USER MOD reduce.3.24.130724 H: found=0, std=0, add=1414, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1414 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 30 GLN : amide:sc= 1.35 K(o=3.6,f=2.1) USER MOD Set 1.2: A 75 TYR OH : rot 28:sc= 0.588 USER MOD Set 1.3: A 159 THR OG1 : rot 174:sc= 1.7 USER MOD Set 2.1: A 27 GLN :FLIP amide:sc= -1.26 F(o=-4,f=-3.3) USER MOD Set 2.2: A 163 ASN : amide:sc= -2.08 K(o=-3.3,f=-4!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0 (180deg=-0.108) USER MOD Single : A 3 HIS : no HD1:sc= -0.0592 X(o=-0.059,f=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.155 K(o=-0.15,f=-0.73) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=-0.0032) USER MOD Single : A 8 HIS : no HD1:sc= -0.181 X(o=-0.18,f=-0.49) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 HIS : no HD1:sc= -0.0308 X(o=-0.031,f=-0.031) USER MOD Single : A 11 MET CE :methyl -160:sc= -0.145 (180deg=-0.674) USER MOD Single : A 13 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.081) USER MOD Single : A 21 THR OG1 : rot 176:sc= -0.757 USER MOD Single : A 31 GLN :FLIP amide:sc= -0.124 F(o=-1,f=-0.12) USER MOD Single : A 35 MET CE :methyl -120:sc= -1.6 (180deg=-2.82!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 68:sc= 0.555 USER MOD Single : A 41 MET CE :methyl -142:sc= -0.41 (180deg=-3.15!) USER MOD Single : A 45 THR OG1 : rot 180:sc= -0.0872 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 CYS SG : rot 180:sc= -0.106 USER MOD Single : A 51 TYR OH : rot -106:sc= 0.48 USER MOD Single : A 53 TYR OH : rot 130:sc= -0.117 USER MOD Single : A 54 MET CE :methyl 154:sc= 0 (180deg=-0.89) USER MOD Single : A 57 HIS : no HE2:sc= -2.78! K(o=-2.8!,f=-4.1) USER MOD Single : A 59 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 159:sc= 1.22 (180deg=1.19) USER MOD Single : A 77 HIS : no HD1:sc= 0.0219 K(o=0.022,f=-2.7!) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0.996 (180deg=0.996) USER MOD Single : A 85 ASN : amide:sc= 1.1 K(o=1.1,f=-0.3) USER MOD Single : A 88 CYS SG : rot -38:sc= 0.157 USER MOD Single : A 95 HIS :FLIP no HD1:sc= -0.275 F(o=-0.79,f=-0.27) USER MOD Single : A 96 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 MET CE :methyl -137:sc= -0.896 (180deg=-2.72!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 GLN : amide:sc= -0.335 X(o=-0.34,f=-0.24) USER MOD Single : A 108 SER OG : rot 85:sc= 0.709 USER MOD Single : A 109 HIS : +bothHN:sc= -7.3! C(o=-7.3!,f=-11!) USER MOD Single : A 110 GLN :FLIP amide:sc= 0 F(o=-0.85,f=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 114 GLN :FLIP amide:sc= -0.0911 F(o=-0.73,f=-0.091) USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.17 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 120 ASN : amide:sc= -0.212 X(o=-0.21,f=0) USER MOD Single : A 122 CYS SG : rot 73:sc= 0.284 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 127 ASN : amide:sc= -0.016 X(o=-0.016,f=-0.31) USER MOD Single : A 132 ASN : amide:sc= 0.108 X(o=0.11,f=0) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.0349 K(o=-0.035,f=-0.58) USER MOD Single : A 136 ASN : amide:sc= -1.07 X(o=-1.1,f=-1.3) USER MOD Single : A 137 LYS NZ :NH3+ -157:sc= -0.099 (180deg=-0.563) USER MOD Single : A 138 CYS SG : rot 120:sc= -0.941! USER MOD Single : A 146 MET CE :methyl -157:sc= -0.117 (180deg=-0.682) USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 THR OG1 : rot -17:sc= 0.725 USER MOD Single : A 156 LYS NZ :NH3+ -158:sc= 0.941 (180deg=0.273) USER MOD Single : A 157 GLN : amide:sc= -0.0599 X(o=-0.06,f=-0.06) USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 THR OG1 : rot 80:sc= 1.04 USER MOD Single : A 164 THR OG1 : rot 180:sc= 0 USER MOD Single : A 165 ASN : amide:sc= -0.875! X(o=-0.87!,f=-0.9) USER MOD Single : A 176 SER OG : rot 49:sc= 0.583 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -35.439 2.893 -6.223 1.00 1.35 N ATOM 2 CA MET A 1 -34.641 4.089 -6.620 1.00 12.41 C ATOM 3 C MET A 1 -33.128 3.833 -6.509 1.00 50.13 C ATOM 4 O MET A 1 -32.350 4.293 -7.351 1.00 20.13 O ATOM 5 CB MET A 1 -35.028 5.300 -5.760 1.00 34.02 C ATOM 6 CG MET A 1 -36.458 5.785 -5.975 1.00 12.25 C ATOM 7 SD MET A 1 -36.873 7.188 -4.920 1.00 51.22 S ATOM 8 CE MET A 1 -38.522 7.584 -5.501 1.00 34.35 C ATOM 0 H1 MET A 1 -36.438 3.044 -6.470 1.00 1.35 H new ATOM 0 H2 MET A 1 -35.081 2.055 -6.724 1.00 1.35 H new ATOM 0 H3 MET A 1 -35.355 2.745 -5.197 1.00 1.35 H new ATOM 0 HA MET A 1 -34.869 4.297 -7.665 1.00 12.41 H new ATOM 0 HB2 MET A 1 -34.897 5.042 -4.709 1.00 34.02 H new ATOM 0 HB3 MET A 1 -34.342 6.119 -5.975 1.00 34.02 H new ATOM 0 HG2 MET A 1 -36.590 6.067 -7.019 1.00 12.25 H new ATOM 0 HG3 MET A 1 -37.150 4.967 -5.776 1.00 12.25 H new ATOM 0 HE1 MET A 1 -38.911 8.434 -4.941 1.00 34.35 H new ATOM 0 HE2 MET A 1 -38.484 7.835 -6.561 1.00 34.35 H new ATOM 0 HE3 MET A 1 -39.175 6.724 -5.355 1.00 34.35 H new ATOM 20 N GLY A 2 -32.711 3.117 -5.467 1.00 51.32 N ATOM 21 CA GLY A 2 -31.298 2.792 -5.289 1.00 10.21 C ATOM 22 C GLY A 2 -30.511 3.891 -4.575 1.00 34.24 C ATOM 23 O GLY A 2 -30.698 4.121 -3.381 1.00 64.34 O ATOM 0 H GLY A 2 -33.326 2.753 -4.739 1.00 51.32 H new ATOM 0 HA2 GLY A 2 -31.214 1.866 -4.720 1.00 10.21 H new ATOM 0 HA3 GLY A 2 -30.849 2.608 -6.265 1.00 10.21 H new ATOM 27 N HIS A 3 -29.620 4.556 -5.313 1.00 25.31 N ATOM 28 CA HIS A 3 -28.795 5.651 -4.777 1.00 63.40 C ATOM 29 C HIS A 3 -28.023 5.240 -3.506 1.00 3.13 C ATOM 30 O HIS A 3 -27.982 5.982 -2.521 1.00 62.54 O ATOM 31 CB HIS A 3 -29.665 6.886 -4.501 1.00 22.51 C ATOM 32 CG HIS A 3 -30.315 7.440 -5.732 1.00 54.11 C ATOM 33 ND1 HIS A 3 -29.625 8.159 -6.682 1.00 40.32 N ATOM 34 CD2 HIS A 3 -31.592 7.363 -6.179 1.00 71.11 C ATOM 35 CE1 HIS A 3 -30.441 8.499 -7.656 1.00 12.44 C ATOM 36 NE2 HIS A 3 -31.640 8.030 -7.377 1.00 15.00 N ATOM 0 H HIS A 3 -29.447 4.354 -6.298 1.00 25.31 H new ATOM 0 HA HIS A 3 -28.052 5.895 -5.536 1.00 63.40 H new ATOM 0 HB2 HIS A 3 -30.437 6.624 -3.778 1.00 22.51 H new ATOM 0 HB3 HIS A 3 -29.049 7.661 -4.044 1.00 22.51 H new ATOM 0 HD2 HIS A 3 -32.416 6.870 -5.685 1.00 71.11 H new ATOM 0 HE1 HIS A 3 -30.173 9.066 -8.535 1.00 12.44 H new ATOM 0 HE2 HIS A 3 -32.470 8.144 -7.958 1.00 15.00 H new ATOM 45 N HIS A 4 -27.370 4.080 -3.554 1.00 12.02 N ATOM 46 CA HIS A 4 -26.632 3.551 -2.395 1.00 53.10 C ATOM 47 C HIS A 4 -25.207 4.137 -2.312 1.00 63.34 C ATOM 48 O HIS A 4 -24.259 3.453 -1.918 1.00 60.04 O ATOM 49 CB HIS A 4 -26.579 2.021 -2.476 1.00 75.14 C ATOM 50 CG HIS A 4 -27.936 1.383 -2.511 1.00 21.14 C ATOM 51 ND1 HIS A 4 -28.704 1.192 -1.385 1.00 32.44 N ATOM 52 CD2 HIS A 4 -28.671 0.907 -3.545 1.00 51.23 C ATOM 53 CE1 HIS A 4 -29.847 0.631 -1.719 1.00 43.13 C ATOM 54 NE2 HIS A 4 -29.855 0.448 -3.023 1.00 13.34 N ATOM 0 H HIS A 4 -27.334 3.484 -4.381 1.00 12.02 H new ATOM 0 HA HIS A 4 -27.159 3.850 -1.489 1.00 53.10 H new ATOM 0 HB2 HIS A 4 -26.025 1.730 -3.368 1.00 75.14 H new ATOM 0 HB3 HIS A 4 -26.026 1.637 -1.618 1.00 75.14 H new ATOM 0 HD2 HIS A 4 -28.380 0.892 -4.585 1.00 51.23 H new ATOM 0 HE1 HIS A 4 -30.643 0.366 -1.039 1.00 43.13 H new ATOM 0 HE2 HIS A 4 -30.617 0.033 -3.558 1.00 13.34 H new ATOM 63 N HIS A 5 -25.080 5.420 -2.644 1.00 25.44 N ATOM 64 CA HIS A 5 -23.784 6.105 -2.672 1.00 41.44 C ATOM 65 C HIS A 5 -23.403 6.659 -1.284 1.00 24.14 C ATOM 66 O HIS A 5 -23.954 7.665 -0.834 1.00 64.25 O ATOM 67 CB HIS A 5 -23.829 7.247 -3.701 1.00 20.04 C ATOM 68 CG HIS A 5 -22.536 7.995 -3.845 1.00 71.43 C ATOM 69 ND1 HIS A 5 -21.555 7.637 -4.745 1.00 61.53 N ATOM 70 CD2 HIS A 5 -22.068 9.095 -3.205 1.00 72.40 C ATOM 71 CE1 HIS A 5 -20.546 8.480 -4.654 1.00 63.41 C ATOM 72 NE2 HIS A 5 -20.831 9.370 -3.729 1.00 23.02 N ATOM 0 H HIS A 5 -25.868 6.015 -2.901 1.00 25.44 H new ATOM 0 HA HIS A 5 -23.022 5.379 -2.958 1.00 41.44 H new ATOM 0 HB2 HIS A 5 -24.108 6.836 -4.671 1.00 20.04 H new ATOM 0 HB3 HIS A 5 -24.612 7.949 -3.414 1.00 20.04 H new ATOM 0 HD2 HIS A 5 -22.574 9.650 -2.429 1.00 72.40 H new ATOM 0 HE1 HIS A 5 -19.639 8.446 -5.240 1.00 63.41 H new ATOM 0 HE2 HIS A 5 -20.228 10.142 -3.446 1.00 23.02 H new ATOM 81 N HIS A 6 -22.458 5.997 -0.613 1.00 71.30 N ATOM 82 CA HIS A 6 -21.960 6.463 0.690 1.00 23.12 C ATOM 83 C HIS A 6 -20.567 5.889 1.010 1.00 24.01 C ATOM 84 O HIS A 6 -20.309 4.703 0.808 1.00 54.50 O ATOM 85 CB HIS A 6 -22.958 6.110 1.806 1.00 4.53 C ATOM 86 CG HIS A 6 -23.377 4.667 1.827 1.00 75.34 C ATOM 87 ND1 HIS A 6 -24.526 4.214 1.214 1.00 64.51 N ATOM 88 CD2 HIS A 6 -22.808 3.574 2.397 1.00 63.42 C ATOM 89 CE1 HIS A 6 -24.647 2.918 1.405 1.00 60.23 C ATOM 90 NE2 HIS A 6 -23.621 2.505 2.118 1.00 45.44 N ATOM 0 H HIS A 6 -22.021 5.138 -0.947 1.00 71.30 H new ATOM 0 HA HIS A 6 -21.862 7.547 0.634 1.00 23.12 H new ATOM 0 HB2 HIS A 6 -22.512 6.361 2.769 1.00 4.53 H new ATOM 0 HB3 HIS A 6 -23.846 6.732 1.694 1.00 4.53 H new ATOM 0 HD2 HIS A 6 -21.889 3.551 2.963 1.00 63.42 H new ATOM 0 HE1 HIS A 6 -25.452 2.298 1.039 1.00 60.23 H new ATOM 0 HE2 HIS A 6 -23.457 1.543 2.416 1.00 45.44 H new ATOM 99 N HIS A 7 -19.669 6.748 1.490 1.00 14.22 N ATOM 100 CA HIS A 7 -18.327 6.330 1.920 1.00 72.32 C ATOM 101 C HIS A 7 -18.235 6.238 3.450 1.00 74.42 C ATOM 102 O HIS A 7 -19.043 6.824 4.174 1.00 35.21 O ATOM 103 CB HIS A 7 -17.263 7.315 1.415 1.00 50.42 C ATOM 104 CG HIS A 7 -17.053 7.305 -0.070 1.00 30.23 C ATOM 105 ND1 HIS A 7 -15.931 6.770 -0.662 1.00 42.03 N ATOM 106 CD2 HIS A 7 -17.801 7.802 -1.081 1.00 75.23 C ATOM 107 CE1 HIS A 7 -15.995 6.941 -1.964 1.00 42.11 C ATOM 108 NE2 HIS A 7 -17.119 7.566 -2.253 1.00 53.42 N ATOM 0 H HIS A 7 -19.845 7.747 1.593 1.00 14.22 H new ATOM 0 HA HIS A 7 -18.145 5.344 1.493 1.00 72.32 H new ATOM 0 HB2 HIS A 7 -17.546 8.322 1.721 1.00 50.42 H new ATOM 0 HB3 HIS A 7 -16.316 7.087 1.904 1.00 50.42 H new ATOM 0 HD2 HIS A 7 -18.758 8.294 -0.986 1.00 75.23 H new ATOM 0 HE1 HIS A 7 -15.250 6.622 -2.678 1.00 42.11 H new ATOM 0 HE2 HIS A 7 -17.431 7.830 -3.188 1.00 53.42 H new ATOM 117 N HIS A 8 -17.235 5.505 3.935 1.00 60.32 N ATOM 118 CA HIS A 8 -16.975 5.382 5.374 1.00 13.32 C ATOM 119 C HIS A 8 -15.492 5.072 5.641 1.00 0.33 C ATOM 120 O HIS A 8 -15.010 3.981 5.338 1.00 53.23 O ATOM 121 CB HIS A 8 -17.872 4.298 5.992 1.00 32.21 C ATOM 122 CG HIS A 8 -17.780 2.965 5.309 1.00 21.34 C ATOM 123 ND1 HIS A 8 -17.024 1.922 5.792 1.00 20.41 N ATOM 124 CD2 HIS A 8 -18.364 2.505 4.177 1.00 22.41 C ATOM 125 CE1 HIS A 8 -17.144 0.883 4.994 1.00 55.23 C ATOM 126 NE2 HIS A 8 -17.952 1.206 4.004 1.00 11.13 N ATOM 0 H HIS A 8 -16.584 4.982 3.349 1.00 60.32 H new ATOM 0 HA HIS A 8 -17.211 6.337 5.844 1.00 13.32 H new ATOM 0 HB2 HIS A 8 -17.605 4.176 7.042 1.00 32.21 H new ATOM 0 HB3 HIS A 8 -18.907 4.638 5.964 1.00 32.21 H new ATOM 0 HD2 HIS A 8 -19.030 3.057 3.530 1.00 22.41 H new ATOM 0 HE1 HIS A 8 -16.661 -0.074 5.128 1.00 55.23 H new ATOM 0 HE2 HIS A 8 -18.226 0.593 3.236 1.00 11.13 H new ATOM 135 N SER A 9 -14.771 6.049 6.190 1.00 12.35 N ATOM 136 CA SER A 9 -13.338 5.891 6.485 1.00 74.31 C ATOM 137 C SER A 9 -12.855 6.959 7.475 1.00 14.54 C ATOM 138 O SER A 9 -13.331 8.095 7.459 1.00 54.14 O ATOM 139 CB SER A 9 -12.502 5.973 5.198 1.00 53.02 C ATOM 140 OG SER A 9 -12.636 7.240 4.568 1.00 1.32 O ATOM 0 H SER A 9 -15.152 6.961 6.442 1.00 12.35 H new ATOM 0 HA SER A 9 -13.206 4.907 6.936 1.00 74.31 H new ATOM 0 HB2 SER A 9 -11.453 5.791 5.432 1.00 53.02 H new ATOM 0 HB3 SER A 9 -12.815 5.188 4.509 1.00 53.02 H new ATOM 0 HG SER A 9 -12.091 7.260 3.754 1.00 1.32 H new ATOM 146 N HIS A 10 -11.916 6.588 8.345 1.00 62.32 N ATOM 147 CA HIS A 10 -11.376 7.514 9.351 1.00 41.13 C ATOM 148 C HIS A 10 -9.842 7.442 9.414 1.00 70.21 C ATOM 149 O HIS A 10 -9.266 6.354 9.453 1.00 31.11 O ATOM 150 CB HIS A 10 -11.963 7.196 10.733 1.00 54.22 C ATOM 151 CG HIS A 10 -13.459 7.136 10.746 1.00 60.52 C ATOM 152 ND1 HIS A 10 -14.258 8.253 10.823 1.00 53.02 N ATOM 153 CD2 HIS A 10 -14.302 6.080 10.676 1.00 12.23 C ATOM 154 CE1 HIS A 10 -15.523 7.889 10.801 1.00 61.32 C ATOM 155 NE2 HIS A 10 -15.578 6.577 10.712 1.00 73.44 N ATOM 0 H HIS A 10 -11.511 5.653 8.377 1.00 62.32 H new ATOM 0 HA HIS A 10 -11.660 8.525 9.057 1.00 41.13 H new ATOM 0 HB2 HIS A 10 -11.566 6.241 11.077 1.00 54.22 H new ATOM 0 HB3 HIS A 10 -11.631 7.953 11.443 1.00 54.22 H new ATOM 0 HD2 HIS A 10 -14.021 5.040 10.605 1.00 12.23 H new ATOM 0 HE1 HIS A 10 -16.372 8.555 10.848 1.00 61.32 H new ATOM 0 HE2 HIS A 10 -16.432 6.021 10.676 1.00 73.44 H new ATOM 164 N MET A 11 -9.190 8.605 9.437 1.00 31.14 N ATOM 165 CA MET A 11 -7.722 8.679 9.508 1.00 35.12 C ATOM 166 C MET A 11 -7.262 9.491 10.728 1.00 53.15 C ATOM 167 O MET A 11 -7.939 10.428 11.156 1.00 64.10 O ATOM 168 CB MET A 11 -7.150 9.300 8.223 1.00 33.14 C ATOM 169 CG MET A 11 -7.448 8.496 6.962 1.00 31.13 C ATOM 170 SD MET A 11 -6.734 9.238 5.478 1.00 0.40 S ATOM 171 CE MET A 11 -7.561 10.829 5.461 1.00 52.52 C ATOM 0 H MET A 11 -9.653 9.513 9.408 1.00 31.14 H new ATOM 0 HA MET A 11 -7.346 7.661 9.612 1.00 35.12 H new ATOM 0 HB2 MET A 11 -7.555 10.305 8.105 1.00 33.14 H new ATOM 0 HB3 MET A 11 -6.070 9.402 8.330 1.00 33.14 H new ATOM 0 HG2 MET A 11 -7.059 7.485 7.081 1.00 31.13 H new ATOM 0 HG3 MET A 11 -8.527 8.410 6.837 1.00 31.13 H new ATOM 0 HE1 MET A 11 -7.514 11.253 4.458 1.00 52.52 H new ATOM 0 HE2 MET A 11 -8.604 10.700 5.752 1.00 52.52 H new ATOM 0 HE3 MET A 11 -7.069 11.502 6.163 1.00 52.52 H new ATOM 181 N ASP A 12 -6.113 9.120 11.284 1.00 63.11 N ATOM 182 CA ASP A 12 -5.552 9.798 12.461 1.00 44.05 C ATOM 183 C ASP A 12 -4.699 11.017 12.066 1.00 21.25 C ATOM 184 O ASP A 12 -4.520 11.312 10.884 1.00 61.44 O ATOM 185 CB ASP A 12 -4.699 8.809 13.262 1.00 75.50 C ATOM 186 CG ASP A 12 -5.479 7.570 13.664 1.00 64.21 C ATOM 187 OD1 ASP A 12 -5.829 6.772 12.774 1.00 14.34 O ATOM 188 OD2 ASP A 12 -5.742 7.381 14.870 1.00 13.11 O ATOM 0 H ASP A 12 -5.544 8.347 10.939 1.00 63.11 H new ATOM 0 HA ASP A 12 -6.382 10.157 13.070 1.00 44.05 H new ATOM 0 HB2 ASP A 12 -3.834 8.514 12.668 1.00 75.50 H new ATOM 0 HB3 ASP A 12 -4.318 9.302 14.156 1.00 75.50 H new ATOM 193 N LYS A 13 -4.166 11.718 13.068 1.00 32.01 N ATOM 194 CA LYS A 13 -3.321 12.897 12.834 1.00 64.15 C ATOM 195 C LYS A 13 -1.830 12.512 12.770 1.00 40.30 C ATOM 196 O LYS A 13 -1.164 12.720 11.755 1.00 22.41 O ATOM 197 CB LYS A 13 -3.546 13.937 13.944 1.00 53.22 C ATOM 198 CG LYS A 13 -5.004 14.361 14.122 1.00 31.25 C ATOM 199 CD LYS A 13 -5.584 14.986 12.853 1.00 75.50 C ATOM 200 CE LYS A 13 -6.995 15.523 13.078 1.00 4.45 C ATOM 201 NZ LYS A 13 -7.940 14.456 13.503 1.00 10.42 N ATOM 0 H LYS A 13 -4.303 11.491 14.053 1.00 32.01 H new ATOM 0 HA LYS A 13 -3.603 13.327 11.873 1.00 64.15 H new ATOM 0 HB2 LYS A 13 -3.180 13.530 14.887 1.00 53.22 H new ATOM 0 HB3 LYS A 13 -2.947 14.821 13.725 1.00 53.22 H new ATOM 0 HG2 LYS A 13 -5.601 13.493 14.403 1.00 31.25 H new ATOM 0 HG3 LYS A 13 -5.075 15.076 14.942 1.00 31.25 H new ATOM 0 HD2 LYS A 13 -4.936 15.796 12.518 1.00 75.50 H new ATOM 0 HD3 LYS A 13 -5.601 14.242 12.057 1.00 75.50 H new ATOM 0 HE2 LYS A 13 -6.968 16.305 13.837 1.00 4.45 H new ATOM 0 HE3 LYS A 13 -7.358 15.983 12.159 1.00 4.45 H new ATOM 0 HZ1 LYS A 13 -8.909 14.834 13.513 1.00 10.42 H new ATOM 0 HZ2 LYS A 13 -7.886 13.659 12.837 1.00 10.42 H new ATOM 0 HZ3 LYS A 13 -7.687 14.128 14.457 1.00 10.42 H new ATOM 215 N ARG A 14 -1.313 11.963 13.870 1.00 20.43 N ATOM 216 CA ARG A 14 0.082 11.503 13.934 1.00 54.11 C ATOM 217 C ARG A 14 0.318 10.591 15.149 1.00 51.24 C ATOM 218 O ARG A 14 -0.301 10.760 16.201 1.00 32.40 O ATOM 219 CB ARG A 14 1.066 12.685 13.991 1.00 11.15 C ATOM 220 CG ARG A 14 0.865 13.608 15.189 1.00 71.24 C ATOM 221 CD ARG A 14 2.082 14.497 15.446 1.00 43.23 C ATOM 222 NE ARG A 14 2.482 15.270 14.271 1.00 61.32 N ATOM 223 CZ ARG A 14 1.987 16.436 13.950 1.00 60.32 C ATOM 224 NH1 ARG A 14 1.041 16.972 14.653 1.00 62.23 N ATOM 225 NH2 ARG A 14 2.447 17.065 12.920 1.00 24.23 N ATOM 0 H ARG A 14 -1.838 11.824 14.733 1.00 20.43 H new ATOM 0 HA ARG A 14 0.264 10.935 13.021 1.00 54.11 H new ATOM 0 HB2 ARG A 14 2.084 12.295 14.013 1.00 11.15 H new ATOM 0 HB3 ARG A 14 0.968 13.269 13.076 1.00 11.15 H new ATOM 0 HG2 ARG A 14 -0.011 14.234 15.019 1.00 71.24 H new ATOM 0 HG3 ARG A 14 0.661 13.009 16.077 1.00 71.24 H new ATOM 0 HD2 ARG A 14 1.859 15.180 16.265 1.00 43.23 H new ATOM 0 HD3 ARG A 14 2.918 13.876 15.767 1.00 43.23 H new ATOM 0 HE ARG A 14 3.196 14.872 13.661 1.00 61.32 H new ATOM 0 HH11 ARG A 14 0.673 16.483 15.469 1.00 62.23 H new ATOM 0 HH12 ARG A 14 0.664 17.883 14.391 1.00 62.23 H new ATOM 0 HH21 ARG A 14 3.193 16.651 12.361 1.00 24.23 H new ATOM 0 HH22 ARG A 14 2.064 17.975 12.665 1.00 24.23 H new ATOM 239 N LEU A 15 1.236 9.643 14.992 1.00 42.55 N ATOM 240 CA LEU A 15 1.584 8.690 16.055 1.00 31.14 C ATOM 241 C LEU A 15 2.741 9.196 16.941 1.00 32.41 C ATOM 242 O LEU A 15 3.570 9.998 16.506 1.00 30.55 O ATOM 243 CB LEU A 15 1.924 7.318 15.430 1.00 12.30 C ATOM 244 CG LEU A 15 2.767 7.346 14.135 1.00 4.30 C ATOM 245 CD1 LEU A 15 4.196 7.819 14.392 1.00 11.12 C ATOM 246 CD2 LEU A 15 2.770 5.974 13.473 1.00 14.24 C ATOM 0 H LEU A 15 1.762 9.509 14.129 1.00 42.55 H new ATOM 0 HA LEU A 15 0.718 8.585 16.709 1.00 31.14 H new ATOM 0 HB2 LEU A 15 2.458 6.726 16.173 1.00 12.30 H new ATOM 0 HB3 LEU A 15 0.990 6.797 15.219 1.00 12.30 H new ATOM 0 HG LEU A 15 2.304 8.065 13.460 1.00 4.30 H new ATOM 0 HD11 LEU A 15 4.752 7.823 13.455 1.00 11.12 H new ATOM 0 HD12 LEU A 15 4.177 8.827 14.807 1.00 11.12 H new ATOM 0 HD13 LEU A 15 4.681 7.145 15.098 1.00 11.12 H new ATOM 0 HD21 LEU A 15 3.368 6.011 12.562 1.00 14.24 H new ATOM 0 HD22 LEU A 15 3.196 5.241 14.158 1.00 14.24 H new ATOM 0 HD23 LEU A 15 1.748 5.688 13.225 1.00 14.24 H new ATOM 258 N PHE A 16 2.770 8.736 18.193 1.00 4.32 N ATOM 259 CA PHE A 16 3.845 9.082 19.137 1.00 41.34 C ATOM 260 C PHE A 16 4.420 7.819 19.799 1.00 22.31 C ATOM 261 O PHE A 16 3.706 7.100 20.501 1.00 62.11 O ATOM 262 CB PHE A 16 3.325 10.029 20.229 1.00 1.35 C ATOM 263 CG PHE A 16 2.910 11.389 19.727 1.00 42.20 C ATOM 264 CD1 PHE A 16 3.842 12.411 19.605 1.00 73.34 C ATOM 265 CD2 PHE A 16 1.590 11.648 19.387 1.00 54.24 C ATOM 266 CE1 PHE A 16 3.467 13.660 19.153 1.00 53.31 C ATOM 267 CE2 PHE A 16 1.211 12.896 18.934 1.00 65.44 C ATOM 268 CZ PHE A 16 2.149 13.903 18.818 1.00 73.43 C ATOM 0 H PHE A 16 2.058 8.118 18.583 1.00 4.32 H new ATOM 0 HA PHE A 16 4.632 9.580 18.571 1.00 41.34 H new ATOM 0 HB2 PHE A 16 2.473 9.562 20.723 1.00 1.35 H new ATOM 0 HB3 PHE A 16 4.101 10.155 20.984 1.00 1.35 H new ATOM 0 HD1 PHE A 16 4.873 12.226 19.867 1.00 73.34 H new ATOM 0 HD2 PHE A 16 0.851 10.865 19.478 1.00 54.24 H new ATOM 0 HE1 PHE A 16 4.202 14.446 19.061 1.00 53.31 H new ATOM 0 HE2 PHE A 16 0.181 13.085 18.670 1.00 65.44 H new ATOM 0 HZ PHE A 16 1.852 14.880 18.466 1.00 73.43 H new ATOM 278 N LEU A 17 5.710 7.558 19.582 1.00 74.23 N ATOM 279 CA LEU A 17 6.367 6.366 20.143 1.00 71.24 C ATOM 280 C LEU A 17 7.898 6.480 20.062 1.00 42.04 C ATOM 281 O LEU A 17 8.432 7.449 19.520 1.00 12.32 O ATOM 282 CB LEU A 17 5.891 5.085 19.425 1.00 5.44 C ATOM 283 CG LEU A 17 6.369 4.890 17.971 1.00 65.54 C ATOM 284 CD1 LEU A 17 5.887 3.547 17.429 1.00 4.44 C ATOM 285 CD2 LEU A 17 5.893 6.027 17.070 1.00 64.42 C ATOM 0 H LEU A 17 6.323 8.152 19.024 1.00 74.23 H new ATOM 0 HA LEU A 17 6.085 6.303 21.194 1.00 71.24 H new ATOM 0 HB2 LEU A 17 6.218 4.225 20.009 1.00 5.44 H new ATOM 0 HB3 LEU A 17 4.801 5.077 19.429 1.00 5.44 H new ATOM 0 HG LEU A 17 7.459 4.900 17.974 1.00 65.54 H new ATOM 0 HD11 LEU A 17 6.232 3.424 16.402 1.00 4.44 H new ATOM 0 HD12 LEU A 17 6.286 2.741 18.045 1.00 4.44 H new ATOM 0 HD13 LEU A 17 4.798 3.515 17.452 1.00 4.44 H new ATOM 0 HD21 LEU A 17 6.247 5.858 16.053 1.00 64.42 H new ATOM 0 HD22 LEU A 17 4.804 6.062 17.074 1.00 64.42 H new ATOM 0 HD23 LEU A 17 6.288 6.973 17.439 1.00 64.42 H new ATOM 297 N ASP A 18 8.598 5.490 20.613 1.00 42.34 N ATOM 298 CA ASP A 18 10.063 5.473 20.604 1.00 2.45 C ATOM 299 C ASP A 18 10.620 5.135 19.206 1.00 70.15 C ATOM 300 O ASP A 18 9.991 4.402 18.436 1.00 62.12 O ATOM 301 CB ASP A 18 10.579 4.454 21.625 1.00 31.23 C ATOM 302 CG ASP A 18 9.953 4.646 22.993 1.00 21.21 C ATOM 303 OD1 ASP A 18 8.820 4.162 23.206 1.00 1.24 O ATOM 304 OD2 ASP A 18 10.582 5.290 23.857 1.00 31.41 O ATOM 0 H ASP A 18 8.174 4.685 21.074 1.00 42.34 H new ATOM 0 HA ASP A 18 10.409 6.472 20.872 1.00 2.45 H new ATOM 0 HB2 ASP A 18 10.367 3.446 21.269 1.00 31.23 H new ATOM 0 HB3 ASP A 18 11.662 4.542 21.708 1.00 31.23 H new ATOM 309 N PRO A 19 11.820 5.651 18.872 1.00 31.33 N ATOM 310 CA PRO A 19 12.454 5.419 17.560 1.00 63.11 C ATOM 311 C PRO A 19 12.662 3.926 17.247 1.00 21.00 C ATOM 312 O PRO A 19 12.183 3.414 16.233 1.00 74.41 O ATOM 313 CB PRO A 19 13.812 6.131 17.678 1.00 23.51 C ATOM 314 CG PRO A 19 13.664 7.092 18.810 1.00 42.12 C ATOM 315 CD PRO A 19 12.650 6.500 19.748 1.00 43.15 C ATOM 0 HA PRO A 19 11.828 5.791 16.749 1.00 63.11 H new ATOM 0 HB2 PRO A 19 14.613 5.418 17.872 1.00 23.51 H new ATOM 0 HB3 PRO A 19 14.064 6.650 16.753 1.00 23.51 H new ATOM 0 HG2 PRO A 19 14.617 7.244 19.316 1.00 42.12 H new ATOM 0 HG3 PRO A 19 13.335 8.067 18.450 1.00 42.12 H new ATOM 0 HD2 PRO A 19 13.126 5.917 20.537 1.00 43.15 H new ATOM 0 HD3 PRO A 19 12.057 7.273 20.236 1.00 43.15 H new ATOM 323 N ASP A 20 13.385 3.240 18.130 1.00 4.22 N ATOM 324 CA ASP A 20 13.670 1.810 17.970 1.00 50.54 C ATOM 325 C ASP A 20 12.372 0.976 17.946 1.00 10.14 C ATOM 326 O ASP A 20 12.251 0.005 17.196 1.00 1.53 O ATOM 327 CB ASP A 20 14.595 1.354 19.106 1.00 33.31 C ATOM 328 CG ASP A 20 15.049 -0.086 18.960 1.00 41.31 C ATOM 329 OD1 ASP A 20 15.955 -0.350 18.141 1.00 74.43 O ATOM 330 OD2 ASP A 20 14.506 -0.959 19.668 1.00 55.54 O ATOM 0 H ASP A 20 13.788 3.653 18.971 1.00 4.22 H new ATOM 0 HA ASP A 20 14.167 1.653 17.013 1.00 50.54 H new ATOM 0 HB2 ASP A 20 15.470 2.003 19.137 1.00 33.31 H new ATOM 0 HB3 ASP A 20 14.077 1.471 20.058 1.00 33.31 H new ATOM 335 N THR A 21 11.397 1.373 18.762 1.00 21.11 N ATOM 336 CA THR A 21 10.096 0.686 18.820 1.00 14.01 C ATOM 337 C THR A 21 9.326 0.814 17.495 1.00 53.24 C ATOM 338 O THR A 21 8.663 -0.128 17.050 1.00 25.05 O ATOM 339 CB THR A 21 9.219 1.246 19.971 1.00 23.33 C ATOM 340 OG1 THR A 21 9.952 1.210 21.207 1.00 23.25 O ATOM 341 CG2 THR A 21 7.923 0.452 20.122 1.00 34.23 C ATOM 0 H THR A 21 11.478 2.168 19.396 1.00 21.11 H new ATOM 0 HA THR A 21 10.307 -0.367 19.004 1.00 14.01 H new ATOM 0 HB THR A 21 8.961 2.276 19.724 1.00 23.33 H new ATOM 0 HG1 THR A 21 9.418 1.625 21.916 1.00 23.25 H new ATOM 0 HG21 THR A 21 7.333 0.871 20.937 1.00 34.23 H new ATOM 0 HG22 THR A 21 7.352 0.507 19.195 1.00 34.23 H new ATOM 0 HG23 THR A 21 8.158 -0.589 20.342 1.00 34.23 H new ATOM 349 N ALA A 22 9.423 1.980 16.859 1.00 13.20 N ATOM 350 CA ALA A 22 8.734 2.227 15.585 1.00 51.21 C ATOM 351 C ALA A 22 9.159 1.226 14.496 1.00 61.01 C ATOM 352 O ALA A 22 8.392 0.926 13.577 1.00 22.24 O ATOM 353 CB ALA A 22 8.983 3.659 15.121 1.00 10.02 C ATOM 0 H ALA A 22 9.970 2.770 17.201 1.00 13.20 H new ATOM 0 HA ALA A 22 7.667 2.086 15.755 1.00 51.21 H new ATOM 0 HB1 ALA A 22 8.467 3.830 14.176 1.00 10.02 H new ATOM 0 HB2 ALA A 22 8.607 4.355 15.871 1.00 10.02 H new ATOM 0 HB3 ALA A 22 10.053 3.816 14.984 1.00 10.02 H new ATOM 359 N ILE A 23 10.377 0.699 14.620 1.00 54.52 N ATOM 360 CA ILE A 23 10.906 -0.274 13.659 1.00 64.01 C ATOM 361 C ILE A 23 10.096 -1.577 13.692 1.00 14.51 C ATOM 362 O ILE A 23 9.542 -2.001 12.675 1.00 64.22 O ATOM 363 CB ILE A 23 12.401 -0.581 13.940 1.00 20.50 C ATOM 364 CG1 ILE A 23 13.228 0.720 13.917 1.00 70.11 C ATOM 365 CG2 ILE A 23 12.945 -1.583 12.922 1.00 44.42 C ATOM 366 CD1 ILE A 23 14.705 0.521 14.203 1.00 14.13 C ATOM 0 H ILE A 23 11.019 0.929 15.378 1.00 54.52 H new ATOM 0 HA ILE A 23 10.820 0.169 12.667 1.00 64.01 H new ATOM 0 HB ILE A 23 12.483 -1.025 14.932 1.00 20.50 H new ATOM 0 HG12 ILE A 23 13.118 1.190 12.940 1.00 70.11 H new ATOM 0 HG13 ILE A 23 12.817 1.412 14.652 1.00 70.11 H new ATOM 0 HG21 ILE A 23 13.995 -1.785 13.136 1.00 44.42 H new ATOM 0 HG22 ILE A 23 12.376 -2.511 12.985 1.00 44.42 H new ATOM 0 HG23 ILE A 23 12.853 -1.168 11.918 1.00 44.42 H new ATOM 0 HD11 ILE A 23 15.215 1.484 14.168 1.00 14.13 H new ATOM 0 HD12 ILE A 23 14.828 0.081 15.193 1.00 14.13 H new ATOM 0 HD13 ILE A 23 15.134 -0.145 13.454 1.00 14.13 H new ATOM 378 N GLU A 24 10.006 -2.198 14.870 1.00 55.32 N ATOM 379 CA GLU A 24 9.242 -3.441 15.028 1.00 31.11 C ATOM 380 C GLU A 24 7.764 -3.230 14.655 1.00 53.20 C ATOM 381 O GLU A 24 7.095 -4.145 14.181 1.00 51.13 O ATOM 382 CB GLU A 24 9.363 -3.973 16.470 1.00 73.42 C ATOM 383 CG GLU A 24 8.634 -3.131 17.522 1.00 52.11 C ATOM 384 CD GLU A 24 7.436 -3.854 18.131 1.00 73.34 C ATOM 385 OE1 GLU A 24 6.430 -4.056 17.418 1.00 74.23 O ATOM 386 OE2 GLU A 24 7.495 -4.229 19.320 1.00 24.35 O ATOM 0 H GLU A 24 10.450 -1.864 15.726 1.00 55.32 H new ATOM 0 HA GLU A 24 9.662 -4.183 14.349 1.00 31.11 H new ATOM 0 HB2 GLU A 24 8.972 -4.990 16.502 1.00 73.42 H new ATOM 0 HB3 GLU A 24 10.419 -4.029 16.736 1.00 73.42 H new ATOM 0 HG2 GLU A 24 9.333 -2.864 18.315 1.00 52.11 H new ATOM 0 HG3 GLU A 24 8.297 -2.200 17.066 1.00 52.11 H new ATOM 393 N ARG A 25 7.266 -2.012 14.877 1.00 24.42 N ATOM 394 CA ARG A 25 5.898 -1.642 14.487 1.00 61.45 C ATOM 395 C ARG A 25 5.711 -1.690 12.958 1.00 3.12 C ATOM 396 O ARG A 25 4.811 -2.361 12.445 1.00 62.21 O ATOM 397 CB ARG A 25 5.578 -0.222 14.977 1.00 22.33 C ATOM 398 CG ARG A 25 5.624 -0.030 16.492 1.00 3.11 C ATOM 399 CD ARG A 25 4.400 -0.615 17.188 1.00 62.31 C ATOM 400 NE ARG A 25 4.446 -2.072 17.275 1.00 23.13 N ATOM 401 CZ ARG A 25 3.422 -2.830 17.556 1.00 43.40 C ATOM 402 NH1 ARG A 25 2.246 -2.314 17.741 1.00 52.44 N ATOM 403 NH2 ARG A 25 3.584 -4.106 17.654 1.00 54.35 N ATOM 0 H ARG A 25 7.789 -1.261 15.326 1.00 24.42 H new ATOM 0 HA ARG A 25 5.222 -2.364 14.946 1.00 61.45 H new ATOM 0 HB2 ARG A 25 6.283 0.471 14.518 1.00 22.33 H new ATOM 0 HB3 ARG A 25 4.584 0.052 14.622 1.00 22.33 H new ATOM 0 HG2 ARG A 25 6.524 -0.501 16.888 1.00 3.11 H new ATOM 0 HG3 ARG A 25 5.694 1.034 16.719 1.00 3.11 H new ATOM 0 HD2 ARG A 25 4.323 -0.197 18.192 1.00 62.31 H new ATOM 0 HD3 ARG A 25 3.502 -0.315 16.648 1.00 62.31 H new ATOM 0 HE ARG A 25 5.342 -2.529 17.104 1.00 23.13 H new ATOM 0 HH11 ARG A 25 2.114 -1.305 17.667 1.00 52.44 H new ATOM 0 HH12 ARG A 25 1.453 -2.917 17.960 1.00 52.44 H new ATOM 0 HH21 ARG A 25 4.507 -4.515 17.512 1.00 54.35 H new ATOM 0 HH22 ARG A 25 2.789 -4.706 17.873 1.00 54.35 H new ATOM 417 N LEU A 26 6.574 -0.967 12.245 1.00 51.52 N ATOM 418 CA LEU A 26 6.466 -0.824 10.787 1.00 25.35 C ATOM 419 C LEU A 26 6.730 -2.153 10.057 1.00 20.40 C ATOM 420 O LEU A 26 6.049 -2.484 9.083 1.00 43.14 O ATOM 421 CB LEU A 26 7.444 0.255 10.300 1.00 64.51 C ATOM 422 CG LEU A 26 7.352 0.614 8.806 1.00 62.43 C ATOM 423 CD1 LEU A 26 5.950 1.102 8.447 1.00 73.51 C ATOM 424 CD2 LEU A 26 8.399 1.665 8.445 1.00 1.12 C ATOM 0 H LEU A 26 7.363 -0.466 12.654 1.00 51.52 H new ATOM 0 HA LEU A 26 5.444 -0.525 10.554 1.00 25.35 H new ATOM 0 HB2 LEU A 26 7.277 1.161 10.883 1.00 64.51 H new ATOM 0 HB3 LEU A 26 8.460 -0.079 10.513 1.00 64.51 H new ATOM 0 HG LEU A 26 7.552 -0.287 8.226 1.00 62.43 H new ATOM 0 HD11 LEU A 26 5.911 1.349 7.386 1.00 73.51 H new ATOM 0 HD12 LEU A 26 5.225 0.317 8.663 1.00 73.51 H new ATOM 0 HD13 LEU A 26 5.712 1.988 9.035 1.00 73.51 H new ATOM 0 HD21 LEU A 26 8.321 1.908 7.385 1.00 1.12 H new ATOM 0 HD22 LEU A 26 8.230 2.565 9.037 1.00 1.12 H new ATOM 0 HD23 LEU A 26 9.395 1.274 8.655 1.00 1.12 H new ATOM 436 N GLN A 27 7.714 -2.914 10.537 1.00 14.31 N ATOM 437 CA GLN A 27 8.065 -4.210 9.934 1.00 4.02 C ATOM 438 C GLN A 27 6.848 -5.149 9.828 1.00 34.03 C ATOM 439 O GLN A 27 6.711 -5.897 8.859 1.00 65.41 O ATOM 440 CB GLN A 27 9.186 -4.881 10.741 1.00 65.43 C ATOM 441 CG GLN A 27 10.520 -4.138 10.675 1.00 53.43 C ATOM 442 CD GLN A 27 11.132 -4.129 9.279 1.00 41.03 C ATOM 443 OE1 GLN A 27 11.916 -3.113 8.980 1.00 13.04 O flip ATOM 444 NE2 GLN A 27 10.920 -5.038 8.483 1.00 22.04 N flip ATOM 0 H GLN A 27 8.286 -2.659 11.342 1.00 14.31 H new ATOM 0 HA GLN A 27 8.414 -4.016 8.920 1.00 4.02 H new ATOM 0 HB2 GLN A 27 8.875 -4.959 11.783 1.00 65.43 H new ATOM 0 HB3 GLN A 27 9.328 -5.897 10.374 1.00 65.43 H new ATOM 0 HG2 GLN A 27 10.373 -3.110 11.007 1.00 53.43 H new ATOM 0 HG3 GLN A 27 11.221 -4.601 11.370 1.00 53.43 H new ATOM 0 HE21 GLN A 27 10.308 -5.811 8.743 1.00 22.04 H new ATOM 0 HE22 GLN A 27 11.356 -5.020 7.561 1.00 22.04 H new ATOM 453 N ARG A 28 5.961 -5.094 10.822 1.00 34.01 N ATOM 454 CA ARG A 28 4.746 -5.921 10.824 1.00 11.12 C ATOM 455 C ARG A 28 3.816 -5.549 9.656 1.00 12.22 C ATOM 456 O ARG A 28 3.215 -6.416 9.019 1.00 50.21 O ATOM 457 CB ARG A 28 3.998 -5.760 12.154 1.00 1.02 C ATOM 458 CG ARG A 28 4.879 -5.970 13.378 1.00 12.23 C ATOM 459 CD ARG A 28 4.093 -5.876 14.678 1.00 14.43 C ATOM 460 NE ARG A 28 4.971 -5.913 15.849 1.00 52.14 N ATOM 461 CZ ARG A 28 4.844 -6.746 16.847 1.00 34.51 C ATOM 462 NH1 ARG A 28 3.882 -7.613 16.873 1.00 33.53 N ATOM 463 NH2 ARG A 28 5.670 -6.685 17.838 1.00 61.52 N ATOM 0 H ARG A 28 6.058 -4.488 11.636 1.00 34.01 H new ATOM 0 HA ARG A 28 5.049 -6.961 10.702 1.00 11.12 H new ATOM 0 HB2 ARG A 28 3.562 -4.762 12.197 1.00 1.02 H new ATOM 0 HB3 ARG A 28 3.172 -6.470 12.185 1.00 1.02 H new ATOM 0 HG2 ARG A 28 5.358 -6.947 13.315 1.00 12.23 H new ATOM 0 HG3 ARG A 28 5.675 -5.225 13.382 1.00 12.23 H new ATOM 0 HD2 ARG A 28 3.514 -4.952 14.687 1.00 14.43 H new ATOM 0 HD3 ARG A 28 3.380 -6.699 14.732 1.00 14.43 H new ATOM 0 HE ARG A 28 5.737 -5.240 15.888 1.00 52.14 H new ATOM 0 HH11 ARG A 28 3.210 -7.652 16.107 1.00 33.53 H new ATOM 0 HH12 ARG A 28 3.797 -8.257 17.660 1.00 33.53 H new ATOM 0 HH21 ARG A 28 6.416 -5.989 17.838 1.00 61.52 H new ATOM 0 HH22 ARG A 28 5.576 -7.333 18.621 1.00 61.52 H new ATOM 477 N LEU A 29 3.716 -4.250 9.381 1.00 74.31 N ATOM 478 CA LEU A 29 2.850 -3.741 8.312 1.00 75.30 C ATOM 479 C LEU A 29 3.364 -4.144 6.923 1.00 72.14 C ATOM 480 O LEU A 29 2.578 -4.489 6.040 1.00 72.51 O ATOM 481 CB LEU A 29 2.735 -2.216 8.411 1.00 21.40 C ATOM 482 CG LEU A 29 2.111 -1.695 9.715 1.00 2.21 C ATOM 483 CD1 LEU A 29 2.120 -0.172 9.746 1.00 71.10 C ATOM 484 CD2 LEU A 29 0.691 -2.233 9.888 1.00 31.21 C ATOM 0 H LEU A 29 4.226 -3.525 9.885 1.00 74.31 H new ATOM 0 HA LEU A 29 1.864 -4.188 8.441 1.00 75.30 H new ATOM 0 HB2 LEU A 29 3.730 -1.784 8.304 1.00 21.40 H new ATOM 0 HB3 LEU A 29 2.139 -1.856 7.572 1.00 21.40 H new ATOM 0 HG LEU A 29 2.714 -2.055 10.549 1.00 2.21 H new ATOM 0 HD11 LEU A 29 1.674 0.176 10.678 1.00 71.10 H new ATOM 0 HD12 LEU A 29 3.147 0.187 9.679 1.00 71.10 H new ATOM 0 HD13 LEU A 29 1.546 0.212 8.903 1.00 71.10 H new ATOM 0 HD21 LEU A 29 0.268 -1.852 10.817 1.00 31.21 H new ATOM 0 HD22 LEU A 29 0.075 -1.909 9.049 1.00 31.21 H new ATOM 0 HD23 LEU A 29 0.716 -3.322 9.921 1.00 31.21 H new ATOM 496 N GLN A 30 4.684 -4.090 6.735 1.00 73.31 N ATOM 497 CA GLN A 30 5.308 -4.529 5.478 1.00 20.10 C ATOM 498 C GLN A 30 4.911 -5.980 5.143 1.00 10.34 C ATOM 499 O GLN A 30 4.431 -6.269 4.045 1.00 74.44 O ATOM 500 CB GLN A 30 6.841 -4.401 5.573 1.00 3.11 C ATOM 501 CG GLN A 30 7.601 -4.976 4.375 1.00 24.24 C ATOM 502 CD GLN A 30 7.386 -4.194 3.086 1.00 1.41 C ATOM 503 OE1 GLN A 30 7.168 -2.987 3.105 1.00 43.30 O ATOM 504 NE2 GLN A 30 7.449 -4.872 1.957 1.00 3.12 N ATOM 0 H GLN A 30 5.344 -3.748 7.434 1.00 73.31 H new ATOM 0 HA GLN A 30 4.949 -3.886 4.675 1.00 20.10 H new ATOM 0 HB2 GLN A 30 7.099 -3.347 5.679 1.00 3.11 H new ATOM 0 HB3 GLN A 30 7.180 -4.905 6.478 1.00 3.11 H new ATOM 0 HG2 GLN A 30 8.666 -4.995 4.606 1.00 24.24 H new ATOM 0 HG3 GLN A 30 7.290 -6.009 4.220 1.00 24.24 H new ATOM 0 HE21 GLN A 30 7.632 -5.875 1.974 1.00 3.12 H new ATOM 0 HE22 GLN A 30 7.315 -4.393 1.066 1.00 3.12 H new ATOM 513 N GLN A 31 5.095 -6.884 6.108 1.00 60.20 N ATOM 514 CA GLN A 31 4.750 -8.300 5.916 1.00 50.02 C ATOM 515 C GLN A 31 3.239 -8.490 5.694 1.00 71.14 C ATOM 516 O GLN A 31 2.821 -9.300 4.861 1.00 11.31 O ATOM 517 CB GLN A 31 5.216 -9.141 7.117 1.00 64.22 C ATOM 518 CG GLN A 31 6.717 -9.050 7.401 1.00 12.54 C ATOM 519 CD GLN A 31 7.591 -9.402 6.201 1.00 72.22 C ATOM 520 OE1 GLN A 31 7.114 -10.285 5.343 1.00 2.25 O flip ATOM 521 NE2 GLN A 31 8.700 -8.894 6.055 1.00 61.14 N flip ATOM 0 H GLN A 31 5.479 -6.665 7.027 1.00 60.20 H new ATOM 0 HA GLN A 31 5.269 -8.642 5.020 1.00 50.02 H new ATOM 0 HB2 GLN A 31 4.670 -8.821 8.004 1.00 64.22 H new ATOM 0 HB3 GLN A 31 4.954 -10.184 6.940 1.00 64.22 H new ATOM 0 HG2 GLN A 31 6.955 -8.038 7.728 1.00 12.54 H new ATOM 0 HG3 GLN A 31 6.963 -9.718 8.227 1.00 12.54 H new ATOM 0 HE21 GLN A 31 9.043 -8.214 6.734 1.00 61.14 H new ATOM 0 HE22 GLN A 31 9.278 -9.152 5.255 1.00 61.14 H new ATOM 530 N ALA A 32 2.425 -7.741 6.438 1.00 43.22 N ATOM 531 CA ALA A 32 0.966 -7.789 6.286 1.00 74.20 C ATOM 532 C ALA A 32 0.540 -7.378 4.868 1.00 32.32 C ATOM 533 O ALA A 32 -0.325 -8.010 4.251 1.00 71.13 O ATOM 534 CB ALA A 32 0.302 -6.889 7.322 1.00 74.34 C ATOM 0 H ALA A 32 2.750 -7.092 7.154 1.00 43.22 H new ATOM 0 HA ALA A 32 0.641 -8.817 6.447 1.00 74.20 H new ATOM 0 HB1 ALA A 32 -0.780 -6.932 7.201 1.00 74.34 H new ATOM 0 HB2 ALA A 32 0.569 -7.228 8.323 1.00 74.34 H new ATOM 0 HB3 ALA A 32 0.642 -5.863 7.184 1.00 74.34 H new ATOM 540 N LEU A 33 1.165 -6.319 4.358 1.00 51.42 N ATOM 541 CA LEU A 33 0.917 -5.840 2.996 1.00 40.04 C ATOM 542 C LEU A 33 1.227 -6.931 1.961 1.00 32.12 C ATOM 543 O LEU A 33 0.442 -7.168 1.039 1.00 64.50 O ATOM 544 CB LEU A 33 1.766 -4.589 2.725 1.00 51.23 C ATOM 545 CG LEU A 33 1.606 -3.961 1.330 1.00 4.01 C ATOM 546 CD1 LEU A 33 0.163 -3.518 1.091 1.00 53.52 C ATOM 547 CD2 LEU A 33 2.569 -2.788 1.166 1.00 74.42 C ATOM 0 H LEU A 33 1.854 -5.770 4.872 1.00 51.42 H new ATOM 0 HA LEU A 33 -0.139 -5.585 2.905 1.00 40.04 H new ATOM 0 HB2 LEU A 33 1.518 -3.836 3.473 1.00 51.23 H new ATOM 0 HB3 LEU A 33 2.815 -4.847 2.868 1.00 51.23 H new ATOM 0 HG LEU A 33 1.849 -4.716 0.583 1.00 4.01 H new ATOM 0 HD11 LEU A 33 0.077 -3.078 0.098 1.00 53.52 H new ATOM 0 HD12 LEU A 33 -0.499 -4.381 1.164 1.00 53.52 H new ATOM 0 HD13 LEU A 33 -0.120 -2.779 1.841 1.00 53.52 H new ATOM 0 HD21 LEU A 33 2.446 -2.352 0.175 1.00 74.42 H new ATOM 0 HD22 LEU A 33 2.356 -2.033 1.923 1.00 74.42 H new ATOM 0 HD23 LEU A 33 3.594 -3.140 1.283 1.00 74.42 H new ATOM 559 N GLU A 34 2.368 -7.603 2.131 1.00 52.45 N ATOM 560 CA GLU A 34 2.775 -8.683 1.227 1.00 3.11 C ATOM 561 C GLU A 34 1.756 -9.840 1.223 1.00 25.40 C ATOM 562 O GLU A 34 1.550 -10.486 0.196 1.00 55.10 O ATOM 563 CB GLU A 34 4.171 -9.203 1.602 1.00 50.20 C ATOM 564 CG GLU A 34 5.256 -8.124 1.566 1.00 73.45 C ATOM 565 CD GLU A 34 6.661 -8.664 1.802 1.00 12.14 C ATOM 566 OE1 GLU A 34 6.802 -9.744 2.416 1.00 73.23 O ATOM 567 OE2 GLU A 34 7.635 -8.012 1.363 1.00 11.12 O ATOM 0 H GLU A 34 3.028 -7.419 2.887 1.00 52.45 H new ATOM 0 HA GLU A 34 2.810 -8.269 0.219 1.00 3.11 H new ATOM 0 HB2 GLU A 34 4.132 -9.635 2.602 1.00 50.20 H new ATOM 0 HB3 GLU A 34 4.446 -10.006 0.919 1.00 50.20 H new ATOM 0 HG2 GLU A 34 5.226 -7.623 0.599 1.00 73.45 H new ATOM 0 HG3 GLU A 34 5.033 -7.371 2.322 1.00 73.45 H new ATOM 574 N MET A 35 1.114 -10.094 2.367 1.00 22.44 N ATOM 575 CA MET A 35 0.061 -11.119 2.443 1.00 55.02 C ATOM 576 C MET A 35 -1.148 -10.730 1.577 1.00 75.30 C ATOM 577 O MET A 35 -1.685 -11.554 0.827 1.00 23.24 O ATOM 578 CB MET A 35 -0.395 -11.342 3.892 1.00 23.10 C ATOM 579 CG MET A 35 0.713 -11.799 4.834 1.00 63.24 C ATOM 580 SD MET A 35 0.077 -12.422 6.407 1.00 43.35 S ATOM 581 CE MET A 35 -0.935 -11.048 6.958 1.00 55.43 C ATOM 0 H MET A 35 1.300 -9.611 3.246 1.00 22.44 H new ATOM 0 HA MET A 35 0.486 -12.048 2.063 1.00 55.02 H new ATOM 0 HB2 MET A 35 -0.821 -10.414 4.274 1.00 23.10 H new ATOM 0 HB3 MET A 35 -1.192 -12.085 3.900 1.00 23.10 H new ATOM 0 HG2 MET A 35 1.298 -12.580 4.348 1.00 63.24 H new ATOM 0 HG3 MET A 35 1.389 -10.966 5.024 1.00 63.24 H new ATOM 0 HE1 MET A 35 -0.563 -10.683 7.915 1.00 55.43 H new ATOM 0 HE2 MET A 35 -0.891 -10.245 6.222 1.00 55.43 H new ATOM 0 HE3 MET A 35 -1.967 -11.379 7.072 1.00 55.43 H new ATOM 591 N GLY A 36 -1.573 -9.471 1.684 1.00 72.23 N ATOM 592 CA GLY A 36 -2.678 -8.977 0.866 1.00 22.13 C ATOM 593 C GLY A 36 -2.364 -9.019 -0.627 1.00 43.30 C ATOM 594 O GLY A 36 -3.160 -9.516 -1.426 1.00 44.21 O ATOM 0 H GLY A 36 -1.174 -8.782 2.322 1.00 72.23 H new ATOM 0 HA2 GLY A 36 -3.568 -9.575 1.064 1.00 22.13 H new ATOM 0 HA3 GLY A 36 -2.911 -7.953 1.156 1.00 22.13 H new ATOM 598 N VAL A 37 -1.191 -8.508 -0.996 1.00 32.03 N ATOM 599 CA VAL A 37 -0.722 -8.550 -2.384 1.00 20.41 C ATOM 600 C VAL A 37 -0.619 -10.000 -2.894 1.00 12.31 C ATOM 601 O VAL A 37 -1.082 -10.322 -3.990 1.00 4.11 O ATOM 602 CB VAL A 37 0.655 -7.851 -2.525 1.00 71.25 C ATOM 603 CG1 VAL A 37 1.180 -7.944 -3.956 1.00 30.51 C ATOM 604 CG2 VAL A 37 0.563 -6.392 -2.077 1.00 34.43 C ATOM 0 H VAL A 37 -0.543 -8.057 -0.350 1.00 32.03 H new ATOM 0 HA VAL A 37 -1.455 -8.017 -2.990 1.00 20.41 H new ATOM 0 HB VAL A 37 1.362 -8.369 -1.878 1.00 71.25 H new ATOM 0 HG11 VAL A 37 2.147 -7.445 -4.022 1.00 30.51 H new ATOM 0 HG12 VAL A 37 1.293 -8.992 -4.235 1.00 30.51 H new ATOM 0 HG13 VAL A 37 0.476 -7.462 -4.634 1.00 30.51 H new ATOM 0 HG21 VAL A 37 1.538 -5.917 -2.183 1.00 34.43 H new ATOM 0 HG22 VAL A 37 -0.165 -5.867 -2.695 1.00 34.43 H new ATOM 0 HG23 VAL A 37 0.250 -6.351 -1.034 1.00 34.43 H new ATOM 614 N SER A 38 -0.037 -10.878 -2.074 1.00 14.01 N ATOM 615 CA SER A 38 0.139 -12.292 -2.445 1.00 0.34 C ATOM 616 C SER A 38 -1.205 -12.948 -2.793 1.00 72.21 C ATOM 617 O SER A 38 -1.295 -13.769 -3.711 1.00 3.05 O ATOM 618 CB SER A 38 0.816 -13.075 -1.310 1.00 53.35 C ATOM 619 OG SER A 38 1.020 -14.436 -1.669 1.00 54.02 O ATOM 0 H SER A 38 0.321 -10.639 -1.149 1.00 14.01 H new ATOM 0 HA SER A 38 0.779 -12.319 -3.327 1.00 0.34 H new ATOM 0 HB2 SER A 38 1.773 -12.613 -1.068 1.00 53.35 H new ATOM 0 HB3 SER A 38 0.201 -13.022 -0.412 1.00 53.35 H new ATOM 0 HG SER A 38 1.454 -14.908 -0.928 1.00 54.02 H new ATOM 625 N SER A 39 -2.251 -12.564 -2.061 1.00 61.33 N ATOM 626 CA SER A 39 -3.605 -13.080 -2.305 1.00 65.30 C ATOM 627 C SER A 39 -4.068 -12.786 -3.741 1.00 73.10 C ATOM 628 O SER A 39 -4.648 -13.648 -4.406 1.00 4.43 O ATOM 629 CB SER A 39 -4.596 -12.467 -1.305 1.00 21.01 C ATOM 630 OG SER A 39 -4.260 -12.811 0.036 1.00 15.33 O ATOM 0 H SER A 39 -2.190 -11.896 -1.292 1.00 61.33 H new ATOM 0 HA SER A 39 -3.576 -14.161 -2.171 1.00 65.30 H new ATOM 0 HB2 SER A 39 -4.601 -11.382 -1.414 1.00 21.01 H new ATOM 0 HB3 SER A 39 -5.604 -12.815 -1.530 1.00 21.01 H new ATOM 0 HG SER A 39 -3.417 -12.377 0.284 1.00 15.33 H new ATOM 636 N LEU A 40 -3.795 -11.571 -4.219 1.00 30.35 N ATOM 637 CA LEU A 40 -4.159 -11.180 -5.586 1.00 22.34 C ATOM 638 C LEU A 40 -3.247 -11.859 -6.622 1.00 74.51 C ATOM 639 O LEU A 40 -3.721 -12.389 -7.629 1.00 53.51 O ATOM 640 CB LEU A 40 -4.094 -9.655 -5.749 1.00 32.44 C ATOM 641 CG LEU A 40 -4.539 -9.124 -7.124 1.00 32.01 C ATOM 642 CD1 LEU A 40 -5.995 -9.492 -7.400 1.00 15.14 C ATOM 643 CD2 LEU A 40 -4.341 -7.615 -7.211 1.00 23.42 C ATOM 0 H LEU A 40 -3.325 -10.841 -3.684 1.00 30.35 H new ATOM 0 HA LEU A 40 -5.183 -11.511 -5.762 1.00 22.34 H new ATOM 0 HB2 LEU A 40 -4.717 -9.197 -4.981 1.00 32.44 H new ATOM 0 HB3 LEU A 40 -3.070 -9.329 -5.565 1.00 32.44 H new ATOM 0 HG LEU A 40 -3.917 -9.594 -7.886 1.00 32.01 H new ATOM 0 HD11 LEU A 40 -6.289 -9.107 -8.377 1.00 15.14 H new ATOM 0 HD12 LEU A 40 -6.104 -10.576 -7.389 1.00 15.14 H new ATOM 0 HD13 LEU A 40 -6.633 -9.056 -6.631 1.00 15.14 H new ATOM 0 HD21 LEU A 40 -4.662 -7.262 -8.191 1.00 23.42 H new ATOM 0 HD22 LEU A 40 -4.932 -7.125 -6.437 1.00 23.42 H new ATOM 0 HD23 LEU A 40 -3.287 -7.377 -7.067 1.00 23.42 H new ATOM 655 N MET A 41 -1.936 -11.838 -6.367 1.00 1.42 N ATOM 656 CA MET A 41 -0.958 -12.504 -7.242 1.00 34.54 C ATOM 657 C MET A 41 -1.298 -13.991 -7.459 1.00 63.55 C ATOM 658 O MET A 41 -0.996 -14.562 -8.511 1.00 73.34 O ATOM 659 CB MET A 41 0.458 -12.355 -6.668 1.00 25.43 C ATOM 660 CG MET A 41 1.116 -11.003 -6.952 1.00 2.03 C ATOM 661 SD MET A 41 0.069 -9.585 -6.544 1.00 1.14 S ATOM 662 CE MET A 41 -0.750 -9.268 -8.110 1.00 24.02 C ATOM 0 H MET A 41 -1.524 -11.367 -5.562 1.00 1.42 H new ATOM 0 HA MET A 41 -1.002 -12.015 -8.215 1.00 34.54 H new ATOM 0 HB2 MET A 41 0.417 -12.506 -5.589 1.00 25.43 H new ATOM 0 HB3 MET A 41 1.088 -13.145 -7.077 1.00 25.43 H new ATOM 0 HG2 MET A 41 2.044 -10.934 -6.384 1.00 2.03 H new ATOM 0 HG3 MET A 41 1.384 -10.954 -8.007 1.00 2.03 H new ATOM 0 HE1 MET A 41 -0.849 -8.193 -8.257 1.00 24.02 H new ATOM 0 HE2 MET A 41 -0.160 -9.693 -8.922 1.00 24.02 H new ATOM 0 HE3 MET A 41 -1.739 -9.726 -8.103 1.00 24.02 H new ATOM 672 N ALA A 42 -1.931 -14.608 -6.467 1.00 71.24 N ATOM 673 CA ALA A 42 -2.389 -15.997 -6.588 1.00 34.40 C ATOM 674 C ALA A 42 -3.604 -16.117 -7.525 1.00 15.02 C ATOM 675 O ALA A 42 -3.777 -17.124 -8.213 1.00 50.11 O ATOM 676 CB ALA A 42 -2.731 -16.551 -5.210 1.00 70.12 C ATOM 0 H ALA A 42 -2.141 -14.173 -5.569 1.00 71.24 H new ATOM 0 HA ALA A 42 -1.578 -16.580 -7.024 1.00 34.40 H new ATOM 0 HB1 ALA A 42 -3.070 -17.582 -5.306 1.00 70.12 H new ATOM 0 HB2 ALA A 42 -1.846 -16.518 -4.575 1.00 70.12 H new ATOM 0 HB3 ALA A 42 -3.522 -15.949 -4.762 1.00 70.12 H new ATOM 682 N LEU A 43 -4.435 -15.080 -7.550 1.00 65.45 N ATOM 683 CA LEU A 43 -5.664 -15.075 -8.356 1.00 24.12 C ATOM 684 C LEU A 43 -5.421 -14.604 -9.800 1.00 51.54 C ATOM 685 O LEU A 43 -6.209 -14.910 -10.698 1.00 20.51 O ATOM 686 CB LEU A 43 -6.721 -14.198 -7.676 1.00 44.11 C ATOM 687 CG LEU A 43 -7.300 -14.793 -6.383 1.00 13.00 C ATOM 688 CD1 LEU A 43 -8.110 -13.755 -5.616 1.00 65.14 C ATOM 689 CD2 LEU A 43 -8.157 -16.014 -6.702 1.00 61.43 C ATOM 0 H LEU A 43 -4.283 -14.223 -7.019 1.00 65.45 H new ATOM 0 HA LEU A 43 -6.022 -16.103 -8.419 1.00 24.12 H new ATOM 0 HB2 LEU A 43 -6.280 -13.227 -7.450 1.00 44.11 H new ATOM 0 HB3 LEU A 43 -7.536 -14.022 -8.378 1.00 44.11 H new ATOM 0 HG LEU A 43 -6.470 -15.104 -5.749 1.00 13.00 H new ATOM 0 HD11 LEU A 43 -8.508 -14.204 -4.706 1.00 65.14 H new ATOM 0 HD12 LEU A 43 -7.469 -12.913 -5.355 1.00 65.14 H new ATOM 0 HD13 LEU A 43 -8.934 -13.405 -6.238 1.00 65.14 H new ATOM 0 HD21 LEU A 43 -8.561 -16.426 -5.778 1.00 61.43 H new ATOM 0 HD22 LEU A 43 -8.977 -15.722 -7.358 1.00 61.43 H new ATOM 0 HD23 LEU A 43 -7.546 -16.768 -7.199 1.00 61.43 H new ATOM 701 N VAL A 44 -4.348 -13.841 -10.021 1.00 73.22 N ATOM 702 CA VAL A 44 -3.955 -13.449 -11.382 1.00 53.45 C ATOM 703 C VAL A 44 -3.200 -14.593 -12.083 1.00 73.40 C ATOM 704 O VAL A 44 -3.398 -14.835 -13.271 1.00 73.32 O ATOM 705 CB VAL A 44 -3.084 -12.162 -11.392 1.00 33.43 C ATOM 706 CG1 VAL A 44 -1.778 -12.368 -10.630 1.00 74.51 C ATOM 707 CG2 VAL A 44 -2.803 -11.707 -12.822 1.00 62.24 C ATOM 0 H VAL A 44 -3.739 -13.484 -9.285 1.00 73.22 H new ATOM 0 HA VAL A 44 -4.875 -13.236 -11.927 1.00 53.45 H new ATOM 0 HB VAL A 44 -3.648 -11.379 -10.885 1.00 33.43 H new ATOM 0 HG11 VAL A 44 -1.193 -11.449 -10.656 1.00 74.51 H new ATOM 0 HG12 VAL A 44 -1.998 -12.629 -9.595 1.00 74.51 H new ATOM 0 HG13 VAL A 44 -1.209 -13.174 -11.094 1.00 74.51 H new ATOM 0 HG21 VAL A 44 -2.192 -10.805 -12.803 1.00 62.24 H new ATOM 0 HG22 VAL A 44 -2.271 -12.494 -13.356 1.00 62.24 H new ATOM 0 HG23 VAL A 44 -3.745 -11.497 -13.329 1.00 62.24 H new ATOM 717 N THR A 45 -2.355 -15.300 -11.314 1.00 21.50 N ATOM 718 CA THR A 45 -1.566 -16.458 -11.796 1.00 13.41 C ATOM 719 C THR A 45 -1.075 -16.328 -13.258 1.00 42.10 C ATOM 720 O THR A 45 0.059 -15.896 -13.495 1.00 74.24 O ATOM 721 CB THR A 45 -2.310 -17.812 -11.586 1.00 33.20 C ATOM 722 OG1 THR A 45 -1.672 -18.853 -12.336 1.00 23.35 O ATOM 723 CG2 THR A 45 -3.790 -17.734 -11.965 1.00 3.42 C ATOM 0 H THR A 45 -2.195 -15.086 -10.330 1.00 21.50 H new ATOM 0 HA THR A 45 -0.673 -16.454 -11.171 1.00 13.41 H new ATOM 0 HB THR A 45 -2.257 -18.039 -10.521 1.00 33.20 H new ATOM 0 HG1 THR A 45 -2.148 -19.698 -12.194 1.00 23.35 H new ATOM 0 HG21 THR A 45 -4.260 -18.704 -11.799 1.00 3.42 H new ATOM 0 HG22 THR A 45 -4.284 -16.982 -11.350 1.00 3.42 H new ATOM 0 HG23 THR A 45 -3.882 -17.461 -13.016 1.00 3.42 H new ATOM 731 N THR A 46 -1.914 -16.715 -14.221 1.00 3.53 N ATOM 732 CA THR A 46 -1.593 -16.603 -15.653 1.00 15.23 C ATOM 733 C THR A 46 -2.817 -16.938 -16.519 1.00 24.40 C ATOM 734 O THR A 46 -3.672 -17.727 -16.112 1.00 33.32 O ATOM 735 CB THR A 46 -0.422 -17.530 -16.071 1.00 61.33 C ATOM 736 OG1 THR A 46 -0.167 -17.395 -17.478 1.00 10.11 O ATOM 737 CG2 THR A 46 -0.719 -18.993 -15.745 1.00 73.23 C ATOM 0 H THR A 46 -2.834 -17.114 -14.035 1.00 3.53 H new ATOM 0 HA THR A 46 -1.292 -15.568 -15.815 1.00 15.23 H new ATOM 0 HB THR A 46 0.458 -17.227 -15.504 1.00 61.33 H new ATOM 0 HG1 THR A 46 0.575 -17.982 -17.734 1.00 10.11 H new ATOM 0 HG21 THR A 46 0.124 -19.612 -16.052 1.00 73.23 H new ATOM 0 HG22 THR A 46 -0.877 -19.102 -14.672 1.00 73.23 H new ATOM 0 HG23 THR A 46 -1.615 -19.310 -16.278 1.00 73.23 H new ATOM 745 N ASP A 47 -2.906 -16.318 -17.702 1.00 72.13 N ATOM 746 CA ASP A 47 -4.018 -16.563 -18.640 1.00 63.33 C ATOM 747 C ASP A 47 -5.380 -16.199 -18.000 1.00 0.52 C ATOM 748 O ASP A 47 -6.445 -16.594 -18.481 1.00 71.51 O ATOM 749 CB ASP A 47 -3.990 -18.039 -19.091 1.00 23.51 C ATOM 750 CG ASP A 47 -4.874 -18.313 -20.294 1.00 13.32 C ATOM 751 OD1 ASP A 47 -4.751 -17.584 -21.300 1.00 12.14 O ATOM 752 OD2 ASP A 47 -5.674 -19.276 -20.257 1.00 4.12 O ATOM 0 H ASP A 47 -2.221 -15.640 -18.037 1.00 72.13 H new ATOM 0 HA ASP A 47 -3.894 -15.923 -19.513 1.00 63.33 H new ATOM 0 HB2 ASP A 47 -2.964 -18.320 -19.330 1.00 23.51 H new ATOM 0 HB3 ASP A 47 -4.309 -18.672 -18.262 1.00 23.51 H new ATOM 757 N TRP A 48 -5.328 -15.388 -16.942 1.00 1.12 N ATOM 758 CA TRP A 48 -6.499 -15.094 -16.102 1.00 52.23 C ATOM 759 C TRP A 48 -7.598 -14.288 -16.822 1.00 2.51 C ATOM 760 O TRP A 48 -8.715 -14.195 -16.320 1.00 50.32 O ATOM 761 CB TRP A 48 -6.055 -14.332 -14.847 1.00 13.05 C ATOM 762 CG TRP A 48 -5.546 -12.944 -15.134 1.00 32.20 C ATOM 763 CD1 TRP A 48 -4.376 -12.608 -15.752 1.00 71.42 C ATOM 764 CD2 TRP A 48 -6.196 -11.708 -14.806 1.00 61.34 C ATOM 765 NE1 TRP A 48 -4.261 -11.242 -15.832 1.00 60.32 N ATOM 766 CE2 TRP A 48 -5.363 -10.667 -15.255 1.00 15.42 C ATOM 767 CE3 TRP A 48 -7.400 -11.382 -14.174 1.00 52.22 C ATOM 768 CZ2 TRP A 48 -5.695 -9.325 -15.095 1.00 24.23 C ATOM 769 CZ3 TRP A 48 -7.730 -10.050 -14.017 1.00 11.25 C ATOM 770 CH2 TRP A 48 -6.879 -9.035 -14.475 1.00 32.40 C ATOM 0 H TRP A 48 -4.476 -14.915 -16.640 1.00 1.12 H new ATOM 0 HA TRP A 48 -6.937 -16.058 -15.843 1.00 52.23 H new ATOM 0 HB2 TRP A 48 -6.895 -14.266 -14.156 1.00 13.05 H new ATOM 0 HB3 TRP A 48 -5.272 -14.900 -14.345 1.00 13.05 H new ATOM 0 HD1 TRP A 48 -3.647 -13.313 -16.124 1.00 71.42 H new ATOM 0 HE1 TRP A 48 -3.481 -10.737 -16.253 1.00 60.32 H new ATOM 0 HE3 TRP A 48 -8.060 -12.158 -13.815 1.00 52.22 H new ATOM 0 HZ2 TRP A 48 -5.041 -8.541 -15.448 1.00 24.23 H new ATOM 0 HZ3 TRP A 48 -8.659 -9.786 -13.533 1.00 11.25 H new ATOM 0 HH2 TRP A 48 -7.164 -8.003 -14.335 1.00 32.40 H new ATOM 781 N ARG A 49 -7.287 -13.693 -17.975 1.00 64.10 N ATOM 782 CA ARG A 49 -8.262 -12.843 -18.680 1.00 42.02 C ATOM 783 C ARG A 49 -9.153 -13.629 -19.656 1.00 4.25 C ATOM 784 O ARG A 49 -10.015 -13.047 -20.319 1.00 3.54 O ATOM 785 CB ARG A 49 -7.553 -11.701 -19.419 1.00 73.02 C ATOM 786 CG ARG A 49 -6.874 -10.700 -18.486 1.00 65.23 C ATOM 787 CD ARG A 49 -6.557 -9.389 -19.194 1.00 14.33 C ATOM 788 NE ARG A 49 -7.768 -8.747 -19.712 1.00 35.41 N ATOM 789 CZ ARG A 49 -8.300 -7.660 -19.221 1.00 42.22 C ATOM 790 NH1 ARG A 49 -7.788 -7.082 -18.179 1.00 65.04 N ATOM 791 NH2 ARG A 49 -9.354 -7.157 -19.775 1.00 40.12 N ATOM 0 H ARG A 49 -6.383 -13.779 -18.439 1.00 64.10 H new ATOM 0 HA ARG A 49 -8.917 -12.430 -17.913 1.00 42.02 H new ATOM 0 HB2 ARG A 49 -6.806 -12.123 -20.092 1.00 73.02 H new ATOM 0 HB3 ARG A 49 -8.279 -11.174 -20.038 1.00 73.02 H new ATOM 0 HG2 ARG A 49 -7.521 -10.504 -17.631 1.00 65.23 H new ATOM 0 HG3 ARG A 49 -5.953 -11.134 -18.096 1.00 65.23 H new ATOM 0 HD2 ARG A 49 -6.055 -8.714 -18.502 1.00 14.33 H new ATOM 0 HD3 ARG A 49 -5.865 -9.577 -20.015 1.00 14.33 H new ATOM 0 HE ARG A 49 -8.228 -9.180 -20.513 1.00 35.41 H new ATOM 0 HH11 ARG A 49 -6.960 -7.476 -17.733 1.00 65.04 H new ATOM 0 HH12 ARG A 49 -8.214 -6.233 -17.806 1.00 65.04 H new ATOM 0 HH21 ARG A 49 -9.766 -7.609 -20.591 1.00 40.12 H new ATOM 0 HH22 ARG A 49 -9.774 -6.308 -19.396 1.00 40.12 H new ATOM 805 N CYS A 50 -8.945 -14.937 -19.763 1.00 4.40 N ATOM 806 CA CYS A 50 -9.834 -15.781 -20.571 1.00 1.20 C ATOM 807 C CYS A 50 -11.139 -16.043 -19.812 1.00 41.41 C ATOM 808 O CYS A 50 -11.105 -16.524 -18.685 1.00 1.21 O ATOM 809 CB CYS A 50 -9.151 -17.105 -20.924 1.00 12.11 C ATOM 810 SG CYS A 50 -7.699 -16.916 -21.985 1.00 31.12 S ATOM 0 H CYS A 50 -8.180 -15.436 -19.309 1.00 4.40 H new ATOM 0 HA CYS A 50 -10.062 -15.256 -21.499 1.00 1.20 H new ATOM 0 HB2 CYS A 50 -8.854 -17.607 -20.003 1.00 12.11 H new ATOM 0 HB3 CYS A 50 -9.872 -17.754 -21.422 1.00 12.11 H new ATOM 0 HG CYS A 50 -7.185 -18.085 -22.230 1.00 31.12 H new ATOM 816 N TYR A 51 -12.278 -15.743 -20.442 1.00 41.24 N ATOM 817 CA TYR A 51 -13.592 -15.773 -19.768 1.00 51.25 C ATOM 818 C TYR A 51 -13.775 -17.009 -18.862 1.00 20.21 C ATOM 819 O TYR A 51 -14.157 -16.881 -17.696 1.00 41.14 O ATOM 820 CB TYR A 51 -14.724 -15.715 -20.806 1.00 71.44 C ATOM 821 CG TYR A 51 -16.111 -15.812 -20.188 1.00 61.44 C ATOM 822 CD1 TYR A 51 -16.695 -14.714 -19.562 1.00 63.11 C ATOM 823 CD2 TYR A 51 -16.823 -17.007 -20.207 1.00 3.44 C ATOM 824 CE1 TYR A 51 -17.943 -14.805 -18.972 1.00 31.33 C ATOM 825 CE2 TYR A 51 -18.073 -17.103 -19.626 1.00 41.52 C ATOM 826 CZ TYR A 51 -18.627 -16.002 -19.009 1.00 22.21 C ATOM 827 OH TYR A 51 -19.864 -16.105 -18.406 1.00 13.33 O ATOM 0 H TYR A 51 -12.323 -15.474 -21.425 1.00 41.24 H new ATOM 0 HA TYR A 51 -13.633 -14.895 -19.124 1.00 51.25 H new ATOM 0 HB2 TYR A 51 -14.647 -14.783 -21.366 1.00 71.44 H new ATOM 0 HB3 TYR A 51 -14.594 -16.528 -21.521 1.00 71.44 H new ATOM 0 HD1 TYR A 51 -16.164 -13.774 -19.537 1.00 63.11 H new ATOM 0 HD2 TYR A 51 -16.391 -17.874 -20.684 1.00 3.44 H new ATOM 0 HE1 TYR A 51 -18.379 -13.945 -18.486 1.00 31.33 H new ATOM 0 HE2 TYR A 51 -18.614 -18.037 -19.655 1.00 41.52 H new ATOM 0 HH TYR A 51 -19.782 -16.620 -17.577 1.00 13.33 H new ATOM 837 N GLY A 52 -13.494 -18.195 -19.399 1.00 4.13 N ATOM 838 CA GLY A 52 -13.632 -19.426 -18.624 1.00 14.03 C ATOM 839 C GLY A 52 -12.740 -19.461 -17.384 1.00 44.30 C ATOM 840 O GLY A 52 -13.209 -19.742 -16.279 1.00 53.20 O ATOM 0 H GLY A 52 -13.173 -18.329 -20.358 1.00 4.13 H new ATOM 0 HA2 GLY A 52 -14.672 -19.540 -18.319 1.00 14.03 H new ATOM 0 HA3 GLY A 52 -13.391 -20.277 -19.261 1.00 14.03 H new ATOM 844 N TYR A 53 -11.459 -19.156 -17.565 1.00 74.25 N ATOM 845 CA TYR A 53 -10.483 -19.187 -16.469 1.00 11.32 C ATOM 846 C TYR A 53 -10.692 -18.001 -15.504 1.00 74.24 C ATOM 847 O TYR A 53 -10.367 -18.078 -14.313 1.00 32.21 O ATOM 848 CB TYR A 53 -9.061 -19.160 -17.055 1.00 25.11 C ATOM 849 CG TYR A 53 -7.963 -19.502 -16.064 1.00 15.45 C ATOM 850 CD1 TYR A 53 -7.597 -20.825 -15.836 1.00 22.34 C ATOM 851 CD2 TYR A 53 -7.284 -18.509 -15.366 1.00 74.45 C ATOM 852 CE1 TYR A 53 -6.590 -21.147 -14.948 1.00 10.20 C ATOM 853 CE2 TYR A 53 -6.277 -18.823 -14.474 1.00 73.53 C ATOM 854 CZ TYR A 53 -5.933 -20.144 -14.269 1.00 62.15 C ATOM 855 OH TYR A 53 -4.928 -20.463 -13.382 1.00 24.13 O ATOM 0 H TYR A 53 -11.066 -18.882 -18.465 1.00 74.25 H new ATOM 0 HA TYR A 53 -10.624 -20.105 -15.898 1.00 11.32 H new ATOM 0 HB2 TYR A 53 -9.012 -19.861 -17.888 1.00 25.11 H new ATOM 0 HB3 TYR A 53 -8.869 -18.167 -17.462 1.00 25.11 H new ATOM 0 HD1 TYR A 53 -8.110 -21.615 -16.364 1.00 22.34 H new ATOM 0 HD2 TYR A 53 -7.549 -17.474 -15.524 1.00 74.45 H new ATOM 0 HE1 TYR A 53 -6.319 -22.180 -14.786 1.00 10.20 H new ATOM 0 HE2 TYR A 53 -5.761 -18.039 -13.940 1.00 73.53 H new ATOM 0 HH TYR A 53 -4.136 -19.920 -13.576 1.00 24.13 H new ATOM 865 N MET A 54 -11.248 -16.910 -16.028 1.00 21.04 N ATOM 866 CA MET A 54 -11.484 -15.694 -15.245 1.00 23.13 C ATOM 867 C MET A 54 -12.678 -15.858 -14.298 1.00 42.21 C ATOM 868 O MET A 54 -12.560 -15.628 -13.091 1.00 24.23 O ATOM 869 CB MET A 54 -11.718 -14.497 -16.178 1.00 71.03 C ATOM 870 CG MET A 54 -11.866 -13.171 -15.445 1.00 14.12 C ATOM 871 SD MET A 54 -12.060 -11.779 -16.572 1.00 41.53 S ATOM 872 CE MET A 54 -12.199 -10.420 -15.415 1.00 71.12 C ATOM 0 H MET A 54 -11.547 -16.842 -17.001 1.00 21.04 H new ATOM 0 HA MET A 54 -10.595 -15.513 -14.640 1.00 23.13 H new ATOM 0 HB2 MET A 54 -10.885 -14.425 -16.878 1.00 71.03 H new ATOM 0 HB3 MET A 54 -12.616 -14.678 -16.769 1.00 71.03 H new ATOM 0 HG2 MET A 54 -12.729 -13.220 -14.782 1.00 14.12 H new ATOM 0 HG3 MET A 54 -10.990 -13.007 -14.817 1.00 14.12 H new ATOM 0 HE1 MET A 54 -11.868 -9.499 -15.894 1.00 71.12 H new ATOM 0 HE2 MET A 54 -13.238 -10.313 -15.102 1.00 71.12 H new ATOM 0 HE3 MET A 54 -11.576 -10.620 -14.543 1.00 71.12 H new ATOM 882 N GLU A 55 -13.817 -16.270 -14.855 1.00 71.53 N ATOM 883 CA GLU A 55 -15.050 -16.456 -14.079 1.00 20.31 C ATOM 884 C GLU A 55 -14.818 -17.347 -12.849 1.00 51.42 C ATOM 885 O GLU A 55 -15.347 -17.082 -11.770 1.00 71.41 O ATOM 886 CB GLU A 55 -16.137 -17.071 -14.971 1.00 65.41 C ATOM 887 CG GLU A 55 -17.467 -17.305 -14.256 1.00 22.12 C ATOM 888 CD GLU A 55 -18.421 -18.174 -15.060 1.00 64.33 C ATOM 889 OE1 GLU A 55 -18.971 -17.691 -16.072 1.00 34.31 O ATOM 890 OE2 GLU A 55 -18.605 -19.357 -14.697 1.00 21.42 O ATOM 0 H GLU A 55 -13.914 -16.483 -15.848 1.00 71.53 H new ATOM 0 HA GLU A 55 -15.374 -15.477 -13.725 1.00 20.31 H new ATOM 0 HB2 GLU A 55 -16.306 -16.415 -15.825 1.00 65.41 H new ATOM 0 HB3 GLU A 55 -15.775 -18.021 -15.365 1.00 65.41 H new ATOM 0 HG2 GLU A 55 -17.278 -17.776 -13.291 1.00 22.12 H new ATOM 0 HG3 GLU A 55 -17.940 -16.344 -14.054 1.00 22.12 H new ATOM 897 N ARG A 56 -14.005 -18.388 -13.008 1.00 31.43 N ATOM 898 CA ARG A 56 -13.711 -19.311 -11.907 1.00 51.22 C ATOM 899 C ARG A 56 -13.126 -18.589 -10.678 1.00 64.24 C ATOM 900 O ARG A 56 -13.321 -19.028 -9.544 1.00 60.24 O ATOM 901 CB ARG A 56 -12.753 -20.415 -12.377 1.00 72.02 C ATOM 902 CG ARG A 56 -13.320 -21.331 -13.467 1.00 21.42 C ATOM 903 CD ARG A 56 -14.590 -22.062 -13.023 1.00 21.24 C ATOM 904 NE ARG A 56 -15.774 -21.199 -13.052 1.00 40.10 N ATOM 905 CZ ARG A 56 -16.633 -21.087 -12.073 1.00 11.12 C ATOM 906 NH1 ARG A 56 -16.484 -21.768 -10.979 1.00 13.50 N ATOM 907 NH2 ARG A 56 -17.655 -20.306 -12.201 1.00 54.32 N ATOM 0 H ARG A 56 -13.537 -18.616 -13.885 1.00 31.43 H new ATOM 0 HA ARG A 56 -14.657 -19.758 -11.602 1.00 51.22 H new ATOM 0 HB2 ARG A 56 -11.840 -19.951 -12.750 1.00 72.02 H new ATOM 0 HB3 ARG A 56 -12.473 -21.025 -11.518 1.00 72.02 H new ATOM 0 HG2 ARG A 56 -13.538 -20.739 -14.356 1.00 21.42 H new ATOM 0 HG3 ARG A 56 -12.564 -22.064 -13.750 1.00 21.42 H new ATOM 0 HD2 ARG A 56 -14.756 -22.922 -13.672 1.00 21.24 H new ATOM 0 HD3 ARG A 56 -14.450 -22.447 -12.013 1.00 21.24 H new ATOM 0 HE ARG A 56 -15.939 -20.648 -13.894 1.00 40.10 H new ATOM 0 HH11 ARG A 56 -15.690 -22.400 -10.876 1.00 13.50 H new ATOM 0 HH12 ARG A 56 -17.161 -21.672 -10.222 1.00 13.50 H new ATOM 0 HH21 ARG A 56 -17.789 -19.779 -13.064 1.00 54.32 H new ATOM 0 HH22 ARG A 56 -18.327 -20.216 -11.439 1.00 54.32 H new ATOM 921 N HIS A 57 -12.427 -17.469 -10.894 1.00 44.41 N ATOM 922 CA HIS A 57 -11.820 -16.725 -9.779 1.00 73.03 C ATOM 923 C HIS A 57 -12.340 -15.274 -9.686 1.00 3.22 C ATOM 924 O HIS A 57 -11.766 -14.452 -8.967 1.00 32.44 O ATOM 925 CB HIS A 57 -10.281 -16.745 -9.887 1.00 25.50 C ATOM 926 CG HIS A 57 -9.704 -15.965 -11.038 1.00 3.11 C ATOM 927 ND1 HIS A 57 -9.397 -16.528 -12.259 1.00 54.43 N ATOM 928 CD2 HIS A 57 -9.326 -14.663 -11.129 1.00 32.50 C ATOM 929 CE1 HIS A 57 -8.854 -15.617 -13.041 1.00 63.20 C ATOM 930 NE2 HIS A 57 -8.799 -14.477 -12.385 1.00 4.14 N ATOM 0 H HIS A 57 -12.268 -17.061 -11.815 1.00 44.41 H new ATOM 0 HA HIS A 57 -12.117 -17.229 -8.860 1.00 73.03 H new ATOM 0 HB2 HIS A 57 -9.864 -16.353 -8.959 1.00 25.50 H new ATOM 0 HB3 HIS A 57 -9.953 -17.781 -9.972 1.00 25.50 H new ATOM 0 HD1 HIS A 57 -9.565 -17.500 -12.517 1.00 54.43 H new ATOM 0 HD2 HIS A 57 -9.422 -13.913 -10.358 1.00 32.50 H new ATOM 0 HE1 HIS A 57 -8.511 -15.779 -14.052 1.00 63.20 H new ATOM 939 N ILE A 58 -13.434 -14.969 -10.392 1.00 24.44 N ATOM 940 CA ILE A 58 -14.024 -13.617 -10.361 1.00 22.42 C ATOM 941 C ILE A 58 -14.592 -13.289 -8.965 1.00 71.12 C ATOM 942 O ILE A 58 -14.513 -12.154 -8.493 1.00 64.53 O ATOM 943 CB ILE A 58 -15.149 -13.452 -11.426 1.00 45.24 C ATOM 944 CG1 ILE A 58 -15.554 -11.972 -11.565 1.00 34.10 C ATOM 945 CG2 ILE A 58 -16.371 -14.302 -11.076 1.00 72.32 C ATOM 946 CD1 ILE A 58 -14.479 -11.093 -12.170 1.00 74.23 C ATOM 0 H ILE A 58 -13.929 -15.631 -10.989 1.00 24.44 H new ATOM 0 HA ILE A 58 -13.219 -12.920 -10.595 1.00 22.42 H new ATOM 0 HB ILE A 58 -14.754 -13.799 -12.381 1.00 45.24 H new ATOM 0 HG12 ILE A 58 -16.451 -11.908 -12.181 1.00 34.10 H new ATOM 0 HG13 ILE A 58 -15.815 -11.583 -10.581 1.00 34.10 H new ATOM 0 HG21 ILE A 58 -17.139 -14.166 -11.837 1.00 72.32 H new ATOM 0 HG22 ILE A 58 -16.084 -15.353 -11.034 1.00 72.32 H new ATOM 0 HG23 ILE A 58 -16.763 -13.994 -10.106 1.00 72.32 H new ATOM 0 HD11 ILE A 58 -14.841 -10.067 -12.234 1.00 74.23 H new ATOM 0 HD12 ILE A 58 -13.588 -11.125 -11.543 1.00 74.23 H new ATOM 0 HD13 ILE A 58 -14.233 -11.454 -13.169 1.00 74.23 H new ATOM 958 N ASN A 59 -15.147 -14.302 -8.306 1.00 50.32 N ATOM 959 CA ASN A 59 -15.728 -14.143 -6.969 1.00 55.51 C ATOM 960 C ASN A 59 -14.651 -13.875 -5.906 1.00 24.33 C ATOM 961 O ASN A 59 -14.837 -13.053 -5.007 1.00 21.53 O ATOM 962 CB ASN A 59 -16.519 -15.404 -6.607 1.00 61.43 C ATOM 963 CG ASN A 59 -17.670 -15.646 -7.560 1.00 45.11 C ATOM 964 OD1 ASN A 59 -18.281 -14.712 -8.065 1.00 12.41 O ATOM 965 ND2 ASN A 59 -17.972 -16.897 -7.826 1.00 33.33 N ATOM 0 H ASN A 59 -15.209 -15.250 -8.677 1.00 50.32 H new ATOM 0 HA ASN A 59 -16.391 -13.278 -6.988 1.00 55.51 H new ATOM 0 HB2 ASN A 59 -15.852 -16.266 -6.618 1.00 61.43 H new ATOM 0 HB3 ASN A 59 -16.903 -15.312 -5.591 1.00 61.43 H new ATOM 0 HD21 ASN A 59 -18.734 -17.112 -8.469 1.00 33.33 H new ATOM 0 HD22 ASN A 59 -17.444 -17.653 -7.389 1.00 33.33 H new ATOM 972 N GLU A 60 -13.524 -14.564 -6.034 1.00 4.35 N ATOM 973 CA GLU A 60 -12.427 -14.466 -5.064 1.00 60.35 C ATOM 974 C GLU A 60 -11.655 -13.139 -5.200 1.00 52.03 C ATOM 975 O GLU A 60 -11.336 -12.484 -4.205 1.00 52.23 O ATOM 976 CB GLU A 60 -11.466 -15.647 -5.265 1.00 15.23 C ATOM 977 CG GLU A 60 -12.151 -17.014 -5.305 1.00 3.03 C ATOM 978 CD GLU A 60 -12.833 -17.382 -3.997 1.00 15.32 C ATOM 979 OE1 GLU A 60 -12.140 -17.877 -3.082 1.00 54.04 O ATOM 980 OE2 GLU A 60 -14.064 -17.192 -3.881 1.00 34.42 O ATOM 0 H GLU A 60 -13.340 -15.204 -6.806 1.00 4.35 H new ATOM 0 HA GLU A 60 -12.858 -14.495 -4.063 1.00 60.35 H new ATOM 0 HB2 GLU A 60 -10.918 -15.500 -6.196 1.00 15.23 H new ATOM 0 HB3 GLU A 60 -10.732 -15.645 -4.459 1.00 15.23 H new ATOM 0 HG2 GLU A 60 -12.890 -17.019 -6.106 1.00 3.03 H new ATOM 0 HG3 GLU A 60 -11.411 -17.777 -5.548 1.00 3.03 H new ATOM 987 N ILE A 61 -11.368 -12.746 -6.444 1.00 64.33 N ATOM 988 CA ILE A 61 -10.556 -11.551 -6.723 1.00 63.15 C ATOM 989 C ILE A 61 -11.189 -10.268 -6.150 1.00 2.42 C ATOM 990 O ILE A 61 -10.483 -9.322 -5.797 1.00 53.55 O ATOM 991 CB ILE A 61 -10.306 -11.397 -8.248 1.00 0.52 C ATOM 992 CG1 ILE A 61 -9.300 -10.270 -8.532 1.00 3.05 C ATOM 993 CG2 ILE A 61 -11.615 -11.155 -8.994 1.00 2.33 C ATOM 994 CD1 ILE A 61 -8.878 -10.183 -9.985 1.00 41.44 C ATOM 0 H ILE A 61 -11.686 -13.238 -7.279 1.00 64.33 H new ATOM 0 HA ILE A 61 -9.599 -11.694 -6.221 1.00 63.15 H new ATOM 0 HB ILE A 61 -9.877 -12.331 -8.611 1.00 0.52 H new ATOM 0 HG12 ILE A 61 -9.740 -9.319 -8.233 1.00 3.05 H new ATOM 0 HG13 ILE A 61 -8.415 -10.421 -7.914 1.00 3.05 H new ATOM 0 HG21 ILE A 61 -11.412 -11.051 -10.060 1.00 2.33 H new ATOM 0 HG22 ILE A 61 -12.287 -11.998 -8.833 1.00 2.33 H new ATOM 0 HG23 ILE A 61 -12.082 -10.243 -8.622 1.00 2.33 H new ATOM 0 HD11 ILE A 61 -8.168 -9.365 -10.109 1.00 41.44 H new ATOM 0 HD12 ILE A 61 -8.409 -11.120 -10.284 1.00 41.44 H new ATOM 0 HD13 ILE A 61 -9.754 -10.001 -10.608 1.00 41.44 H new ATOM 1006 N ARG A 62 -12.517 -10.257 -6.040 1.00 1.52 N ATOM 1007 CA ARG A 62 -13.252 -9.122 -5.464 1.00 11.10 C ATOM 1008 C ARG A 62 -12.707 -8.730 -4.077 1.00 51.05 C ATOM 1009 O ARG A 62 -12.413 -7.560 -3.821 1.00 41.11 O ATOM 1010 CB ARG A 62 -14.744 -9.473 -5.368 1.00 41.41 C ATOM 1011 CG ARG A 62 -15.395 -9.709 -6.729 1.00 23.12 C ATOM 1012 CD ARG A 62 -16.766 -10.374 -6.615 1.00 34.21 C ATOM 1013 NE ARG A 62 -17.735 -9.564 -5.878 1.00 42.41 N ATOM 1014 CZ ARG A 62 -18.983 -9.909 -5.693 1.00 3.13 C ATOM 1015 NH1 ARG A 62 -19.430 -11.043 -6.137 1.00 71.41 N ATOM 1016 NH2 ARG A 62 -19.784 -9.126 -5.050 1.00 34.22 N ATOM 0 H ARG A 62 -13.114 -11.026 -6.344 1.00 1.52 H new ATOM 0 HA ARG A 62 -13.116 -8.263 -6.121 1.00 11.10 H new ATOM 0 HB2 ARG A 62 -14.862 -10.367 -4.756 1.00 41.41 H new ATOM 0 HB3 ARG A 62 -15.268 -8.666 -4.857 1.00 41.41 H new ATOM 0 HG2 ARG A 62 -15.499 -8.756 -7.248 1.00 23.12 H new ATOM 0 HG3 ARG A 62 -14.741 -10.334 -7.337 1.00 23.12 H new ATOM 0 HD2 ARG A 62 -17.152 -10.572 -7.615 1.00 34.21 H new ATOM 0 HD3 ARG A 62 -16.656 -11.339 -6.120 1.00 34.21 H new ATOM 0 HE ARG A 62 -17.419 -8.677 -5.485 1.00 42.41 H new ATOM 0 HH11 ARG A 62 -18.806 -11.677 -6.637 1.00 71.41 H new ATOM 0 HH12 ARG A 62 -20.405 -11.301 -5.986 1.00 71.41 H new ATOM 0 HH21 ARG A 62 -19.444 -8.236 -4.685 1.00 34.22 H new ATOM 0 HH22 ARG A 62 -20.757 -9.397 -4.907 1.00 34.22 H new ATOM 1030 N THR A 63 -12.560 -9.718 -3.195 1.00 11.50 N ATOM 1031 CA THR A 63 -12.046 -9.485 -1.836 1.00 11.43 C ATOM 1032 C THR A 63 -10.528 -9.236 -1.832 1.00 15.12 C ATOM 1033 O THR A 63 -10.021 -8.438 -1.040 1.00 4.45 O ATOM 1034 CB THR A 63 -12.370 -10.682 -0.902 1.00 12.14 C ATOM 1035 OG1 THR A 63 -13.794 -10.846 -0.790 1.00 60.23 O ATOM 1036 CG2 THR A 63 -11.772 -10.492 0.491 1.00 54.04 C ATOM 0 H THR A 63 -12.789 -10.692 -3.393 1.00 11.50 H new ATOM 0 HA THR A 63 -12.546 -8.591 -1.464 1.00 11.43 H new ATOM 0 HB THR A 63 -11.925 -11.573 -1.345 1.00 12.14 H new ATOM 0 HG1 THR A 63 -13.991 -11.604 -0.201 1.00 60.23 H new ATOM 0 HG21 THR A 63 -12.021 -11.351 1.114 1.00 54.04 H new ATOM 0 HG22 THR A 63 -10.688 -10.403 0.413 1.00 54.04 H new ATOM 0 HG23 THR A 63 -12.179 -9.587 0.941 1.00 54.04 H new ATOM 1044 N ALA A 64 -9.805 -9.919 -2.718 1.00 14.54 N ATOM 1045 CA ALA A 64 -8.347 -9.759 -2.818 1.00 43.44 C ATOM 1046 C ALA A 64 -7.959 -8.316 -3.179 1.00 5.14 C ATOM 1047 O ALA A 64 -7.029 -7.750 -2.601 1.00 24.45 O ATOM 1048 CB ALA A 64 -7.776 -10.732 -3.841 1.00 71.21 C ATOM 0 H ALA A 64 -10.200 -10.589 -3.378 1.00 14.54 H new ATOM 0 HA ALA A 64 -7.922 -9.982 -1.839 1.00 43.44 H new ATOM 0 HB1 ALA A 64 -6.696 -10.601 -3.904 1.00 71.21 H new ATOM 0 HB2 ALA A 64 -8.001 -11.754 -3.536 1.00 71.21 H new ATOM 0 HB3 ALA A 64 -8.222 -10.538 -4.816 1.00 71.21 H new ATOM 1054 N VAL A 65 -8.683 -7.731 -4.136 1.00 44.42 N ATOM 1055 CA VAL A 65 -8.473 -6.333 -4.529 1.00 22.11 C ATOM 1056 C VAL A 65 -8.607 -5.389 -3.321 1.00 74.22 C ATOM 1057 O VAL A 65 -7.806 -4.467 -3.147 1.00 43.14 O ATOM 1058 CB VAL A 65 -9.471 -5.914 -5.643 1.00 24.13 C ATOM 1059 CG1 VAL A 65 -9.393 -4.416 -5.930 1.00 2.01 C ATOM 1060 CG2 VAL A 65 -9.215 -6.716 -6.920 1.00 14.01 C ATOM 0 H VAL A 65 -9.422 -8.204 -4.655 1.00 44.42 H new ATOM 0 HA VAL A 65 -7.458 -6.252 -4.919 1.00 22.11 H new ATOM 0 HB VAL A 65 -10.477 -6.132 -5.286 1.00 24.13 H new ATOM 0 HG11 VAL A 65 -10.105 -4.158 -6.714 1.00 2.01 H new ATOM 0 HG12 VAL A 65 -9.634 -3.859 -5.024 1.00 2.01 H new ATOM 0 HG13 VAL A 65 -8.385 -4.160 -6.256 1.00 2.01 H new ATOM 0 HG21 VAL A 65 -9.923 -6.410 -7.690 1.00 14.01 H new ATOM 0 HG22 VAL A 65 -8.199 -6.532 -7.268 1.00 14.01 H new ATOM 0 HG23 VAL A 65 -9.341 -7.779 -6.714 1.00 14.01 H new ATOM 1070 N ASP A 66 -9.615 -5.634 -2.482 1.00 64.54 N ATOM 1071 CA ASP A 66 -9.792 -4.862 -1.248 1.00 64.42 C ATOM 1072 C ASP A 66 -8.601 -5.051 -0.296 1.00 31.25 C ATOM 1073 O ASP A 66 -8.109 -4.088 0.284 1.00 53.15 O ATOM 1074 CB ASP A 66 -11.092 -5.265 -0.534 1.00 52.53 C ATOM 1075 CG ASP A 66 -12.335 -4.991 -1.362 1.00 42.24 C ATOM 1076 OD1 ASP A 66 -12.379 -3.955 -2.055 1.00 55.15 O ATOM 1077 OD2 ASP A 66 -13.286 -5.800 -1.304 1.00 4.44 O ATOM 0 H ASP A 66 -10.319 -6.357 -2.632 1.00 64.54 H new ATOM 0 HA ASP A 66 -9.850 -3.810 -1.528 1.00 64.42 H new ATOM 0 HB2 ASP A 66 -11.052 -6.327 -0.290 1.00 52.53 H new ATOM 0 HB3 ASP A 66 -11.164 -4.724 0.409 1.00 52.53 H new ATOM 1082 N LYS A 67 -8.138 -6.295 -0.143 1.00 43.14 N ATOM 1083 CA LYS A 67 -7.010 -6.598 0.754 1.00 0.14 C ATOM 1084 C LYS A 67 -5.747 -5.810 0.385 1.00 14.11 C ATOM 1085 O LYS A 67 -5.070 -5.272 1.262 1.00 53.04 O ATOM 1086 CB LYS A 67 -6.694 -8.101 0.764 1.00 23.02 C ATOM 1087 CG LYS A 67 -7.759 -8.945 1.456 1.00 0.31 C ATOM 1088 CD LYS A 67 -7.254 -10.355 1.760 1.00 3.23 C ATOM 1089 CE LYS A 67 -8.254 -11.137 2.599 1.00 70.52 C ATOM 1090 NZ LYS A 67 -7.724 -12.459 3.022 1.00 44.04 N ATOM 0 H LYS A 67 -8.522 -7.108 -0.625 1.00 43.14 H new ATOM 0 HA LYS A 67 -7.322 -6.291 1.752 1.00 0.14 H new ATOM 0 HB2 LYS A 67 -6.580 -8.446 -0.263 1.00 23.02 H new ATOM 0 HB3 LYS A 67 -5.737 -8.259 1.262 1.00 23.02 H new ATOM 0 HG2 LYS A 67 -8.062 -8.459 2.383 1.00 0.31 H new ATOM 0 HG3 LYS A 67 -8.644 -9.004 0.823 1.00 0.31 H new ATOM 0 HD2 LYS A 67 -7.068 -10.885 0.826 1.00 3.23 H new ATOM 0 HD3 LYS A 67 -6.302 -10.296 2.288 1.00 3.23 H new ATOM 0 HE2 LYS A 67 -8.518 -10.555 3.482 1.00 70.52 H new ATOM 0 HE3 LYS A 67 -9.170 -11.282 2.027 1.00 70.52 H new ATOM 0 HZ1 LYS A 67 -8.440 -12.954 3.591 1.00 44.04 H new ATOM 0 HZ2 LYS A 67 -7.496 -13.027 2.181 1.00 44.04 H new ATOM 0 HZ3 LYS A 67 -6.864 -12.322 3.591 1.00 44.04 H new ATOM 1104 N VAL A 68 -5.434 -5.745 -0.908 1.00 73.33 N ATOM 1105 CA VAL A 68 -4.258 -5.000 -1.381 1.00 34.43 C ATOM 1106 C VAL A 68 -4.267 -3.552 -0.859 1.00 75.54 C ATOM 1107 O VAL A 68 -3.321 -3.113 -0.198 1.00 25.02 O ATOM 1108 CB VAL A 68 -4.180 -4.991 -2.931 1.00 61.31 C ATOM 1109 CG1 VAL A 68 -2.964 -4.202 -3.415 1.00 5.22 C ATOM 1110 CG2 VAL A 68 -4.154 -6.418 -3.480 1.00 22.43 C ATOM 0 H VAL A 68 -5.973 -6.196 -1.648 1.00 73.33 H new ATOM 0 HA VAL A 68 -3.379 -5.512 -0.988 1.00 34.43 H new ATOM 0 HB VAL A 68 -5.074 -4.495 -3.310 1.00 61.31 H new ATOM 0 HG11 VAL A 68 -2.934 -4.212 -4.505 1.00 5.22 H new ATOM 0 HG12 VAL A 68 -3.035 -3.173 -3.063 1.00 5.22 H new ATOM 0 HG13 VAL A 68 -2.055 -4.658 -3.023 1.00 5.22 H new ATOM 0 HG21 VAL A 68 -4.099 -6.388 -4.568 1.00 22.43 H new ATOM 0 HG22 VAL A 68 -3.283 -6.943 -3.087 1.00 22.43 H new ATOM 0 HG23 VAL A 68 -5.061 -6.941 -3.177 1.00 22.43 H new ATOM 1120 N GLU A 69 -5.348 -2.828 -1.134 1.00 21.31 N ATOM 1121 CA GLU A 69 -5.482 -1.433 -0.700 1.00 64.44 C ATOM 1122 C GLU A 69 -5.831 -1.320 0.800 1.00 50.35 C ATOM 1123 O GLU A 69 -5.629 -0.275 1.415 1.00 54.33 O ATOM 1124 CB GLU A 69 -6.529 -0.717 -1.565 1.00 32.43 C ATOM 1125 CG GLU A 69 -6.084 -0.494 -3.013 1.00 22.42 C ATOM 1126 CD GLU A 69 -4.781 0.296 -3.124 1.00 4.34 C ATOM 1127 OE1 GLU A 69 -4.834 1.544 -3.133 1.00 71.53 O ATOM 1128 OE2 GLU A 69 -3.699 -0.329 -3.210 1.00 15.05 O ATOM 0 H GLU A 69 -6.149 -3.182 -1.657 1.00 21.31 H new ATOM 0 HA GLU A 69 -4.516 -0.946 -0.833 1.00 64.44 H new ATOM 0 HB2 GLU A 69 -7.449 -1.301 -1.563 1.00 32.43 H new ATOM 0 HB3 GLU A 69 -6.762 0.247 -1.113 1.00 32.43 H new ATOM 0 HG2 GLU A 69 -5.959 -1.460 -3.501 1.00 22.42 H new ATOM 0 HG3 GLU A 69 -6.870 0.036 -3.551 1.00 22.42 H new ATOM 1135 N LEU A 70 -6.352 -2.400 1.384 1.00 74.53 N ATOM 1136 CA LEU A 70 -6.630 -2.443 2.829 1.00 73.42 C ATOM 1137 C LEU A 70 -5.327 -2.397 3.633 1.00 61.50 C ATOM 1138 O LEU A 70 -5.121 -1.494 4.444 1.00 32.43 O ATOM 1139 CB LEU A 70 -7.429 -3.708 3.189 1.00 12.23 C ATOM 1140 CG LEU A 70 -7.619 -3.977 4.694 1.00 11.40 C ATOM 1141 CD1 LEU A 70 -8.317 -2.802 5.377 1.00 1.11 C ATOM 1142 CD2 LEU A 70 -8.398 -5.276 4.909 1.00 41.31 C ATOM 0 H LEU A 70 -6.591 -3.257 0.884 1.00 74.53 H new ATOM 0 HA LEU A 70 -7.227 -1.568 3.085 1.00 73.42 H new ATOM 0 HB2 LEU A 70 -8.413 -3.637 2.725 1.00 12.23 H new ATOM 0 HB3 LEU A 70 -6.929 -4.569 2.746 1.00 12.23 H new ATOM 0 HG LEU A 70 -6.635 -4.087 5.149 1.00 11.40 H new ATOM 0 HD11 LEU A 70 -8.439 -3.018 6.438 1.00 1.11 H new ATOM 0 HD12 LEU A 70 -7.715 -1.901 5.257 1.00 1.11 H new ATOM 0 HD13 LEU A 70 -9.296 -2.647 4.924 1.00 1.11 H new ATOM 0 HD21 LEU A 70 -8.524 -5.452 5.977 1.00 41.31 H new ATOM 0 HD22 LEU A 70 -9.377 -5.196 4.437 1.00 41.31 H new ATOM 0 HD23 LEU A 70 -7.849 -6.107 4.467 1.00 41.31 H new ATOM 1154 N PHE A 71 -4.446 -3.369 3.396 1.00 74.24 N ATOM 1155 CA PHE A 71 -3.137 -3.399 4.060 1.00 65.33 C ATOM 1156 C PHE A 71 -2.290 -2.187 3.643 1.00 63.04 C ATOM 1157 O PHE A 71 -1.477 -1.685 4.421 1.00 14.21 O ATOM 1158 CB PHE A 71 -2.405 -4.709 3.750 1.00 13.34 C ATOM 1159 CG PHE A 71 -3.090 -5.928 4.317 1.00 54.40 C ATOM 1160 CD1 PHE A 71 -3.053 -6.186 5.680 1.00 12.44 C ATOM 1161 CD2 PHE A 71 -3.770 -6.812 3.493 1.00 1.01 C ATOM 1162 CE1 PHE A 71 -3.680 -7.300 6.206 1.00 44.34 C ATOM 1163 CE2 PHE A 71 -4.398 -7.926 4.013 1.00 72.52 C ATOM 1164 CZ PHE A 71 -4.353 -8.171 5.372 1.00 71.44 C ATOM 0 H PHE A 71 -4.611 -4.144 2.753 1.00 74.24 H new ATOM 0 HA PHE A 71 -3.297 -3.346 5.137 1.00 65.33 H new ATOM 0 HB2 PHE A 71 -2.318 -4.821 2.669 1.00 13.34 H new ATOM 0 HB3 PHE A 71 -1.392 -4.653 4.148 1.00 13.34 H new ATOM 0 HD1 PHE A 71 -2.528 -5.509 6.337 1.00 12.44 H new ATOM 0 HD2 PHE A 71 -3.809 -6.626 2.430 1.00 1.01 H new ATOM 0 HE1 PHE A 71 -3.644 -7.489 7.269 1.00 44.34 H new ATOM 0 HE2 PHE A 71 -4.924 -8.605 3.358 1.00 72.52 H new ATOM 0 HZ PHE A 71 -4.843 -9.042 5.781 1.00 71.44 H new ATOM 1174 N LEU A 72 -2.499 -1.720 2.414 1.00 65.44 N ATOM 1175 CA LEU A 72 -1.902 -0.467 1.943 1.00 12.41 C ATOM 1176 C LEU A 72 -2.412 0.722 2.779 1.00 12.42 C ATOM 1177 O LEU A 72 -1.642 1.602 3.159 1.00 63.32 O ATOM 1178 CB LEU A 72 -2.216 -0.279 0.443 1.00 13.30 C ATOM 1179 CG LEU A 72 -1.716 1.019 -0.230 1.00 41.14 C ATOM 1180 CD1 LEU A 72 -2.685 2.176 -0.004 1.00 2.51 C ATOM 1181 CD2 LEU A 72 -0.306 1.375 0.246 1.00 23.34 C ATOM 0 H LEU A 72 -3.080 -2.192 1.721 1.00 65.44 H new ATOM 0 HA LEU A 72 -0.820 -0.512 2.066 1.00 12.41 H new ATOM 0 HB2 LEU A 72 -1.792 -1.124 -0.099 1.00 13.30 H new ATOM 0 HB3 LEU A 72 -3.297 -0.329 0.316 1.00 13.30 H new ATOM 0 HG LEU A 72 -1.671 0.838 -1.304 1.00 41.14 H new ATOM 0 HD11 LEU A 72 -2.301 3.072 -0.491 1.00 2.51 H new ATOM 0 HD12 LEU A 72 -3.658 1.923 -0.424 1.00 2.51 H new ATOM 0 HD13 LEU A 72 -2.789 2.360 1.065 1.00 2.51 H new ATOM 0 HD21 LEU A 72 0.022 2.292 -0.243 1.00 23.34 H new ATOM 0 HD22 LEU A 72 -0.313 1.522 1.326 1.00 23.34 H new ATOM 0 HD23 LEU A 72 0.378 0.565 -0.006 1.00 23.34 H new ATOM 1193 N LYS A 73 -3.711 0.733 3.068 1.00 14.04 N ATOM 1194 CA LYS A 73 -4.308 1.773 3.911 1.00 10.32 C ATOM 1195 C LYS A 73 -3.716 1.708 5.326 1.00 54.21 C ATOM 1196 O LYS A 73 -3.424 2.733 5.942 1.00 34.24 O ATOM 1197 CB LYS A 73 -5.843 1.608 3.935 1.00 20.40 C ATOM 1198 CG LYS A 73 -6.595 2.652 4.771 1.00 23.41 C ATOM 1199 CD LYS A 73 -6.734 2.249 6.241 1.00 11.03 C ATOM 1200 CE LYS A 73 -7.717 1.104 6.432 1.00 32.11 C ATOM 1201 NZ LYS A 73 -7.881 0.752 7.867 1.00 24.40 N ATOM 0 H LYS A 73 -4.373 0.034 2.732 1.00 14.04 H new ATOM 0 HA LYS A 73 -4.078 2.755 3.497 1.00 10.32 H new ATOM 0 HB2 LYS A 73 -6.214 1.649 2.911 1.00 20.40 H new ATOM 0 HB3 LYS A 73 -6.081 0.616 4.320 1.00 20.40 H new ATOM 0 HG2 LYS A 73 -6.071 3.606 4.709 1.00 23.41 H new ATOM 0 HG3 LYS A 73 -7.587 2.805 4.346 1.00 23.41 H new ATOM 0 HD2 LYS A 73 -5.758 1.957 6.630 1.00 11.03 H new ATOM 0 HD3 LYS A 73 -7.064 3.110 6.822 1.00 11.03 H new ATOM 0 HE2 LYS A 73 -8.684 1.381 6.013 1.00 32.11 H new ATOM 0 HE3 LYS A 73 -7.369 0.230 5.881 1.00 32.11 H new ATOM 0 HZ1 LYS A 73 -8.779 0.245 8.000 1.00 24.40 H new ATOM 0 HZ2 LYS A 73 -7.093 0.144 8.168 1.00 24.40 H new ATOM 0 HZ3 LYS A 73 -7.886 1.620 8.439 1.00 24.40 H new ATOM 1215 N GLU A 74 -3.538 0.487 5.822 1.00 4.15 N ATOM 1216 CA GLU A 74 -2.910 0.248 7.125 1.00 5.31 C ATOM 1217 C GLU A 74 -1.458 0.756 7.139 1.00 25.12 C ATOM 1218 O GLU A 74 -0.981 1.298 8.139 1.00 13.33 O ATOM 1219 CB GLU A 74 -2.948 -1.257 7.438 1.00 65.52 C ATOM 1220 CG GLU A 74 -4.350 -1.866 7.371 1.00 12.55 C ATOM 1221 CD GLU A 74 -5.186 -1.601 8.614 1.00 10.41 C ATOM 1222 OE1 GLU A 74 -5.548 -0.429 8.858 1.00 4.30 O ATOM 1223 OE2 GLU A 74 -5.499 -2.568 9.342 1.00 54.05 O ATOM 0 H GLU A 74 -3.823 -0.364 5.337 1.00 4.15 H new ATOM 0 HA GLU A 74 -3.464 0.796 7.888 1.00 5.31 H new ATOM 0 HB2 GLU A 74 -2.300 -1.781 6.735 1.00 65.52 H new ATOM 0 HB3 GLU A 74 -2.537 -1.422 8.434 1.00 65.52 H new ATOM 0 HG2 GLU A 74 -4.870 -1.466 6.501 1.00 12.55 H new ATOM 0 HG3 GLU A 74 -4.263 -2.943 7.224 1.00 12.55 H new ATOM 1230 N TYR A 75 -0.765 0.576 6.016 1.00 43.31 N ATOM 1231 CA TYR A 75 0.621 1.032 5.866 1.00 42.53 C ATOM 1232 C TYR A 75 0.702 2.570 5.797 1.00 43.31 C ATOM 1233 O TYR A 75 1.411 3.203 6.585 1.00 64.31 O ATOM 1234 CB TYR A 75 1.244 0.410 4.605 1.00 72.24 C ATOM 1235 CG TYR A 75 2.714 0.740 4.426 1.00 75.43 C ATOM 1236 CD1 TYR A 75 3.698 -0.048 5.014 1.00 52.23 C ATOM 1237 CD2 TYR A 75 3.116 1.844 3.681 1.00 44.14 C ATOM 1238 CE1 TYR A 75 5.037 0.256 4.867 1.00 13.23 C ATOM 1239 CE2 TYR A 75 4.452 2.155 3.534 1.00 73.42 C ATOM 1240 CZ TYR A 75 5.408 1.358 4.128 1.00 0.14 C ATOM 1241 OH TYR A 75 6.737 1.673 3.992 1.00 45.03 O ATOM 0 H TYR A 75 -1.142 0.114 5.189 1.00 43.31 H new ATOM 0 HA TYR A 75 1.181 0.707 6.743 1.00 42.53 H new ATOM 0 HB2 TYR A 75 1.126 -0.673 4.648 1.00 72.24 H new ATOM 0 HB3 TYR A 75 0.694 0.756 3.730 1.00 72.24 H new ATOM 0 HD1 TYR A 75 3.410 -0.912 5.595 1.00 52.23 H new ATOM 0 HD2 TYR A 75 2.370 2.467 3.210 1.00 44.14 H new ATOM 0 HE1 TYR A 75 5.789 -0.367 5.329 1.00 13.23 H new ATOM 0 HE2 TYR A 75 4.748 3.018 2.957 1.00 73.42 H new ATOM 0 HH TYR A 75 7.275 0.857 4.062 1.00 45.03 H new ATOM 1251 N LEU A 76 -0.030 3.165 4.849 1.00 1.21 N ATOM 1252 CA LEU A 76 -0.066 4.628 4.690 1.00 74.22 C ATOM 1253 C LEU A 76 -0.520 5.325 5.986 1.00 40.54 C ATOM 1254 O LEU A 76 -0.064 6.425 6.305 1.00 52.22 O ATOM 1255 CB LEU A 76 -0.975 5.025 3.509 1.00 60.52 C ATOM 1256 CG LEU A 76 -0.395 4.742 2.107 1.00 2.34 C ATOM 1257 CD1 LEU A 76 -1.389 5.115 1.004 1.00 0.30 C ATOM 1258 CD2 LEU A 76 0.919 5.491 1.911 1.00 74.15 C ATOM 0 H LEU A 76 -0.607 2.658 4.178 1.00 1.21 H new ATOM 0 HA LEU A 76 0.948 4.963 4.473 1.00 74.22 H new ATOM 0 HB2 LEU A 76 -1.922 4.494 3.606 1.00 60.52 H new ATOM 0 HB3 LEU A 76 -1.197 6.090 3.584 1.00 60.52 H new ATOM 0 HG LEU A 76 -0.204 3.671 2.038 1.00 2.34 H new ATOM 0 HD11 LEU A 76 -0.948 4.903 0.030 1.00 0.30 H new ATOM 0 HD12 LEU A 76 -2.302 4.531 1.124 1.00 0.30 H new ATOM 0 HD13 LEU A 76 -1.626 6.177 1.072 1.00 0.30 H new ATOM 0 HD21 LEU A 76 1.314 5.280 0.917 1.00 74.15 H new ATOM 0 HD22 LEU A 76 0.746 6.562 2.012 1.00 74.15 H new ATOM 0 HD23 LEU A 76 1.638 5.167 2.663 1.00 74.15 H new ATOM 1270 N HIS A 77 -1.407 4.667 6.731 1.00 30.24 N ATOM 1271 CA HIS A 77 -1.872 5.165 8.032 1.00 11.22 C ATOM 1272 C HIS A 77 -0.709 5.378 9.025 1.00 1.25 C ATOM 1273 O HIS A 77 -0.754 6.282 9.863 1.00 51.30 O ATOM 1274 CB HIS A 77 -2.901 4.179 8.610 1.00 61.35 C ATOM 1275 CG HIS A 77 -3.214 4.378 10.062 1.00 63.52 C ATOM 1276 ND1 HIS A 77 -2.936 3.432 11.019 1.00 74.33 N ATOM 1277 CD2 HIS A 77 -3.790 5.412 10.720 1.00 22.43 C ATOM 1278 CE1 HIS A 77 -3.324 3.867 12.197 1.00 41.54 C ATOM 1279 NE2 HIS A 77 -3.847 5.064 12.047 1.00 21.43 N ATOM 0 H HIS A 77 -1.824 3.778 6.455 1.00 30.24 H new ATOM 0 HA HIS A 77 -2.336 6.139 7.878 1.00 11.22 H new ATOM 0 HB2 HIS A 77 -3.825 4.263 8.038 1.00 61.35 H new ATOM 0 HB3 HIS A 77 -2.530 3.164 8.468 1.00 61.35 H new ATOM 0 HD2 HIS A 77 -4.139 6.336 10.283 1.00 22.43 H new ATOM 0 HE1 HIS A 77 -3.229 3.332 13.130 1.00 41.54 H new ATOM 0 HE2 HIS A 77 -4.232 5.640 12.795 1.00 21.43 H new ATOM 1288 N PHE A 78 0.325 4.545 8.925 1.00 42.25 N ATOM 1289 CA PHE A 78 1.475 4.615 9.835 1.00 25.15 C ATOM 1290 C PHE A 78 2.519 5.632 9.340 1.00 34.42 C ATOM 1291 O PHE A 78 2.919 6.543 10.073 1.00 12.45 O ATOM 1292 CB PHE A 78 2.116 3.223 9.963 1.00 3.02 C ATOM 1293 CG PHE A 78 3.083 3.080 11.117 1.00 60.42 C ATOM 1294 CD1 PHE A 78 4.418 3.438 10.981 1.00 45.13 C ATOM 1295 CD2 PHE A 78 2.652 2.581 12.342 1.00 21.24 C ATOM 1296 CE1 PHE A 78 5.300 3.299 12.039 1.00 41.42 C ATOM 1297 CE2 PHE A 78 3.529 2.443 13.400 1.00 42.12 C ATOM 1298 CZ PHE A 78 4.854 2.803 13.250 1.00 61.14 C ATOM 0 H PHE A 78 0.393 3.810 8.221 1.00 42.25 H new ATOM 0 HA PHE A 78 1.120 4.947 10.811 1.00 25.15 H new ATOM 0 HB2 PHE A 78 1.325 2.482 10.075 1.00 3.02 H new ATOM 0 HB3 PHE A 78 2.640 2.992 9.036 1.00 3.02 H new ATOM 0 HD1 PHE A 78 4.772 3.829 10.039 1.00 45.13 H new ATOM 0 HD2 PHE A 78 1.617 2.298 12.467 1.00 21.24 H new ATOM 0 HE1 PHE A 78 6.336 3.578 11.918 1.00 41.42 H new ATOM 0 HE2 PHE A 78 3.179 2.054 14.345 1.00 42.12 H new ATOM 0 HZ PHE A 78 5.540 2.697 14.077 1.00 61.14 H new ATOM 1308 N VAL A 79 2.948 5.475 8.087 1.00 72.04 N ATOM 1309 CA VAL A 79 4.002 6.325 7.515 1.00 42.35 C ATOM 1310 C VAL A 79 3.623 7.819 7.521 1.00 12.43 C ATOM 1311 O VAL A 79 4.472 8.676 7.764 1.00 35.33 O ATOM 1312 CB VAL A 79 4.369 5.887 6.074 1.00 62.23 C ATOM 1313 CG1 VAL A 79 4.857 4.441 6.060 1.00 21.52 C ATOM 1314 CG2 VAL A 79 3.185 6.066 5.127 1.00 32.45 C ATOM 0 H VAL A 79 2.585 4.769 7.447 1.00 72.04 H new ATOM 0 HA VAL A 79 4.872 6.195 8.158 1.00 42.35 H new ATOM 0 HB VAL A 79 5.178 6.527 5.723 1.00 62.23 H new ATOM 0 HG11 VAL A 79 5.110 4.152 5.040 1.00 21.52 H new ATOM 0 HG12 VAL A 79 5.740 4.349 6.692 1.00 21.52 H new ATOM 0 HG13 VAL A 79 4.070 3.788 6.438 1.00 21.52 H new ATOM 0 HG21 VAL A 79 3.471 5.751 4.123 1.00 32.45 H new ATOM 0 HG22 VAL A 79 2.348 5.460 5.473 1.00 32.45 H new ATOM 0 HG23 VAL A 79 2.890 7.115 5.108 1.00 32.45 H new ATOM 1324 N LYS A 80 2.348 8.129 7.267 1.00 52.20 N ATOM 1325 CA LYS A 80 1.863 9.518 7.337 1.00 54.44 C ATOM 1326 C LYS A 80 2.098 10.116 8.733 1.00 64.24 C ATOM 1327 O LYS A 80 2.482 11.279 8.865 1.00 75.41 O ATOM 1328 CB LYS A 80 0.372 9.596 6.971 1.00 54.32 C ATOM 1329 CG LYS A 80 0.093 9.467 5.474 1.00 41.41 C ATOM 1330 CD LYS A 80 -1.407 9.463 5.180 1.00 31.22 C ATOM 1331 CE LYS A 80 -1.701 9.537 3.684 1.00 2.44 C ATOM 1332 NZ LYS A 80 -1.274 10.834 3.089 1.00 51.02 N ATOM 0 H LYS A 80 1.635 7.445 7.013 1.00 52.20 H new ATOM 0 HA LYS A 80 2.430 10.103 6.613 1.00 54.44 H new ATOM 0 HB2 LYS A 80 -0.163 8.807 7.499 1.00 54.32 H new ATOM 0 HB3 LYS A 80 -0.029 10.546 7.325 1.00 54.32 H new ATOM 0 HG2 LYS A 80 0.566 10.293 4.943 1.00 41.41 H new ATOM 0 HG3 LYS A 80 0.541 8.547 5.098 1.00 41.41 H new ATOM 0 HD2 LYS A 80 -1.854 8.558 5.592 1.00 31.22 H new ATOM 0 HD3 LYS A 80 -1.877 10.308 5.683 1.00 31.22 H new ATOM 0 HE2 LYS A 80 -1.190 8.720 3.174 1.00 2.44 H new ATOM 0 HE3 LYS A 80 -2.769 9.398 3.518 1.00 2.44 H new ATOM 0 HZ1 LYS A 80 -1.493 10.839 2.072 1.00 51.02 H new ATOM 0 HZ2 LYS A 80 -1.780 11.613 3.556 1.00 51.02 H new ATOM 0 HZ3 LYS A 80 -0.250 10.957 3.223 1.00 51.02 H new ATOM 1346 N GLY A 81 1.882 9.305 9.769 1.00 12.01 N ATOM 1347 CA GLY A 81 2.137 9.744 11.136 1.00 60.34 C ATOM 1348 C GLY A 81 3.612 10.041 11.383 1.00 54.15 C ATOM 1349 O GLY A 81 3.959 11.030 12.033 1.00 52.34 O ATOM 0 H GLY A 81 1.534 8.350 9.687 1.00 12.01 H new ATOM 0 HA2 GLY A 81 1.549 10.638 11.344 1.00 60.34 H new ATOM 0 HA3 GLY A 81 1.802 8.974 11.831 1.00 60.34 H new ATOM 1353 N ALA A 82 4.481 9.177 10.864 1.00 63.32 N ATOM 1354 CA ALA A 82 5.931 9.393 10.937 1.00 54.41 C ATOM 1355 C ALA A 82 6.336 10.705 10.241 1.00 11.41 C ATOM 1356 O ALA A 82 6.996 11.558 10.837 1.00 12.22 O ATOM 1357 CB ALA A 82 6.671 8.210 10.324 1.00 21.04 C ATOM 0 H ALA A 82 4.209 8.318 10.386 1.00 63.32 H new ATOM 0 HA ALA A 82 6.209 9.476 11.988 1.00 54.41 H new ATOM 0 HB1 ALA A 82 7.746 8.382 10.384 1.00 21.04 H new ATOM 0 HB2 ALA A 82 6.418 7.301 10.869 1.00 21.04 H new ATOM 0 HB3 ALA A 82 6.379 8.100 9.280 1.00 21.04 H new ATOM 1363 N VAL A 83 5.916 10.865 8.982 1.00 62.53 N ATOM 1364 CA VAL A 83 6.185 12.092 8.214 1.00 53.33 C ATOM 1365 C VAL A 83 5.627 13.336 8.932 1.00 4.31 C ATOM 1366 O VAL A 83 6.233 14.414 8.903 1.00 42.41 O ATOM 1367 CB VAL A 83 5.580 12.005 6.784 1.00 52.25 C ATOM 1368 CG1 VAL A 83 5.879 13.270 5.978 1.00 40.30 C ATOM 1369 CG2 VAL A 83 6.097 10.768 6.047 1.00 43.04 C ATOM 0 H VAL A 83 5.387 10.160 8.469 1.00 62.53 H new ATOM 0 HA VAL A 83 7.268 12.187 8.135 1.00 53.33 H new ATOM 0 HB VAL A 83 4.499 11.918 6.889 1.00 52.25 H new ATOM 0 HG11 VAL A 83 5.443 13.179 4.983 1.00 40.30 H new ATOM 0 HG12 VAL A 83 5.449 14.134 6.485 1.00 40.30 H new ATOM 0 HG13 VAL A 83 6.958 13.400 5.891 1.00 40.30 H new ATOM 0 HG21 VAL A 83 5.659 10.730 5.049 1.00 43.04 H new ATOM 0 HG22 VAL A 83 7.183 10.820 5.965 1.00 43.04 H new ATOM 0 HG23 VAL A 83 5.818 9.871 6.600 1.00 43.04 H new ATOM 1379 N ALA A 84 4.477 13.174 9.584 1.00 74.31 N ATOM 1380 CA ALA A 84 3.858 14.258 10.355 1.00 5.02 C ATOM 1381 C ALA A 84 4.748 14.710 11.527 1.00 22.33 C ATOM 1382 O ALA A 84 4.709 15.874 11.930 1.00 21.11 O ATOM 1383 CB ALA A 84 2.486 13.827 10.865 1.00 13.23 C ATOM 0 H ALA A 84 3.951 12.300 9.595 1.00 74.31 H new ATOM 0 HA ALA A 84 3.740 15.111 9.687 1.00 5.02 H new ATOM 0 HB1 ALA A 84 2.038 14.641 11.435 1.00 13.23 H new ATOM 0 HB2 ALA A 84 1.844 13.580 10.019 1.00 13.23 H new ATOM 0 HB3 ALA A 84 2.594 12.952 11.505 1.00 13.23 H new ATOM 1389 N ASN A 85 5.536 13.785 12.086 1.00 34.43 N ATOM 1390 CA ASN A 85 6.503 14.130 13.142 1.00 22.22 C ATOM 1391 C ASN A 85 7.832 14.613 12.539 1.00 24.41 C ATOM 1392 O ASN A 85 8.530 15.445 13.124 1.00 72.34 O ATOM 1393 CB ASN A 85 6.763 12.936 14.072 1.00 12.23 C ATOM 1394 CG ASN A 85 5.577 12.613 14.962 1.00 55.35 C ATOM 1395 OD1 ASN A 85 5.395 13.217 16.014 1.00 31.04 O ATOM 1396 ND2 ASN A 85 4.768 11.655 14.562 1.00 13.13 N ATOM 0 H ASN A 85 5.526 12.798 11.829 1.00 34.43 H new ATOM 0 HA ASN A 85 6.065 14.939 13.726 1.00 22.22 H new ATOM 0 HB2 ASN A 85 7.009 12.061 13.471 1.00 12.23 H new ATOM 0 HB3 ASN A 85 7.631 13.149 14.695 1.00 12.23 H new ATOM 0 HD21 ASN A 85 3.963 11.396 15.132 1.00 13.13 H new ATOM 0 HD22 ASN A 85 4.946 11.171 13.682 1.00 13.13 H new ATOM 1403 N ALA A 86 8.169 14.090 11.361 1.00 1.21 N ATOM 1404 CA ALA A 86 9.388 14.485 10.647 1.00 64.23 C ATOM 1405 C ALA A 86 9.409 15.990 10.332 1.00 65.41 C ATOM 1406 O ALA A 86 10.463 16.573 10.093 1.00 30.35 O ATOM 1407 CB ALA A 86 9.527 13.679 9.363 1.00 42.50 C ATOM 0 H ALA A 86 7.612 13.386 10.876 1.00 1.21 H new ATOM 0 HA ALA A 86 10.234 14.275 11.301 1.00 64.23 H new ATOM 0 HB1 ALA A 86 10.435 13.980 8.841 1.00 42.50 H new ATOM 0 HB2 ALA A 86 9.582 12.617 9.604 1.00 42.50 H new ATOM 0 HB3 ALA A 86 8.663 13.862 8.724 1.00 42.50 H new ATOM 1413 N ALA A 87 8.235 16.612 10.316 1.00 75.53 N ATOM 1414 CA ALA A 87 8.126 18.056 10.079 1.00 64.03 C ATOM 1415 C ALA A 87 8.756 18.882 11.219 1.00 51.03 C ATOM 1416 O ALA A 87 8.976 20.083 11.073 1.00 62.15 O ATOM 1417 CB ALA A 87 6.663 18.439 9.889 1.00 43.22 C ATOM 0 H ALA A 87 7.342 16.142 10.464 1.00 75.53 H new ATOM 0 HA ALA A 87 8.684 18.287 9.171 1.00 64.03 H new ATOM 0 HB1 ALA A 87 6.588 19.512 9.713 1.00 43.22 H new ATOM 0 HB2 ALA A 87 6.254 17.902 9.033 1.00 43.22 H new ATOM 0 HB3 ALA A 87 6.099 18.177 10.784 1.00 43.22 H new ATOM 1423 N CYS A 88 9.050 18.234 12.347 1.00 5.23 N ATOM 1424 CA CYS A 88 9.618 18.924 13.521 1.00 52.04 C ATOM 1425 C CYS A 88 11.135 18.685 13.657 1.00 44.11 C ATOM 1426 O CYS A 88 11.730 19.006 14.686 1.00 72.14 O ATOM 1427 CB CYS A 88 8.903 18.460 14.799 1.00 12.41 C ATOM 1428 SG CYS A 88 9.390 19.354 16.297 1.00 0.02 S ATOM 0 H CYS A 88 8.907 17.233 12.479 1.00 5.23 H new ATOM 0 HA CYS A 88 9.464 19.993 13.377 1.00 52.04 H new ATOM 0 HB2 CYS A 88 7.828 18.569 14.659 1.00 12.41 H new ATOM 0 HB3 CYS A 88 9.099 17.398 14.945 1.00 12.41 H new ATOM 0 HG CYS A 88 10.665 19.605 16.258 1.00 0.02 H new ATOM 1434 N LEU A 89 11.756 18.137 12.612 1.00 51.32 N ATOM 1435 CA LEU A 89 13.201 17.847 12.619 1.00 12.13 C ATOM 1436 C LEU A 89 14.059 19.130 12.587 1.00 10.34 C ATOM 1437 O LEU A 89 13.585 20.197 12.191 1.00 33.24 O ATOM 1438 CB LEU A 89 13.562 16.956 11.418 1.00 1.44 C ATOM 1439 CG LEU A 89 12.962 15.542 11.439 1.00 11.23 C ATOM 1440 CD1 LEU A 89 13.373 14.760 10.193 1.00 54.42 C ATOM 1441 CD2 LEU A 89 13.378 14.797 12.704 1.00 33.12 C ATOM 0 H LEU A 89 11.284 17.882 11.744 1.00 51.32 H new ATOM 0 HA LEU A 89 13.421 17.328 13.552 1.00 12.13 H new ATOM 0 HB2 LEU A 89 13.236 17.456 10.506 1.00 1.44 H new ATOM 0 HB3 LEU A 89 14.647 16.870 11.365 1.00 1.44 H new ATOM 0 HG LEU A 89 11.876 15.635 11.439 1.00 11.23 H new ATOM 0 HD11 LEU A 89 12.937 13.762 10.230 1.00 54.42 H new ATOM 0 HD12 LEU A 89 13.017 15.279 9.303 1.00 54.42 H new ATOM 0 HD13 LEU A 89 14.459 14.680 10.156 1.00 54.42 H new ATOM 0 HD21 LEU A 89 12.942 13.798 12.698 1.00 33.12 H new ATOM 0 HD22 LEU A 89 14.465 14.718 12.739 1.00 33.12 H new ATOM 0 HD23 LEU A 89 13.025 15.342 13.580 1.00 33.12 H new ATOM 1453 N PRO A 90 15.347 19.038 13.007 1.00 25.35 N ATOM 1454 CA PRO A 90 16.290 20.178 12.960 1.00 74.32 C ATOM 1455 C PRO A 90 16.569 20.672 11.527 1.00 33.01 C ATOM 1456 O PRO A 90 16.998 21.809 11.326 1.00 12.04 O ATOM 1457 CB PRO A 90 17.570 19.616 13.603 1.00 32.30 C ATOM 1458 CG PRO A 90 17.453 18.135 13.460 1.00 10.43 C ATOM 1459 CD PRO A 90 15.984 17.833 13.583 1.00 70.23 C ATOM 0 HA PRO A 90 15.888 21.051 13.474 1.00 74.32 H new ATOM 0 HB2 PRO A 90 18.462 19.992 13.102 1.00 32.30 H new ATOM 0 HB3 PRO A 90 17.646 19.907 14.651 1.00 32.30 H new ATOM 0 HG2 PRO A 90 17.843 17.802 12.498 1.00 10.43 H new ATOM 0 HG3 PRO A 90 18.025 17.620 14.232 1.00 10.43 H new ATOM 0 HD2 PRO A 90 15.710 16.931 13.036 1.00 70.23 H new ATOM 0 HD3 PRO A 90 15.689 17.678 14.621 1.00 70.23 H new ATOM 1467 N GLU A 91 16.342 19.808 10.539 1.00 72.23 N ATOM 1468 CA GLU A 91 16.431 20.201 9.126 1.00 14.32 C ATOM 1469 C GLU A 91 15.307 19.547 8.307 1.00 32.51 C ATOM 1470 O GLU A 91 15.019 18.358 8.457 1.00 30.31 O ATOM 1471 CB GLU A 91 17.809 19.859 8.530 1.00 32.02 C ATOM 1472 CG GLU A 91 18.167 18.376 8.561 1.00 53.33 C ATOM 1473 CD GLU A 91 19.535 18.089 7.955 1.00 10.33 C ATOM 1474 OE1 GLU A 91 20.536 18.675 8.423 1.00 11.11 O ATOM 1475 OE2 GLU A 91 19.614 17.292 6.996 1.00 42.11 O ATOM 0 H GLU A 91 16.095 18.830 10.687 1.00 72.23 H new ATOM 0 HA GLU A 91 16.309 21.283 9.077 1.00 14.32 H new ATOM 0 HB2 GLU A 91 17.839 20.204 7.497 1.00 32.02 H new ATOM 0 HB3 GLU A 91 18.573 20.415 9.074 1.00 32.02 H new ATOM 0 HG2 GLU A 91 18.150 18.024 9.592 1.00 53.33 H new ATOM 0 HG3 GLU A 91 17.408 17.812 8.019 1.00 53.33 H new ATOM 1482 N LEU A 92 14.676 20.336 7.441 1.00 42.44 N ATOM 1483 CA LEU A 92 13.512 19.883 6.661 1.00 34.41 C ATOM 1484 C LEU A 92 13.940 18.996 5.469 1.00 62.24 C ATOM 1485 O LEU A 92 13.101 18.416 4.775 1.00 55.13 O ATOM 1486 CB LEU A 92 12.721 21.123 6.185 1.00 14.54 C ATOM 1487 CG LEU A 92 11.186 20.978 6.082 1.00 54.41 C ATOM 1488 CD1 LEU A 92 10.774 20.132 4.883 1.00 51.13 C ATOM 1489 CD2 LEU A 92 10.611 20.397 7.374 1.00 22.02 C ATOM 0 H LEU A 92 14.949 21.301 7.256 1.00 42.44 H new ATOM 0 HA LEU A 92 12.873 19.266 7.293 1.00 34.41 H new ATOM 0 HB2 LEU A 92 12.939 21.946 6.866 1.00 14.54 H new ATOM 0 HB3 LEU A 92 13.101 21.411 5.205 1.00 14.54 H new ATOM 0 HG LEU A 92 10.774 21.976 5.934 1.00 54.41 H new ATOM 0 HD11 LEU A 92 9.687 20.055 4.848 1.00 51.13 H new ATOM 0 HD12 LEU A 92 11.135 20.599 3.967 1.00 51.13 H new ATOM 0 HD13 LEU A 92 11.205 19.135 4.976 1.00 51.13 H new ATOM 0 HD21 LEU A 92 9.529 20.303 7.281 1.00 22.02 H new ATOM 0 HD22 LEU A 92 11.046 19.414 7.556 1.00 22.02 H new ATOM 0 HD23 LEU A 92 10.847 21.059 8.207 1.00 22.02 H new ATOM 1501 N ILE A 93 15.249 18.874 5.254 1.00 15.44 N ATOM 1502 CA ILE A 93 15.793 18.089 4.136 1.00 21.11 C ATOM 1503 C ILE A 93 15.209 16.663 4.089 1.00 23.44 C ATOM 1504 O ILE A 93 14.622 16.253 3.084 1.00 42.14 O ATOM 1505 CB ILE A 93 17.339 17.994 4.225 1.00 24.20 C ATOM 1506 CG1 ILE A 93 17.957 19.394 4.382 1.00 54.14 C ATOM 1507 CG2 ILE A 93 17.911 17.284 2.997 1.00 11.44 C ATOM 1508 CD1 ILE A 93 17.601 20.356 3.267 1.00 0.51 C ATOM 0 H ILE A 93 15.960 19.310 5.841 1.00 15.44 H new ATOM 0 HA ILE A 93 15.506 18.613 3.224 1.00 21.11 H new ATOM 0 HB ILE A 93 17.595 17.405 5.106 1.00 24.20 H new ATOM 0 HG12 ILE A 93 17.631 19.819 5.332 1.00 54.14 H new ATOM 0 HG13 ILE A 93 19.042 19.297 4.431 1.00 54.14 H new ATOM 0 HG21 ILE A 93 18.996 17.229 3.081 1.00 11.44 H new ATOM 0 HG22 ILE A 93 17.500 16.276 2.935 1.00 11.44 H new ATOM 0 HG23 ILE A 93 17.645 17.840 2.098 1.00 11.44 H new ATOM 0 HD11 ILE A 93 18.076 21.320 3.452 1.00 0.51 H new ATOM 0 HD12 ILE A 93 17.951 19.956 2.316 1.00 0.51 H new ATOM 0 HD13 ILE A 93 16.519 20.486 3.230 1.00 0.51 H new ATOM 1520 N LEU A 94 15.367 15.919 5.186 1.00 2.52 N ATOM 1521 CA LEU A 94 14.855 14.543 5.276 1.00 10.12 C ATOM 1522 C LEU A 94 13.338 14.478 5.030 1.00 50.31 C ATOM 1523 O LEU A 94 12.853 13.587 4.327 1.00 33.20 O ATOM 1524 CB LEU A 94 15.196 13.942 6.650 1.00 2.34 C ATOM 1525 CG LEU A 94 14.646 12.526 6.914 1.00 2.55 C ATOM 1526 CD1 LEU A 94 15.130 11.537 5.854 1.00 74.15 C ATOM 1527 CD2 LEU A 94 15.035 12.051 8.314 1.00 13.24 C ATOM 0 H LEU A 94 15.845 16.243 6.027 1.00 2.52 H new ATOM 0 HA LEU A 94 15.339 13.958 4.494 1.00 10.12 H new ATOM 0 HB2 LEU A 94 16.281 13.916 6.756 1.00 2.34 H new ATOM 0 HB3 LEU A 94 14.816 14.610 7.423 1.00 2.34 H new ATOM 0 HG LEU A 94 13.559 12.572 6.854 1.00 2.55 H new ATOM 0 HD11 LEU A 94 14.725 10.548 6.068 1.00 74.15 H new ATOM 0 HD12 LEU A 94 14.791 11.863 4.871 1.00 74.15 H new ATOM 0 HD13 LEU A 94 16.219 11.494 5.867 1.00 74.15 H new ATOM 0 HD21 LEU A 94 14.638 11.050 8.482 1.00 13.24 H new ATOM 0 HD22 LEU A 94 16.121 12.030 8.402 1.00 13.24 H new ATOM 0 HD23 LEU A 94 14.624 12.734 9.057 1.00 13.24 H new ATOM 1539 N HIS A 95 12.595 15.432 5.596 1.00 34.54 N ATOM 1540 CA HIS A 95 11.136 15.468 5.438 1.00 62.13 C ATOM 1541 C HIS A 95 10.738 15.562 3.956 1.00 62.44 C ATOM 1542 O HIS A 95 9.743 14.972 3.532 1.00 31.14 O ATOM 1543 CB HIS A 95 10.534 16.643 6.224 1.00 54.32 C ATOM 1544 CG HIS A 95 9.030 16.684 6.193 1.00 5.54 C ATOM 1545 ND1 HIS A 95 8.107 16.083 6.983 1.00 60.21 N flip ATOM 1546 CD2 HIS A 95 8.313 17.410 5.267 1.00 71.14 C flip ATOM 1547 CE1 HIS A 95 6.870 16.456 6.522 1.00 52.12 C flip ATOM 1548 NE2 HIS A 95 7.023 17.255 5.487 1.00 32.34 N flip ATOM 0 H HIS A 95 12.976 16.187 6.166 1.00 34.54 H new ATOM 0 HA HIS A 95 10.737 14.536 5.839 1.00 62.13 H new ATOM 0 HB2 HIS A 95 10.866 16.583 7.261 1.00 54.32 H new ATOM 0 HB3 HIS A 95 10.923 17.577 5.818 1.00 54.32 H new ATOM 0 HD2 HIS A 95 8.743 18.014 4.481 1.00 71.14 H new ATOM 0 HE1 HIS A 95 5.924 16.145 6.940 1.00 52.12 H new ATOM 0 HE2 HIS A 95 6.270 17.682 4.947 1.00 32.34 H new ATOM 1557 N ASN A 96 11.525 16.297 3.171 1.00 11.52 N ATOM 1558 CA ASN A 96 11.268 16.433 1.735 1.00 4.11 C ATOM 1559 C ASN A 96 11.512 15.100 1.003 1.00 23.14 C ATOM 1560 O ASN A 96 10.693 14.662 0.193 1.00 71.40 O ATOM 1561 CB ASN A 96 12.151 17.538 1.136 1.00 64.10 C ATOM 1562 CG ASN A 96 11.792 17.851 -0.308 1.00 72.15 C ATOM 1563 OD1 ASN A 96 10.642 17.732 -0.716 1.00 1.53 O ATOM 1564 ND2 ASN A 96 12.773 18.250 -1.093 1.00 15.31 N ATOM 0 H ASN A 96 12.344 16.807 3.503 1.00 11.52 H new ATOM 0 HA ASN A 96 10.222 16.708 1.603 1.00 4.11 H new ATOM 0 HB2 ASN A 96 12.052 18.443 1.736 1.00 64.10 H new ATOM 0 HB3 ASN A 96 13.196 17.233 1.189 1.00 64.10 H new ATOM 0 HD21 ASN A 96 12.586 18.470 -2.071 1.00 15.31 H new ATOM 0 HD22 ASN A 96 13.719 18.339 -0.722 1.00 15.31 H new ATOM 1571 N LYS A 97 12.633 14.447 1.314 1.00 50.41 N ATOM 1572 CA LYS A 97 12.985 13.166 0.685 1.00 24.55 C ATOM 1573 C LYS A 97 11.960 12.068 1.013 1.00 24.41 C ATOM 1574 O LYS A 97 11.476 11.369 0.123 1.00 72.22 O ATOM 1575 CB LYS A 97 14.379 12.708 1.131 1.00 40.22 C ATOM 1576 CG LYS A 97 15.506 13.659 0.744 1.00 34.15 C ATOM 1577 CD LYS A 97 16.864 13.072 1.113 1.00 51.43 C ATOM 1578 CE LYS A 97 18.018 13.985 0.721 1.00 3.23 C ATOM 1579 NZ LYS A 97 19.333 13.364 1.027 1.00 55.21 N ATOM 0 H LYS A 97 13.314 14.781 1.996 1.00 50.41 H new ATOM 0 HA LYS A 97 12.982 13.329 -0.393 1.00 24.55 H new ATOM 0 HB2 LYS A 97 14.379 12.585 2.214 1.00 40.22 H new ATOM 0 HB3 LYS A 97 14.582 11.728 0.699 1.00 40.22 H new ATOM 0 HG2 LYS A 97 15.469 13.856 -0.327 1.00 34.15 H new ATOM 0 HG3 LYS A 97 15.370 14.615 1.249 1.00 34.15 H new ATOM 0 HD2 LYS A 97 16.898 12.889 2.187 1.00 51.43 H new ATOM 0 HD3 LYS A 97 16.985 12.107 0.621 1.00 51.43 H new ATOM 0 HE2 LYS A 97 17.960 14.210 -0.344 1.00 3.23 H new ATOM 0 HE3 LYS A 97 17.930 14.933 1.252 1.00 3.23 H new ATOM 0 HZ1 LYS A 97 20.097 14.012 0.748 1.00 55.21 H new ATOM 0 HZ2 LYS A 97 19.397 13.172 2.047 1.00 55.21 H new ATOM 0 HZ3 LYS A 97 19.427 12.472 0.501 1.00 55.21 H new ATOM 1593 N MET A 98 11.629 11.921 2.292 1.00 3.13 N ATOM 1594 CA MET A 98 10.711 10.865 2.728 1.00 1.13 C ATOM 1595 C MET A 98 9.290 11.074 2.172 1.00 21.42 C ATOM 1596 O MET A 98 8.580 10.105 1.906 1.00 30.20 O ATOM 1597 CB MET A 98 10.684 10.774 4.264 1.00 61.41 C ATOM 1598 CG MET A 98 10.059 11.979 4.956 1.00 55.21 C ATOM 1599 SD MET A 98 10.306 11.965 6.743 1.00 53.12 S ATOM 1600 CE MET A 98 9.670 10.349 7.181 1.00 22.01 C ATOM 0 H MET A 98 11.979 12.515 3.044 1.00 3.13 H new ATOM 0 HA MET A 98 11.082 9.922 2.326 1.00 1.13 H new ATOM 0 HB2 MET A 98 10.133 9.879 4.553 1.00 61.41 H new ATOM 0 HB3 MET A 98 11.705 10.651 4.626 1.00 61.41 H new ATOM 0 HG2 MET A 98 10.487 12.892 4.542 1.00 55.21 H new ATOM 0 HG3 MET A 98 8.991 12.002 4.742 1.00 55.21 H new ATOM 0 HE1 MET A 98 9.062 10.429 8.082 1.00 22.01 H new ATOM 0 HE2 MET A 98 9.059 9.965 6.364 1.00 22.01 H new ATOM 0 HE3 MET A 98 10.501 9.668 7.363 1.00 22.01 H new ATOM 1610 N LYS A 99 8.875 12.332 1.979 1.00 74.42 N ATOM 1611 CA LYS A 99 7.533 12.603 1.448 1.00 33.55 C ATOM 1612 C LYS A 99 7.470 12.413 -0.078 1.00 64.04 C ATOM 1613 O LYS A 99 6.513 11.834 -0.582 1.00 60.41 O ATOM 1614 CB LYS A 99 7.034 14.011 1.821 1.00 2.23 C ATOM 1615 CG LYS A 99 7.734 15.153 1.090 1.00 11.51 C ATOM 1616 CD LYS A 99 6.984 16.474 1.255 1.00 53.22 C ATOM 1617 CE LYS A 99 5.623 16.444 0.561 1.00 33.35 C ATOM 1618 NZ LYS A 99 4.858 17.699 0.776 1.00 34.21 N ATOM 0 H LYS A 99 9.434 13.162 2.177 1.00 74.42 H new ATOM 0 HA LYS A 99 6.872 11.873 1.915 1.00 33.55 H new ATOM 0 HB2 LYS A 99 5.965 14.068 1.616 1.00 2.23 H new ATOM 0 HB3 LYS A 99 7.161 14.154 2.894 1.00 2.23 H new ATOM 0 HG2 LYS A 99 8.749 15.261 1.471 1.00 11.51 H new ATOM 0 HG3 LYS A 99 7.816 14.911 0.030 1.00 11.51 H new ATOM 0 HD2 LYS A 99 6.847 16.684 2.316 1.00 53.22 H new ATOM 0 HD3 LYS A 99 7.584 17.286 0.844 1.00 53.22 H new ATOM 0 HE2 LYS A 99 5.765 16.285 -0.508 1.00 33.35 H new ATOM 0 HE3 LYS A 99 5.045 15.599 0.935 1.00 33.35 H new ATOM 0 HZ1 LYS A 99 3.942 17.635 0.288 1.00 34.21 H new ATOM 0 HZ2 LYS A 99 4.699 17.838 1.794 1.00 34.21 H new ATOM 0 HZ3 LYS A 99 5.397 18.503 0.396 1.00 34.21 H new ATOM 1632 N ARG A 100 8.486 12.888 -0.814 1.00 74.53 N ATOM 1633 CA ARG A 100 8.491 12.761 -2.284 1.00 44.50 C ATOM 1634 C ARG A 100 8.380 11.291 -2.718 1.00 43.44 C ATOM 1635 O ARG A 100 7.633 10.956 -3.640 1.00 20.33 O ATOM 1636 CB ARG A 100 9.748 13.400 -2.905 1.00 23.04 C ATOM 1637 CG ARG A 100 11.071 12.847 -2.381 1.00 4.53 C ATOM 1638 CD ARG A 100 12.187 12.956 -3.414 1.00 73.52 C ATOM 1639 NE ARG A 100 12.021 11.972 -4.480 1.00 3.02 N ATOM 1640 CZ ARG A 100 11.971 12.252 -5.752 1.00 32.21 C ATOM 1641 NH1 ARG A 100 12.077 13.476 -6.169 1.00 42.53 N ATOM 1642 NH2 ARG A 100 11.816 11.295 -6.607 1.00 51.41 N ATOM 0 H ARG A 100 9.304 13.357 -0.426 1.00 74.53 H new ATOM 0 HA ARG A 100 7.617 13.299 -2.651 1.00 44.50 H new ATOM 0 HB2 ARG A 100 9.714 13.260 -3.985 1.00 23.04 H new ATOM 0 HB3 ARG A 100 9.721 14.474 -2.722 1.00 23.04 H new ATOM 0 HG2 ARG A 100 11.358 13.388 -1.479 1.00 4.53 H new ATOM 0 HG3 ARG A 100 10.940 11.803 -2.098 1.00 4.53 H new ATOM 0 HD2 ARG A 100 12.194 13.959 -3.840 1.00 73.52 H new ATOM 0 HD3 ARG A 100 13.151 12.809 -2.928 1.00 73.52 H new ATOM 0 HE ARG A 100 11.938 10.992 -4.209 1.00 3.02 H new ATOM 0 HH11 ARG A 100 12.201 14.234 -5.498 1.00 42.53 H new ATOM 0 HH12 ARG A 100 12.036 13.680 -7.168 1.00 42.53 H new ATOM 0 HH21 ARG A 100 11.734 10.331 -6.284 1.00 51.41 H new ATOM 0 HH22 ARG A 100 11.776 11.504 -7.605 1.00 51.41 H new ATOM 1656 N GLU A 101 9.114 10.417 -2.036 1.00 44.23 N ATOM 1657 CA GLU A 101 9.054 8.982 -2.312 1.00 25.23 C ATOM 1658 C GLU A 101 7.692 8.405 -1.896 1.00 21.23 C ATOM 1659 O GLU A 101 7.148 7.523 -2.558 1.00 4.04 O ATOM 1660 CB GLU A 101 10.193 8.263 -1.578 1.00 3.24 C ATOM 1661 CG GLU A 101 11.588 8.764 -1.960 1.00 75.24 C ATOM 1662 CD GLU A 101 11.980 8.421 -3.393 1.00 63.31 C ATOM 1663 OE1 GLU A 101 11.556 9.136 -4.326 1.00 51.21 O ATOM 1664 OE2 GLU A 101 12.725 7.437 -3.588 1.00 33.02 O ATOM 0 H GLU A 101 9.758 10.675 -1.288 1.00 44.23 H new ATOM 0 HA GLU A 101 9.172 8.825 -3.384 1.00 25.23 H new ATOM 0 HB2 GLU A 101 10.055 8.386 -0.504 1.00 3.24 H new ATOM 0 HB3 GLU A 101 10.131 7.195 -1.788 1.00 3.24 H new ATOM 0 HG2 GLU A 101 11.627 9.845 -1.829 1.00 75.24 H new ATOM 0 HG3 GLU A 101 12.321 8.334 -1.277 1.00 75.24 H new ATOM 1671 N LEU A 102 7.141 8.928 -0.800 1.00 52.12 N ATOM 1672 CA LEU A 102 5.807 8.530 -0.339 1.00 15.14 C ATOM 1673 C LEU A 102 4.718 8.986 -1.326 1.00 64.21 C ATOM 1674 O LEU A 102 3.693 8.325 -1.488 1.00 32.32 O ATOM 1675 CB LEU A 102 5.532 9.117 1.055 1.00 23.22 C ATOM 1676 CG LEU A 102 4.185 8.721 1.684 1.00 23.25 C ATOM 1677 CD1 LEU A 102 4.082 7.205 1.841 1.00 61.13 C ATOM 1678 CD2 LEU A 102 3.993 9.419 3.029 1.00 3.21 C ATOM 0 H LEU A 102 7.596 9.628 -0.214 1.00 52.12 H new ATOM 0 HA LEU A 102 5.781 7.442 -0.283 1.00 15.14 H new ATOM 0 HB2 LEU A 102 6.333 8.806 1.726 1.00 23.22 H new ATOM 0 HB3 LEU A 102 5.577 10.204 0.988 1.00 23.22 H new ATOM 0 HG LEU A 102 3.389 9.045 1.014 1.00 23.25 H new ATOM 0 HD11 LEU A 102 3.121 6.950 2.288 1.00 61.13 H new ATOM 0 HD12 LEU A 102 4.164 6.731 0.863 1.00 61.13 H new ATOM 0 HD13 LEU A 102 4.887 6.850 2.485 1.00 61.13 H new ATOM 0 HD21 LEU A 102 3.035 9.126 3.458 1.00 3.21 H new ATOM 0 HD22 LEU A 102 4.797 9.131 3.706 1.00 3.21 H new ATOM 0 HD23 LEU A 102 4.010 10.499 2.884 1.00 3.21 H new ATOM 1690 N GLN A 103 4.947 10.125 -1.987 1.00 60.44 N ATOM 1691 CA GLN A 103 4.002 10.638 -2.985 1.00 32.34 C ATOM 1692 C GLN A 103 3.926 9.710 -4.201 1.00 23.44 C ATOM 1693 O GLN A 103 2.882 9.595 -4.831 1.00 54.33 O ATOM 1694 CB GLN A 103 4.375 12.067 -3.414 1.00 71.42 C ATOM 1695 CG GLN A 103 4.298 13.083 -2.276 1.00 72.51 C ATOM 1696 CD GLN A 103 2.940 13.096 -1.587 1.00 73.23 C ATOM 1697 OE1 GLN A 103 2.045 13.852 -1.952 1.00 12.15 O ATOM 1698 NE2 GLN A 103 2.770 12.243 -0.594 1.00 34.25 N ATOM 0 H GLN A 103 5.774 10.707 -1.851 1.00 60.44 H new ATOM 0 HA GLN A 103 3.016 10.669 -2.522 1.00 32.34 H new ATOM 0 HB2 GLN A 103 5.386 12.064 -3.820 1.00 71.42 H new ATOM 0 HB3 GLN A 103 3.710 12.382 -4.218 1.00 71.42 H new ATOM 0 HG2 GLN A 103 5.071 12.858 -1.541 1.00 72.51 H new ATOM 0 HG3 GLN A 103 4.511 14.078 -2.668 1.00 72.51 H new ATOM 0 HE21 GLN A 103 3.534 11.627 -0.314 1.00 34.25 H new ATOM 0 HE22 GLN A 103 1.875 12.199 -0.107 1.00 34.25 H new ATOM 1707 N ARG A 104 5.037 9.046 -4.524 1.00 30.42 N ATOM 1708 CA ARG A 104 5.034 8.002 -5.555 1.00 34.41 C ATOM 1709 C ARG A 104 4.101 6.849 -5.157 1.00 61.33 C ATOM 1710 O ARG A 104 3.298 6.380 -5.964 1.00 4.14 O ATOM 1711 CB ARG A 104 6.462 7.485 -5.801 1.00 32.50 C ATOM 1712 CG ARG A 104 7.283 8.363 -6.749 1.00 12.42 C ATOM 1713 CD ARG A 104 6.998 8.047 -8.221 1.00 5.04 C ATOM 1714 NE ARG A 104 5.579 8.178 -8.572 1.00 24.11 N ATOM 1715 CZ ARG A 104 4.824 7.180 -8.969 1.00 53.54 C ATOM 1716 NH1 ARG A 104 5.306 5.984 -9.073 1.00 41.12 N ATOM 1717 NH2 ARG A 104 3.583 7.384 -9.258 1.00 53.41 N ATOM 0 H ARG A 104 5.946 9.210 -4.091 1.00 30.42 H new ATOM 0 HA ARG A 104 4.661 8.436 -6.483 1.00 34.41 H new ATOM 0 HB2 ARG A 104 6.982 7.413 -4.846 1.00 32.50 H new ATOM 0 HB3 ARG A 104 6.408 6.476 -6.211 1.00 32.50 H new ATOM 0 HG2 ARG A 104 7.060 9.412 -6.554 1.00 12.42 H new ATOM 0 HG3 ARG A 104 8.344 8.220 -6.547 1.00 12.42 H new ATOM 0 HD2 ARG A 104 7.585 8.715 -8.851 1.00 5.04 H new ATOM 0 HD3 ARG A 104 7.328 7.031 -8.439 1.00 5.04 H new ATOM 0 HE ARG A 104 5.153 9.102 -8.503 1.00 24.11 H new ATOM 0 HH11 ARG A 104 6.284 5.807 -8.845 1.00 41.12 H new ATOM 0 HH12 ARG A 104 4.708 5.218 -9.383 1.00 41.12 H new ATOM 0 HH21 ARG A 104 3.188 8.321 -9.178 1.00 53.41 H new ATOM 0 HH22 ARG A 104 2.997 6.608 -9.566 1.00 53.41 H new ATOM 1731 N VAL A 105 4.207 6.415 -3.902 1.00 55.33 N ATOM 1732 CA VAL A 105 3.306 5.396 -3.351 1.00 24.31 C ATOM 1733 C VAL A 105 1.832 5.849 -3.425 1.00 41.45 C ATOM 1734 O VAL A 105 1.006 5.203 -4.075 1.00 14.55 O ATOM 1735 CB VAL A 105 3.684 5.055 -1.879 1.00 21.11 C ATOM 1736 CG1 VAL A 105 2.636 4.152 -1.226 1.00 22.32 C ATOM 1737 CG2 VAL A 105 5.068 4.400 -1.817 1.00 55.24 C ATOM 0 H VAL A 105 4.909 6.752 -3.244 1.00 55.33 H new ATOM 0 HA VAL A 105 3.421 4.499 -3.960 1.00 24.31 H new ATOM 0 HB VAL A 105 3.713 5.990 -1.320 1.00 21.11 H new ATOM 0 HG11 VAL A 105 2.932 3.934 -0.200 1.00 22.32 H new ATOM 0 HG12 VAL A 105 1.670 4.657 -1.226 1.00 22.32 H new ATOM 0 HG13 VAL A 105 2.558 3.220 -1.787 1.00 22.32 H new ATOM 0 HG21 VAL A 105 5.315 4.169 -0.781 1.00 55.24 H new ATOM 0 HG22 VAL A 105 5.062 3.481 -2.402 1.00 55.24 H new ATOM 0 HG23 VAL A 105 5.813 5.084 -2.224 1.00 55.24 H new ATOM 1747 N GLU A 106 1.511 6.972 -2.781 1.00 33.11 N ATOM 1748 CA GLU A 106 0.133 7.490 -2.757 1.00 32.44 C ATOM 1749 C GLU A 106 -0.426 7.719 -4.176 1.00 64.51 C ATOM 1750 O GLU A 106 -1.549 7.316 -4.481 1.00 10.45 O ATOM 1751 CB GLU A 106 0.062 8.793 -1.946 1.00 42.00 C ATOM 1752 CG GLU A 106 0.428 8.628 -0.471 1.00 71.13 C ATOM 1753 CD GLU A 106 0.157 9.885 0.345 1.00 41.54 C ATOM 1754 OE1 GLU A 106 -1.026 10.264 0.479 1.00 61.34 O ATOM 1755 OE2 GLU A 106 1.114 10.489 0.874 1.00 1.23 O ATOM 0 H GLU A 106 2.182 7.543 -2.268 1.00 33.11 H new ATOM 0 HA GLU A 106 -0.487 6.732 -2.277 1.00 32.44 H new ATOM 0 HB2 GLU A 106 0.732 9.526 -2.396 1.00 42.00 H new ATOM 0 HB3 GLU A 106 -0.948 9.198 -2.016 1.00 42.00 H new ATOM 0 HG2 GLU A 106 -0.139 7.797 -0.051 1.00 71.13 H new ATOM 0 HG3 GLU A 106 1.483 8.367 -0.389 1.00 71.13 H new ATOM 1762 N ASP A 107 0.364 8.357 -5.038 1.00 23.14 N ATOM 1763 CA ASP A 107 -0.029 8.600 -6.435 1.00 31.40 C ATOM 1764 C ASP A 107 -0.317 7.279 -7.177 1.00 71.21 C ATOM 1765 O ASP A 107 -1.335 7.142 -7.857 1.00 13.43 O ATOM 1766 CB ASP A 107 1.077 9.397 -7.147 1.00 50.32 C ATOM 1767 CG ASP A 107 0.817 9.613 -8.628 1.00 72.15 C ATOM 1768 OD1 ASP A 107 -0.274 10.101 -8.987 1.00 3.52 O ATOM 1769 OD2 ASP A 107 1.719 9.315 -9.440 1.00 75.02 O ATOM 0 H ASP A 107 1.287 8.719 -4.796 1.00 23.14 H new ATOM 0 HA ASP A 107 -0.951 9.181 -6.441 1.00 31.40 H new ATOM 0 HB2 ASP A 107 1.184 10.367 -6.661 1.00 50.32 H new ATOM 0 HB3 ASP A 107 2.025 8.873 -7.026 1.00 50.32 H new ATOM 1774 N SER A 108 0.572 6.299 -7.022 1.00 60.54 N ATOM 1775 CA SER A 108 0.397 4.990 -7.669 1.00 43.41 C ATOM 1776 C SER A 108 -0.784 4.202 -7.075 1.00 71.14 C ATOM 1777 O SER A 108 -1.395 3.389 -7.763 1.00 65.24 O ATOM 1778 CB SER A 108 1.682 4.157 -7.568 1.00 33.21 C ATOM 1779 OG SER A 108 2.757 4.775 -8.264 1.00 33.02 O ATOM 0 H SER A 108 1.418 6.381 -6.458 1.00 60.54 H new ATOM 0 HA SER A 108 0.175 5.184 -8.718 1.00 43.41 H new ATOM 0 HB2 SER A 108 1.952 4.027 -6.520 1.00 33.21 H new ATOM 0 HB3 SER A 108 1.506 3.162 -7.977 1.00 33.21 H new ATOM 0 HG SER A 108 3.193 5.429 -7.678 1.00 33.02 H new ATOM 1785 N HIS A 109 -1.097 4.426 -5.795 1.00 31.00 N ATOM 1786 CA HIS A 109 -2.217 3.723 -5.148 1.00 75.21 C ATOM 1787 C HIS A 109 -3.571 4.425 -5.335 1.00 60.34 C ATOM 1788 O HIS A 109 -4.605 3.764 -5.382 1.00 22.43 O ATOM 1789 CB HIS A 109 -1.928 3.505 -3.663 1.00 44.55 C ATOM 1790 CG HIS A 109 -0.913 2.433 -3.436 1.00 20.22 C ATOM 1791 ND1 HIS A 109 -1.234 1.095 -3.394 1.00 13.43 N ATOM 1792 CD2 HIS A 109 0.426 2.497 -3.280 1.00 0.42 C ATOM 1793 CE1 HIS A 109 -0.139 0.389 -3.225 1.00 71.10 C ATOM 1794 NE2 HIS A 109 0.884 1.215 -3.153 1.00 41.04 N ATOM 0 H HIS A 109 -0.600 5.079 -5.190 1.00 31.00 H new ATOM 0 HA HIS A 109 -2.301 2.758 -5.648 1.00 75.21 H new ATOM 0 HB2 HIS A 109 -1.574 4.437 -3.223 1.00 44.55 H new ATOM 0 HB3 HIS A 109 -2.853 3.242 -3.150 1.00 44.55 H new ATOM 0 HD1 HIS A 109 -2.175 0.712 -3.481 1.00 13.43 H new ATOM 0 HD2 HIS A 109 1.025 3.395 -3.259 1.00 0.42 H new ATOM 0 HE1 HIS A 109 -0.087 -0.688 -3.157 1.00 71.10 H new ATOM 0 HE2 HIS A 109 1.859 0.943 -3.024 1.00 41.04 H new ATOM 1803 N GLN A 110 -3.583 5.750 -5.451 1.00 0.21 N ATOM 1804 CA GLN A 110 -4.854 6.469 -5.606 1.00 0.13 C ATOM 1805 C GLN A 110 -5.598 6.007 -6.869 1.00 34.31 C ATOM 1806 O GLN A 110 -6.827 5.930 -6.881 1.00 41.04 O ATOM 1807 CB GLN A 110 -4.650 7.993 -5.618 1.00 40.02 C ATOM 1808 CG GLN A 110 -3.977 8.546 -6.869 1.00 54.21 C ATOM 1809 CD GLN A 110 -3.837 10.063 -6.840 1.00 61.11 C ATOM 1810 OE1 GLN A 110 -3.649 10.633 -5.664 1.00 60.23 O flip ATOM 1811 NE2 GLN A 110 -3.891 10.722 -7.871 1.00 31.45 N flip ATOM 0 H GLN A 110 -2.751 6.340 -5.442 1.00 0.21 H new ATOM 0 HA GLN A 110 -5.470 6.228 -4.739 1.00 0.13 H new ATOM 0 HB2 GLN A 110 -5.621 8.475 -5.504 1.00 40.02 H new ATOM 0 HB3 GLN A 110 -4.052 8.271 -4.750 1.00 40.02 H new ATOM 0 HG2 GLN A 110 -2.990 8.096 -6.974 1.00 54.21 H new ATOM 0 HG3 GLN A 110 -4.555 8.255 -7.746 1.00 54.21 H new ATOM 0 HE21 GLN A 110 -4.037 10.257 -8.767 1.00 31.45 H new ATOM 0 HE22 GLN A 110 -3.790 11.736 -7.834 1.00 31.45 H new ATOM 1820 N ILE A 111 -4.848 5.666 -7.920 1.00 15.33 N ATOM 1821 CA ILE A 111 -5.451 5.109 -9.134 1.00 52.33 C ATOM 1822 C ILE A 111 -6.012 3.701 -8.870 1.00 34.03 C ATOM 1823 O ILE A 111 -6.979 3.280 -9.499 1.00 21.43 O ATOM 1824 CB ILE A 111 -4.444 5.057 -10.316 1.00 4.45 C ATOM 1825 CG1 ILE A 111 -3.287 4.086 -10.016 1.00 50.14 C ATOM 1826 CG2 ILE A 111 -3.911 6.457 -10.623 1.00 74.45 C ATOM 1827 CD1 ILE A 111 -2.291 3.940 -11.152 1.00 61.21 C ATOM 0 H ILE A 111 -3.833 5.764 -7.956 1.00 15.33 H new ATOM 0 HA ILE A 111 -6.266 5.776 -9.415 1.00 52.33 H new ATOM 0 HB ILE A 111 -4.970 4.686 -11.195 1.00 4.45 H new ATOM 0 HG12 ILE A 111 -2.759 4.430 -9.126 1.00 50.14 H new ATOM 0 HG13 ILE A 111 -3.701 3.105 -9.782 1.00 50.14 H new ATOM 0 HG21 ILE A 111 -3.207 6.404 -11.453 1.00 74.45 H new ATOM 0 HG22 ILE A 111 -4.740 7.111 -10.892 1.00 74.45 H new ATOM 0 HG23 ILE A 111 -3.405 6.855 -9.743 1.00 74.45 H new ATOM 0 HD11 ILE A 111 -1.508 3.240 -10.862 1.00 61.21 H new ATOM 0 HD12 ILE A 111 -2.803 3.565 -12.038 1.00 61.21 H new ATOM 0 HD13 ILE A 111 -1.846 4.910 -11.373 1.00 61.21 H new ATOM 1839 N LEU A 112 -5.403 2.984 -7.924 1.00 22.43 N ATOM 1840 CA LEU A 112 -5.888 1.657 -7.519 1.00 3.44 C ATOM 1841 C LEU A 112 -7.223 1.773 -6.773 1.00 31.32 C ATOM 1842 O LEU A 112 -8.188 1.068 -7.076 1.00 12.32 O ATOM 1843 CB LEU A 112 -4.848 0.957 -6.632 1.00 64.54 C ATOM 1844 CG LEU A 112 -3.454 0.796 -7.257 1.00 1.32 C ATOM 1845 CD1 LEU A 112 -2.519 0.039 -6.315 1.00 2.41 C ATOM 1846 CD2 LEU A 112 -3.549 0.096 -8.610 1.00 24.24 C ATOM 0 H LEU A 112 -4.572 3.297 -7.422 1.00 22.43 H new ATOM 0 HA LEU A 112 -6.044 1.061 -8.418 1.00 3.44 H new ATOM 0 HB2 LEU A 112 -4.749 1.519 -5.704 1.00 64.54 H new ATOM 0 HB3 LEU A 112 -5.226 -0.031 -6.368 1.00 64.54 H new ATOM 0 HG LEU A 112 -3.035 1.790 -7.417 1.00 1.32 H new ATOM 0 HD11 LEU A 112 -1.538 -0.062 -6.780 1.00 2.41 H new ATOM 0 HD12 LEU A 112 -2.422 0.589 -5.379 1.00 2.41 H new ATOM 0 HD13 LEU A 112 -2.929 -0.951 -6.113 1.00 2.41 H new ATOM 0 HD21 LEU A 112 -2.551 -0.009 -9.036 1.00 24.24 H new ATOM 0 HD22 LEU A 112 -3.993 -0.891 -8.479 1.00 24.24 H new ATOM 0 HD23 LEU A 112 -4.171 0.687 -9.282 1.00 24.24 H new ATOM 1858 N SER A 113 -7.269 2.675 -5.795 1.00 43.11 N ATOM 1859 CA SER A 113 -8.509 2.975 -5.064 1.00 50.43 C ATOM 1860 C SER A 113 -9.655 3.344 -6.020 1.00 74.21 C ATOM 1861 O SER A 113 -10.796 2.905 -5.844 1.00 42.44 O ATOM 1862 CB SER A 113 -8.279 4.126 -4.070 1.00 23.21 C ATOM 1863 OG SER A 113 -9.499 4.554 -3.473 1.00 52.05 O ATOM 0 H SER A 113 -6.461 3.215 -5.486 1.00 43.11 H new ATOM 0 HA SER A 113 -8.793 2.074 -4.521 1.00 50.43 H new ATOM 0 HB2 SER A 113 -7.586 3.803 -3.293 1.00 23.21 H new ATOM 0 HB3 SER A 113 -7.811 4.965 -4.586 1.00 23.21 H new ATOM 0 HG SER A 113 -9.318 5.285 -2.846 1.00 52.05 H new ATOM 1869 N GLN A 114 -9.346 4.144 -7.038 1.00 41.45 N ATOM 1870 CA GLN A 114 -10.357 4.596 -8.002 1.00 70.43 C ATOM 1871 C GLN A 114 -10.767 3.484 -8.985 1.00 43.30 C ATOM 1872 O GLN A 114 -11.951 3.327 -9.287 1.00 74.34 O ATOM 1873 CB GLN A 114 -9.851 5.830 -8.761 1.00 2.23 C ATOM 1874 CG GLN A 114 -9.539 7.016 -7.850 1.00 23.21 C ATOM 1875 CD GLN A 114 -10.722 7.436 -6.986 1.00 35.31 C ATOM 1876 OE1 GLN A 114 -11.925 7.335 -7.522 1.00 44.43 O flip ATOM 1877 NE2 GLN A 114 -10.552 7.870 -5.850 1.00 55.23 N flip ATOM 0 H GLN A 114 -8.406 4.495 -7.220 1.00 41.45 H new ATOM 0 HA GLN A 114 -11.249 4.864 -7.437 1.00 70.43 H new ATOM 0 HB2 GLN A 114 -8.953 5.562 -9.317 1.00 2.23 H new ATOM 0 HB3 GLN A 114 -10.601 6.131 -9.492 1.00 2.23 H new ATOM 0 HG2 GLN A 114 -8.699 6.759 -7.205 1.00 23.21 H new ATOM 0 HG3 GLN A 114 -9.225 7.862 -8.461 1.00 23.21 H new ATOM 0 HE21 GLN A 114 -9.610 7.935 -5.465 1.00 55.23 H new ATOM 0 HE22 GLN A 114 -11.353 8.165 -5.292 1.00 55.23 H new ATOM 1886 N THR A 115 -9.796 2.710 -9.476 1.00 14.23 N ATOM 1887 CA THR A 115 -10.098 1.575 -10.372 1.00 4.13 C ATOM 1888 C THR A 115 -10.958 0.524 -9.661 1.00 43.31 C ATOM 1889 O THR A 115 -11.993 0.109 -10.177 1.00 64.42 O ATOM 1890 CB THR A 115 -8.819 0.891 -10.922 1.00 42.02 C ATOM 1891 OG1 THR A 115 -7.945 0.537 -9.844 1.00 1.12 O ATOM 1892 CG2 THR A 115 -8.081 1.797 -11.903 1.00 73.34 C ATOM 0 H THR A 115 -8.804 2.840 -9.276 1.00 14.23 H new ATOM 0 HA THR A 115 -10.648 1.996 -11.213 1.00 4.13 H new ATOM 0 HB THR A 115 -9.127 -0.010 -11.453 1.00 42.02 H new ATOM 0 HG1 THR A 115 -7.142 0.105 -10.202 1.00 1.12 H new ATOM 0 HG21 THR A 115 -7.190 1.287 -12.269 1.00 73.34 H new ATOM 0 HG22 THR A 115 -8.735 2.033 -12.743 1.00 73.34 H new ATOM 0 HG23 THR A 115 -7.790 2.719 -11.399 1.00 73.34 H new ATOM 1900 N SER A 116 -10.534 0.105 -8.467 1.00 73.13 N ATOM 1901 CA SER A 116 -11.334 -0.812 -7.637 1.00 75.24 C ATOM 1902 C SER A 116 -12.756 -0.269 -7.425 1.00 2.00 C ATOM 1903 O SER A 116 -13.742 -1.004 -7.509 1.00 41.42 O ATOM 1904 CB SER A 116 -10.660 -1.038 -6.275 1.00 75.22 C ATOM 1905 OG SER A 116 -11.473 -1.824 -5.412 1.00 20.42 O ATOM 0 H SER A 116 -9.645 0.382 -8.050 1.00 73.13 H new ATOM 0 HA SER A 116 -11.399 -1.763 -8.166 1.00 75.24 H new ATOM 0 HB2 SER A 116 -9.700 -1.533 -6.421 1.00 75.22 H new ATOM 0 HB3 SER A 116 -10.455 -0.076 -5.806 1.00 75.22 H new ATOM 0 HG SER A 116 -11.014 -1.950 -4.555 1.00 20.42 H new ATOM 1911 N HIS A 117 -12.853 1.033 -7.155 1.00 61.42 N ATOM 1912 CA HIS A 117 -14.149 1.700 -7.006 1.00 71.42 C ATOM 1913 C HIS A 117 -14.973 1.617 -8.304 1.00 74.14 C ATOM 1914 O HIS A 117 -16.188 1.413 -8.265 1.00 43.40 O ATOM 1915 CB HIS A 117 -13.940 3.164 -6.601 1.00 4.12 C ATOM 1916 CG HIS A 117 -15.216 3.917 -6.379 1.00 42.34 C ATOM 1917 ND1 HIS A 117 -15.659 4.915 -7.215 1.00 32.11 N ATOM 1918 CD2 HIS A 117 -16.147 3.811 -5.401 1.00 72.20 C ATOM 1919 CE1 HIS A 117 -16.801 5.389 -6.768 1.00 21.33 C ATOM 1920 NE2 HIS A 117 -17.122 4.737 -5.669 1.00 72.00 N ATOM 0 H HIS A 117 -12.049 1.649 -7.035 1.00 61.42 H new ATOM 0 HA HIS A 117 -14.708 1.187 -6.223 1.00 71.42 H new ATOM 0 HB2 HIS A 117 -13.345 3.198 -5.688 1.00 4.12 H new ATOM 0 HB3 HIS A 117 -13.362 3.667 -7.376 1.00 4.12 H new ATOM 0 HD2 HIS A 117 -16.125 3.126 -4.567 1.00 72.20 H new ATOM 0 HE1 HIS A 117 -17.378 6.179 -7.225 1.00 21.33 H new ATOM 0 HE2 HIS A 117 -17.960 4.895 -5.109 1.00 72.00 H new ATOM 1929 N ASP A 118 -14.303 1.770 -9.444 1.00 3.30 N ATOM 1930 CA ASP A 118 -14.964 1.681 -10.750 1.00 73.31 C ATOM 1931 C ASP A 118 -15.523 0.268 -10.989 1.00 22.22 C ATOM 1932 O ASP A 118 -16.660 0.105 -11.434 1.00 62.21 O ATOM 1933 CB ASP A 118 -13.983 2.059 -11.866 1.00 44.31 C ATOM 1934 CG ASP A 118 -14.670 2.172 -13.214 1.00 51.13 C ATOM 1935 OD1 ASP A 118 -15.250 3.243 -13.495 1.00 31.11 O ATOM 1936 OD2 ASP A 118 -14.649 1.193 -13.989 1.00 60.14 O ATOM 0 H ASP A 118 -13.301 1.957 -9.493 1.00 3.30 H new ATOM 0 HA ASP A 118 -15.798 2.382 -10.758 1.00 73.31 H new ATOM 0 HB2 ASP A 118 -13.505 3.008 -11.622 1.00 44.31 H new ATOM 0 HB3 ASP A 118 -13.193 1.310 -11.923 1.00 44.31 H new ATOM 1941 N LEU A 119 -14.714 -0.746 -10.682 1.00 64.32 N ATOM 1942 CA LEU A 119 -15.142 -2.149 -10.769 1.00 43.22 C ATOM 1943 C LEU A 119 -16.455 -2.371 -9.997 1.00 51.02 C ATOM 1944 O LEU A 119 -17.350 -3.090 -10.454 1.00 34.43 O ATOM 1945 CB LEU A 119 -14.043 -3.064 -10.210 1.00 64.42 C ATOM 1946 CG LEU A 119 -12.667 -2.931 -10.891 1.00 63.12 C ATOM 1947 CD1 LEU A 119 -11.622 -3.786 -10.177 1.00 62.11 C ATOM 1948 CD2 LEU A 119 -12.756 -3.306 -12.368 1.00 44.41 C ATOM 0 H LEU A 119 -13.751 -0.624 -10.368 1.00 64.32 H new ATOM 0 HA LEU A 119 -15.317 -2.392 -11.817 1.00 43.22 H new ATOM 0 HB2 LEU A 119 -13.926 -2.856 -9.147 1.00 64.42 H new ATOM 0 HB3 LEU A 119 -14.375 -4.099 -10.297 1.00 64.42 H new ATOM 0 HG LEU A 119 -12.355 -1.889 -10.823 1.00 63.12 H new ATOM 0 HD11 LEU A 119 -10.659 -3.676 -10.676 1.00 62.11 H new ATOM 0 HD12 LEU A 119 -11.533 -3.461 -9.140 1.00 62.11 H new ATOM 0 HD13 LEU A 119 -11.927 -4.832 -10.205 1.00 62.11 H new ATOM 0 HD21 LEU A 119 -11.773 -3.205 -12.829 1.00 44.41 H new ATOM 0 HD22 LEU A 119 -13.096 -4.337 -12.462 1.00 44.41 H new ATOM 0 HD23 LEU A 119 -13.462 -2.644 -12.870 1.00 44.41 H new ATOM 1960 N ASN A 120 -16.558 -1.732 -8.829 1.00 41.24 N ATOM 1961 CA ASN A 120 -17.782 -1.763 -8.025 1.00 12.42 C ATOM 1962 C ASN A 120 -18.960 -1.137 -8.787 1.00 25.43 C ATOM 1963 O ASN A 120 -20.048 -1.708 -8.849 1.00 51.43 O ATOM 1964 CB ASN A 120 -17.553 -1.025 -6.696 1.00 0.23 C ATOM 1965 CG ASN A 120 -18.839 -0.795 -5.920 1.00 65.11 C ATOM 1966 OD1 ASN A 120 -19.254 -1.620 -5.112 1.00 24.13 O ATOM 1967 ND2 ASN A 120 -19.481 0.331 -6.160 1.00 43.21 N ATOM 0 H ASN A 120 -15.803 -1.184 -8.417 1.00 41.24 H new ATOM 0 HA ASN A 120 -18.031 -2.804 -7.818 1.00 12.42 H new ATOM 0 HB2 ASN A 120 -16.861 -1.600 -6.081 1.00 0.23 H new ATOM 0 HB3 ASN A 120 -17.078 -0.064 -6.896 1.00 0.23 H new ATOM 0 HD21 ASN A 120 -20.350 0.538 -5.668 1.00 43.21 H new ATOM 0 HD22 ASN A 120 -19.109 0.996 -6.838 1.00 43.21 H new ATOM 1974 N GLU A 121 -18.731 0.037 -9.376 1.00 22.23 N ATOM 1975 CA GLU A 121 -19.773 0.746 -10.132 1.00 21.30 C ATOM 1976 C GLU A 121 -20.172 -0.034 -11.398 1.00 42.41 C ATOM 1977 O GLU A 121 -21.307 0.062 -11.875 1.00 35.05 O ATOM 1978 CB GLU A 121 -19.293 2.161 -10.493 1.00 64.25 C ATOM 1979 CG GLU A 121 -18.812 2.959 -9.283 1.00 24.02 C ATOM 1980 CD GLU A 121 -18.522 4.421 -9.597 1.00 43.13 C ATOM 1981 OE1 GLU A 121 -17.375 4.739 -9.980 1.00 44.43 O ATOM 1982 OE2 GLU A 121 -19.433 5.264 -9.440 1.00 61.35 O ATOM 0 H GLU A 121 -17.833 0.520 -9.346 1.00 22.23 H new ATOM 0 HA GLU A 121 -20.658 0.826 -9.501 1.00 21.30 H new ATOM 0 HB2 GLU A 121 -18.483 2.089 -11.218 1.00 64.25 H new ATOM 0 HB3 GLU A 121 -20.107 2.702 -10.977 1.00 64.25 H new ATOM 0 HG2 GLU A 121 -19.568 2.907 -8.499 1.00 24.02 H new ATOM 0 HG3 GLU A 121 -17.909 2.494 -8.887 1.00 24.02 H new ATOM 1989 N CYS A 122 -19.230 -0.818 -11.923 1.00 2.35 N ATOM 1990 CA CYS A 122 -19.486 -1.711 -13.064 1.00 1.03 C ATOM 1991 C CYS A 122 -20.068 -3.060 -12.593 1.00 41.32 C ATOM 1992 O CYS A 122 -20.214 -3.998 -13.381 1.00 71.34 O ATOM 1993 CB CYS A 122 -18.189 -1.944 -13.853 1.00 73.44 C ATOM 1994 SG CYS A 122 -17.440 -0.431 -14.502 1.00 21.24 S ATOM 0 H CYS A 122 -18.272 -0.855 -11.575 1.00 2.35 H new ATOM 0 HA CYS A 122 -20.219 -1.232 -13.713 1.00 1.03 H new ATOM 0 HB2 CYS A 122 -17.468 -2.446 -13.207 1.00 73.44 H new ATOM 0 HB3 CYS A 122 -18.397 -2.619 -14.683 1.00 73.44 H new ATOM 0 HG CYS A 122 -16.911 0.245 -13.526 1.00 21.24 H new ATOM 2000 N SER A 123 -20.372 -3.146 -11.292 1.00 73.22 N ATOM 2001 CA SER A 123 -21.017 -4.329 -10.690 1.00 2.44 C ATOM 2002 C SER A 123 -20.176 -5.606 -10.845 1.00 15.21 C ATOM 2003 O SER A 123 -20.693 -6.714 -10.677 1.00 72.21 O ATOM 2004 CB SER A 123 -22.409 -4.557 -11.304 1.00 53.50 C ATOM 2005 OG SER A 123 -23.250 -3.422 -11.141 1.00 21.21 O ATOM 0 H SER A 123 -20.180 -2.400 -10.624 1.00 73.22 H new ATOM 0 HA SER A 123 -21.110 -4.121 -9.624 1.00 2.44 H new ATOM 0 HB2 SER A 123 -22.306 -4.783 -12.365 1.00 53.50 H new ATOM 0 HB3 SER A 123 -22.875 -5.425 -10.837 1.00 53.50 H new ATOM 0 HG SER A 123 -24.125 -3.602 -11.544 1.00 21.21 H new ATOM 2011 N TRP A 124 -18.881 -5.453 -11.146 1.00 71.40 N ATOM 2012 CA TRP A 124 -17.985 -6.602 -11.376 1.00 20.02 C ATOM 2013 C TRP A 124 -18.530 -7.555 -12.455 1.00 5.24 C ATOM 2014 O TRP A 124 -18.176 -8.734 -12.496 1.00 34.33 O ATOM 2015 CB TRP A 124 -17.744 -7.369 -10.063 1.00 71.02 C ATOM 2016 CG TRP A 124 -16.826 -6.660 -9.110 1.00 1.14 C ATOM 2017 CD1 TRP A 124 -17.167 -5.730 -8.168 1.00 42.42 C ATOM 2018 CD2 TRP A 124 -15.409 -6.835 -9.006 1.00 73.03 C ATOM 2019 NE1 TRP A 124 -16.046 -5.319 -7.486 1.00 52.40 N ATOM 2020 CE2 TRP A 124 -14.955 -5.984 -7.982 1.00 31.11 C ATOM 2021 CE3 TRP A 124 -14.480 -7.636 -9.677 1.00 52.41 C ATOM 2022 CZ2 TRP A 124 -13.614 -5.905 -7.619 1.00 32.10 C ATOM 2023 CZ3 TRP A 124 -13.148 -7.557 -9.318 1.00 23.34 C ATOM 2024 CH2 TRP A 124 -12.726 -6.699 -8.294 1.00 42.52 C ATOM 0 H TRP A 124 -18.426 -4.545 -11.237 1.00 71.40 H new ATOM 0 HA TRP A 124 -17.037 -6.204 -11.738 1.00 20.02 H new ATOM 0 HB2 TRP A 124 -18.702 -7.540 -9.572 1.00 71.02 H new ATOM 0 HB3 TRP A 124 -17.326 -8.348 -10.296 1.00 71.02 H new ATOM 0 HD1 TRP A 124 -18.169 -5.371 -7.986 1.00 42.42 H new ATOM 0 HE1 TRP A 124 -16.029 -4.631 -6.733 1.00 52.40 H new ATOM 0 HE3 TRP A 124 -14.798 -8.305 -10.463 1.00 52.41 H new ATOM 0 HZ2 TRP A 124 -13.285 -5.241 -6.833 1.00 32.10 H new ATOM 0 HZ3 TRP A 124 -12.421 -8.166 -9.835 1.00 23.34 H new ATOM 0 HH2 TRP A 124 -11.679 -6.663 -8.032 1.00 42.52 H new ATOM 2035 N SER A 125 -19.369 -7.029 -13.345 1.00 12.34 N ATOM 2036 CA SER A 125 -20.014 -7.849 -14.382 1.00 4.22 C ATOM 2037 C SER A 125 -19.000 -8.459 -15.360 1.00 51.41 C ATOM 2038 O SER A 125 -18.191 -7.750 -15.963 1.00 63.41 O ATOM 2039 CB SER A 125 -21.035 -7.021 -15.172 1.00 64.51 C ATOM 2040 OG SER A 125 -21.628 -7.795 -16.204 1.00 1.42 O ATOM 0 H SER A 125 -19.621 -6.041 -13.373 1.00 12.34 H new ATOM 0 HA SER A 125 -20.518 -8.663 -13.862 1.00 4.22 H new ATOM 0 HB2 SER A 125 -21.809 -6.652 -14.499 1.00 64.51 H new ATOM 0 HB3 SER A 125 -20.545 -6.148 -15.603 1.00 64.51 H new ATOM 0 HG SER A 125 -22.277 -7.246 -16.693 1.00 1.42 H new ATOM 2046 N LEU A 126 -19.065 -9.781 -15.526 1.00 12.15 N ATOM 2047 CA LEU A 126 -18.208 -10.493 -16.486 1.00 12.11 C ATOM 2048 C LEU A 126 -18.430 -9.976 -17.917 1.00 1.12 C ATOM 2049 O LEU A 126 -17.530 -10.038 -18.754 1.00 32.13 O ATOM 2050 CB LEU A 126 -18.462 -12.016 -16.427 1.00 74.32 C ATOM 2051 CG LEU A 126 -17.870 -12.759 -15.210 1.00 12.51 C ATOM 2052 CD1 LEU A 126 -16.346 -12.667 -15.203 1.00 12.13 C ATOM 2053 CD2 LEU A 126 -18.458 -12.230 -13.899 1.00 12.21 C ATOM 0 H LEU A 126 -19.703 -10.385 -15.008 1.00 12.15 H new ATOM 0 HA LEU A 126 -17.172 -10.301 -16.207 1.00 12.11 H new ATOM 0 HB2 LEU A 126 -19.539 -12.185 -16.441 1.00 74.32 H new ATOM 0 HB3 LEU A 126 -18.057 -12.466 -17.333 1.00 74.32 H new ATOM 0 HG LEU A 126 -18.144 -13.811 -15.296 1.00 12.51 H new ATOM 0 HD11 LEU A 126 -15.953 -13.198 -14.336 1.00 12.13 H new ATOM 0 HD12 LEU A 126 -15.950 -13.116 -16.114 1.00 12.13 H new ATOM 0 HD13 LEU A 126 -16.045 -11.621 -15.154 1.00 12.13 H new ATOM 0 HD21 LEU A 126 -18.022 -12.772 -13.060 1.00 12.21 H new ATOM 0 HD22 LEU A 126 -18.232 -11.168 -13.801 1.00 12.21 H new ATOM 0 HD23 LEU A 126 -19.539 -12.373 -13.901 1.00 12.21 H new ATOM 2065 N ASN A 127 -19.628 -9.450 -18.178 1.00 14.22 N ATOM 2066 CA ASN A 127 -19.964 -8.873 -19.488 1.00 52.55 C ATOM 2067 C ASN A 127 -19.092 -7.646 -19.799 1.00 22.43 C ATOM 2068 O ASN A 127 -18.854 -7.312 -20.959 1.00 63.03 O ATOM 2069 CB ASN A 127 -21.438 -8.453 -19.515 1.00 3.33 C ATOM 2070 CG ASN A 127 -22.384 -9.593 -19.185 1.00 14.51 C ATOM 2071 OD1 ASN A 127 -22.123 -10.751 -19.494 1.00 72.02 O ATOM 2072 ND2 ASN A 127 -23.490 -9.276 -18.541 1.00 23.42 N ATOM 0 H ASN A 127 -20.387 -9.410 -17.498 1.00 14.22 H new ATOM 0 HA ASN A 127 -19.778 -9.637 -20.242 1.00 52.55 H new ATOM 0 HB2 ASN A 127 -21.592 -7.642 -18.803 1.00 3.33 H new ATOM 0 HB3 ASN A 127 -21.681 -8.061 -20.503 1.00 3.33 H new ATOM 0 HD21 ASN A 127 -24.158 -10.004 -18.285 1.00 23.42 H new ATOM 0 HD22 ASN A 127 -23.678 -8.303 -18.298 1.00 23.42 H new ATOM 2079 N ILE A 128 -18.636 -6.973 -18.745 1.00 74.11 N ATOM 2080 CA ILE A 128 -17.825 -5.759 -18.878 1.00 63.34 C ATOM 2081 C ILE A 128 -16.326 -6.062 -18.716 1.00 41.23 C ATOM 2082 O ILE A 128 -15.498 -5.609 -19.511 1.00 72.14 O ATOM 2083 CB ILE A 128 -18.254 -4.708 -17.821 1.00 35.12 C ATOM 2084 CG1 ILE A 128 -19.765 -4.427 -17.937 1.00 60.41 C ATOM 2085 CG2 ILE A 128 -17.443 -3.420 -17.974 1.00 12.15 C ATOM 2086 CD1 ILE A 128 -20.314 -3.508 -16.862 1.00 53.41 C ATOM 0 H ILE A 128 -18.815 -7.249 -17.780 1.00 74.11 H new ATOM 0 HA ILE A 128 -17.990 -5.362 -19.880 1.00 63.34 H new ATOM 0 HB ILE A 128 -18.053 -5.110 -16.828 1.00 35.12 H new ATOM 0 HG12 ILE A 128 -19.967 -3.986 -18.913 1.00 60.41 H new ATOM 0 HG13 ILE A 128 -20.303 -5.374 -17.898 1.00 60.41 H new ATOM 0 HG21 ILE A 128 -17.762 -2.698 -17.222 1.00 12.15 H new ATOM 0 HG22 ILE A 128 -16.384 -3.639 -17.841 1.00 12.15 H new ATOM 0 HG23 ILE A 128 -17.605 -3.004 -18.968 1.00 12.15 H new ATOM 0 HD11 ILE A 128 -21.383 -3.363 -17.018 1.00 53.41 H new ATOM 0 HD12 ILE A 128 -20.148 -3.955 -15.882 1.00 53.41 H new ATOM 0 HD13 ILE A 128 -19.806 -2.545 -16.913 1.00 53.41 H new ATOM 2098 N LEU A 129 -15.988 -6.836 -17.683 1.00 61.24 N ATOM 2099 CA LEU A 129 -14.586 -7.139 -17.357 1.00 32.02 C ATOM 2100 C LEU A 129 -14.000 -8.243 -18.256 1.00 40.13 C ATOM 2101 O LEU A 129 -13.029 -8.015 -18.976 1.00 21.41 O ATOM 2102 CB LEU A 129 -14.466 -7.550 -15.883 1.00 54.10 C ATOM 2103 CG LEU A 129 -14.972 -6.516 -14.862 1.00 3.31 C ATOM 2104 CD1 LEU A 129 -14.818 -7.045 -13.438 1.00 21.14 C ATOM 2105 CD2 LEU A 129 -14.239 -5.185 -15.029 1.00 44.40 C ATOM 0 H LEU A 129 -16.665 -7.267 -17.054 1.00 61.24 H new ATOM 0 HA LEU A 129 -14.010 -6.231 -17.537 1.00 32.02 H new ATOM 0 HB2 LEU A 129 -15.018 -8.479 -15.737 1.00 54.10 H new ATOM 0 HB3 LEU A 129 -13.419 -7.764 -15.668 1.00 54.10 H new ATOM 0 HG LEU A 129 -16.032 -6.344 -15.048 1.00 3.31 H new ATOM 0 HD11 LEU A 129 -15.181 -6.299 -12.731 1.00 21.14 H new ATOM 0 HD12 LEU A 129 -15.396 -7.962 -13.326 1.00 21.14 H new ATOM 0 HD13 LEU A 129 -13.767 -7.252 -13.238 1.00 21.14 H new ATOM 0 HD21 LEU A 129 -14.613 -4.469 -14.297 1.00 44.40 H new ATOM 0 HD22 LEU A 129 -13.171 -5.336 -14.876 1.00 44.40 H new ATOM 0 HD23 LEU A 129 -14.410 -4.799 -16.034 1.00 44.40 H new ATOM 2117 N ALA A 130 -14.589 -9.440 -18.206 1.00 70.31 N ATOM 2118 CA ALA A 130 -14.092 -10.576 -18.998 1.00 0.34 C ATOM 2119 C ALA A 130 -14.347 -10.367 -20.498 1.00 62.12 C ATOM 2120 O ALA A 130 -13.444 -10.514 -21.324 1.00 23.54 O ATOM 2121 CB ALA A 130 -14.745 -11.869 -18.524 1.00 22.31 C ATOM 0 H ALA A 130 -15.405 -9.651 -17.631 1.00 70.31 H new ATOM 0 HA ALA A 130 -13.014 -10.645 -18.851 1.00 0.34 H new ATOM 0 HB1 ALA A 130 -14.371 -12.704 -19.116 1.00 22.31 H new ATOM 0 HB2 ALA A 130 -14.506 -12.033 -17.473 1.00 22.31 H new ATOM 0 HB3 ALA A 130 -15.826 -11.796 -18.643 1.00 22.31 H new ATOM 2127 N ILE A 131 -15.583 -10.020 -20.842 1.00 62.20 N ATOM 2128 CA ILE A 131 -15.946 -9.695 -22.223 1.00 64.53 C ATOM 2129 C ILE A 131 -15.670 -8.203 -22.498 1.00 14.34 C ATOM 2130 O ILE A 131 -16.563 -7.435 -22.872 1.00 12.11 O ATOM 2131 CB ILE A 131 -17.439 -10.030 -22.501 1.00 20.03 C ATOM 2132 CG1 ILE A 131 -17.769 -11.449 -22.000 1.00 71.11 C ATOM 2133 CG2 ILE A 131 -17.756 -9.905 -23.995 1.00 24.04 C ATOM 2134 CD1 ILE A 131 -19.225 -11.837 -22.157 1.00 0.42 C ATOM 0 H ILE A 131 -16.357 -9.955 -20.181 1.00 62.20 H new ATOM 0 HA ILE A 131 -15.336 -10.301 -22.893 1.00 64.53 H new ATOM 0 HB ILE A 131 -18.058 -9.314 -21.960 1.00 20.03 H new ATOM 0 HG12 ILE A 131 -17.152 -12.166 -22.541 1.00 71.11 H new ATOM 0 HG13 ILE A 131 -17.496 -11.524 -20.948 1.00 71.11 H new ATOM 0 HG21 ILE A 131 -18.806 -10.144 -24.165 1.00 24.04 H new ATOM 0 HG22 ILE A 131 -17.558 -8.885 -24.325 1.00 24.04 H new ATOM 0 HG23 ILE A 131 -17.130 -10.597 -24.559 1.00 24.04 H new ATOM 0 HD11 ILE A 131 -19.374 -12.849 -21.781 1.00 0.42 H new ATOM 0 HD12 ILE A 131 -19.849 -11.144 -21.592 1.00 0.42 H new ATOM 0 HD13 ILE A 131 -19.501 -11.797 -23.211 1.00 0.42 H new ATOM 2146 N ASN A 132 -14.422 -7.794 -22.286 1.00 14.22 N ATOM 2147 CA ASN A 132 -14.030 -6.395 -22.459 1.00 55.11 C ATOM 2148 C ASN A 132 -13.795 -6.070 -23.939 1.00 2.51 C ATOM 2149 O ASN A 132 -12.768 -6.439 -24.516 1.00 62.44 O ATOM 2150 CB ASN A 132 -12.775 -6.088 -21.632 1.00 13.24 C ATOM 2151 CG ASN A 132 -12.499 -4.600 -21.538 1.00 71.41 C ATOM 2152 OD1 ASN A 132 -11.799 -4.032 -22.368 1.00 5.32 O ATOM 2153 ND2 ASN A 132 -13.055 -3.952 -20.533 1.00 21.12 N ATOM 0 H ASN A 132 -13.663 -8.410 -21.994 1.00 14.22 H new ATOM 0 HA ASN A 132 -14.845 -5.765 -22.102 1.00 55.11 H new ATOM 0 HB2 ASN A 132 -12.894 -6.497 -20.629 1.00 13.24 H new ATOM 0 HB3 ASN A 132 -11.916 -6.587 -22.080 1.00 13.24 H new ATOM 0 HD21 ASN A 132 -12.908 -2.948 -20.430 1.00 21.12 H new ATOM 0 HD22 ASN A 132 -13.632 -4.455 -19.859 1.00 21.12 H new ATOM 2160 N LYS A 133 -14.763 -5.386 -24.548 1.00 4.43 N ATOM 2161 CA LYS A 133 -14.692 -5.033 -25.968 1.00 45.04 C ATOM 2162 C LYS A 133 -13.607 -3.974 -26.230 1.00 24.12 C ATOM 2163 O LYS A 133 -13.513 -2.979 -25.507 1.00 41.11 O ATOM 2164 CB LYS A 133 -16.060 -4.534 -26.458 1.00 15.23 C ATOM 2165 CG LYS A 133 -17.172 -5.566 -26.292 1.00 34.13 C ATOM 2166 CD LYS A 133 -18.487 -5.091 -26.900 1.00 40.14 C ATOM 2167 CE LYS A 133 -19.579 -6.148 -26.775 1.00 31.32 C ATOM 2168 NZ LYS A 133 -20.820 -5.755 -27.492 1.00 72.21 N ATOM 0 H LYS A 133 -15.609 -5.064 -24.079 1.00 4.43 H new ATOM 0 HA LYS A 133 -14.421 -5.929 -26.525 1.00 45.04 H new ATOM 0 HB2 LYS A 133 -16.327 -3.630 -25.910 1.00 15.23 H new ATOM 0 HB3 LYS A 133 -15.983 -4.258 -27.510 1.00 15.23 H new ATOM 0 HG2 LYS A 133 -16.872 -6.502 -26.763 1.00 34.13 H new ATOM 0 HG3 LYS A 133 -17.317 -5.775 -25.232 1.00 34.13 H new ATOM 0 HD2 LYS A 133 -18.808 -4.175 -26.403 1.00 40.14 H new ATOM 0 HD3 LYS A 133 -18.335 -4.847 -27.951 1.00 40.14 H new ATOM 0 HE2 LYS A 133 -19.214 -7.095 -27.174 1.00 31.32 H new ATOM 0 HE3 LYS A 133 -19.806 -6.312 -25.722 1.00 31.32 H new ATOM 0 HZ1 LYS A 133 -21.536 -6.501 -27.381 1.00 72.21 H new ATOM 0 HZ2 LYS A 133 -21.183 -4.865 -27.095 1.00 72.21 H new ATOM 0 HZ3 LYS A 133 -20.610 -5.623 -28.502 1.00 72.21 H new ATOM 2182 N PRO A 134 -12.776 -4.178 -27.274 1.00 13.52 N ATOM 2183 CA PRO A 134 -11.642 -3.285 -27.586 1.00 33.40 C ATOM 2184 C PRO A 134 -12.041 -1.810 -27.767 1.00 73.35 C ATOM 2185 O PRO A 134 -12.668 -1.434 -28.762 1.00 62.02 O ATOM 2186 CB PRO A 134 -11.089 -3.857 -28.902 1.00 64.15 C ATOM 2187 CG PRO A 134 -11.523 -5.283 -28.906 1.00 44.33 C ATOM 2188 CD PRO A 134 -12.868 -5.300 -28.231 1.00 63.45 C ATOM 0 HA PRO A 134 -10.924 -3.266 -26.766 1.00 33.40 H new ATOM 0 HB2 PRO A 134 -11.484 -3.320 -29.764 1.00 64.15 H new ATOM 0 HB3 PRO A 134 -10.003 -3.773 -28.945 1.00 64.15 H new ATOM 0 HG2 PRO A 134 -11.590 -5.669 -29.923 1.00 44.33 H new ATOM 0 HG3 PRO A 134 -10.809 -5.911 -28.373 1.00 44.33 H new ATOM 0 HD2 PRO A 134 -13.679 -5.156 -28.945 1.00 63.45 H new ATOM 0 HD3 PRO A 134 -13.053 -6.247 -27.725 1.00 63.45 H new ATOM 2196 N GLN A 135 -11.692 -0.985 -26.783 1.00 72.20 N ATOM 2197 CA GLN A 135 -11.878 0.468 -26.875 1.00 41.34 C ATOM 2198 C GLN A 135 -10.537 1.168 -27.159 1.00 41.24 C ATOM 2199 O GLN A 135 -9.489 0.520 -27.232 1.00 23.35 O ATOM 2200 CB GLN A 135 -12.489 1.010 -25.571 1.00 63.01 C ATOM 2201 CG GLN A 135 -13.872 0.448 -25.244 1.00 61.03 C ATOM 2202 CD GLN A 135 -14.923 0.818 -26.279 1.00 64.13 C ATOM 2203 OE1 GLN A 135 -14.850 1.870 -26.911 1.00 3.21 O ATOM 2204 NE2 GLN A 135 -15.912 -0.032 -26.456 1.00 55.33 N ATOM 0 H GLN A 135 -11.276 -1.297 -25.906 1.00 72.20 H new ATOM 0 HA GLN A 135 -12.560 0.676 -27.699 1.00 41.34 H new ATOM 0 HB2 GLN A 135 -11.814 0.785 -24.746 1.00 63.01 H new ATOM 0 HB3 GLN A 135 -12.558 2.096 -25.639 1.00 63.01 H new ATOM 0 HG2 GLN A 135 -13.809 -0.638 -25.170 1.00 61.03 H new ATOM 0 HG3 GLN A 135 -14.186 0.816 -24.267 1.00 61.03 H new ATOM 0 HE21 GLN A 135 -15.944 -0.897 -25.916 1.00 55.33 H new ATOM 0 HE22 GLN A 135 -16.646 0.174 -27.133 1.00 55.33 H new ATOM 2213 N ASN A 136 -10.569 2.492 -27.317 1.00 3.12 N ATOM 2214 CA ASN A 136 -9.343 3.277 -27.549 1.00 22.31 C ATOM 2215 C ASN A 136 -8.523 3.462 -26.256 1.00 71.50 C ATOM 2216 O ASN A 136 -7.389 3.945 -26.294 1.00 55.00 O ATOM 2217 CB ASN A 136 -9.684 4.646 -28.158 1.00 12.31 C ATOM 2218 CG ASN A 136 -10.699 5.415 -27.335 1.00 5.31 C ATOM 2219 OD1 ASN A 136 -10.350 6.135 -26.407 1.00 63.41 O ATOM 2220 ND2 ASN A 136 -11.965 5.277 -27.669 1.00 4.45 N ATOM 0 H ASN A 136 -11.424 3.047 -27.290 1.00 3.12 H new ATOM 0 HA ASN A 136 -8.730 2.715 -28.253 1.00 22.31 H new ATOM 0 HB2 ASN A 136 -8.772 5.237 -28.248 1.00 12.31 H new ATOM 0 HB3 ASN A 136 -10.072 4.504 -29.167 1.00 12.31 H new ATOM 0 HD21 ASN A 136 -12.687 5.777 -27.150 1.00 4.45 H new ATOM 0 HD22 ASN A 136 -12.224 4.670 -28.447 1.00 4.45 H new ATOM 2227 N LYS A 137 -9.095 3.072 -25.118 1.00 52.25 N ATOM 2228 CA LYS A 137 -8.413 3.202 -23.820 1.00 21.32 C ATOM 2229 C LYS A 137 -7.589 1.949 -23.482 1.00 54.44 C ATOM 2230 O LYS A 137 -7.469 1.022 -24.285 1.00 53.24 O ATOM 2231 CB LYS A 137 -9.421 3.437 -22.682 1.00 74.14 C ATOM 2232 CG LYS A 137 -10.266 4.702 -22.804 1.00 22.24 C ATOM 2233 CD LYS A 137 -11.419 4.541 -23.790 1.00 70.35 C ATOM 2234 CE LYS A 137 -12.433 5.666 -23.646 1.00 35.41 C ATOM 2235 NZ LYS A 137 -13.086 5.654 -22.308 1.00 20.40 N ATOM 0 H LYS A 137 -10.028 2.663 -25.063 1.00 52.25 H new ATOM 0 HA LYS A 137 -7.747 4.060 -23.909 1.00 21.32 H new ATOM 0 HB2 LYS A 137 -10.090 2.578 -22.629 1.00 74.14 H new ATOM 0 HB3 LYS A 137 -8.876 3.475 -21.739 1.00 74.14 H new ATOM 0 HG2 LYS A 137 -10.664 4.965 -21.824 1.00 22.24 H new ATOM 0 HG3 LYS A 137 -9.632 5.529 -23.123 1.00 22.24 H new ATOM 0 HD2 LYS A 137 -11.030 4.528 -24.808 1.00 70.35 H new ATOM 0 HD3 LYS A 137 -11.911 3.582 -23.624 1.00 70.35 H new ATOM 0 HE2 LYS A 137 -11.937 6.624 -23.800 1.00 35.41 H new ATOM 0 HE3 LYS A 137 -13.193 5.572 -24.422 1.00 35.41 H new ATOM 0 HZ1 LYS A 137 -14.002 6.143 -22.364 1.00 20.40 H new ATOM 0 HZ2 LYS A 137 -13.236 4.671 -22.004 1.00 20.40 H new ATOM 0 HZ3 LYS A 137 -12.476 6.140 -21.620 1.00 20.40 H new ATOM 2249 N CYS A 138 -7.021 1.944 -22.278 1.00 71.55 N ATOM 2250 CA CYS A 138 -6.353 0.760 -21.725 1.00 63.40 C ATOM 2251 C CYS A 138 -7.201 0.153 -20.595 1.00 3.34 C ATOM 2252 O CYS A 138 -8.057 0.828 -20.022 1.00 33.15 O ATOM 2253 CB CYS A 138 -4.960 1.130 -21.204 1.00 34.11 C ATOM 2254 SG CYS A 138 -4.964 2.438 -19.956 1.00 32.12 S ATOM 0 H CYS A 138 -7.009 2.754 -21.658 1.00 71.55 H new ATOM 0 HA CYS A 138 -6.242 0.019 -22.517 1.00 63.40 H new ATOM 0 HB2 CYS A 138 -4.494 0.240 -20.781 1.00 34.11 H new ATOM 0 HB3 CYS A 138 -4.341 1.446 -22.044 1.00 34.11 H new ATOM 0 HG CYS A 138 -4.449 1.986 -18.852 1.00 32.12 H new ATOM 2260 N ASP A 139 -6.970 -1.116 -20.277 1.00 70.42 N ATOM 2261 CA ASP A 139 -7.799 -1.833 -19.302 1.00 30.04 C ATOM 2262 C ASP A 139 -7.492 -1.399 -17.850 1.00 52.14 C ATOM 2263 O ASP A 139 -6.346 -1.458 -17.397 1.00 21.24 O ATOM 2264 CB ASP A 139 -7.588 -3.341 -19.467 1.00 71.32 C ATOM 2265 CG ASP A 139 -8.666 -4.160 -18.782 1.00 14.22 C ATOM 2266 OD1 ASP A 139 -8.496 -4.504 -17.597 1.00 73.45 O ATOM 2267 OD2 ASP A 139 -9.682 -4.479 -19.435 1.00 2.55 O ATOM 0 H ASP A 139 -6.216 -1.674 -20.678 1.00 70.42 H new ATOM 0 HA ASP A 139 -8.842 -1.584 -19.495 1.00 30.04 H new ATOM 0 HB2 ASP A 139 -7.569 -3.587 -20.529 1.00 71.32 H new ATOM 0 HB3 ASP A 139 -6.615 -3.615 -19.059 1.00 71.32 H new ATOM 2272 N ASP A 140 -8.528 -0.969 -17.127 1.00 43.32 N ATOM 2273 CA ASP A 140 -8.376 -0.498 -15.740 1.00 32.32 C ATOM 2274 C ASP A 140 -8.124 -1.655 -14.749 1.00 33.23 C ATOM 2275 O ASP A 140 -7.299 -1.532 -13.840 1.00 33.55 O ATOM 2276 CB ASP A 140 -9.606 0.318 -15.322 1.00 34.22 C ATOM 2277 CG ASP A 140 -10.913 -0.359 -15.704 1.00 72.24 C ATOM 2278 OD1 ASP A 140 -11.387 -1.225 -14.946 1.00 63.34 O ATOM 2279 OD2 ASP A 140 -11.465 -0.025 -16.774 1.00 11.41 O ATOM 0 H ASP A 140 -9.486 -0.935 -17.476 1.00 43.32 H new ATOM 0 HA ASP A 140 -7.494 0.141 -15.707 1.00 32.32 H new ATOM 0 HB2 ASP A 140 -9.584 0.475 -14.244 1.00 34.22 H new ATOM 0 HB3 ASP A 140 -9.561 1.302 -15.789 1.00 34.22 H new ATOM 2284 N LEU A 141 -8.830 -2.770 -14.925 1.00 3.11 N ATOM 2285 CA LEU A 141 -8.639 -3.956 -14.074 1.00 65.23 C ATOM 2286 C LEU A 141 -7.193 -4.480 -14.161 1.00 50.32 C ATOM 2287 O LEU A 141 -6.539 -4.719 -13.142 1.00 20.11 O ATOM 2288 CB LEU A 141 -9.631 -5.057 -14.482 1.00 40.24 C ATOM 2289 CG LEU A 141 -9.523 -6.378 -13.698 1.00 23.42 C ATOM 2290 CD1 LEU A 141 -9.755 -6.153 -12.206 1.00 22.15 C ATOM 2291 CD2 LEU A 141 -10.506 -7.410 -14.246 1.00 62.23 C ATOM 0 H LEU A 141 -9.541 -2.883 -15.648 1.00 3.11 H new ATOM 0 HA LEU A 141 -8.827 -3.668 -13.040 1.00 65.23 H new ATOM 0 HB2 LEU A 141 -10.643 -4.669 -14.367 1.00 40.24 H new ATOM 0 HB3 LEU A 141 -9.491 -5.272 -15.541 1.00 40.24 H new ATOM 0 HG LEU A 141 -8.511 -6.763 -13.826 1.00 23.42 H new ATOM 0 HD11 LEU A 141 -9.673 -7.103 -11.678 1.00 22.15 H new ATOM 0 HD12 LEU A 141 -9.008 -5.458 -11.822 1.00 22.15 H new ATOM 0 HD13 LEU A 141 -10.750 -5.737 -12.051 1.00 22.15 H new ATOM 0 HD21 LEU A 141 -10.415 -8.336 -13.679 1.00 62.23 H new ATOM 0 HD22 LEU A 141 -11.523 -7.028 -14.155 1.00 62.23 H new ATOM 0 HD23 LEU A 141 -10.283 -7.603 -15.295 1.00 62.23 H new ATOM 2303 N ASP A 142 -6.696 -4.641 -15.387 1.00 53.22 N ATOM 2304 CA ASP A 142 -5.313 -5.068 -15.623 1.00 20.32 C ATOM 2305 C ASP A 142 -4.319 -4.029 -15.068 1.00 34.21 C ATOM 2306 O ASP A 142 -3.228 -4.372 -14.600 1.00 75.34 O ATOM 2307 CB ASP A 142 -5.091 -5.281 -17.127 1.00 55.32 C ATOM 2308 CG ASP A 142 -3.699 -5.797 -17.447 1.00 51.31 C ATOM 2309 OD1 ASP A 142 -3.415 -6.978 -17.152 1.00 23.24 O ATOM 2310 OD2 ASP A 142 -2.885 -5.029 -17.998 1.00 24.41 O ATOM 0 H ASP A 142 -7.233 -4.481 -16.239 1.00 53.22 H new ATOM 0 HA ASP A 142 -5.138 -6.009 -15.101 1.00 20.32 H new ATOM 0 HB2 ASP A 142 -5.831 -5.987 -17.503 1.00 55.32 H new ATOM 0 HB3 ASP A 142 -5.254 -4.339 -17.651 1.00 55.32 H new ATOM 2315 N ARG A 143 -4.723 -2.757 -15.121 1.00 1.53 N ATOM 2316 CA ARG A 143 -3.932 -1.654 -14.562 1.00 73.34 C ATOM 2317 C ARG A 143 -3.721 -1.834 -13.049 1.00 63.30 C ATOM 2318 O ARG A 143 -2.630 -1.597 -12.530 1.00 64.22 O ATOM 2319 CB ARG A 143 -4.635 -0.317 -14.838 1.00 62.04 C ATOM 2320 CG ARG A 143 -3.841 0.915 -14.417 1.00 34.14 C ATOM 2321 CD ARG A 143 -4.626 2.197 -14.677 1.00 60.43 C ATOM 2322 NE ARG A 143 -5.086 2.285 -16.065 1.00 11.54 N ATOM 2323 CZ ARG A 143 -6.150 2.940 -16.447 1.00 62.14 C ATOM 2324 NH1 ARG A 143 -6.870 3.592 -15.589 1.00 11.21 N ATOM 2325 NH2 ARG A 143 -6.488 2.946 -17.695 1.00 54.50 N ATOM 0 H ARG A 143 -5.601 -2.463 -15.549 1.00 1.53 H new ATOM 0 HA ARG A 143 -2.954 -1.657 -15.043 1.00 73.34 H new ATOM 0 HB2 ARG A 143 -4.850 -0.248 -15.904 1.00 62.04 H new ATOM 0 HB3 ARG A 143 -5.593 -0.311 -14.318 1.00 62.04 H new ATOM 0 HG2 ARG A 143 -3.594 0.846 -13.358 1.00 34.14 H new ATOM 0 HG3 ARG A 143 -2.898 0.947 -14.963 1.00 34.14 H new ATOM 0 HD2 ARG A 143 -5.485 2.239 -14.007 1.00 60.43 H new ATOM 0 HD3 ARG A 143 -4.000 3.059 -14.447 1.00 60.43 H new ATOM 0 HE ARG A 143 -4.540 1.804 -16.780 1.00 11.54 H new ATOM 0 HH11 ARG A 143 -6.608 3.598 -14.603 1.00 11.21 H new ATOM 0 HH12 ARG A 143 -7.698 4.100 -15.900 1.00 11.21 H new ATOM 0 HH21 ARG A 143 -5.925 2.440 -18.378 1.00 54.50 H new ATOM 0 HH22 ARG A 143 -7.318 3.456 -17.996 1.00 54.50 H new ATOM 2339 N PHE A 144 -4.771 -2.256 -12.346 1.00 51.53 N ATOM 2340 CA PHE A 144 -4.676 -2.516 -10.904 1.00 12.52 C ATOM 2341 C PHE A 144 -3.640 -3.615 -10.616 1.00 75.11 C ATOM 2342 O PHE A 144 -2.772 -3.463 -9.757 1.00 10.14 O ATOM 2343 CB PHE A 144 -6.049 -2.926 -10.338 1.00 22.43 C ATOM 2344 CG PHE A 144 -6.074 -3.061 -8.830 1.00 0.21 C ATOM 2345 CD1 PHE A 144 -5.652 -4.229 -8.209 1.00 43.34 C ATOM 2346 CD2 PHE A 144 -6.517 -2.013 -8.035 1.00 50.14 C ATOM 2347 CE1 PHE A 144 -5.668 -4.346 -6.832 1.00 2.34 C ATOM 2348 CE2 PHE A 144 -6.536 -2.128 -6.657 1.00 74.31 C ATOM 2349 CZ PHE A 144 -6.110 -3.295 -6.055 1.00 32.22 C ATOM 0 H PHE A 144 -5.694 -2.425 -12.746 1.00 51.53 H new ATOM 0 HA PHE A 144 -4.353 -1.597 -10.415 1.00 12.52 H new ATOM 0 HB2 PHE A 144 -6.791 -2.187 -10.639 1.00 22.43 H new ATOM 0 HB3 PHE A 144 -6.346 -3.876 -10.783 1.00 22.43 H new ATOM 0 HD1 PHE A 144 -5.307 -5.057 -8.810 1.00 43.34 H new ATOM 0 HD2 PHE A 144 -6.851 -1.096 -8.498 1.00 50.14 H new ATOM 0 HE1 PHE A 144 -5.334 -5.260 -6.364 1.00 2.34 H new ATOM 0 HE2 PHE A 144 -6.884 -1.304 -6.051 1.00 74.31 H new ATOM 0 HZ PHE A 144 -6.123 -3.385 -4.979 1.00 32.22 H new ATOM 2359 N VAL A 145 -3.732 -4.712 -11.362 1.00 44.41 N ATOM 2360 CA VAL A 145 -2.858 -5.874 -11.160 1.00 24.10 C ATOM 2361 C VAL A 145 -1.366 -5.540 -11.368 1.00 40.33 C ATOM 2362 O VAL A 145 -0.520 -5.923 -10.554 1.00 14.42 O ATOM 2363 CB VAL A 145 -3.254 -7.041 -12.099 1.00 34.41 C ATOM 2364 CG1 VAL A 145 -2.361 -8.258 -11.864 1.00 34.20 C ATOM 2365 CG2 VAL A 145 -4.727 -7.405 -11.911 1.00 63.53 C ATOM 0 H VAL A 145 -4.407 -4.825 -12.118 1.00 44.41 H new ATOM 0 HA VAL A 145 -2.995 -6.175 -10.121 1.00 24.10 H new ATOM 0 HB VAL A 145 -3.110 -6.713 -13.128 1.00 34.41 H new ATOM 0 HG11 VAL A 145 -2.659 -9.063 -12.535 1.00 34.20 H new ATOM 0 HG12 VAL A 145 -1.322 -7.990 -12.058 1.00 34.20 H new ATOM 0 HG13 VAL A 145 -2.463 -8.590 -10.831 1.00 34.20 H new ATOM 0 HG21 VAL A 145 -4.987 -8.226 -12.579 1.00 63.53 H new ATOM 0 HG22 VAL A 145 -4.898 -7.709 -10.878 1.00 63.53 H new ATOM 0 HG23 VAL A 145 -5.348 -6.539 -12.142 1.00 63.53 H new ATOM 2375 N MET A 146 -1.044 -4.826 -12.452 1.00 22.31 N ATOM 2376 CA MET A 146 0.358 -4.495 -12.761 1.00 11.33 C ATOM 2377 C MET A 146 1.006 -3.649 -11.651 1.00 11.44 C ATOM 2378 O MET A 146 2.196 -3.794 -11.368 1.00 4.11 O ATOM 2379 CB MET A 146 0.478 -3.777 -14.116 1.00 54.11 C ATOM 2380 CG MET A 146 -0.322 -2.486 -14.218 1.00 23.24 C ATOM 2381 SD MET A 146 0.040 -1.557 -15.723 1.00 44.11 S ATOM 2382 CE MET A 146 1.734 -1.064 -15.406 1.00 45.52 C ATOM 0 H MET A 146 -1.723 -4.469 -13.124 1.00 22.31 H new ATOM 0 HA MET A 146 0.898 -5.440 -12.821 1.00 11.33 H new ATOM 0 HB2 MET A 146 1.528 -3.555 -14.304 1.00 54.11 H new ATOM 0 HB3 MET A 146 0.150 -4.456 -14.903 1.00 54.11 H new ATOM 0 HG2 MET A 146 -1.386 -2.720 -14.188 1.00 23.24 H new ATOM 0 HG3 MET A 146 -0.108 -1.862 -13.351 1.00 23.24 H new ATOM 0 HE1 MET A 146 1.973 -0.181 -15.999 1.00 45.52 H new ATOM 0 HE2 MET A 146 1.854 -0.834 -14.347 1.00 45.52 H new ATOM 0 HE3 MET A 146 2.407 -1.877 -15.679 1.00 45.52 H new ATOM 2392 N VAL A 147 0.222 -2.775 -11.023 1.00 54.34 N ATOM 2393 CA VAL A 147 0.713 -1.969 -9.900 1.00 0.04 C ATOM 2394 C VAL A 147 0.697 -2.779 -8.588 1.00 12.32 C ATOM 2395 O VAL A 147 1.584 -2.643 -7.746 1.00 21.41 O ATOM 2396 CB VAL A 147 -0.132 -0.678 -9.719 1.00 20.53 C ATOM 2397 CG1 VAL A 147 0.447 0.209 -8.615 1.00 3.44 C ATOM 2398 CG2 VAL A 147 -0.233 0.089 -11.038 1.00 1.44 C ATOM 0 H VAL A 147 -0.753 -2.605 -11.269 1.00 54.34 H new ATOM 0 HA VAL A 147 1.740 -1.687 -10.133 1.00 0.04 H new ATOM 0 HB VAL A 147 -1.137 -0.972 -9.417 1.00 20.53 H new ATOM 0 HG11 VAL A 147 -0.164 1.105 -8.510 1.00 3.44 H new ATOM 0 HG12 VAL A 147 0.452 -0.339 -7.673 1.00 3.44 H new ATOM 0 HG13 VAL A 147 1.467 0.494 -8.874 1.00 3.44 H new ATOM 0 HG21 VAL A 147 -0.829 0.990 -10.890 1.00 1.44 H new ATOM 0 HG22 VAL A 147 0.766 0.366 -11.375 1.00 1.44 H new ATOM 0 HG23 VAL A 147 -0.708 -0.541 -11.790 1.00 1.44 H new ATOM 2408 N ALA A 148 -0.308 -3.639 -8.438 1.00 43.04 N ATOM 2409 CA ALA A 148 -0.468 -4.452 -7.226 1.00 20.53 C ATOM 2410 C ALA A 148 0.773 -5.313 -6.921 1.00 24.35 C ATOM 2411 O ALA A 148 1.262 -5.336 -5.791 1.00 12.55 O ATOM 2412 CB ALA A 148 -1.701 -5.335 -7.350 1.00 64.20 C ATOM 0 H ALA A 148 -1.029 -3.794 -9.142 1.00 43.04 H new ATOM 0 HA ALA A 148 -0.591 -3.763 -6.391 1.00 20.53 H new ATOM 0 HB1 ALA A 148 -1.812 -5.934 -6.446 1.00 64.20 H new ATOM 0 HB2 ALA A 148 -2.584 -4.710 -7.481 1.00 64.20 H new ATOM 0 HB3 ALA A 148 -1.592 -5.994 -8.211 1.00 64.20 H new ATOM 2418 N LYS A 149 1.291 -6.003 -7.933 1.00 54.52 N ATOM 2419 CA LYS A 149 2.427 -6.920 -7.736 1.00 25.43 C ATOM 2420 C LYS A 149 3.731 -6.186 -7.356 1.00 2.33 C ATOM 2421 O LYS A 149 4.675 -6.807 -6.868 1.00 13.42 O ATOM 2422 CB LYS A 149 2.644 -7.786 -8.987 1.00 42.45 C ATOM 2423 CG LYS A 149 2.852 -6.993 -10.275 1.00 32.42 C ATOM 2424 CD LYS A 149 3.053 -7.916 -11.478 1.00 23.52 C ATOM 2425 CE LYS A 149 1.871 -8.865 -11.673 1.00 35.04 C ATOM 2426 NZ LYS A 149 2.073 -9.783 -12.826 1.00 60.24 N ATOM 0 H LYS A 149 0.951 -5.951 -8.893 1.00 54.52 H new ATOM 0 HA LYS A 149 2.169 -7.562 -6.894 1.00 25.43 H new ATOM 0 HB2 LYS A 149 3.511 -8.426 -8.825 1.00 42.45 H new ATOM 0 HB3 LYS A 149 1.783 -8.442 -9.114 1.00 42.45 H new ATOM 0 HG2 LYS A 149 1.990 -6.349 -10.450 1.00 32.42 H new ATOM 0 HG3 LYS A 149 3.719 -6.342 -10.166 1.00 32.42 H new ATOM 0 HD2 LYS A 149 3.188 -7.315 -12.378 1.00 23.52 H new ATOM 0 HD3 LYS A 149 3.966 -8.496 -11.342 1.00 23.52 H new ATOM 0 HE2 LYS A 149 1.724 -9.451 -10.766 1.00 35.04 H new ATOM 0 HE3 LYS A 149 0.962 -8.284 -11.828 1.00 35.04 H new ATOM 0 HZ1 LYS A 149 1.247 -10.408 -12.921 1.00 60.24 H new ATOM 0 HZ2 LYS A 149 2.188 -9.226 -13.697 1.00 60.24 H new ATOM 0 HZ3 LYS A 149 2.926 -10.357 -12.667 1.00 60.24 H new ATOM 2440 N THR A 150 3.786 -4.871 -7.575 1.00 63.31 N ATOM 2441 CA THR A 150 4.977 -4.080 -7.198 1.00 32.25 C ATOM 2442 C THR A 150 4.739 -3.256 -5.918 1.00 11.22 C ATOM 2443 O THR A 150 5.628 -2.530 -5.464 1.00 74.41 O ATOM 2444 CB THR A 150 5.442 -3.138 -8.343 1.00 54.41 C ATOM 2445 OG1 THR A 150 6.634 -2.434 -7.956 1.00 4.44 O ATOM 2446 CG2 THR A 150 4.360 -2.132 -8.720 1.00 73.04 C ATOM 0 H THR A 150 3.036 -4.330 -8.005 1.00 63.31 H new ATOM 0 HA THR A 150 5.768 -4.805 -7.005 1.00 32.25 H new ATOM 0 HB THR A 150 5.648 -3.761 -9.213 1.00 54.41 H new ATOM 0 HG1 THR A 150 6.739 -2.479 -6.983 1.00 4.44 H new ATOM 0 HG21 THR A 150 4.723 -1.491 -9.524 1.00 73.04 H new ATOM 0 HG22 THR A 150 3.469 -2.664 -9.054 1.00 73.04 H new ATOM 0 HG23 THR A 150 4.113 -1.521 -7.852 1.00 73.04 H new ATOM 2454 N VAL A 151 3.547 -3.391 -5.331 1.00 41.32 N ATOM 2455 CA VAL A 151 3.179 -2.663 -4.104 1.00 15.12 C ATOM 2456 C VAL A 151 4.157 -2.897 -2.928 1.00 33.34 C ATOM 2457 O VAL A 151 4.576 -1.933 -2.284 1.00 32.02 O ATOM 2458 CB VAL A 151 1.737 -3.019 -3.650 1.00 61.22 C ATOM 2459 CG1 VAL A 151 1.447 -2.465 -2.259 1.00 0.13 C ATOM 2460 CG2 VAL A 151 0.715 -2.501 -4.658 1.00 4.32 C ATOM 0 H VAL A 151 2.812 -4.002 -5.686 1.00 41.32 H new ATOM 0 HA VAL A 151 3.235 -1.607 -4.369 1.00 15.12 H new ATOM 0 HB VAL A 151 1.657 -4.105 -3.603 1.00 61.22 H new ATOM 0 HG11 VAL A 151 0.431 -2.729 -1.967 1.00 0.13 H new ATOM 0 HG12 VAL A 151 2.152 -2.889 -1.544 1.00 0.13 H new ATOM 0 HG13 VAL A 151 1.551 -1.380 -2.271 1.00 0.13 H new ATOM 0 HG21 VAL A 151 -0.290 -2.760 -4.323 1.00 4.32 H new ATOM 0 HG22 VAL A 151 0.802 -1.418 -4.741 1.00 4.32 H new ATOM 0 HG23 VAL A 151 0.901 -2.955 -5.631 1.00 4.32 H new ATOM 2470 N PRO A 152 4.536 -4.159 -2.606 1.00 55.25 N ATOM 2471 CA PRO A 152 5.440 -4.437 -1.473 1.00 21.52 C ATOM 2472 C PRO A 152 6.776 -3.681 -1.575 1.00 52.41 C ATOM 2473 O PRO A 152 7.323 -3.254 -0.561 1.00 30.52 O ATOM 2474 CB PRO A 152 5.660 -5.959 -1.538 1.00 3.54 C ATOM 2475 CG PRO A 152 5.227 -6.360 -2.910 1.00 54.03 C ATOM 2476 CD PRO A 152 4.133 -5.402 -3.289 1.00 1.30 C ATOM 0 HA PRO A 152 5.010 -4.104 -0.528 1.00 21.52 H new ATOM 0 HB2 PRO A 152 6.706 -6.213 -1.365 1.00 3.54 H new ATOM 0 HB3 PRO A 152 5.077 -6.474 -0.775 1.00 3.54 H new ATOM 0 HG2 PRO A 152 6.057 -6.304 -3.614 1.00 54.03 H new ATOM 0 HG3 PRO A 152 4.868 -7.389 -2.922 1.00 54.03 H new ATOM 0 HD2 PRO A 152 4.069 -5.268 -4.369 1.00 1.30 H new ATOM 0 HD3 PRO A 152 3.156 -5.750 -2.953 1.00 1.30 H new ATOM 2484 N ASP A 153 7.288 -3.503 -2.797 1.00 31.31 N ATOM 2485 CA ASP A 153 8.543 -2.767 -3.011 1.00 52.31 C ATOM 2486 C ASP A 153 8.293 -1.247 -3.019 1.00 23.33 C ATOM 2487 O ASP A 153 9.123 -0.461 -2.554 1.00 14.04 O ATOM 2488 CB ASP A 153 9.213 -3.215 -4.316 1.00 61.11 C ATOM 2489 CG ASP A 153 10.581 -2.580 -4.507 1.00 1.42 C ATOM 2490 OD1 ASP A 153 11.457 -2.770 -3.631 1.00 4.45 O ATOM 2491 OD2 ASP A 153 10.793 -1.901 -5.533 1.00 75.34 O ATOM 0 H ASP A 153 6.857 -3.856 -3.651 1.00 31.31 H new ATOM 0 HA ASP A 153 9.217 -2.993 -2.184 1.00 52.31 H new ATOM 0 HB2 ASP A 153 9.315 -4.300 -4.316 1.00 61.11 H new ATOM 0 HB3 ASP A 153 8.573 -2.955 -5.159 1.00 61.11 H new ATOM 2496 N ASP A 154 7.132 -0.857 -3.540 1.00 15.24 N ATOM 2497 CA ASP A 154 6.663 0.526 -3.523 1.00 14.25 C ATOM 2498 C ASP A 154 6.661 1.063 -2.077 1.00 60.20 C ATOM 2499 O ASP A 154 7.212 2.126 -1.787 1.00 43.43 O ATOM 2500 CB ASP A 154 5.257 0.539 -4.151 1.00 60.22 C ATOM 2501 CG ASP A 154 4.575 1.889 -4.148 1.00 15.45 C ATOM 2502 OD1 ASP A 154 5.111 2.835 -4.761 1.00 21.11 O ATOM 2503 OD2 ASP A 154 3.480 1.994 -3.551 1.00 4.03 O ATOM 0 H ASP A 154 6.482 -1.501 -3.992 1.00 15.24 H new ATOM 0 HA ASP A 154 7.320 1.180 -4.097 1.00 14.25 H new ATOM 0 HB2 ASP A 154 5.330 0.187 -5.180 1.00 60.22 H new ATOM 0 HB3 ASP A 154 4.628 -0.172 -3.615 1.00 60.22 H new ATOM 2508 N ALA A 155 6.082 0.278 -1.171 1.00 10.12 N ATOM 2509 CA ALA A 155 6.093 0.588 0.263 1.00 74.32 C ATOM 2510 C ALA A 155 7.491 0.380 0.878 1.00 33.34 C ATOM 2511 O ALA A 155 7.961 1.190 1.675 1.00 40.32 O ATOM 2512 CB ALA A 155 5.069 -0.282 0.979 1.00 23.33 C ATOM 0 H ALA A 155 5.594 -0.587 -1.405 1.00 10.12 H new ATOM 0 HA ALA A 155 5.833 1.639 0.387 1.00 74.32 H new ATOM 0 HB1 ALA A 155 5.077 -0.052 2.044 1.00 23.33 H new ATOM 0 HB2 ALA A 155 4.077 -0.085 0.573 1.00 23.33 H new ATOM 0 HB3 ALA A 155 5.319 -1.333 0.833 1.00 23.33 H new ATOM 2518 N LYS A 156 8.144 -0.715 0.487 1.00 73.25 N ATOM 2519 CA LYS A 156 9.493 -1.077 0.967 1.00 33.30 C ATOM 2520 C LYS A 156 10.490 0.096 0.887 1.00 3.11 C ATOM 2521 O LYS A 156 11.444 0.166 1.672 1.00 65.53 O ATOM 2522 CB LYS A 156 9.986 -2.285 0.158 1.00 14.13 C ATOM 2523 CG LYS A 156 11.470 -2.609 0.263 1.00 2.42 C ATOM 2524 CD LYS A 156 11.784 -3.905 -0.486 1.00 44.15 C ATOM 2525 CE LYS A 156 13.253 -4.021 -0.858 1.00 24.32 C ATOM 2526 NZ LYS A 156 13.666 -2.956 -1.810 1.00 45.24 N ATOM 0 H LYS A 156 7.755 -1.385 -0.176 1.00 73.25 H new ATOM 0 HA LYS A 156 9.429 -1.333 2.024 1.00 33.30 H new ATOM 0 HB2 LYS A 156 9.421 -3.162 0.475 1.00 14.13 H new ATOM 0 HB3 LYS A 156 9.747 -2.114 -0.892 1.00 14.13 H new ATOM 0 HG2 LYS A 156 12.058 -1.790 -0.151 1.00 2.42 H new ATOM 0 HG3 LYS A 156 11.754 -2.708 1.311 1.00 2.42 H new ATOM 0 HD2 LYS A 156 11.501 -4.756 0.133 1.00 44.15 H new ATOM 0 HD3 LYS A 156 11.178 -3.954 -1.391 1.00 44.15 H new ATOM 0 HE2 LYS A 156 13.862 -3.959 0.044 1.00 24.32 H new ATOM 0 HE3 LYS A 156 13.440 -4.999 -1.303 1.00 24.32 H new ATOM 0 HZ1 LYS A 156 14.519 -3.260 -2.322 1.00 45.24 H new ATOM 0 HZ2 LYS A 156 12.898 -2.781 -2.489 1.00 45.24 H new ATOM 0 HZ3 LYS A 156 13.870 -2.081 -1.285 1.00 45.24 H new ATOM 2540 N GLN A 157 10.268 1.011 -0.055 1.00 62.35 N ATOM 2541 CA GLN A 157 11.058 2.246 -0.138 1.00 32.03 C ATOM 2542 C GLN A 157 10.964 3.044 1.176 1.00 22.12 C ATOM 2543 O GLN A 157 11.980 3.396 1.788 1.00 24.35 O ATOM 2544 CB GLN A 157 10.563 3.114 -1.308 1.00 21.42 C ATOM 2545 CG GLN A 157 10.705 2.467 -2.685 1.00 12.42 C ATOM 2546 CD GLN A 157 12.149 2.151 -3.049 1.00 21.30 C ATOM 2547 OE1 GLN A 157 12.866 2.988 -3.594 1.00 34.31 O ATOM 2548 NE2 GLN A 157 12.580 0.936 -2.779 1.00 42.24 N ATOM 0 H GLN A 157 9.549 0.924 -0.773 1.00 62.35 H new ATOM 0 HA GLN A 157 12.100 1.973 -0.307 1.00 32.03 H new ATOM 0 HB2 GLN A 157 9.514 3.359 -1.143 1.00 21.42 H new ATOM 0 HB3 GLN A 157 11.114 4.054 -1.304 1.00 21.42 H new ATOM 0 HG2 GLN A 157 10.120 1.547 -2.710 1.00 12.42 H new ATOM 0 HG3 GLN A 157 10.284 3.133 -3.438 1.00 12.42 H new ATOM 0 HE21 GLN A 157 11.961 0.264 -2.326 1.00 42.24 H new ATOM 0 HE22 GLN A 157 13.533 0.667 -3.023 1.00 42.24 H new ATOM 2557 N LEU A 158 9.733 3.302 1.616 1.00 25.21 N ATOM 2558 CA LEU A 158 9.489 4.053 2.851 1.00 72.21 C ATOM 2559 C LEU A 158 9.830 3.216 4.094 1.00 71.51 C ATOM 2560 O LEU A 158 10.352 3.746 5.076 1.00 21.44 O ATOM 2561 CB LEU A 158 8.027 4.533 2.923 1.00 53.53 C ATOM 2562 CG LEU A 158 7.658 5.703 1.989 1.00 15.53 C ATOM 2563 CD1 LEU A 158 8.527 6.923 2.280 1.00 24.43 C ATOM 2564 CD2 LEU A 158 7.773 5.296 0.521 1.00 25.21 C ATOM 0 H LEU A 158 8.885 3.002 1.135 1.00 25.21 H new ATOM 0 HA LEU A 158 10.144 4.924 2.836 1.00 72.21 H new ATOM 0 HB2 LEU A 158 7.376 3.690 2.693 1.00 53.53 H new ATOM 0 HB3 LEU A 158 7.812 4.831 3.949 1.00 53.53 H new ATOM 0 HG LEU A 158 6.619 5.968 2.182 1.00 15.53 H new ATOM 0 HD11 LEU A 158 8.249 7.736 1.609 1.00 24.43 H new ATOM 0 HD12 LEU A 158 8.378 7.238 3.313 1.00 24.43 H new ATOM 0 HD13 LEU A 158 9.575 6.668 2.126 1.00 24.43 H new ATOM 0 HD21 LEU A 158 7.507 6.142 -0.113 1.00 25.21 H new ATOM 0 HD22 LEU A 158 8.797 4.991 0.307 1.00 25.21 H new ATOM 0 HD23 LEU A 158 7.097 4.465 0.320 1.00 25.21 H new ATOM 2576 N THR A 159 9.532 1.915 4.042 1.00 14.23 N ATOM 2577 CA THR A 159 9.869 0.989 5.134 1.00 4.33 C ATOM 2578 C THR A 159 11.329 1.153 5.575 1.00 40.12 C ATOM 2579 O THR A 159 11.614 1.380 6.752 1.00 74.43 O ATOM 2580 CB THR A 159 9.632 -0.487 4.720 1.00 71.30 C ATOM 2581 OG1 THR A 159 8.289 -0.648 4.246 1.00 61.25 O ATOM 2582 CG2 THR A 159 9.871 -1.438 5.890 1.00 3.40 C ATOM 0 H THR A 159 9.057 1.475 3.254 1.00 14.23 H new ATOM 0 HA THR A 159 9.211 1.237 5.967 1.00 4.33 H new ATOM 0 HB THR A 159 10.340 -0.731 3.928 1.00 71.30 H new ATOM 0 HG1 THR A 159 8.171 -1.557 3.900 1.00 61.25 H new ATOM 0 HG21 THR A 159 9.696 -2.464 5.566 1.00 3.40 H new ATOM 0 HG22 THR A 159 10.899 -1.337 6.237 1.00 3.40 H new ATOM 0 HG23 THR A 159 9.188 -1.193 6.703 1.00 3.40 H new ATOM 2590 N THR A 160 12.251 1.059 4.618 1.00 34.23 N ATOM 2591 CA THR A 160 13.679 1.238 4.909 1.00 41.31 C ATOM 2592 C THR A 160 13.991 2.673 5.360 1.00 44.43 C ATOM 2593 O THR A 160 14.651 2.881 6.379 1.00 2.24 O ATOM 2594 CB THR A 160 14.569 0.899 3.685 1.00 51.11 C ATOM 2595 OG1 THR A 160 14.381 -0.472 3.289 1.00 45.13 O ATOM 2596 CG2 THR A 160 16.045 1.139 4.003 1.00 34.40 C ATOM 0 H THR A 160 12.040 0.861 3.640 1.00 34.23 H new ATOM 0 HA THR A 160 13.907 0.545 5.719 1.00 41.31 H new ATOM 0 HB THR A 160 14.273 1.554 2.865 1.00 51.11 H new ATOM 0 HG1 THR A 160 14.948 -0.670 2.515 1.00 45.13 H new ATOM 0 HG21 THR A 160 16.650 0.894 3.130 1.00 34.40 H new ATOM 0 HG22 THR A 160 16.195 2.186 4.267 1.00 34.40 H new ATOM 0 HG23 THR A 160 16.344 0.508 4.840 1.00 34.40 H new ATOM 2604 N THR A 161 13.506 3.660 4.602 1.00 53.13 N ATOM 2605 CA THR A 161 13.791 5.077 4.886 1.00 25.23 C ATOM 2606 C THR A 161 13.429 5.477 6.327 1.00 32.45 C ATOM 2607 O THR A 161 14.239 6.077 7.039 1.00 44.43 O ATOM 2608 CB THR A 161 13.046 6.005 3.897 1.00 21.41 C ATOM 2609 OG1 THR A 161 13.430 5.685 2.551 1.00 33.12 O ATOM 2610 CG2 THR A 161 13.348 7.476 4.175 1.00 25.44 C ATOM 0 H THR A 161 12.914 3.508 3.786 1.00 53.13 H new ATOM 0 HA THR A 161 14.867 5.198 4.762 1.00 25.23 H new ATOM 0 HB THR A 161 11.976 5.846 4.028 1.00 21.41 H new ATOM 0 HG1 THR A 161 12.932 4.898 2.247 1.00 33.12 H new ATOM 0 HG21 THR A 161 12.808 8.099 3.462 1.00 25.44 H new ATOM 0 HG22 THR A 161 13.033 7.727 5.188 1.00 25.44 H new ATOM 0 HG23 THR A 161 14.419 7.653 4.074 1.00 25.44 H new ATOM 2618 N ILE A 162 12.219 5.139 6.757 1.00 1.22 N ATOM 2619 CA ILE A 162 11.775 5.452 8.120 1.00 53.24 C ATOM 2620 C ILE A 162 12.630 4.721 9.169 1.00 51.44 C ATOM 2621 O ILE A 162 13.120 5.332 10.117 1.00 55.35 O ATOM 2622 CB ILE A 162 10.281 5.087 8.322 1.00 0.15 C ATOM 2623 CG1 ILE A 162 9.397 5.923 7.378 1.00 4.55 C ATOM 2624 CG2 ILE A 162 9.854 5.284 9.779 1.00 22.44 C ATOM 2625 CD1 ILE A 162 7.915 5.627 7.497 1.00 71.40 C ATOM 0 H ILE A 162 11.527 4.650 6.189 1.00 1.22 H new ATOM 0 HA ILE A 162 11.897 6.527 8.256 1.00 53.24 H new ATOM 0 HB ILE A 162 10.153 4.032 8.080 1.00 0.15 H new ATOM 0 HG12 ILE A 162 9.563 6.981 7.583 1.00 4.55 H new ATOM 0 HG13 ILE A 162 9.711 5.744 6.350 1.00 4.55 H new ATOM 0 HG21 ILE A 162 8.802 5.020 9.889 1.00 22.44 H new ATOM 0 HG22 ILE A 162 10.458 4.646 10.424 1.00 22.44 H new ATOM 0 HG23 ILE A 162 9.998 6.327 10.063 1.00 22.44 H new ATOM 0 HD11 ILE A 162 7.361 6.256 6.800 1.00 71.40 H new ATOM 0 HD12 ILE A 162 7.733 4.578 7.262 1.00 71.40 H new ATOM 0 HD13 ILE A 162 7.583 5.834 8.515 1.00 71.40 H new ATOM 2637 N ASN A 163 12.820 3.419 8.977 1.00 1.03 N ATOM 2638 CA ASN A 163 13.582 2.591 9.921 1.00 54.45 C ATOM 2639 C ASN A 163 15.041 3.062 10.086 1.00 34.32 C ATOM 2640 O ASN A 163 15.564 3.093 11.202 1.00 72.02 O ATOM 2641 CB ASN A 163 13.536 1.125 9.475 1.00 45.44 C ATOM 2642 CG ASN A 163 12.172 0.497 9.717 1.00 1.33 C ATOM 2643 OD1 ASN A 163 11.479 0.833 10.668 1.00 53.35 O ATOM 2644 ND2 ASN A 163 11.770 -0.411 8.854 1.00 4.03 N ATOM 0 H ASN A 163 12.456 2.907 8.173 1.00 1.03 H new ATOM 0 HA ASN A 163 13.112 2.694 10.899 1.00 54.45 H new ATOM 0 HB2 ASN A 163 13.781 1.061 8.415 1.00 45.44 H new ATOM 0 HB3 ASN A 163 14.296 0.559 10.013 1.00 45.44 H new ATOM 0 HD21 ASN A 163 10.859 -0.855 8.968 1.00 4.03 H new ATOM 0 HD22 ASN A 163 12.369 -0.671 8.071 1.00 4.03 H new ATOM 2651 N THR A 164 15.703 3.424 8.986 1.00 53.11 N ATOM 2652 CA THR A 164 17.104 3.889 9.056 1.00 72.24 C ATOM 2653 C THR A 164 17.214 5.286 9.688 1.00 50.43 C ATOM 2654 O THR A 164 18.199 5.599 10.357 1.00 51.14 O ATOM 2655 CB THR A 164 17.797 3.909 7.669 1.00 11.43 C ATOM 2656 OG1 THR A 164 19.167 4.331 7.807 1.00 31.23 O ATOM 2657 CG2 THR A 164 17.080 4.839 6.700 1.00 44.21 C ATOM 0 H THR A 164 15.306 3.408 8.046 1.00 53.11 H new ATOM 0 HA THR A 164 17.616 3.165 9.689 1.00 72.24 H new ATOM 0 HB THR A 164 17.759 2.897 7.267 1.00 11.43 H new ATOM 0 HG1 THR A 164 19.597 4.339 6.926 1.00 31.23 H new ATOM 0 HG21 THR A 164 17.593 4.828 5.738 1.00 44.21 H new ATOM 0 HG22 THR A 164 16.052 4.503 6.567 1.00 44.21 H new ATOM 0 HG23 THR A 164 17.081 5.853 7.100 1.00 44.21 H new ATOM 2665 N ASN A 165 16.205 6.128 9.473 1.00 15.04 N ATOM 2666 CA ASN A 165 16.187 7.472 10.064 1.00 11.05 C ATOM 2667 C ASN A 165 15.312 7.527 11.330 1.00 55.12 C ATOM 2668 O ASN A 165 15.045 8.607 11.854 1.00 55.25 O ATOM 2669 CB ASN A 165 15.693 8.506 9.044 1.00 74.32 C ATOM 2670 CG ASN A 165 16.634 8.660 7.858 1.00 23.23 C ATOM 2671 OD1 ASN A 165 17.594 9.424 7.903 1.00 24.05 O ATOM 2672 ND2 ASN A 165 16.358 7.957 6.779 1.00 24.13 N ATOM 0 H ASN A 165 15.392 5.909 8.898 1.00 15.04 H new ATOM 0 HA ASN A 165 17.211 7.712 10.350 1.00 11.05 H new ATOM 0 HB2 ASN A 165 14.707 8.212 8.684 1.00 74.32 H new ATOM 0 HB3 ASN A 165 15.578 9.471 9.538 1.00 74.32 H new ATOM 0 HD21 ASN A 165 16.949 8.039 5.952 1.00 24.13 H new ATOM 0 HD22 ASN A 165 15.553 7.330 6.771 1.00 24.13 H new ATOM 2679 N ALA A 166 14.885 6.363 11.827 1.00 22.10 N ATOM 2680 CA ALA A 166 14.022 6.283 13.019 1.00 4.22 C ATOM 2681 C ALA A 166 14.591 7.078 14.205 1.00 3.33 C ATOM 2682 O ALA A 166 13.885 7.878 14.823 1.00 24.43 O ATOM 2683 CB ALA A 166 13.805 4.824 13.418 1.00 4.34 C ATOM 0 H ALA A 166 15.122 5.457 11.423 1.00 22.10 H new ATOM 0 HA ALA A 166 13.065 6.734 12.756 1.00 4.22 H new ATOM 0 HB1 ALA A 166 13.166 4.779 14.300 1.00 4.34 H new ATOM 0 HB2 ALA A 166 13.328 4.289 12.597 1.00 4.34 H new ATOM 0 HB3 ALA A 166 14.766 4.361 13.643 1.00 4.34 H new ATOM 2689 N GLU A 167 15.871 6.859 14.507 1.00 62.05 N ATOM 2690 CA GLU A 167 16.551 7.561 15.606 1.00 4.14 C ATOM 2691 C GLU A 167 16.615 9.081 15.370 1.00 71.20 C ATOM 2692 O GLU A 167 16.879 9.851 16.294 1.00 15.35 O ATOM 2693 CB GLU A 167 17.972 7.011 15.783 1.00 53.14 C ATOM 2694 CG GLU A 167 18.834 7.135 14.530 1.00 62.33 C ATOM 2695 CD GLU A 167 20.305 6.865 14.802 1.00 74.22 C ATOM 2696 OE1 GLU A 167 20.700 5.682 14.842 1.00 34.12 O ATOM 2697 OE2 GLU A 167 21.064 7.841 14.980 1.00 64.13 O ATOM 0 H GLU A 167 16.464 6.198 14.005 1.00 62.05 H new ATOM 0 HA GLU A 167 15.969 7.387 16.511 1.00 4.14 H new ATOM 0 HB2 GLU A 167 18.458 7.540 16.603 1.00 53.14 H new ATOM 0 HB3 GLU A 167 17.913 5.962 16.071 1.00 53.14 H new ATOM 0 HG2 GLU A 167 18.474 6.436 13.775 1.00 62.33 H new ATOM 0 HG3 GLU A 167 18.723 8.137 14.115 1.00 62.33 H new ATOM 2704 N ALA A 168 16.406 9.502 14.125 1.00 53.35 N ATOM 2705 CA ALA A 168 16.374 10.926 13.778 1.00 54.24 C ATOM 2706 C ALA A 168 14.946 11.483 13.872 1.00 50.32 C ATOM 2707 O ALA A 168 14.729 12.579 14.390 1.00 32.13 O ATOM 2708 CB ALA A 168 16.936 11.141 12.376 1.00 1.45 C ATOM 0 H ALA A 168 16.255 8.876 13.334 1.00 53.35 H new ATOM 0 HA ALA A 168 16.996 11.465 14.493 1.00 54.24 H new ATOM 0 HB1 ALA A 168 16.906 12.203 12.131 1.00 1.45 H new ATOM 0 HB2 ALA A 168 17.967 10.789 12.339 1.00 1.45 H new ATOM 0 HB3 ALA A 168 16.337 10.585 11.655 1.00 1.45 H new ATOM 2714 N LEU A 169 13.981 10.704 13.382 1.00 61.43 N ATOM 2715 CA LEU A 169 12.565 11.097 13.371 1.00 43.04 C ATOM 2716 C LEU A 169 12.000 11.249 14.791 1.00 73.23 C ATOM 2717 O LEU A 169 11.444 12.289 15.147 1.00 2.42 O ATOM 2718 CB LEU A 169 11.741 10.052 12.603 1.00 63.32 C ATOM 2719 CG LEU A 169 12.135 9.852 11.129 1.00 13.01 C ATOM 2720 CD1 LEU A 169 11.372 8.678 10.519 1.00 12.24 C ATOM 2721 CD2 LEU A 169 11.887 11.129 10.330 1.00 40.04 C ATOM 0 H LEU A 169 14.155 9.783 12.981 1.00 61.43 H new ATOM 0 HA LEU A 169 12.497 12.066 12.877 1.00 43.04 H new ATOM 0 HB2 LEU A 169 11.829 9.095 13.118 1.00 63.32 H new ATOM 0 HB3 LEU A 169 10.691 10.341 12.644 1.00 63.32 H new ATOM 0 HG LEU A 169 13.200 9.623 11.088 1.00 13.01 H new ATOM 0 HD11 LEU A 169 11.666 8.555 9.477 1.00 12.24 H new ATOM 0 HD12 LEU A 169 11.604 7.767 11.071 1.00 12.24 H new ATOM 0 HD13 LEU A 169 10.301 8.873 10.573 1.00 12.24 H new ATOM 0 HD21 LEU A 169 12.171 10.969 9.290 1.00 40.04 H new ATOM 0 HD22 LEU A 169 10.830 11.391 10.381 1.00 40.04 H new ATOM 0 HD23 LEU A 169 12.482 11.941 10.748 1.00 40.04 H new ATOM 2733 N PHE A 170 12.138 10.199 15.595 1.00 53.14 N ATOM 2734 CA PHE A 170 11.599 10.187 16.960 1.00 53.34 C ATOM 2735 C PHE A 170 12.722 10.349 17.996 1.00 55.42 C ATOM 2736 O PHE A 170 13.906 10.278 17.660 1.00 62.40 O ATOM 2737 CB PHE A 170 10.825 8.884 17.207 1.00 3.55 C ATOM 2738 CG PHE A 170 9.789 8.592 16.147 1.00 43.14 C ATOM 2739 CD1 PHE A 170 8.574 9.265 16.132 1.00 50.22 C ATOM 2740 CD2 PHE A 170 10.043 7.658 15.149 1.00 65.42 C ATOM 2741 CE1 PHE A 170 7.635 9.009 15.151 1.00 73.35 C ATOM 2742 CE2 PHE A 170 9.105 7.403 14.165 1.00 74.21 C ATOM 2743 CZ PHE A 170 7.902 8.080 14.166 1.00 42.34 C ATOM 0 H PHE A 170 12.619 9.340 15.328 1.00 53.14 H new ATOM 0 HA PHE A 170 10.917 11.030 17.069 1.00 53.34 H new ATOM 0 HB2 PHE A 170 11.530 8.054 17.254 1.00 3.55 H new ATOM 0 HB3 PHE A 170 10.334 8.940 18.179 1.00 3.55 H new ATOM 0 HD1 PHE A 170 8.361 9.997 16.896 1.00 50.22 H new ATOM 0 HD2 PHE A 170 10.983 7.126 15.142 1.00 65.42 H new ATOM 0 HE1 PHE A 170 6.692 9.536 15.155 1.00 73.35 H new ATOM 0 HE2 PHE A 170 9.314 6.674 13.396 1.00 74.21 H new ATOM 0 HZ PHE A 170 7.170 7.883 13.397 1.00 42.34 H new ATOM 2753 N ARG A 171 12.352 10.541 19.260 1.00 13.44 N ATOM 2754 CA ARG A 171 13.337 10.785 20.320 1.00 64.11 C ATOM 2755 C ARG A 171 12.983 10.015 21.607 1.00 21.22 C ATOM 2756 O ARG A 171 11.883 10.160 22.140 1.00 43.11 O ATOM 2757 CB ARG A 171 13.415 12.291 20.624 1.00 24.40 C ATOM 2758 CG ARG A 171 14.795 12.760 21.071 1.00 2.13 C ATOM 2759 CD ARG A 171 15.786 12.734 19.913 1.00 51.33 C ATOM 2760 NE ARG A 171 15.338 13.591 18.814 1.00 53.01 N ATOM 2761 CZ ARG A 171 15.358 13.250 17.553 1.00 0.54 C ATOM 2762 NH1 ARG A 171 15.860 12.119 17.183 1.00 10.45 N ATOM 2763 NH2 ARG A 171 14.874 14.052 16.664 1.00 34.41 N ATOM 0 H ARG A 171 11.383 10.533 19.578 1.00 13.44 H new ATOM 0 HA ARG A 171 14.305 10.429 19.967 1.00 64.11 H new ATOM 0 HB2 ARG A 171 13.124 12.847 19.733 1.00 24.40 H new ATOM 0 HB3 ARG A 171 12.690 12.533 21.401 1.00 24.40 H new ATOM 0 HG2 ARG A 171 14.726 13.771 21.472 1.00 2.13 H new ATOM 0 HG3 ARG A 171 15.156 12.121 21.877 1.00 2.13 H new ATOM 0 HD2 ARG A 171 16.764 13.066 20.261 1.00 51.33 H new ATOM 0 HD3 ARG A 171 15.905 11.711 19.555 1.00 51.33 H new ATOM 0 HE ARG A 171 14.986 14.519 19.049 1.00 53.01 H new ATOM 0 HH11 ARG A 171 16.247 11.481 17.878 1.00 10.45 H new ATOM 0 HH12 ARG A 171 15.870 11.864 16.195 1.00 10.45 H new ATOM 0 HH21 ARG A 171 14.478 14.948 16.947 1.00 34.41 H new ATOM 0 HH22 ARG A 171 14.888 13.789 15.679 1.00 34.41 H new ATOM 2777 N PRO A 172 13.916 9.201 22.140 1.00 34.33 N ATOM 2778 CA PRO A 172 13.681 8.428 23.373 1.00 40.21 C ATOM 2779 C PRO A 172 13.892 9.262 24.653 1.00 71.54 C ATOM 2780 O PRO A 172 13.779 8.751 25.771 1.00 44.23 O ATOM 2781 CB PRO A 172 14.729 7.314 23.268 1.00 34.24 C ATOM 2782 CG PRO A 172 15.873 7.946 22.542 1.00 44.42 C ATOM 2783 CD PRO A 172 15.272 8.963 21.595 1.00 53.11 C ATOM 0 HA PRO A 172 12.653 8.073 23.452 1.00 40.21 H new ATOM 0 HB2 PRO A 172 15.031 6.959 24.253 1.00 34.24 H new ATOM 0 HB3 PRO A 172 14.340 6.453 22.724 1.00 34.24 H new ATOM 0 HG2 PRO A 172 16.559 8.425 23.241 1.00 44.42 H new ATOM 0 HG3 PRO A 172 16.446 7.198 21.995 1.00 44.42 H new ATOM 0 HD2 PRO A 172 15.859 9.881 21.570 1.00 53.11 H new ATOM 0 HD3 PRO A 172 15.231 8.583 20.574 1.00 53.11 H new ATOM 2791 N GLY A 173 14.197 10.548 24.477 1.00 73.30 N ATOM 2792 CA GLY A 173 14.455 11.436 25.610 1.00 4.52 C ATOM 2793 C GLY A 173 15.937 11.778 25.759 1.00 13.31 C ATOM 2794 O GLY A 173 16.713 11.594 24.821 1.00 43.31 O ATOM 0 H GLY A 173 14.271 10.996 23.564 1.00 73.30 H new ATOM 0 HA2 GLY A 173 13.884 12.356 25.484 1.00 4.52 H new ATOM 0 HA3 GLY A 173 14.100 10.964 26.526 1.00 4.52 H new ATOM 2798 N PRO A 174 16.362 12.294 26.927 1.00 60.34 N ATOM 2799 CA PRO A 174 17.780 12.596 27.192 1.00 43.13 C ATOM 2800 C PRO A 174 18.622 11.328 27.427 1.00 40.11 C ATOM 2801 O PRO A 174 18.244 10.451 28.209 1.00 41.33 O ATOM 2802 CB PRO A 174 17.717 13.453 28.464 1.00 64.32 C ATOM 2803 CG PRO A 174 16.482 12.996 29.165 1.00 12.31 C ATOM 2804 CD PRO A 174 15.500 12.634 28.078 1.00 55.42 C ATOM 0 HA PRO A 174 18.261 13.091 26.348 1.00 43.13 H new ATOM 0 HB2 PRO A 174 18.602 13.308 29.084 1.00 64.32 H new ATOM 0 HB3 PRO A 174 17.667 14.515 28.224 1.00 64.32 H new ATOM 0 HG2 PRO A 174 16.690 12.138 29.805 1.00 12.31 H new ATOM 0 HG3 PRO A 174 16.083 13.782 29.806 1.00 12.31 H new ATOM 0 HD2 PRO A 174 14.871 11.793 28.370 1.00 55.42 H new ATOM 0 HD3 PRO A 174 14.833 13.465 27.847 1.00 55.42 H new ATOM 2812 N GLY A 175 19.764 11.228 26.751 1.00 52.44 N ATOM 2813 CA GLY A 175 20.633 10.062 26.910 1.00 43.02 C ATOM 2814 C GLY A 175 21.550 10.149 28.132 1.00 73.41 C ATOM 2815 O GLY A 175 22.759 9.921 28.032 1.00 33.42 O ATOM 0 H GLY A 175 20.107 11.930 26.095 1.00 52.44 H new ATOM 0 HA2 GLY A 175 20.016 9.167 26.991 1.00 43.02 H new ATOM 0 HA3 GLY A 175 21.244 9.948 26.014 1.00 43.02 H new ATOM 2819 N SER A 176 20.969 10.458 29.294 1.00 71.41 N ATOM 2820 CA SER A 176 21.740 10.606 30.544 1.00 5.21 C ATOM 2821 C SER A 176 21.144 9.760 31.689 1.00 61.41 C ATOM 2822 O SER A 176 20.359 10.298 32.504 1.00 37.85 O ATOM 2823 CB SER A 176 21.800 12.088 30.955 1.00 44.31 C ATOM 2824 OG SER A 176 20.496 12.637 31.118 1.00 71.10 O ATOM 2825 OXT SER A 176 21.466 8.556 31.773 1.00 37.85 O ATOM 0 H SER A 176 19.966 10.612 29.401 1.00 71.41 H new ATOM 0 HA SER A 176 22.750 10.241 30.356 1.00 5.21 H new ATOM 0 HB2 SER A 176 22.356 12.186 31.887 1.00 44.31 H new ATOM 0 HB3 SER A 176 22.343 12.655 30.199 1.00 44.31 H new ATOM 0 HG SER A 176 19.956 12.038 31.675 1.00 71.10 H new TER 2831 SER A 176