USER MOD reduce.3.24.130724 H: found=0, std=0, add=1209, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1210 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 115 TYR OH : rot 18:sc= 0.225 USER MOD Set 1.2: A 153 THR OG1 : rot -75:sc= 1.33 USER MOD Set 2.1: A 103 THR OG1 : rot -170:sc= 0.206 USER MOD Set 2.2: A 121 THR OG1 : rot -101:sc= 0.519 USER MOD Set 3.1: A 54 SER OG : rot 180:sc= 0.00729 USER MOD Set 3.2: A 57 ASN : amide:sc= -0.186 K(o=-0.18,f=-11!) USER MOD Set 4.1: A 49 HIS : no HD1:sc= -0.304 X(o=-0.3,f=-0.004) USER MOD Set 4.2: A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 32:sc= 0.164 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot -29:sc= -0.0769 USER MOD Single : A 25 LYS NZ :NH3+ -159:sc= 1.26 (180deg=1.09) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0152 USER MOD Single : A 33 LYS NZ :NH3+ 159:sc= 1.67 (180deg=1.11) USER MOD Single : A 35 SER OG : rot -17:sc= 1.07 USER MOD Single : A 38 LYS NZ :NH3+ 177:sc= 2.36 (180deg=2.24) USER MOD Single : A 40 HIS : no HD1:sc= 0 X(o=0,f=-0.003) USER MOD Single : A 41 HIS : no HD1:sc= -1.59! K(o=-1.6!,f=0.5) USER MOD Single : A 42 MET CE :methyl 159:sc= -0.158 (180deg=-0.83) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 HIS : no HE2:sc= 0.646 K(o=0.65,f=-5.4!) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 61 CYS SG : rot -46:sc= -1.65! USER MOD Single : A 64 HIS : no HD1:sc= 0.745 K(o=0.75,f=-4.8!) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot -101:sc= 0.891 USER MOD Single : A 78 ASN : amide:sc= -1.26 K(o=-1.3,f=-2.4!) USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 HIS : no HD1:sc= -0.0384 X(o=-0.038,f=0) USER MOD Single : A 86 LYS NZ :NH3+ -160:sc= 1.22 (180deg=0.995) USER MOD Single : A 89 LYS NZ :NH3+ 163:sc= -0.0714 (180deg=-0.366) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 ASN : amide:sc= -1.49! C(o=-1.5!,f=-4.2!) USER MOD Single : A 112 MET CE :methyl 138:sc= -2.73! (180deg=-5.76!) USER MOD Single : A 113 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0685) USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.132 X(o=-0.13,f=-0.38) USER MOD Single : A 125 THR OG1 : rot 180:sc= -1.07 USER MOD Single : A 127 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0334) USER MOD Single : A 133 SER OG : rot 96:sc= 0.742 USER MOD Single : A 136 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 138 HIS : no HE2:sc= 1.14 K(o=1.1,f=-4.5!) USER MOD Single : A 141 TYR OH : rot 130:sc= -0.0109 USER MOD Single : A 143 LYS NZ :NH3+ -164:sc= -0.0629 (180deg=-0.338) USER MOD Single : A 145 SER OG : rot 180:sc= -0.0274 USER MOD Single : A 150 HIS : no HD1:sc= -0.225 K(o=-0.23,f=-1) USER MOD Single : A 156 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 158 CYS SG : rot -6:sc= 0.0726 USER MOD Single : A 162 SER OG : rot 61:sc= 0.87 USER MOD Single : A 163 LYS NZ :NH3+ -163:sc= -0.0594 (180deg=-0.36) USER MOD Single : A 168 HIS : no HE2:sc= -0.248 K(o=0.35,f=-7.8!) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 17 -3.905 -30.853 -0.319 1.00 14.02 N ATOM 2 CA THR A 17 -3.253 -29.763 0.383 1.00 61.15 C ATOM 3 C THR A 17 -4.125 -29.301 1.541 1.00 11.22 C ATOM 4 O THR A 17 -5.158 -28.655 1.346 1.00 35.31 O ATOM 5 CB THR A 17 -2.980 -28.580 -0.555 1.00 24.35 C ATOM 6 OG1 THR A 17 -2.284 -29.054 -1.718 1.00 61.51 O ATOM 7 CG2 THR A 17 -2.121 -27.525 0.138 1.00 15.22 C ATOM 0 HA THR A 17 -2.298 -30.129 0.761 1.00 61.15 H new ATOM 0 HB THR A 17 -3.933 -28.130 -0.835 1.00 24.35 H new ATOM 0 HG1 THR A 17 -2.565 -29.972 -1.916 1.00 61.51 H new ATOM 0 HG21 THR A 17 -1.940 -26.696 -0.546 1.00 15.22 H new ATOM 0 HG22 THR A 17 -2.640 -27.158 1.024 1.00 15.22 H new ATOM 0 HG23 THR A 17 -1.169 -27.967 0.432 1.00 15.22 H new ATOM 15 N GLU A 18 -3.733 -29.674 2.716 1.00 23.22 N ATOM 16 CA GLU A 18 -4.481 -29.367 3.900 1.00 72.33 C ATOM 17 C GLU A 18 -4.236 -27.970 4.378 1.00 52.43 C ATOM 18 O GLU A 18 -3.086 -27.549 4.557 1.00 34.45 O ATOM 19 CB GLU A 18 -4.160 -30.331 5.015 1.00 23.23 C ATOM 20 CG GLU A 18 -4.469 -31.781 4.700 1.00 63.52 C ATOM 21 CD GLU A 18 -4.151 -32.696 5.841 1.00 54.31 C ATOM 22 OE1 GLU A 18 -4.986 -32.817 6.769 1.00 63.22 O ATOM 23 OE2 GLU A 18 -3.069 -33.317 5.832 1.00 53.02 O ATOM 0 H GLU A 18 -2.879 -30.205 2.886 1.00 23.22 H new ATOM 0 HA GLU A 18 -5.532 -29.461 3.628 1.00 72.33 H new ATOM 0 HB2 GLU A 18 -3.102 -30.243 5.261 1.00 23.23 H new ATOM 0 HB3 GLU A 18 -4.719 -30.038 5.904 1.00 23.23 H new ATOM 0 HG2 GLU A 18 -5.524 -31.877 4.445 1.00 63.52 H new ATOM 0 HG3 GLU A 18 -3.900 -32.088 3.823 1.00 63.52 H new ATOM 30 N ALA A 19 -5.303 -27.259 4.574 1.00 35.45 N ATOM 31 CA ALA A 19 -5.274 -25.955 5.143 1.00 5.43 C ATOM 32 C ALA A 19 -6.591 -25.719 5.859 1.00 10.23 C ATOM 33 O ALA A 19 -7.600 -25.382 5.244 1.00 14.01 O ATOM 34 CB ALA A 19 -5.012 -24.914 4.081 1.00 24.03 C ATOM 0 H ALA A 19 -6.241 -27.582 4.335 1.00 35.45 H new ATOM 0 HA ALA A 19 -4.459 -25.874 5.863 1.00 5.43 H new ATOM 0 HB1 ALA A 19 -4.994 -23.925 4.538 1.00 24.03 H new ATOM 0 HB2 ALA A 19 -4.051 -25.112 3.607 1.00 24.03 H new ATOM 0 HB3 ALA A 19 -5.802 -24.953 3.331 1.00 24.03 H new ATOM 40 N SER A 20 -6.587 -25.950 7.150 1.00 71.24 N ATOM 41 CA SER A 20 -7.789 -25.889 7.959 1.00 1.11 C ATOM 42 C SER A 20 -8.430 -24.498 7.956 1.00 64.44 C ATOM 43 O SER A 20 -9.634 -24.364 7.743 1.00 1.05 O ATOM 44 CB SER A 20 -7.472 -26.356 9.372 1.00 44.22 C ATOM 45 OG SER A 20 -6.932 -27.671 9.336 1.00 62.05 O ATOM 0 H SER A 20 -5.746 -26.187 7.676 1.00 71.24 H new ATOM 0 HA SER A 20 -8.529 -26.557 7.518 1.00 1.11 H new ATOM 0 HB2 SER A 20 -6.761 -25.674 9.839 1.00 44.22 H new ATOM 0 HB3 SER A 20 -8.376 -26.341 9.981 1.00 44.22 H new ATOM 0 HG SER A 20 -6.728 -27.966 10.248 1.00 62.05 H new ATOM 51 N SER A 21 -7.635 -23.480 8.181 1.00 20.40 N ATOM 52 CA SER A 21 -8.146 -22.138 8.191 1.00 33.15 C ATOM 53 C SER A 21 -8.062 -21.510 6.790 1.00 71.33 C ATOM 54 O SER A 21 -8.574 -20.415 6.572 1.00 4.42 O ATOM 55 CB SER A 21 -7.395 -21.286 9.236 1.00 65.24 C ATOM 56 OG SER A 21 -7.962 -19.981 9.372 1.00 50.01 O ATOM 0 H SER A 21 -6.634 -23.559 8.359 1.00 20.40 H new ATOM 0 HA SER A 21 -9.198 -22.168 8.474 1.00 33.15 H new ATOM 0 HB2 SER A 21 -7.417 -21.793 10.201 1.00 65.24 H new ATOM 0 HB3 SER A 21 -6.348 -21.198 8.947 1.00 65.24 H new ATOM 0 HG SER A 21 -8.369 -19.711 8.522 1.00 50.01 H new ATOM 62 N LEU A 22 -7.433 -22.238 5.838 1.00 51.41 N ATOM 63 CA LEU A 22 -7.173 -21.741 4.473 1.00 32.35 C ATOM 64 C LEU A 22 -6.360 -20.445 4.464 1.00 54.34 C ATOM 65 O LEU A 22 -6.416 -19.664 3.511 1.00 43.41 O ATOM 66 CB LEU A 22 -8.474 -21.602 3.699 1.00 40.43 C ATOM 67 CG LEU A 22 -9.160 -22.916 3.347 1.00 61.32 C ATOM 68 CD1 LEU A 22 -10.520 -22.646 2.804 1.00 40.12 C ATOM 69 CD2 LEU A 22 -8.341 -23.687 2.313 1.00 12.22 C ATOM 0 H LEU A 22 -7.093 -23.186 5.998 1.00 51.41 H new ATOM 0 HA LEU A 22 -6.555 -22.483 3.967 1.00 32.35 H new ATOM 0 HB2 LEU A 22 -9.164 -20.995 4.285 1.00 40.43 H new ATOM 0 HB3 LEU A 22 -8.274 -21.056 2.777 1.00 40.43 H new ATOM 0 HG LEU A 22 -9.242 -23.518 4.252 1.00 61.32 H new ATOM 0 HD11 LEU A 22 -11.006 -23.589 2.554 1.00 40.12 H new ATOM 0 HD12 LEU A 22 -11.113 -22.120 3.552 1.00 40.12 H new ATOM 0 HD13 LEU A 22 -10.438 -22.031 1.908 1.00 40.12 H new ATOM 0 HD21 LEU A 22 -8.846 -24.623 2.073 1.00 12.22 H new ATOM 0 HD22 LEU A 22 -8.240 -23.087 1.408 1.00 12.22 H new ATOM 0 HD23 LEU A 22 -7.352 -23.902 2.719 1.00 12.22 H new ATOM 81 N VAL A 23 -5.559 -20.258 5.491 1.00 0.34 N ATOM 82 CA VAL A 23 -4.723 -19.089 5.589 1.00 14.43 C ATOM 83 C VAL A 23 -3.407 -19.321 4.866 1.00 33.31 C ATOM 84 O VAL A 23 -2.752 -20.364 5.031 1.00 63.23 O ATOM 85 CB VAL A 23 -4.466 -18.667 7.072 1.00 14.35 C ATOM 86 CG1 VAL A 23 -3.503 -17.481 7.157 1.00 2.13 C ATOM 87 CG2 VAL A 23 -5.772 -18.300 7.737 1.00 45.41 C ATOM 0 H VAL A 23 -5.472 -20.907 6.273 1.00 0.34 H new ATOM 0 HA VAL A 23 -5.256 -18.268 5.110 1.00 14.43 H new ATOM 0 HB VAL A 23 -4.013 -19.515 7.586 1.00 14.35 H new ATOM 0 HG11 VAL A 23 -3.346 -17.214 8.202 1.00 2.13 H new ATOM 0 HG12 VAL A 23 -2.549 -17.754 6.705 1.00 2.13 H new ATOM 0 HG13 VAL A 23 -3.926 -16.630 6.624 1.00 2.13 H new ATOM 0 HG21 VAL A 23 -5.585 -18.007 8.770 1.00 45.41 H new ATOM 0 HG22 VAL A 23 -6.232 -17.469 7.202 1.00 45.41 H new ATOM 0 HG23 VAL A 23 -6.443 -19.159 7.719 1.00 45.41 H new ATOM 97 N GLY A 24 -3.048 -18.374 4.066 1.00 32.44 N ATOM 98 CA GLY A 24 -1.826 -18.414 3.344 1.00 72.10 C ATOM 99 C GLY A 24 -1.130 -17.110 3.506 1.00 24.42 C ATOM 100 O GLY A 24 -1.782 -16.089 3.734 1.00 15.23 O ATOM 0 H GLY A 24 -3.606 -17.538 3.894 1.00 32.44 H new ATOM 0 HA2 GLY A 24 -1.197 -19.225 3.711 1.00 72.10 H new ATOM 0 HA3 GLY A 24 -2.017 -18.611 2.289 1.00 72.10 H new ATOM 104 N LYS A 25 0.149 -17.110 3.407 1.00 45.24 N ATOM 105 CA LYS A 25 0.894 -15.911 3.590 1.00 11.44 C ATOM 106 C LYS A 25 2.100 -15.863 2.690 1.00 52.12 C ATOM 107 O LYS A 25 2.714 -16.888 2.391 1.00 1.21 O ATOM 108 CB LYS A 25 1.202 -15.641 5.096 1.00 23.42 C ATOM 109 CG LYS A 25 1.830 -16.792 5.882 1.00 25.21 C ATOM 110 CD LYS A 25 3.268 -17.093 5.471 1.00 71.45 C ATOM 111 CE LYS A 25 4.207 -15.915 5.753 1.00 43.03 C ATOM 112 NZ LYS A 25 5.608 -16.216 5.375 1.00 3.23 N ATOM 0 H LYS A 25 0.711 -17.935 3.198 1.00 45.24 H new ATOM 0 HA LYS A 25 0.270 -15.074 3.277 1.00 11.44 H new ATOM 0 HB2 LYS A 25 1.869 -14.781 5.159 1.00 23.42 H new ATOM 0 HB3 LYS A 25 0.272 -15.359 5.589 1.00 23.42 H new ATOM 0 HG2 LYS A 25 1.807 -16.552 6.945 1.00 25.21 H new ATOM 0 HG3 LYS A 25 1.225 -17.688 5.744 1.00 25.21 H new ATOM 0 HD2 LYS A 25 3.621 -17.974 6.007 1.00 71.45 H new ATOM 0 HD3 LYS A 25 3.298 -17.334 4.408 1.00 71.45 H new ATOM 0 HE2 LYS A 25 3.864 -15.039 5.203 1.00 43.03 H new ATOM 0 HE3 LYS A 25 4.164 -15.663 6.813 1.00 43.03 H new ATOM 0 HZ1 LYS A 25 6.250 -15.577 5.886 1.00 3.23 H new ATOM 0 HZ2 LYS A 25 5.830 -17.201 5.623 1.00 3.23 H new ATOM 0 HZ3 LYS A 25 5.728 -16.081 4.351 1.00 3.23 H new ATOM 126 N LEU A 26 2.420 -14.695 2.257 1.00 60.25 N ATOM 127 CA LEU A 26 3.476 -14.488 1.333 1.00 21.20 C ATOM 128 C LEU A 26 4.279 -13.291 1.752 1.00 41.41 C ATOM 129 O LEU A 26 3.732 -12.309 2.214 1.00 61.44 O ATOM 130 CB LEU A 26 2.879 -14.286 -0.063 1.00 30.05 C ATOM 131 CG LEU A 26 3.842 -13.968 -1.202 1.00 34.43 C ATOM 132 CD1 LEU A 26 4.877 -15.065 -1.378 1.00 74.13 C ATOM 133 CD2 LEU A 26 3.060 -13.771 -2.477 1.00 31.32 C ATOM 0 H LEU A 26 1.944 -13.839 2.542 1.00 60.25 H new ATOM 0 HA LEU A 26 4.138 -15.354 1.312 1.00 21.20 H new ATOM 0 HB2 LEU A 26 2.331 -15.190 -0.328 1.00 30.05 H new ATOM 0 HB3 LEU A 26 2.150 -13.478 -0.003 1.00 30.05 H new ATOM 0 HG LEU A 26 4.378 -13.051 -0.957 1.00 34.43 H new ATOM 0 HD11 LEU A 26 5.547 -14.805 -2.198 1.00 74.13 H new ATOM 0 HD12 LEU A 26 5.453 -15.172 -0.459 1.00 74.13 H new ATOM 0 HD13 LEU A 26 4.375 -16.006 -1.603 1.00 74.13 H new ATOM 0 HD21 LEU A 26 3.746 -13.543 -3.293 1.00 31.32 H new ATOM 0 HD22 LEU A 26 2.508 -14.682 -2.710 1.00 31.32 H new ATOM 0 HD23 LEU A 26 2.360 -12.945 -2.351 1.00 31.32 H new ATOM 145 N GLU A 27 5.555 -13.390 1.638 1.00 51.51 N ATOM 146 CA GLU A 27 6.430 -12.311 1.975 1.00 20.43 C ATOM 147 C GLU A 27 7.418 -12.116 0.874 1.00 42.15 C ATOM 148 O GLU A 27 7.966 -13.086 0.351 1.00 20.32 O ATOM 149 CB GLU A 27 7.154 -12.574 3.288 1.00 32.11 C ATOM 150 CG GLU A 27 6.236 -12.697 4.484 1.00 23.41 C ATOM 151 CD GLU A 27 6.986 -12.954 5.739 1.00 4.51 C ATOM 152 OE1 GLU A 27 7.482 -11.994 6.351 1.00 45.43 O ATOM 153 OE2 GLU A 27 7.111 -14.126 6.137 1.00 35.23 O ATOM 0 H GLU A 27 6.032 -14.228 1.305 1.00 51.51 H new ATOM 0 HA GLU A 27 5.834 -11.407 2.101 1.00 20.43 H new ATOM 0 HB2 GLU A 27 7.735 -13.491 3.193 1.00 32.11 H new ATOM 0 HB3 GLU A 27 7.862 -11.765 3.469 1.00 32.11 H new ATOM 0 HG2 GLU A 27 5.655 -11.781 4.590 1.00 23.41 H new ATOM 0 HG3 GLU A 27 5.526 -13.507 4.314 1.00 23.41 H new ATOM 160 N THR A 28 7.640 -10.894 0.523 1.00 43.13 N ATOM 161 CA THR A 28 8.561 -10.554 -0.514 1.00 13.54 C ATOM 162 C THR A 28 9.217 -9.238 -0.129 1.00 11.43 C ATOM 163 O THR A 28 8.773 -8.572 0.826 1.00 4.12 O ATOM 164 CB THR A 28 7.837 -10.432 -1.905 1.00 53.25 C ATOM 165 OG1 THR A 28 8.793 -10.208 -2.956 1.00 25.12 O ATOM 166 CG2 THR A 28 6.824 -9.284 -1.900 1.00 0.24 C ATOM 0 H THR A 28 7.182 -10.091 0.953 1.00 43.13 H new ATOM 0 HA THR A 28 9.310 -11.338 -0.620 1.00 13.54 H new ATOM 0 HB THR A 28 7.312 -11.370 -2.083 1.00 53.25 H new ATOM 0 HG1 THR A 28 8.325 -10.136 -3.814 1.00 25.12 H new ATOM 0 HG21 THR A 28 6.339 -9.223 -2.874 1.00 0.24 H new ATOM 0 HG22 THR A 28 6.073 -9.465 -1.131 1.00 0.24 H new ATOM 0 HG23 THR A 28 7.338 -8.346 -1.691 1.00 0.24 H new ATOM 174 N ASP A 29 10.248 -8.868 -0.821 1.00 22.21 N ATOM 175 CA ASP A 29 10.911 -7.623 -0.547 1.00 34.10 C ATOM 176 C ASP A 29 11.178 -6.903 -1.846 1.00 43.11 C ATOM 177 O ASP A 29 11.490 -7.531 -2.868 1.00 52.22 O ATOM 178 CB ASP A 29 12.213 -7.823 0.258 1.00 73.14 C ATOM 179 CG ASP A 29 13.322 -8.520 -0.504 1.00 64.44 C ATOM 180 OD1 ASP A 29 13.315 -9.770 -0.617 1.00 22.51 O ATOM 181 OD2 ASP A 29 14.223 -7.838 -0.982 1.00 24.22 O ATOM 0 H ASP A 29 10.654 -9.410 -1.584 1.00 22.21 H new ATOM 0 HA ASP A 29 10.255 -7.014 0.075 1.00 34.10 H new ATOM 0 HB2 ASP A 29 12.574 -6.849 0.589 1.00 73.14 H new ATOM 0 HB3 ASP A 29 11.986 -8.401 1.154 1.00 73.14 H new ATOM 186 N VAL A 30 11.006 -5.616 -1.822 1.00 24.41 N ATOM 187 CA VAL A 30 11.201 -4.758 -2.976 1.00 63.32 C ATOM 188 C VAL A 30 12.141 -3.631 -2.570 1.00 50.04 C ATOM 189 O VAL A 30 12.126 -3.204 -1.408 1.00 73.31 O ATOM 190 CB VAL A 30 9.835 -4.165 -3.483 1.00 23.24 C ATOM 191 CG1 VAL A 30 10.033 -3.212 -4.652 1.00 11.23 C ATOM 192 CG2 VAL A 30 8.887 -5.276 -3.896 1.00 32.44 C ATOM 0 H VAL A 30 10.719 -5.110 -0.984 1.00 24.41 H new ATOM 0 HA VAL A 30 11.627 -5.339 -3.794 1.00 63.32 H new ATOM 0 HB VAL A 30 9.403 -3.607 -2.652 1.00 23.24 H new ATOM 0 HG11 VAL A 30 9.066 -2.824 -4.973 1.00 11.23 H new ATOM 0 HG12 VAL A 30 10.672 -2.385 -4.343 1.00 11.23 H new ATOM 0 HG13 VAL A 30 10.503 -3.744 -5.479 1.00 11.23 H new ATOM 0 HG21 VAL A 30 7.949 -4.843 -4.243 1.00 32.44 H new ATOM 0 HG22 VAL A 30 9.337 -5.859 -4.700 1.00 32.44 H new ATOM 0 HG23 VAL A 30 8.693 -5.925 -3.042 1.00 32.44 H new ATOM 202 N GLU A 31 12.981 -3.183 -3.463 1.00 53.33 N ATOM 203 CA GLU A 31 13.881 -2.133 -3.109 1.00 41.24 C ATOM 204 C GLU A 31 13.385 -0.821 -3.670 1.00 71.34 C ATOM 205 O GLU A 31 13.088 -0.712 -4.878 1.00 5.40 O ATOM 206 CB GLU A 31 15.315 -2.337 -3.624 1.00 31.40 C ATOM 207 CG GLU A 31 15.928 -3.728 -3.500 1.00 10.44 C ATOM 208 CD GLU A 31 15.460 -4.704 -4.550 1.00 63.23 C ATOM 209 OE1 GLU A 31 14.465 -5.418 -4.338 1.00 32.23 O ATOM 210 OE2 GLU A 31 16.112 -4.806 -5.599 1.00 51.04 O ATOM 0 H GLU A 31 13.057 -3.524 -4.421 1.00 53.33 H new ATOM 0 HA GLU A 31 13.911 -2.133 -2.019 1.00 41.24 H new ATOM 0 HB2 GLU A 31 15.335 -2.056 -4.677 1.00 31.40 H new ATOM 0 HB3 GLU A 31 15.963 -1.638 -3.095 1.00 31.40 H new ATOM 0 HG2 GLU A 31 17.013 -3.641 -3.558 1.00 10.44 H new ATOM 0 HG3 GLU A 31 15.692 -4.130 -2.515 1.00 10.44 H new ATOM 217 N ILE A 32 13.281 0.161 -2.826 1.00 71.54 N ATOM 218 CA ILE A 32 12.965 1.479 -3.277 1.00 63.41 C ATOM 219 C ILE A 32 14.270 2.246 -3.339 1.00 64.44 C ATOM 220 O ILE A 32 15.188 1.998 -2.539 1.00 60.53 O ATOM 221 CB ILE A 32 11.910 2.222 -2.395 1.00 73.24 C ATOM 222 CG1 ILE A 32 12.427 2.424 -0.963 1.00 33.14 C ATOM 223 CG2 ILE A 32 10.573 1.453 -2.391 1.00 63.52 C ATOM 224 CD1 ILE A 32 11.504 3.238 -0.082 1.00 12.11 C ATOM 0 H ILE A 32 13.411 0.072 -1.818 1.00 71.54 H new ATOM 0 HA ILE A 32 12.490 1.410 -4.255 1.00 63.41 H new ATOM 0 HB ILE A 32 11.741 3.208 -2.829 1.00 73.24 H new ATOM 0 HG12 ILE A 32 12.583 1.448 -0.503 1.00 33.14 H new ATOM 0 HG13 ILE A 32 13.399 2.916 -1.005 1.00 33.14 H new ATOM 0 HG21 ILE A 32 9.850 1.984 -1.772 1.00 63.52 H new ATOM 0 HG22 ILE A 32 10.193 1.378 -3.410 1.00 63.52 H new ATOM 0 HG23 ILE A 32 10.730 0.452 -1.988 1.00 63.52 H new ATOM 0 HD11 ILE A 32 11.941 3.335 0.912 1.00 12.11 H new ATOM 0 HD12 ILE A 32 11.367 4.228 -0.516 1.00 12.11 H new ATOM 0 HD13 ILE A 32 10.538 2.738 -0.007 1.00 12.11 H new ATOM 236 N LYS A 33 14.369 3.144 -4.261 1.00 32.25 N ATOM 237 CA LYS A 33 15.621 3.817 -4.542 1.00 31.34 C ATOM 238 C LYS A 33 15.675 5.142 -3.815 1.00 23.24 C ATOM 239 O LYS A 33 16.493 6.008 -4.117 1.00 2.20 O ATOM 240 CB LYS A 33 15.836 4.011 -6.076 1.00 61.02 C ATOM 241 CG LYS A 33 15.796 2.720 -6.938 1.00 10.44 C ATOM 242 CD LYS A 33 14.411 2.118 -6.936 1.00 45.42 C ATOM 243 CE LYS A 33 14.258 0.878 -7.750 1.00 25.10 C ATOM 244 NZ LYS A 33 12.864 0.385 -7.659 1.00 13.40 N ATOM 0 H LYS A 33 13.591 3.442 -4.849 1.00 32.25 H new ATOM 0 HA LYS A 33 16.433 3.187 -4.180 1.00 31.34 H new ATOM 0 HB2 LYS A 33 15.072 4.695 -6.446 1.00 61.02 H new ATOM 0 HB3 LYS A 33 16.800 4.497 -6.229 1.00 61.02 H new ATOM 0 HG2 LYS A 33 16.096 2.950 -7.960 1.00 10.44 H new ATOM 0 HG3 LYS A 33 16.513 1.996 -6.551 1.00 10.44 H new ATOM 0 HD2 LYS A 33 14.130 1.895 -5.907 1.00 45.42 H new ATOM 0 HD3 LYS A 33 13.707 2.864 -7.304 1.00 45.42 H new ATOM 0 HE2 LYS A 33 14.514 1.081 -8.790 1.00 25.10 H new ATOM 0 HE3 LYS A 33 14.948 0.112 -7.395 1.00 25.10 H new ATOM 0 HZ1 LYS A 33 12.662 -0.235 -8.469 1.00 13.40 H new ATOM 0 HZ2 LYS A 33 12.742 -0.149 -6.775 1.00 13.40 H new ATOM 0 HZ3 LYS A 33 12.209 1.193 -7.670 1.00 13.40 H new ATOM 258 N ALA A 34 14.829 5.273 -2.846 1.00 12.32 N ATOM 259 CA ALA A 34 14.786 6.430 -2.021 1.00 4.50 C ATOM 260 C ALA A 34 14.999 6.017 -0.588 1.00 52.22 C ATOM 261 O ALA A 34 14.944 4.824 -0.262 1.00 23.01 O ATOM 262 CB ALA A 34 13.460 7.145 -2.177 1.00 2.51 C ATOM 0 H ALA A 34 14.137 4.564 -2.603 1.00 12.32 H new ATOM 0 HA ALA A 34 15.575 7.120 -2.321 1.00 4.50 H new ATOM 0 HB1 ALA A 34 13.445 8.028 -1.538 1.00 2.51 H new ATOM 0 HB2 ALA A 34 13.329 7.447 -3.216 1.00 2.51 H new ATOM 0 HB3 ALA A 34 12.650 6.475 -1.889 1.00 2.51 H new ATOM 268 N SER A 35 15.251 6.969 0.252 1.00 54.42 N ATOM 269 CA SER A 35 15.438 6.717 1.643 1.00 53.41 C ATOM 270 C SER A 35 14.076 6.517 2.325 1.00 21.12 C ATOM 271 O SER A 35 13.087 7.186 1.979 1.00 41.21 O ATOM 272 CB SER A 35 16.206 7.878 2.261 1.00 4.34 C ATOM 273 OG SER A 35 17.452 8.057 1.588 1.00 31.20 O ATOM 0 H SER A 35 15.333 7.951 -0.011 1.00 54.42 H new ATOM 0 HA SER A 35 16.017 5.805 1.785 1.00 53.41 H new ATOM 0 HB2 SER A 35 15.614 8.791 2.196 1.00 4.34 H new ATOM 0 HB3 SER A 35 16.380 7.686 3.320 1.00 4.34 H new ATOM 0 HG SER A 35 17.662 7.252 1.070 1.00 31.20 H new ATOM 279 N ALA A 36 14.038 5.601 3.281 1.00 50.10 N ATOM 280 CA ALA A 36 12.822 5.250 4.020 1.00 2.44 C ATOM 281 C ALA A 36 12.229 6.458 4.731 1.00 12.32 C ATOM 282 O ALA A 36 11.016 6.538 4.953 1.00 72.32 O ATOM 283 CB ALA A 36 13.125 4.151 5.024 1.00 24.21 C ATOM 0 H ALA A 36 14.859 5.070 3.573 1.00 50.10 H new ATOM 0 HA ALA A 36 12.085 4.893 3.301 1.00 2.44 H new ATOM 0 HB1 ALA A 36 12.216 3.896 5.569 1.00 24.21 H new ATOM 0 HB2 ALA A 36 13.493 3.270 4.499 1.00 24.21 H new ATOM 0 HB3 ALA A 36 13.884 4.498 5.725 1.00 24.21 H new ATOM 289 N ASP A 37 13.086 7.400 5.065 1.00 52.10 N ATOM 290 CA ASP A 37 12.679 8.636 5.716 1.00 25.51 C ATOM 291 C ASP A 37 11.714 9.442 4.872 1.00 31.53 C ATOM 292 O ASP A 37 10.835 10.106 5.411 1.00 52.31 O ATOM 293 CB ASP A 37 13.880 9.497 6.125 1.00 72.10 C ATOM 294 CG ASP A 37 14.649 8.927 7.292 1.00 72.20 C ATOM 295 OD1 ASP A 37 15.443 7.987 7.103 1.00 2.25 O ATOM 296 OD2 ASP A 37 14.478 9.432 8.426 1.00 33.10 O ATOM 0 H ASP A 37 14.089 7.333 4.894 1.00 52.10 H new ATOM 0 HA ASP A 37 12.155 8.336 6.624 1.00 25.51 H new ATOM 0 HB2 ASP A 37 14.551 9.602 5.272 1.00 72.10 H new ATOM 0 HB3 ASP A 37 13.531 10.497 6.381 1.00 72.10 H new ATOM 301 N LYS A 38 11.834 9.359 3.544 1.00 52.10 N ATOM 302 CA LYS A 38 10.941 10.113 2.676 1.00 15.31 C ATOM 303 C LYS A 38 9.534 9.569 2.770 1.00 3.15 C ATOM 304 O LYS A 38 8.557 10.313 2.715 1.00 12.12 O ATOM 305 CB LYS A 38 11.412 10.126 1.237 1.00 63.51 C ATOM 306 CG LYS A 38 12.809 10.679 1.084 1.00 73.23 C ATOM 307 CD LYS A 38 13.124 11.031 -0.342 1.00 44.23 C ATOM 308 CE LYS A 38 12.306 12.233 -0.815 1.00 21.35 C ATOM 309 NZ LYS A 38 12.656 12.638 -2.184 1.00 44.12 N ATOM 0 H LYS A 38 12.527 8.789 3.059 1.00 52.10 H new ATOM 0 HA LYS A 38 10.949 11.146 3.023 1.00 15.31 H new ATOM 0 HB2 LYS A 38 11.382 9.111 0.841 1.00 63.51 H new ATOM 0 HB3 LYS A 38 10.723 10.722 0.639 1.00 63.51 H new ATOM 0 HG2 LYS A 38 12.918 11.566 1.708 1.00 73.23 H new ATOM 0 HG3 LYS A 38 13.530 9.945 1.444 1.00 73.23 H new ATOM 0 HD2 LYS A 38 14.187 11.253 -0.437 1.00 44.23 H new ATOM 0 HD3 LYS A 38 12.918 10.174 -0.984 1.00 44.23 H new ATOM 0 HE2 LYS A 38 11.245 11.988 -0.770 1.00 21.35 H new ATOM 0 HE3 LYS A 38 12.469 13.071 -0.137 1.00 21.35 H new ATOM 0 HZ1 LYS A 38 12.042 13.423 -2.481 1.00 44.12 H new ATOM 0 HZ2 LYS A 38 13.649 12.945 -2.212 1.00 44.12 H new ATOM 0 HZ3 LYS A 38 12.525 11.833 -2.829 1.00 44.12 H new ATOM 323 N PHE A 39 9.444 8.264 2.965 1.00 11.04 N ATOM 324 CA PHE A 39 8.174 7.584 3.136 1.00 41.41 C ATOM 325 C PHE A 39 7.558 8.036 4.460 1.00 5.53 C ATOM 326 O PHE A 39 6.352 8.257 4.565 1.00 61.35 O ATOM 327 CB PHE A 39 8.399 6.058 3.130 1.00 10.23 C ATOM 328 CG PHE A 39 7.146 5.233 3.228 1.00 53.04 C ATOM 329 CD1 PHE A 39 6.413 4.942 2.097 1.00 44.21 C ATOM 330 CD2 PHE A 39 6.707 4.748 4.450 1.00 31.25 C ATOM 331 CE1 PHE A 39 5.267 4.185 2.175 1.00 42.32 C ATOM 332 CE2 PHE A 39 5.559 3.990 4.534 1.00 54.43 C ATOM 333 CZ PHE A 39 4.838 3.708 3.393 1.00 65.11 C ATOM 0 H PHE A 39 10.254 7.645 3.009 1.00 11.04 H new ATOM 0 HA PHE A 39 7.496 7.831 2.319 1.00 41.41 H new ATOM 0 HB2 PHE A 39 8.925 5.787 2.215 1.00 10.23 H new ATOM 0 HB3 PHE A 39 9.053 5.799 3.962 1.00 10.23 H new ATOM 0 HD1 PHE A 39 6.743 5.313 1.138 1.00 44.21 H new ATOM 0 HD2 PHE A 39 7.270 4.966 5.345 1.00 31.25 H new ATOM 0 HE1 PHE A 39 4.704 3.965 1.280 1.00 42.32 H new ATOM 0 HE2 PHE A 39 5.225 3.618 5.491 1.00 54.43 H new ATOM 0 HZ PHE A 39 3.938 3.114 3.455 1.00 65.11 H new ATOM 343 N HIS A 40 8.419 8.197 5.462 1.00 74.30 N ATOM 344 CA HIS A 40 8.007 8.671 6.776 1.00 13.11 C ATOM 345 C HIS A 40 7.466 10.099 6.672 1.00 61.43 C ATOM 346 O HIS A 40 6.474 10.445 7.325 1.00 33.20 O ATOM 347 CB HIS A 40 9.180 8.595 7.779 1.00 61.14 C ATOM 348 CG HIS A 40 8.841 9.053 9.178 1.00 54.35 C ATOM 349 ND1 HIS A 40 8.429 8.200 10.164 1.00 45.12 N ATOM 350 CD2 HIS A 40 8.874 10.285 9.746 1.00 45.24 C ATOM 351 CE1 HIS A 40 8.221 8.870 11.266 1.00 30.04 C ATOM 352 NE2 HIS A 40 8.481 10.139 11.046 1.00 63.24 N ATOM 0 H HIS A 40 9.417 8.003 5.384 1.00 74.30 H new ATOM 0 HA HIS A 40 7.211 8.026 7.147 1.00 13.11 H new ATOM 0 HB2 HIS A 40 9.536 7.566 7.824 1.00 61.14 H new ATOM 0 HB3 HIS A 40 10.003 9.201 7.402 1.00 61.14 H new ATOM 0 HD2 HIS A 40 9.158 11.207 9.261 1.00 45.24 H new ATOM 0 HE1 HIS A 40 7.890 8.450 12.204 1.00 30.04 H new ATOM 0 HE2 HIS A 40 8.402 10.890 11.732 1.00 63.24 H new ATOM 361 N HIS A 41 8.115 10.922 5.840 1.00 3.34 N ATOM 362 CA HIS A 41 7.658 12.297 5.620 1.00 1.41 C ATOM 363 C HIS A 41 6.254 12.326 5.085 1.00 5.22 C ATOM 364 O HIS A 41 5.468 13.144 5.495 1.00 13.54 O ATOM 365 CB HIS A 41 8.592 13.125 4.704 1.00 20.05 C ATOM 366 CG HIS A 41 9.848 13.646 5.352 1.00 12.45 C ATOM 367 ND1 HIS A 41 9.989 14.957 5.750 1.00 21.44 N ATOM 368 CD2 HIS A 41 11.025 13.054 5.634 1.00 14.32 C ATOM 369 CE1 HIS A 41 11.189 15.144 6.242 1.00 71.12 C ATOM 370 NE2 HIS A 41 11.842 14.006 6.186 1.00 41.43 N ATOM 0 H HIS A 41 8.949 10.663 5.314 1.00 3.34 H new ATOM 0 HA HIS A 41 7.682 12.770 6.602 1.00 1.41 H new ATOM 0 HB2 HIS A 41 8.874 12.508 3.851 1.00 20.05 H new ATOM 0 HB3 HIS A 41 8.029 13.972 4.312 1.00 20.05 H new ATOM 0 HD2 HIS A 41 11.278 12.019 5.457 1.00 14.32 H new ATOM 0 HE1 HIS A 41 11.575 16.076 6.628 1.00 71.12 H new ATOM 0 HE2 HIS A 41 12.800 13.855 6.502 1.00 41.43 H new ATOM 379 N MET A 42 5.927 11.385 4.209 1.00 14.23 N ATOM 380 CA MET A 42 4.596 11.331 3.601 1.00 41.53 C ATOM 381 C MET A 42 3.475 11.170 4.626 1.00 2.14 C ATOM 382 O MET A 42 2.346 11.591 4.381 1.00 24.43 O ATOM 383 CB MET A 42 4.493 10.242 2.528 1.00 44.13 C ATOM 384 CG MET A 42 5.409 10.451 1.333 1.00 70.24 C ATOM 385 SD MET A 42 5.170 9.212 0.038 1.00 35.44 S ATOM 386 CE MET A 42 3.449 9.480 -0.398 1.00 12.41 C ATOM 0 H MET A 42 6.561 10.648 3.901 1.00 14.23 H new ATOM 0 HA MET A 42 4.462 12.300 3.121 1.00 41.53 H new ATOM 0 HB2 MET A 42 4.722 9.278 2.982 1.00 44.13 H new ATOM 0 HB3 MET A 42 3.463 10.191 2.176 1.00 44.13 H new ATOM 0 HG2 MET A 42 5.234 11.443 0.917 1.00 70.24 H new ATOM 0 HG3 MET A 42 6.446 10.424 1.667 1.00 70.24 H new ATOM 0 HE1 MET A 42 3.260 9.081 -1.394 1.00 12.41 H new ATOM 0 HE2 MET A 42 2.808 8.974 0.324 1.00 12.41 H new ATOM 0 HE3 MET A 42 3.233 10.548 -0.388 1.00 12.41 H new ATOM 396 N PHE A 43 3.778 10.579 5.769 1.00 45.12 N ATOM 397 CA PHE A 43 2.757 10.379 6.779 1.00 31.33 C ATOM 398 C PHE A 43 2.871 11.427 7.904 1.00 45.24 C ATOM 399 O PHE A 43 1.862 11.856 8.468 1.00 65.02 O ATOM 400 CB PHE A 43 2.847 8.945 7.346 1.00 54.02 C ATOM 401 CG PHE A 43 1.746 8.574 8.315 1.00 53.13 C ATOM 402 CD1 PHE A 43 0.498 8.186 7.846 1.00 72.44 C ATOM 403 CD2 PHE A 43 1.956 8.611 9.683 1.00 53.41 C ATOM 404 CE1 PHE A 43 -0.514 7.844 8.722 1.00 15.33 C ATOM 405 CE2 PHE A 43 0.950 8.270 10.565 1.00 24.04 C ATOM 406 CZ PHE A 43 -0.287 7.886 10.084 1.00 42.34 C ATOM 0 H PHE A 43 4.706 10.235 6.017 1.00 45.12 H new ATOM 0 HA PHE A 43 1.781 10.508 6.312 1.00 31.33 H new ATOM 0 HB2 PHE A 43 2.833 8.240 6.515 1.00 54.02 H new ATOM 0 HB3 PHE A 43 3.808 8.828 7.848 1.00 54.02 H new ATOM 0 HD1 PHE A 43 0.316 8.151 6.782 1.00 72.44 H new ATOM 0 HD2 PHE A 43 2.920 8.911 10.066 1.00 53.41 H new ATOM 0 HE1 PHE A 43 -1.480 7.545 8.343 1.00 15.33 H new ATOM 0 HE2 PHE A 43 1.130 8.303 11.629 1.00 24.04 H new ATOM 0 HZ PHE A 43 -1.076 7.619 10.772 1.00 42.34 H new ATOM 416 N ALA A 44 4.085 11.871 8.194 1.00 42.03 N ATOM 417 CA ALA A 44 4.307 12.831 9.287 1.00 42.31 C ATOM 418 C ALA A 44 4.014 14.270 8.858 1.00 73.11 C ATOM 419 O ALA A 44 3.483 15.070 9.640 1.00 12.30 O ATOM 420 CB ALA A 44 5.726 12.711 9.821 1.00 21.52 C ATOM 0 H ALA A 44 4.931 11.590 7.698 1.00 42.03 H new ATOM 0 HA ALA A 44 3.606 12.583 10.084 1.00 42.31 H new ATOM 0 HB1 ALA A 44 5.873 13.428 10.629 1.00 21.52 H new ATOM 0 HB2 ALA A 44 5.889 11.701 10.198 1.00 21.52 H new ATOM 0 HB3 ALA A 44 6.435 12.917 9.019 1.00 21.52 H new ATOM 426 N GLY A 45 4.358 14.581 7.636 1.00 2.50 N ATOM 427 CA GLY A 45 4.152 15.899 7.082 1.00 75.22 C ATOM 428 C GLY A 45 4.280 15.819 5.594 1.00 71.45 C ATOM 429 O GLY A 45 5.335 16.120 5.045 1.00 11.43 O ATOM 0 H GLY A 45 4.793 13.923 6.989 1.00 2.50 H new ATOM 0 HA2 GLY A 45 3.166 16.275 7.357 1.00 75.22 H new ATOM 0 HA3 GLY A 45 4.884 16.598 7.487 1.00 75.22 H new ATOM 433 N LYS A 46 3.205 15.377 4.953 1.00 73.14 N ATOM 434 CA LYS A 46 3.176 15.059 3.517 1.00 15.14 C ATOM 435 C LYS A 46 3.854 16.118 2.626 1.00 53.00 C ATOM 436 O LYS A 46 3.618 17.317 2.767 1.00 41.23 O ATOM 437 CB LYS A 46 1.732 14.772 3.005 1.00 53.13 C ATOM 438 CG LYS A 46 0.792 15.987 2.897 1.00 24.23 C ATOM 439 CD LYS A 46 0.517 16.659 4.226 1.00 34.54 C ATOM 440 CE LYS A 46 -0.346 17.892 4.044 1.00 50.24 C ATOM 441 NZ LYS A 46 -0.631 18.568 5.322 1.00 21.55 N ATOM 0 H LYS A 46 2.310 15.224 5.418 1.00 73.14 H new ATOM 0 HA LYS A 46 3.767 14.148 3.429 1.00 15.14 H new ATOM 0 HB2 LYS A 46 1.804 14.307 2.022 1.00 53.13 H new ATOM 0 HB3 LYS A 46 1.272 14.042 3.671 1.00 53.13 H new ATOM 0 HG2 LYS A 46 1.230 16.715 2.214 1.00 24.23 H new ATOM 0 HG3 LYS A 46 -0.153 15.667 2.458 1.00 24.23 H new ATOM 0 HD2 LYS A 46 0.019 15.958 4.896 1.00 34.54 H new ATOM 0 HD3 LYS A 46 1.459 16.937 4.699 1.00 34.54 H new ATOM 0 HE2 LYS A 46 0.155 18.588 3.371 1.00 50.24 H new ATOM 0 HE3 LYS A 46 -1.285 17.609 3.568 1.00 50.24 H new ATOM 0 HZ1 LYS A 46 -1.224 19.405 5.148 1.00 21.55 H new ATOM 0 HZ2 LYS A 46 -1.133 17.914 5.956 1.00 21.55 H new ATOM 0 HZ3 LYS A 46 0.262 18.863 5.766 1.00 21.55 H new ATOM 455 N PRO A 47 4.713 15.664 1.699 1.00 41.44 N ATOM 456 CA PRO A 47 5.403 16.536 0.730 1.00 62.30 C ATOM 457 C PRO A 47 4.505 16.822 -0.477 1.00 70.22 C ATOM 458 O PRO A 47 4.912 17.468 -1.454 1.00 74.15 O ATOM 459 CB PRO A 47 6.583 15.670 0.296 1.00 31.25 C ATOM 460 CG PRO A 47 6.055 14.281 0.361 1.00 2.21 C ATOM 461 CD PRO A 47 5.116 14.253 1.535 1.00 0.51 C ATOM 0 HA PRO A 47 5.683 17.504 1.144 1.00 62.30 H new ATOM 0 HB2 PRO A 47 6.915 15.924 -0.711 1.00 31.25 H new ATOM 0 HB3 PRO A 47 7.439 15.803 0.957 1.00 31.25 H new ATOM 0 HG2 PRO A 47 5.536 14.016 -0.561 1.00 2.21 H new ATOM 0 HG3 PRO A 47 6.863 13.561 0.490 1.00 2.21 H new ATOM 0 HD2 PRO A 47 4.256 13.611 1.344 1.00 0.51 H new ATOM 0 HD3 PRO A 47 5.606 13.871 2.430 1.00 0.51 H new ATOM 469 N HIS A 48 3.296 16.322 -0.395 1.00 14.44 N ATOM 470 CA HIS A 48 2.321 16.452 -1.430 1.00 64.25 C ATOM 471 C HIS A 48 1.011 16.838 -0.801 1.00 33.34 C ATOM 472 O HIS A 48 0.274 15.983 -0.330 1.00 44.31 O ATOM 473 CB HIS A 48 2.172 15.119 -2.184 1.00 35.15 C ATOM 474 CG HIS A 48 1.228 15.144 -3.357 1.00 63.13 C ATOM 475 ND1 HIS A 48 1.659 15.281 -4.641 1.00 55.43 N ATOM 476 CD2 HIS A 48 -0.118 15.006 -3.429 1.00 42.44 C ATOM 477 CE1 HIS A 48 0.637 15.229 -5.460 1.00 52.20 C ATOM 478 NE2 HIS A 48 -0.455 15.063 -4.751 1.00 72.10 N ATOM 0 H HIS A 48 2.963 15.802 0.417 1.00 14.44 H new ATOM 0 HA HIS A 48 2.632 17.216 -2.142 1.00 64.25 H new ATOM 0 HB2 HIS A 48 3.155 14.809 -2.537 1.00 35.15 H new ATOM 0 HB3 HIS A 48 1.831 14.359 -1.481 1.00 35.15 H new ATOM 0 HD1 HIS A 48 2.631 15.405 -4.923 1.00 55.43 H new ATOM 0 HD2 HIS A 48 -0.796 14.876 -2.598 1.00 42.44 H new ATOM 0 HE1 HIS A 48 0.685 15.309 -6.536 1.00 52.20 H new ATOM 487 N HIS A 49 0.748 18.102 -0.740 1.00 33.31 N ATOM 488 CA HIS A 49 -0.487 18.566 -0.162 1.00 24.14 C ATOM 489 C HIS A 49 -1.509 18.796 -1.249 1.00 3.42 C ATOM 490 O HIS A 49 -1.151 19.103 -2.397 1.00 31.23 O ATOM 491 CB HIS A 49 -0.289 19.830 0.724 1.00 50.13 C ATOM 492 CG HIS A 49 0.256 21.042 0.028 1.00 51.13 C ATOM 493 ND1 HIS A 49 1.408 21.686 0.417 1.00 32.22 N ATOM 494 CD2 HIS A 49 -0.230 21.746 -1.009 1.00 14.33 C ATOM 495 CE1 HIS A 49 1.605 22.736 -0.352 1.00 23.41 C ATOM 496 NE2 HIS A 49 0.621 22.791 -1.230 1.00 20.23 N ATOM 0 H HIS A 49 1.366 18.838 -1.081 1.00 33.31 H new ATOM 0 HA HIS A 49 -0.859 17.789 0.506 1.00 24.14 H new ATOM 0 HB2 HIS A 49 -1.249 20.092 1.169 1.00 50.13 H new ATOM 0 HB3 HIS A 49 0.382 19.573 1.544 1.00 50.13 H new ATOM 0 HD2 HIS A 49 -1.129 21.526 -1.566 1.00 14.33 H new ATOM 0 HE1 HIS A 49 2.428 23.431 -0.278 1.00 23.41 H new ATOM 0 HE2 HIS A 49 0.514 23.499 -1.956 1.00 20.23 H new ATOM 505 N VAL A 50 -2.748 18.644 -0.920 1.00 24.11 N ATOM 506 CA VAL A 50 -3.792 18.843 -1.877 1.00 21.50 C ATOM 507 C VAL A 50 -4.404 20.225 -1.753 1.00 24.43 C ATOM 508 O VAL A 50 -5.241 20.505 -0.886 1.00 70.23 O ATOM 509 CB VAL A 50 -4.858 17.713 -1.869 1.00 21.22 C ATOM 510 CG1 VAL A 50 -4.221 16.414 -2.327 1.00 21.41 C ATOM 511 CG2 VAL A 50 -5.452 17.526 -0.483 1.00 61.02 C ATOM 0 H VAL A 50 -3.067 18.380 0.012 1.00 24.11 H new ATOM 0 HA VAL A 50 -3.324 18.785 -2.860 1.00 21.50 H new ATOM 0 HB VAL A 50 -5.661 17.996 -2.549 1.00 21.22 H new ATOM 0 HG11 VAL A 50 -4.968 15.621 -2.322 1.00 21.41 H new ATOM 0 HG12 VAL A 50 -3.830 16.537 -3.337 1.00 21.41 H new ATOM 0 HG13 VAL A 50 -3.407 16.150 -1.652 1.00 21.41 H new ATOM 0 HG21 VAL A 50 -6.195 16.728 -0.510 1.00 61.02 H new ATOM 0 HG22 VAL A 50 -4.661 17.262 0.219 1.00 61.02 H new ATOM 0 HG23 VAL A 50 -5.927 18.453 -0.163 1.00 61.02 H new ATOM 521 N SER A 51 -3.917 21.101 -2.570 1.00 60.55 N ATOM 522 CA SER A 51 -4.384 22.448 -2.627 1.00 51.51 C ATOM 523 C SER A 51 -4.341 22.889 -4.068 1.00 2.24 C ATOM 524 O SER A 51 -3.285 23.243 -4.589 1.00 33.11 O ATOM 525 CB SER A 51 -3.499 23.348 -1.769 1.00 62.25 C ATOM 526 OG SER A 51 -3.428 22.871 -0.430 1.00 72.01 O ATOM 0 H SER A 51 -3.167 20.896 -3.231 1.00 60.55 H new ATOM 0 HA SER A 51 -5.402 22.515 -2.242 1.00 51.51 H new ATOM 0 HB2 SER A 51 -2.497 23.392 -2.196 1.00 62.25 H new ATOM 0 HB3 SER A 51 -3.893 24.364 -1.776 1.00 62.25 H new ATOM 0 HG SER A 51 -2.854 23.464 0.099 1.00 72.01 H new ATOM 532 N LYS A 52 -5.449 22.791 -4.726 1.00 72.43 N ATOM 533 CA LYS A 52 -5.520 23.119 -6.116 1.00 61.43 C ATOM 534 C LYS A 52 -6.735 23.959 -6.407 1.00 10.43 C ATOM 535 O LYS A 52 -6.600 25.102 -6.863 1.00 0.04 O ATOM 536 CB LYS A 52 -5.512 21.831 -6.937 1.00 2.02 C ATOM 537 CG LYS A 52 -5.636 22.009 -8.444 1.00 10.42 C ATOM 538 CD LYS A 52 -5.451 20.676 -9.157 1.00 54.14 C ATOM 539 CE LYS A 52 -6.448 19.629 -8.674 1.00 40.31 C ATOM 540 NZ LYS A 52 -6.228 18.312 -9.311 1.00 73.23 N ATOM 0 H LYS A 52 -6.331 22.482 -4.318 1.00 72.43 H new ATOM 0 HA LYS A 52 -4.650 23.714 -6.395 1.00 61.43 H new ATOM 0 HB2 LYS A 52 -4.587 21.294 -6.728 1.00 2.02 H new ATOM 0 HB3 LYS A 52 -6.332 21.199 -6.595 1.00 2.02 H new ATOM 0 HG2 LYS A 52 -6.613 22.425 -8.687 1.00 10.42 H new ATOM 0 HG3 LYS A 52 -4.890 22.722 -8.794 1.00 10.42 H new ATOM 0 HD2 LYS A 52 -5.568 20.820 -10.231 1.00 54.14 H new ATOM 0 HD3 LYS A 52 -4.436 20.314 -8.992 1.00 54.14 H new ATOM 0 HE2 LYS A 52 -6.368 19.525 -7.592 1.00 40.31 H new ATOM 0 HE3 LYS A 52 -7.461 19.969 -8.887 1.00 40.31 H new ATOM 0 HZ1 LYS A 52 -6.928 17.632 -8.953 1.00 73.23 H new ATOM 0 HZ2 LYS A 52 -6.330 18.404 -10.342 1.00 73.23 H new ATOM 0 HZ3 LYS A 52 -5.271 17.974 -9.087 1.00 73.23 H new ATOM 554 N ALA A 53 -7.911 23.402 -6.096 1.00 62.11 N ATOM 555 CA ALA A 53 -9.215 24.038 -6.346 1.00 31.51 C ATOM 556 C ALA A 53 -9.481 24.215 -7.843 1.00 34.43 C ATOM 557 O ALA A 53 -8.776 24.951 -8.541 1.00 51.21 O ATOM 558 CB ALA A 53 -9.376 25.351 -5.581 1.00 33.15 C ATOM 0 H ALA A 53 -7.988 22.484 -5.657 1.00 62.11 H new ATOM 0 HA ALA A 53 -9.975 23.358 -5.961 1.00 31.51 H new ATOM 0 HB1 ALA A 53 -10.354 25.781 -5.798 1.00 33.15 H new ATOM 0 HB2 ALA A 53 -9.293 25.161 -4.511 1.00 33.15 H new ATOM 0 HB3 ALA A 53 -8.596 26.048 -5.887 1.00 33.15 H new ATOM 564 N SER A 54 -10.486 23.535 -8.316 1.00 43.21 N ATOM 565 CA SER A 54 -10.852 23.547 -9.714 1.00 74.53 C ATOM 566 C SER A 54 -11.278 24.950 -10.194 1.00 53.10 C ATOM 567 O SER A 54 -12.021 25.647 -9.500 1.00 60.24 O ATOM 568 CB SER A 54 -11.955 22.506 -9.953 1.00 3.42 C ATOM 569 OG SER A 54 -13.027 22.660 -9.016 1.00 32.30 O ATOM 0 H SER A 54 -11.086 22.947 -7.738 1.00 43.21 H new ATOM 0 HA SER A 54 -9.976 23.283 -10.306 1.00 74.53 H new ATOM 0 HB2 SER A 54 -12.339 22.606 -10.968 1.00 3.42 H new ATOM 0 HB3 SER A 54 -11.536 21.503 -9.868 1.00 3.42 H new ATOM 0 HG SER A 54 -13.716 21.985 -9.193 1.00 32.30 H new ATOM 575 N PRO A 55 -10.760 25.396 -11.368 1.00 72.44 N ATOM 576 CA PRO A 55 -11.143 26.680 -11.959 1.00 62.13 C ATOM 577 C PRO A 55 -12.649 26.754 -12.194 1.00 50.23 C ATOM 578 O PRO A 55 -13.226 25.935 -12.927 1.00 21.41 O ATOM 579 CB PRO A 55 -10.391 26.707 -13.295 1.00 4.53 C ATOM 580 CG PRO A 55 -9.250 25.774 -13.103 1.00 25.42 C ATOM 581 CD PRO A 55 -9.748 24.700 -12.182 1.00 35.32 C ATOM 0 HA PRO A 55 -10.899 27.523 -11.313 1.00 62.13 H new ATOM 0 HB2 PRO A 55 -11.031 26.386 -14.117 1.00 4.53 H new ATOM 0 HB3 PRO A 55 -10.045 27.712 -13.535 1.00 4.53 H new ATOM 0 HG2 PRO A 55 -8.925 25.353 -14.055 1.00 25.42 H new ATOM 0 HG3 PRO A 55 -8.391 26.290 -12.673 1.00 25.42 H new ATOM 0 HD2 PRO A 55 -10.180 23.865 -12.734 1.00 35.32 H new ATOM 0 HD3 PRO A 55 -8.946 24.294 -11.566 1.00 35.32 H new ATOM 589 N GLY A 56 -13.275 27.712 -11.566 1.00 24.34 N ATOM 590 CA GLY A 56 -14.698 27.846 -11.651 1.00 5.13 C ATOM 591 C GLY A 56 -15.340 27.318 -10.399 1.00 41.11 C ATOM 592 O GLY A 56 -16.288 26.524 -10.451 1.00 72.41 O ATOM 0 H GLY A 56 -12.815 28.414 -10.987 1.00 24.34 H new ATOM 0 HA2 GLY A 56 -14.965 28.893 -11.793 1.00 5.13 H new ATOM 0 HA3 GLY A 56 -15.072 27.302 -12.518 1.00 5.13 H new ATOM 596 N ASN A 57 -14.815 27.749 -9.280 1.00 32.12 N ATOM 597 CA ASN A 57 -15.267 27.319 -7.973 1.00 0.14 C ATOM 598 C ASN A 57 -15.111 28.507 -7.030 1.00 52.24 C ATOM 599 O ASN A 57 -14.371 29.443 -7.337 1.00 44.03 O ATOM 600 CB ASN A 57 -14.361 26.131 -7.508 1.00 15.01 C ATOM 601 CG ASN A 57 -14.773 25.410 -6.205 1.00 44.33 C ATOM 602 OD1 ASN A 57 -15.364 25.979 -5.291 1.00 32.20 O ATOM 603 ND2 ASN A 57 -14.442 24.153 -6.122 1.00 55.11 N ATOM 0 H ASN A 57 -14.048 28.420 -9.247 1.00 32.12 H new ATOM 0 HA ASN A 57 -16.305 26.988 -7.987 1.00 0.14 H new ATOM 0 HB2 ASN A 57 -14.330 25.393 -8.310 1.00 15.01 H new ATOM 0 HB3 ASN A 57 -13.346 26.507 -7.382 1.00 15.01 H new ATOM 0 HD21 ASN A 57 -14.673 23.619 -5.284 1.00 55.11 H new ATOM 0 HD22 ASN A 57 -13.951 23.703 -6.895 1.00 55.11 H new ATOM 610 N ILE A 58 -15.814 28.484 -5.920 1.00 11.24 N ATOM 611 CA ILE A 58 -15.693 29.505 -4.894 1.00 24.51 C ATOM 612 C ILE A 58 -14.274 29.444 -4.308 1.00 62.22 C ATOM 613 O ILE A 58 -13.701 30.463 -3.897 1.00 32.32 O ATOM 614 CB ILE A 58 -16.729 29.265 -3.765 1.00 13.53 C ATOM 615 CG1 ILE A 58 -18.161 29.337 -4.323 1.00 34.33 C ATOM 616 CG2 ILE A 58 -16.530 30.265 -2.639 1.00 71.22 C ATOM 617 CD1 ILE A 58 -19.248 29.077 -3.292 1.00 34.45 C ATOM 0 H ILE A 58 -16.491 27.754 -5.699 1.00 11.24 H new ATOM 0 HA ILE A 58 -15.881 30.484 -5.334 1.00 24.51 H new ATOM 0 HB ILE A 58 -16.576 28.265 -3.359 1.00 13.53 H new ATOM 0 HG12 ILE A 58 -18.319 30.323 -4.760 1.00 34.33 H new ATOM 0 HG13 ILE A 58 -18.261 28.611 -5.130 1.00 34.33 H new ATOM 0 HG21 ILE A 58 -17.265 30.082 -1.856 1.00 71.22 H new ATOM 0 HG22 ILE A 58 -15.527 30.155 -2.228 1.00 71.22 H new ATOM 0 HG23 ILE A 58 -16.655 31.277 -3.025 1.00 71.22 H new ATOM 0 HD11 ILE A 58 -20.226 29.147 -3.769 1.00 34.45 H new ATOM 0 HD12 ILE A 58 -19.120 28.080 -2.872 1.00 34.45 H new ATOM 0 HD13 ILE A 58 -19.179 29.818 -2.496 1.00 34.45 H new ATOM 629 N GLN A 59 -13.731 28.223 -4.306 1.00 1.34 N ATOM 630 CA GLN A 59 -12.375 27.899 -3.864 1.00 40.33 C ATOM 631 C GLN A 59 -12.228 27.999 -2.372 1.00 55.13 C ATOM 632 O GLN A 59 -12.036 29.080 -1.816 1.00 63.32 O ATOM 633 CB GLN A 59 -11.302 28.730 -4.568 1.00 13.12 C ATOM 634 CG GLN A 59 -11.375 28.660 -6.069 1.00 51.33 C ATOM 635 CD GLN A 59 -10.256 29.417 -6.731 1.00 73.55 C ATOM 636 OE1 GLN A 59 -9.190 28.861 -7.016 1.00 41.13 O ATOM 637 NE2 GLN A 59 -10.469 30.677 -6.976 1.00 11.22 N ATOM 0 H GLN A 59 -14.246 27.402 -4.625 1.00 1.34 H new ATOM 0 HA GLN A 59 -12.216 26.860 -4.152 1.00 40.33 H new ATOM 0 HB2 GLN A 59 -11.397 29.770 -4.256 1.00 13.12 H new ATOM 0 HB3 GLN A 59 -10.319 28.388 -4.244 1.00 13.12 H new ATOM 0 HG2 GLN A 59 -11.341 27.617 -6.384 1.00 51.33 H new ATOM 0 HG3 GLN A 59 -12.331 29.063 -6.403 1.00 51.33 H new ATOM 0 HE21 GLN A 59 -11.362 31.101 -6.726 1.00 11.22 H new ATOM 0 HE22 GLN A 59 -9.743 31.241 -7.418 1.00 11.22 H new ATOM 646 N GLY A 60 -12.357 26.885 -1.731 1.00 51.23 N ATOM 647 CA GLY A 60 -12.196 26.838 -0.322 1.00 53.11 C ATOM 648 C GLY A 60 -11.053 25.950 0.043 1.00 0.43 C ATOM 649 O GLY A 60 -10.107 26.385 0.705 1.00 3.50 O ATOM 0 H GLY A 60 -12.575 25.990 -2.168 1.00 51.23 H new ATOM 0 HA2 GLY A 60 -12.022 27.842 0.064 1.00 53.11 H new ATOM 0 HA3 GLY A 60 -13.112 26.472 0.143 1.00 53.11 H new ATOM 653 N CYS A 61 -11.145 24.681 -0.400 1.00 55.34 N ATOM 654 CA CYS A 61 -10.130 23.651 -0.143 1.00 31.31 C ATOM 655 C CYS A 61 -10.014 23.462 1.383 1.00 73.13 C ATOM 656 O CYS A 61 -8.993 23.041 1.922 1.00 42.33 O ATOM 657 CB CYS A 61 -8.787 24.072 -0.787 1.00 25.33 C ATOM 658 SG CYS A 61 -7.507 22.791 -0.815 1.00 10.43 S ATOM 0 H CYS A 61 -11.934 24.343 -0.951 1.00 55.34 H new ATOM 0 HA CYS A 61 -10.412 22.698 -0.590 1.00 31.31 H new ATOM 0 HB2 CYS A 61 -8.979 24.393 -1.811 1.00 25.33 H new ATOM 0 HB3 CYS A 61 -8.400 24.937 -0.249 1.00 25.33 H new ATOM 0 HG CYS A 61 -7.437 22.222 0.352 1.00 10.43 H new ATOM 664 N ASP A 62 -11.125 23.726 2.044 1.00 73.54 N ATOM 665 CA ASP A 62 -11.240 23.692 3.491 1.00 25.43 C ATOM 666 C ASP A 62 -11.311 22.270 3.993 1.00 71.52 C ATOM 667 O ASP A 62 -10.869 21.968 5.099 1.00 63.34 O ATOM 668 CB ASP A 62 -12.470 24.501 3.911 1.00 73.13 C ATOM 669 CG ASP A 62 -12.764 24.479 5.392 1.00 10.24 C ATOM 670 OD1 ASP A 62 -12.003 25.073 6.180 1.00 62.31 O ATOM 671 OD2 ASP A 62 -13.804 23.927 5.783 1.00 63.21 O ATOM 0 H ASP A 62 -11.997 23.977 1.577 1.00 73.54 H new ATOM 0 HA ASP A 62 -10.353 24.140 3.939 1.00 25.43 H new ATOM 0 HB2 ASP A 62 -12.332 25.536 3.597 1.00 73.13 H new ATOM 0 HB3 ASP A 62 -13.339 24.119 3.376 1.00 73.13 H new ATOM 676 N LEU A 63 -11.835 21.396 3.166 1.00 71.14 N ATOM 677 CA LEU A 63 -11.920 19.992 3.502 1.00 71.11 C ATOM 678 C LEU A 63 -10.535 19.357 3.400 1.00 15.31 C ATOM 679 O LEU A 63 -9.963 19.243 2.307 1.00 22.15 O ATOM 680 CB LEU A 63 -12.918 19.273 2.585 1.00 32.04 C ATOM 681 CG LEU A 63 -14.365 19.795 2.616 1.00 2.15 C ATOM 682 CD1 LEU A 63 -15.238 19.004 1.659 1.00 34.13 C ATOM 683 CD2 LEU A 63 -14.937 19.740 4.030 1.00 63.44 C ATOM 0 H LEU A 63 -12.212 21.634 2.249 1.00 71.14 H new ATOM 0 HA LEU A 63 -12.280 19.893 4.526 1.00 71.11 H new ATOM 0 HB2 LEU A 63 -12.552 19.339 1.561 1.00 32.04 H new ATOM 0 HB3 LEU A 63 -12.929 18.216 2.852 1.00 32.04 H new ATOM 0 HG LEU A 63 -14.354 20.837 2.296 1.00 2.15 H new ATOM 0 HD11 LEU A 63 -16.258 19.388 1.695 1.00 34.13 H new ATOM 0 HD12 LEU A 63 -14.849 19.102 0.646 1.00 34.13 H new ATOM 0 HD13 LEU A 63 -15.235 17.953 1.948 1.00 34.13 H new ATOM 0 HD21 LEU A 63 -15.961 20.115 4.023 1.00 63.44 H new ATOM 0 HD22 LEU A 63 -14.930 18.710 4.385 1.00 63.44 H new ATOM 0 HD23 LEU A 63 -14.329 20.356 4.693 1.00 63.44 H new ATOM 695 N HIS A 64 -9.989 18.984 4.537 1.00 1.20 N ATOM 696 CA HIS A 64 -8.663 18.396 4.607 1.00 71.40 C ATOM 697 C HIS A 64 -8.693 16.973 4.095 1.00 21.05 C ATOM 698 O HIS A 64 -9.432 16.141 4.604 1.00 22.24 O ATOM 699 CB HIS A 64 -8.127 18.443 6.055 1.00 62.41 C ATOM 700 CG HIS A 64 -6.742 17.881 6.238 1.00 44.00 C ATOM 701 ND1 HIS A 64 -5.618 18.664 6.303 1.00 3.21 N ATOM 702 CD2 HIS A 64 -6.312 16.605 6.385 1.00 1.52 C ATOM 703 CE1 HIS A 64 -4.567 17.903 6.477 1.00 45.42 C ATOM 704 NE2 HIS A 64 -4.959 16.654 6.531 1.00 61.12 N ATOM 0 H HIS A 64 -10.450 19.079 5.442 1.00 1.20 H new ATOM 0 HA HIS A 64 -7.991 18.976 3.975 1.00 71.40 H new ATOM 0 HB2 HIS A 64 -8.131 19.479 6.395 1.00 62.41 H new ATOM 0 HB3 HIS A 64 -8.814 17.894 6.699 1.00 62.41 H new ATOM 0 HD2 HIS A 64 -6.926 15.717 6.386 1.00 1.52 H new ATOM 0 HE1 HIS A 64 -3.547 18.247 6.562 1.00 45.42 H new ATOM 0 HE2 HIS A 64 -4.348 15.847 6.662 1.00 61.12 H new ATOM 713 N GLU A 65 -7.881 16.698 3.111 1.00 65.50 N ATOM 714 CA GLU A 65 -7.824 15.389 2.537 1.00 40.15 C ATOM 715 C GLU A 65 -6.359 14.980 2.371 1.00 42.51 C ATOM 716 O GLU A 65 -5.473 15.838 2.379 1.00 35.14 O ATOM 717 CB GLU A 65 -8.594 15.381 1.202 1.00 23.22 C ATOM 718 CG GLU A 65 -8.733 14.021 0.548 1.00 62.30 C ATOM 719 CD GLU A 65 -9.608 14.063 -0.669 1.00 63.43 C ATOM 720 OE1 GLU A 65 -10.848 13.943 -0.523 1.00 1.01 O ATOM 721 OE2 GLU A 65 -9.088 14.198 -1.789 1.00 73.33 O ATOM 0 H GLU A 65 -7.245 17.374 2.689 1.00 65.50 H new ATOM 0 HA GLU A 65 -8.300 14.657 3.190 1.00 40.15 H new ATOM 0 HB2 GLU A 65 -9.591 15.788 1.373 1.00 23.22 H new ATOM 0 HB3 GLU A 65 -8.090 16.052 0.506 1.00 23.22 H new ATOM 0 HG2 GLU A 65 -7.746 13.651 0.271 1.00 62.30 H new ATOM 0 HG3 GLU A 65 -9.148 13.315 1.267 1.00 62.30 H new ATOM 728 N GLY A 66 -6.111 13.698 2.281 1.00 24.43 N ATOM 729 CA GLY A 66 -4.762 13.195 2.152 1.00 30.21 C ATOM 730 C GLY A 66 -4.395 12.373 3.358 1.00 63.43 C ATOM 731 O GLY A 66 -3.414 11.633 3.350 1.00 10.41 O ATOM 0 H GLY A 66 -6.831 12.976 2.295 1.00 24.43 H new ATOM 0 HA2 GLY A 66 -4.677 12.589 1.250 1.00 30.21 H new ATOM 0 HA3 GLY A 66 -4.065 14.026 2.044 1.00 30.21 H new ATOM 735 N ASP A 67 -5.210 12.507 4.390 1.00 3.32 N ATOM 736 CA ASP A 67 -5.055 11.809 5.651 1.00 1.43 C ATOM 737 C ASP A 67 -6.212 12.204 6.534 1.00 75.44 C ATOM 738 O ASP A 67 -6.780 13.299 6.374 1.00 53.40 O ATOM 739 CB ASP A 67 -3.725 12.168 6.372 1.00 23.24 C ATOM 740 CG ASP A 67 -3.677 13.597 6.894 1.00 74.10 C ATOM 741 OD1 ASP A 67 -3.425 14.535 6.103 1.00 23.33 O ATOM 742 OD2 ASP A 67 -3.875 13.803 8.107 1.00 54.21 O ATOM 0 H ASP A 67 -6.022 13.124 4.371 1.00 3.32 H new ATOM 0 HA ASP A 67 -5.034 10.737 5.454 1.00 1.43 H new ATOM 0 HB2 ASP A 67 -3.577 11.481 7.205 1.00 23.24 H new ATOM 0 HB3 ASP A 67 -2.895 12.015 5.682 1.00 23.24 H new ATOM 747 N TRP A 68 -6.594 11.326 7.418 1.00 55.14 N ATOM 748 CA TRP A 68 -7.651 11.623 8.363 1.00 13.34 C ATOM 749 C TRP A 68 -7.053 11.856 9.746 1.00 64.35 C ATOM 750 O TRP A 68 -7.696 12.415 10.626 1.00 22.24 O ATOM 751 CB TRP A 68 -8.676 10.482 8.406 1.00 51.15 C ATOM 752 CG TRP A 68 -9.391 10.240 7.097 1.00 31.34 C ATOM 753 CD1 TRP A 68 -8.906 9.587 6.000 1.00 23.25 C ATOM 754 CD2 TRP A 68 -10.729 10.626 6.767 1.00 43.42 C ATOM 755 NE1 TRP A 68 -9.849 9.563 5.003 1.00 30.52 N ATOM 756 CE2 TRP A 68 -10.978 10.189 5.449 1.00 75.42 C ATOM 757 CE3 TRP A 68 -11.739 11.302 7.453 1.00 32.13 C ATOM 758 CZ2 TRP A 68 -12.193 10.410 4.808 1.00 72.44 C ATOM 759 CZ3 TRP A 68 -12.941 11.516 6.815 1.00 33.35 C ATOM 760 CH2 TRP A 68 -13.160 11.070 5.508 1.00 20.20 C ATOM 0 H TRP A 68 -6.192 10.393 7.510 1.00 55.14 H new ATOM 0 HA TRP A 68 -8.167 12.528 8.042 1.00 13.34 H new ATOM 0 HB2 TRP A 68 -8.169 9.565 8.705 1.00 51.15 H new ATOM 0 HB3 TRP A 68 -9.416 10.702 9.176 1.00 51.15 H new ATOM 0 HD1 TRP A 68 -7.920 9.151 5.927 1.00 23.25 H new ATOM 0 HE1 TRP A 68 -9.727 9.146 4.080 1.00 30.52 H new ATOM 0 HE3 TRP A 68 -11.581 11.650 8.463 1.00 32.13 H new ATOM 0 HZ2 TRP A 68 -12.364 10.072 3.796 1.00 72.44 H new ATOM 0 HZ3 TRP A 68 -13.730 12.039 7.335 1.00 33.35 H new ATOM 0 HH2 TRP A 68 -14.117 11.252 5.042 1.00 20.20 H new ATOM 771 N GLY A 69 -5.807 11.421 9.919 1.00 41.12 N ATOM 772 CA GLY A 69 -5.100 11.608 11.176 1.00 3.04 C ATOM 773 C GLY A 69 -5.387 10.525 12.204 1.00 2.13 C ATOM 774 O GLY A 69 -4.773 10.494 13.265 1.00 44.51 O ATOM 0 H GLY A 69 -5.269 10.936 9.201 1.00 41.12 H new ATOM 0 HA2 GLY A 69 -4.028 11.636 10.980 1.00 3.04 H new ATOM 0 HA3 GLY A 69 -5.372 12.577 11.596 1.00 3.04 H new ATOM 778 N THR A 70 -6.305 9.643 11.890 1.00 72.30 N ATOM 779 CA THR A 70 -6.703 8.588 12.795 1.00 20.23 C ATOM 780 C THR A 70 -6.363 7.199 12.240 1.00 64.33 C ATOM 781 O THR A 70 -6.405 6.981 11.026 1.00 20.24 O ATOM 782 CB THR A 70 -8.217 8.685 13.064 1.00 31.12 C ATOM 783 OG1 THR A 70 -8.922 8.790 11.806 1.00 30.42 O ATOM 784 CG2 THR A 70 -8.539 9.888 13.934 1.00 22.14 C ATOM 0 H THR A 70 -6.799 9.635 10.998 1.00 72.30 H new ATOM 0 HA THR A 70 -6.148 8.717 13.724 1.00 20.23 H new ATOM 0 HB THR A 70 -8.534 7.786 13.593 1.00 31.12 H new ATOM 0 HG1 THR A 70 -9.885 8.850 11.975 1.00 30.42 H new ATOM 0 HG21 THR A 70 -9.614 9.933 14.109 1.00 22.14 H new ATOM 0 HG22 THR A 70 -8.020 9.797 14.888 1.00 22.14 H new ATOM 0 HG23 THR A 70 -8.215 10.799 13.430 1.00 22.14 H new ATOM 792 N VAL A 71 -5.985 6.282 13.113 1.00 14.10 N ATOM 793 CA VAL A 71 -5.748 4.907 12.714 1.00 10.15 C ATOM 794 C VAL A 71 -7.105 4.254 12.419 1.00 34.54 C ATOM 795 O VAL A 71 -8.061 4.437 13.175 1.00 75.03 O ATOM 796 CB VAL A 71 -4.998 4.101 13.817 1.00 74.14 C ATOM 797 CG1 VAL A 71 -4.711 2.678 13.359 1.00 52.34 C ATOM 798 CG2 VAL A 71 -3.710 4.800 14.225 1.00 62.33 C ATOM 0 H VAL A 71 -5.835 6.466 14.105 1.00 14.10 H new ATOM 0 HA VAL A 71 -5.113 4.902 11.828 1.00 10.15 H new ATOM 0 HB VAL A 71 -5.650 4.052 14.689 1.00 74.14 H new ATOM 0 HG11 VAL A 71 -4.187 2.140 14.149 1.00 52.34 H new ATOM 0 HG12 VAL A 71 -5.650 2.171 13.136 1.00 52.34 H new ATOM 0 HG13 VAL A 71 -4.090 2.702 12.463 1.00 52.34 H new ATOM 0 HG21 VAL A 71 -3.207 4.216 14.996 1.00 62.33 H new ATOM 0 HG22 VAL A 71 -3.057 4.895 13.358 1.00 62.33 H new ATOM 0 HG23 VAL A 71 -3.942 5.791 14.615 1.00 62.33 H new ATOM 808 N GLY A 72 -7.200 3.524 11.332 1.00 24.04 N ATOM 809 CA GLY A 72 -8.464 2.919 10.966 1.00 34.14 C ATOM 810 C GLY A 72 -9.173 3.719 9.922 1.00 21.14 C ATOM 811 O GLY A 72 -10.266 3.354 9.483 1.00 72.33 O ATOM 0 H GLY A 72 -6.429 3.335 10.691 1.00 24.04 H new ATOM 0 HA2 GLY A 72 -8.291 1.908 10.596 1.00 34.14 H new ATOM 0 HA3 GLY A 72 -9.096 2.831 11.850 1.00 34.14 H new ATOM 815 N SER A 73 -8.563 4.811 9.528 1.00 61.43 N ATOM 816 CA SER A 73 -9.107 5.662 8.517 1.00 61.03 C ATOM 817 C SER A 73 -8.945 5.033 7.144 1.00 54.41 C ATOM 818 O SER A 73 -8.056 4.179 6.929 1.00 30.21 O ATOM 819 CB SER A 73 -8.471 7.043 8.583 1.00 35.42 C ATOM 820 OG SER A 73 -7.056 6.971 8.500 1.00 33.05 O ATOM 0 H SER A 73 -7.671 5.129 9.907 1.00 61.43 H new ATOM 0 HA SER A 73 -10.175 5.783 8.698 1.00 61.03 H new ATOM 0 HB2 SER A 73 -8.853 7.659 7.769 1.00 35.42 H new ATOM 0 HB3 SER A 73 -8.757 7.532 9.514 1.00 35.42 H new ATOM 0 HG SER A 73 -6.671 7.065 9.396 1.00 33.05 H new ATOM 826 N ILE A 74 -9.798 5.414 6.236 1.00 61.11 N ATOM 827 CA ILE A 74 -9.778 4.853 4.927 1.00 3.43 C ATOM 828 C ILE A 74 -9.435 5.876 3.865 1.00 34.34 C ATOM 829 O ILE A 74 -10.164 6.855 3.630 1.00 4.14 O ATOM 830 CB ILE A 74 -11.096 4.105 4.623 1.00 3.24 C ATOM 831 CG1 ILE A 74 -11.173 2.886 5.552 1.00 31.14 C ATOM 832 CG2 ILE A 74 -11.177 3.684 3.152 1.00 33.32 C ATOM 833 CD1 ILE A 74 -12.440 2.093 5.463 1.00 32.02 C ATOM 0 H ILE A 74 -10.520 6.118 6.387 1.00 61.11 H new ATOM 0 HA ILE A 74 -8.974 4.117 4.901 1.00 3.43 H new ATOM 0 HB ILE A 74 -11.944 4.767 4.802 1.00 3.24 H new ATOM 0 HG12 ILE A 74 -10.334 2.226 5.329 1.00 31.14 H new ATOM 0 HG13 ILE A 74 -11.047 3.225 6.580 1.00 31.14 H new ATOM 0 HG21 ILE A 74 -12.117 3.161 2.974 1.00 33.32 H new ATOM 0 HG22 ILE A 74 -11.129 4.569 2.517 1.00 33.32 H new ATOM 0 HG23 ILE A 74 -10.343 3.022 2.916 1.00 33.32 H new ATOM 0 HD11 ILE A 74 -12.394 1.255 6.158 1.00 32.02 H new ATOM 0 HD12 ILE A 74 -13.287 2.730 5.718 1.00 32.02 H new ATOM 0 HD13 ILE A 74 -12.563 1.716 4.448 1.00 32.02 H new ATOM 845 N VAL A 75 -8.319 5.632 3.243 1.00 45.12 N ATOM 846 CA VAL A 75 -7.791 6.411 2.158 1.00 3.53 C ATOM 847 C VAL A 75 -7.522 5.441 1.041 1.00 75.12 C ATOM 848 O VAL A 75 -7.558 4.240 1.271 1.00 22.41 O ATOM 849 CB VAL A 75 -6.468 7.163 2.534 1.00 51.02 C ATOM 850 CG1 VAL A 75 -6.700 8.166 3.650 1.00 72.43 C ATOM 851 CG2 VAL A 75 -5.366 6.183 2.928 1.00 52.50 C ATOM 0 H VAL A 75 -7.721 4.844 3.491 1.00 45.12 H new ATOM 0 HA VAL A 75 -8.507 7.185 1.882 1.00 3.53 H new ATOM 0 HB VAL A 75 -6.144 7.706 1.646 1.00 51.02 H new ATOM 0 HG11 VAL A 75 -5.763 8.670 3.887 1.00 72.43 H new ATOM 0 HG12 VAL A 75 -7.437 8.902 3.330 1.00 72.43 H new ATOM 0 HG13 VAL A 75 -7.066 7.647 4.536 1.00 72.43 H new ATOM 0 HG21 VAL A 75 -4.462 6.736 3.183 1.00 52.50 H new ATOM 0 HG22 VAL A 75 -5.689 5.599 3.790 1.00 52.50 H new ATOM 0 HG23 VAL A 75 -5.159 5.514 2.093 1.00 52.50 H new ATOM 861 N PHE A 76 -7.299 5.921 -0.141 1.00 74.45 N ATOM 862 CA PHE A 76 -7.048 5.033 -1.250 1.00 3.44 C ATOM 863 C PHE A 76 -5.746 5.382 -1.918 1.00 51.32 C ATOM 864 O PHE A 76 -5.357 6.562 -1.954 1.00 22.11 O ATOM 865 CB PHE A 76 -8.192 5.098 -2.267 1.00 5.23 C ATOM 866 CG PHE A 76 -9.532 4.746 -1.688 1.00 40.04 C ATOM 867 CD1 PHE A 76 -9.761 3.490 -1.183 1.00 22.43 C ATOM 868 CD2 PHE A 76 -10.548 5.676 -1.635 1.00 51.55 C ATOM 869 CE1 PHE A 76 -10.980 3.151 -0.638 1.00 71.44 C ATOM 870 CE2 PHE A 76 -11.774 5.349 -1.090 1.00 53.02 C ATOM 871 CZ PHE A 76 -11.989 4.082 -0.593 1.00 31.32 C ATOM 0 H PHE A 76 -7.284 6.915 -0.371 1.00 74.45 H new ATOM 0 HA PHE A 76 -6.985 4.016 -0.862 1.00 3.44 H new ATOM 0 HB2 PHE A 76 -8.239 6.104 -2.685 1.00 5.23 H new ATOM 0 HB3 PHE A 76 -7.973 4.420 -3.092 1.00 5.23 H new ATOM 0 HD1 PHE A 76 -8.971 2.754 -1.214 1.00 22.43 H new ATOM 0 HD2 PHE A 76 -10.384 6.670 -2.024 1.00 51.55 H new ATOM 0 HE1 PHE A 76 -11.142 2.157 -0.248 1.00 71.44 H new ATOM 0 HE2 PHE A 76 -12.563 6.085 -1.053 1.00 53.02 H new ATOM 0 HZ PHE A 76 -12.948 3.822 -0.169 1.00 31.32 H new ATOM 881 N TRP A 77 -5.073 4.390 -2.450 1.00 12.32 N ATOM 882 CA TRP A 77 -3.843 4.615 -3.165 1.00 63.35 C ATOM 883 C TRP A 77 -4.048 4.457 -4.625 1.00 32.21 C ATOM 884 O TRP A 77 -4.657 3.487 -5.104 1.00 4.52 O ATOM 885 CB TRP A 77 -2.693 3.708 -2.697 1.00 41.33 C ATOM 886 CG TRP A 77 -2.123 4.076 -1.369 1.00 22.54 C ATOM 887 CD1 TRP A 77 -2.800 4.549 -0.309 1.00 12.04 C ATOM 888 CD2 TRP A 77 -0.749 3.983 -0.963 1.00 44.24 C ATOM 889 NE1 TRP A 77 -1.950 4.762 0.746 1.00 21.22 N ATOM 890 CE2 TRP A 77 -0.685 4.417 0.371 1.00 15.33 C ATOM 891 CE3 TRP A 77 0.427 3.569 -1.597 1.00 70.44 C ATOM 892 CZ2 TRP A 77 0.507 4.454 1.088 1.00 61.02 C ATOM 893 CZ3 TRP A 77 1.612 3.606 -0.884 1.00 64.51 C ATOM 894 CH2 TRP A 77 1.644 4.043 0.445 1.00 34.21 C ATOM 0 H TRP A 77 -5.361 3.413 -2.400 1.00 12.32 H new ATOM 0 HA TRP A 77 -3.549 5.641 -2.944 1.00 63.35 H new ATOM 0 HB2 TRP A 77 -3.052 2.680 -2.653 1.00 41.33 H new ATOM 0 HB3 TRP A 77 -1.897 3.736 -3.441 1.00 41.33 H new ATOM 0 HD1 TRP A 77 -3.864 4.735 -0.290 1.00 12.04 H new ATOM 0 HE1 TRP A 77 -2.220 5.120 1.662 1.00 21.22 H new ATOM 0 HE3 TRP A 77 0.410 3.228 -2.622 1.00 70.44 H new ATOM 0 HZ2 TRP A 77 0.534 4.794 2.113 1.00 61.02 H new ATOM 0 HZ3 TRP A 77 2.528 3.292 -1.361 1.00 64.51 H new ATOM 0 HH2 TRP A 77 2.585 4.056 0.975 1.00 34.21 H new ATOM 905 N ASN A 78 -3.583 5.433 -5.316 1.00 52.43 N ATOM 906 CA ASN A 78 -3.654 5.477 -6.757 1.00 32.42 C ATOM 907 C ASN A 78 -2.314 5.134 -7.328 1.00 43.02 C ATOM 908 O ASN A 78 -1.299 5.660 -6.883 1.00 73.01 O ATOM 909 CB ASN A 78 -4.067 6.873 -7.248 1.00 75.20 C ATOM 910 CG ASN A 78 -5.453 7.282 -6.811 1.00 31.45 C ATOM 911 OD1 ASN A 78 -6.427 7.035 -7.504 1.00 1.30 O ATOM 912 ND2 ASN A 78 -5.554 7.909 -5.668 1.00 62.21 N ATOM 0 H ASN A 78 -3.130 6.247 -4.901 1.00 52.43 H new ATOM 0 HA ASN A 78 -4.403 4.757 -7.087 1.00 32.42 H new ATOM 0 HB2 ASN A 78 -3.348 7.606 -6.881 1.00 75.20 H new ATOM 0 HB3 ASN A 78 -4.017 6.896 -8.337 1.00 75.20 H new ATOM 0 HD21 ASN A 78 -6.468 8.208 -5.330 1.00 62.21 H new ATOM 0 HD22 ASN A 78 -4.718 8.099 -5.115 1.00 62.21 H new ATOM 919 N TYR A 79 -2.306 4.269 -8.291 1.00 10.50 N ATOM 920 CA TYR A 79 -1.092 3.858 -8.970 1.00 33.31 C ATOM 921 C TYR A 79 -1.400 3.652 -10.438 1.00 43.14 C ATOM 922 O TYR A 79 -2.541 3.375 -10.790 1.00 15.24 O ATOM 923 CB TYR A 79 -0.506 2.578 -8.315 1.00 22.15 C ATOM 924 CG TYR A 79 -1.476 1.408 -8.203 1.00 13.01 C ATOM 925 CD1 TYR A 79 -2.346 1.303 -7.118 1.00 2.23 C ATOM 926 CD2 TYR A 79 -1.522 0.417 -9.170 1.00 50.24 C ATOM 927 CE1 TYR A 79 -3.228 0.246 -7.007 1.00 24.32 C ATOM 928 CE2 TYR A 79 -2.407 -0.646 -9.063 1.00 13.33 C ATOM 929 CZ TYR A 79 -3.255 -0.723 -7.981 1.00 63.44 C ATOM 930 OH TYR A 79 -4.142 -1.779 -7.874 1.00 22.51 O ATOM 0 H TYR A 79 -3.149 3.814 -8.642 1.00 10.50 H new ATOM 0 HA TYR A 79 -0.332 4.634 -8.879 1.00 33.31 H new ATOM 0 HB2 TYR A 79 0.361 2.257 -8.893 1.00 22.15 H new ATOM 0 HB3 TYR A 79 -0.148 2.830 -7.317 1.00 22.15 H new ATOM 0 HD1 TYR A 79 -2.330 2.062 -6.350 1.00 2.23 H new ATOM 0 HD2 TYR A 79 -0.859 0.473 -10.020 1.00 50.24 H new ATOM 0 HE1 TYR A 79 -3.893 0.181 -6.159 1.00 24.32 H new ATOM 0 HE2 TYR A 79 -2.431 -1.410 -9.826 1.00 13.33 H new ATOM 0 HH TYR A 79 -4.035 -2.375 -8.644 1.00 22.51 H new ATOM 940 N VAL A 80 -0.422 3.784 -11.294 1.00 62.14 N ATOM 941 CA VAL A 80 -0.674 3.667 -12.711 1.00 14.42 C ATOM 942 C VAL A 80 -0.152 2.347 -13.244 1.00 11.03 C ATOM 943 O VAL A 80 1.022 2.018 -13.093 1.00 54.41 O ATOM 944 CB VAL A 80 -0.059 4.852 -13.513 1.00 61.24 C ATOM 945 CG1 VAL A 80 -0.320 4.701 -15.008 1.00 20.31 C ATOM 946 CG2 VAL A 80 -0.623 6.174 -13.019 1.00 24.31 C ATOM 0 H VAL A 80 0.548 3.971 -11.042 1.00 62.14 H new ATOM 0 HA VAL A 80 -1.755 3.701 -12.847 1.00 14.42 H new ATOM 0 HB VAL A 80 1.019 4.841 -13.352 1.00 61.24 H new ATOM 0 HG11 VAL A 80 0.121 5.543 -15.541 1.00 20.31 H new ATOM 0 HG12 VAL A 80 0.127 3.772 -15.363 1.00 20.31 H new ATOM 0 HG13 VAL A 80 -1.395 4.680 -15.189 1.00 20.31 H new ATOM 0 HG21 VAL A 80 -0.184 6.993 -13.589 1.00 24.31 H new ATOM 0 HG22 VAL A 80 -1.705 6.180 -13.151 1.00 24.31 H new ATOM 0 HG23 VAL A 80 -0.385 6.299 -11.963 1.00 24.31 H new ATOM 956 N HIS A 81 -1.034 1.589 -13.828 1.00 12.34 N ATOM 957 CA HIS A 81 -0.690 0.326 -14.417 1.00 44.24 C ATOM 958 C HIS A 81 -1.511 0.166 -15.673 1.00 62.13 C ATOM 959 O HIS A 81 -2.721 0.386 -15.644 1.00 12.13 O ATOM 960 CB HIS A 81 -0.928 -0.805 -13.414 1.00 63.54 C ATOM 961 CG HIS A 81 -0.478 -2.154 -13.875 1.00 11.43 C ATOM 962 ND1 HIS A 81 0.842 -2.481 -14.083 1.00 13.02 N ATOM 963 CD2 HIS A 81 -1.178 -3.259 -14.143 1.00 4.21 C ATOM 964 CE1 HIS A 81 0.925 -3.738 -14.457 1.00 34.41 C ATOM 965 NE2 HIS A 81 -0.286 -4.237 -14.501 1.00 52.22 N ATOM 0 H HIS A 81 -2.021 1.832 -13.910 1.00 12.34 H new ATOM 0 HA HIS A 81 0.367 0.287 -14.680 1.00 44.24 H new ATOM 0 HB2 HIS A 81 -0.412 -0.563 -12.485 1.00 63.54 H new ATOM 0 HB3 HIS A 81 -1.993 -0.851 -13.185 1.00 63.54 H new ATOM 0 HD2 HIS A 81 -2.252 -3.363 -14.088 1.00 4.21 H new ATOM 0 HE1 HIS A 81 1.836 -4.269 -14.689 1.00 34.41 H new ATOM 0 HE2 HIS A 81 -0.525 -5.194 -14.759 1.00 52.22 H new ATOM 974 N ASP A 82 -0.843 -0.161 -16.779 1.00 2.44 N ATOM 975 CA ASP A 82 -1.470 -0.256 -18.123 1.00 54.11 C ATOM 976 C ASP A 82 -1.978 1.098 -18.548 1.00 4.25 C ATOM 977 O ASP A 82 -2.900 1.216 -19.349 1.00 73.22 O ATOM 978 CB ASP A 82 -2.628 -1.276 -18.172 1.00 20.04 C ATOM 979 CG ASP A 82 -2.191 -2.704 -18.041 1.00 21.32 C ATOM 980 OD1 ASP A 82 -1.687 -3.281 -19.047 1.00 0.51 O ATOM 981 OD2 ASP A 82 -2.341 -3.283 -16.955 1.00 1.41 O ATOM 0 H ASP A 82 0.155 -0.371 -16.781 1.00 2.44 H new ATOM 0 HA ASP A 82 -0.698 -0.606 -18.808 1.00 54.11 H new ATOM 0 HB2 ASP A 82 -3.333 -1.048 -17.372 1.00 20.04 H new ATOM 0 HB3 ASP A 82 -3.164 -1.156 -19.113 1.00 20.04 H new ATOM 986 N GLY A 83 -1.321 2.124 -18.057 1.00 21.34 N ATOM 987 CA GLY A 83 -1.691 3.477 -18.375 1.00 63.30 C ATOM 988 C GLY A 83 -2.895 3.983 -17.584 1.00 13.11 C ATOM 989 O GLY A 83 -3.159 5.188 -17.564 1.00 70.24 O ATOM 0 H GLY A 83 -0.521 2.041 -17.430 1.00 21.34 H new ATOM 0 HA2 GLY A 83 -0.841 4.132 -18.185 1.00 63.30 H new ATOM 0 HA3 GLY A 83 -1.913 3.544 -19.440 1.00 63.30 H new ATOM 993 N GLU A 84 -3.603 3.096 -16.910 1.00 74.13 N ATOM 994 CA GLU A 84 -4.785 3.490 -16.186 1.00 55.45 C ATOM 995 C GLU A 84 -4.424 3.751 -14.748 1.00 14.33 C ATOM 996 O GLU A 84 -3.517 3.102 -14.194 1.00 54.33 O ATOM 997 CB GLU A 84 -5.863 2.387 -16.256 1.00 30.13 C ATOM 998 CG GLU A 84 -7.209 2.799 -15.672 1.00 42.32 C ATOM 999 CD GLU A 84 -8.262 1.723 -15.785 1.00 44.01 C ATOM 1000 OE1 GLU A 84 -8.940 1.641 -16.831 1.00 0.32 O ATOM 1001 OE2 GLU A 84 -8.436 0.943 -14.829 1.00 30.20 O ATOM 0 H GLU A 84 -3.377 2.103 -16.852 1.00 74.13 H new ATOM 0 HA GLU A 84 -5.187 4.396 -16.639 1.00 55.45 H new ATOM 0 HB2 GLU A 84 -6.004 2.096 -17.297 1.00 30.13 H new ATOM 0 HB3 GLU A 84 -5.502 1.506 -15.725 1.00 30.13 H new ATOM 0 HG2 GLU A 84 -7.077 3.060 -14.622 1.00 42.32 H new ATOM 0 HG3 GLU A 84 -7.560 3.696 -16.182 1.00 42.32 H new ATOM 1008 N ALA A 85 -5.090 4.700 -14.152 1.00 33.24 N ATOM 1009 CA ALA A 85 -4.903 4.954 -12.764 1.00 45.54 C ATOM 1010 C ALA A 85 -5.765 3.973 -12.028 1.00 11.14 C ATOM 1011 O ALA A 85 -7.000 3.999 -12.137 1.00 65.32 O ATOM 1012 CB ALA A 85 -5.281 6.385 -12.410 1.00 15.22 C ATOM 0 H ALA A 85 -5.767 5.308 -14.613 1.00 33.24 H new ATOM 0 HA ALA A 85 -3.855 4.836 -12.488 1.00 45.54 H new ATOM 0 HB1 ALA A 85 -5.127 6.549 -11.343 1.00 15.22 H new ATOM 0 HB2 ALA A 85 -4.658 7.077 -12.977 1.00 15.22 H new ATOM 0 HB3 ALA A 85 -6.329 6.556 -12.656 1.00 15.22 H new ATOM 1018 N LYS A 86 -5.139 3.116 -11.307 1.00 61.13 N ATOM 1019 CA LYS A 86 -5.813 2.069 -10.633 1.00 13.33 C ATOM 1020 C LYS A 86 -5.949 2.488 -9.198 1.00 40.41 C ATOM 1021 O LYS A 86 -5.048 3.141 -8.649 1.00 24.22 O ATOM 1022 CB LYS A 86 -4.990 0.783 -10.703 1.00 54.02 C ATOM 1023 CG LYS A 86 -4.300 0.512 -12.051 1.00 51.24 C ATOM 1024 CD LYS A 86 -5.241 0.340 -13.246 1.00 1.44 C ATOM 1025 CE LYS A 86 -6.101 -0.886 -13.121 1.00 73.40 C ATOM 1026 NZ LYS A 86 -6.882 -1.142 -14.338 1.00 41.45 N ATOM 0 H LYS A 86 -4.129 3.123 -11.167 1.00 61.13 H new ATOM 0 HA LYS A 86 -6.785 1.883 -11.090 1.00 13.33 H new ATOM 0 HB2 LYS A 86 -4.228 0.817 -9.925 1.00 54.02 H new ATOM 0 HB3 LYS A 86 -5.643 -0.059 -10.473 1.00 54.02 H new ATOM 0 HG2 LYS A 86 -3.618 1.335 -12.263 1.00 51.24 H new ATOM 0 HG3 LYS A 86 -3.693 -0.388 -11.955 1.00 51.24 H new ATOM 0 HD2 LYS A 86 -5.877 1.220 -13.334 1.00 1.44 H new ATOM 0 HD3 LYS A 86 -4.654 0.278 -14.162 1.00 1.44 H new ATOM 0 HE2 LYS A 86 -5.471 -1.749 -12.907 1.00 73.40 H new ATOM 0 HE3 LYS A 86 -6.778 -0.768 -12.275 1.00 73.40 H new ATOM 0 HZ1 LYS A 86 -7.686 -1.761 -14.111 1.00 41.45 H new ATOM 0 HZ2 LYS A 86 -7.235 -0.241 -14.720 1.00 41.45 H new ATOM 0 HZ3 LYS A 86 -6.278 -1.605 -15.047 1.00 41.45 H new ATOM 1040 N VAL A 87 -7.030 2.131 -8.602 1.00 2.12 N ATOM 1041 CA VAL A 87 -7.313 2.521 -7.236 1.00 32.43 C ATOM 1042 C VAL A 87 -7.542 1.278 -6.394 1.00 11.34 C ATOM 1043 O VAL A 87 -8.265 0.357 -6.816 1.00 10.40 O ATOM 1044 CB VAL A 87 -8.577 3.432 -7.165 1.00 72.30 C ATOM 1045 CG1 VAL A 87 -8.842 3.912 -5.741 1.00 33.42 C ATOM 1046 CG2 VAL A 87 -8.458 4.613 -8.117 1.00 70.22 C ATOM 0 H VAL A 87 -7.755 1.559 -9.035 1.00 2.12 H new ATOM 0 HA VAL A 87 -6.460 3.082 -6.854 1.00 32.43 H new ATOM 0 HB VAL A 87 -9.429 2.828 -7.477 1.00 72.30 H new ATOM 0 HG11 VAL A 87 -9.730 4.544 -5.729 1.00 33.42 H new ATOM 0 HG12 VAL A 87 -9.000 3.052 -5.091 1.00 33.42 H new ATOM 0 HG13 VAL A 87 -7.985 4.484 -5.384 1.00 33.42 H new ATOM 0 HG21 VAL A 87 -9.354 5.230 -8.045 1.00 70.22 H new ATOM 0 HG22 VAL A 87 -7.585 5.209 -7.850 1.00 70.22 H new ATOM 0 HG23 VAL A 87 -8.350 4.248 -9.138 1.00 70.22 H new ATOM 1056 N ALA A 88 -6.929 1.232 -5.238 1.00 61.02 N ATOM 1057 CA ALA A 88 -7.086 0.120 -4.331 1.00 63.45 C ATOM 1058 C ALA A 88 -7.890 0.554 -3.120 1.00 65.22 C ATOM 1059 O ALA A 88 -7.719 1.665 -2.631 1.00 32.33 O ATOM 1060 CB ALA A 88 -5.725 -0.414 -3.901 1.00 60.25 C ATOM 0 H ALA A 88 -6.306 1.965 -4.898 1.00 61.02 H new ATOM 0 HA ALA A 88 -7.621 -0.680 -4.843 1.00 63.45 H new ATOM 0 HB1 ALA A 88 -5.862 -1.252 -3.217 1.00 60.25 H new ATOM 0 HB2 ALA A 88 -5.172 -0.748 -4.778 1.00 60.25 H new ATOM 0 HB3 ALA A 88 -5.166 0.376 -3.399 1.00 60.25 H new ATOM 1066 N LYS A 89 -8.800 -0.300 -2.683 1.00 4.23 N ATOM 1067 CA LYS A 89 -9.581 -0.031 -1.497 1.00 42.34 C ATOM 1068 C LYS A 89 -8.901 -0.684 -0.314 1.00 1.41 C ATOM 1069 O LYS A 89 -8.650 -1.897 -0.319 1.00 51.32 O ATOM 1070 CB LYS A 89 -11.020 -0.520 -1.661 1.00 34.10 C ATOM 1071 CG LYS A 89 -11.715 0.075 -2.869 1.00 53.03 C ATOM 1072 CD LYS A 89 -13.112 -0.477 -3.044 1.00 2.41 C ATOM 1073 CE LYS A 89 -13.751 0.043 -4.324 1.00 53.22 C ATOM 1074 NZ LYS A 89 -13.005 -0.389 -5.534 1.00 60.40 N ATOM 0 H LYS A 89 -9.014 -1.188 -3.137 1.00 4.23 H new ATOM 0 HA LYS A 89 -9.637 1.045 -1.330 1.00 42.34 H new ATOM 0 HB2 LYS A 89 -11.021 -1.607 -1.747 1.00 34.10 H new ATOM 0 HB3 LYS A 89 -11.587 -0.271 -0.764 1.00 34.10 H new ATOM 0 HG2 LYS A 89 -11.763 1.159 -2.763 1.00 53.03 H new ATOM 0 HG3 LYS A 89 -11.128 -0.132 -3.764 1.00 53.03 H new ATOM 0 HD2 LYS A 89 -13.075 -1.566 -3.069 1.00 2.41 H new ATOM 0 HD3 LYS A 89 -13.726 -0.198 -2.188 1.00 2.41 H new ATOM 0 HE2 LYS A 89 -14.780 -0.313 -4.386 1.00 53.22 H new ATOM 0 HE3 LYS A 89 -13.791 1.132 -4.293 1.00 53.22 H new ATOM 0 HZ1 LYS A 89 -13.607 -0.271 -6.374 1.00 60.40 H new ATOM 0 HZ2 LYS A 89 -12.147 0.190 -5.638 1.00 60.40 H new ATOM 0 HZ3 LYS A 89 -12.738 -1.389 -5.438 1.00 60.40 H new ATOM 1088 N GLU A 90 -8.641 0.094 0.697 1.00 11.02 N ATOM 1089 CA GLU A 90 -7.827 -0.314 1.793 1.00 1.22 C ATOM 1090 C GLU A 90 -8.208 0.473 3.030 1.00 32.21 C ATOM 1091 O GLU A 90 -8.980 1.425 2.956 1.00 1.25 O ATOM 1092 CB GLU A 90 -6.362 -0.049 1.433 1.00 14.21 C ATOM 1093 CG GLU A 90 -6.106 1.399 1.038 1.00 11.13 C ATOM 1094 CD GLU A 90 -4.692 1.667 0.628 1.00 11.40 C ATOM 1095 OE1 GLU A 90 -4.378 1.494 -0.569 1.00 1.05 O ATOM 1096 OE2 GLU A 90 -3.890 2.071 1.498 1.00 71.03 O ATOM 0 H GLU A 90 -8.998 1.046 0.779 1.00 11.02 H new ATOM 0 HA GLU A 90 -7.972 -1.375 1.996 1.00 1.22 H new ATOM 0 HB2 GLU A 90 -5.731 -0.306 2.284 1.00 14.21 H new ATOM 0 HB3 GLU A 90 -6.070 -0.702 0.611 1.00 14.21 H new ATOM 0 HG2 GLU A 90 -6.771 1.666 0.216 1.00 11.13 H new ATOM 0 HG3 GLU A 90 -6.361 2.046 1.877 1.00 11.13 H new ATOM 1103 N ARG A 91 -7.700 0.053 4.141 1.00 33.54 N ATOM 1104 CA ARG A 91 -7.908 0.709 5.394 1.00 13.30 C ATOM 1105 C ARG A 91 -6.584 0.756 6.096 1.00 1.52 C ATOM 1106 O ARG A 91 -5.790 -0.194 5.968 1.00 35.20 O ATOM 1107 CB ARG A 91 -8.876 -0.105 6.271 1.00 25.52 C ATOM 1108 CG ARG A 91 -9.225 0.566 7.595 1.00 30.54 C ATOM 1109 CD ARG A 91 -10.021 -0.348 8.513 1.00 62.00 C ATOM 1110 NE ARG A 91 -10.469 0.375 9.712 1.00 32.43 N ATOM 1111 CZ ARG A 91 -10.350 -0.047 10.989 1.00 3.10 C ATOM 1112 NH1 ARG A 91 -9.667 -1.157 11.292 1.00 61.33 N ATOM 1113 NH2 ARG A 91 -10.880 0.684 11.969 1.00 11.11 N ATOM 0 H ARG A 91 -7.113 -0.778 4.207 1.00 33.54 H new ATOM 0 HA ARG A 91 -8.323 1.703 5.226 1.00 13.30 H new ATOM 0 HB2 ARG A 91 -9.795 -0.283 5.712 1.00 25.52 H new ATOM 0 HB3 ARG A 91 -8.433 -1.080 6.475 1.00 25.52 H new ATOM 0 HG2 ARG A 91 -8.308 0.872 8.097 1.00 30.54 H new ATOM 0 HG3 ARG A 91 -9.799 1.472 7.400 1.00 30.54 H new ATOM 0 HD2 ARG A 91 -10.884 -0.745 7.979 1.00 62.00 H new ATOM 0 HD3 ARG A 91 -9.408 -1.200 8.805 1.00 62.00 H new ATOM 0 HE ARG A 91 -10.912 1.282 9.565 1.00 32.43 H new ATOM 0 HH11 ARG A 91 -9.224 -1.701 10.552 1.00 61.33 H new ATOM 0 HH12 ARG A 91 -9.589 -1.459 12.263 1.00 61.33 H new ATOM 0 HH21 ARG A 91 -11.369 1.552 11.750 1.00 11.11 H new ATOM 0 HH22 ARG A 91 -10.797 0.376 12.938 1.00 11.11 H new ATOM 1127 N ILE A 92 -6.317 1.825 6.813 1.00 70.44 N ATOM 1128 CA ILE A 92 -5.126 1.862 7.625 1.00 15.25 C ATOM 1129 C ILE A 92 -5.416 1.011 8.841 1.00 10.11 C ATOM 1130 O ILE A 92 -6.360 1.282 9.566 1.00 3.21 O ATOM 1131 CB ILE A 92 -4.791 3.316 8.075 1.00 4.43 C ATOM 1132 CG1 ILE A 92 -4.491 4.203 6.849 1.00 60.21 C ATOM 1133 CG2 ILE A 92 -3.625 3.338 9.074 1.00 11.10 C ATOM 1134 CD1 ILE A 92 -4.169 5.646 7.186 1.00 52.44 C ATOM 0 H ILE A 92 -6.897 2.664 6.850 1.00 70.44 H new ATOM 0 HA ILE A 92 -4.270 1.494 7.060 1.00 15.25 H new ATOM 0 HB ILE A 92 -5.664 3.722 8.586 1.00 4.43 H new ATOM 0 HG12 ILE A 92 -3.652 3.774 6.302 1.00 60.21 H new ATOM 0 HG13 ILE A 92 -5.352 4.182 6.181 1.00 60.21 H new ATOM 0 HG21 ILE A 92 -3.417 4.367 9.368 1.00 11.10 H new ATOM 0 HG22 ILE A 92 -3.891 2.755 9.956 1.00 11.10 H new ATOM 0 HG23 ILE A 92 -2.739 2.907 8.608 1.00 11.10 H new ATOM 0 HD11 ILE A 92 -3.971 6.199 6.268 1.00 52.44 H new ATOM 0 HD12 ILE A 92 -5.015 6.096 7.705 1.00 52.44 H new ATOM 0 HD13 ILE A 92 -3.289 5.682 7.828 1.00 52.44 H new ATOM 1146 N GLU A 93 -4.632 -0.003 9.065 1.00 62.34 N ATOM 1147 CA GLU A 93 -4.907 -0.881 10.176 1.00 12.54 C ATOM 1148 C GLU A 93 -3.887 -0.679 11.286 1.00 65.32 C ATOM 1149 O GLU A 93 -4.235 -0.616 12.460 1.00 32.00 O ATOM 1150 CB GLU A 93 -4.944 -2.337 9.693 1.00 4.15 C ATOM 1151 CG GLU A 93 -5.374 -3.343 10.746 1.00 24.24 C ATOM 1152 CD GLU A 93 -6.733 -3.015 11.329 1.00 15.52 C ATOM 1153 OE1 GLU A 93 -7.756 -3.180 10.628 1.00 74.32 O ATOM 1154 OE2 GLU A 93 -6.789 -2.564 12.496 1.00 22.41 O ATOM 0 H GLU A 93 -3.812 -0.244 8.509 1.00 62.34 H new ATOM 0 HA GLU A 93 -5.885 -0.639 10.591 1.00 12.54 H new ATOM 0 HB2 GLU A 93 -5.624 -2.407 8.844 1.00 4.15 H new ATOM 0 HB3 GLU A 93 -3.953 -2.611 9.331 1.00 4.15 H new ATOM 0 HG2 GLU A 93 -5.401 -4.339 10.305 1.00 24.24 H new ATOM 0 HG3 GLU A 93 -4.634 -3.368 11.546 1.00 24.24 H new ATOM 1161 N ALA A 94 -2.648 -0.534 10.912 1.00 60.24 N ATOM 1162 CA ALA A 94 -1.592 -0.327 11.869 1.00 44.22 C ATOM 1163 C ALA A 94 -0.529 0.519 11.244 1.00 44.42 C ATOM 1164 O ALA A 94 -0.235 0.363 10.064 1.00 24.13 O ATOM 1165 CB ALA A 94 -1.012 -1.658 12.330 1.00 52.21 C ATOM 0 H ALA A 94 -2.339 -0.555 9.940 1.00 60.24 H new ATOM 0 HA ALA A 94 -1.995 0.181 12.745 1.00 44.22 H new ATOM 0 HB1 ALA A 94 -0.216 -1.477 13.052 1.00 52.21 H new ATOM 0 HB2 ALA A 94 -1.796 -2.255 12.796 1.00 52.21 H new ATOM 0 HB3 ALA A 94 -0.608 -2.196 11.472 1.00 52.21 H new ATOM 1171 N VAL A 95 0.026 1.411 12.002 1.00 5.01 N ATOM 1172 CA VAL A 95 1.057 2.280 11.515 1.00 4.32 C ATOM 1173 C VAL A 95 2.058 2.585 12.624 1.00 41.05 C ATOM 1174 O VAL A 95 1.687 3.037 13.711 1.00 75.51 O ATOM 1175 CB VAL A 95 0.476 3.598 10.884 1.00 2.23 C ATOM 1176 CG1 VAL A 95 -0.369 4.392 11.878 1.00 4.01 C ATOM 1177 CG2 VAL A 95 1.587 4.463 10.294 1.00 1.43 C ATOM 0 H VAL A 95 -0.222 1.560 12.980 1.00 5.01 H new ATOM 0 HA VAL A 95 1.578 1.759 10.712 1.00 4.32 H new ATOM 0 HB VAL A 95 -0.187 3.295 10.073 1.00 2.23 H new ATOM 0 HG11 VAL A 95 -0.748 5.293 11.395 1.00 4.01 H new ATOM 0 HG12 VAL A 95 -1.207 3.781 12.213 1.00 4.01 H new ATOM 0 HG13 VAL A 95 0.244 4.670 12.736 1.00 4.01 H new ATOM 0 HG21 VAL A 95 1.155 5.367 9.865 1.00 1.43 H new ATOM 0 HG22 VAL A 95 2.292 4.735 11.079 1.00 1.43 H new ATOM 0 HG23 VAL A 95 2.108 3.905 9.516 1.00 1.43 H new ATOM 1187 N GLU A 96 3.300 2.293 12.357 1.00 75.15 N ATOM 1188 CA GLU A 96 4.374 2.538 13.288 1.00 65.01 C ATOM 1189 C GLU A 96 5.212 3.670 12.755 1.00 62.02 C ATOM 1190 O GLU A 96 5.844 3.523 11.704 1.00 40.30 O ATOM 1191 CB GLU A 96 5.271 1.309 13.418 1.00 51.13 C ATOM 1192 CG GLU A 96 4.601 0.065 13.964 1.00 71.34 C ATOM 1193 CD GLU A 96 4.148 0.222 15.389 1.00 52.55 C ATOM 1194 OE1 GLU A 96 4.939 -0.043 16.293 1.00 33.20 O ATOM 1195 OE2 GLU A 96 2.994 0.592 15.627 1.00 43.43 O ATOM 0 H GLU A 96 3.602 1.873 11.478 1.00 75.15 H new ATOM 0 HA GLU A 96 3.948 2.776 14.263 1.00 65.01 H new ATOM 0 HB2 GLU A 96 5.683 1.077 12.436 1.00 51.13 H new ATOM 0 HB3 GLU A 96 6.111 1.561 14.065 1.00 51.13 H new ATOM 0 HG2 GLU A 96 3.742 -0.182 13.340 1.00 71.34 H new ATOM 0 HG3 GLU A 96 5.294 -0.773 13.899 1.00 71.34 H new ATOM 1202 N PRO A 97 5.212 4.818 13.419 1.00 11.14 N ATOM 1203 CA PRO A 97 6.029 5.952 13.008 1.00 34.13 C ATOM 1204 C PRO A 97 7.527 5.655 13.141 1.00 3.44 C ATOM 1205 O PRO A 97 8.306 5.909 12.224 1.00 34.42 O ATOM 1206 CB PRO A 97 5.627 7.066 13.985 1.00 21.21 C ATOM 1207 CG PRO A 97 4.327 6.625 14.564 1.00 70.34 C ATOM 1208 CD PRO A 97 4.388 5.134 14.602 1.00 75.42 C ATOM 0 HA PRO A 97 5.868 6.209 11.961 1.00 34.13 H new ATOM 0 HB2 PRO A 97 6.380 7.199 14.762 1.00 21.21 H new ATOM 0 HB3 PRO A 97 5.526 8.022 13.472 1.00 21.21 H new ATOM 0 HG2 PRO A 97 4.183 7.037 15.563 1.00 70.34 H new ATOM 0 HG3 PRO A 97 3.491 6.967 13.955 1.00 70.34 H new ATOM 0 HD2 PRO A 97 4.843 4.770 15.523 1.00 75.42 H new ATOM 0 HD3 PRO A 97 3.397 4.685 14.538 1.00 75.42 H new ATOM 1216 N ASP A 98 7.915 5.096 14.271 1.00 52.32 N ATOM 1217 CA ASP A 98 9.320 4.845 14.554 1.00 5.42 C ATOM 1218 C ASP A 98 9.830 3.598 13.860 1.00 4.33 C ATOM 1219 O ASP A 98 10.973 3.561 13.398 1.00 53.40 O ATOM 1220 CB ASP A 98 9.576 4.758 16.059 1.00 73.13 C ATOM 1221 CG ASP A 98 9.205 6.020 16.797 1.00 52.14 C ATOM 1222 OD1 ASP A 98 10.065 6.921 16.938 1.00 11.20 O ATOM 1223 OD2 ASP A 98 8.051 6.130 17.251 1.00 74.11 O ATOM 0 H ASP A 98 7.277 4.805 15.012 1.00 52.32 H new ATOM 0 HA ASP A 98 9.875 5.695 14.155 1.00 5.42 H new ATOM 0 HB2 ASP A 98 9.008 3.924 16.470 1.00 73.13 H new ATOM 0 HB3 ASP A 98 10.630 4.541 16.230 1.00 73.13 H new ATOM 1228 N LYS A 99 8.988 2.575 13.761 1.00 44.20 N ATOM 1229 CA LYS A 99 9.399 1.321 13.118 1.00 32.24 C ATOM 1230 C LYS A 99 9.199 1.383 11.627 1.00 51.23 C ATOM 1231 O LYS A 99 9.613 0.474 10.897 1.00 54.50 O ATOM 1232 CB LYS A 99 8.639 0.134 13.676 1.00 34.14 C ATOM 1233 CG LYS A 99 8.814 -0.044 15.152 1.00 71.05 C ATOM 1234 CD LYS A 99 8.217 -1.336 15.608 1.00 62.01 C ATOM 1235 CE LYS A 99 8.417 -1.532 17.100 1.00 20.41 C ATOM 1236 NZ LYS A 99 7.852 -2.808 17.579 1.00 70.05 N ATOM 0 H LYS A 99 8.030 2.582 14.110 1.00 44.20 H new ATOM 0 HA LYS A 99 10.460 1.191 13.332 1.00 32.24 H new ATOM 0 HB2 LYS A 99 7.578 0.255 13.455 1.00 34.14 H new ATOM 0 HB3 LYS A 99 8.969 -0.771 13.167 1.00 34.14 H new ATOM 0 HG2 LYS A 99 9.875 -0.021 15.402 1.00 71.05 H new ATOM 0 HG3 LYS A 99 8.344 0.785 15.681 1.00 71.05 H new ATOM 0 HD2 LYS A 99 7.152 -1.351 15.375 1.00 62.01 H new ATOM 0 HD3 LYS A 99 8.673 -2.163 15.065 1.00 62.01 H new ATOM 0 HE2 LYS A 99 9.482 -1.501 17.328 1.00 20.41 H new ATOM 0 HE3 LYS A 99 7.951 -0.706 17.638 1.00 20.41 H new ATOM 0 HZ1 LYS A 99 8.013 -2.896 18.603 1.00 70.05 H new ATOM 0 HZ2 LYS A 99 6.830 -2.829 17.386 1.00 70.05 H new ATOM 0 HZ3 LYS A 99 8.314 -3.599 17.086 1.00 70.05 H new ATOM 1250 N ASN A 100 8.561 2.461 11.198 1.00 1.15 N ATOM 1251 CA ASN A 100 8.213 2.729 9.803 1.00 22.41 C ATOM 1252 C ASN A 100 7.476 1.540 9.197 1.00 14.24 C ATOM 1253 O ASN A 100 8.013 0.787 8.367 1.00 43.02 O ATOM 1254 CB ASN A 100 9.426 3.146 8.959 1.00 33.52 C ATOM 1255 CG ASN A 100 9.036 3.662 7.583 1.00 14.21 C ATOM 1256 OD1 ASN A 100 7.971 4.243 7.404 1.00 25.25 O ATOM 1257 ND2 ASN A 100 9.887 3.462 6.618 1.00 73.32 N ATOM 0 H ASN A 100 8.259 3.202 11.830 1.00 1.15 H new ATOM 0 HA ASN A 100 7.539 3.585 9.795 1.00 22.41 H new ATOM 0 HB2 ASN A 100 9.982 3.920 9.488 1.00 33.52 H new ATOM 0 HB3 ASN A 100 10.095 2.293 8.846 1.00 33.52 H new ATOM 0 HD21 ASN A 100 9.677 3.793 5.676 1.00 73.32 H new ATOM 0 HD22 ASN A 100 10.764 2.975 6.804 1.00 73.32 H new ATOM 1264 N LEU A 101 6.284 1.340 9.687 1.00 31.34 N ATOM 1265 CA LEU A 101 5.441 0.238 9.293 1.00 14.25 C ATOM 1266 C LEU A 101 4.063 0.729 8.995 1.00 2.53 C ATOM 1267 O LEU A 101 3.562 1.626 9.672 1.00 42.33 O ATOM 1268 CB LEU A 101 5.423 -0.858 10.421 1.00 65.02 C ATOM 1269 CG LEU A 101 4.397 -2.037 10.317 1.00 53.42 C ATOM 1270 CD1 LEU A 101 4.775 -3.133 11.264 1.00 41.14 C ATOM 1271 CD2 LEU A 101 2.978 -1.599 10.703 1.00 12.14 C ATOM 0 H LEU A 101 5.860 1.950 10.386 1.00 31.34 H new ATOM 0 HA LEU A 101 5.842 -0.216 8.387 1.00 14.25 H new ATOM 0 HB2 LEU A 101 6.421 -1.294 10.473 1.00 65.02 H new ATOM 0 HB3 LEU A 101 5.247 -0.351 11.370 1.00 65.02 H new ATOM 0 HG LEU A 101 4.416 -2.371 9.280 1.00 53.42 H new ATOM 0 HD11 LEU A 101 4.055 -3.948 11.184 1.00 41.14 H new ATOM 0 HD12 LEU A 101 5.770 -3.502 11.015 1.00 41.14 H new ATOM 0 HD13 LEU A 101 4.775 -2.749 12.284 1.00 41.14 H new ATOM 0 HD21 LEU A 101 2.299 -2.447 10.617 1.00 12.14 H new ATOM 0 HD22 LEU A 101 2.976 -1.236 11.731 1.00 12.14 H new ATOM 0 HD23 LEU A 101 2.649 -0.802 10.036 1.00 12.14 H new ATOM 1283 N ILE A 102 3.460 0.156 7.996 1.00 34.52 N ATOM 1284 CA ILE A 102 2.092 0.426 7.682 1.00 43.13 C ATOM 1285 C ILE A 102 1.391 -0.861 7.225 1.00 51.41 C ATOM 1286 O ILE A 102 1.836 -1.549 6.294 1.00 20.15 O ATOM 1287 CB ILE A 102 1.939 1.577 6.637 1.00 65.31 C ATOM 1288 CG1 ILE A 102 0.470 1.809 6.223 1.00 72.12 C ATOM 1289 CG2 ILE A 102 2.818 1.357 5.433 1.00 33.14 C ATOM 1290 CD1 ILE A 102 -0.434 2.264 7.347 1.00 21.00 C ATOM 0 H ILE A 102 3.908 -0.516 7.373 1.00 34.52 H new ATOM 0 HA ILE A 102 1.603 0.779 8.590 1.00 43.13 H new ATOM 0 HB ILE A 102 2.275 2.488 7.132 1.00 65.31 H new ATOM 0 HG12 ILE A 102 0.443 2.554 5.428 1.00 72.12 H new ATOM 0 HG13 ILE A 102 0.073 0.884 5.806 1.00 72.12 H new ATOM 0 HG21 ILE A 102 2.683 2.178 4.729 1.00 33.14 H new ATOM 0 HG22 ILE A 102 3.861 1.315 5.747 1.00 33.14 H new ATOM 0 HG23 ILE A 102 2.546 0.418 4.951 1.00 33.14 H new ATOM 0 HD11 ILE A 102 -1.446 2.402 6.967 1.00 21.00 H new ATOM 0 HD12 ILE A 102 -0.442 1.511 8.135 1.00 21.00 H new ATOM 0 HD13 ILE A 102 -0.066 3.207 7.751 1.00 21.00 H new ATOM 1302 N THR A 103 0.352 -1.196 7.928 1.00 22.01 N ATOM 1303 CA THR A 103 -0.481 -2.326 7.617 1.00 1.50 C ATOM 1304 C THR A 103 -1.731 -1.880 6.850 1.00 23.22 C ATOM 1305 O THR A 103 -2.502 -1.022 7.323 1.00 55.24 O ATOM 1306 CB THR A 103 -0.923 -3.027 8.918 1.00 42.23 C ATOM 1307 OG1 THR A 103 0.235 -3.429 9.660 1.00 42.24 O ATOM 1308 CG2 THR A 103 -1.777 -4.248 8.620 1.00 11.31 C ATOM 0 H THR A 103 0.050 -0.681 8.755 1.00 22.01 H new ATOM 0 HA THR A 103 0.096 -3.014 6.999 1.00 1.50 H new ATOM 0 HB THR A 103 -1.518 -2.324 9.501 1.00 42.23 H new ATOM 0 HG1 THR A 103 -0.037 -4.009 10.402 1.00 42.24 H new ATOM 0 HG21 THR A 103 -2.074 -4.722 9.556 1.00 11.31 H new ATOM 0 HG22 THR A 103 -2.667 -3.944 8.069 1.00 11.31 H new ATOM 0 HG23 THR A 103 -1.204 -4.956 8.021 1.00 11.31 H new ATOM 1316 N PHE A 104 -1.917 -2.470 5.688 1.00 34.42 N ATOM 1317 CA PHE A 104 -3.038 -2.208 4.828 1.00 42.10 C ATOM 1318 C PHE A 104 -4.022 -3.363 4.950 1.00 50.34 C ATOM 1319 O PHE A 104 -3.623 -4.535 5.019 1.00 22.32 O ATOM 1320 CB PHE A 104 -2.581 -2.109 3.363 1.00 2.23 C ATOM 1321 CG PHE A 104 -1.538 -1.071 3.085 1.00 44.32 C ATOM 1322 CD1 PHE A 104 -1.860 0.270 3.064 1.00 3.51 C ATOM 1323 CD2 PHE A 104 -0.236 -1.445 2.823 1.00 71.35 C ATOM 1324 CE1 PHE A 104 -0.900 1.223 2.788 1.00 64.32 C ATOM 1325 CE2 PHE A 104 0.724 -0.501 2.550 1.00 31.24 C ATOM 1326 CZ PHE A 104 0.393 0.836 2.531 1.00 34.55 C ATOM 0 H PHE A 104 -1.271 -3.163 5.311 1.00 34.42 H new ATOM 0 HA PHE A 104 -3.501 -1.266 5.122 1.00 42.10 H new ATOM 0 HB2 PHE A 104 -2.194 -3.080 3.054 1.00 2.23 H new ATOM 0 HB3 PHE A 104 -3.452 -1.900 2.742 1.00 2.23 H new ATOM 0 HD1 PHE A 104 -2.875 0.578 3.266 1.00 3.51 H new ATOM 0 HD2 PHE A 104 0.031 -2.491 2.833 1.00 71.35 H new ATOM 0 HE1 PHE A 104 -1.165 2.270 2.774 1.00 64.32 H new ATOM 0 HE2 PHE A 104 1.740 -0.808 2.350 1.00 31.24 H new ATOM 0 HZ PHE A 104 1.148 1.578 2.315 1.00 34.55 H new ATOM 1336 N ARG A 105 -5.268 -3.036 4.993 1.00 43.31 N ATOM 1337 CA ARG A 105 -6.339 -4.006 5.096 1.00 32.41 C ATOM 1338 C ARG A 105 -7.322 -3.799 3.973 1.00 3.40 C ATOM 1339 O ARG A 105 -7.892 -2.726 3.852 1.00 24.54 O ATOM 1340 CB ARG A 105 -6.996 -3.868 6.492 1.00 53.02 C ATOM 1341 CG ARG A 105 -8.332 -4.589 6.738 1.00 12.41 C ATOM 1342 CD ARG A 105 -8.343 -6.027 6.279 1.00 20.52 C ATOM 1343 NE ARG A 105 -9.453 -6.786 6.891 1.00 53.41 N ATOM 1344 CZ ARG A 105 -10.183 -7.746 6.295 1.00 52.12 C ATOM 1345 NH1 ARG A 105 -10.121 -7.928 4.990 1.00 34.02 N ATOM 1346 NH2 ARG A 105 -11.024 -8.472 7.011 1.00 43.24 N ATOM 0 H ARG A 105 -5.593 -2.070 4.958 1.00 43.31 H new ATOM 0 HA ARG A 105 -5.957 -5.022 5.000 1.00 32.41 H new ATOM 0 HB2 ARG A 105 -6.282 -4.227 7.233 1.00 53.02 H new ATOM 0 HB3 ARG A 105 -7.150 -2.806 6.685 1.00 53.02 H new ATOM 0 HG2 ARG A 105 -8.561 -4.556 7.803 1.00 12.41 H new ATOM 0 HG3 ARG A 105 -9.126 -4.047 6.224 1.00 12.41 H new ATOM 0 HD2 ARG A 105 -8.433 -6.062 5.193 1.00 20.52 H new ATOM 0 HD3 ARG A 105 -7.394 -6.498 6.536 1.00 20.52 H new ATOM 0 HE ARG A 105 -9.688 -6.561 7.858 1.00 53.41 H new ATOM 0 HH11 ARG A 105 -9.515 -7.337 4.421 1.00 34.02 H new ATOM 0 HH12 ARG A 105 -10.679 -8.659 4.550 1.00 34.02 H new ATOM 0 HH21 ARG A 105 -11.118 -8.304 8.013 1.00 43.24 H new ATOM 0 HH22 ARG A 105 -11.579 -9.201 6.562 1.00 43.24 H new ATOM 1360 N VAL A 106 -7.517 -4.815 3.134 1.00 72.23 N ATOM 1361 CA VAL A 106 -8.444 -4.675 2.052 1.00 23.22 C ATOM 1362 C VAL A 106 -9.850 -4.816 2.639 1.00 71.14 C ATOM 1363 O VAL A 106 -10.135 -5.771 3.350 1.00 40.12 O ATOM 1364 CB VAL A 106 -8.192 -5.734 0.904 1.00 53.54 C ATOM 1365 CG1 VAL A 106 -8.507 -7.134 1.336 1.00 52.53 C ATOM 1366 CG2 VAL A 106 -8.934 -5.366 -0.367 1.00 71.33 C ATOM 0 H VAL A 106 -7.049 -5.719 3.193 1.00 72.23 H new ATOM 0 HA VAL A 106 -8.317 -3.700 1.582 1.00 23.22 H new ATOM 0 HB VAL A 106 -7.125 -5.706 0.685 1.00 53.54 H new ATOM 0 HG11 VAL A 106 -8.317 -7.821 0.511 1.00 52.53 H new ATOM 0 HG12 VAL A 106 -7.878 -7.403 2.185 1.00 52.53 H new ATOM 0 HG13 VAL A 106 -9.556 -7.198 1.627 1.00 52.53 H new ATOM 0 HG21 VAL A 106 -8.737 -6.116 -1.133 1.00 71.33 H new ATOM 0 HG22 VAL A 106 -10.004 -5.326 -0.165 1.00 71.33 H new ATOM 0 HG23 VAL A 106 -8.594 -4.391 -0.717 1.00 71.33 H new ATOM 1376 N ILE A 107 -10.684 -3.852 2.415 1.00 65.01 N ATOM 1377 CA ILE A 107 -12.029 -3.909 2.977 1.00 32.31 C ATOM 1378 C ILE A 107 -13.041 -4.253 1.903 1.00 32.44 C ATOM 1379 O ILE A 107 -14.091 -4.839 2.176 1.00 4.52 O ATOM 1380 CB ILE A 107 -12.460 -2.584 3.736 1.00 1.23 C ATOM 1381 CG1 ILE A 107 -12.679 -1.375 2.791 1.00 45.33 C ATOM 1382 CG2 ILE A 107 -11.401 -2.209 4.762 1.00 54.10 C ATOM 1383 CD1 ILE A 107 -11.443 -0.904 2.082 1.00 50.44 C ATOM 0 H ILE A 107 -10.480 -3.022 1.859 1.00 65.01 H new ATOM 0 HA ILE A 107 -12.008 -4.699 3.728 1.00 32.31 H new ATOM 0 HB ILE A 107 -13.414 -2.805 4.214 1.00 1.23 H new ATOM 0 HG12 ILE A 107 -13.429 -1.644 2.047 1.00 45.33 H new ATOM 0 HG13 ILE A 107 -13.087 -0.547 3.370 1.00 45.33 H new ATOM 0 HG21 ILE A 107 -11.702 -1.298 5.280 1.00 54.10 H new ATOM 0 HG22 ILE A 107 -11.292 -3.018 5.484 1.00 54.10 H new ATOM 0 HG23 ILE A 107 -10.449 -2.041 4.258 1.00 54.10 H new ATOM 0 HD11 ILE A 107 -11.691 -0.056 1.443 1.00 50.44 H new ATOM 0 HD12 ILE A 107 -10.696 -0.600 2.816 1.00 50.44 H new ATOM 0 HD13 ILE A 107 -11.043 -1.713 1.471 1.00 50.44 H new ATOM 1395 N GLU A 108 -12.699 -3.917 0.691 1.00 52.43 N ATOM 1396 CA GLU A 108 -13.525 -4.121 -0.455 1.00 21.32 C ATOM 1397 C GLU A 108 -12.532 -4.004 -1.605 1.00 61.33 C ATOM 1398 O GLU A 108 -11.414 -3.552 -1.366 1.00 42.21 O ATOM 1399 CB GLU A 108 -14.571 -2.974 -0.496 1.00 35.31 C ATOM 1400 CG GLU A 108 -15.891 -3.283 -1.219 1.00 45.45 C ATOM 1401 CD GLU A 108 -15.737 -3.620 -2.664 1.00 72.22 C ATOM 1402 OE1 GLU A 108 -15.688 -2.711 -3.482 1.00 4.23 O ATOM 1403 OE2 GLU A 108 -15.656 -4.826 -2.998 1.00 5.14 O ATOM 0 H GLU A 108 -11.805 -3.478 0.471 1.00 52.43 H new ATOM 0 HA GLU A 108 -14.072 -5.063 -0.476 1.00 21.32 H new ATOM 0 HB2 GLU A 108 -14.802 -2.685 0.529 1.00 35.31 H new ATOM 0 HB3 GLU A 108 -14.112 -2.109 -0.976 1.00 35.31 H new ATOM 0 HG2 GLU A 108 -16.381 -4.115 -0.714 1.00 45.45 H new ATOM 0 HG3 GLU A 108 -16.552 -2.421 -1.128 1.00 45.45 H new ATOM 1410 N GLY A 109 -12.871 -4.408 -2.786 1.00 34.51 N ATOM 1411 CA GLY A 109 -11.934 -4.263 -3.863 1.00 51.12 C ATOM 1412 C GLY A 109 -11.880 -5.450 -4.775 1.00 71.43 C ATOM 1413 O GLY A 109 -12.744 -6.334 -4.720 1.00 0.02 O ATOM 0 H GLY A 109 -13.766 -4.832 -3.031 1.00 34.51 H new ATOM 0 HA2 GLY A 109 -12.196 -3.380 -4.445 1.00 51.12 H new ATOM 0 HA3 GLY A 109 -10.941 -4.088 -3.449 1.00 51.12 H new ATOM 1417 N ASP A 110 -10.847 -5.476 -5.583 1.00 31.44 N ATOM 1418 CA ASP A 110 -10.607 -6.509 -6.592 1.00 55.15 C ATOM 1419 C ASP A 110 -10.331 -7.868 -5.947 1.00 33.33 C ATOM 1420 O ASP A 110 -10.947 -8.876 -6.296 1.00 70.12 O ATOM 1421 CB ASP A 110 -9.404 -6.074 -7.456 1.00 1.12 C ATOM 1422 CG ASP A 110 -8.987 -7.073 -8.517 1.00 54.33 C ATOM 1423 OD1 ASP A 110 -9.523 -7.023 -9.644 1.00 14.22 O ATOM 1424 OD2 ASP A 110 -8.089 -7.892 -8.253 1.00 53.13 O ATOM 0 H ASP A 110 -10.120 -4.760 -5.565 1.00 31.44 H new ATOM 0 HA ASP A 110 -11.498 -6.620 -7.210 1.00 55.15 H new ATOM 0 HB2 ASP A 110 -9.647 -5.129 -7.942 1.00 1.12 H new ATOM 0 HB3 ASP A 110 -8.554 -5.885 -6.801 1.00 1.12 H new ATOM 1429 N LEU A 111 -9.446 -7.863 -4.970 1.00 72.11 N ATOM 1430 CA LEU A 111 -8.975 -9.087 -4.320 1.00 33.22 C ATOM 1431 C LEU A 111 -10.028 -9.729 -3.416 1.00 65.30 C ATOM 1432 O LEU A 111 -10.008 -10.929 -3.201 1.00 44.11 O ATOM 1433 CB LEU A 111 -7.703 -8.792 -3.517 1.00 34.23 C ATOM 1434 CG LEU A 111 -6.504 -8.265 -4.316 1.00 44.22 C ATOM 1435 CD1 LEU A 111 -5.349 -7.934 -3.389 1.00 15.14 C ATOM 1436 CD2 LEU A 111 -6.061 -9.280 -5.362 1.00 2.02 C ATOM 0 H LEU A 111 -9.027 -7.011 -4.598 1.00 72.11 H new ATOM 0 HA LEU A 111 -8.762 -9.805 -5.112 1.00 33.22 H new ATOM 0 HB2 LEU A 111 -7.947 -8.063 -2.745 1.00 34.23 H new ATOM 0 HB3 LEU A 111 -7.400 -9.707 -3.007 1.00 34.23 H new ATOM 0 HG LEU A 111 -6.815 -7.354 -4.828 1.00 44.22 H new ATOM 0 HD11 LEU A 111 -4.508 -7.562 -3.974 1.00 15.14 H new ATOM 0 HD12 LEU A 111 -5.662 -7.171 -2.677 1.00 15.14 H new ATOM 0 HD13 LEU A 111 -5.047 -8.832 -2.850 1.00 15.14 H new ATOM 0 HD21 LEU A 111 -5.210 -8.884 -5.916 1.00 2.02 H new ATOM 0 HD22 LEU A 111 -5.773 -10.208 -4.869 1.00 2.02 H new ATOM 0 HD23 LEU A 111 -6.883 -9.475 -6.051 1.00 2.02 H new ATOM 1448 N MET A 112 -10.963 -8.938 -2.925 1.00 2.14 N ATOM 1449 CA MET A 112 -11.987 -9.427 -1.968 1.00 65.12 C ATOM 1450 C MET A 112 -12.951 -10.441 -2.571 1.00 21.40 C ATOM 1451 O MET A 112 -13.701 -11.098 -1.849 1.00 23.14 O ATOM 1452 CB MET A 112 -12.775 -8.275 -1.372 1.00 33.12 C ATOM 1453 CG MET A 112 -12.037 -7.393 -0.354 1.00 65.23 C ATOM 1454 SD MET A 112 -11.968 -8.045 1.365 1.00 11.04 S ATOM 1455 CE MET A 112 -10.954 -9.517 1.258 1.00 60.10 C ATOM 0 H MET A 112 -11.050 -7.950 -3.162 1.00 2.14 H new ATOM 0 HA MET A 112 -11.428 -9.939 -1.184 1.00 65.12 H new ATOM 0 HB2 MET A 112 -13.119 -7.639 -2.188 1.00 33.12 H new ATOM 0 HB3 MET A 112 -13.663 -8.683 -0.889 1.00 33.12 H new ATOM 0 HG2 MET A 112 -11.017 -7.240 -0.706 1.00 65.23 H new ATOM 0 HG3 MET A 112 -12.517 -6.415 -0.333 1.00 65.23 H new ATOM 0 HE1 MET A 112 -10.272 -9.551 2.107 1.00 60.10 H new ATOM 0 HE2 MET A 112 -11.593 -10.400 1.269 1.00 60.10 H new ATOM 0 HE3 MET A 112 -10.380 -9.497 0.332 1.00 60.10 H new ATOM 1465 N LYS A 113 -12.948 -10.562 -3.873 1.00 1.52 N ATOM 1466 CA LYS A 113 -13.828 -11.502 -4.522 1.00 61.21 C ATOM 1467 C LYS A 113 -13.144 -12.857 -4.700 1.00 32.51 C ATOM 1468 O LYS A 113 -13.804 -13.879 -4.951 1.00 74.54 O ATOM 1469 CB LYS A 113 -14.337 -10.933 -5.846 1.00 71.44 C ATOM 1470 CG LYS A 113 -15.147 -9.643 -5.682 1.00 71.45 C ATOM 1471 CD LYS A 113 -16.414 -9.879 -4.853 1.00 5.31 C ATOM 1472 CE LYS A 113 -17.196 -8.590 -4.611 1.00 52.55 C ATOM 1473 NZ LYS A 113 -17.620 -7.929 -5.865 1.00 65.21 N ATOM 0 H LYS A 113 -12.351 -10.026 -4.503 1.00 1.52 H new ATOM 0 HA LYS A 113 -14.696 -11.667 -3.884 1.00 61.21 H new ATOM 0 HB2 LYS A 113 -13.487 -10.739 -6.500 1.00 71.44 H new ATOM 0 HB3 LYS A 113 -14.956 -11.682 -6.341 1.00 71.44 H new ATOM 0 HG2 LYS A 113 -14.531 -8.884 -5.200 1.00 71.45 H new ATOM 0 HG3 LYS A 113 -15.420 -9.256 -6.664 1.00 71.45 H new ATOM 0 HD2 LYS A 113 -17.053 -10.598 -5.366 1.00 5.31 H new ATOM 0 HD3 LYS A 113 -16.142 -10.322 -3.895 1.00 5.31 H new ATOM 0 HE2 LYS A 113 -18.076 -8.813 -4.008 1.00 52.55 H new ATOM 0 HE3 LYS A 113 -16.580 -7.901 -4.033 1.00 52.55 H new ATOM 0 HZ1 LYS A 113 -18.217 -7.108 -5.640 1.00 65.21 H new ATOM 0 HZ2 LYS A 113 -16.781 -7.613 -6.392 1.00 65.21 H new ATOM 0 HZ3 LYS A 113 -18.161 -8.601 -6.446 1.00 65.21 H new ATOM 1487 N GLU A 114 -11.829 -12.867 -4.549 1.00 15.15 N ATOM 1488 CA GLU A 114 -11.058 -14.109 -4.631 1.00 61.00 C ATOM 1489 C GLU A 114 -10.554 -14.524 -3.256 1.00 30.03 C ATOM 1490 O GLU A 114 -10.453 -15.710 -2.937 1.00 75.40 O ATOM 1491 CB GLU A 114 -9.862 -14.029 -5.609 1.00 62.02 C ATOM 1492 CG GLU A 114 -10.195 -13.949 -7.107 1.00 74.50 C ATOM 1493 CD GLU A 114 -10.837 -12.671 -7.545 1.00 22.04 C ATOM 1494 OE1 GLU A 114 -10.133 -11.660 -7.625 1.00 34.41 O ATOM 1495 OE2 GLU A 114 -12.032 -12.676 -7.889 1.00 62.41 O ATOM 0 H GLU A 114 -11.269 -12.034 -4.369 1.00 15.15 H new ATOM 0 HA GLU A 114 -11.747 -14.858 -5.021 1.00 61.00 H new ATOM 0 HB2 GLU A 114 -9.267 -13.155 -5.346 1.00 62.02 H new ATOM 0 HB3 GLU A 114 -9.232 -14.904 -5.447 1.00 62.02 H new ATOM 0 HG2 GLU A 114 -9.276 -14.090 -7.676 1.00 74.50 H new ATOM 0 HG3 GLU A 114 -10.857 -14.776 -7.361 1.00 74.50 H new ATOM 1502 N TYR A 115 -10.237 -13.552 -2.456 1.00 54.42 N ATOM 1503 CA TYR A 115 -9.740 -13.782 -1.131 1.00 40.43 C ATOM 1504 C TYR A 115 -10.773 -13.299 -0.155 1.00 44.12 C ATOM 1505 O TYR A 115 -11.381 -12.256 -0.366 1.00 73.12 O ATOM 1506 CB TYR A 115 -8.432 -13.007 -0.915 1.00 0.43 C ATOM 1507 CG TYR A 115 -7.369 -13.304 -1.949 1.00 33.22 C ATOM 1508 CD1 TYR A 115 -7.303 -12.574 -3.128 1.00 55.53 C ATOM 1509 CD2 TYR A 115 -6.442 -14.305 -1.754 1.00 32.23 C ATOM 1510 CE1 TYR A 115 -6.350 -12.837 -4.077 1.00 53.14 C ATOM 1511 CE2 TYR A 115 -5.479 -14.574 -2.699 1.00 54.22 C ATOM 1512 CZ TYR A 115 -5.444 -13.833 -3.864 1.00 1.54 C ATOM 1513 OH TYR A 115 -4.496 -14.092 -4.813 1.00 22.14 O ATOM 0 H TYR A 115 -10.316 -12.566 -2.706 1.00 54.42 H new ATOM 0 HA TYR A 115 -9.543 -14.844 -0.988 1.00 40.43 H new ATOM 0 HB2 TYR A 115 -8.648 -11.939 -0.926 1.00 0.43 H new ATOM 0 HB3 TYR A 115 -8.040 -13.243 0.074 1.00 0.43 H new ATOM 0 HD1 TYR A 115 -8.017 -11.783 -3.301 1.00 55.53 H new ATOM 0 HD2 TYR A 115 -6.472 -14.887 -0.845 1.00 32.23 H new ATOM 0 HE1 TYR A 115 -6.317 -12.259 -4.988 1.00 53.14 H new ATOM 0 HE2 TYR A 115 -4.756 -15.359 -2.531 1.00 54.22 H new ATOM 0 HH TYR A 115 -4.423 -13.326 -5.420 1.00 22.14 H new ATOM 1523 N LYS A 116 -10.977 -14.027 0.910 1.00 3.41 N ATOM 1524 CA LYS A 116 -11.975 -13.634 1.889 1.00 41.43 C ATOM 1525 C LYS A 116 -11.385 -12.742 2.959 1.00 20.35 C ATOM 1526 O LYS A 116 -12.094 -12.239 3.829 1.00 25.04 O ATOM 1527 CB LYS A 116 -12.715 -14.842 2.468 1.00 44.11 C ATOM 1528 CG LYS A 116 -11.839 -15.928 3.059 1.00 34.54 C ATOM 1529 CD LYS A 116 -12.673 -17.137 3.472 1.00 54.54 C ATOM 1530 CE LYS A 116 -13.695 -16.787 4.550 1.00 35.23 C ATOM 1531 NZ LYS A 116 -14.499 -17.962 4.961 1.00 64.33 N ATOM 0 H LYS A 116 -10.475 -14.888 1.128 1.00 3.41 H new ATOM 0 HA LYS A 116 -12.726 -13.039 1.369 1.00 41.43 H new ATOM 0 HB2 LYS A 116 -13.397 -14.490 3.242 1.00 44.11 H new ATOM 0 HB3 LYS A 116 -13.326 -15.282 1.680 1.00 44.11 H new ATOM 0 HG2 LYS A 116 -11.088 -16.232 2.330 1.00 34.54 H new ATOM 0 HG3 LYS A 116 -11.304 -15.538 3.925 1.00 34.54 H new ATOM 0 HD2 LYS A 116 -13.190 -17.536 2.599 1.00 54.54 H new ATOM 0 HD3 LYS A 116 -12.014 -17.923 3.839 1.00 54.54 H new ATOM 0 HE2 LYS A 116 -13.179 -16.380 5.419 1.00 35.23 H new ATOM 0 HE3 LYS A 116 -14.359 -16.006 4.179 1.00 35.23 H new ATOM 0 HZ1 LYS A 116 -15.180 -17.678 5.694 1.00 64.33 H new ATOM 0 HZ2 LYS A 116 -15.013 -18.336 4.138 1.00 64.33 H new ATOM 0 HZ3 LYS A 116 -13.869 -18.698 5.340 1.00 64.33 H new ATOM 1545 N SER A 117 -10.083 -12.549 2.880 1.00 22.25 N ATOM 1546 CA SER A 117 -9.367 -11.654 3.735 1.00 43.23 C ATOM 1547 C SER A 117 -7.972 -11.486 3.180 1.00 74.50 C ATOM 1548 O SER A 117 -7.394 -12.446 2.657 1.00 13.52 O ATOM 1549 CB SER A 117 -9.339 -12.181 5.164 1.00 14.12 C ATOM 1550 OG SER A 117 -8.690 -11.280 6.047 1.00 4.44 O ATOM 0 H SER A 117 -9.490 -13.026 2.201 1.00 22.25 H new ATOM 0 HA SER A 117 -9.864 -10.684 3.766 1.00 43.23 H new ATOM 0 HB2 SER A 117 -10.359 -12.354 5.507 1.00 14.12 H new ATOM 0 HB3 SER A 117 -8.827 -13.143 5.186 1.00 14.12 H new ATOM 0 HG SER A 117 -8.693 -11.651 6.954 1.00 4.44 H new ATOM 1556 N PHE A 118 -7.465 -10.277 3.244 1.00 62.41 N ATOM 1557 CA PHE A 118 -6.146 -9.950 2.766 1.00 61.24 C ATOM 1558 C PHE A 118 -5.619 -8.796 3.598 1.00 0.05 C ATOM 1559 O PHE A 118 -6.212 -7.700 3.624 1.00 51.43 O ATOM 1560 CB PHE A 118 -6.181 -9.585 1.263 1.00 14.13 C ATOM 1561 CG PHE A 118 -4.853 -9.255 0.643 1.00 41.32 C ATOM 1562 CD1 PHE A 118 -3.942 -10.249 0.352 1.00 64.20 C ATOM 1563 CD2 PHE A 118 -4.523 -7.947 0.347 1.00 21.24 C ATOM 1564 CE1 PHE A 118 -2.728 -9.948 -0.218 1.00 1.13 C ATOM 1565 CE2 PHE A 118 -3.307 -7.642 -0.228 1.00 34.11 C ATOM 1566 CZ PHE A 118 -2.409 -8.642 -0.507 1.00 45.50 C ATOM 0 H PHE A 118 -7.968 -9.481 3.637 1.00 62.41 H new ATOM 0 HA PHE A 118 -5.485 -10.811 2.868 1.00 61.24 H new ATOM 0 HB2 PHE A 118 -6.620 -10.419 0.715 1.00 14.13 H new ATOM 0 HB3 PHE A 118 -6.846 -8.731 1.130 1.00 14.13 H new ATOM 0 HD1 PHE A 118 -4.186 -11.277 0.575 1.00 64.20 H new ATOM 0 HD2 PHE A 118 -5.224 -7.155 0.568 1.00 21.24 H new ATOM 0 HE1 PHE A 118 -2.025 -10.737 -0.439 1.00 1.13 H new ATOM 0 HE2 PHE A 118 -3.061 -6.616 -0.459 1.00 34.11 H new ATOM 0 HZ PHE A 118 -1.454 -8.404 -0.952 1.00 45.50 H new ATOM 1576 N LEU A 119 -4.563 -9.050 4.299 1.00 24.44 N ATOM 1577 CA LEU A 119 -3.943 -8.089 5.158 1.00 31.23 C ATOM 1578 C LEU A 119 -2.470 -8.034 4.781 1.00 2.41 C ATOM 1579 O LEU A 119 -1.812 -9.072 4.700 1.00 73.21 O ATOM 1580 CB LEU A 119 -4.087 -8.588 6.603 1.00 43.02 C ATOM 1581 CG LEU A 119 -3.596 -7.668 7.711 1.00 22.33 C ATOM 1582 CD1 LEU A 119 -4.435 -6.402 7.766 1.00 53.30 C ATOM 1583 CD2 LEU A 119 -3.626 -8.392 9.045 1.00 73.21 C ATOM 0 H LEU A 119 -4.093 -9.955 4.291 1.00 24.44 H new ATOM 0 HA LEU A 119 -4.396 -7.102 5.063 1.00 31.23 H new ATOM 0 HB2 LEU A 119 -5.141 -8.800 6.783 1.00 43.02 H new ATOM 0 HB3 LEU A 119 -3.552 -9.534 6.688 1.00 43.02 H new ATOM 0 HG LEU A 119 -2.566 -7.382 7.496 1.00 22.33 H new ATOM 0 HD11 LEU A 119 -4.068 -5.757 8.565 1.00 53.30 H new ATOM 0 HD12 LEU A 119 -4.364 -5.877 6.814 1.00 53.30 H new ATOM 0 HD13 LEU A 119 -5.475 -6.663 7.959 1.00 53.30 H new ATOM 0 HD21 LEU A 119 -3.272 -7.723 9.830 1.00 73.21 H new ATOM 0 HD22 LEU A 119 -4.647 -8.704 9.267 1.00 73.21 H new ATOM 0 HD23 LEU A 119 -2.981 -9.269 8.998 1.00 73.21 H new ATOM 1595 N LEU A 120 -1.946 -6.871 4.549 1.00 24.22 N ATOM 1596 CA LEU A 120 -0.564 -6.776 4.154 1.00 75.31 C ATOM 1597 C LEU A 120 0.116 -5.651 4.870 1.00 41.21 C ATOM 1598 O LEU A 120 -0.438 -4.580 5.024 1.00 33.41 O ATOM 1599 CB LEU A 120 -0.366 -6.651 2.614 1.00 24.41 C ATOM 1600 CG LEU A 120 -0.883 -5.379 1.900 1.00 64.24 C ATOM 1601 CD1 LEU A 120 -0.446 -5.389 0.451 1.00 31.43 C ATOM 1602 CD2 LEU A 120 -2.399 -5.267 1.975 1.00 12.11 C ATOM 0 H LEU A 120 -2.441 -5.982 4.623 1.00 24.22 H new ATOM 0 HA LEU A 120 -0.099 -7.718 4.444 1.00 75.31 H new ATOM 0 HB2 LEU A 120 0.702 -6.734 2.410 1.00 24.41 H new ATOM 0 HB3 LEU A 120 -0.847 -7.511 2.148 1.00 24.41 H new ATOM 0 HG LEU A 120 -0.456 -4.516 2.411 1.00 64.24 H new ATOM 0 HD11 LEU A 120 -0.813 -4.491 -0.046 1.00 31.43 H new ATOM 0 HD12 LEU A 120 0.643 -5.413 0.399 1.00 31.43 H new ATOM 0 HD13 LEU A 120 -0.852 -6.270 -0.045 1.00 31.43 H new ATOM 0 HD21 LEU A 120 -2.723 -4.361 1.462 1.00 12.11 H new ATOM 0 HD22 LEU A 120 -2.852 -6.136 1.497 1.00 12.11 H new ATOM 0 HD23 LEU A 120 -2.709 -5.224 3.019 1.00 12.11 H new ATOM 1614 N THR A 121 1.290 -5.898 5.318 1.00 61.54 N ATOM 1615 CA THR A 121 2.032 -4.916 6.028 1.00 11.23 C ATOM 1616 C THR A 121 3.343 -4.655 5.329 1.00 12.03 C ATOM 1617 O THR A 121 4.019 -5.595 4.907 1.00 51.43 O ATOM 1618 CB THR A 121 2.311 -5.397 7.460 1.00 4.04 C ATOM 1619 OG1 THR A 121 1.068 -5.712 8.116 1.00 51.22 O ATOM 1620 CG2 THR A 121 3.038 -4.335 8.245 1.00 65.04 C ATOM 0 H THR A 121 1.769 -6.791 5.204 1.00 61.54 H new ATOM 0 HA THR A 121 1.447 -3.997 6.062 1.00 11.23 H new ATOM 0 HB THR A 121 2.938 -6.287 7.411 1.00 4.04 H new ATOM 0 HG1 THR A 121 0.815 -4.974 8.709 1.00 51.22 H new ATOM 0 HG21 THR A 121 3.226 -4.695 9.256 1.00 65.04 H new ATOM 0 HG22 THR A 121 3.986 -4.108 7.758 1.00 65.04 H new ATOM 0 HG23 THR A 121 2.428 -3.433 8.289 1.00 65.04 H new ATOM 1628 N ILE A 122 3.691 -3.405 5.184 1.00 75.34 N ATOM 1629 CA ILE A 122 4.958 -3.067 4.625 1.00 32.11 C ATOM 1630 C ILE A 122 5.769 -2.330 5.646 1.00 1.24 C ATOM 1631 O ILE A 122 5.249 -1.478 6.385 1.00 61.11 O ATOM 1632 CB ILE A 122 4.882 -2.252 3.310 1.00 55.45 C ATOM 1633 CG1 ILE A 122 4.212 -0.907 3.503 1.00 14.02 C ATOM 1634 CG2 ILE A 122 4.153 -3.038 2.259 1.00 60.22 C ATOM 1635 CD1 ILE A 122 4.230 -0.026 2.262 1.00 5.01 C ATOM 0 H ILE A 122 3.110 -2.609 5.447 1.00 75.34 H new ATOM 0 HA ILE A 122 5.436 -4.008 4.354 1.00 32.11 H new ATOM 0 HB ILE A 122 5.906 -2.063 2.988 1.00 55.45 H new ATOM 0 HG12 ILE A 122 3.178 -1.068 3.808 1.00 14.02 H new ATOM 0 HG13 ILE A 122 4.706 -0.379 4.319 1.00 14.02 H new ATOM 0 HG21 ILE A 122 4.105 -2.457 1.338 1.00 60.22 H new ATOM 0 HG22 ILE A 122 4.682 -3.972 2.071 1.00 60.22 H new ATOM 0 HG23 ILE A 122 3.142 -3.256 2.604 1.00 60.22 H new ATOM 0 HD11 ILE A 122 3.732 0.919 2.479 1.00 5.01 H new ATOM 0 HD12 ILE A 122 5.262 0.167 1.968 1.00 5.01 H new ATOM 0 HD13 ILE A 122 3.709 -0.532 1.449 1.00 5.01 H new ATOM 1647 N GLN A 123 7.002 -2.683 5.728 1.00 43.41 N ATOM 1648 CA GLN A 123 7.895 -2.074 6.650 1.00 32.12 C ATOM 1649 C GLN A 123 9.172 -1.747 5.913 1.00 4.25 C ATOM 1650 O GLN A 123 9.826 -2.638 5.352 1.00 13.31 O ATOM 1651 CB GLN A 123 8.113 -3.012 7.830 1.00 4.13 C ATOM 1652 CG GLN A 123 8.914 -2.429 8.957 1.00 34.24 C ATOM 1653 CD GLN A 123 8.909 -3.323 10.169 1.00 23.23 C ATOM 1654 OE1 GLN A 123 8.829 -4.553 10.060 1.00 70.42 O ATOM 1655 NE2 GLN A 123 8.970 -2.722 11.322 1.00 0.42 N ATOM 0 H GLN A 123 7.425 -3.410 5.151 1.00 43.41 H new ATOM 0 HA GLN A 123 7.492 -1.146 7.056 1.00 32.12 H new ATOM 0 HB2 GLN A 123 7.141 -3.321 8.215 1.00 4.13 H new ATOM 0 HB3 GLN A 123 8.615 -3.911 7.473 1.00 4.13 H new ATOM 0 HG2 GLN A 123 9.941 -2.269 8.628 1.00 34.24 H new ATOM 0 HG3 GLN A 123 8.509 -1.453 9.224 1.00 34.24 H new ATOM 0 HE21 GLN A 123 9.035 -1.705 11.364 1.00 0.42 H new ATOM 0 HE22 GLN A 123 8.953 -3.268 12.183 1.00 0.42 H new ATOM 1664 N VAL A 124 9.501 -0.481 5.872 1.00 14.12 N ATOM 1665 CA VAL A 124 10.611 -0.010 5.069 1.00 4.25 C ATOM 1666 C VAL A 124 11.761 0.433 5.956 1.00 44.22 C ATOM 1667 O VAL A 124 11.555 1.155 6.939 1.00 3.05 O ATOM 1668 CB VAL A 124 10.184 1.196 4.181 1.00 30.30 C ATOM 1669 CG1 VAL A 124 11.290 1.588 3.215 1.00 51.12 C ATOM 1670 CG2 VAL A 124 8.892 0.912 3.435 1.00 31.34 C ATOM 0 H VAL A 124 9.014 0.251 6.389 1.00 14.12 H new ATOM 0 HA VAL A 124 10.927 -0.838 4.434 1.00 4.25 H new ATOM 0 HB VAL A 124 10.003 2.039 4.848 1.00 30.30 H new ATOM 0 HG11 VAL A 124 10.962 2.433 2.609 1.00 51.12 H new ATOM 0 HG12 VAL A 124 12.181 1.869 3.777 1.00 51.12 H new ATOM 0 HG13 VAL A 124 11.522 0.744 2.565 1.00 51.12 H new ATOM 0 HG21 VAL A 124 8.626 1.776 2.826 1.00 31.34 H new ATOM 0 HG22 VAL A 124 9.027 0.042 2.792 1.00 31.34 H new ATOM 0 HG23 VAL A 124 8.095 0.713 4.151 1.00 31.34 H new ATOM 1680 N THR A 125 12.947 -0.005 5.644 1.00 24.40 N ATOM 1681 CA THR A 125 14.099 0.439 6.368 1.00 20.55 C ATOM 1682 C THR A 125 15.246 0.682 5.367 1.00 22.14 C ATOM 1683 O THR A 125 15.279 0.050 4.288 1.00 20.52 O ATOM 1684 CB THR A 125 14.532 -0.602 7.461 1.00 0.22 C ATOM 1685 OG1 THR A 125 15.404 0.023 8.397 1.00 63.41 O ATOM 1686 CG2 THR A 125 15.291 -1.754 6.838 1.00 55.44 C ATOM 0 H THR A 125 13.140 -0.668 4.894 1.00 24.40 H new ATOM 0 HA THR A 125 13.855 1.365 6.889 1.00 20.55 H new ATOM 0 HB THR A 125 13.628 -0.970 7.947 1.00 0.22 H new ATOM 0 HG1 THR A 125 15.672 -0.627 9.079 1.00 63.41 H new ATOM 0 HG21 THR A 125 15.580 -2.462 7.615 1.00 55.44 H new ATOM 0 HG22 THR A 125 14.656 -2.256 6.108 1.00 55.44 H new ATOM 0 HG23 THR A 125 16.184 -1.375 6.342 1.00 55.44 H new ATOM 1694 N PRO A 126 16.145 1.616 5.654 1.00 42.34 N ATOM 1695 CA PRO A 126 17.349 1.832 4.849 1.00 15.32 C ATOM 1696 C PRO A 126 18.291 0.622 4.975 1.00 21.31 C ATOM 1697 O PRO A 126 18.869 0.373 6.047 1.00 50.52 O ATOM 1698 CB PRO A 126 17.986 3.053 5.524 1.00 10.21 C ATOM 1699 CG PRO A 126 17.479 2.964 6.920 1.00 14.44 C ATOM 1700 CD PRO A 126 16.068 2.569 6.779 1.00 33.30 C ATOM 0 HA PRO A 126 17.145 1.969 3.787 1.00 15.32 H new ATOM 0 HB2 PRO A 126 19.075 3.013 5.486 1.00 10.21 H new ATOM 0 HB3 PRO A 126 17.684 3.984 5.043 1.00 10.21 H new ATOM 0 HG2 PRO A 126 18.040 2.231 7.499 1.00 14.44 H new ATOM 0 HG3 PRO A 126 17.573 3.919 7.438 1.00 14.44 H new ATOM 0 HD2 PRO A 126 15.679 2.105 7.685 1.00 33.30 H new ATOM 0 HD3 PRO A 126 15.424 3.419 6.554 1.00 33.30 H new ATOM 1708 N LYS A 127 18.427 -0.144 3.924 1.00 62.12 N ATOM 1709 CA LYS A 127 19.277 -1.301 3.997 1.00 70.50 C ATOM 1710 C LYS A 127 20.660 -1.001 3.365 1.00 12.23 C ATOM 1711 O LYS A 127 21.645 -0.959 4.095 1.00 74.23 O ATOM 1712 CB LYS A 127 18.566 -2.565 3.475 1.00 50.44 C ATOM 1713 CG LYS A 127 19.349 -3.852 3.606 1.00 10.13 C ATOM 1714 CD LYS A 127 18.547 -5.016 3.050 1.00 24.32 C ATOM 1715 CE LYS A 127 19.224 -6.358 3.318 1.00 32.45 C ATOM 1716 NZ LYS A 127 20.589 -6.444 2.740 1.00 33.13 N ATOM 0 H LYS A 127 17.970 0.008 3.025 1.00 62.12 H new ATOM 0 HA LYS A 127 19.487 -1.535 5.041 1.00 70.50 H new ATOM 0 HB2 LYS A 127 17.623 -2.678 4.010 1.00 50.44 H new ATOM 0 HB3 LYS A 127 18.320 -2.415 2.424 1.00 50.44 H new ATOM 0 HG2 LYS A 127 20.295 -3.766 3.072 1.00 10.13 H new ATOM 0 HG3 LYS A 127 19.589 -4.034 4.653 1.00 10.13 H new ATOM 0 HD2 LYS A 127 17.552 -5.016 3.496 1.00 24.32 H new ATOM 0 HD3 LYS A 127 18.415 -4.885 1.976 1.00 24.32 H new ATOM 0 HE2 LYS A 127 19.280 -6.522 4.394 1.00 32.45 H new ATOM 0 HE3 LYS A 127 18.609 -7.158 2.905 1.00 32.45 H new ATOM 0 HZ1 LYS A 127 20.965 -7.403 2.879 1.00 33.13 H new ATOM 0 HZ2 LYS A 127 20.549 -6.232 1.723 1.00 33.13 H new ATOM 0 HZ3 LYS A 127 21.210 -5.757 3.213 1.00 33.13 H new ATOM 1730 N PRO A 128 20.784 -0.775 2.007 1.00 10.34 N ATOM 1731 CA PRO A 128 22.048 -0.282 1.440 1.00 41.13 C ATOM 1732 C PRO A 128 22.359 1.119 1.988 1.00 34.10 C ATOM 1733 O PRO A 128 23.505 1.443 2.311 1.00 23.31 O ATOM 1734 CB PRO A 128 21.772 -0.201 -0.068 1.00 50.21 C ATOM 1735 CG PRO A 128 20.616 -1.096 -0.303 1.00 24.34 C ATOM 1736 CD PRO A 128 19.788 -1.037 0.944 1.00 54.42 C ATOM 0 HA PRO A 128 22.897 -0.921 1.683 1.00 41.13 H new ATOM 0 HB2 PRO A 128 21.546 0.821 -0.372 1.00 50.21 H new ATOM 0 HB3 PRO A 128 22.640 -0.521 -0.644 1.00 50.21 H new ATOM 0 HG2 PRO A 128 20.040 -0.770 -1.169 1.00 24.34 H new ATOM 0 HG3 PRO A 128 20.946 -2.115 -0.504 1.00 24.34 H new ATOM 0 HD2 PRO A 128 19.039 -0.247 0.892 1.00 54.42 H new ATOM 0 HD3 PRO A 128 19.254 -1.971 1.116 1.00 54.42 H new ATOM 1744 N GLY A 129 21.317 1.934 2.109 1.00 43.22 N ATOM 1745 CA GLY A 129 21.470 3.274 2.621 1.00 14.00 C ATOM 1746 C GLY A 129 21.444 4.293 1.512 1.00 63.32 C ATOM 1747 O GLY A 129 22.059 4.083 0.469 1.00 33.10 O ATOM 0 H GLY A 129 20.361 1.682 1.857 1.00 43.22 H new ATOM 0 HA2 GLY A 129 20.671 3.487 3.331 1.00 14.00 H new ATOM 0 HA3 GLY A 129 22.411 3.351 3.166 1.00 14.00 H new ATOM 1751 N GLY A 130 20.724 5.375 1.723 1.00 45.34 N ATOM 1752 CA GLY A 130 20.624 6.419 0.733 1.00 31.32 C ATOM 1753 C GLY A 130 19.609 6.073 -0.331 1.00 33.15 C ATOM 1754 O GLY A 130 18.409 6.016 -0.044 1.00 11.30 O ATOM 0 H GLY A 130 20.197 5.552 2.578 1.00 45.34 H new ATOM 0 HA2 GLY A 130 20.343 7.355 1.216 1.00 31.32 H new ATOM 0 HA3 GLY A 130 21.598 6.579 0.271 1.00 31.32 H new ATOM 1758 N PRO A 131 20.058 5.799 -1.563 1.00 72.41 N ATOM 1759 CA PRO A 131 19.178 5.421 -2.679 1.00 55.03 C ATOM 1760 C PRO A 131 18.803 3.938 -2.643 1.00 43.35 C ATOM 1761 O PRO A 131 18.533 3.313 -3.676 1.00 62.03 O ATOM 1762 CB PRO A 131 20.049 5.704 -3.880 1.00 52.34 C ATOM 1763 CG PRO A 131 21.432 5.420 -3.418 1.00 34.25 C ATOM 1764 CD PRO A 131 21.478 5.861 -1.987 1.00 34.54 C ATOM 0 HA PRO A 131 18.229 5.957 -2.666 1.00 55.03 H new ATOM 0 HB2 PRO A 131 19.776 5.072 -4.725 1.00 52.34 H new ATOM 0 HB3 PRO A 131 19.946 6.738 -4.209 1.00 52.34 H new ATOM 0 HG2 PRO A 131 21.665 4.359 -3.509 1.00 34.25 H new ATOM 0 HG3 PRO A 131 22.164 5.960 -4.018 1.00 34.25 H new ATOM 0 HD2 PRO A 131 22.106 5.205 -1.384 1.00 34.54 H new ATOM 0 HD3 PRO A 131 21.883 6.868 -1.890 1.00 34.54 H new ATOM 1772 N GLY A 132 18.762 3.406 -1.473 1.00 3.21 N ATOM 1773 CA GLY A 132 18.433 2.029 -1.305 1.00 53.01 C ATOM 1774 C GLY A 132 17.791 1.736 0.026 1.00 43.13 C ATOM 1775 O GLY A 132 18.463 1.747 1.073 1.00 63.22 O ATOM 0 H GLY A 132 18.954 3.908 -0.606 1.00 3.21 H new ATOM 0 HA2 GLY A 132 17.757 1.722 -2.104 1.00 53.01 H new ATOM 0 HA3 GLY A 132 19.338 1.430 -1.406 1.00 53.01 H new ATOM 1779 N SER A 133 16.516 1.490 0.000 1.00 31.10 N ATOM 1780 CA SER A 133 15.786 1.090 1.171 1.00 31.45 C ATOM 1781 C SER A 133 14.944 -0.126 0.814 1.00 41.34 C ATOM 1782 O SER A 133 14.463 -0.239 -0.317 1.00 33.33 O ATOM 1783 CB SER A 133 14.902 2.236 1.668 1.00 33.10 C ATOM 1784 OG SER A 133 15.680 3.396 1.929 1.00 2.25 O ATOM 0 H SER A 133 15.945 1.561 -0.842 1.00 31.10 H new ATOM 0 HA SER A 133 16.477 0.837 1.975 1.00 31.45 H new ATOM 0 HB2 SER A 133 14.140 2.464 0.922 1.00 33.10 H new ATOM 0 HB3 SER A 133 14.379 1.931 2.575 1.00 33.10 H new ATOM 0 HG SER A 133 15.654 3.989 1.149 1.00 2.25 H new ATOM 1790 N ILE A 134 14.777 -1.026 1.744 1.00 51.54 N ATOM 1791 CA ILE A 134 14.034 -2.225 1.483 1.00 51.10 C ATOM 1792 C ILE A 134 12.654 -2.144 2.068 1.00 4.53 C ATOM 1793 O ILE A 134 12.483 -1.809 3.254 1.00 64.31 O ATOM 1794 CB ILE A 134 14.744 -3.485 2.043 1.00 23.22 C ATOM 1795 CG1 ILE A 134 16.015 -3.739 1.280 1.00 33.41 C ATOM 1796 CG2 ILE A 134 13.841 -4.727 1.986 1.00 45.02 C ATOM 1797 CD1 ILE A 134 15.817 -4.042 -0.182 1.00 35.25 C ATOM 0 H ILE A 134 15.147 -0.950 2.691 1.00 51.54 H new ATOM 0 HA ILE A 134 13.968 -2.315 0.399 1.00 51.10 H new ATOM 0 HB ILE A 134 14.976 -3.294 3.091 1.00 23.22 H new ATOM 0 HG12 ILE A 134 16.660 -2.865 1.373 1.00 33.41 H new ATOM 0 HG13 ILE A 134 16.541 -4.574 1.743 1.00 33.41 H new ATOM 0 HG21 ILE A 134 14.378 -5.586 2.388 1.00 45.02 H new ATOM 0 HG22 ILE A 134 12.943 -4.551 2.578 1.00 45.02 H new ATOM 0 HG23 ILE A 134 13.561 -4.926 0.952 1.00 45.02 H new ATOM 0 HD11 ILE A 134 16.785 -4.212 -0.653 1.00 35.25 H new ATOM 0 HD12 ILE A 134 15.201 -4.935 -0.288 1.00 35.25 H new ATOM 0 HD13 ILE A 134 15.322 -3.199 -0.664 1.00 35.25 H new ATOM 1809 N VAL A 135 11.685 -2.428 1.262 1.00 75.40 N ATOM 1810 CA VAL A 135 10.332 -2.512 1.721 1.00 41.20 C ATOM 1811 C VAL A 135 9.973 -3.974 1.903 1.00 50.32 C ATOM 1812 O VAL A 135 9.968 -4.759 0.948 1.00 21.31 O ATOM 1813 CB VAL A 135 9.294 -1.752 0.815 1.00 71.54 C ATOM 1814 CG1 VAL A 135 9.344 -2.195 -0.627 1.00 70.41 C ATOM 1815 CG2 VAL A 135 7.884 -1.903 1.365 1.00 13.32 C ATOM 0 H VAL A 135 11.806 -2.609 0.265 1.00 75.40 H new ATOM 0 HA VAL A 135 10.272 -1.992 2.677 1.00 41.20 H new ATOM 0 HB VAL A 135 9.576 -0.699 0.837 1.00 71.54 H new ATOM 0 HG11 VAL A 135 8.607 -1.637 -1.205 1.00 70.41 H new ATOM 0 HG12 VAL A 135 10.339 -2.008 -1.031 1.00 70.41 H new ATOM 0 HG13 VAL A 135 9.122 -3.260 -0.688 1.00 70.41 H new ATOM 0 HG21 VAL A 135 7.184 -1.369 0.722 1.00 13.32 H new ATOM 0 HG22 VAL A 135 7.616 -2.959 1.395 1.00 13.32 H new ATOM 0 HG23 VAL A 135 7.840 -1.489 2.372 1.00 13.32 H new ATOM 1825 N HIS A 136 9.744 -4.346 3.129 1.00 12.54 N ATOM 1826 CA HIS A 136 9.410 -5.706 3.450 1.00 32.12 C ATOM 1827 C HIS A 136 7.916 -5.872 3.391 1.00 22.50 C ATOM 1828 O HIS A 136 7.191 -5.301 4.210 1.00 50.52 O ATOM 1829 CB HIS A 136 9.926 -6.095 4.849 1.00 40.41 C ATOM 1830 CG HIS A 136 11.418 -6.046 5.013 1.00 43.43 C ATOM 1831 ND1 HIS A 136 12.244 -7.108 4.727 1.00 63.41 N ATOM 1832 CD2 HIS A 136 12.230 -5.057 5.458 1.00 25.14 C ATOM 1833 CE1 HIS A 136 13.493 -6.776 4.992 1.00 12.35 C ATOM 1834 NE2 HIS A 136 13.511 -5.539 5.434 1.00 44.34 N ATOM 0 H HIS A 136 9.783 -3.719 3.933 1.00 12.54 H new ATOM 0 HA HIS A 136 9.889 -6.363 2.724 1.00 32.12 H new ATOM 0 HB2 HIS A 136 9.473 -5.430 5.584 1.00 40.41 H new ATOM 0 HB3 HIS A 136 9.584 -7.104 5.078 1.00 40.41 H new ATOM 0 HD2 HIS A 136 11.923 -4.071 5.773 1.00 25.14 H new ATOM 0 HE1 HIS A 136 14.356 -7.414 4.867 1.00 12.35 H new ATOM 0 HE2 HIS A 136 14.344 -5.022 5.714 1.00 44.34 H new ATOM 1843 N TRP A 137 7.461 -6.621 2.425 1.00 71.20 N ATOM 1844 CA TRP A 137 6.055 -6.869 2.244 1.00 3.42 C ATOM 1845 C TRP A 137 5.663 -8.132 2.957 1.00 63.04 C ATOM 1846 O TRP A 137 6.220 -9.201 2.696 1.00 1.41 O ATOM 1847 CB TRP A 137 5.712 -7.012 0.759 1.00 51.22 C ATOM 1848 CG TRP A 137 5.865 -5.766 -0.053 1.00 54.33 C ATOM 1849 CD1 TRP A 137 7.019 -5.200 -0.526 1.00 3.13 C ATOM 1850 CD2 TRP A 137 4.803 -4.941 -0.505 1.00 12.33 C ATOM 1851 NE1 TRP A 137 6.720 -4.070 -1.240 1.00 34.34 N ATOM 1852 CE2 TRP A 137 5.369 -3.887 -1.236 1.00 15.23 C ATOM 1853 CE3 TRP A 137 3.414 -4.993 -0.354 1.00 71.42 C ATOM 1854 CZ2 TRP A 137 4.596 -2.889 -1.817 1.00 22.43 C ATOM 1855 CZ3 TRP A 137 2.652 -4.005 -0.927 1.00 73.23 C ATOM 1856 CH2 TRP A 137 3.242 -2.968 -1.649 1.00 13.40 C ATOM 0 H TRP A 137 8.058 -7.080 1.736 1.00 71.20 H new ATOM 0 HA TRP A 137 5.507 -6.021 2.656 1.00 3.42 H new ATOM 0 HB2 TRP A 137 6.347 -7.787 0.329 1.00 51.22 H new ATOM 0 HB3 TRP A 137 4.682 -7.359 0.672 1.00 51.22 H new ATOM 0 HD1 TRP A 137 8.014 -5.586 -0.361 1.00 3.13 H new ATOM 0 HE1 TRP A 137 7.399 -3.463 -1.700 1.00 34.34 H new ATOM 0 HE3 TRP A 137 2.950 -5.794 0.202 1.00 71.42 H new ATOM 0 HZ2 TRP A 137 5.047 -2.084 -2.378 1.00 22.43 H new ATOM 0 HZ3 TRP A 137 1.578 -4.031 -0.817 1.00 73.23 H new ATOM 0 HH2 TRP A 137 2.612 -2.207 -2.087 1.00 13.40 H new ATOM 1867 N HIS A 138 4.724 -8.023 3.854 1.00 24.14 N ATOM 1868 CA HIS A 138 4.240 -9.177 4.566 1.00 54.23 C ATOM 1869 C HIS A 138 2.770 -9.318 4.244 1.00 25.13 C ATOM 1870 O HIS A 138 1.961 -8.496 4.670 1.00 52.32 O ATOM 1871 CB HIS A 138 4.417 -8.988 6.089 1.00 70.13 C ATOM 1872 CG HIS A 138 5.802 -8.591 6.518 1.00 34.42 C ATOM 1873 ND1 HIS A 138 6.816 -9.481 6.790 1.00 73.33 N ATOM 1874 CD2 HIS A 138 6.327 -7.368 6.720 1.00 40.33 C ATOM 1875 CE1 HIS A 138 7.892 -8.820 7.143 1.00 54.14 C ATOM 1876 NE2 HIS A 138 7.625 -7.535 7.108 1.00 13.34 N ATOM 0 H HIS A 138 4.275 -7.144 4.112 1.00 24.14 H new ATOM 0 HA HIS A 138 4.798 -10.065 4.269 1.00 54.23 H new ATOM 0 HB2 HIS A 138 3.714 -8.228 6.431 1.00 70.13 H new ATOM 0 HB3 HIS A 138 4.149 -9.918 6.590 1.00 70.13 H new ATOM 0 HD1 HIS A 138 6.742 -10.496 6.727 1.00 73.33 H new ATOM 0 HD2 HIS A 138 5.814 -6.425 6.597 1.00 40.33 H new ATOM 0 HE1 HIS A 138 8.840 -9.259 7.417 1.00 54.14 H new ATOM 1885 N LEU A 139 2.428 -10.336 3.510 1.00 43.13 N ATOM 1886 CA LEU A 139 1.068 -10.534 3.063 1.00 12.52 C ATOM 1887 C LEU A 139 0.475 -11.732 3.765 1.00 52.21 C ATOM 1888 O LEU A 139 1.028 -12.818 3.705 1.00 44.33 O ATOM 1889 CB LEU A 139 0.986 -10.766 1.521 1.00 41.04 C ATOM 1890 CG LEU A 139 1.526 -9.663 0.560 1.00 65.15 C ATOM 1891 CD1 LEU A 139 3.037 -9.531 0.614 1.00 23.23 C ATOM 1892 CD2 LEU A 139 1.073 -9.931 -0.863 1.00 42.02 C ATOM 0 H LEU A 139 3.080 -11.057 3.201 1.00 43.13 H new ATOM 0 HA LEU A 139 0.510 -9.629 3.303 1.00 12.52 H new ATOM 0 HB2 LEU A 139 1.523 -11.688 1.298 1.00 41.04 H new ATOM 0 HB3 LEU A 139 -0.061 -10.938 1.269 1.00 41.04 H new ATOM 0 HG LEU A 139 1.109 -8.715 0.900 1.00 65.15 H new ATOM 0 HD11 LEU A 139 3.359 -8.749 -0.074 1.00 23.23 H new ATOM 0 HD12 LEU A 139 3.344 -9.271 1.627 1.00 23.23 H new ATOM 0 HD13 LEU A 139 3.495 -10.478 0.328 1.00 23.23 H new ATOM 0 HD21 LEU A 139 1.459 -9.152 -1.520 1.00 42.02 H new ATOM 0 HD22 LEU A 139 1.451 -10.900 -1.189 1.00 42.02 H new ATOM 0 HD23 LEU A 139 -0.016 -9.934 -0.904 1.00 42.02 H new ATOM 1904 N GLU A 140 -0.624 -11.530 4.422 1.00 15.42 N ATOM 1905 CA GLU A 140 -1.325 -12.584 5.117 1.00 22.23 C ATOM 1906 C GLU A 140 -2.752 -12.568 4.656 1.00 42.11 C ATOM 1907 O GLU A 140 -3.409 -11.526 4.686 1.00 61.24 O ATOM 1908 CB GLU A 140 -1.246 -12.353 6.614 1.00 35.14 C ATOM 1909 CG GLU A 140 0.166 -12.366 7.137 1.00 55.43 C ATOM 1910 CD GLU A 140 0.246 -12.045 8.589 1.00 72.53 C ATOM 1911 OE1 GLU A 140 0.098 -12.966 9.424 1.00 52.32 O ATOM 1912 OE2 GLU A 140 0.474 -10.857 8.938 1.00 11.32 O ATOM 0 H GLU A 140 -1.073 -10.617 4.497 1.00 15.42 H new ATOM 0 HA GLU A 140 -0.876 -13.553 4.902 1.00 22.23 H new ATOM 0 HB2 GLU A 140 -1.707 -11.395 6.853 1.00 35.14 H new ATOM 0 HB3 GLU A 140 -1.824 -13.122 7.126 1.00 35.14 H new ATOM 0 HG2 GLU A 140 0.604 -13.348 6.962 1.00 55.43 H new ATOM 0 HG3 GLU A 140 0.763 -11.646 6.577 1.00 55.43 H new ATOM 1919 N TYR A 141 -3.238 -13.689 4.231 1.00 14.24 N ATOM 1920 CA TYR A 141 -4.541 -13.730 3.612 1.00 14.34 C ATOM 1921 C TYR A 141 -5.226 -15.066 3.758 1.00 52.35 C ATOM 1922 O TYR A 141 -4.603 -16.066 4.109 1.00 1.11 O ATOM 1923 CB TYR A 141 -4.436 -13.274 2.146 1.00 24.32 C ATOM 1924 CG TYR A 141 -3.404 -14.013 1.327 1.00 63.43 C ATOM 1925 CD1 TYR A 141 -2.051 -13.721 1.456 1.00 4.54 C ATOM 1926 CD2 TYR A 141 -3.775 -14.984 0.439 1.00 5.24 C ATOM 1927 CE1 TYR A 141 -1.105 -14.382 0.721 1.00 25.13 C ATOM 1928 CE2 TYR A 141 -2.838 -15.656 -0.307 1.00 24.41 C ATOM 1929 CZ TYR A 141 -1.508 -15.357 -0.163 1.00 44.34 C ATOM 1930 OH TYR A 141 -0.586 -16.024 -0.918 1.00 14.33 O ATOM 0 H TYR A 141 -2.762 -14.589 4.296 1.00 14.24 H new ATOM 0 HA TYR A 141 -5.186 -13.031 4.144 1.00 14.34 H new ATOM 0 HB2 TYR A 141 -5.410 -13.394 1.672 1.00 24.32 H new ATOM 0 HB3 TYR A 141 -4.201 -12.210 2.127 1.00 24.32 H new ATOM 0 HD1 TYR A 141 -1.740 -12.956 2.152 1.00 4.54 H new ATOM 0 HD2 TYR A 141 -4.821 -15.226 0.322 1.00 5.24 H new ATOM 0 HE1 TYR A 141 -0.058 -14.142 0.833 1.00 25.13 H new ATOM 0 HE2 TYR A 141 -3.148 -16.419 -1.006 1.00 24.41 H new ATOM 0 HH TYR A 141 -0.735 -16.989 -0.839 1.00 14.33 H new ATOM 1940 N GLU A 142 -6.501 -15.087 3.485 1.00 43.43 N ATOM 1941 CA GLU A 142 -7.281 -16.273 3.667 1.00 21.41 C ATOM 1942 C GLU A 142 -8.022 -16.617 2.376 1.00 63.34 C ATOM 1943 O GLU A 142 -8.683 -15.753 1.764 1.00 73.54 O ATOM 1944 CB GLU A 142 -8.232 -16.061 4.845 1.00 54.40 C ATOM 1945 CG GLU A 142 -9.019 -17.278 5.274 1.00 41.30 C ATOM 1946 CD GLU A 142 -9.838 -17.000 6.509 1.00 51.11 C ATOM 1947 OE1 GLU A 142 -9.280 -17.011 7.623 1.00 72.24 O ATOM 1948 OE2 GLU A 142 -11.045 -16.757 6.389 1.00 33.22 O ATOM 0 H GLU A 142 -7.024 -14.285 3.132 1.00 43.43 H new ATOM 0 HA GLU A 142 -6.638 -17.122 3.898 1.00 21.41 H new ATOM 0 HB2 GLU A 142 -7.653 -15.706 5.697 1.00 54.40 H new ATOM 0 HB3 GLU A 142 -8.934 -15.269 4.584 1.00 54.40 H new ATOM 0 HG2 GLU A 142 -9.677 -17.592 4.463 1.00 41.30 H new ATOM 0 HG3 GLU A 142 -8.336 -18.105 5.468 1.00 41.30 H new ATOM 1955 N LYS A 143 -7.888 -17.859 1.959 1.00 25.32 N ATOM 1956 CA LYS A 143 -8.482 -18.353 0.733 1.00 45.43 C ATOM 1957 C LYS A 143 -9.951 -18.700 0.907 1.00 63.25 C ATOM 1958 O LYS A 143 -10.359 -19.267 1.925 1.00 21.04 O ATOM 1959 CB LYS A 143 -7.752 -19.623 0.205 1.00 23.44 C ATOM 1960 CG LYS A 143 -6.363 -19.442 -0.421 1.00 3.20 C ATOM 1961 CD LYS A 143 -5.301 -18.942 0.532 1.00 25.32 C ATOM 1962 CE LYS A 143 -3.952 -18.831 -0.171 1.00 64.44 C ATOM 1963 NZ LYS A 143 -3.471 -20.122 -0.715 1.00 22.44 N ATOM 0 H LYS A 143 -7.356 -18.564 2.469 1.00 25.32 H new ATOM 0 HA LYS A 143 -8.380 -17.540 0.014 1.00 45.43 H new ATOM 0 HB2 LYS A 143 -7.657 -20.324 1.035 1.00 23.44 H new ATOM 0 HB3 LYS A 143 -8.395 -20.094 -0.538 1.00 23.44 H new ATOM 0 HG2 LYS A 143 -6.039 -20.397 -0.836 1.00 3.20 H new ATOM 0 HG3 LYS A 143 -6.443 -18.743 -1.254 1.00 3.20 H new ATOM 0 HD2 LYS A 143 -5.591 -17.969 0.929 1.00 25.32 H new ATOM 0 HD3 LYS A 143 -5.219 -19.621 1.381 1.00 25.32 H new ATOM 0 HE2 LYS A 143 -4.031 -18.108 -0.983 1.00 64.44 H new ATOM 0 HE3 LYS A 143 -3.214 -18.442 0.531 1.00 64.44 H new ATOM 0 HZ1 LYS A 143 -2.457 -20.050 -0.933 1.00 22.44 H new ATOM 0 HZ2 LYS A 143 -3.622 -20.873 -0.011 1.00 22.44 H new ATOM 0 HZ3 LYS A 143 -3.997 -20.350 -1.583 1.00 22.44 H new ATOM 1977 N ILE A 144 -10.751 -18.342 -0.084 1.00 10.22 N ATOM 1978 CA ILE A 144 -12.134 -18.796 -0.138 1.00 21.04 C ATOM 1979 C ILE A 144 -12.082 -20.235 -0.615 1.00 30.05 C ATOM 1980 O ILE A 144 -12.811 -21.115 -0.150 1.00 62.41 O ATOM 1981 CB ILE A 144 -12.951 -17.965 -1.152 1.00 22.51 C ATOM 1982 CG1 ILE A 144 -12.911 -16.499 -0.777 1.00 22.00 C ATOM 1983 CG2 ILE A 144 -14.394 -18.461 -1.224 1.00 34.34 C ATOM 1984 CD1 ILE A 144 -13.619 -15.604 -1.750 1.00 35.15 C ATOM 0 H ILE A 144 -10.470 -17.741 -0.859 1.00 10.22 H new ATOM 0 HA ILE A 144 -12.609 -18.693 0.838 1.00 21.04 H new ATOM 0 HB ILE A 144 -12.503 -18.087 -2.138 1.00 22.51 H new ATOM 0 HG12 ILE A 144 -13.359 -16.374 0.209 1.00 22.00 H new ATOM 0 HG13 ILE A 144 -11.871 -16.183 -0.697 1.00 22.00 H new ATOM 0 HG21 ILE A 144 -14.950 -17.861 -1.944 1.00 34.34 H new ATOM 0 HG22 ILE A 144 -14.405 -19.505 -1.537 1.00 34.34 H new ATOM 0 HG23 ILE A 144 -14.859 -18.372 -0.242 1.00 34.34 H new ATOM 0 HD11 ILE A 144 -13.546 -14.570 -1.413 1.00 35.15 H new ATOM 0 HD12 ILE A 144 -13.158 -15.698 -2.733 1.00 35.15 H new ATOM 0 HD13 ILE A 144 -14.668 -15.892 -1.813 1.00 35.15 H new ATOM 1996 N SER A 145 -11.178 -20.434 -1.524 1.00 2.33 N ATOM 1997 CA SER A 145 -10.851 -21.676 -2.104 1.00 4.55 C ATOM 1998 C SER A 145 -9.428 -21.546 -2.576 1.00 73.34 C ATOM 1999 O SER A 145 -8.916 -20.424 -2.694 1.00 73.12 O ATOM 2000 CB SER A 145 -11.780 -21.986 -3.290 1.00 72.04 C ATOM 2001 OG SER A 145 -11.419 -23.204 -3.929 1.00 31.12 O ATOM 0 H SER A 145 -10.616 -19.670 -1.899 1.00 2.33 H new ATOM 0 HA SER A 145 -10.967 -22.490 -1.389 1.00 4.55 H new ATOM 0 HB2 SER A 145 -12.810 -22.049 -2.940 1.00 72.04 H new ATOM 0 HB3 SER A 145 -11.737 -21.169 -4.010 1.00 72.04 H new ATOM 0 HG SER A 145 -12.029 -23.374 -4.677 1.00 31.12 H new ATOM 2007 N GLU A 146 -8.800 -22.640 -2.836 1.00 62.43 N ATOM 2008 CA GLU A 146 -7.437 -22.643 -3.304 1.00 61.30 C ATOM 2009 C GLU A 146 -7.406 -22.180 -4.735 1.00 63.22 C ATOM 2010 O GLU A 146 -6.576 -21.377 -5.131 1.00 12.33 O ATOM 2011 CB GLU A 146 -6.927 -24.039 -3.285 1.00 60.14 C ATOM 2012 CG GLU A 146 -6.961 -24.699 -1.919 1.00 4.21 C ATOM 2013 CD GLU A 146 -6.421 -26.102 -1.944 1.00 73.13 C ATOM 2014 OE1 GLU A 146 -5.193 -26.277 -1.791 1.00 3.11 O ATOM 2015 OE2 GLU A 146 -7.215 -27.049 -2.105 1.00 32.10 O ATOM 0 H GLU A 146 -9.210 -23.568 -2.733 1.00 62.43 H new ATOM 0 HA GLU A 146 -6.835 -21.992 -2.670 1.00 61.30 H new ATOM 0 HB2 GLU A 146 -7.516 -24.638 -3.979 1.00 60.14 H new ATOM 0 HB3 GLU A 146 -5.901 -24.043 -3.652 1.00 60.14 H new ATOM 0 HG2 GLU A 146 -6.380 -24.102 -1.216 1.00 4.21 H new ATOM 0 HG3 GLU A 146 -7.987 -24.715 -1.552 1.00 4.21 H new ATOM 2022 N GLU A 147 -8.369 -22.682 -5.482 1.00 0.51 N ATOM 2023 CA GLU A 147 -8.489 -22.479 -6.917 1.00 51.43 C ATOM 2024 C GLU A 147 -8.726 -21.029 -7.253 1.00 52.44 C ATOM 2025 O GLU A 147 -8.406 -20.569 -8.347 1.00 71.33 O ATOM 2026 CB GLU A 147 -9.673 -23.287 -7.410 1.00 50.03 C ATOM 2027 CG GLU A 147 -9.591 -24.752 -7.070 1.00 11.24 C ATOM 2028 CD GLU A 147 -10.794 -25.506 -7.520 1.00 14.55 C ATOM 2029 OE1 GLU A 147 -10.801 -25.989 -8.666 1.00 42.24 O ATOM 2030 OE2 GLU A 147 -11.754 -25.630 -6.744 1.00 34.42 O ATOM 0 H GLU A 147 -9.115 -23.262 -5.097 1.00 0.51 H new ATOM 0 HA GLU A 147 -7.560 -22.793 -7.393 1.00 51.43 H new ATOM 0 HB2 GLU A 147 -10.587 -22.874 -6.982 1.00 50.03 H new ATOM 0 HB3 GLU A 147 -9.751 -23.178 -8.492 1.00 50.03 H new ATOM 0 HG2 GLU A 147 -8.702 -25.181 -7.533 1.00 11.24 H new ATOM 0 HG3 GLU A 147 -9.476 -24.866 -5.992 1.00 11.24 H new ATOM 2037 N VAL A 148 -9.256 -20.314 -6.309 1.00 21.54 N ATOM 2038 CA VAL A 148 -9.648 -18.930 -6.568 1.00 70.03 C ATOM 2039 C VAL A 148 -8.523 -17.957 -6.185 1.00 23.32 C ATOM 2040 O VAL A 148 -8.421 -16.846 -6.723 1.00 41.14 O ATOM 2041 CB VAL A 148 -10.988 -18.556 -5.850 1.00 21.21 C ATOM 2042 CG1 VAL A 148 -10.850 -18.561 -4.352 1.00 74.33 C ATOM 2043 CG2 VAL A 148 -11.532 -17.228 -6.343 1.00 20.50 C ATOM 0 H VAL A 148 -9.432 -20.644 -5.360 1.00 21.54 H new ATOM 0 HA VAL A 148 -9.823 -18.840 -7.640 1.00 70.03 H new ATOM 0 HB VAL A 148 -11.709 -19.331 -6.110 1.00 21.21 H new ATOM 0 HG11 VAL A 148 -11.805 -18.296 -3.898 1.00 74.33 H new ATOM 0 HG12 VAL A 148 -10.553 -19.555 -4.017 1.00 74.33 H new ATOM 0 HG13 VAL A 148 -10.093 -17.836 -4.054 1.00 74.33 H new ATOM 0 HG21 VAL A 148 -12.463 -17.000 -5.823 1.00 20.50 H new ATOM 0 HG22 VAL A 148 -10.804 -16.441 -6.146 1.00 20.50 H new ATOM 0 HG23 VAL A 148 -11.721 -17.287 -7.415 1.00 20.50 H new ATOM 2053 N ALA A 149 -7.666 -18.391 -5.304 1.00 63.25 N ATOM 2054 CA ALA A 149 -6.595 -17.563 -4.839 1.00 43.52 C ATOM 2055 C ALA A 149 -5.378 -17.790 -5.678 1.00 75.22 C ATOM 2056 O ALA A 149 -4.948 -18.927 -5.865 1.00 35.32 O ATOM 2057 CB ALA A 149 -6.292 -17.867 -3.405 1.00 73.22 C ATOM 0 H ALA A 149 -7.692 -19.324 -4.891 1.00 63.25 H new ATOM 0 HA ALA A 149 -6.895 -16.518 -4.920 1.00 43.52 H new ATOM 0 HB1 ALA A 149 -5.476 -17.231 -3.063 1.00 73.22 H new ATOM 0 HB2 ALA A 149 -7.178 -17.679 -2.798 1.00 73.22 H new ATOM 0 HB3 ALA A 149 -6.002 -18.913 -3.308 1.00 73.22 H new ATOM 2063 N HIS A 150 -4.821 -16.730 -6.189 1.00 2.12 N ATOM 2064 CA HIS A 150 -3.655 -16.843 -7.022 1.00 12.45 C ATOM 2065 C HIS A 150 -2.609 -15.848 -6.580 1.00 24.14 C ATOM 2066 O HIS A 150 -2.640 -14.693 -6.999 1.00 11.31 O ATOM 2067 CB HIS A 150 -3.984 -16.680 -8.527 1.00 24.03 C ATOM 2068 CG HIS A 150 -4.966 -17.697 -9.066 1.00 42.22 C ATOM 2069 ND1 HIS A 150 -4.601 -18.954 -9.492 1.00 33.42 N ATOM 2070 CD2 HIS A 150 -6.310 -17.631 -9.233 1.00 52.42 C ATOM 2071 CE1 HIS A 150 -5.667 -19.608 -9.895 1.00 14.11 C ATOM 2072 NE2 HIS A 150 -6.717 -18.832 -9.748 1.00 33.24 N ATOM 0 H HIS A 150 -5.154 -15.777 -6.045 1.00 2.12 H new ATOM 0 HA HIS A 150 -3.259 -17.852 -6.903 1.00 12.45 H new ATOM 0 HB2 HIS A 150 -4.387 -15.681 -8.692 1.00 24.03 H new ATOM 0 HB3 HIS A 150 -3.058 -16.749 -9.098 1.00 24.03 H new ATOM 0 HD2 HIS A 150 -6.943 -16.787 -9.002 1.00 52.42 H new ATOM 0 HE1 HIS A 150 -5.678 -20.616 -10.283 1.00 14.11 H new ATOM 0 HE2 HIS A 150 -7.678 -19.083 -9.980 1.00 33.24 H new ATOM 2081 N PRO A 151 -1.676 -16.282 -5.686 1.00 3.43 N ATOM 2082 CA PRO A 151 -0.586 -15.430 -5.120 1.00 15.51 C ATOM 2083 C PRO A 151 0.229 -14.656 -6.178 1.00 30.14 C ATOM 2084 O PRO A 151 0.953 -13.710 -5.849 1.00 12.15 O ATOM 2085 CB PRO A 151 0.303 -16.444 -4.402 1.00 54.53 C ATOM 2086 CG PRO A 151 -0.629 -17.528 -3.996 1.00 21.13 C ATOM 2087 CD PRO A 151 -1.635 -17.648 -5.107 1.00 3.34 C ATOM 0 HA PRO A 151 -0.994 -14.645 -4.483 1.00 15.51 H new ATOM 0 HB2 PRO A 151 1.088 -16.820 -5.058 1.00 54.53 H new ATOM 0 HB3 PRO A 151 0.796 -15.999 -3.538 1.00 54.53 H new ATOM 0 HG2 PRO A 151 -0.095 -18.467 -3.850 1.00 21.13 H new ATOM 0 HG3 PRO A 151 -1.118 -17.289 -3.051 1.00 21.13 H new ATOM 0 HD2 PRO A 151 -1.330 -18.388 -5.846 1.00 3.34 H new ATOM 0 HD3 PRO A 151 -2.612 -17.955 -4.733 1.00 3.34 H new ATOM 2095 N GLU A 152 0.105 -15.067 -7.427 1.00 54.13 N ATOM 2096 CA GLU A 152 0.752 -14.411 -8.563 1.00 4.24 C ATOM 2097 C GLU A 152 0.306 -12.954 -8.617 1.00 0.34 C ATOM 2098 O GLU A 152 1.106 -12.037 -8.788 1.00 34.34 O ATOM 2099 CB GLU A 152 0.280 -15.068 -9.855 1.00 24.21 C ATOM 2100 CG GLU A 152 0.371 -16.574 -9.872 1.00 40.11 C ATOM 2101 CD GLU A 152 1.774 -17.084 -9.649 1.00 34.34 C ATOM 2102 OE1 GLU A 152 2.587 -17.062 -10.601 1.00 64.25 O ATOM 2103 OE2 GLU A 152 2.087 -17.505 -8.515 1.00 13.04 O ATOM 0 H GLU A 152 -0.455 -15.878 -7.691 1.00 54.13 H new ATOM 0 HA GLU A 152 1.834 -14.490 -8.453 1.00 4.24 H new ATOM 0 HB2 GLU A 152 -0.755 -14.779 -10.035 1.00 24.21 H new ATOM 0 HB3 GLU A 152 0.870 -14.674 -10.683 1.00 24.21 H new ATOM 0 HG2 GLU A 152 -0.284 -16.981 -9.101 1.00 40.11 H new ATOM 0 HG3 GLU A 152 0.004 -16.944 -10.830 1.00 40.11 H new ATOM 2110 N THR A 153 -0.984 -12.773 -8.426 1.00 14.23 N ATOM 2111 CA THR A 153 -1.632 -11.484 -8.514 1.00 20.44 C ATOM 2112 C THR A 153 -1.159 -10.571 -7.387 1.00 64.01 C ATOM 2113 O THR A 153 -1.041 -9.357 -7.552 1.00 4.40 O ATOM 2114 CB THR A 153 -3.166 -11.667 -8.421 1.00 32.43 C ATOM 2115 OG1 THR A 153 -3.506 -12.198 -7.127 1.00 3.14 O ATOM 2116 CG2 THR A 153 -3.634 -12.662 -9.476 1.00 35.02 C ATOM 0 H THR A 153 -1.624 -13.535 -8.201 1.00 14.23 H new ATOM 0 HA THR A 153 -1.373 -11.027 -9.469 1.00 20.44 H new ATOM 0 HB THR A 153 -3.645 -10.701 -8.578 1.00 32.43 H new ATOM 0 HG1 THR A 153 -3.280 -13.151 -7.095 1.00 3.14 H new ATOM 0 HG21 THR A 153 -4.715 -12.786 -9.405 1.00 35.02 H new ATOM 0 HG22 THR A 153 -3.376 -12.290 -10.467 1.00 35.02 H new ATOM 0 HG23 THR A 153 -3.147 -13.623 -9.311 1.00 35.02 H new ATOM 2124 N LEU A 154 -0.849 -11.181 -6.260 1.00 23.45 N ATOM 2125 CA LEU A 154 -0.436 -10.473 -5.078 1.00 2.50 C ATOM 2126 C LEU A 154 0.968 -9.946 -5.256 1.00 2.53 C ATOM 2127 O LEU A 154 1.261 -8.799 -4.894 1.00 2.34 O ATOM 2128 CB LEU A 154 -0.525 -11.393 -3.877 1.00 12.33 C ATOM 2129 CG LEU A 154 -1.893 -12.039 -3.651 1.00 72.00 C ATOM 2130 CD1 LEU A 154 -1.861 -12.920 -2.442 1.00 62.31 C ATOM 2131 CD2 LEU A 154 -2.987 -10.991 -3.521 1.00 14.04 C ATOM 0 H LEU A 154 -0.879 -12.194 -6.144 1.00 23.45 H new ATOM 0 HA LEU A 154 -1.098 -9.623 -4.911 1.00 2.50 H new ATOM 0 HB2 LEU A 154 0.218 -12.183 -3.989 1.00 12.33 H new ATOM 0 HB3 LEU A 154 -0.257 -10.827 -2.985 1.00 12.33 H new ATOM 0 HG LEU A 154 -2.123 -12.651 -4.524 1.00 72.00 H new ATOM 0 HD11 LEU A 154 -2.842 -13.372 -2.295 1.00 62.31 H new ATOM 0 HD12 LEU A 154 -1.117 -13.704 -2.583 1.00 62.31 H new ATOM 0 HD13 LEU A 154 -1.600 -12.326 -1.566 1.00 62.31 H new ATOM 0 HD21 LEU A 154 -3.946 -11.484 -3.361 1.00 14.04 H new ATOM 0 HD22 LEU A 154 -2.768 -10.340 -2.675 1.00 14.04 H new ATOM 0 HD23 LEU A 154 -3.032 -10.397 -4.434 1.00 14.04 H new ATOM 2143 N LEU A 155 1.837 -10.771 -5.839 1.00 34.24 N ATOM 2144 CA LEU A 155 3.180 -10.333 -6.155 1.00 61.42 C ATOM 2145 C LEU A 155 3.141 -9.202 -7.136 1.00 50.54 C ATOM 2146 O LEU A 155 3.882 -8.248 -7.015 1.00 14.44 O ATOM 2147 CB LEU A 155 4.066 -11.461 -6.671 1.00 5.33 C ATOM 2148 CG LEU A 155 4.476 -12.511 -5.649 1.00 1.11 C ATOM 2149 CD1 LEU A 155 5.350 -13.546 -6.301 1.00 54.42 C ATOM 2150 CD2 LEU A 155 5.222 -11.862 -4.488 1.00 40.44 C ATOM 0 H LEU A 155 1.630 -11.736 -6.097 1.00 34.24 H new ATOM 0 HA LEU A 155 3.628 -9.988 -5.223 1.00 61.42 H new ATOM 0 HB2 LEU A 155 3.544 -11.961 -7.487 1.00 5.33 H new ATOM 0 HB3 LEU A 155 4.970 -11.022 -7.093 1.00 5.33 H new ATOM 0 HG LEU A 155 3.577 -12.991 -5.263 1.00 1.11 H new ATOM 0 HD11 LEU A 155 5.640 -14.294 -5.563 1.00 54.42 H new ATOM 0 HD12 LEU A 155 4.802 -14.028 -7.111 1.00 54.42 H new ATOM 0 HD13 LEU A 155 6.243 -13.067 -6.702 1.00 54.42 H new ATOM 0 HD21 LEU A 155 5.508 -12.627 -3.766 1.00 40.44 H new ATOM 0 HD22 LEU A 155 6.116 -11.364 -4.863 1.00 40.44 H new ATOM 0 HD23 LEU A 155 4.576 -11.130 -4.004 1.00 40.44 H new ATOM 2162 N GLN A 156 2.256 -9.284 -8.093 1.00 14.34 N ATOM 2163 CA GLN A 156 2.117 -8.203 -9.027 1.00 14.21 C ATOM 2164 C GLN A 156 1.563 -6.952 -8.361 1.00 40.23 C ATOM 2165 O GLN A 156 2.045 -5.864 -8.612 1.00 2.20 O ATOM 2166 CB GLN A 156 1.333 -8.597 -10.260 1.00 11.53 C ATOM 2167 CG GLN A 156 2.039 -9.654 -11.080 1.00 61.50 C ATOM 2168 CD GLN A 156 1.401 -9.867 -12.414 1.00 23.24 C ATOM 2169 OE1 GLN A 156 0.516 -10.700 -12.578 1.00 53.44 O ATOM 2170 NE2 GLN A 156 1.843 -9.107 -13.379 1.00 32.42 N ATOM 0 H GLN A 156 1.630 -10.075 -8.244 1.00 14.34 H new ATOM 0 HA GLN A 156 3.120 -7.959 -9.377 1.00 14.21 H new ATOM 0 HB2 GLN A 156 0.353 -8.968 -9.961 1.00 11.53 H new ATOM 0 HB3 GLN A 156 1.165 -7.715 -10.877 1.00 11.53 H new ATOM 0 HG2 GLN A 156 3.080 -9.364 -11.221 1.00 61.50 H new ATOM 0 HG3 GLN A 156 2.042 -10.594 -10.529 1.00 61.50 H new ATOM 0 HE21 GLN A 156 2.581 -8.427 -13.196 1.00 32.42 H new ATOM 0 HE22 GLN A 156 1.450 -9.193 -14.316 1.00 32.42 H new ATOM 2179 N PHE A 157 0.589 -7.125 -7.475 1.00 73.43 N ATOM 2180 CA PHE A 157 -0.007 -6.006 -6.741 1.00 72.25 C ATOM 2181 C PHE A 157 1.051 -5.254 -5.933 1.00 74.23 C ATOM 2182 O PHE A 157 1.047 -4.018 -5.894 1.00 74.30 O ATOM 2183 CB PHE A 157 -1.156 -6.491 -5.826 1.00 10.14 C ATOM 2184 CG PHE A 157 -1.811 -5.400 -4.999 1.00 73.24 C ATOM 2185 CD1 PHE A 157 -2.624 -4.456 -5.600 1.00 13.11 C ATOM 2186 CD2 PHE A 157 -1.603 -5.321 -3.622 1.00 63.01 C ATOM 2187 CE1 PHE A 157 -3.222 -3.456 -4.857 1.00 11.32 C ATOM 2188 CE2 PHE A 157 -2.202 -4.316 -2.871 1.00 55.15 C ATOM 2189 CZ PHE A 157 -3.011 -3.386 -3.492 1.00 12.23 C ATOM 0 H PHE A 157 0.190 -8.035 -7.244 1.00 73.43 H new ATOM 0 HA PHE A 157 -0.427 -5.315 -7.472 1.00 72.25 H new ATOM 0 HB2 PHE A 157 -1.918 -6.967 -6.443 1.00 10.14 H new ATOM 0 HB3 PHE A 157 -0.768 -7.255 -5.153 1.00 10.14 H new ATOM 0 HD1 PHE A 157 -2.794 -4.501 -6.666 1.00 13.11 H new ATOM 0 HD2 PHE A 157 -0.970 -6.048 -3.134 1.00 63.01 H new ATOM 0 HE1 PHE A 157 -3.855 -2.728 -5.343 1.00 11.32 H new ATOM 0 HE2 PHE A 157 -2.035 -4.263 -1.805 1.00 55.15 H new ATOM 0 HZ PHE A 157 -3.479 -2.604 -2.912 1.00 12.23 H new ATOM 2199 N CYS A 158 1.971 -5.988 -5.302 1.00 25.42 N ATOM 2200 CA CYS A 158 3.014 -5.324 -4.554 1.00 23.43 C ATOM 2201 C CYS A 158 3.953 -4.570 -5.492 1.00 20.42 C ATOM 2202 O CYS A 158 4.474 -3.518 -5.137 1.00 13.20 O ATOM 2203 CB CYS A 158 3.770 -6.267 -3.590 1.00 61.34 C ATOM 2204 SG CYS A 158 4.701 -7.611 -4.338 1.00 62.03 S ATOM 0 H CYS A 158 2.008 -7.007 -5.298 1.00 25.42 H new ATOM 0 HA CYS A 158 2.528 -4.593 -3.908 1.00 23.43 H new ATOM 0 HB2 CYS A 158 4.458 -5.666 -2.996 1.00 61.34 H new ATOM 0 HB3 CYS A 158 3.046 -6.698 -2.899 1.00 61.34 H new ATOM 0 HG CYS A 158 4.476 -7.635 -5.618 1.00 62.03 H new ATOM 2210 N VAL A 159 4.132 -5.094 -6.709 1.00 10.42 N ATOM 2211 CA VAL A 159 4.942 -4.421 -7.721 1.00 52.50 C ATOM 2212 C VAL A 159 4.241 -3.127 -8.142 1.00 25.21 C ATOM 2213 O VAL A 159 4.862 -2.074 -8.187 1.00 14.24 O ATOM 2214 CB VAL A 159 5.185 -5.308 -8.979 1.00 71.22 C ATOM 2215 CG1 VAL A 159 6.015 -4.568 -10.014 1.00 34.34 C ATOM 2216 CG2 VAL A 159 5.873 -6.605 -8.610 1.00 50.03 C ATOM 0 H VAL A 159 3.727 -5.979 -7.013 1.00 10.42 H new ATOM 0 HA VAL A 159 5.916 -4.211 -7.278 1.00 52.50 H new ATOM 0 HB VAL A 159 4.209 -5.539 -9.406 1.00 71.22 H new ATOM 0 HG11 VAL A 159 6.170 -5.209 -10.882 1.00 34.34 H new ATOM 0 HG12 VAL A 159 5.491 -3.663 -10.321 1.00 34.34 H new ATOM 0 HG13 VAL A 159 6.980 -4.301 -9.583 1.00 34.34 H new ATOM 0 HG21 VAL A 159 6.029 -7.202 -9.508 1.00 50.03 H new ATOM 0 HG22 VAL A 159 6.836 -6.387 -8.147 1.00 50.03 H new ATOM 0 HG23 VAL A 159 5.250 -7.160 -7.908 1.00 50.03 H new ATOM 2226 N GLU A 160 2.926 -3.225 -8.417 1.00 31.31 N ATOM 2227 CA GLU A 160 2.090 -2.063 -8.773 1.00 20.33 C ATOM 2228 C GLU A 160 2.223 -0.929 -7.771 1.00 71.44 C ATOM 2229 O GLU A 160 2.406 0.231 -8.151 1.00 35.42 O ATOM 2230 CB GLU A 160 0.606 -2.448 -8.923 1.00 43.12 C ATOM 2231 CG GLU A 160 0.164 -2.903 -10.317 1.00 62.50 C ATOM 2232 CD GLU A 160 0.878 -4.102 -10.862 1.00 53.14 C ATOM 2233 OE1 GLU A 160 1.986 -3.941 -11.408 1.00 54.20 O ATOM 2234 OE2 GLU A 160 0.310 -5.213 -10.803 1.00 42.40 O ATOM 0 H GLU A 160 2.416 -4.108 -8.399 1.00 31.31 H new ATOM 0 HA GLU A 160 2.461 -1.714 -9.737 1.00 20.33 H new ATOM 0 HB2 GLU A 160 0.386 -3.248 -8.216 1.00 43.12 H new ATOM 0 HB3 GLU A 160 -0.002 -1.591 -8.634 1.00 43.12 H new ATOM 0 HG2 GLU A 160 -0.904 -3.120 -10.287 1.00 62.50 H new ATOM 0 HG3 GLU A 160 0.301 -2.074 -11.011 1.00 62.50 H new ATOM 2241 N VAL A 161 2.140 -1.262 -6.502 1.00 74.34 N ATOM 2242 CA VAL A 161 2.271 -0.269 -5.458 1.00 31.24 C ATOM 2243 C VAL A 161 3.703 0.275 -5.418 1.00 21.30 C ATOM 2244 O VAL A 161 3.906 1.488 -5.323 1.00 55.31 O ATOM 2245 CB VAL A 161 1.867 -0.827 -4.076 1.00 75.15 C ATOM 2246 CG1 VAL A 161 2.022 0.234 -2.988 1.00 33.05 C ATOM 2247 CG2 VAL A 161 0.434 -1.344 -4.107 1.00 55.11 C ATOM 0 H VAL A 161 1.982 -2.213 -6.168 1.00 74.34 H new ATOM 0 HA VAL A 161 1.586 0.546 -5.693 1.00 31.24 H new ATOM 0 HB VAL A 161 2.535 -1.656 -3.841 1.00 75.15 H new ATOM 0 HG11 VAL A 161 1.731 -0.187 -2.026 1.00 33.05 H new ATOM 0 HG12 VAL A 161 3.061 0.559 -2.942 1.00 33.05 H new ATOM 0 HG13 VAL A 161 1.385 1.088 -3.219 1.00 33.05 H new ATOM 0 HG21 VAL A 161 0.166 -1.733 -3.125 1.00 55.11 H new ATOM 0 HG22 VAL A 161 -0.241 -0.530 -4.371 1.00 55.11 H new ATOM 0 HG23 VAL A 161 0.350 -2.139 -4.848 1.00 55.11 H new ATOM 2257 N SER A 162 4.692 -0.631 -5.537 1.00 21.22 N ATOM 2258 CA SER A 162 6.107 -0.256 -5.541 1.00 63.34 C ATOM 2259 C SER A 162 6.409 0.742 -6.651 1.00 52.31 C ATOM 2260 O SER A 162 7.218 1.628 -6.473 1.00 73.34 O ATOM 2261 CB SER A 162 6.985 -1.497 -5.687 1.00 0.14 C ATOM 2262 OG SER A 162 6.790 -2.382 -4.591 1.00 34.35 O ATOM 0 H SER A 162 4.529 -1.633 -5.632 1.00 21.22 H new ATOM 0 HA SER A 162 6.331 0.223 -4.588 1.00 63.34 H new ATOM 0 HB2 SER A 162 6.749 -2.008 -6.620 1.00 0.14 H new ATOM 0 HB3 SER A 162 8.033 -1.203 -5.741 1.00 0.14 H new ATOM 0 HG SER A 162 5.855 -2.675 -4.570 1.00 34.35 H new ATOM 2268 N LYS A 163 5.721 0.603 -7.784 1.00 62.30 N ATOM 2269 CA LYS A 163 5.893 1.513 -8.912 1.00 52.14 C ATOM 2270 C LYS A 163 5.581 2.933 -8.503 1.00 74.31 C ATOM 2271 O LYS A 163 6.400 3.834 -8.682 1.00 64.30 O ATOM 2272 CB LYS A 163 4.971 1.128 -10.068 1.00 25.14 C ATOM 2273 CG LYS A 163 5.204 -0.248 -10.625 1.00 30.13 C ATOM 2274 CD LYS A 163 4.198 -0.578 -11.707 1.00 13.50 C ATOM 2275 CE LYS A 163 4.441 -1.961 -12.276 1.00 43.24 C ATOM 2276 NZ LYS A 163 5.780 -2.069 -12.887 1.00 63.01 N ATOM 0 H LYS A 163 5.036 -0.136 -7.944 1.00 62.30 H new ATOM 0 HA LYS A 163 6.932 1.441 -9.234 1.00 52.14 H new ATOM 0 HB2 LYS A 163 3.937 1.198 -9.729 1.00 25.14 H new ATOM 0 HB3 LYS A 163 5.093 1.856 -10.870 1.00 25.14 H new ATOM 0 HG2 LYS A 163 6.213 -0.313 -11.031 1.00 30.13 H new ATOM 0 HG3 LYS A 163 5.135 -0.984 -9.824 1.00 30.13 H new ATOM 0 HD2 LYS A 163 3.189 -0.522 -11.299 1.00 13.50 H new ATOM 0 HD3 LYS A 163 4.261 0.163 -12.504 1.00 13.50 H new ATOM 0 HE2 LYS A 163 4.341 -2.704 -11.484 1.00 43.24 H new ATOM 0 HE3 LYS A 163 3.680 -2.187 -13.023 1.00 43.24 H new ATOM 0 HZ1 LYS A 163 5.812 -2.903 -13.508 1.00 63.01 H new ATOM 0 HZ2 LYS A 163 5.977 -1.214 -13.445 1.00 63.01 H new ATOM 0 HZ3 LYS A 163 6.496 -2.166 -12.139 1.00 63.01 H new ATOM 2290 N GLU A 164 4.408 3.126 -7.943 1.00 54.21 N ATOM 2291 CA GLU A 164 3.974 4.442 -7.540 1.00 42.25 C ATOM 2292 C GLU A 164 4.815 4.954 -6.422 1.00 2.51 C ATOM 2293 O GLU A 164 5.399 5.996 -6.538 1.00 55.10 O ATOM 2294 CB GLU A 164 2.518 4.405 -7.085 1.00 33.53 C ATOM 2295 CG GLU A 164 1.963 5.737 -6.534 1.00 42.25 C ATOM 2296 CD GLU A 164 2.100 6.922 -7.485 1.00 12.05 C ATOM 2297 OE1 GLU A 164 1.512 6.895 -8.573 1.00 51.45 O ATOM 2298 OE2 GLU A 164 2.796 7.905 -7.138 1.00 61.24 O ATOM 0 H GLU A 164 3.735 2.383 -7.756 1.00 54.21 H new ATOM 0 HA GLU A 164 4.073 5.104 -8.400 1.00 42.25 H new ATOM 0 HB2 GLU A 164 1.900 4.094 -7.927 1.00 33.53 H new ATOM 0 HB3 GLU A 164 2.415 3.641 -6.314 1.00 33.53 H new ATOM 0 HG2 GLU A 164 0.909 5.603 -6.290 1.00 42.25 H new ATOM 0 HG3 GLU A 164 2.478 5.973 -5.603 1.00 42.25 H new ATOM 2305 N ILE A 165 4.934 4.173 -5.376 1.00 42.51 N ATOM 2306 CA ILE A 165 5.558 4.645 -4.173 1.00 74.33 C ATOM 2307 C ILE A 165 7.040 4.991 -4.373 1.00 64.22 C ATOM 2308 O ILE A 165 7.484 6.061 -3.999 1.00 71.05 O ATOM 2309 CB ILE A 165 5.324 3.671 -2.966 1.00 23.01 C ATOM 2310 CG1 ILE A 165 5.785 4.290 -1.665 1.00 31.14 C ATOM 2311 CG2 ILE A 165 5.994 2.324 -3.171 1.00 74.24 C ATOM 2312 CD1 ILE A 165 5.077 5.574 -1.354 1.00 22.22 C ATOM 0 H ILE A 165 4.606 3.208 -5.337 1.00 42.51 H new ATOM 0 HA ILE A 165 5.065 5.582 -3.915 1.00 74.33 H new ATOM 0 HB ILE A 165 4.249 3.499 -2.913 1.00 23.01 H new ATOM 0 HG12 ILE A 165 5.620 3.583 -0.852 1.00 31.14 H new ATOM 0 HG13 ILE A 165 6.858 4.474 -1.715 1.00 31.14 H new ATOM 0 HG21 ILE A 165 5.802 1.687 -2.308 1.00 74.24 H new ATOM 0 HG22 ILE A 165 5.593 1.851 -4.067 1.00 74.24 H new ATOM 0 HG23 ILE A 165 7.069 2.466 -3.285 1.00 74.24 H new ATOM 0 HD11 ILE A 165 5.447 5.974 -0.410 1.00 22.22 H new ATOM 0 HD12 ILE A 165 5.263 6.294 -2.151 1.00 22.22 H new ATOM 0 HD13 ILE A 165 4.006 5.389 -1.275 1.00 22.22 H new ATOM 2324 N ASP A 166 7.747 4.127 -5.020 1.00 41.14 N ATOM 2325 CA ASP A 166 9.195 4.306 -5.245 1.00 3.21 C ATOM 2326 C ASP A 166 9.480 5.516 -6.118 1.00 4.31 C ATOM 2327 O ASP A 166 10.257 6.404 -5.742 1.00 64.13 O ATOM 2328 CB ASP A 166 9.790 3.031 -5.850 1.00 64.32 C ATOM 2329 CG ASP A 166 11.210 3.165 -6.321 1.00 43.13 C ATOM 2330 OD1 ASP A 166 12.076 3.530 -5.520 1.00 13.45 O ATOM 2331 OD2 ASP A 166 11.481 2.836 -7.515 1.00 20.23 O ATOM 0 H ASP A 166 7.366 3.269 -5.419 1.00 41.14 H new ATOM 0 HA ASP A 166 9.672 4.491 -4.282 1.00 3.21 H new ATOM 0 HB2 ASP A 166 9.741 2.235 -5.107 1.00 64.32 H new ATOM 0 HB3 ASP A 166 9.170 2.720 -6.691 1.00 64.32 H new ATOM 2336 N GLU A 167 8.818 5.582 -7.249 1.00 74.52 N ATOM 2337 CA GLU A 167 9.003 6.692 -8.150 1.00 43.04 C ATOM 2338 C GLU A 167 8.446 7.988 -7.557 1.00 73.51 C ATOM 2339 O GLU A 167 8.963 9.058 -7.824 1.00 1.11 O ATOM 2340 CB GLU A 167 8.453 6.395 -9.553 1.00 20.23 C ATOM 2341 CG GLU A 167 9.180 5.241 -10.244 1.00 3.35 C ATOM 2342 CD GLU A 167 8.685 4.950 -11.646 1.00 50.45 C ATOM 2343 OE1 GLU A 167 9.191 5.572 -12.614 1.00 33.41 O ATOM 2344 OE2 GLU A 167 7.808 4.072 -11.810 1.00 34.11 O ATOM 0 H GLU A 167 8.148 4.881 -7.566 1.00 74.52 H new ATOM 0 HA GLU A 167 10.076 6.839 -8.275 1.00 43.04 H new ATOM 0 HB2 GLU A 167 7.392 6.157 -9.479 1.00 20.23 H new ATOM 0 HB3 GLU A 167 8.537 7.291 -10.168 1.00 20.23 H new ATOM 0 HG2 GLU A 167 10.245 5.470 -10.286 1.00 3.35 H new ATOM 0 HG3 GLU A 167 9.071 4.342 -9.638 1.00 3.35 H new ATOM 2351 N HIS A 168 7.406 7.872 -6.737 1.00 41.30 N ATOM 2352 CA HIS A 168 6.779 9.021 -6.077 1.00 15.14 C ATOM 2353 C HIS A 168 7.791 9.692 -5.145 1.00 55.41 C ATOM 2354 O HIS A 168 7.888 10.915 -5.094 1.00 11.12 O ATOM 2355 CB HIS A 168 5.566 8.557 -5.260 1.00 71.00 C ATOM 2356 CG HIS A 168 4.647 9.637 -4.821 1.00 13.13 C ATOM 2357 ND1 HIS A 168 3.403 9.793 -5.359 1.00 31.02 N ATOM 2358 CD2 HIS A 168 4.781 10.601 -3.894 1.00 72.40 C ATOM 2359 CE1 HIS A 168 2.808 10.810 -4.793 1.00 2.32 C ATOM 2360 NE2 HIS A 168 3.624 11.324 -3.894 1.00 14.43 N ATOM 0 H HIS A 168 6.971 6.978 -6.509 1.00 41.30 H new ATOM 0 HA HIS A 168 6.452 9.732 -6.836 1.00 15.14 H new ATOM 0 HB2 HIS A 168 5.000 7.840 -5.855 1.00 71.00 H new ATOM 0 HB3 HIS A 168 5.924 8.026 -4.378 1.00 71.00 H new ATOM 0 HD1 HIS A 168 3.000 9.207 -6.090 1.00 31.02 H new ATOM 0 HD2 HIS A 168 5.643 10.771 -3.266 1.00 72.40 H new ATOM 0 HE1 HIS A 168 1.816 11.169 -5.023 1.00 2.32 H new ATOM 2369 N LEU A 169 8.543 8.875 -4.415 1.00 75.21 N ATOM 2370 CA LEU A 169 9.577 9.362 -3.511 1.00 32.34 C ATOM 2371 C LEU A 169 10.707 10.043 -4.244 1.00 35.54 C ATOM 2372 O LEU A 169 11.337 10.936 -3.718 1.00 72.54 O ATOM 2373 CB LEU A 169 10.119 8.243 -2.609 1.00 21.31 C ATOM 2374 CG LEU A 169 9.351 7.936 -1.313 1.00 44.11 C ATOM 2375 CD1 LEU A 169 7.897 7.644 -1.545 1.00 44.32 C ATOM 2376 CD2 LEU A 169 10.010 6.803 -0.549 1.00 60.34 C ATOM 0 H LEU A 169 8.453 7.859 -4.434 1.00 75.21 H new ATOM 0 HA LEU A 169 9.098 10.109 -2.877 1.00 32.34 H new ATOM 0 HB2 LEU A 169 10.161 7.327 -3.199 1.00 21.31 H new ATOM 0 HB3 LEU A 169 11.144 8.496 -2.339 1.00 21.31 H new ATOM 0 HG LEU A 169 9.393 8.843 -0.709 1.00 44.11 H new ATOM 0 HD11 LEU A 169 7.411 7.435 -0.592 1.00 44.32 H new ATOM 0 HD12 LEU A 169 7.423 8.507 -2.013 1.00 44.32 H new ATOM 0 HD13 LEU A 169 7.800 6.777 -2.199 1.00 44.32 H new ATOM 0 HD21 LEU A 169 9.448 6.605 0.364 1.00 60.34 H new ATOM 0 HD22 LEU A 169 10.024 5.906 -1.169 1.00 60.34 H new ATOM 0 HD23 LEU A 169 11.032 7.083 -0.293 1.00 60.34 H new ATOM 2388 N LEU A 170 10.973 9.613 -5.434 1.00 64.41 N ATOM 2389 CA LEU A 170 12.013 10.229 -6.237 1.00 73.24 C ATOM 2390 C LEU A 170 11.480 11.452 -6.966 1.00 72.23 C ATOM 2391 O LEU A 170 12.240 12.309 -7.427 1.00 5.34 O ATOM 2392 CB LEU A 170 12.587 9.219 -7.196 1.00 60.41 C ATOM 2393 CG LEU A 170 13.200 7.991 -6.538 1.00 4.12 C ATOM 2394 CD1 LEU A 170 13.700 7.039 -7.585 1.00 64.55 C ATOM 2395 CD2 LEU A 170 14.323 8.390 -5.584 1.00 32.51 C ATOM 0 H LEU A 170 10.490 8.836 -5.885 1.00 64.41 H new ATOM 0 HA LEU A 170 12.814 10.568 -5.580 1.00 73.24 H new ATOM 0 HB2 LEU A 170 11.799 8.895 -7.875 1.00 60.41 H new ATOM 0 HB3 LEU A 170 13.349 9.707 -7.803 1.00 60.41 H new ATOM 0 HG LEU A 170 12.429 7.489 -5.954 1.00 4.12 H new ATOM 0 HD11 LEU A 170 14.136 6.164 -7.103 1.00 64.55 H new ATOM 0 HD12 LEU A 170 12.870 6.727 -8.219 1.00 64.55 H new ATOM 0 HD13 LEU A 170 14.457 7.533 -8.194 1.00 64.55 H new ATOM 0 HD21 LEU A 170 14.746 7.496 -5.126 1.00 32.51 H new ATOM 0 HD22 LEU A 170 15.101 8.917 -6.137 1.00 32.51 H new ATOM 0 HD23 LEU A 170 13.925 9.043 -4.807 1.00 32.51 H new ATOM 2407 N ALA A 171 10.180 11.506 -7.079 1.00 22.11 N ATOM 2408 CA ALA A 171 9.490 12.587 -7.745 1.00 11.10 C ATOM 2409 C ALA A 171 9.349 13.802 -6.842 1.00 1.11 C ATOM 2410 O ALA A 171 9.594 14.937 -7.269 1.00 4.42 O ATOM 2411 CB ALA A 171 8.119 12.121 -8.189 1.00 60.21 C ATOM 0 H ALA A 171 9.557 10.790 -6.706 1.00 22.11 H new ATOM 0 HA ALA A 171 10.082 12.879 -8.612 1.00 11.10 H new ATOM 0 HB1 ALA A 171 7.602 12.939 -8.691 1.00 60.21 H new ATOM 0 HB2 ALA A 171 8.225 11.282 -8.877 1.00 60.21 H new ATOM 0 HB3 ALA A 171 7.542 11.806 -7.319 1.00 60.21 H new ATOM 2417 N GLU A 172 8.962 13.582 -5.606 1.00 13.34 N ATOM 2418 CA GLU A 172 8.724 14.689 -4.705 1.00 3.25 C ATOM 2419 C GLU A 172 9.782 14.794 -3.622 1.00 34.24 C ATOM 2420 O GLU A 172 10.599 13.889 -3.436 1.00 14.42 O ATOM 2421 CB GLU A 172 7.319 14.624 -4.111 1.00 52.53 C ATOM 2422 CG GLU A 172 6.252 14.574 -5.181 1.00 11.35 C ATOM 2423 CD GLU A 172 4.859 14.715 -4.661 1.00 54.42 C ATOM 2424 OE1 GLU A 172 4.347 13.786 -4.032 1.00 43.21 O ATOM 2425 OE2 GLU A 172 4.238 15.781 -4.897 1.00 72.11 O ATOM 0 H GLU A 172 8.806 12.658 -5.204 1.00 13.34 H new ATOM 0 HA GLU A 172 8.796 15.601 -5.298 1.00 3.25 H new ATOM 0 HB2 GLU A 172 7.235 13.743 -3.474 1.00 52.53 H new ATOM 0 HB3 GLU A 172 7.154 15.494 -3.475 1.00 52.53 H new ATOM 0 HG2 GLU A 172 6.440 15.368 -5.904 1.00 11.35 H new ATOM 0 HG3 GLU A 172 6.334 13.628 -5.717 1.00 11.35 H new ATOM 2432 N GLU A 173 9.761 15.892 -2.925 1.00 52.30 N ATOM 2433 CA GLU A 173 10.717 16.177 -1.896 1.00 61.52 C ATOM 2434 C GLU A 173 10.033 16.876 -0.745 1.00 10.02 C ATOM 2435 O GLU A 173 9.857 16.249 0.316 1.00 37.00 O ATOM 2436 CB GLU A 173 11.861 17.029 -2.447 1.00 23.41 C ATOM 2437 CG GLU A 173 12.907 17.388 -1.413 1.00 54.33 C ATOM 2438 CD GLU A 173 14.040 18.173 -1.992 1.00 74.21 C ATOM 2439 OE1 GLU A 173 13.953 19.414 -2.035 1.00 32.15 O ATOM 2440 OE2 GLU A 173 15.038 17.560 -2.408 1.00 31.34 O ATOM 2441 OXT GLU A 173 9.621 18.050 -0.920 1.00 37.00 O ATOM 0 H GLU A 173 9.067 16.627 -3.058 1.00 52.30 H new ATOM 0 HA GLU A 173 11.141 15.240 -1.535 1.00 61.52 H new ATOM 0 HB2 GLU A 173 12.341 16.491 -3.265 1.00 23.41 H new ATOM 0 HB3 GLU A 173 11.449 17.946 -2.867 1.00 23.41 H new ATOM 0 HG2 GLU A 173 12.441 17.965 -0.614 1.00 54.33 H new ATOM 0 HG3 GLU A 173 13.295 16.475 -0.962 1.00 54.33 H new TER 2448 GLU A 173