.605 4.970 3.454 1.00 51.00 H new ATOM 0 HG22 ILE A 144 -9.941 5.415 5.045 1.00 51.00 H new ATOM 0 HG23 ILE A 144 -10.733 3.837 4.820 1.00 51.00 H new ATOM 0 HD11 ILE A 144 -15.222 5.152 3.392 1.00 54.40 H new ATOM 0 HD12 ILE A 144 -14.876 5.941 4.949 1.00 54.40 H new ATOM 0 HD13 ILE A 144 -14.219 6.621 3.442 1.00 54.40 H new ATOM 2225 N GLY A 145 -14.515 5.749 7.416 1.00 73.20 N ATOM 2226 CA GLY A 145 -15.635 6.553 7.901 1.00 1.30 C ATOM 2227 C GLY A 145 -16.987 5.870 7.724 1.00 5.01 C ATOM 2228 O GLY A 145 -17.823 5.891 8.627 1.00 72.44 O ATOM 0 H GLY A 145 -14.638 4.741 7.515 1.00 73.20 H new ATOM 0 HA2 GLY A 145 -15.483 6.776 8.957 1.00 1.30 H new ATOM 0 HA3 GLY A 145 -15.645 7.506 7.373 1.00 1.30 H new ATOM 2232 N SER A 146 -17.200 5.255 6.564 1.00 13.03 N ATOM 2233 CA SER A 146 -18.469 4.576 6.264 1.00 1.40 C ATOM 2234 C SER A 146 -18.698 3.392 7.207 1.00 1.04 C ATOM 2235 O SER A 146 -19.597 2.574 6.997 1.00 44.31 O ATOM 2236 CB SER A 146 -18.487 4.088 4.807 1.00 55.04 C ATOM 2237 OG SER A 146 -18.286 5.158 3.899 1.00 55.11 O ATOM 0 H SER A 146 -16.513 5.210 5.812 1.00 13.03 H new ATOM 0 HA SER A 146 -19.273 5.297 6.411 1.00 1.40 H new ATOM 0 HB2 SER A 146 -17.710 3.337 4.664 1.00 55.04 H new ATOM 0 HB3 SER A 146 -19.441 3.604 4.596 1.00 55.04 H new ATOM 0 HG SER A 146 -18.301 4.815 2.981 1.00 55.11 H new TER 2243 SER A 146