USER MOD reduce.3.24.130724 H: found=0, std=0, add=1155, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1149 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 79 ASN : amide:sc= -1.2 K(o=-1.3,f=-7.1!) USER MOD Set 1.2: A 123 TYR OH : rot 30:sc= -0.0628 USER MOD Set 2.1: A 116 ASN : amide:sc= 1.12 K(o=1.1,f=-3.7) USER MOD Set 2.2: A 117 GLN : amide:sc= 0.0237 K(o=1.1,f=-0.61) USER MOD Set 3.1: A 115 TYR OH : rot -175:sc= 0.859 USER MOD Set 3.2: A 145 ASN : amide:sc= 0.441 K(o=1.3,f=0.75) USER MOD Set 4.1: A 86 LYS NZ :NH3+ -125:sc= 1.25 (180deg=0) USER MOD Set 4.2: A 87 SER OG : rot -103:sc= 2.3 USER MOD Set 5.1: A 53 TYR OH : rot 180:sc= 0.426 USER MOD Set 5.2: A 76 LYS NZ :NH3+ -164:sc= 1.17 (180deg=-0.0161) USER MOD Set 6.1: A 66 LYS NZ :NH3+ 173:sc= 0.515 (180deg=0.226) USER MOD Set 6.2: A 68 THR OG1 : rot 98:sc= 0.542 USER MOD Set 7.1: A 40 THR OG1 : rot -170:sc= 0.0684 USER MOD Set 7.2: A 106 HIS : no HE2:sc= -2.01 K(o=-1.9,f=-4.9) USER MOD Set 8.1: A 18 SER OG : rot 18:sc= 1.93 USER MOD Set 8.2: A 21 SER OG : rot 1:sc= 2.39 USER MOD Set 9.1: A 12 THR OG1 : rot 170:sc= 0.0505 USER MOD Set 9.2: A 39 HIS : no HE2:sc= -0.244 K(o=-0.19,f=-6.8!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 1.3 (180deg=1.3) USER MOD Single : A 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 3 SER OG : rot 37:sc= 0.735 USER MOD Single : A 4 HIS : no HE2:sc= 1.13 K(o=1.1,f=-3.5!) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0.188 USER MOD Single : A 11 GLN : amide:sc= -0.824 K(o=-0.82,f=-2.2) USER MOD Single : A 14 GLN : amide:sc= 1.4 K(o=1.4,f=-0.021) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 20 HIS : no HE2:sc= 1.02 K(o=1,f=-4.8!) USER MOD Single : A 23 LYS NZ :NH3+ 179:sc= 2.37 (180deg=2.25) USER MOD Single : A 24 MET CE :methyl 174:sc= 0 (180deg=-0.0556) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0.92 K(o=0.92,f=-5!) USER MOD Single : A 41 SER OG : rot 128:sc= 0.982 USER MOD Single : A 44 LYS NZ :NH3+ 177:sc= 1.33 (180deg=1.16) USER MOD Single : A 52 THR OG1 : rot -45:sc= 0.437 USER MOD Single : A 56 THR OG1 : rot 50:sc= 0.574 USER MOD Single : A 60 SER OG : rot -36:sc= 0.414 USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 17:sc= 0.923 USER MOD Single : A 77 GLN : amide:sc= -3.31! K(o=-3.3!,f=-0.039) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 HIS : no HE2:sc= 0.497 K(o=0.5,f=-2.9!) USER MOD Single : A 91 ASN : amide:sc= 0.0922 X(o=0.092,f=-0.0083) USER MOD Single : A 100 LYS NZ :NH3+ -121:sc= 1.03 (180deg=-1.03!) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 163:sc= 1.3 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot 37:sc= 0.214 USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= -0.69 K(o=-0.69,f=-0.072) USER MOD Single : A 138 SER OG : rot 13:sc= 0.81 USER MOD Single : A 142 LYS NZ :NH3+ 140:sc= 1.19 (180deg=1.09) USER MOD Single : A 143 THR OG1 : rot 157:sc= 0.928 USER MOD Single : A 149 HIS : no HE2:sc= 0.272 K(o=0.27,f=-8!) USER MOD Single : A 155 LYS NZ :NH3+ 165:sc= 1.25 (180deg=1.16) USER MOD Single : A 156 GLN : amide:sc= -0.964 K(o=-0.96,f=-0.35) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -20.904 -12.277 -21.278 1.00 42.70 N ATOM 2 CA MET A 1 -21.413 -11.265 -22.219 1.00 43.30 C ATOM 3 C MET A 1 -21.782 -12.018 -23.495 1.00 42.20 C ATOM 4 O MET A 1 -21.114 -13.011 -23.786 1.00 41.40 O ATOM 5 CB MET A 1 -20.357 -10.168 -22.436 1.00 44.23 C ATOM 6 CG MET A 1 -20.918 -8.855 -23.002 1.00 45.63 C ATOM 7 SD MET A 1 -21.432 -8.877 -24.736 1.00 46.82 S ATOM 8 CE MET A 1 -22.021 -7.180 -24.918 1.00 48.32 C ATOM 0 H1 MET A 1 -20.636 -11.817 -20.385 1.00 42.70 H new ATOM 0 H2 MET A 1 -21.644 -12.984 -21.094 1.00 42.70 H new ATOM 0 H3 MET A 1 -20.072 -12.746 -21.689 1.00 42.70 H new ATOM 0 HA MET A 1 -22.294 -10.745 -21.843 1.00 43.30 H new ATOM 0 HB2 MET A 1 -19.865 -9.960 -21.486 1.00 44.23 H new ATOM 0 HB3 MET A 1 -19.592 -10.545 -23.115 1.00 44.23 H new ATOM 0 HG2 MET A 1 -21.775 -8.561 -22.396 1.00 45.63 H new ATOM 0 HG3 MET A 1 -20.161 -8.080 -22.881 1.00 45.63 H new ATOM 0 HE1 MET A 1 -22.376 -7.025 -25.937 1.00 48.32 H new ATOM 0 HE2 MET A 1 -22.837 -7.001 -24.218 1.00 48.32 H new ATOM 0 HE3 MET A 1 -21.206 -6.487 -24.709 1.00 48.32 H new ATOM 20 N GLN A 2 -22.867 -11.622 -24.173 1.00 42.24 N ATOM 21 CA GLN A 2 -23.558 -12.416 -25.184 1.00 41.31 C ATOM 22 C GLN A 2 -24.044 -13.712 -24.529 1.00 39.99 C ATOM 23 O GLN A 2 -25.178 -13.786 -24.064 1.00 40.48 O ATOM 24 CB GLN A 2 -22.685 -12.608 -26.437 1.00 41.18 C ATOM 25 CG GLN A 2 -23.454 -13.302 -27.569 1.00 41.21 C ATOM 26 CD GLN A 2 -22.567 -13.533 -28.788 1.00 41.35 C ATOM 27 OE1 GLN A 2 -22.260 -14.668 -29.132 1.00 41.14 O ATOM 28 NE2 GLN A 2 -22.141 -12.460 -29.448 1.00 41.83 N ATOM 0 H GLN A 2 -23.298 -10.710 -24.024 1.00 42.24 H new ATOM 0 HA GLN A 2 -24.440 -11.895 -25.558 1.00 41.31 H new ATOM 0 HB2 GLN A 2 -22.327 -11.638 -26.782 1.00 41.18 H new ATOM 0 HB3 GLN A 2 -21.806 -13.199 -26.180 1.00 41.18 H new ATOM 0 HG2 GLN A 2 -23.842 -14.257 -27.214 1.00 41.21 H new ATOM 0 HG3 GLN A 2 -24.313 -12.694 -27.853 1.00 41.21 H new ATOM 0 HE21 GLN A 2 -22.414 -11.528 -29.137 1.00 41.83 H new ATOM 0 HE22 GLN A 2 -21.541 -12.569 -30.266 1.00 41.83 H new ATOM 37 N SER A 3 -23.153 -14.693 -24.396 1.00 38.43 N ATOM 38 CA SER A 3 -23.271 -15.750 -23.411 1.00 37.08 C ATOM 39 C SER A 3 -23.452 -15.125 -22.021 1.00 36.13 C ATOM 40 O SER A 3 -22.646 -14.284 -21.610 1.00 36.21 O ATOM 41 CB SER A 3 -21.986 -16.586 -23.470 1.00 36.50 C ATOM 42 OG SER A 3 -20.872 -15.765 -23.788 1.00 36.74 O ATOM 0 H SER A 3 -22.320 -14.771 -24.980 1.00 38.43 H new ATOM 0 HA SER A 3 -24.133 -16.386 -23.613 1.00 37.08 H new ATOM 0 HB2 SER A 3 -21.821 -17.078 -22.511 1.00 36.50 H new ATOM 0 HB3 SER A 3 -22.091 -17.372 -24.218 1.00 36.50 H new ATOM 0 HG SER A 3 -20.972 -14.894 -23.350 1.00 36.74 H new ATOM 48 N HIS A 4 -24.500 -15.522 -21.301 1.00 35.38 N ATOM 49 CA HIS A 4 -24.775 -15.095 -19.941 1.00 34.44 C ATOM 50 C HIS A 4 -25.568 -16.217 -19.276 1.00 33.39 C ATOM 51 O HIS A 4 -26.293 -16.926 -19.972 1.00 33.84 O ATOM 52 CB HIS A 4 -25.543 -13.767 -19.939 1.00 35.36 C ATOM 53 CG HIS A 4 -26.882 -13.833 -20.631 1.00 36.19 C ATOM 54 ND1 HIS A 4 -27.094 -13.853 -21.992 1.00 36.93 N ATOM 55 CD2 HIS A 4 -28.106 -13.916 -20.022 1.00 36.45 C ATOM 56 CE1 HIS A 4 -28.420 -13.942 -22.193 1.00 37.63 C ATOM 57 NE2 HIS A 4 -29.078 -13.981 -21.023 1.00 37.37 N ATOM 0 H HIS A 4 -25.199 -16.170 -21.664 1.00 35.38 H new ATOM 0 HA HIS A 4 -23.854 -14.914 -19.387 1.00 34.44 H new ATOM 0 HB2 HIS A 4 -25.694 -13.447 -18.908 1.00 35.36 H new ATOM 0 HB3 HIS A 4 -24.932 -13.005 -20.423 1.00 35.36 H new ATOM 0 HD1 HIS A 4 -26.376 -13.808 -22.715 1.00 36.93 H new ATOM 0 HD2 HIS A 4 -28.287 -13.929 -18.957 1.00 36.45 H new ATOM 0 HE1 HIS A 4 -28.892 -13.977 -23.164 1.00 37.63 H new ATOM 65 N SER A 5 -25.400 -16.383 -17.961 1.00 32.12 N ATOM 66 CA SER A 5 -25.847 -17.547 -17.203 1.00 30.95 C ATOM 67 C SER A 5 -24.996 -18.772 -17.562 1.00 29.22 C ATOM 68 O SER A 5 -24.602 -18.949 -18.712 1.00 29.20 O ATOM 69 CB SER A 5 -27.350 -17.811 -17.392 1.00 31.61 C ATOM 70 OG SER A 5 -27.836 -18.650 -16.363 1.00 31.62 O ATOM 0 H SER A 5 -24.934 -15.687 -17.379 1.00 32.12 H new ATOM 0 HA SER A 5 -25.706 -17.338 -16.142 1.00 30.95 H new ATOM 0 HB2 SER A 5 -27.895 -16.867 -17.388 1.00 31.61 H new ATOM 0 HB3 SER A 5 -27.525 -18.276 -18.362 1.00 31.61 H new ATOM 0 HG SER A 5 -28.794 -18.808 -16.495 1.00 31.62 H new ATOM 76 N ALA A 6 -24.701 -19.614 -16.569 1.00 27.90 N ATOM 77 CA ALA A 6 -24.002 -20.881 -16.757 1.00 26.26 C ATOM 78 C ALA A 6 -24.082 -21.634 -15.438 1.00 25.24 C ATOM 79 O ALA A 6 -24.820 -22.606 -15.307 1.00 25.64 O ATOM 80 CB ALA A 6 -22.544 -20.663 -17.193 1.00 25.63 C ATOM 0 H ALA A 6 -24.947 -19.429 -15.597 1.00 27.90 H new ATOM 0 HA ALA A 6 -24.469 -21.458 -17.555 1.00 26.26 H new ATOM 0 HB1 ALA A 6 -22.055 -21.628 -17.323 1.00 25.63 H new ATOM 0 HB2 ALA A 6 -22.524 -20.116 -18.136 1.00 25.63 H new ATOM 0 HB3 ALA A 6 -22.018 -20.090 -16.430 1.00 25.63 H new ATOM 86 N LEU A 7 -23.371 -21.121 -14.433 1.00 24.14 N ATOM 87 CA LEU A 7 -23.637 -21.463 -13.049 1.00 23.36 C ATOM 88 C LEU A 7 -24.941 -20.757 -12.655 1.00 23.33 C ATOM 89 O LEU A 7 -25.321 -19.767 -13.284 1.00 23.86 O ATOM 90 CB LEU A 7 -22.466 -21.025 -12.158 1.00 22.91 C ATOM 91 CG LEU A 7 -21.193 -21.879 -12.309 1.00 22.01 C ATOM 92 CD1 LEU A 7 -20.513 -21.752 -13.679 1.00 21.25 C ATOM 93 CD2 LEU A 7 -20.187 -21.455 -11.234 1.00 22.26 C ATOM 0 H LEU A 7 -22.602 -20.463 -14.561 1.00 24.14 H new ATOM 0 HA LEU A 7 -23.743 -22.540 -12.920 1.00 23.36 H new ATOM 0 HB2 LEU A 7 -22.221 -19.988 -12.386 1.00 22.91 H new ATOM 0 HB3 LEU A 7 -22.787 -21.056 -11.117 1.00 22.91 H new ATOM 0 HG LEU A 7 -21.504 -22.918 -12.203 1.00 22.01 H new ATOM 0 HD11 LEU A 7 -19.625 -22.384 -13.704 1.00 21.25 H new ATOM 0 HD12 LEU A 7 -21.205 -22.068 -14.459 1.00 21.25 H new ATOM 0 HD13 LEU A 7 -20.225 -20.714 -13.847 1.00 21.25 H new ATOM 0 HD21 LEU A 7 -19.280 -22.052 -11.329 1.00 22.26 H new ATOM 0 HD22 LEU A 7 -19.942 -20.400 -11.360 1.00 22.26 H new ATOM 0 HD23 LEU A 7 -20.622 -21.611 -10.247 1.00 22.26 H new ATOM 105 N THR A 8 -25.629 -21.283 -11.638 1.00 22.92 N ATOM 106 CA THR A 8 -26.890 -20.734 -11.151 1.00 22.99 C ATOM 107 C THR A 8 -26.635 -19.608 -10.140 1.00 22.36 C ATOM 108 O THR A 8 -25.505 -19.156 -9.975 1.00 21.93 O ATOM 109 CB THR A 8 -27.767 -21.873 -10.595 1.00 23.44 C ATOM 110 OG1 THR A 8 -29.060 -21.392 -10.282 1.00 23.82 O ATOM 111 CG2 THR A 8 -27.170 -22.553 -9.356 1.00 23.38 C ATOM 0 H THR A 8 -25.320 -22.110 -11.127 1.00 22.92 H new ATOM 0 HA THR A 8 -27.443 -20.277 -11.972 1.00 22.99 H new ATOM 0 HB THR A 8 -27.819 -22.624 -11.384 1.00 23.44 H new ATOM 0 HG1 THR A 8 -29.606 -22.126 -9.932 1.00 23.82 H new ATOM 0 HG21 THR A 8 -27.839 -23.344 -9.018 1.00 23.38 H new ATOM 0 HG22 THR A 8 -26.200 -22.981 -9.608 1.00 23.38 H new ATOM 0 HG23 THR A 8 -27.047 -21.817 -8.561 1.00 23.38 H new ATOM 119 N ALA A 9 -27.693 -19.186 -9.443 1.00 22.50 N ATOM 120 CA ALA A 9 -27.685 -18.242 -8.331 1.00 22.08 C ATOM 121 C ALA A 9 -27.194 -16.842 -8.721 1.00 21.43 C ATOM 122 O ALA A 9 -28.004 -15.924 -8.817 1.00 22.53 O ATOM 123 CB ALA A 9 -26.931 -18.826 -7.132 1.00 21.37 C ATOM 0 H ALA A 9 -28.634 -19.517 -9.656 1.00 22.50 H new ATOM 0 HA ALA A 9 -28.722 -18.093 -8.030 1.00 22.08 H new ATOM 0 HB1 ALA A 9 -26.936 -18.107 -6.313 1.00 21.37 H new ATOM 0 HB2 ALA A 9 -27.418 -19.746 -6.809 1.00 21.37 H new ATOM 0 HB3 ALA A 9 -25.902 -19.041 -7.419 1.00 21.37 H new ATOM 129 N PHE A 10 -25.886 -16.667 -8.931 1.00 19.81 N ATOM 130 CA PHE A 10 -25.264 -15.386 -9.247 1.00 19.16 C ATOM 131 C PHE A 10 -25.666 -14.286 -8.254 1.00 19.14 C ATOM 132 O PHE A 10 -26.252 -13.278 -8.643 1.00 20.10 O ATOM 133 CB PHE A 10 -25.551 -14.998 -10.709 1.00 19.71 C ATOM 134 CG PHE A 10 -24.670 -13.875 -11.228 1.00 19.64 C ATOM 135 CD1 PHE A 10 -23.304 -14.116 -11.458 1.00 18.86 C ATOM 136 CD2 PHE A 10 -25.174 -12.568 -11.360 1.00 20.58 C ATOM 137 CE1 PHE A 10 -22.434 -13.054 -11.756 1.00 19.09 C ATOM 138 CE2 PHE A 10 -24.310 -11.507 -11.688 1.00 20.77 C ATOM 139 CZ PHE A 10 -22.938 -11.748 -11.876 1.00 20.05 C ATOM 0 H PHE A 10 -25.216 -17.435 -8.884 1.00 19.81 H new ATOM 0 HA PHE A 10 -24.185 -15.497 -9.141 1.00 19.16 H new ATOM 0 HB2 PHE A 10 -25.416 -15.875 -11.341 1.00 19.71 H new ATOM 0 HB3 PHE A 10 -26.595 -14.699 -10.798 1.00 19.71 H new ATOM 0 HD1 PHE A 10 -22.921 -15.124 -11.405 1.00 18.86 H new ATOM 0 HD2 PHE A 10 -26.227 -12.379 -11.209 1.00 20.58 H new ATOM 0 HE1 PHE A 10 -21.379 -13.241 -11.893 1.00 19.09 H new ATOM 0 HE2 PHE A 10 -24.701 -10.506 -11.795 1.00 20.77 H new ATOM 0 HZ PHE A 10 -22.273 -10.931 -12.112 1.00 20.05 H new ATOM 149 N GLN A 11 -25.328 -14.459 -6.971 1.00 18.23 N ATOM 150 CA GLN A 11 -25.450 -13.378 -6.002 1.00 18.08 C ATOM 151 C GLN A 11 -24.207 -12.489 -6.124 1.00 16.84 C ATOM 152 O GLN A 11 -24.278 -11.441 -6.761 1.00 17.47 O ATOM 153 CB GLN A 11 -25.725 -13.927 -4.590 1.00 18.33 C ATOM 154 CG GLN A 11 -26.512 -12.933 -3.718 1.00 19.59 C ATOM 155 CD GLN A 11 -25.709 -11.701 -3.301 1.00 19.74 C ATOM 156 OE1 GLN A 11 -25.192 -11.637 -2.193 1.00 19.80 O ATOM 157 NE2 GLN A 11 -25.600 -10.700 -4.169 1.00 20.08 N ATOM 0 H GLN A 11 -24.971 -15.334 -6.587 1.00 18.23 H new ATOM 0 HA GLN A 11 -26.316 -12.750 -6.211 1.00 18.08 H new ATOM 0 HB2 GLN A 11 -26.284 -14.860 -4.668 1.00 18.33 H new ATOM 0 HB3 GLN A 11 -24.778 -14.163 -4.104 1.00 18.33 H new ATOM 0 HG2 GLN A 11 -27.398 -12.609 -4.264 1.00 19.59 H new ATOM 0 HG3 GLN A 11 -26.860 -13.448 -2.822 1.00 19.59 H new ATOM 0 HE21 GLN A 11 -26.038 -10.772 -5.088 1.00 20.08 H new ATOM 0 HE22 GLN A 11 -25.079 -9.860 -3.916 1.00 20.08 H new ATOM 166 N THR A 12 -23.074 -12.899 -5.543 1.00 15.30 N ATOM 167 CA THR A 12 -21.774 -12.260 -5.720 1.00 13.96 C ATOM 168 C THR A 12 -20.708 -13.118 -5.034 1.00 12.09 C ATOM 169 O THR A 12 -21.030 -14.137 -4.417 1.00 12.18 O ATOM 170 CB THR A 12 -21.751 -10.804 -5.210 1.00 15.26 C ATOM 171 OG1 THR A 12 -20.574 -10.173 -5.677 1.00 14.67 O ATOM 172 CG2 THR A 12 -21.810 -10.703 -3.682 1.00 16.13 C ATOM 0 H THR A 12 -23.040 -13.707 -4.921 1.00 15.30 H new ATOM 0 HA THR A 12 -21.561 -12.195 -6.787 1.00 13.96 H new ATOM 0 HB THR A 12 -22.643 -10.309 -5.595 1.00 15.26 H new ATOM 0 HG1 THR A 12 -20.625 -9.211 -5.497 1.00 14.67 H new ATOM 0 HG21 THR A 12 -21.791 -9.654 -3.386 1.00 16.13 H new ATOM 0 HG22 THR A 12 -22.729 -11.165 -3.322 1.00 16.13 H new ATOM 0 HG23 THR A 12 -20.952 -11.218 -3.250 1.00 16.13 H new ATOM 180 N GLU A 13 -19.451 -12.673 -5.123 1.00 10.73 N ATOM 181 CA GLU A 13 -18.305 -13.289 -4.471 1.00 9.12 C ATOM 182 C GLU A 13 -18.411 -13.004 -2.967 1.00 10.24 C ATOM 183 O GLU A 13 -17.829 -12.046 -2.455 1.00 10.41 O ATOM 184 CB GLU A 13 -17.012 -12.779 -5.128 1.00 7.78 C ATOM 185 CG GLU A 13 -15.777 -13.669 -4.895 1.00 6.19 C ATOM 186 CD GLU A 13 -15.243 -13.644 -3.467 1.00 6.79 C ATOM 187 OE1 GLU A 13 -15.899 -14.251 -2.596 1.00 7.65 O ATOM 188 OE2 GLU A 13 -14.176 -13.018 -3.283 1.00 6.91 O ATOM 0 H GLU A 13 -19.202 -11.848 -5.669 1.00 10.73 H new ATOM 0 HA GLU A 13 -18.287 -14.372 -4.592 1.00 9.12 H new ATOM 0 HB2 GLU A 13 -17.178 -12.686 -6.201 1.00 7.78 H new ATOM 0 HB3 GLU A 13 -16.799 -11.779 -4.750 1.00 7.78 H new ATOM 0 HG2 GLU A 13 -16.030 -14.696 -5.157 1.00 6.19 H new ATOM 0 HG3 GLU A 13 -14.984 -13.353 -5.572 1.00 6.19 H new ATOM 195 N GLN A 14 -19.238 -13.796 -2.279 1.00 11.45 N ATOM 196 CA GLN A 14 -19.373 -13.768 -0.830 1.00 12.95 C ATOM 197 C GLN A 14 -20.226 -14.943 -0.343 1.00 13.72 C ATOM 198 O GLN A 14 -19.879 -15.615 0.624 1.00 14.08 O ATOM 199 CB GLN A 14 -19.986 -12.431 -0.362 1.00 14.53 C ATOM 200 CG GLN A 14 -19.623 -12.113 1.095 1.00 15.53 C ATOM 201 CD GLN A 14 -18.181 -11.649 1.331 1.00 15.86 C ATOM 202 OE1 GLN A 14 -17.835 -11.330 2.464 1.00 16.90 O ATOM 203 NE2 GLN A 14 -17.329 -11.571 0.311 1.00 15.29 N ATOM 0 H GLN A 14 -19.841 -14.486 -2.727 1.00 11.45 H new ATOM 0 HA GLN A 14 -18.377 -13.860 -0.397 1.00 12.95 H new ATOM 0 HB2 GLN A 14 -19.636 -11.626 -1.007 1.00 14.53 H new ATOM 0 HB3 GLN A 14 -21.070 -12.473 -0.465 1.00 14.53 H new ATOM 0 HG2 GLN A 14 -20.299 -11.339 1.459 1.00 15.53 H new ATOM 0 HG3 GLN A 14 -19.803 -13.003 1.698 1.00 15.53 H new ATOM 0 HE21 GLN A 14 -17.629 -11.839 -0.626 1.00 15.29 H new ATOM 0 HE22 GLN A 14 -16.376 -11.243 0.467 1.00 15.29 H new ATOM 212 N ILE A 15 -21.383 -15.152 -0.976 1.00 14.25 N ATOM 213 CA ILE A 15 -22.379 -16.104 -0.499 1.00 15.34 C ATOM 214 C ILE A 15 -21.916 -17.536 -0.784 1.00 14.89 C ATOM 215 O ILE A 15 -21.374 -17.807 -1.852 1.00 13.84 O ATOM 216 CB ILE A 15 -23.742 -15.796 -1.142 1.00 16.19 C ATOM 217 CG1 ILE A 15 -24.185 -14.339 -0.915 1.00 16.95 C ATOM 218 CG2 ILE A 15 -24.831 -16.765 -0.657 1.00 17.35 C ATOM 219 CD1 ILE A 15 -24.239 -13.901 0.553 1.00 18.26 C ATOM 0 H ILE A 15 -21.652 -14.665 -1.831 1.00 14.25 H new ATOM 0 HA ILE A 15 -22.494 -16.009 0.581 1.00 15.34 H new ATOM 0 HB ILE A 15 -23.608 -15.936 -2.215 1.00 16.19 H new ATOM 0 HG12 ILE A 15 -23.502 -13.680 -1.451 1.00 16.95 H new ATOM 0 HG13 ILE A 15 -25.172 -14.202 -1.356 1.00 16.95 H new ATOM 0 HG21 ILE A 15 -25.779 -16.515 -1.134 1.00 17.35 H new ATOM 0 HG22 ILE A 15 -24.552 -17.786 -0.918 1.00 17.35 H new ATOM 0 HG23 ILE A 15 -24.936 -16.682 0.425 1.00 17.35 H new ATOM 0 HD11 ILE A 15 -24.561 -12.861 0.611 1.00 18.26 H new ATOM 0 HD12 ILE A 15 -24.945 -14.530 1.095 1.00 18.26 H new ATOM 0 HD13 ILE A 15 -23.249 -14.000 0.999 1.00 18.26 H new ATOM 231 N GLN A 16 -22.144 -18.455 0.162 1.00 15.90 N ATOM 232 CA GLN A 16 -21.771 -19.857 0.019 1.00 15.91 C ATOM 233 C GLN A 16 -22.252 -20.407 -1.329 1.00 15.04 C ATOM 234 O GLN A 16 -23.403 -20.183 -1.709 1.00 15.37 O ATOM 235 CB GLN A 16 -22.368 -20.676 1.171 1.00 17.50 C ATOM 236 CG GLN A 16 -21.726 -22.069 1.262 1.00 17.91 C ATOM 237 CD GLN A 16 -22.628 -23.048 2.000 1.00 18.99 C ATOM 238 OE1 GLN A 16 -22.458 -23.295 3.188 1.00 20.13 O ATOM 239 NE2 GLN A 16 -23.600 -23.616 1.291 1.00 18.84 N ATOM 0 H GLN A 16 -22.595 -18.240 1.051 1.00 15.90 H new ATOM 0 HA GLN A 16 -20.684 -19.935 0.053 1.00 15.91 H new ATOM 0 HB2 GLN A 16 -22.221 -20.144 2.111 1.00 17.50 H new ATOM 0 HB3 GLN A 16 -23.444 -20.778 1.027 1.00 17.50 H new ATOM 0 HG2 GLN A 16 -21.523 -22.444 0.259 1.00 17.91 H new ATOM 0 HG3 GLN A 16 -20.767 -21.997 1.776 1.00 17.91 H new ATOM 0 HE21 GLN A 16 -23.712 -23.386 0.303 1.00 18.84 H new ATOM 0 HE22 GLN A 16 -24.233 -24.281 1.735 1.00 18.84 H new ATOM 248 N ASP A 17 -21.362 -21.112 -2.035 1.00 14.22 N ATOM 249 CA ASP A 17 -21.542 -21.670 -3.372 1.00 13.55 C ATOM 250 C ASP A 17 -21.704 -20.593 -4.445 1.00 12.65 C ATOM 251 O ASP A 17 -20.916 -20.539 -5.383 1.00 11.54 O ATOM 252 CB ASP A 17 -22.660 -22.715 -3.451 1.00 14.76 C ATOM 253 CG ASP A 17 -22.787 -23.218 -4.887 1.00 14.48 C ATOM 254 OD1 ASP A 17 -23.935 -23.263 -5.373 1.00 15.35 O ATOM 255 OD2 ASP A 17 -21.725 -23.515 -5.479 1.00 13.66 O ATOM 0 H ASP A 17 -20.437 -21.320 -1.659 1.00 14.22 H new ATOM 0 HA ASP A 17 -20.612 -22.198 -3.584 1.00 13.55 H new ATOM 0 HB2 ASP A 17 -22.443 -23.547 -2.781 1.00 14.76 H new ATOM 0 HB3 ASP A 17 -23.603 -22.279 -3.122 1.00 14.76 H new ATOM 260 N SER A 18 -22.697 -19.710 -4.311 1.00 13.40 N ATOM 261 CA SER A 18 -22.928 -18.653 -5.286 1.00 13.03 C ATOM 262 C SER A 18 -21.703 -17.747 -5.464 1.00 11.65 C ATOM 263 O SER A 18 -21.591 -17.090 -6.496 1.00 11.26 O ATOM 264 CB SER A 18 -24.194 -17.856 -4.962 1.00 14.42 C ATOM 265 OG SER A 18 -24.517 -17.008 -6.052 1.00 15.31 O ATOM 0 H SER A 18 -23.354 -19.711 -3.531 1.00 13.40 H new ATOM 0 HA SER A 18 -23.092 -19.138 -6.248 1.00 13.03 H new ATOM 0 HB2 SER A 18 -25.022 -18.536 -4.760 1.00 14.42 H new ATOM 0 HB3 SER A 18 -24.041 -17.263 -4.060 1.00 14.42 H new ATOM 0 HG SER A 18 -24.055 -17.320 -6.858 1.00 15.31 H new ATOM 271 N GLU A 19 -20.766 -17.754 -4.512 1.00 11.23 N ATOM 272 CA GLU A 19 -19.389 -17.327 -4.709 1.00 9.98 C ATOM 273 C GLU A 19 -18.929 -17.675 -6.132 1.00 8.74 C ATOM 274 O GLU A 19 -18.635 -16.776 -6.921 1.00 8.23 O ATOM 275 CB GLU A 19 -18.520 -17.963 -3.606 1.00 10.36 C ATOM 276 CG GLU A 19 -17.074 -17.444 -3.539 1.00 10.73 C ATOM 277 CD GLU A 19 -16.079 -18.176 -4.432 1.00 10.47 C ATOM 278 OE1 GLU A 19 -14.920 -17.713 -4.510 1.00 10.72 O ATOM 279 OE2 GLU A 19 -16.451 -19.206 -5.028 1.00 10.41 O ATOM 0 H GLU A 19 -20.955 -18.066 -3.560 1.00 11.23 H new ATOM 0 HA GLU A 19 -19.293 -16.245 -4.621 1.00 9.98 H new ATOM 0 HB2 GLU A 19 -18.998 -17.789 -2.642 1.00 10.36 H new ATOM 0 HB3 GLU A 19 -18.496 -19.042 -3.760 1.00 10.36 H new ATOM 0 HG2 GLU A 19 -17.071 -16.388 -3.809 1.00 10.73 H new ATOM 0 HG3 GLU A 19 -16.729 -17.510 -2.507 1.00 10.73 H new ATOM 286 N HIS A 20 -18.981 -18.964 -6.482 1.00 8.75 N ATOM 287 CA HIS A 20 -18.572 -19.507 -7.767 1.00 8.22 C ATOM 288 C HIS A 20 -19.200 -18.714 -8.910 1.00 8.60 C ATOM 289 O HIS A 20 -18.495 -18.195 -9.778 1.00 8.38 O ATOM 290 CB HIS A 20 -18.969 -20.989 -7.863 1.00 9.03 C ATOM 291 CG HIS A 20 -18.446 -21.875 -6.758 1.00 9.80 C ATOM 292 ND1 HIS A 20 -19.192 -22.755 -6.001 1.00 11.07 N ATOM 293 CD2 HIS A 20 -17.133 -22.034 -6.398 1.00 9.89 C ATOM 294 CE1 HIS A 20 -18.342 -23.421 -5.204 1.00 11.79 C ATOM 295 NE2 HIS A 20 -17.075 -23.028 -5.415 1.00 11.18 N ATOM 0 H HIS A 20 -19.325 -19.683 -5.845 1.00 8.75 H new ATOM 0 HA HIS A 20 -17.488 -19.426 -7.850 1.00 8.22 H new ATOM 0 HB2 HIS A 20 -20.057 -21.056 -7.874 1.00 9.03 H new ATOM 0 HB3 HIS A 20 -18.616 -21.381 -8.817 1.00 9.03 H new ATOM 0 HD1 HIS A 20 -20.204 -22.877 -6.040 1.00 11.07 H new ATOM 0 HD2 HIS A 20 -16.293 -21.489 -6.801 1.00 9.89 H new ATOM 0 HE1 HIS A 20 -18.638 -24.173 -4.488 1.00 11.79 H new ATOM 303 N SER A 21 -20.533 -18.621 -8.907 1.00 9.80 N ATOM 304 CA SER A 21 -21.264 -17.911 -9.940 1.00 10.91 C ATOM 305 C SER A 21 -20.845 -16.441 -9.977 1.00 10.72 C ATOM 306 O SER A 21 -20.602 -15.897 -11.050 1.00 11.17 O ATOM 307 CB SER A 21 -22.778 -18.105 -9.757 1.00 12.58 C ATOM 308 OG SER A 21 -23.245 -17.806 -8.450 1.00 13.38 O ATOM 0 H SER A 21 -21.126 -19.036 -8.188 1.00 9.80 H new ATOM 0 HA SER A 21 -21.014 -18.329 -10.915 1.00 10.91 H new ATOM 0 HB2 SER A 21 -23.304 -17.473 -10.473 1.00 12.58 H new ATOM 0 HB3 SER A 21 -23.033 -19.138 -9.995 1.00 12.58 H new ATOM 0 HG SER A 21 -22.495 -17.505 -7.896 1.00 13.38 H new ATOM 314 N GLY A 22 -20.760 -15.809 -8.806 1.00 10.42 N ATOM 315 CA GLY A 22 -20.429 -14.407 -8.663 1.00 10.49 C ATOM 316 C GLY A 22 -19.097 -14.099 -9.330 1.00 9.50 C ATOM 317 O GLY A 22 -19.023 -13.214 -10.181 1.00 10.36 O ATOM 0 H GLY A 22 -20.925 -16.277 -7.915 1.00 10.42 H new ATOM 0 HA2 GLY A 22 -21.214 -13.796 -9.108 1.00 10.49 H new ATOM 0 HA3 GLY A 22 -20.381 -14.145 -7.606 1.00 10.49 H new ATOM 321 N LYS A 23 -18.041 -14.813 -8.929 1.00 8.10 N ATOM 322 CA LYS A 23 -16.719 -14.580 -9.487 1.00 7.59 C ATOM 323 C LYS A 23 -16.591 -15.041 -10.940 1.00 8.44 C ATOM 324 O LYS A 23 -15.991 -14.325 -11.740 1.00 9.27 O ATOM 325 CB LYS A 23 -15.603 -15.105 -8.584 1.00 6.66 C ATOM 326 CG LYS A 23 -15.747 -16.567 -8.156 1.00 6.51 C ATOM 327 CD LYS A 23 -14.365 -17.089 -7.785 1.00 6.70 C ATOM 328 CE LYS A 23 -14.345 -18.584 -7.454 1.00 7.45 C ATOM 329 NZ LYS A 23 -13.423 -18.837 -6.334 1.00 8.14 N ATOM 0 H LYS A 23 -18.081 -15.550 -8.225 1.00 8.10 H new ATOM 0 HA LYS A 23 -16.591 -13.498 -9.520 1.00 7.59 H new ATOM 0 HB2 LYS A 23 -14.652 -14.987 -9.102 1.00 6.66 H new ATOM 0 HB3 LYS A 23 -15.558 -14.484 -7.690 1.00 6.66 H new ATOM 0 HG2 LYS A 23 -16.426 -16.650 -7.307 1.00 6.51 H new ATOM 0 HG3 LYS A 23 -16.174 -17.160 -8.965 1.00 6.51 H new ATOM 0 HD2 LYS A 23 -13.680 -16.899 -8.611 1.00 6.70 H new ATOM 0 HD3 LYS A 23 -13.993 -16.530 -6.927 1.00 6.70 H new ATOM 0 HE2 LYS A 23 -15.348 -18.921 -7.194 1.00 7.45 H new ATOM 0 HE3 LYS A 23 -14.034 -19.155 -8.329 1.00 7.45 H new ATOM 0 HZ1 LYS A 23 -13.427 -19.851 -6.103 1.00 8.14 H new ATOM 0 HZ2 LYS A 23 -12.461 -18.547 -6.604 1.00 8.14 H new ATOM 0 HZ3 LYS A 23 -13.729 -18.292 -5.503 1.00 8.14 H new ATOM 343 N MET A 24 -17.101 -16.228 -11.293 1.00 8.64 N ATOM 344 CA MET A 24 -16.827 -16.808 -12.602 1.00 9.75 C ATOM 345 C MET A 24 -17.984 -17.651 -13.145 1.00 10.55 C ATOM 346 O MET A 24 -17.909 -18.874 -13.236 1.00 10.61 O ATOM 347 CB MET A 24 -15.461 -17.519 -12.601 1.00 9.49 C ATOM 348 CG MET A 24 -15.291 -18.639 -11.565 1.00 8.98 C ATOM 349 SD MET A 24 -13.801 -19.654 -11.761 1.00 9.74 S ATOM 350 CE MET A 24 -12.501 -18.417 -11.540 1.00 9.64 C ATOM 0 H MET A 24 -17.699 -16.796 -10.693 1.00 8.64 H new ATOM 0 HA MET A 24 -16.752 -15.994 -13.323 1.00 9.75 H new ATOM 0 HB2 MET A 24 -15.290 -17.938 -13.593 1.00 9.49 H new ATOM 0 HB3 MET A 24 -14.684 -16.773 -12.432 1.00 9.49 H new ATOM 0 HG2 MET A 24 -15.279 -18.193 -10.570 1.00 8.98 H new ATOM 0 HG3 MET A 24 -16.164 -19.291 -11.612 1.00 8.98 H new ATOM 0 HE1 MET A 24 -11.529 -18.909 -11.527 1.00 9.64 H new ATOM 0 HE2 MET A 24 -12.535 -17.702 -12.362 1.00 9.64 H new ATOM 0 HE3 MET A 24 -12.654 -17.892 -10.597 1.00 9.64 H new ATOM 360 N VAL A 25 -19.019 -16.961 -13.636 1.00 11.57 N ATOM 361 CA VAL A 25 -19.959 -17.518 -14.604 1.00 12.71 C ATOM 362 C VAL A 25 -19.173 -18.173 -15.749 1.00 13.35 C ATOM 363 O VAL A 25 -19.449 -19.304 -16.148 1.00 13.76 O ATOM 364 CB VAL A 25 -20.869 -16.401 -15.153 1.00 13.87 C ATOM 365 CG1 VAL A 25 -21.898 -16.956 -16.150 1.00 15.16 C ATOM 366 CG2 VAL A 25 -21.629 -15.683 -14.033 1.00 13.76 C ATOM 0 H VAL A 25 -19.226 -15.998 -13.370 1.00 11.57 H new ATOM 0 HA VAL A 25 -20.584 -18.268 -14.120 1.00 12.71 H new ATOM 0 HB VAL A 25 -20.209 -15.694 -15.655 1.00 13.87 H new ATOM 0 HG11 VAL A 25 -22.524 -16.143 -16.518 1.00 15.16 H new ATOM 0 HG12 VAL A 25 -21.379 -17.422 -16.988 1.00 15.16 H new ATOM 0 HG13 VAL A 25 -22.523 -17.698 -15.653 1.00 15.16 H new ATOM 0 HG21 VAL A 25 -22.259 -14.904 -14.462 1.00 13.76 H new ATOM 0 HG22 VAL A 25 -22.253 -16.400 -13.499 1.00 13.76 H new ATOM 0 HG23 VAL A 25 -20.917 -15.234 -13.340 1.00 13.76 H new ATOM 376 N ALA A 26 -18.193 -17.440 -16.287 1.00 13.80 N ATOM 377 CA ALA A 26 -17.287 -17.940 -17.306 1.00 14.73 C ATOM 378 C ALA A 26 -16.372 -18.998 -16.685 1.00 14.04 C ATOM 379 O ALA A 26 -15.471 -18.655 -15.925 1.00 13.29 O ATOM 380 CB ALA A 26 -16.476 -16.775 -17.882 1.00 15.70 C ATOM 0 H ALA A 26 -18.011 -16.473 -16.019 1.00 13.80 H new ATOM 0 HA ALA A 26 -17.847 -18.400 -18.120 1.00 14.73 H new ATOM 0 HB1 ALA A 26 -15.795 -17.149 -18.647 1.00 15.70 H new ATOM 0 HB2 ALA A 26 -17.153 -16.044 -18.324 1.00 15.70 H new ATOM 0 HB3 ALA A 26 -15.902 -16.302 -17.085 1.00 15.70 H new ATOM 386 N LYS A 27 -16.605 -20.273 -17.008 1.00 14.59 N ATOM 387 CA LYS A 27 -15.881 -21.424 -16.480 1.00 14.30 C ATOM 388 C LYS A 27 -14.409 -21.417 -16.926 1.00 14.65 C ATOM 389 O LYS A 27 -13.997 -22.210 -17.770 1.00 15.33 O ATOM 390 CB LYS A 27 -16.632 -22.690 -16.927 1.00 14.76 C ATOM 391 CG LYS A 27 -16.113 -23.983 -16.284 1.00 14.26 C ATOM 392 CD LYS A 27 -16.894 -25.172 -16.858 1.00 14.97 C ATOM 393 CE LYS A 27 -16.379 -26.500 -16.286 1.00 14.84 C ATOM 394 NZ LYS A 27 -17.091 -27.661 -16.861 1.00 16.07 N ATOM 0 H LYS A 27 -17.333 -20.538 -17.671 1.00 14.59 H new ATOM 0 HA LYS A 27 -15.849 -21.390 -15.391 1.00 14.30 H new ATOM 0 HB2 LYS A 27 -17.689 -22.576 -16.688 1.00 14.76 H new ATOM 0 HB3 LYS A 27 -16.558 -22.780 -18.011 1.00 14.76 H new ATOM 0 HG2 LYS A 27 -15.048 -24.101 -16.482 1.00 14.26 H new ATOM 0 HG3 LYS A 27 -16.233 -23.940 -15.202 1.00 14.26 H new ATOM 0 HD2 LYS A 27 -17.954 -25.060 -16.628 1.00 14.97 H new ATOM 0 HD3 LYS A 27 -16.803 -25.181 -17.944 1.00 14.97 H new ATOM 0 HE2 LYS A 27 -15.312 -26.592 -16.487 1.00 14.84 H new ATOM 0 HE3 LYS A 27 -16.500 -26.500 -15.203 1.00 14.84 H new ATOM 0 HZ1 LYS A 27 -16.714 -28.538 -16.449 1.00 16.07 H new ATOM 0 HZ2 LYS A 27 -18.106 -27.586 -16.647 1.00 16.07 H new ATOM 0 HZ3 LYS A 27 -16.955 -27.676 -17.892 1.00 16.07 H new ATOM 408 N ARG A 28 -13.609 -20.518 -16.353 1.00 14.50 N ATOM 409 CA ARG A 28 -12.197 -20.369 -16.663 1.00 15.11 C ATOM 410 C ARG A 28 -11.410 -21.604 -16.199 1.00 15.07 C ATOM 411 O ARG A 28 -11.688 -22.164 -15.140 1.00 14.82 O ATOM 412 CB ARG A 28 -11.696 -19.048 -16.052 1.00 15.28 C ATOM 413 CG ARG A 28 -10.221 -18.740 -16.364 1.00 15.75 C ATOM 414 CD ARG A 28 -9.297 -19.146 -15.204 1.00 15.63 C ATOM 415 NE ARG A 28 -8.012 -19.693 -15.672 1.00 16.35 N ATOM 416 CZ ARG A 28 -7.001 -19.007 -16.227 1.00 17.46 C ATOM 417 NH1 ARG A 28 -7.097 -17.679 -16.343 1.00 18.00 N ATOM 418 NH2 ARG A 28 -5.909 -19.640 -16.670 1.00 18.31 N ATOM 0 H ARG A 28 -13.937 -19.861 -15.645 1.00 14.50 H new ATOM 0 HA ARG A 28 -12.039 -20.312 -17.740 1.00 15.11 H new ATOM 0 HB2 ARG A 28 -12.314 -18.230 -16.421 1.00 15.28 H new ATOM 0 HB3 ARG A 28 -11.829 -19.085 -14.971 1.00 15.28 H new ATOM 0 HG2 ARG A 28 -9.922 -19.269 -17.269 1.00 15.75 H new ATOM 0 HG3 ARG A 28 -10.106 -17.675 -16.565 1.00 15.75 H new ATOM 0 HD2 ARG A 28 -9.110 -18.278 -14.572 1.00 15.63 H new ATOM 0 HD3 ARG A 28 -9.801 -19.889 -14.585 1.00 15.63 H new ATOM 0 HE ARG A 28 -7.876 -20.698 -15.563 1.00 16.35 H new ATOM 0 HH11 ARG A 28 -7.933 -17.197 -16.011 1.00 18.00 H new ATOM 0 HH12 ARG A 28 -6.335 -17.147 -16.763 1.00 18.00 H new ATOM 0 HH21 ARG A 28 -5.839 -20.654 -16.588 1.00 18.31 H new ATOM 0 HH22 ARG A 28 -5.147 -19.108 -17.090 1.00 18.31 H new ATOM 432 N GLN A 29 -10.430 -22.016 -17.014 1.00 15.64 N ATOM 433 CA GLN A 29 -9.493 -23.110 -16.771 1.00 16.01 C ATOM 434 C GLN A 29 -9.042 -23.150 -15.305 1.00 15.28 C ATOM 435 O GLN A 29 -8.531 -22.152 -14.798 1.00 15.45 O ATOM 436 CB GLN A 29 -8.284 -22.882 -17.691 1.00 17.09 C ATOM 437 CG GLN A 29 -7.144 -23.903 -17.523 1.00 17.52 C ATOM 438 CD GLN A 29 -5.795 -23.274 -17.860 1.00 18.47 C ATOM 439 OE1 GLN A 29 -5.457 -22.212 -17.336 1.00 18.34 O ATOM 440 NE2 GLN A 29 -5.015 -23.902 -18.735 1.00 19.67 N ATOM 0 H GLN A 29 -10.264 -21.564 -17.913 1.00 15.64 H new ATOM 0 HA GLN A 29 -9.975 -24.065 -16.980 1.00 16.01 H new ATOM 0 HB2 GLN A 29 -8.624 -22.905 -18.726 1.00 17.09 H new ATOM 0 HB3 GLN A 29 -7.888 -21.883 -17.507 1.00 17.09 H new ATOM 0 HG2 GLN A 29 -7.131 -24.274 -16.498 1.00 17.52 H new ATOM 0 HG3 GLN A 29 -7.321 -24.762 -18.171 1.00 17.52 H new ATOM 0 HE21 GLN A 29 -5.322 -24.781 -19.153 1.00 19.67 H new ATOM 0 HE22 GLN A 29 -4.110 -23.505 -18.988 1.00 19.67 H new ATOM 449 N PHE A 30 -9.180 -24.303 -14.645 1.00 14.76 N ATOM 450 CA PHE A 30 -8.789 -24.460 -13.251 1.00 14.21 C ATOM 451 C PHE A 30 -7.290 -24.238 -13.028 1.00 13.92 C ATOM 452 O PHE A 30 -6.514 -24.064 -13.966 1.00 14.67 O ATOM 453 CB PHE A 30 -9.191 -25.844 -12.737 1.00 14.24 C ATOM 454 CG PHE A 30 -10.579 -26.315 -13.138 1.00 15.11 C ATOM 455 CD1 PHE A 30 -11.695 -25.474 -12.958 1.00 15.45 C ATOM 456 CD2 PHE A 30 -10.757 -27.599 -13.687 1.00 15.88 C ATOM 457 CE1 PHE A 30 -12.980 -25.922 -13.308 1.00 16.45 C ATOM 458 CE2 PHE A 30 -12.043 -28.048 -14.033 1.00 16.88 C ATOM 459 CZ PHE A 30 -13.155 -27.214 -13.834 1.00 17.12 C ATOM 0 H PHE A 30 -9.565 -25.149 -15.065 1.00 14.76 H new ATOM 0 HA PHE A 30 -9.318 -23.690 -12.689 1.00 14.21 H new ATOM 0 HB2 PHE A 30 -8.462 -26.571 -13.096 1.00 14.24 H new ATOM 0 HB3 PHE A 30 -9.128 -25.840 -11.649 1.00 14.24 H new ATOM 0 HD1 PHE A 30 -11.562 -24.483 -12.550 1.00 15.45 H new ATOM 0 HD2 PHE A 30 -9.903 -28.241 -13.843 1.00 15.88 H new ATOM 0 HE1 PHE A 30 -13.833 -25.274 -13.173 1.00 16.45 H new ATOM 0 HE2 PHE A 30 -12.176 -29.035 -14.452 1.00 16.88 H new ATOM 0 HZ PHE A 30 -14.145 -27.565 -14.085 1.00 17.12 H new ATOM 469 N ARG A 31 -6.893 -24.249 -11.754 1.00 13.12 N ATOM 470 CA ARG A 31 -5.588 -23.784 -11.312 1.00 12.96 C ATOM 471 C ARG A 31 -5.299 -24.336 -9.915 1.00 11.95 C ATOM 472 O ARG A 31 -4.277 -24.979 -9.705 1.00 12.22 O ATOM 473 CB ARG A 31 -5.631 -22.255 -11.346 1.00 13.36 C ATOM 474 CG ARG A 31 -4.406 -21.559 -10.744 1.00 13.64 C ATOM 475 CD ARG A 31 -3.096 -21.850 -11.490 1.00 15.14 C ATOM 476 NE ARG A 31 -2.051 -20.982 -10.929 1.00 15.47 N ATOM 477 CZ ARG A 31 -1.025 -20.400 -11.560 1.00 16.82 C ATOM 478 NH1 ARG A 31 -0.584 -20.911 -12.714 1.00 17.96 N ATOM 479 NH2 ARG A 31 -0.461 -19.311 -11.031 1.00 17.20 N ATOM 0 H ARG A 31 -7.482 -24.587 -10.993 1.00 13.12 H new ATOM 0 HA ARG A 31 -4.781 -24.133 -11.956 1.00 12.96 H new ATOM 0 HB2 ARG A 31 -5.741 -21.933 -12.381 1.00 13.36 H new ATOM 0 HB3 ARG A 31 -6.520 -21.920 -10.812 1.00 13.36 H new ATOM 0 HG2 ARG A 31 -4.578 -20.483 -10.738 1.00 13.64 H new ATOM 0 HG3 ARG A 31 -4.298 -21.870 -9.705 1.00 13.64 H new ATOM 0 HD2 ARG A 31 -2.820 -22.899 -11.380 1.00 15.14 H new ATOM 0 HD3 ARG A 31 -3.215 -21.662 -12.557 1.00 15.14 H new ATOM 0 HE ARG A 31 -2.117 -20.800 -9.928 1.00 15.47 H new ATOM 0 HH11 ARG A 31 -1.029 -21.740 -13.108 1.00 17.96 H new ATOM 0 HH12 ARG A 31 0.198 -20.472 -13.200 1.00 17.96 H new ATOM 0 HH21 ARG A 31 -0.813 -18.930 -10.153 1.00 17.20 H new ATOM 0 HH22 ARG A 31 0.322 -18.861 -11.505 1.00 17.20 H new ATOM 493 N ILE A 32 -6.226 -24.106 -8.977 1.00 11.13 N ATOM 494 CA ILE A 32 -6.211 -24.682 -7.636 1.00 10.40 C ATOM 495 C ILE A 32 -4.976 -24.214 -6.853 1.00 10.09 C ATOM 496 O ILE A 32 -4.113 -24.998 -6.470 1.00 10.87 O ATOM 497 CB ILE A 32 -6.393 -26.217 -7.673 1.00 11.17 C ATOM 498 CG1 ILE A 32 -7.505 -26.664 -8.644 1.00 11.93 C ATOM 499 CG2 ILE A 32 -6.684 -26.772 -6.269 1.00 10.80 C ATOM 500 CD1 ILE A 32 -8.886 -26.059 -8.367 1.00 12.00 C ATOM 0 H ILE A 32 -7.028 -23.496 -9.139 1.00 11.13 H new ATOM 0 HA ILE A 32 -7.073 -24.308 -7.084 1.00 10.40 H new ATOM 0 HB ILE A 32 -5.450 -26.624 -8.039 1.00 11.17 H new ATOM 0 HG12 ILE A 32 -7.207 -26.403 -9.659 1.00 11.93 H new ATOM 0 HG13 ILE A 32 -7.586 -27.750 -8.605 1.00 11.93 H new ATOM 0 HG21 ILE A 32 -6.808 -27.854 -6.324 1.00 10.80 H new ATOM 0 HG22 ILE A 32 -5.853 -26.535 -5.605 1.00 10.80 H new ATOM 0 HG23 ILE A 32 -7.598 -26.321 -5.882 1.00 10.80 H new ATOM 0 HD11 ILE A 32 -9.601 -26.432 -9.101 1.00 12.00 H new ATOM 0 HD12 ILE A 32 -9.213 -26.341 -7.366 1.00 12.00 H new ATOM 0 HD13 ILE A 32 -8.828 -24.973 -8.437 1.00 12.00 H new ATOM 512 N GLY A 33 -4.921 -22.906 -6.590 1.00 9.31 N ATOM 513 CA GLY A 33 -3.914 -22.287 -5.743 1.00 9.19 C ATOM 514 C GLY A 33 -4.267 -20.812 -5.599 1.00 8.17 C ATOM 515 O GLY A 33 -4.610 -20.338 -4.516 1.00 7.98 O ATOM 0 H GLY A 33 -5.592 -22.239 -6.971 1.00 9.31 H new ATOM 0 HA2 GLY A 33 -3.887 -22.770 -4.766 1.00 9.19 H new ATOM 0 HA3 GLY A 33 -2.923 -22.401 -6.182 1.00 9.19 H new ATOM 519 N ASP A 34 -4.254 -20.114 -6.734 1.00 7.94 N ATOM 520 CA ASP A 34 -4.607 -18.714 -6.915 1.00 7.48 C ATOM 521 C ASP A 34 -6.123 -18.543 -6.715 1.00 6.24 C ATOM 522 O ASP A 34 -6.867 -18.319 -7.665 1.00 6.63 O ATOM 523 CB ASP A 34 -4.154 -18.248 -8.320 1.00 8.77 C ATOM 524 CG ASP A 34 -2.757 -18.692 -8.746 1.00 9.65 C ATOM 525 OD1 ASP A 34 -2.441 -19.887 -8.550 1.00 9.68 O ATOM 526 OD2 ASP A 34 -2.037 -17.910 -9.404 1.00 10.67 O ATOM 0 H ASP A 34 -3.975 -20.548 -7.614 1.00 7.94 H new ATOM 0 HA ASP A 34 -4.099 -18.093 -6.177 1.00 7.48 H new ATOM 0 HB2 ASP A 34 -4.872 -18.616 -9.053 1.00 8.77 H new ATOM 0 HB3 ASP A 34 -4.195 -17.159 -8.352 1.00 8.77 H new ATOM 531 N ILE A 35 -6.581 -18.727 -5.474 1.00 5.29 N ATOM 532 CA ILE A 35 -7.990 -18.777 -5.078 1.00 4.48 C ATOM 533 C ILE A 35 -8.390 -17.492 -4.348 1.00 3.43 C ATOM 534 O ILE A 35 -9.572 -17.198 -4.195 1.00 4.07 O ATOM 535 CB ILE A 35 -8.192 -20.014 -4.177 1.00 5.17 C ATOM 536 CG1 ILE A 35 -7.890 -21.295 -4.978 1.00 6.60 C ATOM 537 CG2 ILE A 35 -9.619 -20.099 -3.607 1.00 5.40 C ATOM 538 CD1 ILE A 35 -7.657 -22.527 -4.096 1.00 7.47 C ATOM 0 H ILE A 35 -5.950 -18.851 -4.682 1.00 5.29 H new ATOM 0 HA ILE A 35 -8.626 -18.857 -5.960 1.00 4.48 H new ATOM 0 HB ILE A 35 -7.504 -19.916 -3.337 1.00 5.17 H new ATOM 0 HG12 ILE A 35 -8.720 -21.495 -5.655 1.00 6.60 H new ATOM 0 HG13 ILE A 35 -7.008 -21.128 -5.596 1.00 6.60 H new ATOM 0 HG21 ILE A 35 -9.708 -20.987 -2.981 1.00 5.40 H new ATOM 0 HG22 ILE A 35 -9.826 -19.211 -3.010 1.00 5.40 H new ATOM 0 HG23 ILE A 35 -10.335 -20.160 -4.427 1.00 5.40 H new ATOM 0 HD11 ILE A 35 -7.450 -23.392 -4.726 1.00 7.47 H new ATOM 0 HD12 ILE A 35 -6.808 -22.347 -3.437 1.00 7.47 H new ATOM 0 HD13 ILE A 35 -8.547 -22.719 -3.497 1.00 7.47 H new ATOM 550 N ALA A 36 -7.407 -16.758 -3.829 1.00 2.98 N ATOM 551 CA ALA A 36 -7.642 -15.524 -3.096 1.00 2.79 C ATOM 552 C ALA A 36 -8.002 -14.376 -4.044 1.00 2.34 C ATOM 553 O ALA A 36 -7.902 -14.509 -5.260 1.00 2.99 O ATOM 554 CB ALA A 36 -6.391 -15.193 -2.285 1.00 4.00 C ATOM 0 H ALA A 36 -6.421 -17.008 -3.908 1.00 2.98 H new ATOM 0 HA ALA A 36 -8.489 -15.658 -2.424 1.00 2.79 H new ATOM 0 HB1 ALA A 36 -6.552 -14.269 -1.729 1.00 4.00 H new ATOM 0 HB2 ALA A 36 -6.184 -16.005 -1.588 1.00 4.00 H new ATOM 0 HB3 ALA A 36 -5.543 -15.068 -2.959 1.00 4.00 H new ATOM 560 N GLY A 37 -8.393 -13.235 -3.473 1.00 2.41 N ATOM 561 CA GLY A 37 -8.558 -11.991 -4.211 1.00 2.16 C ATOM 562 C GLY A 37 -9.611 -12.067 -5.313 1.00 2.03 C ATOM 563 O GLY A 37 -9.447 -11.435 -6.358 1.00 2.81 O ATOM 0 H GLY A 37 -8.604 -13.153 -2.479 1.00 2.41 H new ATOM 0 HA2 GLY A 37 -8.831 -11.199 -3.514 1.00 2.16 H new ATOM 0 HA3 GLY A 37 -7.602 -11.711 -4.653 1.00 2.16 H new ATOM 567 N GLU A 38 -10.701 -12.807 -5.095 1.00 1.83 N ATOM 568 CA GLU A 38 -11.684 -13.001 -6.138 1.00 2.07 C ATOM 569 C GLU A 38 -12.537 -11.739 -6.238 1.00 1.54 C ATOM 570 O GLU A 38 -12.549 -11.126 -7.299 1.00 1.57 O ATOM 571 CB GLU A 38 -12.483 -14.284 -5.905 1.00 2.65 C ATOM 572 CG GLU A 38 -11.582 -15.534 -5.898 1.00 3.54 C ATOM 573 CD GLU A 38 -11.423 -16.203 -7.255 1.00 5.63 C ATOM 574 OE1 GLU A 38 -11.452 -15.483 -8.274 1.00 6.80 O ATOM 575 OE2 GLU A 38 -11.387 -17.457 -7.254 1.00 6.51 O ATOM 0 H GLU A 38 -10.915 -13.273 -4.213 1.00 1.83 H new ATOM 0 HA GLU A 38 -11.203 -13.147 -7.105 1.00 2.07 H new ATOM 0 HB2 GLU A 38 -13.012 -14.214 -4.955 1.00 2.65 H new ATOM 0 HB3 GLU A 38 -13.239 -14.387 -6.684 1.00 2.65 H new ATOM 0 HG2 GLU A 38 -10.596 -15.254 -5.527 1.00 3.54 H new ATOM 0 HG3 GLU A 38 -11.993 -16.259 -5.195 1.00 3.54 H new ATOM 582 N HIS A 39 -13.219 -11.299 -5.170 1.00 1.33 N ATOM 583 CA HIS A 39 -14.137 -10.165 -5.278 1.00 1.25 C ATOM 584 C HIS A 39 -13.475 -8.865 -5.767 1.00 1.12 C ATOM 585 O HIS A 39 -14.178 -8.012 -6.304 1.00 1.42 O ATOM 586 CB HIS A 39 -14.902 -9.908 -3.974 1.00 1.58 C ATOM 587 CG HIS A 39 -16.272 -9.308 -4.142 1.00 2.61 C ATOM 588 ND1 HIS A 39 -16.855 -8.882 -5.316 1.00 4.18 N ATOM 589 CD2 HIS A 39 -17.170 -9.103 -3.133 1.00 3.46 C ATOM 590 CE1 HIS A 39 -18.069 -8.396 -5.007 1.00 5.28 C ATOM 591 NE2 HIS A 39 -18.282 -8.456 -3.680 1.00 4.81 N ATOM 0 H HIS A 39 -13.152 -11.706 -4.237 1.00 1.33 H new ATOM 0 HA HIS A 39 -14.847 -10.467 -6.048 1.00 1.25 H new ATOM 0 HB2 HIS A 39 -15.000 -10.851 -3.437 1.00 1.58 H new ATOM 0 HB3 HIS A 39 -14.307 -9.244 -3.347 1.00 1.58 H new ATOM 0 HD1 HIS A 39 -16.441 -8.927 -6.247 1.00 4.18 H new ATOM 0 HD2 HIS A 39 -17.044 -9.389 -2.099 1.00 3.46 H new ATOM 0 HE1 HIS A 39 -18.777 -8.010 -5.726 1.00 5.28 H new ATOM 599 N THR A 40 -12.157 -8.690 -5.609 1.00 1.14 N ATOM 600 CA THR A 40 -11.442 -7.619 -6.293 1.00 1.39 C ATOM 601 C THR A 40 -11.350 -7.930 -7.785 1.00 1.37 C ATOM 602 O THR A 40 -11.895 -7.205 -8.613 1.00 1.67 O ATOM 603 CB THR A 40 -10.027 -7.453 -5.723 1.00 1.73 C ATOM 604 OG1 THR A 40 -9.471 -8.729 -5.483 1.00 2.04 O ATOM 605 CG2 THR A 40 -9.970 -6.629 -4.441 1.00 3.01 C ATOM 0 H THR A 40 -11.571 -9.277 -5.015 1.00 1.14 H new ATOM 0 HA THR A 40 -11.992 -6.691 -6.140 1.00 1.39 H new ATOM 0 HB THR A 40 -9.454 -6.903 -6.469 1.00 1.73 H new ATOM 0 HG1 THR A 40 -8.638 -8.633 -4.976 1.00 2.04 H new ATOM 0 HG21 THR A 40 -8.937 -6.557 -4.100 1.00 3.01 H new ATOM 0 HG22 THR A 40 -10.359 -5.629 -4.633 1.00 3.01 H new ATOM 0 HG23 THR A 40 -10.573 -7.111 -3.671 1.00 3.01 H new ATOM 613 N SER A 41 -10.603 -8.988 -8.116 1.00 1.40 N ATOM 614 CA SER A 41 -10.276 -9.385 -9.489 1.00 1.51 C ATOM 615 C SER A 41 -11.539 -9.408 -10.373 1.00 1.42 C ATOM 616 O SER A 41 -11.582 -8.812 -11.453 1.00 1.48 O ATOM 617 CB SER A 41 -9.519 -10.725 -9.444 1.00 1.76 C ATOM 618 OG SER A 41 -8.772 -10.944 -10.625 1.00 2.64 O ATOM 0 H SER A 41 -10.198 -9.609 -7.416 1.00 1.40 H new ATOM 0 HA SER A 41 -9.619 -8.652 -9.957 1.00 1.51 H new ATOM 0 HB2 SER A 41 -8.850 -10.736 -8.583 1.00 1.76 H new ATOM 0 HB3 SER A 41 -10.230 -11.540 -9.307 1.00 1.76 H new ATOM 0 HG SER A 41 -7.845 -11.158 -10.391 1.00 2.64 H new ATOM 624 N PHE A 42 -12.589 -10.025 -9.824 1.00 1.41 N ATOM 625 CA PHE A 42 -13.997 -10.012 -10.218 1.00 1.49 C ATOM 626 C PHE A 42 -14.430 -8.726 -10.918 1.00 1.55 C ATOM 627 O PHE A 42 -15.140 -8.789 -11.920 1.00 1.62 O ATOM 628 CB PHE A 42 -14.822 -10.203 -8.930 1.00 1.81 C ATOM 629 CG PHE A 42 -16.231 -9.638 -8.887 1.00 2.05 C ATOM 630 CD1 PHE A 42 -16.441 -8.288 -8.546 1.00 3.48 C ATOM 631 CD2 PHE A 42 -17.336 -10.463 -9.140 1.00 1.88 C ATOM 632 CE1 PHE A 42 -17.725 -7.732 -8.636 1.00 3.76 C ATOM 633 CE2 PHE A 42 -18.637 -9.945 -9.062 1.00 2.05 C ATOM 634 CZ PHE A 42 -18.835 -8.568 -8.851 1.00 2.65 C ATOM 0 H PHE A 42 -12.455 -10.611 -9.000 1.00 1.41 H new ATOM 0 HA PHE A 42 -14.159 -10.809 -10.944 1.00 1.49 H new ATOM 0 HB2 PHE A 42 -14.887 -11.273 -8.732 1.00 1.81 H new ATOM 0 HB3 PHE A 42 -14.261 -9.760 -8.107 1.00 1.81 H new ATOM 0 HD1 PHE A 42 -15.612 -7.680 -8.215 1.00 3.48 H new ATOM 0 HD2 PHE A 42 -17.185 -11.501 -9.396 1.00 1.88 H new ATOM 0 HE1 PHE A 42 -17.861 -6.665 -8.540 1.00 3.76 H new ATOM 0 HE2 PHE A 42 -19.487 -10.603 -9.164 1.00 2.05 H new ATOM 0 HZ PHE A 42 -19.833 -8.156 -8.854 1.00 2.65 H new ATOM 644 N ASP A 43 -14.073 -7.562 -10.358 1.00 1.64 N ATOM 645 CA ASP A 43 -14.687 -6.295 -10.728 1.00 1.79 C ATOM 646 C ASP A 43 -14.597 -6.048 -12.226 1.00 1.81 C ATOM 647 O ASP A 43 -15.523 -5.461 -12.788 1.00 2.29 O ATOM 648 CB ASP A 43 -14.039 -5.137 -9.968 1.00 2.00 C ATOM 649 CG ASP A 43 -14.742 -3.838 -10.290 1.00 2.31 C ATOM 650 OD1 ASP A 43 -14.249 -3.132 -11.195 1.00 3.45 O ATOM 651 OD2 ASP A 43 -15.822 -3.594 -9.714 1.00 2.65 O ATOM 0 H ASP A 43 -13.353 -7.480 -9.640 1.00 1.64 H new ATOM 0 HA ASP A 43 -15.741 -6.352 -10.456 1.00 1.79 H new ATOM 0 HB2 ASP A 43 -14.084 -5.327 -8.896 1.00 2.00 H new ATOM 0 HB3 ASP A 43 -12.985 -5.063 -10.234 1.00 2.00 H new ATOM 656 N LYS A 44 -13.462 -6.462 -12.808 1.00 1.52 N ATOM 657 CA LYS A 44 -13.088 -6.469 -14.224 1.00 1.59 C ATOM 658 C LYS A 44 -11.564 -6.360 -14.369 1.00 1.64 C ATOM 659 O LYS A 44 -11.078 -5.625 -15.227 1.00 2.01 O ATOM 660 CB LYS A 44 -13.788 -5.351 -15.019 1.00 1.86 C ATOM 661 CG LYS A 44 -13.496 -3.963 -14.423 1.00 3.16 C ATOM 662 CD LYS A 44 -14.407 -2.875 -14.990 1.00 3.48 C ATOM 663 CE LYS A 44 -15.859 -2.935 -14.497 1.00 3.27 C ATOM 664 NZ LYS A 44 -15.932 -2.721 -13.041 1.00 3.90 N ATOM 0 H LYS A 44 -12.707 -6.839 -12.235 1.00 1.52 H new ATOM 0 HA LYS A 44 -13.423 -7.417 -14.645 1.00 1.59 H new ATOM 0 HB2 LYS A 44 -13.456 -5.379 -16.057 1.00 1.86 H new ATOM 0 HB3 LYS A 44 -14.864 -5.526 -15.024 1.00 1.86 H new ATOM 0 HG2 LYS A 44 -13.616 -4.004 -13.340 1.00 3.16 H new ATOM 0 HG3 LYS A 44 -12.457 -3.699 -14.619 1.00 3.16 H new ATOM 0 HD2 LYS A 44 -13.990 -1.901 -14.734 1.00 3.48 H new ATOM 0 HD3 LYS A 44 -14.403 -2.947 -16.078 1.00 3.48 H new ATOM 0 HE2 LYS A 44 -16.452 -2.178 -15.010 1.00 3.27 H new ATOM 0 HE3 LYS A 44 -16.292 -3.903 -14.748 1.00 3.27 H new ATOM 0 HZ1 LYS A 44 -16.928 -2.716 -12.740 1.00 3.90 H new ATOM 0 HZ2 LYS A 44 -15.427 -3.487 -12.552 1.00 3.90 H new ATOM 0 HZ3 LYS A 44 -15.493 -1.809 -12.802 1.00 3.90 H new ATOM 678 N LEU A 45 -10.788 -7.041 -13.520 1.00 1.47 N ATOM 679 CA LEU A 45 -9.364 -6.762 -13.410 1.00 1.62 C ATOM 680 C LEU A 45 -8.571 -7.968 -12.899 1.00 1.62 C ATOM 681 O LEU A 45 -7.996 -7.913 -11.815 1.00 3.00 O ATOM 682 CB LEU A 45 -9.140 -5.457 -12.617 1.00 2.45 C ATOM 683 CG LEU A 45 -9.984 -5.261 -11.337 1.00 1.53 C ATOM 684 CD1 LEU A 45 -9.139 -5.387 -10.064 1.00 1.69 C ATOM 685 CD2 LEU A 45 -10.635 -3.874 -11.369 1.00 2.84 C ATOM 0 H LEU A 45 -11.124 -7.783 -12.906 1.00 1.47 H new ATOM 0 HA LEU A 45 -8.957 -6.589 -14.406 1.00 1.62 H new ATOM 0 HB2 LEU A 45 -8.087 -5.405 -12.340 1.00 2.45 H new ATOM 0 HB3 LEU A 45 -9.336 -4.617 -13.284 1.00 2.45 H new ATOM 0 HG LEU A 45 -10.741 -6.045 -11.316 1.00 1.53 H new ATOM 0 HD11 LEU A 45 -9.774 -5.242 -9.190 1.00 1.69 H new ATOM 0 HD12 LEU A 45 -8.687 -6.378 -10.024 1.00 1.69 H new ATOM 0 HD13 LEU A 45 -8.354 -4.631 -10.072 1.00 1.69 H new ATOM 0 HD21 LEU A 45 -11.232 -3.731 -10.468 1.00 2.84 H new ATOM 0 HD22 LEU A 45 -9.860 -3.109 -11.416 1.00 2.84 H new ATOM 0 HD23 LEU A 45 -11.277 -3.794 -12.246 1.00 2.84 H new ATOM 697 N PRO A 46 -8.500 -9.044 -13.701 1.00 1.16 N ATOM 698 CA PRO A 46 -7.493 -10.082 -13.588 1.00 1.47 C ATOM 699 C PRO A 46 -6.208 -9.562 -14.249 1.00 1.94 C ATOM 700 O PRO A 46 -5.671 -8.578 -13.768 1.00 2.81 O ATOM 701 CB PRO A 46 -8.120 -11.292 -14.280 1.00 2.65 C ATOM 702 CG PRO A 46 -8.827 -10.614 -15.451 1.00 3.32 C ATOM 703 CD PRO A 46 -9.367 -9.321 -14.835 1.00 2.49 C ATOM 0 HA PRO A 46 -7.210 -10.359 -12.573 1.00 1.47 H new ATOM 0 HB2 PRO A 46 -7.372 -12.013 -14.610 1.00 2.65 H new ATOM 0 HB3 PRO A 46 -8.814 -11.826 -13.631 1.00 2.65 H new ATOM 0 HG2 PRO A 46 -8.140 -10.412 -16.273 1.00 3.32 H new ATOM 0 HG3 PRO A 46 -9.629 -11.235 -15.851 1.00 3.32 H new ATOM 0 HD2 PRO A 46 -9.345 -8.503 -15.555 1.00 2.49 H new ATOM 0 HD3 PRO A 46 -10.403 -9.439 -14.518 1.00 2.49 H new ATOM 711 N GLU A 47 -5.704 -10.193 -15.322 1.00 2.59 N ATOM 712 CA GLU A 47 -4.410 -9.905 -15.946 1.00 4.04 C ATOM 713 C GLU A 47 -3.271 -9.899 -14.914 1.00 3.07 C ATOM 714 O GLU A 47 -2.389 -9.042 -14.907 1.00 4.47 O ATOM 715 CB GLU A 47 -4.454 -8.693 -16.898 1.00 6.21 C ATOM 716 CG GLU A 47 -4.915 -7.380 -16.256 1.00 6.92 C ATOM 717 CD GLU A 47 -4.704 -6.177 -17.165 1.00 9.20 C ATOM 718 OE1 GLU A 47 -4.413 -5.095 -16.611 1.00 10.53 O ATOM 719 OE2 GLU A 47 -4.841 -6.363 -18.393 1.00 9.83 O ATOM 0 H GLU A 47 -6.208 -10.944 -15.793 1.00 2.59 H new ATOM 0 HA GLU A 47 -4.172 -10.732 -16.615 1.00 4.04 H new ATOM 0 HB2 GLU A 47 -3.459 -8.544 -17.319 1.00 6.21 H new ATOM 0 HB3 GLU A 47 -5.120 -8.927 -17.729 1.00 6.21 H new ATOM 0 HG2 GLU A 47 -5.972 -7.456 -16.000 1.00 6.92 H new ATOM 0 HG3 GLU A 47 -4.372 -7.226 -15.324 1.00 6.92 H new ATOM 726 N GLY A 48 -3.293 -10.929 -14.061 1.00 1.35 N ATOM 727 CA GLY A 48 -2.269 -11.260 -13.082 1.00 1.82 C ATOM 728 C GLY A 48 -0.851 -11.046 -13.610 1.00 1.34 C ATOM 729 O GLY A 48 -0.380 -11.819 -14.440 1.00 2.88 O ATOM 0 H GLY A 48 -4.072 -11.587 -14.040 1.00 1.35 H new ATOM 0 HA2 GLY A 48 -2.415 -10.650 -12.190 1.00 1.82 H new ATOM 0 HA3 GLY A 48 -2.386 -12.301 -12.779 1.00 1.82 H new ATOM 733 N GLY A 49 -0.162 -10.013 -13.114 1.00 0.99 N ATOM 734 CA GLY A 49 1.198 -9.723 -13.525 1.00 1.23 C ATOM 735 C GLY A 49 1.725 -8.470 -12.834 1.00 1.32 C ATOM 736 O GLY A 49 2.743 -8.522 -12.147 1.00 2.08 O ATOM 0 H GLY A 49 -0.536 -9.364 -12.422 1.00 0.99 H new ATOM 0 HA2 GLY A 49 1.841 -10.570 -13.288 1.00 1.23 H new ATOM 0 HA3 GLY A 49 1.234 -9.588 -14.606 1.00 1.23 H new ATOM 740 N ARG A 50 1.106 -7.319 -13.106 1.00 0.90 N ATOM 741 CA ARG A 50 1.388 -6.064 -12.416 1.00 0.83 C ATOM 742 C ARG A 50 0.220 -5.105 -12.608 1.00 0.83 C ATOM 743 O ARG A 50 -0.015 -4.661 -13.728 1.00 1.25 O ATOM 744 CB ARG A 50 2.734 -5.468 -12.860 1.00 0.90 C ATOM 745 CG ARG A 50 2.904 -5.379 -14.387 1.00 2.29 C ATOM 746 CD ARG A 50 4.389 -5.319 -14.784 1.00 2.67 C ATOM 747 NE ARG A 50 4.729 -6.328 -15.802 1.00 3.83 N ATOM 748 CZ ARG A 50 4.826 -7.654 -15.589 1.00 4.35 C ATOM 749 NH1 ARG A 50 4.535 -8.173 -14.391 1.00 4.44 N ATOM 750 NH2 ARG A 50 5.210 -8.460 -16.587 1.00 5.55 N ATOM 0 H ARG A 50 0.385 -7.234 -13.822 1.00 0.90 H new ATOM 0 HA ARG A 50 1.490 -6.253 -11.347 1.00 0.83 H new ATOM 0 HB2 ARG A 50 2.836 -4.470 -12.434 1.00 0.90 H new ATOM 0 HB3 ARG A 50 3.542 -6.074 -12.449 1.00 0.90 H new ATOM 0 HG2 ARG A 50 2.435 -6.243 -14.858 1.00 2.29 H new ATOM 0 HG3 ARG A 50 2.390 -4.494 -14.761 1.00 2.29 H new ATOM 0 HD2 ARG A 50 4.622 -4.325 -15.166 1.00 2.67 H new ATOM 0 HD3 ARG A 50 5.007 -5.473 -13.900 1.00 2.67 H new ATOM 0 HE ARG A 50 4.906 -5.994 -16.749 1.00 3.83 H new ATOM 0 HH11 ARG A 50 4.237 -7.563 -13.630 1.00 4.44 H new ATOM 0 HH12 ARG A 50 4.611 -9.179 -14.239 1.00 4.44 H new ATOM 0 HH21 ARG A 50 5.428 -8.069 -17.504 1.00 5.55 H new ATOM 0 HH22 ARG A 50 5.285 -9.465 -16.431 1.00 5.55 H new ATOM 764 N ALA A 51 -0.505 -4.772 -11.539 1.00 0.85 N ATOM 765 CA ALA A 51 -1.536 -3.755 -11.629 1.00 0.87 C ATOM 766 C ALA A 51 -0.906 -2.370 -11.585 1.00 0.66 C ATOM 767 O ALA A 51 0.143 -2.176 -10.972 1.00 1.08 O ATOM 768 CB ALA A 51 -2.533 -3.918 -10.493 1.00 1.39 C ATOM 0 H ALA A 51 -0.395 -5.189 -10.615 1.00 0.85 H new ATOM 0 HA ALA A 51 -2.065 -3.870 -12.575 1.00 0.87 H new ATOM 0 HB1 ALA A 51 -3.302 -3.149 -10.571 1.00 1.39 H new ATOM 0 HB2 ALA A 51 -2.997 -4.903 -10.554 1.00 1.39 H new ATOM 0 HB3 ALA A 51 -2.016 -3.819 -9.538 1.00 1.39 H new ATOM 774 N THR A 52 -1.559 -1.394 -12.216 1.00 0.67 N ATOM 775 CA THR A 52 -1.006 -0.063 -12.404 1.00 0.71 C ATOM 776 C THR A 52 -1.189 0.784 -11.135 1.00 0.92 C ATOM 777 O THR A 52 -1.688 1.904 -11.197 1.00 1.29 O ATOM 778 CB THR A 52 -1.677 0.550 -13.655 1.00 0.88 C ATOM 779 OG1 THR A 52 -1.248 1.881 -13.826 1.00 1.26 O ATOM 780 CG2 THR A 52 -3.217 0.527 -13.624 1.00 0.97 C ATOM 0 H THR A 52 -2.492 -1.511 -12.612 1.00 0.67 H new ATOM 0 HA THR A 52 0.070 -0.100 -12.572 1.00 0.71 H new ATOM 0 HB THR A 52 -1.369 -0.079 -14.490 1.00 0.88 H new ATOM 0 HG1 THR A 52 -1.273 2.346 -12.964 1.00 1.26 H new ATOM 0 HG21 THR A 52 -3.606 0.975 -14.538 1.00 0.97 H new ATOM 0 HG22 THR A 52 -3.564 -0.504 -13.549 1.00 0.97 H new ATOM 0 HG23 THR A 52 -3.572 1.093 -12.763 1.00 0.97 H new ATOM 788 N TYR A 53 -0.708 0.311 -9.986 1.00 1.32 N ATOM 789 CA TYR A 53 -0.993 0.937 -8.700 1.00 1.78 C ATOM 790 C TYR A 53 -0.093 2.151 -8.448 1.00 1.68 C ATOM 791 O TYR A 53 0.783 2.103 -7.589 1.00 2.12 O ATOM 792 CB TYR A 53 -0.887 -0.099 -7.573 1.00 2.18 C ATOM 793 CG TYR A 53 -2.064 -1.041 -7.396 1.00 2.03 C ATOM 794 CD1 TYR A 53 -2.960 -1.327 -8.447 1.00 2.81 C ATOM 795 CD2 TYR A 53 -2.317 -1.563 -6.112 1.00 2.64 C ATOM 796 CE1 TYR A 53 -4.096 -2.117 -8.212 1.00 3.27 C ATOM 797 CE2 TYR A 53 -3.486 -2.302 -5.867 1.00 2.83 C ATOM 798 CZ TYR A 53 -4.375 -2.574 -6.918 1.00 2.84 C ATOM 799 OH TYR A 53 -5.514 -3.283 -6.685 1.00 3.58 O ATOM 0 H TYR A 53 -0.112 -0.514 -9.923 1.00 1.32 H new ATOM 0 HA TYR A 53 -2.016 1.312 -8.721 1.00 1.78 H new ATOM 0 HB2 TYR A 53 0.006 -0.700 -7.747 1.00 2.18 H new ATOM 0 HB3 TYR A 53 -0.735 0.434 -6.635 1.00 2.18 H new ATOM 0 HD1 TYR A 53 -2.771 -0.937 -9.436 1.00 2.81 H new ATOM 0 HD2 TYR A 53 -1.610 -1.394 -5.313 1.00 2.64 H new ATOM 0 HE1 TYR A 53 -4.755 -2.372 -9.029 1.00 3.27 H new ATOM 0 HE2 TYR A 53 -3.700 -2.660 -4.871 1.00 2.83 H new ATOM 0 HH TYR A 53 -5.559 -3.527 -5.737 1.00 3.58 H new ATOM 809 N ARG A 54 -0.316 3.253 -9.170 1.00 1.40 N ATOM 810 CA ARG A 54 0.365 4.504 -8.870 1.00 1.27 C ATOM 811 C ARG A 54 -0.348 5.130 -7.669 1.00 1.37 C ATOM 812 O ARG A 54 -1.569 5.293 -7.703 1.00 1.84 O ATOM 813 CB ARG A 54 0.298 5.474 -10.065 1.00 1.43 C ATOM 814 CG ARG A 54 1.272 5.157 -11.211 1.00 1.31 C ATOM 815 CD ARG A 54 0.757 4.142 -12.241 1.00 2.91 C ATOM 816 NE ARG A 54 -0.353 4.688 -13.057 1.00 3.65 N ATOM 817 CZ ARG A 54 -0.476 4.646 -14.400 1.00 4.68 C ATOM 818 NH1 ARG A 54 0.509 4.157 -15.165 1.00 5.14 N ATOM 819 NH2 ARG A 54 -1.585 5.092 -14.998 1.00 5.79 N ATOM 0 H ARG A 54 -0.959 3.299 -9.960 1.00 1.40 H new ATOM 0 HA ARG A 54 1.417 4.311 -8.658 1.00 1.27 H new ATOM 0 HB2 ARG A 54 -0.718 5.471 -10.460 1.00 1.43 H new ATOM 0 HB3 ARG A 54 0.498 6.484 -9.706 1.00 1.43 H new ATOM 0 HG2 ARG A 54 1.514 6.085 -11.728 1.00 1.31 H new ATOM 0 HG3 ARG A 54 2.201 4.778 -10.784 1.00 1.31 H new ATOM 0 HD2 ARG A 54 1.576 3.845 -12.896 1.00 2.91 H new ATOM 0 HD3 ARG A 54 0.419 3.243 -11.725 1.00 2.91 H new ATOM 0 HE ARG A 54 -1.108 5.146 -12.547 1.00 3.65 H new ATOM 0 HH11 ARG A 54 1.366 3.810 -14.733 1.00 5.14 H new ATOM 0 HH12 ARG A 54 0.402 4.131 -16.179 1.00 5.14 H new ATOM 0 HH21 ARG A 54 -2.350 5.469 -14.438 1.00 5.79 H new ATOM 0 HH22 ARG A 54 -1.667 5.055 -16.014 1.00 5.79 H new ATOM 833 N GLY A 55 0.387 5.492 -6.612 1.00 1.04 N ATOM 834 CA GLY A 55 -0.205 6.237 -5.514 1.00 0.97 C ATOM 835 C GLY A 55 0.832 6.968 -4.671 1.00 0.84 C ATOM 836 O GLY A 55 2.035 6.816 -4.883 1.00 0.88 O ATOM 0 H GLY A 55 1.379 5.281 -6.501 1.00 1.04 H new ATOM 0 HA2 GLY A 55 -0.917 6.959 -5.913 1.00 0.97 H new ATOM 0 HA3 GLY A 55 -0.767 5.553 -4.878 1.00 0.97 H new ATOM 840 N THR A 56 0.350 7.774 -3.726 1.00 0.76 N ATOM 841 CA THR A 56 1.126 8.702 -2.921 1.00 0.79 C ATOM 842 C THR A 56 0.945 8.337 -1.450 1.00 0.58 C ATOM 843 O THR A 56 -0.069 8.696 -0.853 1.00 0.87 O ATOM 844 CB THR A 56 0.597 10.120 -3.185 1.00 1.22 C ATOM 845 OG1 THR A 56 -0.815 10.120 -3.076 1.00 2.57 O ATOM 846 CG2 THR A 56 0.978 10.606 -4.585 1.00 1.94 C ATOM 0 H THR A 56 -0.643 7.795 -3.493 1.00 0.76 H new ATOM 0 HA THR A 56 2.185 8.654 -3.174 1.00 0.79 H new ATOM 0 HB THR A 56 1.043 10.789 -2.449 1.00 1.22 H new ATOM 0 HG1 THR A 56 -1.078 9.684 -2.239 1.00 2.57 H new ATOM 0 HG21 THR A 56 0.588 11.612 -4.739 1.00 1.94 H new ATOM 0 HG22 THR A 56 2.064 10.618 -4.683 1.00 1.94 H new ATOM 0 HG23 THR A 56 0.554 9.934 -5.331 1.00 1.94 H new ATOM 854 N ALA A 57 1.922 7.653 -0.855 1.00 0.73 N ATOM 855 CA ALA A 57 1.944 7.362 0.566 1.00 0.70 C ATOM 856 C ALA A 57 2.564 8.552 1.296 1.00 0.75 C ATOM 857 O ALA A 57 3.664 8.455 1.841 1.00 0.97 O ATOM 858 CB ALA A 57 2.725 6.070 0.802 1.00 0.78 C ATOM 0 H ALA A 57 2.728 7.283 -1.359 1.00 0.73 H new ATOM 0 HA ALA A 57 0.936 7.212 0.954 1.00 0.70 H new ATOM 0 HB1 ALA A 57 2.745 5.846 1.869 1.00 0.78 H new ATOM 0 HB2 ALA A 57 2.243 5.251 0.268 1.00 0.78 H new ATOM 0 HB3 ALA A 57 3.745 6.190 0.437 1.00 0.78 H new ATOM 864 N PHE A 58 1.849 9.677 1.294 1.00 0.73 N ATOM 865 CA PHE A 58 2.342 10.921 1.874 1.00 0.79 C ATOM 866 C PHE A 58 2.214 10.867 3.386 1.00 0.76 C ATOM 867 O PHE A 58 1.228 10.369 3.928 1.00 0.72 O ATOM 868 CB PHE A 58 1.691 12.146 1.229 1.00 0.89 C ATOM 869 CG PHE A 58 0.230 12.382 1.557 1.00 0.90 C ATOM 870 CD1 PHE A 58 -0.111 13.057 2.745 1.00 1.88 C ATOM 871 CD2 PHE A 58 -0.777 12.027 0.643 1.00 2.25 C ATOM 872 CE1 PHE A 58 -1.453 13.348 3.033 1.00 2.05 C ATOM 873 CE2 PHE A 58 -2.121 12.333 0.924 1.00 2.27 C ATOM 874 CZ PHE A 58 -2.460 12.994 2.118 1.00 1.25 C ATOM 0 H PHE A 58 0.915 9.749 0.891 1.00 0.73 H new ATOM 0 HA PHE A 58 3.404 11.031 1.653 1.00 0.79 H new ATOM 0 HB2 PHE A 58 2.255 13.030 1.527 1.00 0.89 H new ATOM 0 HB3 PHE A 58 1.788 12.055 0.147 1.00 0.89 H new ATOM 0 HD1 PHE A 58 0.664 13.352 3.437 1.00 1.88 H new ATOM 0 HD2 PHE A 58 -0.519 11.519 -0.275 1.00 2.25 H new ATOM 0 HE1 PHE A 58 -1.712 13.844 3.957 1.00 2.05 H new ATOM 0 HE2 PHE A 58 -2.894 12.060 0.221 1.00 2.27 H new ATOM 0 HZ PHE A 58 -3.492 13.229 2.332 1.00 1.25 H new ATOM 884 N GLY A 59 3.253 11.331 4.072 1.00 0.84 N ATOM 885 CA GLY A 59 3.356 11.180 5.512 1.00 0.94 C ATOM 886 C GLY A 59 2.461 12.203 6.205 1.00 0.96 C ATOM 887 O GLY A 59 2.033 13.178 5.590 1.00 0.96 O ATOM 0 H GLY A 59 4.041 11.819 3.645 1.00 0.84 H new ATOM 0 HA2 GLY A 59 3.063 10.171 5.803 1.00 0.94 H new ATOM 0 HA3 GLY A 59 4.390 11.315 5.828 1.00 0.94 H new ATOM 891 N SER A 60 2.221 12.029 7.506 1.00 1.12 N ATOM 892 CA SER A 60 1.511 13.017 8.308 1.00 1.22 C ATOM 893 C SER A 60 2.148 14.403 8.164 1.00 1.10 C ATOM 894 O SER A 60 1.449 15.413 8.143 1.00 1.31 O ATOM 895 CB SER A 60 1.526 12.562 9.769 1.00 1.46 C ATOM 896 OG SER A 60 1.293 11.168 9.815 1.00 3.32 O ATOM 0 H SER A 60 2.513 11.203 8.028 1.00 1.12 H new ATOM 0 HA SER A 60 0.482 13.097 7.958 1.00 1.22 H new ATOM 0 HB2 SER A 60 2.486 12.800 10.228 1.00 1.46 H new ATOM 0 HB3 SER A 60 0.761 13.091 10.337 1.00 1.46 H new ATOM 0 HG SER A 60 0.655 10.920 9.113 1.00 3.32 H new ATOM 902 N ASP A 61 3.480 14.416 8.066 1.00 0.97 N ATOM 903 CA ASP A 61 4.317 15.597 7.910 1.00 1.05 C ATOM 904 C ASP A 61 4.792 15.745 6.452 1.00 0.99 C ATOM 905 O ASP A 61 5.785 16.415 6.193 1.00 1.04 O ATOM 906 CB ASP A 61 5.516 15.393 8.854 1.00 1.19 C ATOM 907 CG ASP A 61 6.330 16.661 9.085 1.00 1.55 C ATOM 908 OD1 ASP A 61 5.695 17.716 9.292 1.00 2.67 O ATOM 909 OD2 ASP A 61 7.572 16.530 9.119 1.00 2.13 O ATOM 0 H ASP A 61 4.027 13.556 8.095 1.00 0.97 H new ATOM 0 HA ASP A 61 3.767 16.506 8.153 1.00 1.05 H new ATOM 0 HB2 ASP A 61 5.154 15.023 9.813 1.00 1.19 H new ATOM 0 HB3 ASP A 61 6.167 14.623 8.440 1.00 1.19 H new ATOM 914 N ASP A 62 4.152 15.035 5.508 1.00 0.95 N ATOM 915 CA ASP A 62 4.787 14.499 4.325 1.00 1.02 C ATOM 916 C ASP A 62 6.310 14.397 4.322 1.00 0.99 C ATOM 917 O ASP A 62 7.005 15.021 3.523 1.00 1.16 O ATOM 918 CB ASP A 62 4.194 14.967 2.997 1.00 1.41 C ATOM 919 CG ASP A 62 4.586 13.977 1.903 1.00 2.11 C ATOM 920 OD1 ASP A 62 4.435 14.336 0.718 1.00 2.70 O ATOM 921 OD2 ASP A 62 4.948 12.833 2.274 1.00 3.27 O ATOM 0 H ASP A 62 3.156 14.821 5.561 1.00 0.95 H new ATOM 0 HA ASP A 62 4.495 13.453 4.416 1.00 1.02 H new ATOM 0 HB2 ASP A 62 3.109 15.035 3.072 1.00 1.41 H new ATOM 0 HB3 ASP A 62 4.560 15.964 2.752 1.00 1.41 H new ATOM 926 N ALA A 63 6.793 13.474 5.152 1.00 0.94 N ATOM 927 CA ALA A 63 8.025 12.759 4.880 1.00 0.98 C ATOM 928 C ALA A 63 7.628 11.352 4.431 1.00 0.88 C ATOM 929 O ALA A 63 8.042 10.361 5.025 1.00 0.97 O ATOM 930 CB ALA A 63 8.840 12.735 6.169 1.00 1.14 C ATOM 0 H ALA A 63 6.340 13.206 6.026 1.00 0.94 H new ATOM 0 HA ALA A 63 8.630 13.225 4.102 1.00 0.98 H new ATOM 0 HB1 ALA A 63 9.776 12.203 5.998 1.00 1.14 H new ATOM 0 HB2 ALA A 63 9.056 13.757 6.482 1.00 1.14 H new ATOM 0 HB3 ALA A 63 8.272 12.228 6.949 1.00 1.14 H new ATOM 936 N GLY A 64 6.807 11.275 3.385 1.00 0.81 N ATOM 937 CA GLY A 64 6.204 10.061 2.874 1.00 0.78 C ATOM 938 C GLY A 64 6.837 9.660 1.541 1.00 0.78 C ATOM 939 O GLY A 64 7.801 10.271 1.080 1.00 1.09 O ATOM 0 H GLY A 64 6.536 12.101 2.851 1.00 0.81 H new ATOM 0 HA2 GLY A 64 6.328 9.255 3.598 1.00 0.78 H new ATOM 0 HA3 GLY A 64 5.132 10.209 2.743 1.00 0.78 H new ATOM 943 N GLY A 65 6.347 8.561 0.968 1.00 0.78 N ATOM 944 CA GLY A 65 6.886 7.926 -0.224 1.00 0.83 C ATOM 945 C GLY A 65 5.772 7.590 -1.209 1.00 0.74 C ATOM 946 O GLY A 65 4.604 7.884 -0.975 1.00 0.85 O ATOM 0 H GLY A 65 5.532 8.073 1.340 1.00 0.78 H new ATOM 0 HA2 GLY A 65 7.610 8.588 -0.699 1.00 0.83 H new ATOM 0 HA3 GLY A 65 7.420 7.017 0.053 1.00 0.83 H new ATOM 950 N LYS A 66 6.130 7.021 -2.357 1.00 0.83 N ATOM 951 CA LYS A 66 5.148 6.586 -3.341 1.00 0.97 C ATOM 952 C LYS A 66 4.608 5.217 -2.934 1.00 0.98 C ATOM 953 O LYS A 66 5.357 4.404 -2.399 1.00 1.19 O ATOM 954 CB LYS A 66 5.816 6.462 -4.713 1.00 1.45 C ATOM 955 CG LYS A 66 6.510 7.758 -5.152 1.00 1.67 C ATOM 956 CD LYS A 66 7.852 7.475 -5.854 1.00 2.18 C ATOM 957 CE LYS A 66 8.956 6.974 -4.899 1.00 2.50 C ATOM 958 NZ LYS A 66 9.160 5.502 -4.880 1.00 4.01 N ATOM 0 H LYS A 66 7.099 6.851 -2.628 1.00 0.83 H new ATOM 0 HA LYS A 66 4.337 7.313 -3.390 1.00 0.97 H new ATOM 0 HB2 LYS A 66 6.547 5.654 -4.685 1.00 1.45 H new ATOM 0 HB3 LYS A 66 5.066 6.187 -5.454 1.00 1.45 H new ATOM 0 HG2 LYS A 66 5.856 8.311 -5.826 1.00 1.67 H new ATOM 0 HG3 LYS A 66 6.681 8.392 -4.282 1.00 1.67 H new ATOM 0 HD2 LYS A 66 7.694 6.731 -6.635 1.00 2.18 H new ATOM 0 HD3 LYS A 66 8.194 8.386 -6.346 1.00 2.18 H new ATOM 0 HE2 LYS A 66 9.896 7.451 -5.175 1.00 2.50 H new ATOM 0 HE3 LYS A 66 8.716 7.304 -3.888 1.00 2.50 H new ATOM 0 HZ1 LYS A 66 9.995 5.275 -4.303 1.00 4.01 H new ATOM 0 HZ2 LYS A 66 8.322 5.041 -4.473 1.00 4.01 H new ATOM 0 HZ3 LYS A 66 9.306 5.159 -5.851 1.00 4.01 H new ATOM 972 N LEU A 67 3.355 4.918 -3.278 1.00 1.02 N ATOM 973 CA LEU A 67 2.963 3.534 -3.470 1.00 0.96 C ATOM 974 C LEU A 67 3.463 3.164 -4.864 1.00 0.79 C ATOM 975 O LEU A 67 2.867 3.558 -5.865 1.00 1.01 O ATOM 976 CB LEU A 67 1.444 3.356 -3.346 1.00 1.04 C ATOM 977 CG LEU A 67 1.066 1.866 -3.434 1.00 1.04 C ATOM 978 CD1 LEU A 67 1.214 1.153 -2.084 1.00 1.24 C ATOM 979 CD2 LEU A 67 -0.374 1.718 -3.918 1.00 1.22 C ATOM 0 H LEU A 67 2.614 5.603 -3.425 1.00 1.02 H new ATOM 0 HA LEU A 67 3.391 2.885 -2.706 1.00 0.96 H new ATOM 0 HB2 LEU A 67 1.100 3.769 -2.398 1.00 1.04 H new ATOM 0 HB3 LEU A 67 0.941 3.912 -4.137 1.00 1.04 H new ATOM 0 HG LEU A 67 1.753 1.402 -4.142 1.00 1.04 H new ATOM 0 HD11 LEU A 67 0.937 0.105 -2.194 1.00 1.24 H new ATOM 0 HD12 LEU A 67 2.249 1.221 -1.748 1.00 1.24 H new ATOM 0 HD13 LEU A 67 0.562 1.626 -1.349 1.00 1.24 H new ATOM 0 HD21 LEU A 67 -0.631 0.660 -3.977 1.00 1.22 H new ATOM 0 HD22 LEU A 67 -1.046 2.217 -3.219 1.00 1.22 H new ATOM 0 HD23 LEU A 67 -0.475 2.171 -4.904 1.00 1.22 H new ATOM 991 N THR A 68 4.597 2.466 -4.922 1.00 0.62 N ATOM 992 CA THR A 68 5.198 2.028 -6.173 1.00 0.67 C ATOM 993 C THR A 68 4.499 0.741 -6.656 1.00 0.77 C ATOM 994 O THR A 68 4.225 -0.143 -5.854 1.00 1.01 O ATOM 995 CB THR A 68 6.721 1.908 -5.976 1.00 0.97 C ATOM 996 OG1 THR A 68 7.235 2.982 -5.181 1.00 2.19 O ATOM 997 CG2 THR A 68 7.404 1.958 -7.345 1.00 1.17 C ATOM 0 H THR A 68 5.125 2.189 -4.094 1.00 0.62 H new ATOM 0 HA THR A 68 5.053 2.754 -6.973 1.00 0.67 H new ATOM 0 HB THR A 68 6.922 0.966 -5.465 1.00 0.97 H new ATOM 0 HG1 THR A 68 7.335 2.683 -4.253 1.00 2.19 H new ATOM 0 HG21 THR A 68 8.483 1.874 -7.217 1.00 1.17 H new ATOM 0 HG22 THR A 68 7.046 1.133 -7.960 1.00 1.17 H new ATOM 0 HG23 THR A 68 7.170 2.903 -7.834 1.00 1.17 H new ATOM 1005 N TYR A 69 4.149 0.633 -7.943 1.00 0.73 N ATOM 1006 CA TYR A 69 3.091 -0.278 -8.382 1.00 0.72 C ATOM 1007 C TYR A 69 3.529 -1.747 -8.470 1.00 0.66 C ATOM 1008 O TYR A 69 4.408 -2.083 -9.260 1.00 0.70 O ATOM 1009 CB TYR A 69 2.507 0.202 -9.719 1.00 0.73 C ATOM 1010 CG TYR A 69 3.463 0.401 -10.880 1.00 0.74 C ATOM 1011 CD1 TYR A 69 4.019 1.673 -11.115 1.00 2.18 C ATOM 1012 CD2 TYR A 69 3.634 -0.622 -11.833 1.00 1.70 C ATOM 1013 CE1 TYR A 69 4.772 1.908 -12.278 1.00 2.35 C ATOM 1014 CE2 TYR A 69 4.391 -0.386 -12.994 1.00 1.64 C ATOM 1015 CZ TYR A 69 4.964 0.879 -13.213 1.00 1.05 C ATOM 1016 OH TYR A 69 5.668 1.128 -14.352 1.00 1.37 O ATOM 0 H TYR A 69 4.584 1.166 -8.696 1.00 0.73 H new ATOM 0 HA TYR A 69 2.320 -0.251 -7.612 1.00 0.72 H new ATOM 0 HB2 TYR A 69 1.748 -0.516 -10.030 1.00 0.73 H new ATOM 0 HB3 TYR A 69 1.996 1.148 -9.540 1.00 0.73 H new ATOM 0 HD1 TYR A 69 3.867 2.469 -10.401 1.00 2.18 H new ATOM 0 HD2 TYR A 69 3.183 -1.590 -11.672 1.00 1.70 H new ATOM 0 HE1 TYR A 69 5.204 2.882 -12.453 1.00 2.35 H new ATOM 0 HE2 TYR A 69 4.532 -1.176 -13.717 1.00 1.64 H new ATOM 0 HH TYR A 69 5.712 0.313 -14.894 1.00 1.37 H new ATOM 1026 N THR A 70 2.925 -2.633 -7.665 1.00 0.62 N ATOM 1027 CA THR A 70 3.147 -4.083 -7.696 1.00 0.64 C ATOM 1028 C THR A 70 1.948 -4.835 -7.076 1.00 0.65 C ATOM 1029 O THR A 70 1.782 -4.756 -5.862 1.00 0.65 O ATOM 1030 CB THR A 70 4.456 -4.378 -6.935 1.00 0.80 C ATOM 1031 OG1 THR A 70 5.584 -4.000 -7.700 1.00 1.18 O ATOM 1032 CG2 THR A 70 4.652 -5.860 -6.595 1.00 0.89 C ATOM 0 H THR A 70 2.250 -2.351 -6.955 1.00 0.62 H new ATOM 0 HA THR A 70 3.235 -4.432 -8.725 1.00 0.64 H new ATOM 0 HB THR A 70 4.369 -3.802 -6.014 1.00 0.80 H new ATOM 0 HG1 THR A 70 5.305 -3.393 -8.417 1.00 1.18 H new ATOM 0 HG21 THR A 70 5.593 -5.989 -6.061 1.00 0.89 H new ATOM 0 HG22 THR A 70 3.829 -6.201 -5.967 1.00 0.89 H new ATOM 0 HG23 THR A 70 4.674 -6.445 -7.515 1.00 0.89 H new ATOM 1040 N ILE A 71 1.160 -5.602 -7.858 1.00 0.81 N ATOM 1041 CA ILE A 71 0.270 -6.670 -7.369 1.00 0.91 C ATOM 1042 C ILE A 71 0.210 -7.788 -8.419 1.00 0.99 C ATOM 1043 O ILE A 71 0.618 -7.560 -9.556 1.00 1.49 O ATOM 1044 CB ILE A 71 -1.164 -6.187 -6.997 1.00 1.05 C ATOM 1045 CG1 ILE A 71 -2.172 -6.277 -8.153 1.00 1.21 C ATOM 1046 CG2 ILE A 71 -1.268 -4.727 -6.513 1.00 1.11 C ATOM 1047 CD1 ILE A 71 -3.219 -7.321 -7.851 1.00 2.07 C ATOM 0 H ILE A 71 1.126 -5.491 -8.871 1.00 0.81 H new ATOM 0 HA ILE A 71 0.697 -7.038 -6.436 1.00 0.91 H new ATOM 0 HB ILE A 71 -1.399 -6.878 -6.188 1.00 1.05 H new ATOM 0 HG12 ILE A 71 -2.648 -5.308 -8.307 1.00 1.21 H new ATOM 0 HG13 ILE A 71 -1.654 -6.528 -9.078 1.00 1.21 H new ATOM 0 HG21 ILE A 71 -2.307 -4.494 -6.281 1.00 1.11 H new ATOM 0 HG22 ILE A 71 -0.658 -4.596 -5.619 1.00 1.11 H new ATOM 0 HG23 ILE A 71 -0.912 -4.058 -7.296 1.00 1.11 H new ATOM 0 HD11 ILE A 71 -3.928 -7.375 -8.677 1.00 2.07 H new ATOM 0 HD12 ILE A 71 -2.739 -8.291 -7.720 1.00 2.07 H new ATOM 0 HD13 ILE A 71 -3.748 -7.052 -6.937 1.00 2.07 H new ATOM 1059 N ASP A 72 -0.362 -8.944 -8.072 1.00 0.82 N ATOM 1060 CA ASP A 72 -0.556 -10.113 -8.921 1.00 0.88 C ATOM 1061 C ASP A 72 -2.040 -10.525 -8.985 1.00 1.04 C ATOM 1062 O ASP A 72 -2.467 -11.464 -8.318 1.00 1.67 O ATOM 1063 CB ASP A 72 0.312 -11.243 -8.351 1.00 0.92 C ATOM 1064 CG ASP A 72 0.063 -11.550 -6.872 1.00 2.90 C ATOM 1065 OD1 ASP A 72 0.703 -12.504 -6.393 1.00 4.00 O ATOM 1066 OD2 ASP A 72 -0.733 -10.824 -6.219 1.00 4.22 O ATOM 0 H ASP A 72 -0.723 -9.094 -7.130 1.00 0.82 H new ATOM 0 HA ASP A 72 -0.260 -9.887 -9.945 1.00 0.88 H new ATOM 0 HB2 ASP A 72 0.135 -12.148 -8.932 1.00 0.92 H new ATOM 0 HB3 ASP A 72 1.361 -10.980 -8.483 1.00 0.92 H new ATOM 1071 N PHE A 73 -2.849 -9.854 -9.817 1.00 0.77 N ATOM 1072 CA PHE A 73 -4.316 -9.985 -9.865 1.00 0.84 C ATOM 1073 C PHE A 73 -4.899 -11.401 -9.996 1.00 1.18 C ATOM 1074 O PHE A 73 -6.113 -11.561 -9.868 1.00 1.58 O ATOM 1075 CB PHE A 73 -4.913 -9.176 -11.018 1.00 0.75 C ATOM 1076 CG PHE A 73 -4.402 -7.763 -11.243 1.00 0.87 C ATOM 1077 CD1 PHE A 73 -5.291 -6.690 -11.028 1.00 2.12 C ATOM 1078 CD2 PHE A 73 -3.304 -7.577 -12.103 1.00 2.00 C ATOM 1079 CE1 PHE A 73 -5.195 -5.528 -11.811 1.00 2.24 C ATOM 1080 CE2 PHE A 73 -3.229 -6.433 -12.911 1.00 2.19 C ATOM 1081 CZ PHE A 73 -4.218 -5.441 -12.814 1.00 1.46 C ATOM 0 H PHE A 73 -2.491 -9.184 -10.497 1.00 0.77 H new ATOM 0 HA PHE A 73 -4.592 -9.613 -8.878 1.00 0.84 H new ATOM 0 HB2 PHE A 73 -4.753 -9.739 -11.938 1.00 0.75 H new ATOM 0 HB3 PHE A 73 -5.990 -9.120 -10.863 1.00 0.75 H new ATOM 0 HD1 PHE A 73 -6.047 -6.762 -10.260 1.00 2.12 H new ATOM 0 HD2 PHE A 73 -2.518 -8.316 -12.141 1.00 2.00 H new ATOM 0 HE1 PHE A 73 -5.872 -4.703 -11.641 1.00 2.24 H new ATOM 0 HE2 PHE A 73 -2.412 -6.315 -13.607 1.00 2.19 H new ATOM 0 HZ PHE A 73 -4.227 -4.614 -13.509 1.00 1.46 H new ATOM 1091 N ALA A 74 -4.076 -12.412 -10.284 1.00 1.24 N ATOM 1092 CA ALA A 74 -4.490 -13.803 -10.182 1.00 1.53 C ATOM 1093 C ALA A 74 -4.983 -14.113 -8.765 1.00 1.58 C ATOM 1094 O ALA A 74 -5.860 -14.952 -8.590 1.00 1.79 O ATOM 1095 CB ALA A 74 -3.315 -14.713 -10.551 1.00 1.75 C ATOM 0 H ALA A 74 -3.112 -12.286 -10.592 1.00 1.24 H new ATOM 0 HA ALA A 74 -5.313 -13.983 -10.874 1.00 1.53 H new ATOM 0 HB1 ALA A 74 -3.624 -15.755 -10.475 1.00 1.75 H new ATOM 0 HB2 ALA A 74 -2.998 -14.502 -11.572 1.00 1.75 H new ATOM 0 HB3 ALA A 74 -2.485 -14.530 -9.869 1.00 1.75 H new ATOM 1101 N ALA A 75 -4.403 -13.441 -7.763 1.00 1.45 N ATOM 1102 CA ALA A 75 -4.709 -13.669 -6.354 1.00 1.57 C ATOM 1103 C ALA A 75 -4.568 -12.433 -5.454 1.00 1.50 C ATOM 1104 O ALA A 75 -5.159 -12.422 -4.379 1.00 1.76 O ATOM 1105 CB ALA A 75 -3.891 -14.860 -5.850 1.00 1.87 C ATOM 0 H ALA A 75 -3.701 -12.717 -7.914 1.00 1.45 H new ATOM 0 HA ALA A 75 -5.772 -13.902 -6.291 1.00 1.57 H new ATOM 0 HB1 ALA A 75 -4.115 -15.036 -4.798 1.00 1.87 H new ATOM 0 HB2 ALA A 75 -4.146 -15.748 -6.429 1.00 1.87 H new ATOM 0 HB3 ALA A 75 -2.828 -14.646 -5.964 1.00 1.87 H new ATOM 1111 N LYS A 76 -3.834 -11.390 -5.866 1.00 1.28 N ATOM 1112 CA LYS A 76 -3.885 -10.068 -5.265 1.00 1.29 C ATOM 1113 C LYS A 76 -3.177 -10.002 -3.908 1.00 1.49 C ATOM 1114 O LYS A 76 -3.797 -9.843 -2.863 1.00 1.84 O ATOM 1115 CB LYS A 76 -5.338 -9.599 -5.206 1.00 1.43 C ATOM 1116 CG LYS A 76 -5.552 -8.093 -5.180 1.00 1.56 C ATOM 1117 CD LYS A 76 -6.148 -7.646 -6.513 1.00 2.33 C ATOM 1118 CE LYS A 76 -6.186 -6.114 -6.520 1.00 2.77 C ATOM 1119 NZ LYS A 76 -6.346 -5.530 -7.866 1.00 4.18 N ATOM 0 H LYS A 76 -3.177 -11.453 -6.644 1.00 1.28 H new ATOM 0 HA LYS A 76 -3.325 -9.377 -5.895 1.00 1.29 H new ATOM 0 HB2 LYS A 76 -5.866 -10.006 -6.068 1.00 1.43 H new ATOM 0 HB3 LYS A 76 -5.801 -10.027 -4.317 1.00 1.43 H new ATOM 0 HG2 LYS A 76 -6.219 -7.823 -4.361 1.00 1.56 H new ATOM 0 HG3 LYS A 76 -4.606 -7.582 -5.002 1.00 1.56 H new ATOM 0 HD2 LYS A 76 -5.547 -8.017 -7.343 1.00 2.33 H new ATOM 0 HD3 LYS A 76 -7.151 -8.053 -6.639 1.00 2.33 H new ATOM 0 HE2 LYS A 76 -7.007 -5.777 -5.888 1.00 2.77 H new ATOM 0 HE3 LYS A 76 -5.266 -5.735 -6.076 1.00 2.77 H new ATOM 0 HZ1 LYS A 76 -6.096 -4.521 -7.839 1.00 4.18 H new ATOM 0 HZ2 LYS A 76 -5.721 -6.024 -8.535 1.00 4.18 H new ATOM 0 HZ3 LYS A 76 -7.334 -5.633 -8.174 1.00 4.18 H new ATOM 1133 N GLN A 77 -1.852 -10.017 -3.939 1.00 1.33 N ATOM 1134 CA GLN A 77 -1.008 -9.790 -2.789 1.00 1.39 C ATOM 1135 C GLN A 77 0.088 -8.839 -3.224 1.00 1.94 C ATOM 1136 O GLN A 77 1.239 -9.209 -3.437 1.00 2.93 O ATOM 1137 CB GLN A 77 -0.480 -11.078 -2.158 1.00 2.23 C ATOM 1138 CG GLN A 77 0.160 -12.127 -3.072 1.00 2.11 C ATOM 1139 CD GLN A 77 -0.873 -13.156 -3.494 1.00 2.20 C ATOM 1140 OE1 GLN A 77 -1.020 -14.202 -2.868 1.00 2.95 O ATOM 1141 NE2 GLN A 77 -1.633 -12.843 -4.525 1.00 1.76 N ATOM 0 H GLN A 77 -1.325 -10.193 -4.794 1.00 1.33 H new ATOM 0 HA GLN A 77 -1.590 -9.343 -1.983 1.00 1.39 H new ATOM 0 HB2 GLN A 77 0.257 -10.801 -1.404 1.00 2.23 H new ATOM 0 HB3 GLN A 77 -1.308 -11.555 -1.634 1.00 2.23 H new ATOM 0 HG2 GLN A 77 0.583 -11.643 -3.953 1.00 2.11 H new ATOM 0 HG3 GLN A 77 0.983 -12.619 -2.553 1.00 2.11 H new ATOM 0 HE21 GLN A 77 -1.482 -11.965 -5.022 1.00 1.76 H new ATOM 0 HE22 GLN A 77 -2.372 -13.479 -4.826 1.00 1.76 H new ATOM 1150 N GLY A 78 -0.318 -7.586 -3.377 1.00 1.78 N ATOM 1151 CA GLY A 78 0.534 -6.529 -3.851 1.00 2.56 C ATOM 1152 C GLY A 78 0.723 -5.476 -2.782 1.00 1.81 C ATOM 1153 O GLY A 78 0.084 -5.532 -1.733 1.00 2.15 O ATOM 0 H GLY A 78 -1.269 -7.281 -3.168 1.00 1.78 H new ATOM 0 HA2 GLY A 78 1.502 -6.938 -4.141 1.00 2.56 H new ATOM 0 HA3 GLY A 78 0.099 -6.076 -4.742 1.00 2.56 H new ATOM 1157 N ASN A 79 1.631 -4.545 -3.047 1.00 1.06 N ATOM 1158 CA ASN A 79 2.208 -3.626 -2.085 1.00 0.69 C ATOM 1159 C ASN A 79 3.017 -2.615 -2.889 1.00 0.79 C ATOM 1160 O ASN A 79 3.181 -2.802 -4.094 1.00 1.40 O ATOM 1161 CB ASN A 79 3.110 -4.413 -1.118 1.00 0.87 C ATOM 1162 CG ASN A 79 2.590 -4.430 0.307 1.00 1.56 C ATOM 1163 OD1 ASN A 79 3.195 -3.868 1.200 1.00 3.23 O ATOM 1164 ND2 ASN A 79 1.469 -5.079 0.562 1.00 0.88 N ATOM 0 H ASN A 79 2.001 -4.407 -3.988 1.00 1.06 H new ATOM 0 HA ASN A 79 1.449 -3.117 -1.491 1.00 0.69 H new ATOM 0 HB2 ASN A 79 3.206 -5.438 -1.475 1.00 0.87 H new ATOM 0 HB3 ASN A 79 4.109 -3.977 -1.128 1.00 0.87 H new ATOM 0 HD21 ASN A 79 1.104 -5.112 1.514 1.00 0.88 H new ATOM 0 HD22 ASN A 79 0.968 -5.548 -0.193 1.00 0.88 H new ATOM 1171 N GLY A 80 3.536 -1.562 -2.253 1.00 0.58 N ATOM 1172 CA GLY A 80 4.315 -0.573 -2.978 1.00 0.63 C ATOM 1173 C GLY A 80 5.278 0.159 -2.065 1.00 0.68 C ATOM 1174 O GLY A 80 4.868 0.749 -1.074 1.00 0.93 O ATOM 0 H GLY A 80 3.430 -1.379 -1.255 1.00 0.58 H new ATOM 0 HA2 GLY A 80 4.872 -1.062 -3.777 1.00 0.63 H new ATOM 0 HA3 GLY A 80 3.644 0.145 -3.450 1.00 0.63 H new ATOM 1178 N LYS A 81 6.565 0.139 -2.405 1.00 0.65 N ATOM 1179 CA LYS A 81 7.596 0.514 -1.455 1.00 0.63 C ATOM 1180 C LYS A 81 7.634 2.034 -1.316 1.00 0.69 C ATOM 1181 O LYS A 81 7.777 2.759 -2.308 1.00 0.83 O ATOM 1182 CB LYS A 81 8.964 -0.017 -1.900 1.00 0.83 C ATOM 1183 CG LYS A 81 9.122 -1.519 -1.648 1.00 1.84 C ATOM 1184 CD LYS A 81 8.695 -2.430 -2.805 1.00 2.56 C ATOM 1185 CE LYS A 81 8.880 -3.885 -2.345 1.00 4.08 C ATOM 1186 NZ LYS A 81 8.620 -4.864 -3.414 1.00 5.34 N ATOM 0 H LYS A 81 6.912 -0.132 -3.325 1.00 0.65 H new ATOM 0 HA LYS A 81 7.362 0.071 -0.487 1.00 0.63 H new ATOM 0 HB2 LYS A 81 9.101 0.186 -2.962 1.00 0.83 H new ATOM 0 HB3 LYS A 81 9.749 0.521 -1.369 1.00 0.83 H new ATOM 0 HG2 LYS A 81 10.167 -1.723 -1.415 1.00 1.84 H new ATOM 0 HG3 LYS A 81 8.540 -1.785 -0.765 1.00 1.84 H new ATOM 0 HD2 LYS A 81 7.656 -2.243 -3.076 1.00 2.56 H new ATOM 0 HD3 LYS A 81 9.296 -2.230 -3.692 1.00 2.56 H new ATOM 0 HE2 LYS A 81 9.898 -4.018 -1.978 1.00 4.08 H new ATOM 0 HE3 LYS A 81 8.211 -4.083 -1.508 1.00 4.08 H new ATOM 0 HZ1 LYS A 81 8.760 -5.826 -3.045 1.00 5.34 H new ATOM 0 HZ2 LYS A 81 7.641 -4.761 -3.749 1.00 5.34 H new ATOM 0 HZ3 LYS A 81 9.275 -4.697 -4.204 1.00 5.34 H new ATOM 1200 N ILE A 82 7.545 2.488 -0.064 1.00 0.83 N ATOM 1201 CA ILE A 82 7.581 3.881 0.354 1.00 1.01 C ATOM 1202 C ILE A 82 9.064 4.256 0.462 1.00 1.01 C ATOM 1203 O ILE A 82 9.590 4.593 1.523 1.00 1.39 O ATOM 1204 CB ILE A 82 6.776 4.034 1.663 1.00 1.12 C ATOM 1205 CG1 ILE A 82 5.330 3.536 1.470 1.00 1.65 C ATOM 1206 CG2 ILE A 82 6.744 5.471 2.208 1.00 1.62 C ATOM 1207 CD1 ILE A 82 4.459 3.726 2.719 1.00 2.10 C ATOM 0 H ILE A 82 7.440 1.852 0.727 1.00 0.83 H new ATOM 0 HA ILE A 82 7.111 4.567 -0.351 1.00 1.01 H new ATOM 0 HB ILE A 82 7.297 3.423 2.400 1.00 1.12 H new ATOM 0 HG12 ILE A 82 4.877 4.068 0.633 1.00 1.65 H new ATOM 0 HG13 ILE A 82 5.348 2.479 1.204 1.00 1.65 H new ATOM 0 HG21 ILE A 82 6.160 5.498 3.128 1.00 1.62 H new ATOM 0 HG22 ILE A 82 7.761 5.805 2.413 1.00 1.62 H new ATOM 0 HG23 ILE A 82 6.288 6.130 1.469 1.00 1.62 H new ATOM 0 HD11 ILE A 82 3.453 3.357 2.521 1.00 2.10 H new ATOM 0 HD12 ILE A 82 4.891 3.172 3.552 1.00 2.10 H new ATOM 0 HD13 ILE A 82 4.413 4.785 2.973 1.00 2.10 H new ATOM 1219 N GLU A 83 9.740 4.162 -0.684 1.00 0.89 N ATOM 1220 CA GLU A 83 11.140 4.473 -0.867 1.00 0.89 C ATOM 1221 C GLU A 83 11.206 5.784 -1.644 1.00 1.12 C ATOM 1222 O GLU A 83 10.842 5.818 -2.824 1.00 1.73 O ATOM 1223 CB GLU A 83 11.779 3.320 -1.642 1.00 1.04 C ATOM 1224 CG GLU A 83 13.290 3.505 -1.754 1.00 0.99 C ATOM 1225 CD GLU A 83 13.884 2.431 -2.654 1.00 1.37 C ATOM 1226 OE1 GLU A 83 13.468 2.408 -3.833 1.00 2.16 O ATOM 1227 OE2 GLU A 83 14.715 1.651 -2.146 1.00 2.03 O ATOM 0 H GLU A 83 9.294 3.850 -1.547 1.00 0.89 H new ATOM 0 HA GLU A 83 11.677 4.589 0.075 1.00 0.89 H new ATOM 0 HB2 GLU A 83 11.561 2.376 -1.142 1.00 1.04 H new ATOM 0 HB3 GLU A 83 11.342 3.261 -2.639 1.00 1.04 H new ATOM 0 HG2 GLU A 83 13.514 4.493 -2.157 1.00 0.99 H new ATOM 0 HG3 GLU A 83 13.745 3.454 -0.765 1.00 0.99 H new ATOM 1234 N HIS A 84 11.585 6.871 -0.966 1.00 0.85 N ATOM 1235 CA HIS A 84 11.644 8.204 -1.564 1.00 1.18 C ATOM 1236 C HIS A 84 12.622 9.163 -0.860 1.00 0.97 C ATOM 1237 O HIS A 84 12.842 10.268 -1.354 1.00 1.35 O ATOM 1238 CB HIS A 84 10.217 8.784 -1.550 1.00 2.01 C ATOM 1239 CG HIS A 84 9.941 9.889 -2.540 1.00 1.90 C ATOM 1240 ND1 HIS A 84 10.859 10.750 -3.098 1.00 2.56 N ATOM 1241 CD2 HIS A 84 8.715 10.217 -3.049 1.00 2.25 C ATOM 1242 CE1 HIS A 84 10.199 11.556 -3.947 1.00 3.39 C ATOM 1243 NE2 HIS A 84 8.889 11.259 -3.962 1.00 3.19 N ATOM 0 H HIS A 84 11.860 6.849 0.016 1.00 0.85 H new ATOM 0 HA HIS A 84 12.029 8.102 -2.579 1.00 1.18 H new ATOM 0 HB2 HIS A 84 9.514 7.972 -1.737 1.00 2.01 H new ATOM 0 HB3 HIS A 84 10.009 9.161 -0.548 1.00 2.01 H new ATOM 0 HD1 HIS A 84 11.860 10.772 -2.902 1.00 2.56 H new ATOM 0 HD2 HIS A 84 7.776 9.751 -2.790 1.00 2.25 H new ATOM 0 HE1 HIS A 84 10.659 12.336 -4.536 1.00 3.39 H new ATOM 1251 N LEU A 85 13.157 8.809 0.313 1.00 0.80 N ATOM 1252 CA LEU A 85 13.554 9.791 1.317 1.00 0.92 C ATOM 1253 C LEU A 85 15.059 9.744 1.549 1.00 1.09 C ATOM 1254 O LEU A 85 15.667 8.678 1.482 1.00 1.30 O ATOM 1255 CB LEU A 85 12.765 9.501 2.606 1.00 1.02 C ATOM 1256 CG LEU A 85 11.298 9.904 2.444 1.00 1.26 C ATOM 1257 CD1 LEU A 85 10.337 9.034 3.255 1.00 1.76 C ATOM 1258 CD2 LEU A 85 11.085 11.372 2.818 1.00 2.24 C ATOM 0 H LEU A 85 13.324 7.841 0.588 1.00 0.80 H new ATOM 0 HA LEU A 85 13.324 10.800 0.975 1.00 0.92 H new ATOM 0 HB2 LEU A 85 12.831 8.440 2.848 1.00 1.02 H new ATOM 0 HB3 LEU A 85 13.207 10.046 3.440 1.00 1.02 H new ATOM 0 HG LEU A 85 11.069 9.752 1.389 1.00 1.26 H new ATOM 0 HD11 LEU A 85 9.314 9.374 3.094 1.00 1.76 H new ATOM 0 HD12 LEU A 85 10.428 7.996 2.936 1.00 1.76 H new ATOM 0 HD13 LEU A 85 10.582 9.111 4.314 1.00 1.76 H new ATOM 0 HD21 LEU A 85 10.033 11.630 2.693 1.00 2.24 H new ATOM 0 HD22 LEU A 85 11.376 11.529 3.857 1.00 2.24 H new ATOM 0 HD23 LEU A 85 11.693 12.004 2.171 1.00 2.24 H new ATOM 1270 N LYS A 86 15.646 10.902 1.878 1.00 1.45 N ATOM 1271 CA LYS A 86 17.074 11.050 2.127 1.00 1.77 C ATOM 1272 C LYS A 86 17.536 10.214 3.329 1.00 1.39 C ATOM 1273 O LYS A 86 18.723 9.947 3.495 1.00 1.71 O ATOM 1274 CB LYS A 86 17.440 12.538 2.268 1.00 2.44 C ATOM 1275 CG LYS A 86 16.547 13.404 3.177 1.00 2.60 C ATOM 1276 CD LYS A 86 16.391 12.828 4.589 1.00 2.73 C ATOM 1277 CE LYS A 86 16.051 13.845 5.686 1.00 3.07 C ATOM 1278 NZ LYS A 86 16.243 13.252 7.031 1.00 3.88 N ATOM 0 H LYS A 86 15.127 11.774 1.979 1.00 1.45 H new ATOM 0 HA LYS A 86 17.614 10.657 1.266 1.00 1.77 H new ATOM 0 HB2 LYS A 86 18.462 12.600 2.642 1.00 2.44 H new ATOM 0 HB3 LYS A 86 17.438 12.981 1.272 1.00 2.44 H new ATOM 0 HG2 LYS A 86 16.970 14.406 3.244 1.00 2.60 H new ATOM 0 HG3 LYS A 86 15.562 13.504 2.721 1.00 2.60 H new ATOM 0 HD2 LYS A 86 15.609 12.068 4.568 1.00 2.73 H new ATOM 0 HD3 LYS A 86 17.318 12.324 4.861 1.00 2.73 H new ATOM 0 HE2 LYS A 86 16.682 14.727 5.579 1.00 3.07 H new ATOM 0 HE3 LYS A 86 15.019 14.176 5.574 1.00 3.07 H new ATOM 0 HZ1 LYS A 86 15.365 13.345 7.580 1.00 3.88 H new ATOM 0 HZ2 LYS A 86 16.487 12.245 6.935 1.00 3.88 H new ATOM 0 HZ3 LYS A 86 17.013 13.749 7.523 1.00 3.88 H new ATOM 1292 N SER A 87 16.587 9.865 4.195 1.00 1.03 N ATOM 1293 CA SER A 87 16.790 9.149 5.433 1.00 1.06 C ATOM 1294 C SER A 87 16.608 7.667 5.109 1.00 0.95 C ATOM 1295 O SER A 87 15.464 7.270 4.883 1.00 0.90 O ATOM 1296 CB SER A 87 15.716 9.621 6.425 1.00 1.68 C ATOM 1297 OG SER A 87 16.197 10.628 7.294 1.00 1.55 O ATOM 0 H SER A 87 15.605 10.091 4.034 1.00 1.03 H new ATOM 0 HA SER A 87 17.775 9.321 5.868 1.00 1.06 H new ATOM 0 HB2 SER A 87 14.856 10.000 5.873 1.00 1.68 H new ATOM 0 HB3 SER A 87 15.368 8.772 7.013 1.00 1.68 H new ATOM 0 HG SER A 87 16.385 10.239 8.174 1.00 1.55 H new ATOM 1303 N PRO A 88 17.667 6.841 5.062 1.00 1.03 N ATOM 1304 CA PRO A 88 17.515 5.430 4.755 1.00 1.07 C ATOM 1305 C PRO A 88 16.490 4.784 5.688 1.00 1.12 C ATOM 1306 O PRO A 88 15.642 4.023 5.230 1.00 1.38 O ATOM 1307 CB PRO A 88 18.911 4.810 4.879 1.00 1.31 C ATOM 1308 CG PRO A 88 19.674 5.793 5.765 1.00 1.41 C ATOM 1309 CD PRO A 88 19.048 7.142 5.412 1.00 1.24 C ATOM 0 HA PRO A 88 17.130 5.269 3.748 1.00 1.07 H new ATOM 0 HB2 PRO A 88 18.869 3.818 5.328 1.00 1.31 H new ATOM 0 HB3 PRO A 88 19.386 4.699 3.904 1.00 1.31 H new ATOM 0 HG2 PRO A 88 19.554 5.558 6.823 1.00 1.41 H new ATOM 0 HG3 PRO A 88 20.743 5.778 5.554 1.00 1.41 H new ATOM 0 HD2 PRO A 88 19.100 7.833 6.254 1.00 1.24 H new ATOM 0 HD3 PRO A 88 19.571 7.614 4.580 1.00 1.24 H new ATOM 1317 N GLU A 89 16.523 5.128 6.978 1.00 1.25 N ATOM 1318 CA GLU A 89 15.591 4.651 7.982 1.00 1.45 C ATOM 1319 C GLU A 89 14.130 4.930 7.597 1.00 1.34 C ATOM 1320 O GLU A 89 13.251 4.117 7.872 1.00 1.59 O ATOM 1321 CB GLU A 89 15.994 5.187 9.371 1.00 1.71 C ATOM 1322 CG GLU A 89 15.748 6.679 9.680 1.00 3.03 C ATOM 1323 CD GLU A 89 16.668 7.685 8.990 1.00 3.18 C ATOM 1324 OE1 GLU A 89 17.495 7.265 8.155 1.00 3.30 O ATOM 1325 OE2 GLU A 89 16.484 8.896 9.252 1.00 4.30 O ATOM 0 H GLU A 89 17.223 5.766 7.356 1.00 1.25 H new ATOM 0 HA GLU A 89 15.651 3.564 8.035 1.00 1.45 H new ATOM 0 HB2 GLU A 89 15.463 4.600 10.120 1.00 1.71 H new ATOM 0 HB3 GLU A 89 17.057 4.990 9.507 1.00 1.71 H new ATOM 0 HG2 GLU A 89 14.720 6.917 9.409 1.00 3.03 H new ATOM 0 HG3 GLU A 89 15.835 6.822 10.757 1.00 3.03 H new ATOM 1332 N LEU A 90 13.869 6.060 6.930 1.00 1.25 N ATOM 1333 CA LEU A 90 12.538 6.415 6.452 1.00 1.15 C ATOM 1334 C LEU A 90 12.137 5.605 5.218 1.00 0.91 C ATOM 1335 O LEU A 90 10.949 5.555 4.908 1.00 0.99 O ATOM 1336 CB LEU A 90 12.464 7.914 6.123 1.00 1.20 C ATOM 1337 CG LEU A 90 11.932 8.838 7.228 1.00 1.52 C ATOM 1338 CD1 LEU A 90 10.423 8.666 7.439 1.00 1.79 C ATOM 1339 CD2 LEU A 90 12.659 8.679 8.562 1.00 2.03 C ATOM 0 H LEU A 90 14.583 6.754 6.708 1.00 1.25 H new ATOM 0 HA LEU A 90 11.840 6.180 7.255 1.00 1.15 H new ATOM 0 HB2 LEU A 90 13.463 8.252 5.849 1.00 1.20 H new ATOM 0 HB3 LEU A 90 11.833 8.038 5.243 1.00 1.20 H new ATOM 0 HG LEU A 90 12.132 9.847 6.869 1.00 1.52 H new ATOM 0 HD11 LEU A 90 10.087 9.338 8.229 1.00 1.79 H new ATOM 0 HD12 LEU A 90 9.897 8.902 6.514 1.00 1.79 H new ATOM 0 HD13 LEU A 90 10.211 7.636 7.724 1.00 1.79 H new ATOM 0 HD21 LEU A 90 12.230 9.363 9.294 1.00 2.03 H new ATOM 0 HD22 LEU A 90 12.550 7.654 8.916 1.00 2.03 H new ATOM 0 HD23 LEU A 90 13.717 8.907 8.429 1.00 2.03 H new ATOM 1351 N ASN A 91 13.085 5.022 4.471 1.00 0.77 N ATOM 1352 CA ASN A 91 12.752 4.222 3.295 1.00 0.67 C ATOM 1353 C ASN A 91 11.981 2.988 3.765 1.00 0.72 C ATOM 1354 O ASN A 91 12.578 2.020 4.234 1.00 1.03 O ATOM 1355 CB ASN A 91 14.004 3.824 2.495 1.00 0.78 C ATOM 1356 CG ASN A 91 14.831 4.987 1.938 1.00 0.92 C ATOM 1357 OD1 ASN A 91 15.837 4.766 1.275 1.00 1.99 O ATOM 1358 ND2 ASN A 91 14.451 6.234 2.204 1.00 1.09 N ATOM 0 H ASN A 91 14.084 5.092 4.663 1.00 0.77 H new ATOM 0 HA ASN A 91 12.137 4.815 2.618 1.00 0.67 H new ATOM 0 HB2 ASN A 91 14.646 3.220 3.136 1.00 0.78 H new ATOM 0 HB3 ASN A 91 13.696 3.190 1.664 1.00 0.78 H new ATOM 0 HD21 ASN A 91 14.999 7.020 1.855 1.00 1.09 H new ATOM 0 HD22 ASN A 91 13.611 6.404 2.757 1.00 1.09 H new ATOM 1365 N VAL A 92 10.652 3.043 3.677 1.00 0.64 N ATOM 1366 CA VAL A 92 9.769 2.011 4.186 1.00 0.63 C ATOM 1367 C VAL A 92 9.465 1.043 3.051 1.00 0.60 C ATOM 1368 O VAL A 92 8.927 1.447 2.020 1.00 0.72 O ATOM 1369 CB VAL A 92 8.505 2.653 4.791 1.00 0.64 C ATOM 1370 CG1 VAL A 92 7.287 1.720 4.792 1.00 0.86 C ATOM 1371 CG2 VAL A 92 8.764 3.041 6.245 1.00 0.97 C ATOM 0 H VAL A 92 10.157 3.822 3.242 1.00 0.64 H new ATOM 0 HA VAL A 92 10.239 1.448 4.992 1.00 0.63 H new ATOM 0 HB VAL A 92 8.286 3.516 4.163 1.00 0.64 H new ATOM 0 HG11 VAL A 92 6.434 2.236 5.232 1.00 0.86 H new ATOM 0 HG12 VAL A 92 7.049 1.432 3.768 1.00 0.86 H new ATOM 0 HG13 VAL A 92 7.512 0.828 5.377 1.00 0.86 H new ATOM 0 HG21 VAL A 92 7.866 3.494 6.666 1.00 0.97 H new ATOM 0 HG22 VAL A 92 9.024 2.151 6.818 1.00 0.97 H new ATOM 0 HG23 VAL A 92 9.586 3.755 6.290 1.00 0.97 H new ATOM 1381 N ASP A 93 9.769 -0.238 3.252 1.00 0.56 N ATOM 1382 CA ASP A 93 9.209 -1.293 2.420 1.00 0.54 C ATOM 1383 C ASP A 93 7.994 -1.832 3.174 1.00 0.60 C ATOM 1384 O ASP A 93 7.875 -1.628 4.385 1.00 0.81 O ATOM 1385 CB ASP A 93 10.269 -2.375 2.162 1.00 0.57 C ATOM 1386 CG ASP A 93 9.931 -3.295 0.995 1.00 1.07 C ATOM 1387 OD1 ASP A 93 10.875 -3.704 0.288 1.00 1.65 O ATOM 1388 OD2 ASP A 93 8.727 -3.540 0.775 1.00 2.26 O ATOM 0 H ASP A 93 10.399 -0.567 3.983 1.00 0.56 H new ATOM 0 HA ASP A 93 8.903 -0.930 1.439 1.00 0.54 H new ATOM 0 HB2 ASP A 93 11.228 -1.894 1.968 1.00 0.57 H new ATOM 0 HB3 ASP A 93 10.390 -2.975 3.064 1.00 0.57 H new ATOM 1393 N LEU A 94 7.078 -2.496 2.476 1.00 0.63 N ATOM 1394 CA LEU A 94 5.944 -3.141 3.120 1.00 0.85 C ATOM 1395 C LEU A 94 5.578 -4.507 2.545 1.00 0.72 C ATOM 1396 O LEU A 94 5.903 -4.842 1.405 1.00 0.83 O ATOM 1397 CB LEU A 94 4.763 -2.180 3.354 1.00 1.62 C ATOM 1398 CG LEU A 94 4.700 -0.858 2.566 1.00 1.10 C ATOM 1399 CD1 LEU A 94 3.936 -1.022 1.256 1.00 1.30 C ATOM 1400 CD2 LEU A 94 3.972 0.176 3.425 1.00 1.87 C ATOM 0 H LEU A 94 7.101 -2.600 1.462 1.00 0.63 H new ATOM 0 HA LEU A 94 6.285 -3.400 4.122 1.00 0.85 H new ATOM 0 HB2 LEU A 94 3.846 -2.731 3.144 1.00 1.62 H new ATOM 0 HB3 LEU A 94 4.749 -1.930 4.415 1.00 1.62 H new ATOM 0 HG LEU A 94 5.717 -0.544 2.333 1.00 1.10 H new ATOM 0 HD11 LEU A 94 3.912 -0.069 0.727 1.00 1.30 H new ATOM 0 HD12 LEU A 94 4.433 -1.769 0.636 1.00 1.30 H new ATOM 0 HD13 LEU A 94 2.917 -1.345 1.467 1.00 1.30 H new ATOM 0 HD21 LEU A 94 3.915 1.122 2.886 1.00 1.87 H new ATOM 0 HD22 LEU A 94 2.964 -0.178 3.644 1.00 1.87 H new ATOM 0 HD23 LEU A 94 4.516 0.322 4.358 1.00 1.87 H new ATOM 1412 N ALA A 95 4.959 -5.328 3.401 1.00 0.77 N ATOM 1413 CA ALA A 95 4.794 -6.756 3.194 1.00 0.88 C ATOM 1414 C ALA A 95 3.528 -7.062 2.398 1.00 0.93 C ATOM 1415 O ALA A 95 2.464 -6.490 2.644 1.00 1.09 O ATOM 1416 CB ALA A 95 4.757 -7.463 4.550 1.00 0.99 C ATOM 0 H ALA A 95 4.551 -5.001 4.277 1.00 0.77 H new ATOM 0 HA ALA A 95 5.640 -7.123 2.613 1.00 0.88 H new ATOM 0 HB1 ALA A 95 4.633 -8.535 4.398 1.00 0.99 H new ATOM 0 HB2 ALA A 95 5.690 -7.277 5.083 1.00 0.99 H new ATOM 0 HB3 ALA A 95 3.922 -7.081 5.137 1.00 0.99 H new ATOM 1422 N ALA A 96 3.636 -8.023 1.478 1.00 0.95 N ATOM 1423 CA ALA A 96 2.545 -8.450 0.620 1.00 1.03 C ATOM 1424 C ALA A 96 1.594 -9.321 1.441 1.00 0.85 C ATOM 1425 O ALA A 96 2.046 -10.133 2.246 1.00 1.17 O ATOM 1426 CB ALA A 96 3.129 -9.240 -0.554 1.00 1.21 C ATOM 0 H ALA A 96 4.504 -8.532 1.311 1.00 0.95 H new ATOM 0 HA ALA A 96 1.993 -7.595 0.230 1.00 1.03 H new ATOM 0 HB1 ALA A 96 2.322 -9.568 -1.209 1.00 1.21 H new ATOM 0 HB2 ALA A 96 3.815 -8.605 -1.114 1.00 1.21 H new ATOM 0 HB3 ALA A 96 3.666 -10.110 -0.176 1.00 1.21 H new ATOM 1432 N ALA A 97 0.283 -9.114 1.279 1.00 0.83 N ATOM 1433 CA ALA A 97 -0.733 -9.721 2.131 1.00 0.80 C ATOM 1434 C ALA A 97 -2.022 -9.971 1.348 1.00 1.01 C ATOM 1435 O ALA A 97 -2.244 -9.342 0.316 1.00 1.29 O ATOM 1436 CB ALA A 97 -0.990 -8.803 3.329 1.00 0.99 C ATOM 0 H ALA A 97 -0.101 -8.516 0.547 1.00 0.83 H new ATOM 0 HA ALA A 97 -0.377 -10.688 2.487 1.00 0.80 H new ATOM 0 HB1 ALA A 97 -1.749 -9.248 3.972 1.00 0.99 H new ATOM 0 HB2 ALA A 97 -0.066 -8.674 3.893 1.00 0.99 H new ATOM 0 HB3 ALA A 97 -1.338 -7.832 2.976 1.00 0.99 H new ATOM 1442 N ASP A 98 -2.848 -10.894 1.851 1.00 1.18 N ATOM 1443 CA ASP A 98 -4.072 -11.382 1.216 1.00 1.46 C ATOM 1444 C ASP A 98 -5.212 -10.365 1.431 1.00 1.25 C ATOM 1445 O ASP A 98 -5.185 -9.596 2.394 1.00 1.37 O ATOM 1446 CB ASP A 98 -4.401 -12.755 1.852 1.00 2.00 C ATOM 1447 CG ASP A 98 -5.618 -13.465 1.264 1.00 3.05 C ATOM 1448 OD1 ASP A 98 -6.060 -14.477 1.868 1.00 4.32 O ATOM 1449 OD2 ASP A 98 -6.102 -12.989 0.219 1.00 3.68 O ATOM 0 H ASP A 98 -2.672 -11.340 2.751 1.00 1.18 H new ATOM 0 HA ASP A 98 -3.947 -11.498 0.139 1.00 1.46 H new ATOM 0 HB2 ASP A 98 -3.533 -13.405 1.744 1.00 2.00 H new ATOM 0 HB3 ASP A 98 -4.563 -12.614 2.921 1.00 2.00 H new ATOM 1454 N ILE A 99 -6.207 -10.370 0.541 1.00 1.16 N ATOM 1455 CA ILE A 99 -7.437 -9.616 0.535 1.00 0.98 C ATOM 1456 C ILE A 99 -8.520 -10.612 0.127 1.00 1.11 C ATOM 1457 O ILE A 99 -8.641 -10.954 -1.046 1.00 1.45 O ATOM 1458 CB ILE A 99 -7.311 -8.453 -0.455 1.00 0.75 C ATOM 1459 CG1 ILE A 99 -8.675 -7.824 -0.705 1.00 0.96 C ATOM 1460 CG2 ILE A 99 -6.661 -8.802 -1.801 1.00 1.02 C ATOM 1461 CD1 ILE A 99 -8.504 -6.460 -1.370 1.00 1.24 C ATOM 0 H ILE A 99 -6.152 -10.974 -0.279 1.00 1.16 H new ATOM 0 HA ILE A 99 -7.677 -9.174 1.502 1.00 0.98 H new ATOM 0 HB ILE A 99 -6.632 -7.751 0.029 1.00 0.75 H new ATOM 0 HG12 ILE A 99 -9.275 -8.476 -1.341 1.00 0.96 H new ATOM 0 HG13 ILE A 99 -9.213 -7.714 0.237 1.00 0.96 H new ATOM 0 HG21 ILE A 99 -6.620 -7.911 -2.427 1.00 1.02 H new ATOM 0 HG22 ILE A 99 -5.650 -9.173 -1.632 1.00 1.02 H new ATOM 0 HG23 ILE A 99 -7.251 -9.570 -2.301 1.00 1.02 H new ATOM 0 HD11 ILE A 99 -9.484 -6.016 -1.546 1.00 1.24 H new ATOM 0 HD12 ILE A 99 -7.922 -5.808 -0.719 1.00 1.24 H new ATOM 0 HD13 ILE A 99 -7.985 -6.581 -2.321 1.00 1.24 H new ATOM 1473 N LYS A 100 -9.251 -11.145 1.106 1.00 1.49 N ATOM 1474 CA LYS A 100 -10.061 -12.324 0.915 1.00 1.53 C ATOM 1475 C LYS A 100 -11.137 -12.478 2.000 1.00 1.56 C ATOM 1476 O LYS A 100 -12.277 -12.761 1.634 1.00 2.55 O ATOM 1477 CB LYS A 100 -9.108 -13.512 0.757 1.00 2.40 C ATOM 1478 CG LYS A 100 -9.752 -14.882 0.920 1.00 3.80 C ATOM 1479 CD LYS A 100 -9.743 -15.271 2.405 1.00 4.28 C ATOM 1480 CE LYS A 100 -9.027 -16.610 2.595 1.00 5.41 C ATOM 1481 NZ LYS A 100 -7.569 -16.466 2.353 1.00 6.23 N ATOM 0 H LYS A 100 -9.291 -10.763 2.051 1.00 1.49 H new ATOM 0 HA LYS A 100 -10.658 -12.251 0.006 1.00 1.53 H new ATOM 0 HB2 LYS A 100 -8.647 -13.459 -0.229 1.00 2.40 H new ATOM 0 HB3 LYS A 100 -8.306 -13.415 1.489 1.00 2.40 H new ATOM 0 HG2 LYS A 100 -10.775 -14.864 0.543 1.00 3.80 H new ATOM 0 HG3 LYS A 100 -9.210 -15.624 0.334 1.00 3.80 H new ATOM 0 HD2 LYS A 100 -9.244 -14.497 2.988 1.00 4.28 H new ATOM 0 HD3 LYS A 100 -10.765 -15.341 2.777 1.00 4.28 H new ATOM 0 HE2 LYS A 100 -9.198 -16.979 3.606 1.00 5.41 H new ATOM 0 HE3 LYS A 100 -9.443 -17.350 1.911 1.00 5.41 H new ATOM 0 HZ1 LYS A 100 -7.281 -17.101 1.582 1.00 6.23 H new ATOM 0 HZ2 LYS A 100 -7.356 -15.483 2.089 1.00 6.23 H new ATOM 0 HZ3 LYS A 100 -7.047 -16.713 3.218 1.00 6.23 H new ATOM 1495 N PRO A 101 -10.879 -12.302 3.315 1.00 2.00 N ATOM 1496 CA PRO A 101 -11.958 -12.352 4.291 1.00 2.94 C ATOM 1497 C PRO A 101 -12.627 -10.973 4.282 1.00 2.37 C ATOM 1498 O PRO A 101 -12.552 -10.228 5.258 1.00 3.34 O ATOM 1499 CB PRO A 101 -11.275 -12.701 5.615 1.00 4.37 C ATOM 1500 CG PRO A 101 -9.908 -12.025 5.501 1.00 4.29 C ATOM 1501 CD PRO A 101 -9.645 -11.909 3.993 1.00 2.91 C ATOM 0 HA PRO A 101 -12.739 -13.086 4.094 1.00 2.94 H new ATOM 0 HB2 PRO A 101 -11.839 -12.325 6.469 1.00 4.37 H new ATOM 0 HB3 PRO A 101 -11.180 -13.779 5.746 1.00 4.37 H new ATOM 0 HG2 PRO A 101 -9.912 -11.045 5.977 1.00 4.29 H new ATOM 0 HG3 PRO A 101 -9.134 -12.615 5.992 1.00 4.29 H new ATOM 0 HD2 PRO A 101 -9.366 -10.889 3.727 1.00 2.91 H new ATOM 0 HD3 PRO A 101 -8.818 -12.554 3.695 1.00 2.91 H new ATOM 1509 N ASP A 102 -13.204 -10.617 3.131 1.00 1.59 N ATOM 1510 CA ASP A 102 -13.542 -9.254 2.761 1.00 1.49 C ATOM 1511 C ASP A 102 -14.737 -9.294 1.816 1.00 1.41 C ATOM 1512 O ASP A 102 -14.937 -10.284 1.107 1.00 2.60 O ATOM 1513 CB ASP A 102 -12.327 -8.627 2.071 1.00 2.36 C ATOM 1514 CG ASP A 102 -12.392 -7.118 1.972 1.00 3.36 C ATOM 1515 OD1 ASP A 102 -13.507 -6.573 2.115 1.00 3.98 O ATOM 1516 OD2 ASP A 102 -11.321 -6.537 1.687 1.00 4.51 O ATOM 0 H ASP A 102 -13.454 -11.297 2.413 1.00 1.59 H new ATOM 0 HA ASP A 102 -13.802 -8.658 3.636 1.00 1.49 H new ATOM 0 HB2 ASP A 102 -11.426 -8.908 2.617 1.00 2.36 H new ATOM 0 HB3 ASP A 102 -12.235 -9.044 1.068 1.00 2.36 H new ATOM 1521 N GLY A 103 -15.524 -8.226 1.784 1.00 1.79 N ATOM 1522 CA GLY A 103 -16.867 -8.252 1.240 1.00 2.27 C ATOM 1523 C GLY A 103 -17.331 -6.878 0.785 1.00 2.11 C ATOM 1524 O GLY A 103 -17.590 -6.015 1.620 1.00 3.05 O ATOM 0 H GLY A 103 -15.242 -7.312 2.139 1.00 1.79 H new ATOM 0 HA2 GLY A 103 -16.902 -8.943 0.397 1.00 2.27 H new ATOM 0 HA3 GLY A 103 -17.555 -8.634 1.994 1.00 2.27 H new ATOM 1528 N LYS A 104 -17.486 -6.746 -0.539 1.00 1.63 N ATOM 1529 CA LYS A 104 -18.229 -5.728 -1.296 1.00 1.83 C ATOM 1530 C LYS A 104 -17.306 -5.090 -2.338 1.00 1.87 C ATOM 1531 O LYS A 104 -16.933 -3.927 -2.216 1.00 2.84 O ATOM 1532 CB LYS A 104 -18.928 -4.701 -0.389 1.00 2.25 C ATOM 1533 CG LYS A 104 -19.906 -3.773 -1.122 1.00 3.34 C ATOM 1534 CD LYS A 104 -20.349 -2.623 -0.205 1.00 3.93 C ATOM 1535 CE LYS A 104 -20.962 -3.124 1.115 1.00 4.29 C ATOM 1536 NZ LYS A 104 -21.463 -2.019 1.957 1.00 5.56 N ATOM 0 H LYS A 104 -17.050 -7.417 -1.171 1.00 1.63 H new ATOM 0 HA LYS A 104 -19.046 -6.218 -1.826 1.00 1.83 H new ATOM 0 HB2 LYS A 104 -19.468 -5.233 0.394 1.00 2.25 H new ATOM 0 HB3 LYS A 104 -18.169 -4.093 0.104 1.00 2.25 H new ATOM 0 HG2 LYS A 104 -19.432 -3.370 -2.017 1.00 3.34 H new ATOM 0 HG3 LYS A 104 -20.777 -4.340 -1.450 1.00 3.34 H new ATOM 0 HD2 LYS A 104 -19.492 -1.987 0.015 1.00 3.93 H new ATOM 0 HD3 LYS A 104 -21.078 -2.005 -0.729 1.00 3.93 H new ATOM 0 HE2 LYS A 104 -21.780 -3.810 0.895 1.00 4.29 H new ATOM 0 HE3 LYS A 104 -20.213 -3.689 1.669 1.00 4.29 H new ATOM 0 HZ1 LYS A 104 -21.866 -2.406 2.834 1.00 5.56 H new ATOM 0 HZ2 LYS A 104 -20.679 -1.377 2.190 1.00 5.56 H new ATOM 0 HZ3 LYS A 104 -22.198 -1.494 1.440 1.00 5.56 H new ATOM 1550 N ARG A 105 -16.963 -5.876 -3.364 1.00 1.60 N ATOM 1551 CA ARG A 105 -15.840 -5.665 -4.281 1.00 1.70 C ATOM 1552 C ARG A 105 -14.521 -5.876 -3.529 1.00 1.59 C ATOM 1553 O ARG A 105 -13.494 -5.308 -3.903 1.00 2.26 O ATOM 1554 CB ARG A 105 -15.921 -4.314 -5.023 1.00 2.08 C ATOM 1555 CG ARG A 105 -17.239 -4.212 -5.804 1.00 2.79 C ATOM 1556 CD ARG A 105 -17.304 -2.927 -6.639 1.00 3.49 C ATOM 1557 NE ARG A 105 -18.650 -2.743 -7.210 1.00 4.25 N ATOM 1558 CZ ARG A 105 -19.139 -3.338 -8.312 1.00 5.04 C ATOM 1559 NH1 ARG A 105 -18.343 -3.990 -9.163 1.00 5.58 N ATOM 1560 NH2 ARG A 105 -20.454 -3.282 -8.561 1.00 5.96 N ATOM 0 H ARG A 105 -17.489 -6.720 -3.588 1.00 1.60 H new ATOM 0 HA ARG A 105 -15.892 -6.408 -5.077 1.00 1.70 H new ATOM 0 HB2 ARG A 105 -15.850 -3.494 -4.308 1.00 2.08 H new ATOM 0 HB3 ARG A 105 -15.077 -4.216 -5.706 1.00 2.08 H new ATOM 0 HG2 ARG A 105 -17.342 -5.077 -6.459 1.00 2.79 H new ATOM 0 HG3 ARG A 105 -18.078 -4.237 -5.108 1.00 2.79 H new ATOM 0 HD2 ARG A 105 -17.048 -2.070 -6.016 1.00 3.49 H new ATOM 0 HD3 ARG A 105 -16.567 -2.971 -7.441 1.00 3.49 H new ATOM 0 HE ARG A 105 -19.273 -2.100 -6.720 1.00 4.25 H new ATOM 0 HH11 ARG A 105 -17.340 -4.045 -8.984 1.00 5.58 H new ATOM 0 HH12 ARG A 105 -18.738 -4.434 -9.992 1.00 5.58 H new ATOM 0 HH21 ARG A 105 -21.075 -2.791 -7.917 1.00 5.96 H new ATOM 0 HH22 ARG A 105 -20.835 -3.730 -9.394 1.00 5.96 H new ATOM 1574 N HIS A 106 -14.567 -6.690 -2.459 1.00 1.78 N ATOM 1575 CA HIS A 106 -13.573 -6.700 -1.390 1.00 2.24 C ATOM 1576 C HIS A 106 -13.335 -5.249 -0.918 1.00 1.67 C ATOM 1577 O HIS A 106 -14.152 -4.367 -1.182 1.00 2.89 O ATOM 1578 CB HIS A 106 -12.307 -7.438 -1.866 1.00 3.29 C ATOM 1579 CG HIS A 106 -12.319 -8.956 -1.828 1.00 5.38 C ATOM 1580 ND1 HIS A 106 -13.180 -9.793 -1.140 1.00 6.94 N ATOM 1581 CD2 HIS A 106 -11.444 -9.761 -2.509 1.00 6.64 C ATOM 1582 CE1 HIS A 106 -12.820 -11.060 -1.414 1.00 8.75 C ATOM 1583 NE2 HIS A 106 -11.767 -11.090 -2.245 1.00 8.67 N ATOM 0 H HIS A 106 -15.314 -7.370 -2.318 1.00 1.78 H new ATOM 0 HA HIS A 106 -13.922 -7.254 -0.519 1.00 2.24 H new ATOM 0 HB2 HIS A 106 -12.105 -7.130 -2.892 1.00 3.29 H new ATOM 0 HB3 HIS A 106 -11.470 -7.094 -1.259 1.00 3.29 H new ATOM 0 HD1 HIS A 106 -13.948 -9.502 -0.535 1.00 6.94 H new ATOM 0 HD2 HIS A 106 -10.639 -9.422 -3.144 1.00 6.64 H new ATOM 0 HE1 HIS A 106 -13.313 -11.936 -1.018 1.00 8.75 H new ATOM 1591 N ALA A 107 -12.246 -4.982 -0.201 1.00 1.15 N ATOM 1592 CA ALA A 107 -11.946 -3.675 0.344 1.00 1.54 C ATOM 1593 C ALA A 107 -10.439 -3.490 0.471 1.00 1.32 C ATOM 1594 O ALA A 107 -9.931 -2.514 -0.074 1.00 1.60 O ATOM 1595 CB ALA A 107 -12.654 -3.471 1.688 1.00 2.65 C ATOM 0 H ALA A 107 -11.540 -5.685 0.017 1.00 1.15 H new ATOM 0 HA ALA A 107 -12.321 -2.914 -0.341 1.00 1.54 H new ATOM 0 HB1 ALA A 107 -12.414 -2.482 2.079 1.00 2.65 H new ATOM 0 HB2 ALA A 107 -13.732 -3.554 1.548 1.00 2.65 H new ATOM 0 HB3 ALA A 107 -12.320 -4.231 2.394 1.00 2.65 H new ATOM 1601 N VAL A 108 -9.721 -4.367 1.191 1.00 1.07 N ATOM 1602 CA VAL A 108 -8.323 -4.106 1.550 1.00 1.01 C ATOM 1603 C VAL A 108 -7.446 -5.356 1.690 1.00 0.94 C ATOM 1604 O VAL A 108 -7.879 -6.366 2.239 1.00 1.00 O ATOM 1605 CB VAL A 108 -8.231 -3.277 2.846 1.00 1.12 C ATOM 1606 CG1 VAL A 108 -8.555 -1.800 2.619 1.00 1.39 C ATOM 1607 CG2 VAL A 108 -9.096 -3.835 3.985 1.00 1.15 C ATOM 0 H VAL A 108 -10.085 -5.256 1.533 1.00 1.07 H new ATOM 0 HA VAL A 108 -7.927 -3.545 0.703 1.00 1.01 H new ATOM 0 HB VAL A 108 -7.189 -3.358 3.155 1.00 1.12 H new ATOM 0 HG11 VAL A 108 -8.476 -1.261 3.563 1.00 1.39 H new ATOM 0 HG12 VAL A 108 -7.851 -1.379 1.901 1.00 1.39 H new ATOM 0 HG13 VAL A 108 -9.569 -1.705 2.231 1.00 1.39 H new ATOM 0 HG21 VAL A 108 -8.986 -3.205 4.868 1.00 1.15 H new ATOM 0 HG22 VAL A 108 -10.141 -3.847 3.676 1.00 1.15 H new ATOM 0 HG23 VAL A 108 -8.776 -4.850 4.221 1.00 1.15 H new ATOM 1617 N ILE A 109 -6.178 -5.249 1.261 1.00 1.09 N ATOM 1618 CA ILE A 109 -5.096 -6.034 1.844 1.00 0.99 C ATOM 1619 C ILE A 109 -4.703 -5.336 3.141 1.00 0.94 C ATOM 1620 O ILE A 109 -4.814 -4.111 3.222 1.00 1.29 O ATOM 1621 CB ILE A 109 -3.873 -6.187 0.907 1.00 1.30 C ATOM 1622 CG1 ILE A 109 -3.097 -4.894 0.682 1.00 1.86 C ATOM 1623 CG2 ILE A 109 -4.215 -6.838 -0.436 1.00 2.23 C ATOM 1624 CD1 ILE A 109 -1.923 -4.713 1.646 1.00 3.01 C ATOM 0 H ILE A 109 -5.884 -4.623 0.511 1.00 1.09 H new ATOM 0 HA ILE A 109 -5.443 -7.052 2.019 1.00 0.99 H new ATOM 0 HB ILE A 109 -3.217 -6.865 1.453 1.00 1.30 H new ATOM 0 HG12 ILE A 109 -2.723 -4.877 -0.342 1.00 1.86 H new ATOM 0 HG13 ILE A 109 -3.777 -4.048 0.787 1.00 1.86 H new ATOM 0 HG21 ILE A 109 -3.313 -6.915 -1.043 1.00 2.23 H new ATOM 0 HG22 ILE A 109 -4.623 -7.834 -0.264 1.00 2.23 H new ATOM 0 HG23 ILE A 109 -4.953 -6.229 -0.958 1.00 2.23 H new ATOM 0 HD11 ILE A 109 -1.416 -3.773 1.429 1.00 3.01 H new ATOM 0 HD12 ILE A 109 -2.293 -4.698 2.671 1.00 3.01 H new ATOM 0 HD13 ILE A 109 -1.223 -5.539 1.525 1.00 3.01 H new ATOM 1636 N SER A 110 -4.202 -6.093 4.119 1.00 0.74 N ATOM 1637 CA SER A 110 -3.671 -5.570 5.371 1.00 0.75 C ATOM 1638 C SER A 110 -2.269 -6.139 5.569 1.00 0.67 C ATOM 1639 O SER A 110 -2.142 -7.323 5.869 1.00 0.88 O ATOM 1640 CB SER A 110 -4.603 -5.958 6.521 1.00 0.87 C ATOM 1641 OG SER A 110 -5.870 -5.355 6.319 1.00 2.14 O ATOM 0 H SER A 110 -4.155 -7.110 4.057 1.00 0.74 H new ATOM 0 HA SER A 110 -3.611 -4.482 5.347 1.00 0.75 H new ATOM 0 HB2 SER A 110 -4.707 -7.042 6.571 1.00 0.87 H new ATOM 0 HB3 SER A 110 -4.181 -5.634 7.472 1.00 0.87 H new ATOM 0 HG SER A 110 -6.471 -5.602 7.053 1.00 2.14 H new ATOM 1647 N GLY A 111 -1.234 -5.320 5.367 1.00 0.64 N ATOM 1648 CA GLY A 111 0.163 -5.753 5.448 1.00 0.67 C ATOM 1649 C GLY A 111 0.919 -5.040 6.572 1.00 0.60 C ATOM 1650 O GLY A 111 0.486 -3.995 7.052 1.00 0.71 O ATOM 0 H GLY A 111 -1.343 -4.331 5.141 1.00 0.64 H new ATOM 0 HA2 GLY A 111 0.200 -6.830 5.612 1.00 0.67 H new ATOM 0 HA3 GLY A 111 0.659 -5.558 4.497 1.00 0.67 H new ATOM 1654 N SER A 112 2.066 -5.580 6.996 1.00 0.70 N ATOM 1655 CA SER A 112 2.984 -4.887 7.883 1.00 0.62 C ATOM 1656 C SER A 112 3.896 -3.994 7.042 1.00 0.51 C ATOM 1657 O SER A 112 3.974 -4.162 5.822 1.00 0.61 O ATOM 1658 CB SER A 112 3.793 -5.914 8.680 1.00 0.86 C ATOM 1659 OG SER A 112 4.332 -6.898 7.822 1.00 2.51 O ATOM 0 H SER A 112 2.378 -6.514 6.728 1.00 0.70 H new ATOM 0 HA SER A 112 2.439 -4.263 8.591 1.00 0.62 H new ATOM 0 HB2 SER A 112 4.598 -5.413 9.218 1.00 0.86 H new ATOM 0 HB3 SER A 112 3.156 -6.386 9.428 1.00 0.86 H new ATOM 0 HG SER A 112 5.051 -7.377 8.284 1.00 2.51 H new ATOM 1665 N VAL A 113 4.593 -3.053 7.686 1.00 0.52 N ATOM 1666 CA VAL A 113 5.655 -2.295 7.038 1.00 0.54 C ATOM 1667 C VAL A 113 6.943 -2.464 7.819 1.00 0.52 C ATOM 1668 O VAL A 113 6.891 -2.620 9.036 1.00 0.63 O ATOM 1669 CB VAL A 113 5.294 -0.809 6.838 1.00 0.70 C ATOM 1670 CG1 VAL A 113 3.781 -0.546 6.831 1.00 0.93 C ATOM 1671 CG2 VAL A 113 5.988 0.117 7.839 1.00 0.87 C ATOM 0 H VAL A 113 4.435 -2.801 8.662 1.00 0.52 H new ATOM 0 HA VAL A 113 5.792 -2.696 6.034 1.00 0.54 H new ATOM 0 HB VAL A 113 5.673 -0.570 5.844 1.00 0.70 H new ATOM 0 HG11 VAL A 113 3.597 0.519 6.686 1.00 0.93 H new ATOM 0 HG12 VAL A 113 3.318 -1.108 6.020 1.00 0.93 H new ATOM 0 HG13 VAL A 113 3.352 -0.862 7.782 1.00 0.93 H new ATOM 0 HG21 VAL A 113 5.693 1.148 7.646 1.00 0.87 H new ATOM 0 HG22 VAL A 113 5.697 -0.160 8.852 1.00 0.87 H new ATOM 0 HG23 VAL A 113 7.069 0.023 7.733 1.00 0.87 H new ATOM 1681 N LEU A 114 8.076 -2.366 7.118 1.00 0.55 N ATOM 1682 CA LEU A 114 9.391 -2.324 7.722 1.00 0.67 C ATOM 1683 C LEU A 114 10.058 -0.983 7.435 1.00 0.70 C ATOM 1684 O LEU A 114 10.286 -0.588 6.290 1.00 0.75 O ATOM 1685 CB LEU A 114 10.216 -3.551 7.338 1.00 0.87 C ATOM 1686 CG LEU A 114 10.562 -3.620 5.847 1.00 1.45 C ATOM 1687 CD1 LEU A 114 12.059 -3.398 5.622 1.00 2.05 C ATOM 1688 CD2 LEU A 114 10.132 -4.969 5.258 1.00 2.61 C ATOM 0 H LEU A 114 8.095 -2.313 6.100 1.00 0.55 H new ATOM 0 HA LEU A 114 9.304 -2.384 8.807 1.00 0.67 H new ATOM 0 HB2 LEU A 114 11.140 -3.552 7.916 1.00 0.87 H new ATOM 0 HB3 LEU A 114 9.665 -4.450 7.616 1.00 0.87 H new ATOM 0 HG LEU A 114 10.018 -2.825 5.337 1.00 1.45 H new ATOM 0 HD11 LEU A 114 12.279 -3.452 4.556 1.00 2.05 H new ATOM 0 HD12 LEU A 114 12.342 -2.416 6.002 1.00 2.05 H new ATOM 0 HD13 LEU A 114 12.624 -4.167 6.148 1.00 2.05 H new ATOM 0 HD21 LEU A 114 10.385 -5.001 4.198 1.00 2.61 H new ATOM 0 HD22 LEU A 114 10.649 -5.775 5.779 1.00 2.61 H new ATOM 0 HD23 LEU A 114 9.056 -5.092 5.378 1.00 2.61 H new ATOM 1700 N TYR A 115 10.368 -0.279 8.519 1.00 0.85 N ATOM 1701 CA TYR A 115 11.044 1.001 8.529 1.00 1.04 C ATOM 1702 C TYR A 115 12.524 0.713 8.319 1.00 1.08 C ATOM 1703 O TYR A 115 13.317 0.772 9.259 1.00 1.23 O ATOM 1704 CB TYR A 115 10.732 1.679 9.867 1.00 1.28 C ATOM 1705 CG TYR A 115 11.287 3.076 10.040 1.00 1.79 C ATOM 1706 CD1 TYR A 115 12.427 3.283 10.838 1.00 3.15 C ATOM 1707 CD2 TYR A 115 10.545 4.180 9.579 1.00 2.57 C ATOM 1708 CE1 TYR A 115 12.760 4.580 11.262 1.00 4.02 C ATOM 1709 CE2 TYR A 115 10.887 5.476 9.996 1.00 3.32 C ATOM 1710 CZ TYR A 115 11.979 5.671 10.859 1.00 3.71 C ATOM 1711 OH TYR A 115 12.173 6.878 11.453 1.00 4.65 O ATOM 0 H TYR A 115 10.141 -0.607 9.458 1.00 0.85 H new ATOM 0 HA TYR A 115 10.718 1.682 7.743 1.00 1.04 H new ATOM 0 HB2 TYR A 115 9.650 1.720 9.989 1.00 1.28 H new ATOM 0 HB3 TYR A 115 11.119 1.052 10.670 1.00 1.28 H new ATOM 0 HD1 TYR A 115 13.046 2.445 11.124 1.00 3.15 H new ATOM 0 HD2 TYR A 115 9.714 4.030 8.906 1.00 2.57 H new ATOM 0 HE1 TYR A 115 13.618 4.736 11.899 1.00 4.02 H new ATOM 0 HE2 TYR A 115 10.311 6.323 9.654 1.00 3.32 H new ATOM 0 HH TYR A 115 11.505 7.515 11.124 1.00 4.65 H new ATOM 1721 N ASN A 116 12.850 0.302 7.088 1.00 1.02 N ATOM 1722 CA ASN A 116 14.167 -0.103 6.612 1.00 1.08 C ATOM 1723 C ASN A 116 14.640 -1.405 7.272 1.00 0.85 C ATOM 1724 O ASN A 116 14.909 -2.383 6.580 1.00 0.89 O ATOM 1725 CB ASN A 116 15.159 1.051 6.749 1.00 1.42 C ATOM 1726 CG ASN A 116 16.471 0.757 6.026 1.00 2.04 C ATOM 1727 OD1 ASN A 116 17.220 -0.135 6.413 1.00 2.73 O ATOM 1728 ND2 ASN A 116 16.784 1.525 4.989 1.00 2.75 N ATOM 0 H ASN A 116 12.148 0.241 6.351 1.00 1.02 H new ATOM 0 HA ASN A 116 14.099 -0.335 5.549 1.00 1.08 H new ATOM 0 HB2 ASN A 116 14.717 1.961 6.344 1.00 1.42 H new ATOM 0 HB3 ASN A 116 15.359 1.236 7.804 1.00 1.42 H new ATOM 0 HD21 ASN A 116 17.664 1.380 4.494 1.00 2.75 H new ATOM 0 HD22 ASN A 116 16.144 2.260 4.687 1.00 2.75 H new ATOM 1735 N GLN A 117 14.699 -1.433 8.606 1.00 0.79 N ATOM 1736 CA GLN A 117 14.898 -2.627 9.417 1.00 0.80 C ATOM 1737 C GLN A 117 13.659 -2.927 10.273 1.00 1.01 C ATOM 1738 O GLN A 117 13.272 -4.083 10.425 1.00 1.59 O ATOM 1739 CB GLN A 117 16.130 -2.484 10.331 1.00 0.96 C ATOM 1740 CG GLN A 117 17.287 -1.662 9.741 1.00 1.16 C ATOM 1741 CD GLN A 117 17.128 -0.160 9.984 1.00 1.50 C ATOM 1742 OE1 GLN A 117 16.656 0.266 11.032 1.00 2.73 O ATOM 1743 NE2 GLN A 117 17.526 0.665 9.023 1.00 1.61 N ATOM 0 H GLN A 117 14.605 -0.588 9.169 1.00 0.79 H new ATOM 0 HA GLN A 117 15.064 -3.456 8.730 1.00 0.80 H new ATOM 0 HB2 GLN A 117 15.817 -2.022 11.267 1.00 0.96 H new ATOM 0 HB3 GLN A 117 16.500 -3.480 10.575 1.00 0.96 H new ATOM 0 HG2 GLN A 117 18.227 -1.999 10.178 1.00 1.16 H new ATOM 0 HG3 GLN A 117 17.350 -1.848 8.669 1.00 1.16 H new ATOM 0 HE21 GLN A 117 17.916 0.290 8.158 1.00 1.61 H new ATOM 0 HE22 GLN A 117 17.442 1.674 9.149 1.00 1.61 H new ATOM 1752 N ALA A 118 13.077 -1.900 10.905 1.00 0.96 N ATOM 1753 CA ALA A 118 12.211 -2.090 12.064 1.00 1.07 C ATOM 1754 C ALA A 118 10.748 -2.261 11.655 1.00 0.90 C ATOM 1755 O ALA A 118 10.134 -1.317 11.155 1.00 1.19 O ATOM 1756 CB ALA A 118 12.382 -0.905 13.021 1.00 1.34 C ATOM 0 H ALA A 118 13.194 -0.926 10.627 1.00 0.96 H new ATOM 0 HA ALA A 118 12.504 -3.009 12.572 1.00 1.07 H new ATOM 0 HB1 ALA A 118 11.737 -1.042 13.889 1.00 1.34 H new ATOM 0 HB2 ALA A 118 13.421 -0.847 13.346 1.00 1.34 H new ATOM 0 HB3 ALA A 118 12.110 0.018 12.509 1.00 1.34 H new ATOM 1762 N GLU A 119 10.161 -3.438 11.896 1.00 0.79 N ATOM 1763 CA GLU A 119 8.783 -3.707 11.505 1.00 0.86 C ATOM 1764 C GLU A 119 7.790 -3.100 12.507 1.00 0.88 C ATOM 1765 O GLU A 119 6.946 -3.807 13.059 1.00 1.50 O ATOM 1766 CB GLU A 119 8.601 -5.226 11.318 1.00 1.32 C ATOM 1767 CG GLU A 119 7.367 -5.568 10.464 1.00 1.66 C ATOM 1768 CD GLU A 119 7.126 -7.068 10.336 1.00 2.40 C ATOM 1769 OE1 GLU A 119 6.320 -7.431 9.449 1.00 2.96 O ATOM 1770 OE2 GLU A 119 7.731 -7.820 11.129 1.00 3.43 O ATOM 0 H GLU A 119 10.625 -4.218 12.362 1.00 0.79 H new ATOM 0 HA GLU A 119 8.567 -3.223 10.552 1.00 0.86 H new ATOM 0 HB2 GLU A 119 9.492 -5.641 10.847 1.00 1.32 H new ATOM 0 HB3 GLU A 119 8.507 -5.701 12.295 1.00 1.32 H new ATOM 0 HG2 GLU A 119 6.486 -5.101 10.905 1.00 1.66 H new ATOM 0 HG3 GLU A 119 7.491 -5.140 9.469 1.00 1.66 H new ATOM 1777 N LYS A 120 7.840 -1.777 12.732 1.00 0.65 N ATOM 1778 CA LYS A 120 6.904 -1.069 13.595 1.00 0.87 C ATOM 1779 C LYS A 120 5.986 -0.234 12.726 1.00 0.79 C ATOM 1780 O LYS A 120 5.891 0.985 12.840 1.00 1.12 O ATOM 1781 CB LYS A 120 7.643 -0.265 14.671 1.00 1.37 C ATOM 1782 CG LYS A 120 8.513 -1.164 15.557 1.00 2.12 C ATOM 1783 CD LYS A 120 7.839 -2.463 15.995 1.00 2.39 C ATOM 1784 CE LYS A 120 6.585 -2.306 16.863 1.00 2.70 C ATOM 1785 NZ LYS A 120 5.890 -3.602 17.020 1.00 3.11 N ATOM 0 H LYS A 120 8.543 -1.170 12.311 1.00 0.65 H new ATOM 0 HA LYS A 120 6.284 -1.774 14.150 1.00 0.87 H new ATOM 0 HB2 LYS A 120 8.268 0.490 14.195 1.00 1.37 H new ATOM 0 HB3 LYS A 120 6.919 0.264 15.290 1.00 1.37 H new ATOM 0 HG2 LYS A 120 9.428 -1.408 15.018 1.00 2.12 H new ATOM 0 HG3 LYS A 120 8.806 -0.604 16.445 1.00 2.12 H new ATOM 0 HD2 LYS A 120 7.572 -3.030 15.103 1.00 2.39 H new ATOM 0 HD3 LYS A 120 8.566 -3.060 16.546 1.00 2.39 H new ATOM 0 HE2 LYS A 120 6.862 -1.915 17.842 1.00 2.70 H new ATOM 0 HE3 LYS A 120 5.911 -1.579 16.409 1.00 2.70 H new ATOM 0 HZ1 LYS A 120 5.044 -3.473 17.611 1.00 3.11 H new ATOM 0 HZ2 LYS A 120 5.608 -3.960 16.085 1.00 3.11 H new ATOM 0 HZ3 LYS A 120 6.529 -4.286 17.474 1.00 3.11 H new ATOM 1799 N GLY A 121 5.286 -0.942 11.852 1.00 0.57 N ATOM 1800 CA GLY A 121 4.137 -0.368 11.177 1.00 0.52 C ATOM 1801 C GLY A 121 3.185 -1.416 10.623 1.00 0.46 C ATOM 1802 O GLY A 121 3.585 -2.542 10.324 1.00 0.58 O ATOM 0 H GLY A 121 5.493 -1.908 11.596 1.00 0.57 H new ATOM 0 HA2 GLY A 121 3.597 0.273 11.874 1.00 0.52 H new ATOM 0 HA3 GLY A 121 4.482 0.268 10.362 1.00 0.52 H new ATOM 1806 N SER A 122 1.930 -1.004 10.456 1.00 0.54 N ATOM 1807 CA SER A 122 0.845 -1.765 9.866 1.00 0.57 C ATOM 1808 C SER A 122 0.149 -0.849 8.868 1.00 0.53 C ATOM 1809 O SER A 122 -0.112 0.304 9.217 1.00 0.82 O ATOM 1810 CB SER A 122 -0.124 -2.169 10.978 1.00 0.73 C ATOM 1811 OG SER A 122 -0.448 -1.037 11.767 1.00 0.83 O ATOM 0 H SER A 122 1.632 -0.073 10.748 1.00 0.54 H new ATOM 0 HA SER A 122 1.203 -2.665 9.366 1.00 0.57 H new ATOM 0 HB2 SER A 122 -1.030 -2.594 10.547 1.00 0.73 H new ATOM 0 HB3 SER A 122 0.325 -2.942 11.602 1.00 0.73 H new ATOM 0 HG SER A 122 -0.523 -0.247 11.191 1.00 0.83 H new ATOM 1817 N TYR A 123 -0.172 -1.332 7.668 1.00 0.56 N ATOM 1818 CA TYR A 123 -0.937 -0.564 6.704 1.00 0.56 C ATOM 1819 C TYR A 123 -1.961 -1.448 6.007 1.00 0.61 C ATOM 1820 O TYR A 123 -1.895 -2.675 6.090 1.00 0.77 O ATOM 1821 CB TYR A 123 -0.003 0.166 5.721 1.00 0.94 C ATOM 1822 CG TYR A 123 0.184 -0.455 4.350 1.00 0.85 C ATOM 1823 CD1 TYR A 123 -0.098 0.306 3.200 1.00 1.69 C ATOM 1824 CD2 TYR A 123 0.619 -1.787 4.217 1.00 2.08 C ATOM 1825 CE1 TYR A 123 0.020 -0.271 1.927 1.00 1.91 C ATOM 1826 CE2 TYR A 123 0.664 -2.385 2.946 1.00 2.44 C ATOM 1827 CZ TYR A 123 0.351 -1.628 1.803 1.00 1.79 C ATOM 1828 OH TYR A 123 0.381 -2.194 0.566 1.00 2.39 O ATOM 0 H TYR A 123 0.092 -2.262 7.344 1.00 0.56 H new ATOM 0 HA TYR A 123 -1.497 0.210 7.229 1.00 0.56 H new ATOM 0 HB2 TYR A 123 -0.382 1.179 5.584 1.00 0.94 H new ATOM 0 HB3 TYR A 123 0.978 0.253 6.189 1.00 0.94 H new ATOM 0 HD1 TYR A 123 -0.406 1.337 3.298 1.00 1.69 H new ATOM 0 HD2 TYR A 123 0.918 -2.348 5.090 1.00 2.08 H new ATOM 0 HE1 TYR A 123 -0.144 0.329 1.044 1.00 1.91 H new ATOM 0 HE2 TYR A 123 0.939 -3.425 2.847 1.00 2.44 H new ATOM 0 HH TYR A 123 0.627 -1.516 -0.098 1.00 2.39 H new ATOM 1838 N SER A 124 -2.898 -0.825 5.302 1.00 0.72 N ATOM 1839 CA SER A 124 -3.892 -1.527 4.533 1.00 1.11 C ATOM 1840 C SER A 124 -4.170 -0.712 3.282 1.00 1.03 C ATOM 1841 O SER A 124 -4.081 0.518 3.298 1.00 1.14 O ATOM 1842 CB SER A 124 -5.143 -1.790 5.380 1.00 1.45 C ATOM 1843 OG SER A 124 -5.601 -0.597 5.989 1.00 1.53 O ATOM 0 H SER A 124 -2.981 0.190 5.254 1.00 0.72 H new ATOM 0 HA SER A 124 -3.536 -2.512 4.230 1.00 1.11 H new ATOM 0 HB2 SER A 124 -5.930 -2.208 4.753 1.00 1.45 H new ATOM 0 HB3 SER A 124 -4.919 -2.531 6.147 1.00 1.45 H new ATOM 0 HG SER A 124 -6.400 -0.788 6.523 1.00 1.53 H new ATOM 1849 N LEU A 125 -4.421 -1.419 2.185 1.00 0.97 N ATOM 1850 CA LEU A 125 -4.503 -0.821 0.858 1.00 0.98 C ATOM 1851 C LEU A 125 -5.566 -1.538 0.040 1.00 1.05 C ATOM 1852 O LEU A 125 -5.666 -2.762 0.067 1.00 1.11 O ATOM 1853 CB LEU A 125 -3.105 -0.829 0.243 1.00 0.97 C ATOM 1854 CG LEU A 125 -2.963 -0.369 -1.208 1.00 1.00 C ATOM 1855 CD1 LEU A 125 -3.240 -1.502 -2.191 1.00 1.14 C ATOM 1856 CD2 LEU A 125 -3.702 0.921 -1.557 1.00 1.00 C ATOM 0 H LEU A 125 -4.574 -2.427 2.192 1.00 0.97 H new ATOM 0 HA LEU A 125 -4.823 0.220 0.894 1.00 0.98 H new ATOM 0 HB2 LEU A 125 -2.464 -0.198 0.859 1.00 0.97 H new ATOM 0 HB3 LEU A 125 -2.714 -1.844 0.313 1.00 0.97 H new ATOM 0 HG LEU A 125 -1.914 -0.094 -1.313 1.00 1.00 H new ATOM 0 HD11 LEU A 125 -3.129 -1.134 -3.211 1.00 1.14 H new ATOM 0 HD12 LEU A 125 -2.533 -2.314 -2.019 1.00 1.14 H new ATOM 0 HD13 LEU A 125 -4.256 -1.869 -2.046 1.00 1.14 H new ATOM 0 HD21 LEU A 125 -3.538 1.161 -2.608 1.00 1.00 H new ATOM 0 HD22 LEU A 125 -4.769 0.789 -1.377 1.00 1.00 H new ATOM 0 HD23 LEU A 125 -3.327 1.735 -0.936 1.00 1.00 H new ATOM 1868 N GLY A 126 -6.387 -0.751 -0.645 1.00 1.03 N ATOM 1869 CA GLY A 126 -7.631 -1.154 -1.275 1.00 0.89 C ATOM 1870 C GLY A 126 -7.636 -0.825 -2.759 1.00 0.97 C ATOM 1871 O GLY A 126 -6.638 -0.352 -3.293 1.00 1.67 O ATOM 0 H GLY A 126 -6.188 0.240 -0.781 1.00 1.03 H new ATOM 0 HA2 GLY A 126 -7.779 -2.225 -1.138 1.00 0.89 H new ATOM 0 HA3 GLY A 126 -8.466 -0.652 -0.787 1.00 0.89 H new ATOM 1875 N ILE A 127 -8.730 -1.154 -3.448 1.00 0.65 N ATOM 1876 CA ILE A 127 -8.914 -0.898 -4.867 1.00 0.69 C ATOM 1877 C ILE A 127 -10.357 -0.469 -5.085 1.00 0.73 C ATOM 1878 O ILE A 127 -11.270 -1.188 -4.686 1.00 0.98 O ATOM 1879 CB ILE A 127 -8.513 -2.143 -5.675 1.00 0.90 C ATOM 1880 CG1 ILE A 127 -8.752 -1.982 -7.187 1.00 1.29 C ATOM 1881 CG2 ILE A 127 -9.115 -3.450 -5.144 1.00 1.43 C ATOM 1882 CD1 ILE A 127 -10.139 -2.421 -7.679 1.00 2.67 C ATOM 0 H ILE A 127 -9.530 -1.618 -3.018 1.00 0.65 H new ATOM 0 HA ILE A 127 -8.271 -0.091 -5.219 1.00 0.69 H new ATOM 0 HB ILE A 127 -7.436 -2.226 -5.528 1.00 0.90 H new ATOM 0 HG12 ILE A 127 -8.604 -0.935 -7.453 1.00 1.29 H new ATOM 0 HG13 ILE A 127 -7.996 -2.557 -7.722 1.00 1.29 H new ATOM 0 HG21 ILE A 127 -8.786 -4.282 -5.767 1.00 1.43 H new ATOM 0 HG22 ILE A 127 -8.785 -3.612 -4.118 1.00 1.43 H new ATOM 0 HG23 ILE A 127 -10.203 -3.386 -5.169 1.00 1.43 H new ATOM 0 HD11 ILE A 127 -10.208 -2.268 -8.756 1.00 2.67 H new ATOM 0 HD12 ILE A 127 -10.288 -3.477 -7.452 1.00 2.67 H new ATOM 0 HD13 ILE A 127 -10.906 -1.830 -7.179 1.00 2.67 H new ATOM 1894 N PHE A 128 -10.563 0.703 -5.693 1.00 0.72 N ATOM 1895 CA PHE A 128 -11.881 1.303 -5.800 1.00 0.93 C ATOM 1896 C PHE A 128 -12.080 1.983 -7.149 1.00 1.26 C ATOM 1897 O PHE A 128 -11.235 1.914 -8.047 1.00 1.38 O ATOM 1898 CB PHE A 128 -12.071 2.299 -4.645 1.00 2.04 C ATOM 1899 CG PHE A 128 -11.781 1.714 -3.277 1.00 3.62 C ATOM 1900 CD1 PHE A 128 -10.561 1.998 -2.642 1.00 5.08 C ATOM 1901 CD2 PHE A 128 -12.659 0.771 -2.713 1.00 4.67 C ATOM 1902 CE1 PHE A 128 -10.240 1.385 -1.420 1.00 7.11 C ATOM 1903 CE2 PHE A 128 -12.327 0.135 -1.504 1.00 6.54 C ATOM 1904 CZ PHE A 128 -11.124 0.453 -0.851 1.00 7.66 C ATOM 0 H PHE A 128 -9.819 1.255 -6.121 1.00 0.72 H new ATOM 0 HA PHE A 128 -12.634 0.518 -5.731 1.00 0.93 H new ATOM 0 HB2 PHE A 128 -11.420 3.158 -4.808 1.00 2.04 H new ATOM 0 HB3 PHE A 128 -13.096 2.669 -4.662 1.00 2.04 H new ATOM 0 HD1 PHE A 128 -9.867 2.690 -3.095 1.00 5.08 H new ATOM 0 HD2 PHE A 128 -13.589 0.535 -3.209 1.00 4.67 H new ATOM 0 HE1 PHE A 128 -9.315 1.630 -0.919 1.00 7.11 H new ATOM 0 HE2 PHE A 128 -12.996 -0.598 -1.077 1.00 6.54 H new ATOM 0 HZ PHE A 128 -10.879 -0.019 0.089 1.00 7.66 H new ATOM 1914 N GLY A 129 -13.263 2.582 -7.310 1.00 2.26 N ATOM 1915 CA GLY A 129 -13.678 3.269 -8.523 1.00 3.25 C ATOM 1916 C GLY A 129 -14.256 2.262 -9.513 1.00 2.51 C ATOM 1917 O GLY A 129 -15.307 2.497 -10.102 1.00 3.04 O ATOM 0 H GLY A 129 -13.973 2.600 -6.578 1.00 2.26 H new ATOM 0 HA2 GLY A 129 -14.423 4.028 -8.285 1.00 3.25 H new ATOM 0 HA3 GLY A 129 -12.828 3.785 -8.969 1.00 3.25 H new ATOM 1921 N GLY A 130 -13.586 1.117 -9.663 1.00 1.69 N ATOM 1922 CA GLY A 130 -14.150 -0.041 -10.341 1.00 1.72 C ATOM 1923 C GLY A 130 -13.614 -0.173 -11.759 1.00 1.90 C ATOM 1924 O GLY A 130 -14.341 -0.575 -12.666 1.00 2.89 O ATOM 0 H GLY A 130 -12.638 0.972 -9.316 1.00 1.69 H new ATOM 0 HA2 GLY A 130 -13.916 -0.944 -9.777 1.00 1.72 H new ATOM 0 HA3 GLY A 130 -15.236 0.045 -10.368 1.00 1.72 H new ATOM 1928 N LYS A 131 -12.326 0.148 -11.928 1.00 1.51 N ATOM 1929 CA LYS A 131 -11.475 -0.413 -12.970 1.00 1.47 C ATOM 1930 C LYS A 131 -10.000 -0.304 -12.554 1.00 1.18 C ATOM 1931 O LYS A 131 -9.150 -0.046 -13.399 1.00 1.45 O ATOM 1932 CB LYS A 131 -11.743 0.228 -14.346 1.00 1.75 C ATOM 1933 CG LYS A 131 -11.467 1.738 -14.396 1.00 1.87 C ATOM 1934 CD LYS A 131 -10.885 2.136 -15.758 1.00 2.07 C ATOM 1935 CE LYS A 131 -10.542 3.633 -15.775 1.00 2.80 C ATOM 1936 NZ LYS A 131 -9.888 4.040 -17.037 1.00 3.31 N ATOM 0 H LYS A 131 -11.842 0.818 -11.330 1.00 1.51 H new ATOM 0 HA LYS A 131 -11.720 -1.469 -13.083 1.00 1.47 H new ATOM 0 HB2 LYS A 131 -11.125 -0.269 -15.094 1.00 1.75 H new ATOM 0 HB3 LYS A 131 -12.782 0.050 -14.622 1.00 1.75 H new ATOM 0 HG2 LYS A 131 -12.390 2.288 -14.214 1.00 1.87 H new ATOM 0 HG3 LYS A 131 -10.771 2.012 -13.603 1.00 1.87 H new ATOM 0 HD2 LYS A 131 -9.990 1.549 -15.964 1.00 2.07 H new ATOM 0 HD3 LYS A 131 -11.603 1.911 -16.547 1.00 2.07 H new ATOM 0 HE2 LYS A 131 -11.453 4.215 -15.636 1.00 2.80 H new ATOM 0 HE3 LYS A 131 -9.885 3.863 -14.936 1.00 2.80 H new ATOM 0 HZ1 LYS A 131 -9.674 5.057 -17.005 1.00 3.31 H new ATOM 0 HZ2 LYS A 131 -9.005 3.504 -17.159 1.00 3.31 H new ATOM 0 HZ3 LYS A 131 -10.524 3.845 -17.836 1.00 3.31 H new ATOM 1950 N ALA A 132 -9.708 -0.452 -11.252 1.00 0.90 N ATOM 1951 CA ALA A 132 -8.383 -0.261 -10.678 1.00 0.84 C ATOM 1952 C ALA A 132 -7.846 1.125 -11.050 1.00 0.91 C ATOM 1953 O ALA A 132 -6.949 1.260 -11.876 1.00 1.33 O ATOM 1954 CB ALA A 132 -7.446 -1.405 -11.071 1.00 1.10 C ATOM 0 H ALA A 132 -10.409 -0.714 -10.560 1.00 0.90 H new ATOM 0 HA ALA A 132 -8.448 -0.292 -9.590 1.00 0.84 H new ATOM 0 HB1 ALA A 132 -6.463 -1.238 -10.630 1.00 1.10 H new ATOM 0 HB2 ALA A 132 -7.852 -2.349 -10.707 1.00 1.10 H new ATOM 0 HB3 ALA A 132 -7.354 -1.444 -12.156 1.00 1.10 H new ATOM 1960 N GLN A 133 -8.448 2.152 -10.445 1.00 0.74 N ATOM 1961 CA GLN A 133 -8.217 3.558 -10.766 1.00 0.82 C ATOM 1962 C GLN A 133 -7.810 4.359 -9.525 1.00 0.76 C ATOM 1963 O GLN A 133 -7.001 5.279 -9.630 1.00 0.99 O ATOM 1964 CB GLN A 133 -9.439 4.147 -11.480 1.00 1.01 C ATOM 1965 CG GLN A 133 -10.735 4.040 -10.675 1.00 1.83 C ATOM 1966 CD GLN A 133 -11.935 4.464 -11.511 1.00 2.16 C ATOM 1967 OE1 GLN A 133 -12.138 5.643 -11.770 1.00 2.71 O ATOM 1968 NE2 GLN A 133 -12.742 3.500 -11.946 1.00 2.77 N ATOM 0 H GLN A 133 -9.129 2.022 -9.697 1.00 0.74 H new ATOM 0 HA GLN A 133 -7.375 3.626 -11.455 1.00 0.82 H new ATOM 0 HB2 GLN A 133 -9.247 5.196 -11.704 1.00 1.01 H new ATOM 0 HB3 GLN A 133 -9.572 3.637 -12.434 1.00 1.01 H new ATOM 0 HG2 GLN A 133 -10.871 3.014 -10.332 1.00 1.83 H new ATOM 0 HG3 GLN A 133 -10.667 4.667 -9.786 1.00 1.83 H new ATOM 0 HE21 GLN A 133 -12.546 2.527 -11.713 1.00 2.77 H new ATOM 0 HE22 GLN A 133 -13.557 3.734 -12.513 1.00 2.77 H new ATOM 1977 N GLU A 134 -8.356 4.006 -8.354 1.00 0.72 N ATOM 1978 CA GLU A 134 -8.044 4.633 -7.082 1.00 0.86 C ATOM 1979 C GLU A 134 -7.783 3.523 -6.066 1.00 0.79 C ATOM 1980 O GLU A 134 -8.714 2.817 -5.674 1.00 1.16 O ATOM 1981 CB GLU A 134 -9.224 5.517 -6.662 1.00 1.20 C ATOM 1982 CG GLU A 134 -9.368 6.705 -7.623 1.00 1.21 C ATOM 1983 CD GLU A 134 -10.558 7.593 -7.291 1.00 1.87 C ATOM 1984 OE1 GLU A 134 -11.453 7.121 -6.563 1.00 2.91 O ATOM 1985 OE2 GLU A 134 -10.554 8.727 -7.821 1.00 2.32 O ATOM 0 H GLU A 134 -9.043 3.257 -8.273 1.00 0.72 H new ATOM 0 HA GLU A 134 -7.159 5.266 -7.151 1.00 0.86 H new ATOM 0 HB2 GLU A 134 -10.143 4.931 -6.657 1.00 1.20 H new ATOM 0 HB3 GLU A 134 -9.072 5.879 -5.645 1.00 1.20 H new ATOM 0 HG2 GLU A 134 -8.456 7.302 -7.594 1.00 1.21 H new ATOM 0 HG3 GLU A 134 -9.473 6.331 -8.642 1.00 1.21 H new ATOM 1992 N VAL A 135 -6.520 3.348 -5.666 1.00 0.68 N ATOM 1993 CA VAL A 135 -6.123 2.403 -4.630 1.00 0.79 C ATOM 1994 C VAL A 135 -5.935 3.145 -3.307 1.00 1.03 C ATOM 1995 O VAL A 135 -4.822 3.437 -2.884 1.00 1.90 O ATOM 1996 CB VAL A 135 -4.910 1.552 -5.063 1.00 0.88 C ATOM 1997 CG1 VAL A 135 -5.303 0.670 -6.246 1.00 0.96 C ATOM 1998 CG2 VAL A 135 -3.643 2.332 -5.424 1.00 1.28 C ATOM 0 H VAL A 135 -5.737 3.869 -6.061 1.00 0.68 H new ATOM 0 HA VAL A 135 -6.919 1.675 -4.473 1.00 0.79 H new ATOM 0 HB VAL A 135 -4.649 0.968 -4.180 1.00 0.88 H new ATOM 0 HG11 VAL A 135 -4.447 0.069 -6.552 1.00 0.96 H new ATOM 0 HG12 VAL A 135 -6.122 0.013 -5.954 1.00 0.96 H new ATOM 0 HG13 VAL A 135 -5.621 1.298 -7.078 1.00 0.96 H new ATOM 0 HG21 VAL A 135 -2.856 1.635 -5.713 1.00 1.28 H new ATOM 0 HG22 VAL A 135 -3.854 3.005 -6.255 1.00 1.28 H new ATOM 0 HG23 VAL A 135 -3.315 2.912 -4.562 1.00 1.28 H new ATOM 2008 N ALA A 136 -7.044 3.465 -2.643 1.00 0.65 N ATOM 2009 CA ALA A 136 -6.980 4.178 -1.378 1.00 0.80 C ATOM 2010 C ALA A 136 -6.570 3.195 -0.282 1.00 0.83 C ATOM 2011 O ALA A 136 -6.827 1.994 -0.382 1.00 0.98 O ATOM 2012 CB ALA A 136 -8.331 4.830 -1.072 1.00 0.93 C ATOM 0 H ALA A 136 -7.988 3.242 -2.960 1.00 0.65 H new ATOM 0 HA ALA A 136 -6.239 4.975 -1.431 1.00 0.80 H new ATOM 0 HB1 ALA A 136 -8.272 5.361 -0.122 1.00 0.93 H new ATOM 0 HB2 ALA A 136 -8.584 5.533 -1.866 1.00 0.93 H new ATOM 0 HB3 ALA A 136 -9.101 4.061 -1.010 1.00 0.93 H new ATOM 2018 N GLY A 137 -5.881 3.699 0.738 1.00 0.75 N ATOM 2019 CA GLY A 137 -5.296 2.904 1.799 1.00 0.80 C ATOM 2020 C GLY A 137 -5.128 3.772 3.036 1.00 0.77 C ATOM 2021 O GLY A 137 -5.472 4.954 3.029 1.00 0.90 O ATOM 0 H GLY A 137 -5.713 4.699 0.847 1.00 0.75 H new ATOM 0 HA2 GLY A 137 -5.934 2.049 2.023 1.00 0.80 H new ATOM 0 HA3 GLY A 137 -4.331 2.508 1.484 1.00 0.80 H new ATOM 2025 N SER A 138 -4.596 3.199 4.111 1.00 0.74 N ATOM 2026 CA SER A 138 -4.065 3.973 5.224 1.00 0.71 C ATOM 2027 C SER A 138 -2.911 3.192 5.840 1.00 0.56 C ATOM 2028 O SER A 138 -2.892 1.965 5.745 1.00 0.66 O ATOM 2029 CB SER A 138 -5.167 4.235 6.256 1.00 0.96 C ATOM 2030 OG SER A 138 -6.138 5.120 5.731 1.00 1.67 O ATOM 0 H SER A 138 -4.522 2.189 4.234 1.00 0.74 H new ATOM 0 HA SER A 138 -3.703 4.941 4.877 1.00 0.71 H new ATOM 0 HB2 SER A 138 -5.639 3.294 6.539 1.00 0.96 H new ATOM 0 HB3 SER A 138 -4.732 4.659 7.161 1.00 0.96 H new ATOM 0 HG SER A 138 -6.006 5.215 4.765 1.00 1.67 H new ATOM 2036 N ALA A 139 -1.959 3.892 6.467 1.00 0.73 N ATOM 2037 CA ALA A 139 -0.950 3.262 7.308 1.00 0.76 C ATOM 2038 C ALA A 139 -0.942 3.861 8.706 1.00 0.85 C ATOM 2039 O ALA A 139 -1.341 5.009 8.892 1.00 1.07 O ATOM 2040 CB ALA A 139 0.447 3.369 6.687 1.00 0.90 C ATOM 0 H ALA A 139 -1.871 4.906 6.403 1.00 0.73 H new ATOM 0 HA ALA A 139 -1.214 2.207 7.383 1.00 0.76 H new ATOM 0 HB1 ALA A 139 1.174 2.888 7.342 1.00 0.90 H new ATOM 0 HB2 ALA A 139 0.452 2.876 5.715 1.00 0.90 H new ATOM 0 HB3 ALA A 139 0.710 4.419 6.562 1.00 0.90 H new ATOM 2046 N GLU A 140 -0.434 3.065 9.651 1.00 0.76 N ATOM 2047 CA GLU A 140 0.210 3.532 10.864 1.00 0.77 C ATOM 2048 C GLU A 140 1.633 2.975 10.852 1.00 0.70 C ATOM 2049 O GLU A 140 1.820 1.768 11.003 1.00 0.97 O ATOM 2050 CB GLU A 140 -0.574 3.121 12.119 1.00 0.95 C ATOM 2051 CG GLU A 140 0.265 3.432 13.375 1.00 2.17 C ATOM 2052 CD GLU A 140 -0.532 3.820 14.608 1.00 2.48 C ATOM 2053 OE1 GLU A 140 0.124 4.037 15.653 1.00 3.45 O ATOM 2054 OE2 GLU A 140 -1.754 4.044 14.511 1.00 2.82 O ATOM 0 H GLU A 140 -0.465 2.048 9.583 1.00 0.76 H new ATOM 0 HA GLU A 140 0.237 4.621 10.895 1.00 0.77 H new ATOM 0 HB2 GLU A 140 -1.522 3.657 12.160 1.00 0.95 H new ATOM 0 HB3 GLU A 140 -0.811 2.058 12.081 1.00 0.95 H new ATOM 0 HG2 GLU A 140 0.869 2.557 13.614 1.00 2.17 H new ATOM 0 HG3 GLU A 140 0.956 4.242 13.139 1.00 2.17 H new ATOM 2061 N VAL A 141 2.629 3.847 10.668 1.00 0.64 N ATOM 2062 CA VAL A 141 4.040 3.518 10.812 1.00 0.66 C ATOM 2063 C VAL A 141 4.576 4.349 11.969 1.00 0.69 C ATOM 2064 O VAL A 141 4.240 5.522 12.083 1.00 1.05 O ATOM 2065 CB VAL A 141 4.793 3.809 9.504 1.00 0.76 C ATOM 2066 CG1 VAL A 141 6.227 3.269 9.588 1.00 1.65 C ATOM 2067 CG2 VAL A 141 4.048 3.191 8.314 1.00 1.90 C ATOM 0 H VAL A 141 2.467 4.820 10.409 1.00 0.64 H new ATOM 0 HA VAL A 141 4.180 2.458 11.021 1.00 0.66 H new ATOM 0 HB VAL A 141 4.840 4.888 9.356 1.00 0.76 H new ATOM 0 HG11 VAL A 141 6.751 3.481 8.656 1.00 1.65 H new ATOM 0 HG12 VAL A 141 6.749 3.750 10.415 1.00 1.65 H new ATOM 0 HG13 VAL A 141 6.201 2.192 9.753 1.00 1.65 H new ATOM 0 HG21 VAL A 141 4.592 3.404 7.394 1.00 1.90 H new ATOM 0 HG22 VAL A 141 3.975 2.112 8.451 1.00 1.90 H new ATOM 0 HG23 VAL A 141 3.047 3.617 8.251 1.00 1.90 H new ATOM 2077 N LYS A 142 5.362 3.764 12.870 1.00 0.67 N ATOM 2078 CA LYS A 142 5.770 4.467 14.073 1.00 0.78 C ATOM 2079 C LYS A 142 7.190 4.082 14.449 1.00 0.91 C ATOM 2080 O LYS A 142 7.486 2.920 14.718 1.00 1.13 O ATOM 2081 CB LYS A 142 4.762 4.201 15.194 1.00 0.91 C ATOM 2082 CG LYS A 142 4.827 2.754 15.699 1.00 1.01 C ATOM 2083 CD LYS A 142 3.447 2.265 16.161 1.00 1.30 C ATOM 2084 CE LYS A 142 2.893 3.077 17.343 1.00 2.48 C ATOM 2085 NZ LYS A 142 1.455 2.812 17.561 1.00 2.93 N ATOM 0 H LYS A 142 5.724 2.814 12.787 1.00 0.67 H new ATOM 0 HA LYS A 142 5.775 5.542 13.895 1.00 0.78 H new ATOM 0 HB2 LYS A 142 4.954 4.882 16.023 1.00 0.91 H new ATOM 0 HB3 LYS A 142 3.756 4.414 14.834 1.00 0.91 H new ATOM 0 HG2 LYS A 142 5.199 2.105 14.906 1.00 1.01 H new ATOM 0 HG3 LYS A 142 5.535 2.686 16.525 1.00 1.01 H new ATOM 0 HD2 LYS A 142 2.748 2.323 15.327 1.00 1.30 H new ATOM 0 HD3 LYS A 142 3.515 1.215 16.447 1.00 1.30 H new ATOM 0 HE2 LYS A 142 3.450 2.830 18.247 1.00 2.48 H new ATOM 0 HE3 LYS A 142 3.043 4.140 17.156 1.00 2.48 H new ATOM 0 HZ1 LYS A 142 1.263 2.759 18.582 1.00 2.93 H new ATOM 0 HZ2 LYS A 142 0.893 3.580 17.142 1.00 2.93 H new ATOM 0 HZ3 LYS A 142 1.196 1.910 17.113 1.00 2.93 H new ATOM 2099 N THR A 143 8.056 5.082 14.514 1.00 1.03 N ATOM 2100 CA THR A 143 9.395 4.908 15.044 1.00 1.23 C ATOM 2101 C THR A 143 9.739 6.226 15.730 1.00 1.21 C ATOM 2102 O THR A 143 8.936 7.160 15.669 1.00 1.09 O ATOM 2103 CB THR A 143 10.384 4.534 13.918 1.00 1.40 C ATOM 2104 OG1 THR A 143 9.702 4.035 12.784 1.00 1.94 O ATOM 2105 CG2 THR A 143 11.350 3.448 14.404 1.00 2.59 C ATOM 0 H THR A 143 7.850 6.031 14.202 1.00 1.03 H new ATOM 0 HA THR A 143 9.458 4.087 15.758 1.00 1.23 H new ATOM 0 HB THR A 143 10.928 5.439 13.648 1.00 1.40 H new ATOM 0 HG1 THR A 143 10.259 4.157 11.987 1.00 1.94 H new ATOM 0 HG21 THR A 143 12.043 3.192 13.602 1.00 2.59 H new ATOM 0 HG22 THR A 143 11.910 3.817 15.263 1.00 2.59 H new ATOM 0 HG23 THR A 143 10.785 2.561 14.693 1.00 2.59 H new ATOM 2113 N VAL A 144 10.940 6.328 16.310 1.00 1.39 N ATOM 2114 CA VAL A 144 11.475 7.552 16.909 1.00 1.49 C ATOM 2115 C VAL A 144 11.214 8.797 16.048 1.00 1.53 C ATOM 2116 O VAL A 144 11.065 9.896 16.575 1.00 1.64 O ATOM 2117 CB VAL A 144 12.976 7.381 17.209 1.00 1.68 C ATOM 2118 CG1 VAL A 144 13.202 6.306 18.280 1.00 2.68 C ATOM 2119 CG2 VAL A 144 13.803 7.040 15.960 1.00 2.31 C ATOM 0 H VAL A 144 11.583 5.539 16.377 1.00 1.39 H new ATOM 0 HA VAL A 144 10.944 7.717 17.846 1.00 1.49 H new ATOM 0 HB VAL A 144 13.320 8.347 17.578 1.00 1.68 H new ATOM 0 HG11 VAL A 144 14.270 6.204 18.474 1.00 2.68 H new ATOM 0 HG12 VAL A 144 12.692 6.595 19.199 1.00 2.68 H new ATOM 0 HG13 VAL A 144 12.805 5.354 17.929 1.00 2.68 H new ATOM 0 HG21 VAL A 144 14.852 6.932 16.236 1.00 2.31 H new ATOM 0 HG22 VAL A 144 13.443 6.105 15.529 1.00 2.31 H new ATOM 0 HG23 VAL A 144 13.701 7.840 15.227 1.00 2.31 H new ATOM 2129 N ASN A 145 11.115 8.609 14.730 1.00 1.52 N ATOM 2130 CA ASN A 145 10.593 9.604 13.807 1.00 1.57 C ATOM 2131 C ASN A 145 10.034 8.857 12.595 1.00 1.33 C ATOM 2132 O ASN A 145 10.486 9.027 11.462 1.00 1.58 O ATOM 2133 CB ASN A 145 11.629 10.698 13.496 1.00 2.23 C ATOM 2134 CG ASN A 145 12.992 10.148 13.100 1.00 1.88 C ATOM 2135 OD1 ASN A 145 13.942 10.191 13.875 1.00 2.84 O ATOM 2136 ND2 ASN A 145 13.095 9.619 11.893 1.00 2.19 N ATOM 0 H ASN A 145 11.402 7.744 14.272 1.00 1.52 H new ATOM 0 HA ASN A 145 9.774 10.171 14.249 1.00 1.57 H new ATOM 0 HB2 ASN A 145 11.251 11.326 12.689 1.00 2.23 H new ATOM 0 HB3 ASN A 145 11.744 11.338 14.371 1.00 2.23 H new ATOM 0 HD21 ASN A 145 13.985 9.230 11.581 1.00 2.19 H new ATOM 0 HD22 ASN A 145 12.285 9.600 11.274 1.00 2.19 H new ATOM 2143 N GLY A 146 9.058 7.985 12.864 1.00 1.03 N ATOM 2144 CA GLY A 146 8.273 7.280 11.858 1.00 1.04 C ATOM 2145 C GLY A 146 6.858 7.844 11.878 1.00 0.74 C ATOM 2146 O GLY A 146 6.307 8.064 12.956 1.00 0.77 O ATOM 0 H GLY A 146 8.788 7.746 13.818 1.00 1.03 H new ATOM 0 HA2 GLY A 146 8.719 7.406 10.871 1.00 1.04 H new ATOM 0 HA3 GLY A 146 8.259 6.210 12.067 1.00 1.04 H new ATOM 2150 N ILE A 147 6.306 8.134 10.698 1.00 0.66 N ATOM 2151 CA ILE A 147 5.085 8.911 10.550 1.00 0.69 C ATOM 2152 C ILE A 147 3.851 8.008 10.589 1.00 0.78 C ATOM 2153 O ILE A 147 3.690 7.122 9.755 1.00 1.33 O ATOM 2154 CB ILE A 147 5.110 9.763 9.260 1.00 0.86 C ATOM 2155 CG1 ILE A 147 5.622 8.986 8.037 1.00 1.40 C ATOM 2156 CG2 ILE A 147 5.849 11.088 9.492 1.00 1.47 C ATOM 2157 CD1 ILE A 147 7.111 9.170 7.733 1.00 1.20 C ATOM 0 H ILE A 147 6.704 7.829 9.810 1.00 0.66 H new ATOM 0 HA ILE A 147 5.027 9.597 11.395 1.00 0.69 H new ATOM 0 HB ILE A 147 4.078 10.013 9.015 1.00 0.86 H new ATOM 0 HG12 ILE A 147 5.426 7.925 8.191 1.00 1.40 H new ATOM 0 HG13 ILE A 147 5.047 9.293 7.163 1.00 1.40 H new ATOM 0 HG21 ILE A 147 5.853 11.669 8.570 1.00 1.47 H new ATOM 0 HG22 ILE A 147 5.344 11.654 10.275 1.00 1.47 H new ATOM 0 HG23 ILE A 147 6.876 10.884 9.796 1.00 1.47 H new ATOM 0 HD11 ILE A 147 7.378 8.583 6.854 1.00 1.20 H new ATOM 0 HD12 ILE A 147 7.316 10.223 7.542 1.00 1.20 H new ATOM 0 HD13 ILE A 147 7.701 8.834 8.586 1.00 1.20 H new ATOM 2169 N ARG A 148 2.970 8.262 11.557 1.00 0.68 N ATOM 2170 CA ARG A 148 1.784 7.453 11.780 1.00 0.70 C ATOM 2171 C ARG A 148 0.806 7.577 10.620 1.00 0.76 C ATOM 2172 O ARG A 148 0.726 6.680 9.790 1.00 1.23 O ATOM 2173 CB ARG A 148 1.125 7.778 13.125 1.00 0.90 C ATOM 2174 CG ARG A 148 1.940 7.221 14.303 1.00 1.68 C ATOM 2175 CD ARG A 148 1.229 7.403 15.654 1.00 1.96 C ATOM 2176 NE ARG A 148 -0.096 6.750 15.663 1.00 1.87 N ATOM 2177 CZ ARG A 148 -1.256 7.320 15.292 1.00 2.09 C ATOM 2178 NH1 ARG A 148 -1.351 8.646 15.181 1.00 2.73 N ATOM 2179 NH2 ARG A 148 -2.319 6.581 14.972 1.00 2.45 N ATOM 0 H ARG A 148 3.065 9.041 12.209 1.00 0.68 H new ATOM 0 HA ARG A 148 2.098 6.410 11.826 1.00 0.70 H new ATOM 0 HB2 ARG A 148 1.024 8.858 13.230 1.00 0.90 H new ATOM 0 HB3 ARG A 148 0.119 7.360 13.148 1.00 0.90 H new ATOM 0 HG2 ARG A 148 2.132 6.161 14.138 1.00 1.68 H new ATOM 0 HG3 ARG A 148 2.909 7.719 14.337 1.00 1.68 H new ATOM 0 HD2 ARG A 148 1.846 6.986 16.450 1.00 1.96 H new ATOM 0 HD3 ARG A 148 1.113 8.466 15.864 1.00 1.96 H new ATOM 0 HE ARG A 148 -0.134 5.781 15.979 1.00 1.87 H new ATOM 0 HH11 ARG A 148 -0.541 9.234 15.378 1.00 2.73 H new ATOM 0 HH12 ARG A 148 -2.234 9.072 14.899 1.00 2.73 H new ATOM 0 HH21 ARG A 148 -2.261 5.563 15.006 1.00 2.45 H new ATOM 0 HH22 ARG A 148 -3.190 7.034 14.693 1.00 2.45 H new ATOM 2193 N HIS A 149 0.026 8.658 10.586 1.00 0.63 N ATOM 2194 CA HIS A 149 -1.078 8.791 9.649 1.00 0.75 C ATOM 2195 C HIS A 149 -0.517 9.050 8.253 1.00 0.75 C ATOM 2196 O HIS A 149 -0.438 10.203 7.831 1.00 0.99 O ATOM 2197 CB HIS A 149 -2.013 9.928 10.094 1.00 0.93 C ATOM 2198 CG HIS A 149 -2.685 9.743 11.437 1.00 1.01 C ATOM 2199 ND1 HIS A 149 -3.432 10.700 12.086 1.00 2.02 N ATOM 2200 CD2 HIS A 149 -2.678 8.623 12.229 1.00 1.31 C ATOM 2201 CE1 HIS A 149 -3.851 10.173 13.249 1.00 1.88 C ATOM 2202 NE2 HIS A 149 -3.395 8.916 13.399 1.00 1.10 N ATOM 0 H HIS A 149 0.145 9.459 11.206 1.00 0.63 H new ATOM 0 HA HIS A 149 -1.662 7.871 9.627 1.00 0.75 H new ATOM 0 HB2 HIS A 149 -1.440 10.855 10.121 1.00 0.93 H new ATOM 0 HB3 HIS A 149 -2.787 10.054 9.336 1.00 0.93 H new ATOM 0 HD1 HIS A 149 -3.632 11.640 11.745 1.00 2.02 H new ATOM 0 HD2 HIS A 149 -2.204 7.682 11.993 1.00 1.31 H new ATOM 0 HE1 HIS A 149 -4.471 10.689 13.967 1.00 1.88 H new ATOM 2210 N ILE A 150 -0.103 7.994 7.552 1.00 0.64 N ATOM 2211 CA ILE A 150 0.305 8.112 6.162 1.00 0.61 C ATOM 2212 C ILE A 150 -0.969 8.159 5.320 1.00 0.64 C ATOM 2213 O ILE A 150 -1.754 7.206 5.306 1.00 0.84 O ATOM 2214 CB ILE A 150 1.239 6.965 5.744 1.00 0.73 C ATOM 2215 CG1 ILE A 150 2.430 6.862 6.716 1.00 1.07 C ATOM 2216 CG2 ILE A 150 1.736 7.181 4.310 1.00 1.11 C ATOM 2217 CD1 ILE A 150 3.564 5.957 6.223 1.00 1.26 C ATOM 0 H ILE A 150 -0.043 7.048 7.929 1.00 0.64 H new ATOM 0 HA ILE A 150 0.884 9.023 6.010 1.00 0.61 H new ATOM 0 HB ILE A 150 0.681 6.030 5.781 1.00 0.73 H new ATOM 0 HG12 ILE A 150 2.828 7.861 6.893 1.00 1.07 H new ATOM 0 HG13 ILE A 150 2.071 6.487 7.675 1.00 1.07 H new ATOM 0 HG21 ILE A 150 2.397 6.362 4.027 1.00 1.11 H new ATOM 0 HG22 ILE A 150 0.884 7.212 3.631 1.00 1.11 H new ATOM 0 HG23 ILE A 150 2.281 8.123 4.252 1.00 1.11 H new ATOM 0 HD11 ILE A 150 4.363 5.939 6.964 1.00 1.26 H new ATOM 0 HD12 ILE A 150 3.184 4.946 6.074 1.00 1.26 H new ATOM 0 HD13 ILE A 150 3.953 6.342 5.280 1.00 1.26 H new ATOM 2229 N GLY A 151 -1.170 9.269 4.614 1.00 0.64 N ATOM 2230 CA GLY A 151 -2.317 9.481 3.760 1.00 0.79 C ATOM 2231 C GLY A 151 -2.086 8.717 2.466 1.00 0.61 C ATOM 2232 O GLY A 151 -1.669 9.283 1.460 1.00 1.12 O ATOM 0 H GLY A 151 -0.522 10.057 4.625 1.00 0.64 H new ATOM 0 HA2 GLY A 151 -3.227 9.134 4.250 1.00 0.79 H new ATOM 0 HA3 GLY A 151 -2.450 10.544 3.557 1.00 0.79 H new ATOM 2236 N LEU A 152 -2.367 7.415 2.490 1.00 0.65 N ATOM 2237 CA LEU A 152 -2.197 6.549 1.334 1.00 0.79 C ATOM 2238 C LEU A 152 -3.375 6.804 0.385 1.00 0.76 C ATOM 2239 O LEU A 152 -4.316 6.015 0.277 1.00 0.91 O ATOM 2240 CB LEU A 152 -2.073 5.098 1.826 1.00 1.18 C ATOM 2241 CG LEU A 152 -1.516 4.049 0.849 1.00 0.82 C ATOM 2242 CD1 LEU A 152 -2.221 3.997 -0.511 1.00 0.74 C ATOM 2243 CD2 LEU A 152 -0.020 4.246 0.608 1.00 0.77 C ATOM 0 H LEU A 152 -2.720 6.933 3.317 1.00 0.65 H new ATOM 0 HA LEU A 152 -1.286 6.755 0.772 1.00 0.79 H new ATOM 0 HB2 LEU A 152 -1.438 5.099 2.712 1.00 1.18 H new ATOM 0 HB3 LEU A 152 -3.062 4.767 2.143 1.00 1.18 H new ATOM 0 HG LEU A 152 -1.708 3.100 1.349 1.00 0.82 H new ATOM 0 HD11 LEU A 152 -1.759 3.228 -1.131 1.00 0.74 H new ATOM 0 HD12 LEU A 152 -3.275 3.761 -0.366 1.00 0.74 H new ATOM 0 HD13 LEU A 152 -2.130 4.964 -1.005 1.00 0.74 H new ATOM 0 HD21 LEU A 152 0.340 3.487 -0.087 1.00 0.77 H new ATOM 0 HD22 LEU A 152 0.153 5.236 0.186 1.00 0.77 H new ATOM 0 HD23 LEU A 152 0.516 4.155 1.553 1.00 0.77 H new ATOM 2255 N ALA A 153 -3.307 7.950 -0.294 1.00 1.16 N ATOM 2256 CA ALA A 153 -4.158 8.297 -1.417 1.00 1.22 C ATOM 2257 C ALA A 153 -3.493 7.783 -2.692 1.00 1.17 C ATOM 2258 O ALA A 153 -2.276 7.584 -2.720 1.00 1.23 O ATOM 2259 CB ALA A 153 -4.337 9.817 -1.470 1.00 1.32 C ATOM 0 H ALA A 153 -2.634 8.681 -0.064 1.00 1.16 H new ATOM 0 HA ALA A 153 -5.144 7.843 -1.313 1.00 1.22 H new ATOM 0 HB1 ALA A 153 -4.976 10.079 -2.313 1.00 1.32 H new ATOM 0 HB2 ALA A 153 -4.798 10.162 -0.544 1.00 1.32 H new ATOM 0 HB3 ALA A 153 -3.364 10.294 -1.590 1.00 1.32 H new ATOM 2265 N ALA A 154 -4.271 7.562 -3.752 1.00 1.27 N ATOM 2266 CA ALA A 154 -3.732 7.044 -4.994 1.00 1.21 C ATOM 2267 C ALA A 154 -4.602 7.435 -6.173 1.00 1.12 C ATOM 2268 O ALA A 154 -5.783 7.727 -5.998 1.00 1.24 O ATOM 2269 CB ALA A 154 -3.644 5.526 -4.914 1.00 1.48 C ATOM 0 H ALA A 154 -5.276 7.736 -3.768 1.00 1.27 H new ATOM 0 HA ALA A 154 -2.740 7.471 -5.141 1.00 1.21 H new ATOM 0 HB1 ALA A 154 -3.239 5.135 -5.847 1.00 1.48 H new ATOM 0 HB2 ALA A 154 -2.991 5.242 -4.088 1.00 1.48 H new ATOM 0 HB3 ALA A 154 -4.639 5.112 -4.749 1.00 1.48 H new ATOM 2275 N LYS A 155 -4.011 7.412 -7.369 1.00 1.06 N ATOM 2276 CA LYS A 155 -4.731 7.539 -8.619 1.00 1.07 C ATOM 2277 C LYS A 155 -3.863 6.913 -9.705 1.00 1.21 C ATOM 2278 O LYS A 155 -2.652 7.124 -9.696 1.00 1.54 O ATOM 2279 CB LYS A 155 -5.018 9.010 -8.944 1.00 1.24 C ATOM 2280 CG LYS A 155 -6.059 9.099 -10.071 1.00 1.76 C ATOM 2281 CD LYS A 155 -7.375 9.661 -9.516 1.00 2.58 C ATOM 2282 CE LYS A 155 -8.516 9.525 -10.534 1.00 3.59 C ATOM 2283 NZ LYS A 155 -9.797 10.012 -9.983 1.00 4.12 N ATOM 0 H LYS A 155 -3.004 7.303 -7.489 1.00 1.06 H new ATOM 0 HA LYS A 155 -5.695 7.034 -8.552 1.00 1.07 H new ATOM 0 HB2 LYS A 155 -5.385 9.524 -8.055 1.00 1.24 H new ATOM 0 HB3 LYS A 155 -4.098 9.512 -9.245 1.00 1.24 H new ATOM 0 HG2 LYS A 155 -5.688 9.739 -10.872 1.00 1.76 H new ATOM 0 HG3 LYS A 155 -6.227 8.112 -10.503 1.00 1.76 H new ATOM 0 HD2 LYS A 155 -7.639 9.135 -8.599 1.00 2.58 H new ATOM 0 HD3 LYS A 155 -7.242 10.711 -9.254 1.00 2.58 H new ATOM 0 HE2 LYS A 155 -8.270 10.087 -11.435 1.00 3.59 H new ATOM 0 HE3 LYS A 155 -8.619 8.481 -10.828 1.00 3.59 H new ATOM 0 HZ1 LYS A 155 -10.479 10.145 -10.756 1.00 4.12 H new ATOM 0 HZ2 LYS A 155 -10.171 9.316 -9.307 1.00 4.12 H new ATOM 0 HZ3 LYS A 155 -9.644 10.918 -9.497 1.00 4.12 H new ATOM 2297 N GLN A 156 -4.457 6.170 -10.636 1.00 1.18 N ATOM 2298 CA GLN A 156 -3.749 5.601 -11.759 1.00 1.42 C ATOM 2299 C GLN A 156 -4.615 5.677 -13.007 1.00 2.10 C ATOM 2300 O GLN A 156 -4.002 5.614 -14.096 1.00 2.67 O ATOM 2301 CB GLN A 156 -3.368 4.162 -11.425 1.00 2.14 C ATOM 2302 CG GLN A 156 -4.597 3.290 -11.136 1.00 2.11 C ATOM 2303 CD GLN A 156 -4.374 2.248 -10.046 1.00 2.96 C ATOM 2304 OE1 GLN A 156 -4.436 1.042 -10.263 1.00 4.24 O ATOM 2305 NE2 GLN A 156 -4.136 2.720 -8.826 1.00 3.20 N ATOM 0 H GLN A 156 -5.453 5.949 -10.624 1.00 1.18 H new ATOM 0 HA GLN A 156 -2.837 6.164 -11.957 1.00 1.42 H new ATOM 0 HB2 GLN A 156 -2.808 3.734 -12.256 1.00 2.14 H new ATOM 0 HB3 GLN A 156 -2.707 4.155 -10.558 1.00 2.14 H new ATOM 0 HG2 GLN A 156 -5.427 3.934 -10.845 1.00 2.11 H new ATOM 0 HG3 GLN A 156 -4.894 2.783 -12.054 1.00 2.11 H new ATOM 0 HE21 GLN A 156 -4.089 3.727 -8.669 1.00 3.20 H new ATOM 0 HE22 GLN A 156 -4.001 2.075 -8.047 1.00 3.20 H new TER 2314 GLN A 156