USER MOD reduce.3.24.130724 H: found=0, std=0, add=1284, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1284 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 129 SER OG : rot 18:sc= 0.273 USER MOD Set 1.2: A 150 TYR OH : rot -53:sc= 0.0572 USER MOD Set 1.3: A 154 GLN : amide:sc= -0.443 X(o=-0.11,f=0.029) USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= 0.0691 USER MOD Set 2.2: A 112 TYR OH : rot 50:sc= -0.424 USER MOD Set 2.3: A 138 ASN : amide:sc= 0.228 K(o=-0.13,f=-1.4) USER MOD Set 3.1: A 52 LYS NZ :NH3+ 157:sc= 0.797 (180deg=0.649) USER MOD Set 3.2: A 84 LYS NZ :NH3+ 146:sc= 0.567 (180deg=0.175) USER MOD Set 3.3: A 88 TYR OH : rot 30:sc= 0.766 USER MOD Set 4.1: A 74 ASN :FLIP amide:sc= 0.585 F(o=-0.5,f=1.2) USER MOD Set 4.2: A 106 THR OG1 : rot -20:sc= 0.596 USER MOD Set 5.1: A 63 MET CE :methyl -119:sc= -1 (180deg=-1.6) USER MOD Set 5.2: A 82 CYS SG : rot 68:sc= 0.17 USER MOD Set 6.1: A 28 TYR OH : rot 180:sc= 0.0284 USER MOD Set 6.2: A 69 LYS NZ :NH3+ -142:sc= 0.0289 (180deg=-0.0884) USER MOD Set 7.1: A 27 SER OG : rot 180:sc= 0 USER MOD Set 7.2: A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -150:sc= 0.779 (180deg=-0.474!) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc=-0.00605 X(o=-0.006,f=-0.006) USER MOD Single : A 5 HIS : no HE2:sc= 0.177 K(o=0.18,f=-0.77) USER MOD Single : A 6 HIS : no HD1:sc=-0.00556 X(o=-0.0056,f=-0.5) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 64:sc= 0.398 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 MET CE :methyl 174:sc= 0 (180deg=-0.0492) USER MOD Single : A 13 THR OG1 : rot -165:sc= 0.328 USER MOD Single : A 16 ASN : amide:sc= -0.0839 X(o=-0.084,f=-0.56) USER MOD Single : A 19 GLN : amide:sc= -0.356 X(o=-0.36,f=0) USER MOD Single : A 20 MET CE :methyl -118:sc= -0.877 (180deg=-3.61!) USER MOD Single : A 24 HIS :FLIP no HE2:sc= 0.135 F(o=-0.57,f=0.14) USER MOD Single : A 25 MET CE :methyl 140:sc= -0.636 (180deg=-1.75) USER MOD Single : A 26 GLN : amide:sc=-0.00229 X(o=-0.0023,f=-0.041) USER MOD Single : A 31 ASN : amide:sc= -0.141 K(o=-0.14,f=-1.6) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.226 X(o=0.23,f=0) USER MOD Single : A 47 ASN : amide:sc= 0.106 X(o=0.11,f=-0.15) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 TYR OH : rot -168:sc= 0.664 USER MOD Single : A 57 THR OG1 : rot 68:sc= 1.22 USER MOD Single : A 61 HIS : no HD1:sc= -2.74 X(o=-2.7,f=-3.2!) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 TYR OH : rot 117:sc= -0.577 USER MOD Single : A 73 HIS :FLIP no HD1:sc= -0.321 F(o=-1,f=-0.32) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot -177:sc= 0.448 USER MOD Single : A 89 ASN : amide:sc= 0.462 X(o=0.46,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HE2:sc= -0.344 K(o=-0.34,f=-0.93) USER MOD Single : A 94 GLN : amide:sc= -0.108 K(o=-0.11,f=-1.4) USER MOD Single : A 101 ASN : amide:sc= -0.0619 K(o=-0.062,f=-0.67) USER MOD Single : A 102 HIS : no HE2:sc= -1.67 K(o=-1.7,f=-2.9) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -1.07 USER MOD Single : A 118 HIS : no HD1:sc= -2.75! C(o=-2.8!,f=-3.3!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 126 GLN : amide:sc= -0.325 X(o=-0.32,f=-0.32) USER MOD Single : A 127 HIS : no HE2:sc= -0.513 K(o=-0.51,f=-3.4!) USER MOD Single : A 133 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.68) USER MOD Single : A 137 GLN : amide:sc= 0.0266 X(o=0.027,f=0) USER MOD Single : A 139 GLN : amide:sc= -0.391 X(o=-0.39,f=-0.02) USER MOD Single : A 147 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 148 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 149 GLN :FLIP amide:sc= -0.0895 F(o=-1.4!,f=-0.09) USER MOD Single : A 155 THR OG1 : rot -36:sc= 0.0119 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 17.854 34.224 -14.169 1.00 34.05 N ATOM 2 CA MET A 1 18.854 35.214 -13.671 1.00 63.51 C ATOM 3 C MET A 1 18.174 36.518 -13.170 1.00 61.11 C ATOM 4 O MET A 1 18.418 36.951 -12.033 1.00 45.12 O ATOM 5 CB MET A 1 19.944 35.505 -14.756 1.00 12.35 C ATOM 6 CG MET A 1 19.430 36.019 -16.116 1.00 54.14 C ATOM 7 SD MET A 1 18.296 34.856 -16.914 1.00 71.33 S ATOM 8 CE MET A 1 17.971 35.653 -18.489 1.00 73.20 C ATOM 0 H1 MET A 1 18.214 33.260 -14.016 1.00 34.05 H new ATOM 0 H2 MET A 1 16.959 34.345 -13.653 1.00 34.05 H new ATOM 0 H3 MET A 1 17.691 34.376 -15.185 1.00 34.05 H new ATOM 0 HA MET A 1 19.356 34.772 -12.811 1.00 63.51 H new ATOM 0 HB2 MET A 1 20.641 36.240 -14.353 1.00 12.35 H new ATOM 0 HB3 MET A 1 20.510 34.589 -14.927 1.00 12.35 H new ATOM 0 HG2 MET A 1 18.924 36.974 -15.972 1.00 54.14 H new ATOM 0 HG3 MET A 1 20.278 36.204 -16.775 1.00 54.14 H new ATOM 0 HE1 MET A 1 17.287 35.038 -19.074 1.00 73.20 H new ATOM 0 HE2 MET A 1 17.522 36.631 -18.316 1.00 73.20 H new ATOM 0 HE3 MET A 1 18.906 35.775 -19.035 1.00 73.20 H new ATOM 20 N GLY A 2 17.304 37.124 -14.020 1.00 65.42 N ATOM 21 CA GLY A 2 16.673 38.427 -13.720 1.00 43.42 C ATOM 22 C GLY A 2 17.682 39.573 -13.524 1.00 50.25 C ATOM 23 O GLY A 2 18.843 39.467 -13.936 1.00 23.25 O ATOM 0 H GLY A 2 17.027 36.727 -14.918 1.00 65.42 H new ATOM 0 HA2 GLY A 2 15.994 38.687 -14.532 1.00 43.42 H new ATOM 0 HA3 GLY A 2 16.068 38.329 -12.818 1.00 43.42 H new ATOM 27 N HIS A 3 17.233 40.674 -12.904 1.00 63.43 N ATOM 28 CA HIS A 3 18.120 41.778 -12.460 1.00 71.31 C ATOM 29 C HIS A 3 18.645 41.457 -11.030 1.00 11.33 C ATOM 30 O HIS A 3 18.253 42.093 -10.043 1.00 21.22 O ATOM 31 CB HIS A 3 17.346 43.132 -12.525 1.00 0.20 C ATOM 32 CG HIS A 3 18.192 44.369 -12.308 1.00 3.34 C ATOM 33 ND1 HIS A 3 18.826 45.035 -13.335 1.00 13.13 N ATOM 34 CD2 HIS A 3 18.495 45.068 -11.181 1.00 61.14 C ATOM 35 CE1 HIS A 3 19.473 46.075 -12.856 1.00 60.51 C ATOM 36 NE2 HIS A 3 19.288 46.118 -11.556 1.00 24.42 N ATOM 0 H HIS A 3 16.248 40.831 -12.693 1.00 63.43 H new ATOM 0 HA HIS A 3 18.983 41.872 -13.119 1.00 71.31 H new ATOM 0 HB2 HIS A 3 16.861 43.209 -13.498 1.00 0.20 H new ATOM 0 HB3 HIS A 3 16.555 43.116 -11.775 1.00 0.20 H new ATOM 0 HD2 HIS A 3 18.170 44.837 -10.177 1.00 61.14 H new ATOM 0 HE1 HIS A 3 20.058 46.775 -13.434 1.00 60.51 H new ATOM 0 HE2 HIS A 3 19.674 46.822 -10.927 1.00 24.42 H new ATOM 45 N HIS A 4 19.504 40.411 -10.957 1.00 3.45 N ATOM 46 CA HIS A 4 20.029 39.828 -9.697 1.00 12.51 C ATOM 47 C HIS A 4 18.885 39.463 -8.707 1.00 71.42 C ATOM 48 O HIS A 4 18.749 40.049 -7.628 1.00 10.31 O ATOM 49 CB HIS A 4 21.117 40.744 -9.050 1.00 54.00 C ATOM 50 CG HIS A 4 21.803 40.135 -7.846 1.00 32.51 C ATOM 51 ND1 HIS A 4 22.649 39.048 -7.934 1.00 10.41 N ATOM 52 CD2 HIS A 4 21.738 40.437 -6.522 1.00 2.43 C ATOM 53 CE1 HIS A 4 23.063 38.709 -6.732 1.00 13.31 C ATOM 54 NE2 HIS A 4 22.527 39.535 -5.861 1.00 24.54 N ATOM 0 H HIS A 4 19.859 39.939 -11.789 1.00 3.45 H new ATOM 0 HA HIS A 4 20.523 38.890 -9.951 1.00 12.51 H new ATOM 0 HB2 HIS A 4 21.870 40.982 -9.802 1.00 54.00 H new ATOM 0 HB3 HIS A 4 20.654 41.685 -8.753 1.00 54.00 H new ATOM 0 HD2 HIS A 4 21.170 41.239 -6.075 1.00 2.43 H new ATOM 0 HE1 HIS A 4 23.730 37.891 -6.500 1.00 13.31 H new ATOM 0 HE2 HIS A 4 22.676 39.508 -4.852 1.00 24.54 H new ATOM 63 N HIS A 5 18.020 38.529 -9.134 1.00 31.12 N ATOM 64 CA HIS A 5 16.931 37.968 -8.297 1.00 23.13 C ATOM 65 C HIS A 5 16.739 36.476 -8.620 1.00 4.14 C ATOM 66 O HIS A 5 16.514 36.112 -9.780 1.00 55.05 O ATOM 67 CB HIS A 5 15.597 38.742 -8.498 1.00 24.24 C ATOM 68 CG HIS A 5 15.568 40.094 -7.828 1.00 13.44 C ATOM 69 ND1 HIS A 5 15.977 41.257 -8.447 1.00 11.21 N ATOM 70 CD2 HIS A 5 15.187 40.458 -6.578 1.00 21.44 C ATOM 71 CE1 HIS A 5 15.848 42.265 -7.615 1.00 21.52 C ATOM 72 NE2 HIS A 5 15.375 41.807 -6.479 1.00 21.43 N ATOM 0 H HIS A 5 18.051 38.135 -10.074 1.00 31.12 H new ATOM 0 HA HIS A 5 17.219 38.077 -7.251 1.00 23.13 H new ATOM 0 HB2 HIS A 5 15.421 38.873 -9.566 1.00 24.24 H new ATOM 0 HB3 HIS A 5 14.776 38.138 -8.111 1.00 24.24 H new ATOM 0 HD1 HIS A 5 16.326 41.324 -9.403 1.00 11.21 H new ATOM 0 HD2 HIS A 5 14.807 39.804 -5.807 1.00 21.44 H new ATOM 0 HE1 HIS A 5 16.090 43.296 -7.829 1.00 21.52 H new ATOM 81 N HIS A 6 16.862 35.620 -7.590 1.00 62.32 N ATOM 82 CA HIS A 6 16.666 34.168 -7.726 1.00 2.01 C ATOM 83 C HIS A 6 15.171 33.846 -7.997 1.00 0.45 C ATOM 84 O HIS A 6 14.278 34.411 -7.351 1.00 61.32 O ATOM 85 CB HIS A 6 17.176 33.444 -6.455 1.00 22.24 C ATOM 86 CG HIS A 6 17.068 31.941 -6.519 1.00 32.43 C ATOM 87 ND1 HIS A 6 15.922 31.258 -6.176 1.00 72.35 N ATOM 88 CD2 HIS A 6 17.953 30.996 -6.917 1.00 70.54 C ATOM 89 CE1 HIS A 6 16.105 29.970 -6.358 1.00 34.12 C ATOM 90 NE2 HIS A 6 17.324 29.785 -6.806 1.00 54.14 N ATOM 0 H HIS A 6 17.099 35.915 -6.643 1.00 62.32 H new ATOM 0 HA HIS A 6 17.243 33.808 -8.578 1.00 2.01 H new ATOM 0 HB2 HIS A 6 18.218 33.716 -6.288 1.00 22.24 H new ATOM 0 HB3 HIS A 6 16.611 33.802 -5.594 1.00 22.24 H new ATOM 0 HD2 HIS A 6 18.964 31.166 -7.258 1.00 70.54 H new ATOM 0 HE1 HIS A 6 15.376 29.195 -6.171 1.00 34.12 H new ATOM 0 HE2 HIS A 6 17.738 28.881 -7.035 1.00 54.14 H new ATOM 99 N HIS A 7 14.932 32.929 -8.951 1.00 23.31 N ATOM 100 CA HIS A 7 13.584 32.520 -9.404 1.00 74.34 C ATOM 101 C HIS A 7 12.738 31.922 -8.243 1.00 32.11 C ATOM 102 O HIS A 7 13.259 31.194 -7.396 1.00 12.15 O ATOM 103 CB HIS A 7 13.758 31.506 -10.568 1.00 32.42 C ATOM 104 CG HIS A 7 12.485 30.944 -11.148 1.00 21.34 C ATOM 105 ND1 HIS A 7 11.488 31.729 -11.678 1.00 12.50 N ATOM 106 CD2 HIS A 7 12.065 29.665 -11.304 1.00 51.02 C ATOM 107 CE1 HIS A 7 10.523 30.965 -12.132 1.00 31.20 C ATOM 108 NE2 HIS A 7 10.847 29.712 -11.920 1.00 4.43 N ATOM 0 H HIS A 7 15.682 32.440 -9.440 1.00 23.31 H new ATOM 0 HA HIS A 7 13.033 33.394 -9.752 1.00 74.34 H new ATOM 0 HB2 HIS A 7 14.315 31.993 -11.368 1.00 32.42 H new ATOM 0 HB3 HIS A 7 14.370 30.677 -10.213 1.00 32.42 H new ATOM 0 HD2 HIS A 7 12.595 28.775 -10.998 1.00 51.02 H new ATOM 0 HE1 HIS A 7 9.614 31.310 -12.602 1.00 31.20 H new ATOM 0 HE2 HIS A 7 10.280 28.903 -12.174 1.00 4.43 H new ATOM 117 N HIS A 8 11.437 32.264 -8.211 1.00 5.40 N ATOM 118 CA HIS A 8 10.488 31.774 -7.179 1.00 15.41 C ATOM 119 C HIS A 8 9.967 30.352 -7.511 1.00 61.34 C ATOM 120 O HIS A 8 10.288 29.782 -8.563 1.00 75.12 O ATOM 121 CB HIS A 8 9.303 32.766 -7.029 1.00 2.45 C ATOM 122 CG HIS A 8 9.700 34.139 -6.557 1.00 34.21 C ATOM 123 ND1 HIS A 8 9.765 34.488 -5.225 1.00 4.44 N ATOM 124 CD2 HIS A 8 10.052 35.254 -7.244 1.00 34.35 C ATOM 125 CE1 HIS A 8 10.136 35.746 -5.119 1.00 24.34 C ATOM 126 NE2 HIS A 8 10.315 36.230 -6.325 1.00 14.11 N ATOM 0 H HIS A 8 11.009 32.887 -8.896 1.00 5.40 H new ATOM 0 HA HIS A 8 11.024 31.714 -6.232 1.00 15.41 H new ATOM 0 HB2 HIS A 8 8.797 32.857 -7.990 1.00 2.45 H new ATOM 0 HB3 HIS A 8 8.581 32.348 -6.327 1.00 2.45 H new ATOM 0 HD2 HIS A 8 10.113 35.352 -8.318 1.00 34.35 H new ATOM 0 HE1 HIS A 8 10.270 36.289 -4.195 1.00 24.34 H new ATOM 0 HE2 HIS A 8 10.605 37.184 -6.542 1.00 14.11 H new ATOM 135 N SER A 9 9.154 29.792 -6.595 1.00 35.11 N ATOM 136 CA SER A 9 8.625 28.414 -6.713 1.00 53.13 C ATOM 137 C SER A 9 7.406 28.348 -7.674 1.00 11.04 C ATOM 138 O SER A 9 6.244 28.354 -7.242 1.00 61.31 O ATOM 139 CB SER A 9 8.268 27.867 -5.306 1.00 41.43 C ATOM 140 OG SER A 9 7.890 26.502 -5.347 1.00 31.24 O ATOM 0 H SER A 9 8.844 30.278 -5.753 1.00 35.11 H new ATOM 0 HA SER A 9 9.400 27.783 -7.147 1.00 53.13 H new ATOM 0 HB2 SER A 9 9.125 27.986 -4.643 1.00 41.43 H new ATOM 0 HB3 SER A 9 7.454 28.456 -4.884 1.00 41.43 H new ATOM 0 HG SER A 9 8.650 25.961 -5.647 1.00 31.24 H new ATOM 146 N HIS A 10 7.688 28.340 -8.994 1.00 12.44 N ATOM 147 CA HIS A 10 6.648 28.183 -10.042 1.00 12.34 C ATOM 148 C HIS A 10 6.317 26.685 -10.237 1.00 23.54 C ATOM 149 O HIS A 10 5.148 26.314 -10.398 1.00 20.33 O ATOM 150 CB HIS A 10 7.132 28.842 -11.366 1.00 33.22 C ATOM 151 CG HIS A 10 6.100 28.915 -12.467 1.00 73.53 C ATOM 152 ND1 HIS A 10 6.337 28.499 -13.760 1.00 31.40 N ATOM 153 CD2 HIS A 10 4.837 29.409 -12.469 1.00 71.10 C ATOM 154 CE1 HIS A 10 5.274 28.734 -14.500 1.00 63.34 C ATOM 155 NE2 HIS A 10 4.348 29.281 -13.745 1.00 53.53 N ATOM 0 H HIS A 10 8.633 28.441 -9.365 1.00 12.44 H new ATOM 0 HA HIS A 10 5.733 28.687 -9.731 1.00 12.34 H new ATOM 0 HB2 HIS A 10 7.475 29.853 -11.145 1.00 33.22 H new ATOM 0 HB3 HIS A 10 7.994 28.286 -11.735 1.00 33.22 H new ATOM 0 HD2 HIS A 10 4.312 29.826 -11.622 1.00 71.10 H new ATOM 0 HE1 HIS A 10 5.179 28.514 -15.553 1.00 63.34 H new ATOM 0 HE2 HIS A 10 3.419 29.564 -14.056 1.00 53.53 H new ATOM 164 N MET A 11 7.378 25.853 -10.202 1.00 20.51 N ATOM 165 CA MET A 11 7.300 24.377 -10.231 1.00 65.11 C ATOM 166 C MET A 11 8.731 23.781 -10.107 1.00 40.33 C ATOM 167 O MET A 11 9.570 23.992 -10.986 1.00 73.44 O ATOM 168 CB MET A 11 6.608 23.854 -11.530 1.00 12.04 C ATOM 169 CG MET A 11 6.283 22.358 -11.501 1.00 62.43 C ATOM 170 SD MET A 11 5.340 21.782 -12.934 1.00 60.12 S ATOM 171 CE MET A 11 6.496 22.009 -14.286 1.00 61.31 C ATOM 0 H MET A 11 8.337 26.197 -10.152 1.00 20.51 H new ATOM 0 HA MET A 11 6.690 24.054 -9.388 1.00 65.11 H new ATOM 0 HB2 MET A 11 5.686 24.413 -11.689 1.00 12.04 H new ATOM 0 HB3 MET A 11 7.256 24.059 -12.382 1.00 12.04 H new ATOM 0 HG2 MET A 11 7.215 21.795 -11.442 1.00 62.43 H new ATOM 0 HG3 MET A 11 5.719 22.137 -10.595 1.00 62.43 H new ATOM 0 HE1 MET A 11 6.073 21.593 -15.200 1.00 61.31 H new ATOM 0 HE2 MET A 11 6.687 23.073 -14.426 1.00 61.31 H new ATOM 0 HE3 MET A 11 7.431 21.499 -14.054 1.00 61.31 H new ATOM 181 N ASP A 12 9.009 23.062 -9.003 1.00 62.24 N ATOM 182 CA ASP A 12 10.331 22.417 -8.759 1.00 32.34 C ATOM 183 C ASP A 12 10.430 21.019 -9.411 1.00 2.53 C ATOM 184 O ASP A 12 9.553 20.612 -10.165 1.00 42.52 O ATOM 185 CB ASP A 12 10.582 22.319 -7.236 1.00 60.32 C ATOM 186 CG ASP A 12 10.642 23.701 -6.592 1.00 41.21 C ATOM 187 OD1 ASP A 12 11.733 24.310 -6.578 1.00 61.41 O ATOM 188 OD2 ASP A 12 9.592 24.201 -6.142 1.00 64.35 O ATOM 0 H ASP A 12 8.334 22.907 -8.254 1.00 62.24 H new ATOM 0 HA ASP A 12 11.097 23.038 -9.222 1.00 32.34 H new ATOM 0 HB2 ASP A 12 9.788 21.734 -6.772 1.00 60.32 H new ATOM 0 HB3 ASP A 12 11.517 21.790 -7.053 1.00 60.32 H new ATOM 193 N THR A 13 11.550 20.326 -9.160 1.00 75.31 N ATOM 194 CA THR A 13 11.727 18.904 -9.536 1.00 71.21 C ATOM 195 C THR A 13 11.486 17.988 -8.300 1.00 11.14 C ATOM 196 O THR A 13 11.820 18.388 -7.170 1.00 14.41 O ATOM 197 CB THR A 13 13.151 18.643 -10.159 1.00 73.43 C ATOM 198 OG1 THR A 13 13.289 17.267 -10.544 1.00 60.25 O ATOM 199 CG2 THR A 13 14.301 19.017 -9.216 1.00 51.02 C ATOM 0 H THR A 13 12.361 20.729 -8.691 1.00 75.31 H new ATOM 0 HA THR A 13 10.989 18.662 -10.301 1.00 71.21 H new ATOM 0 HB THR A 13 13.219 19.290 -11.034 1.00 73.43 H new ATOM 0 HG1 THR A 13 14.235 17.065 -10.702 1.00 60.25 H new ATOM 0 HG21 THR A 13 15.254 18.813 -9.705 1.00 51.02 H new ATOM 0 HG22 THR A 13 14.239 20.077 -8.969 1.00 51.02 H new ATOM 0 HG23 THR A 13 14.229 18.427 -8.302 1.00 51.02 H new ATOM 207 N PRO A 14 10.889 16.750 -8.481 1.00 73.11 N ATOM 208 CA PRO A 14 10.662 15.793 -7.358 1.00 13.12 C ATOM 209 C PRO A 14 11.972 15.412 -6.633 1.00 43.55 C ATOM 210 O PRO A 14 11.959 15.107 -5.442 1.00 1.55 O ATOM 211 CB PRO A 14 10.026 14.555 -8.042 1.00 20.24 C ATOM 212 CG PRO A 14 9.509 15.043 -9.363 1.00 31.31 C ATOM 213 CD PRO A 14 10.394 16.201 -9.770 1.00 43.41 C ATOM 0 HA PRO A 14 10.030 16.226 -6.582 1.00 13.12 H new ATOM 0 HB2 PRO A 14 10.761 13.762 -8.178 1.00 20.24 H new ATOM 0 HB3 PRO A 14 9.221 14.142 -7.434 1.00 20.24 H new ATOM 0 HG2 PRO A 14 9.541 14.249 -10.109 1.00 31.31 H new ATOM 0 HG3 PRO A 14 8.469 15.360 -9.280 1.00 31.31 H new ATOM 0 HD2 PRO A 14 11.216 15.870 -10.404 1.00 43.41 H new ATOM 0 HD3 PRO A 14 9.837 16.949 -10.334 1.00 43.41 H new ATOM 221 N GLU A 15 13.080 15.428 -7.406 1.00 61.34 N ATOM 222 CA GLU A 15 14.454 15.198 -6.915 1.00 22.35 C ATOM 223 C GLU A 15 14.798 16.064 -5.676 1.00 41.42 C ATOM 224 O GLU A 15 15.134 15.527 -4.625 1.00 54.43 O ATOM 225 CB GLU A 15 15.459 15.484 -8.069 1.00 31.30 C ATOM 226 CG GLU A 15 15.275 14.585 -9.314 1.00 24.41 C ATOM 227 CD GLU A 15 16.198 14.965 -10.489 1.00 10.23 C ATOM 228 OE1 GLU A 15 15.871 15.914 -11.232 1.00 64.32 O ATOM 229 OE2 GLU A 15 17.252 14.317 -10.676 1.00 34.33 O ATOM 0 H GLU A 15 13.042 15.605 -8.410 1.00 61.34 H new ATOM 0 HA GLU A 15 14.527 14.158 -6.597 1.00 22.35 H new ATOM 0 HB2 GLU A 15 15.360 16.527 -8.371 1.00 31.30 H new ATOM 0 HB3 GLU A 15 16.473 15.357 -7.691 1.00 31.30 H new ATOM 0 HG2 GLU A 15 15.464 13.548 -9.035 1.00 24.41 H new ATOM 0 HG3 GLU A 15 14.238 14.643 -9.644 1.00 24.41 H new ATOM 236 N ASN A 16 14.674 17.400 -5.807 1.00 34.02 N ATOM 237 CA ASN A 16 15.008 18.349 -4.714 1.00 23.45 C ATOM 238 C ASN A 16 14.024 18.224 -3.523 1.00 2.52 C ATOM 239 O ASN A 16 14.452 18.170 -2.361 1.00 12.23 O ATOM 240 CB ASN A 16 15.042 19.803 -5.252 1.00 21.05 C ATOM 241 CG ASN A 16 16.123 20.028 -6.319 1.00 62.14 C ATOM 242 OD1 ASN A 16 17.136 19.339 -6.360 1.00 20.40 O ATOM 243 ND2 ASN A 16 15.926 21.001 -7.181 1.00 35.12 N ATOM 0 H ASN A 16 14.344 17.852 -6.660 1.00 34.02 H new ATOM 0 HA ASN A 16 16.000 18.091 -4.342 1.00 23.45 H new ATOM 0 HB2 ASN A 16 14.068 20.051 -5.673 1.00 21.05 H new ATOM 0 HB3 ASN A 16 15.213 20.487 -4.421 1.00 21.05 H new ATOM 0 HD21 ASN A 16 16.623 21.194 -7.901 1.00 35.12 H new ATOM 0 HD22 ASN A 16 15.076 21.563 -7.130 1.00 35.12 H new ATOM 250 N VAL A 17 12.711 18.136 -3.840 1.00 24.01 N ATOM 251 CA VAL A 17 11.630 17.957 -2.831 1.00 61.12 C ATOM 252 C VAL A 17 11.903 16.731 -1.911 1.00 43.13 C ATOM 253 O VAL A 17 11.821 16.823 -0.690 1.00 54.40 O ATOM 254 CB VAL A 17 10.220 17.803 -3.532 1.00 20.12 C ATOM 255 CG1 VAL A 17 9.074 17.564 -2.510 1.00 11.52 C ATOM 256 CG2 VAL A 17 9.904 19.028 -4.433 1.00 21.31 C ATOM 0 H VAL A 17 12.367 18.186 -4.799 1.00 24.01 H new ATOM 0 HA VAL A 17 11.618 18.853 -2.210 1.00 61.12 H new ATOM 0 HB VAL A 17 10.280 16.916 -4.163 1.00 20.12 H new ATOM 0 HG11 VAL A 17 8.127 17.465 -3.041 1.00 11.52 H new ATOM 0 HG12 VAL A 17 9.272 16.651 -1.948 1.00 11.52 H new ATOM 0 HG13 VAL A 17 9.018 18.408 -1.823 1.00 11.52 H new ATOM 0 HG21 VAL A 17 8.929 18.893 -4.901 1.00 21.31 H new ATOM 0 HG22 VAL A 17 9.893 19.933 -3.826 1.00 21.31 H new ATOM 0 HG23 VAL A 17 10.668 19.118 -5.205 1.00 21.31 H new ATOM 266 N LEU A 18 12.286 15.615 -2.532 1.00 43.32 N ATOM 267 CA LEU A 18 12.607 14.348 -1.843 1.00 31.32 C ATOM 268 C LEU A 18 13.907 14.460 -1.007 1.00 3.21 C ATOM 269 O LEU A 18 13.921 14.095 0.176 1.00 24.10 O ATOM 270 CB LEU A 18 12.684 13.235 -2.914 1.00 35.43 C ATOM 271 CG LEU A 18 13.096 11.789 -2.470 1.00 73.34 C ATOM 272 CD1 LEU A 18 12.424 11.343 -1.152 1.00 43.30 C ATOM 273 CD2 LEU A 18 12.760 10.804 -3.597 1.00 2.11 C ATOM 0 H LEU A 18 12.386 15.557 -3.545 1.00 43.32 H new ATOM 0 HA LEU A 18 11.826 14.104 -1.123 1.00 31.32 H new ATOM 0 HB2 LEU A 18 11.707 13.168 -3.392 1.00 35.43 H new ATOM 0 HB3 LEU A 18 13.390 13.560 -3.678 1.00 35.43 H new ATOM 0 HG LEU A 18 14.169 11.799 -2.277 1.00 73.34 H new ATOM 0 HD11 LEU A 18 12.751 10.334 -0.900 1.00 43.30 H new ATOM 0 HD12 LEU A 18 12.706 12.026 -0.351 1.00 43.30 H new ATOM 0 HD13 LEU A 18 11.341 11.354 -1.274 1.00 43.30 H new ATOM 0 HD21 LEU A 18 13.044 9.796 -3.296 1.00 2.11 H new ATOM 0 HD22 LEU A 18 11.689 10.834 -3.800 1.00 2.11 H new ATOM 0 HD23 LEU A 18 13.308 11.081 -4.498 1.00 2.11 H new ATOM 285 N GLN A 19 14.971 15.015 -1.614 1.00 22.22 N ATOM 286 CA GLN A 19 16.271 15.215 -0.929 1.00 72.45 C ATOM 287 C GLN A 19 16.148 16.145 0.306 1.00 1.42 C ATOM 288 O GLN A 19 16.992 16.083 1.207 1.00 70.13 O ATOM 289 CB GLN A 19 17.336 15.758 -1.922 1.00 13.44 C ATOM 290 CG GLN A 19 17.709 14.775 -3.049 1.00 31.31 C ATOM 291 CD GLN A 19 18.722 15.348 -4.044 1.00 75.43 C ATOM 292 OE1 GLN A 19 19.931 15.210 -3.877 1.00 45.34 O ATOM 293 NE2 GLN A 19 18.238 16.009 -5.076 1.00 70.54 N ATOM 0 H GLN A 19 14.961 15.336 -2.582 1.00 22.22 H new ATOM 0 HA GLN A 19 16.595 14.240 -0.564 1.00 72.45 H new ATOM 0 HB2 GLN A 19 16.964 16.680 -2.368 1.00 13.44 H new ATOM 0 HB3 GLN A 19 18.238 16.014 -1.366 1.00 13.44 H new ATOM 0 HG2 GLN A 19 18.118 13.866 -2.608 1.00 31.31 H new ATOM 0 HG3 GLN A 19 16.805 14.489 -3.586 1.00 31.31 H new ATOM 0 HE21 GLN A 19 17.229 16.108 -5.190 1.00 70.54 H new ATOM 0 HE22 GLN A 19 18.872 16.421 -5.760 1.00 70.54 H new ATOM 302 N MET A 20 15.099 17.002 0.339 1.00 13.12 N ATOM 303 CA MET A 20 14.795 17.835 1.525 1.00 33.33 C ATOM 304 C MET A 20 14.457 16.990 2.784 1.00 11.05 C ATOM 305 O MET A 20 15.013 17.244 3.858 1.00 41.55 O ATOM 306 CB MET A 20 13.653 18.845 1.247 1.00 4.35 C ATOM 307 CG MET A 20 13.997 19.969 0.269 1.00 42.24 C ATOM 308 SD MET A 20 12.833 21.351 0.360 1.00 50.03 S ATOM 309 CE MET A 20 11.262 20.572 -0.021 1.00 73.22 C ATOM 0 H MET A 20 14.453 17.133 -0.439 1.00 13.12 H new ATOM 0 HA MET A 20 15.710 18.390 1.732 1.00 33.33 H new ATOM 0 HB2 MET A 20 12.794 18.298 0.859 1.00 4.35 H new ATOM 0 HB3 MET A 20 13.346 19.291 2.193 1.00 4.35 H new ATOM 0 HG2 MET A 20 15.003 20.332 0.478 1.00 42.24 H new ATOM 0 HG3 MET A 20 14.006 19.572 -0.746 1.00 42.24 H new ATOM 0 HE1 MET A 20 10.852 21.007 -0.932 1.00 73.22 H new ATOM 0 HE2 MET A 20 11.412 19.502 -0.166 1.00 73.22 H new ATOM 0 HE3 MET A 20 10.567 20.733 0.803 1.00 73.22 H new ATOM 319 N LEU A 21 13.533 16.001 2.672 1.00 73.45 N ATOM 320 CA LEU A 21 13.208 15.113 3.825 1.00 41.40 C ATOM 321 C LEU A 21 14.372 14.150 4.143 1.00 52.40 C ATOM 322 O LEU A 21 14.528 13.730 5.284 1.00 4.41 O ATOM 323 CB LEU A 21 11.847 14.354 3.643 1.00 51.32 C ATOM 324 CG LEU A 21 11.656 13.384 2.418 1.00 31.24 C ATOM 325 CD1 LEU A 21 12.422 12.050 2.572 1.00 54.03 C ATOM 326 CD2 LEU A 21 10.159 13.109 2.167 1.00 71.40 C ATOM 0 H LEU A 21 13.010 15.799 1.820 1.00 73.45 H new ATOM 0 HA LEU A 21 13.076 15.762 4.691 1.00 41.40 H new ATOM 0 HB2 LEU A 21 11.674 13.773 4.549 1.00 51.32 H new ATOM 0 HB3 LEU A 21 11.059 15.105 3.590 1.00 51.32 H new ATOM 0 HG LEU A 21 12.082 13.896 1.556 1.00 31.24 H new ATOM 0 HD11 LEU A 21 12.248 11.427 1.694 1.00 54.03 H new ATOM 0 HD12 LEU A 21 13.489 12.252 2.668 1.00 54.03 H new ATOM 0 HD13 LEU A 21 12.070 11.529 3.462 1.00 54.03 H new ATOM 0 HD21 LEU A 21 10.050 12.437 1.316 1.00 71.40 H new ATOM 0 HD22 LEU A 21 9.720 12.648 3.052 1.00 71.40 H new ATOM 0 HD23 LEU A 21 9.647 14.048 1.955 1.00 71.40 H new ATOM 338 N GLU A 22 15.169 13.804 3.111 1.00 23.24 N ATOM 339 CA GLU A 22 16.384 12.972 3.270 1.00 21.05 C ATOM 340 C GLU A 22 17.490 13.731 4.050 1.00 50.03 C ATOM 341 O GLU A 22 18.284 13.118 4.779 1.00 62.00 O ATOM 342 CB GLU A 22 16.900 12.501 1.888 1.00 64.42 C ATOM 343 CG GLU A 22 15.910 11.607 1.106 1.00 13.01 C ATOM 344 CD GLU A 22 16.502 11.039 -0.191 1.00 63.34 C ATOM 345 OE1 GLU A 22 16.472 11.731 -1.230 1.00 30.44 O ATOM 346 OE2 GLU A 22 17.031 9.905 -0.170 1.00 2.31 O ATOM 0 H GLU A 22 14.992 14.091 2.148 1.00 23.24 H new ATOM 0 HA GLU A 22 16.118 12.092 3.856 1.00 21.05 H new ATOM 0 HB2 GLU A 22 17.134 13.377 1.284 1.00 64.42 H new ATOM 0 HB3 GLU A 22 17.832 11.953 2.029 1.00 64.42 H new ATOM 0 HG2 GLU A 22 15.593 10.782 1.745 1.00 13.01 H new ATOM 0 HG3 GLU A 22 15.018 12.186 0.867 1.00 13.01 H new ATOM 353 N ALA A 23 17.511 15.073 3.897 1.00 55.30 N ATOM 354 CA ALA A 23 18.363 15.971 4.708 1.00 14.43 C ATOM 355 C ALA A 23 17.977 15.899 6.206 1.00 54.35 C ATOM 356 O ALA A 23 18.825 16.077 7.082 1.00 14.20 O ATOM 357 CB ALA A 23 18.270 17.411 4.184 1.00 60.22 C ATOM 0 H ALA A 23 16.939 15.564 3.209 1.00 55.30 H new ATOM 0 HA ALA A 23 19.397 15.639 4.617 1.00 14.43 H new ATOM 0 HB1 ALA A 23 18.902 18.060 4.790 1.00 60.22 H new ATOM 0 HB2 ALA A 23 18.605 17.443 3.147 1.00 60.22 H new ATOM 0 HB3 ALA A 23 17.237 17.753 4.242 1.00 60.22 H new ATOM 363 N HIS A 24 16.680 15.643 6.479 1.00 35.45 N ATOM 364 CA HIS A 24 16.194 15.312 7.837 1.00 34.30 C ATOM 365 C HIS A 24 16.561 13.855 8.224 1.00 1.30 C ATOM 366 O HIS A 24 16.920 13.604 9.362 1.00 60.20 O ATOM 367 CB HIS A 24 14.664 15.533 7.961 1.00 22.54 C ATOM 368 CG HIS A 24 14.227 16.978 7.892 1.00 72.31 C ATOM 369 ND1 HIS A 24 14.022 17.799 6.838 1.00 30.31 N flip ATOM 370 CD2 HIS A 24 13.920 17.731 9.009 1.00 14.43 C flip ATOM 371 CE1 HIS A 24 13.605 19.006 7.333 1.00 4.11 C flip ATOM 372 NE2 HIS A 24 13.550 18.938 8.643 1.00 72.41 N flip ATOM 0 H HIS A 24 15.945 15.659 5.772 1.00 35.45 H new ATOM 0 HA HIS A 24 16.692 15.988 8.532 1.00 34.30 H new ATOM 0 HB2 HIS A 24 14.165 14.978 7.166 1.00 22.54 H new ATOM 0 HB3 HIS A 24 14.325 15.110 8.907 1.00 22.54 H new ATOM 0 HD1 HIS A 24 14.154 17.563 5.854 1.00 30.31 H new ATOM 0 HD2 HIS A 24 13.976 17.381 10.029 1.00 14.43 H new ATOM 0 HE1 HIS A 24 13.360 19.875 6.740 1.00 4.11 H new ATOM 381 N MET A 25 16.490 12.912 7.258 1.00 23.14 N ATOM 382 CA MET A 25 16.816 11.473 7.490 1.00 63.54 C ATOM 383 C MET A 25 18.308 11.243 7.834 1.00 3.44 C ATOM 384 O MET A 25 18.670 10.178 8.343 1.00 20.13 O ATOM 385 CB MET A 25 16.414 10.608 6.264 1.00 72.40 C ATOM 386 CG MET A 25 14.910 10.587 6.006 1.00 64.34 C ATOM 387 SD MET A 25 14.002 10.068 7.475 1.00 43.41 S ATOM 388 CE MET A 25 12.374 10.694 7.109 1.00 50.31 C ATOM 0 H MET A 25 16.208 13.117 6.300 1.00 23.14 H new ATOM 0 HA MET A 25 16.232 11.163 8.357 1.00 63.54 H new ATOM 0 HB2 MET A 25 16.922 10.988 5.378 1.00 72.40 H new ATOM 0 HB3 MET A 25 16.763 9.587 6.418 1.00 72.40 H new ATOM 0 HG2 MET A 25 14.577 11.579 5.701 1.00 64.34 H new ATOM 0 HG3 MET A 25 14.690 9.910 5.181 1.00 64.34 H new ATOM 0 HE1 MET A 25 11.625 9.967 7.423 1.00 50.31 H new ATOM 0 HE2 MET A 25 12.216 11.631 7.643 1.00 50.31 H new ATOM 0 HE3 MET A 25 12.284 10.868 6.037 1.00 50.31 H new ATOM 398 N GLN A 26 19.166 12.231 7.507 1.00 5.52 N ATOM 399 CA GLN A 26 20.595 12.240 7.922 1.00 41.15 C ATOM 400 C GLN A 26 20.801 12.045 9.459 1.00 34.42 C ATOM 401 O GLN A 26 21.829 11.505 9.882 1.00 15.24 O ATOM 402 CB GLN A 26 21.293 13.545 7.451 1.00 62.11 C ATOM 403 CG GLN A 26 21.213 13.817 5.932 1.00 14.51 C ATOM 404 CD GLN A 26 21.783 12.699 5.045 1.00 23.31 C ATOM 405 OE1 GLN A 26 22.732 12.009 5.400 1.00 2.53 O ATOM 406 NE2 GLN A 26 21.174 12.484 3.892 1.00 44.45 N ATOM 0 H GLN A 26 18.896 13.043 6.952 1.00 5.52 H new ATOM 0 HA GLN A 26 21.055 11.380 7.435 1.00 41.15 H new ATOM 0 HB2 GLN A 26 20.848 14.388 7.980 1.00 62.11 H new ATOM 0 HB3 GLN A 26 22.342 13.503 7.743 1.00 62.11 H new ATOM 0 HG2 GLN A 26 20.170 13.980 5.661 1.00 14.51 H new ATOM 0 HG3 GLN A 26 21.747 14.742 5.714 1.00 14.51 H new ATOM 0 HE21 GLN A 26 20.386 13.069 3.615 1.00 44.45 H new ATOM 0 HE22 GLN A 26 21.492 11.733 3.280 1.00 44.45 H new ATOM 415 N SER A 27 19.829 12.491 10.282 1.00 24.40 N ATOM 416 CA SER A 27 19.837 12.257 11.762 1.00 10.51 C ATOM 417 C SER A 27 18.494 11.664 12.229 1.00 51.43 C ATOM 418 O SER A 27 18.476 10.635 12.905 1.00 50.05 O ATOM 419 CB SER A 27 20.127 13.577 12.524 1.00 13.44 C ATOM 420 OG SER A 27 20.159 13.385 13.936 1.00 42.04 O ATOM 0 H SER A 27 19.020 13.019 9.955 1.00 24.40 H new ATOM 0 HA SER A 27 20.630 11.543 11.984 1.00 10.51 H new ATOM 0 HB2 SER A 27 21.082 13.984 12.192 1.00 13.44 H new ATOM 0 HB3 SER A 27 19.363 14.314 12.276 1.00 13.44 H new ATOM 0 HG SER A 27 20.346 14.239 14.378 1.00 42.04 H new ATOM 426 N TYR A 28 17.395 12.315 11.781 1.00 12.12 N ATOM 427 CA TYR A 28 15.963 12.062 12.156 1.00 33.14 C ATOM 428 C TYR A 28 15.748 11.623 13.641 1.00 62.32 C ATOM 429 O TYR A 28 16.021 10.486 14.019 1.00 12.11 O ATOM 430 CB TYR A 28 15.256 11.106 11.128 1.00 44.33 C ATOM 431 CG TYR A 28 15.598 9.598 11.210 1.00 40.20 C ATOM 432 CD1 TYR A 28 16.795 9.085 10.704 1.00 61.31 C ATOM 433 CD2 TYR A 28 14.716 8.690 11.803 1.00 32.11 C ATOM 434 CE1 TYR A 28 17.093 7.737 10.785 1.00 74.55 C ATOM 435 CE2 TYR A 28 15.011 7.348 11.883 1.00 73.04 C ATOM 436 CZ TYR A 28 16.198 6.876 11.375 1.00 54.54 C ATOM 437 OH TYR A 28 16.483 5.528 11.452 1.00 74.31 O ATOM 0 H TYR A 28 17.477 13.077 11.108 1.00 12.12 H new ATOM 0 HA TYR A 28 15.470 13.032 12.094 1.00 33.14 H new ATOM 0 HB2 TYR A 28 14.179 11.215 11.252 1.00 44.33 H new ATOM 0 HB3 TYR A 28 15.498 11.453 10.123 1.00 44.33 H new ATOM 0 HD1 TYR A 28 17.503 9.756 10.240 1.00 61.31 H new ATOM 0 HD2 TYR A 28 13.782 9.050 12.208 1.00 32.11 H new ATOM 0 HE1 TYR A 28 18.024 7.362 10.387 1.00 74.55 H new ATOM 0 HE2 TYR A 28 14.311 6.667 12.344 1.00 73.04 H new ATOM 0 HH TYR A 28 15.746 5.063 11.899 1.00 74.31 H new ATOM 447 N LYS A 29 15.270 12.547 14.496 1.00 3.35 N ATOM 448 CA LYS A 29 15.129 12.293 15.958 1.00 42.23 C ATOM 449 C LYS A 29 13.718 12.669 16.478 1.00 21.25 C ATOM 450 O LYS A 29 12.963 13.363 15.798 1.00 74.35 O ATOM 451 CB LYS A 29 16.227 13.074 16.740 1.00 40.33 C ATOM 452 CG LYS A 29 17.685 12.691 16.369 1.00 1.12 C ATOM 453 CD LYS A 29 18.011 11.202 16.669 1.00 5.13 C ATOM 454 CE LYS A 29 19.388 10.770 16.136 1.00 2.45 C ATOM 455 NZ LYS A 29 20.503 11.542 16.732 1.00 2.54 N ATOM 0 H LYS A 29 14.973 13.479 14.207 1.00 3.35 H new ATOM 0 HA LYS A 29 15.259 11.224 16.126 1.00 42.23 H new ATOM 0 HB2 LYS A 29 16.090 14.141 16.563 1.00 40.33 H new ATOM 0 HB3 LYS A 29 16.082 12.906 17.807 1.00 40.33 H new ATOM 0 HG2 LYS A 29 17.849 12.888 15.310 1.00 1.12 H new ATOM 0 HG3 LYS A 29 18.375 13.328 16.922 1.00 1.12 H new ATOM 0 HD2 LYS A 29 17.976 11.038 17.746 1.00 5.13 H new ATOM 0 HD3 LYS A 29 17.241 10.571 16.225 1.00 5.13 H new ATOM 0 HE2 LYS A 29 19.536 9.710 16.342 1.00 2.45 H new ATOM 0 HE3 LYS A 29 19.407 10.890 15.053 1.00 2.45 H new ATOM 0 HZ1 LYS A 29 21.406 11.209 16.337 1.00 2.54 H new ATOM 0 HZ2 LYS A 29 20.381 12.552 16.515 1.00 2.54 H new ATOM 0 HZ3 LYS A 29 20.506 11.408 17.763 1.00 2.54 H new ATOM 469 N GLY A 30 13.380 12.196 17.698 1.00 64.23 N ATOM 470 CA GLY A 30 12.084 12.485 18.340 1.00 44.04 C ATOM 471 C GLY A 30 10.918 11.640 17.796 1.00 3.43 C ATOM 472 O GLY A 30 10.788 10.462 18.151 1.00 3.52 O ATOM 0 H GLY A 30 13.995 11.607 18.260 1.00 64.23 H new ATOM 0 HA2 GLY A 30 12.175 12.314 19.413 1.00 44.04 H new ATOM 0 HA3 GLY A 30 11.849 13.541 18.204 1.00 44.04 H new ATOM 476 N ASN A 31 10.092 12.248 16.920 1.00 60.40 N ATOM 477 CA ASN A 31 8.881 11.605 16.336 1.00 52.14 C ATOM 478 C ASN A 31 9.251 10.588 15.215 1.00 33.51 C ATOM 479 O ASN A 31 10.379 10.598 14.718 1.00 44.11 O ATOM 480 CB ASN A 31 7.935 12.714 15.786 1.00 75.22 C ATOM 481 CG ASN A 31 6.562 12.199 15.339 1.00 32.54 C ATOM 482 OD1 ASN A 31 6.004 11.281 15.929 1.00 25.23 O ATOM 483 ND2 ASN A 31 6.025 12.760 14.282 1.00 3.31 N ATOM 0 H ASN A 31 10.241 13.202 16.592 1.00 60.40 H new ATOM 0 HA ASN A 31 8.372 11.041 17.118 1.00 52.14 H new ATOM 0 HB2 ASN A 31 7.794 13.472 16.557 1.00 75.22 H new ATOM 0 HB3 ASN A 31 8.420 13.205 14.942 1.00 75.22 H new ATOM 0 HD21 ASN A 31 5.123 12.434 13.934 1.00 3.31 H new ATOM 0 HD22 ASN A 31 6.509 13.523 13.808 1.00 3.31 H new ATOM 490 N ASP A 32 8.282 9.722 14.835 1.00 33.34 N ATOM 491 CA ASP A 32 8.439 8.711 13.754 1.00 2.13 C ATOM 492 C ASP A 32 8.915 9.341 12.414 1.00 71.24 C ATOM 493 O ASP A 32 8.353 10.359 11.995 1.00 40.35 O ATOM 494 CB ASP A 32 7.097 7.982 13.515 1.00 34.11 C ATOM 495 CG ASP A 32 6.577 7.299 14.779 1.00 31.01 C ATOM 496 OD1 ASP A 32 7.010 6.170 15.082 1.00 53.15 O ATOM 497 OD2 ASP A 32 5.758 7.904 15.492 1.00 14.22 O ATOM 0 H ASP A 32 7.360 9.703 15.272 1.00 33.34 H new ATOM 0 HA ASP A 32 9.204 8.009 14.086 1.00 2.13 H new ATOM 0 HB2 ASP A 32 6.355 8.697 13.160 1.00 34.11 H new ATOM 0 HB3 ASP A 32 7.225 7.238 12.729 1.00 34.11 H new ATOM 502 N PRO A 33 9.959 8.747 11.728 1.00 15.12 N ATOM 503 CA PRO A 33 10.459 9.241 10.409 1.00 4.10 C ATOM 504 C PRO A 33 9.354 9.337 9.321 1.00 21.31 C ATOM 505 O PRO A 33 9.428 10.200 8.443 1.00 4.54 O ATOM 506 CB PRO A 33 11.560 8.213 10.027 1.00 23.52 C ATOM 507 CG PRO A 33 11.319 7.023 10.912 1.00 20.40 C ATOM 508 CD PRO A 33 10.751 7.578 12.194 1.00 43.53 C ATOM 0 HA PRO A 33 10.830 10.264 10.479 1.00 4.10 H new ATOM 0 HB2 PRO A 33 11.494 7.939 8.974 1.00 23.52 H new ATOM 0 HB3 PRO A 33 12.556 8.626 10.187 1.00 23.52 H new ATOM 0 HG2 PRO A 33 10.625 6.323 10.447 1.00 20.40 H new ATOM 0 HG3 PRO A 33 12.245 6.478 11.097 1.00 20.40 H new ATOM 0 HD2 PRO A 33 10.128 6.847 12.709 1.00 43.53 H new ATOM 0 HD3 PRO A 33 11.537 7.874 12.889 1.00 43.53 H new ATOM 516 N LEU A 34 8.323 8.455 9.396 1.00 34.22 N ATOM 517 CA LEU A 34 7.137 8.531 8.500 1.00 52.05 C ATOM 518 C LEU A 34 6.426 9.890 8.635 1.00 3.00 C ATOM 519 O LEU A 34 5.980 10.431 7.643 1.00 74.32 O ATOM 520 CB LEU A 34 6.137 7.375 8.765 1.00 4.35 C ATOM 521 CG LEU A 34 4.836 7.332 7.875 1.00 32.22 C ATOM 522 CD1 LEU A 34 5.160 7.269 6.367 1.00 24.25 C ATOM 523 CD2 LEU A 34 3.911 6.166 8.284 1.00 52.52 C ATOM 0 H LEU A 34 8.288 7.686 10.065 1.00 34.22 H new ATOM 0 HA LEU A 34 7.504 8.428 7.479 1.00 52.05 H new ATOM 0 HB2 LEU A 34 6.668 6.432 8.634 1.00 4.35 H new ATOM 0 HB3 LEU A 34 5.831 7.426 9.810 1.00 4.35 H new ATOM 0 HG LEU A 34 4.306 8.267 8.054 1.00 32.22 H new ATOM 0 HD11 LEU A 34 4.232 7.241 5.796 1.00 24.25 H new ATOM 0 HD12 LEU A 34 5.735 8.150 6.081 1.00 24.25 H new ATOM 0 HD13 LEU A 34 5.742 6.372 6.157 1.00 24.25 H new ATOM 0 HD21 LEU A 34 3.024 6.166 7.651 1.00 52.52 H new ATOM 0 HD22 LEU A 34 4.442 5.221 8.165 1.00 52.52 H new ATOM 0 HD23 LEU A 34 3.613 6.286 9.326 1.00 52.52 H new ATOM 535 N GLY A 35 6.376 10.434 9.869 1.00 14.40 N ATOM 536 CA GLY A 35 5.839 11.782 10.119 1.00 43.22 C ATOM 537 C GLY A 35 6.460 12.878 9.230 1.00 11.20 C ATOM 538 O GLY A 35 5.750 13.772 8.762 1.00 35.41 O ATOM 0 H GLY A 35 6.703 9.956 10.708 1.00 14.40 H new ATOM 0 HA2 GLY A 35 4.761 11.768 9.961 1.00 43.22 H new ATOM 0 HA3 GLY A 35 6.004 12.040 11.165 1.00 43.22 H new ATOM 542 N GLU A 36 7.783 12.769 8.979 1.00 41.43 N ATOM 543 CA GLU A 36 8.531 13.678 8.074 1.00 22.10 C ATOM 544 C GLU A 36 8.133 13.455 6.593 1.00 20.21 C ATOM 545 O GLU A 36 7.989 14.414 5.834 1.00 32.42 O ATOM 546 CB GLU A 36 10.060 13.464 8.260 1.00 30.12 C ATOM 547 CG GLU A 36 10.977 14.424 7.458 1.00 35.14 C ATOM 548 CD GLU A 36 10.832 15.909 7.854 1.00 13.55 C ATOM 549 OE1 GLU A 36 10.887 16.213 9.063 1.00 40.01 O ATOM 550 OE2 GLU A 36 10.687 16.776 6.968 1.00 71.43 O ATOM 0 H GLU A 36 8.367 12.046 9.399 1.00 41.43 H new ATOM 0 HA GLU A 36 8.275 14.705 8.334 1.00 22.10 H new ATOM 0 HB2 GLU A 36 10.296 13.566 9.319 1.00 30.12 H new ATOM 0 HB3 GLU A 36 10.302 12.440 7.977 1.00 30.12 H new ATOM 0 HG2 GLU A 36 12.014 14.121 7.599 1.00 35.14 H new ATOM 0 HG3 GLU A 36 10.755 14.319 6.396 1.00 35.14 H new ATOM 557 N TRP A 37 7.957 12.177 6.202 1.00 33.03 N ATOM 558 CA TRP A 37 7.464 11.805 4.852 1.00 23.23 C ATOM 559 C TRP A 37 6.049 12.367 4.581 1.00 61.14 C ATOM 560 O TRP A 37 5.803 12.951 3.529 1.00 21.23 O ATOM 561 CB TRP A 37 7.444 10.263 4.676 1.00 42.20 C ATOM 562 CG TRP A 37 8.803 9.650 4.467 1.00 3.25 C ATOM 563 CD1 TRP A 37 9.655 9.159 5.412 1.00 71.32 C ATOM 564 CD2 TRP A 37 9.456 9.452 3.207 1.00 55.43 C ATOM 565 NE1 TRP A 37 10.796 8.684 4.819 1.00 31.33 N ATOM 566 CE2 TRP A 37 10.696 8.854 3.467 1.00 32.32 C ATOM 567 CE3 TRP A 37 9.103 9.732 1.884 1.00 35.33 C ATOM 568 CZ2 TRP A 37 11.588 8.527 2.455 1.00 52.32 C ATOM 569 CZ3 TRP A 37 9.990 9.409 0.883 1.00 33.23 C ATOM 570 CH2 TRP A 37 11.219 8.814 1.173 1.00 22.15 C ATOM 0 H TRP A 37 8.149 11.377 6.804 1.00 33.03 H new ATOM 0 HA TRP A 37 8.155 12.245 4.132 1.00 23.23 H new ATOM 0 HB2 TRP A 37 6.986 9.814 5.557 1.00 42.20 H new ATOM 0 HB3 TRP A 37 6.810 10.013 3.825 1.00 42.20 H new ATOM 0 HD1 TRP A 37 9.459 9.146 6.474 1.00 71.32 H new ATOM 0 HE1 TRP A 37 11.590 8.271 5.308 1.00 31.33 H new ATOM 0 HE3 TRP A 37 8.154 10.192 1.652 1.00 35.33 H new ATOM 0 HZ2 TRP A 37 12.538 8.063 2.674 1.00 52.32 H new ATOM 0 HZ3 TRP A 37 9.731 9.619 -0.144 1.00 33.23 H new ATOM 0 HH2 TRP A 37 11.893 8.575 0.364 1.00 22.15 H new ATOM 581 N GLU A 38 5.150 12.203 5.567 1.00 41.25 N ATOM 582 CA GLU A 38 3.728 12.591 5.466 1.00 71.11 C ATOM 583 C GLU A 38 3.560 14.102 5.217 1.00 3.22 C ATOM 584 O GLU A 38 2.628 14.506 4.517 1.00 42.54 O ATOM 585 CB GLU A 38 2.969 12.164 6.748 1.00 73.31 C ATOM 586 CG GLU A 38 2.932 10.640 6.973 1.00 10.10 C ATOM 587 CD GLU A 38 2.165 10.222 8.233 1.00 52.20 C ATOM 588 OE1 GLU A 38 2.758 10.230 9.333 1.00 31.42 O ATOM 589 OE2 GLU A 38 0.959 9.901 8.130 1.00 62.51 O ATOM 0 H GLU A 38 5.391 11.792 6.469 1.00 41.25 H new ATOM 0 HA GLU A 38 3.302 12.073 4.607 1.00 71.11 H new ATOM 0 HB2 GLU A 38 3.438 12.638 7.611 1.00 73.31 H new ATOM 0 HB3 GLU A 38 1.947 12.539 6.695 1.00 73.31 H new ATOM 0 HG2 GLU A 38 2.475 10.164 6.105 1.00 10.10 H new ATOM 0 HG3 GLU A 38 3.954 10.266 7.040 1.00 10.10 H new ATOM 596 N ARG A 39 4.492 14.913 5.780 1.00 44.11 N ATOM 597 CA ARG A 39 4.589 16.370 5.504 1.00 14.01 C ATOM 598 C ARG A 39 4.670 16.644 3.986 1.00 64.33 C ATOM 599 O ARG A 39 4.020 17.549 3.479 1.00 50.53 O ATOM 600 CB ARG A 39 5.858 16.977 6.168 1.00 45.41 C ATOM 601 CG ARG A 39 5.954 16.828 7.697 1.00 4.31 C ATOM 602 CD ARG A 39 4.886 17.619 8.467 1.00 44.44 C ATOM 603 NE ARG A 39 5.099 17.530 9.922 1.00 31.43 N ATOM 604 CZ ARG A 39 4.472 18.238 10.836 1.00 21.44 C ATOM 605 NH1 ARG A 39 3.536 19.083 10.523 1.00 54.43 N ATOM 606 NH2 ARG A 39 4.777 18.079 12.077 1.00 33.25 N ATOM 0 H ARG A 39 5.196 14.576 6.437 1.00 44.11 H new ATOM 0 HA ARG A 39 3.692 16.831 5.917 1.00 14.01 H new ATOM 0 HB2 ARG A 39 6.736 16.511 5.721 1.00 45.41 H new ATOM 0 HB3 ARG A 39 5.901 18.038 5.922 1.00 45.41 H new ATOM 0 HG2 ARG A 39 5.868 15.773 7.956 1.00 4.31 H new ATOM 0 HG3 ARG A 39 6.941 17.156 8.023 1.00 4.31 H new ATOM 0 HD2 ARG A 39 4.910 18.664 8.157 1.00 44.44 H new ATOM 0 HD3 ARG A 39 3.897 17.236 8.218 1.00 44.44 H new ATOM 0 HE ARG A 39 5.795 16.860 10.250 1.00 31.43 H new ATOM 0 HH11 ARG A 39 3.270 19.211 9.547 1.00 54.43 H new ATOM 0 HH12 ARG A 39 3.067 19.618 11.254 1.00 54.43 H new ATOM 0 HH21 ARG A 39 5.499 17.409 12.343 1.00 33.25 H new ATOM 0 HH22 ARG A 39 4.297 18.623 12.794 1.00 33.25 H new ATOM 620 N TYR A 40 5.476 15.827 3.287 1.00 4.43 N ATOM 621 CA TYR A 40 5.769 15.983 1.846 1.00 62.24 C ATOM 622 C TYR A 40 4.699 15.328 0.959 1.00 55.45 C ATOM 623 O TYR A 40 4.431 15.835 -0.124 1.00 64.31 O ATOM 624 CB TYR A 40 7.165 15.410 1.523 1.00 61.43 C ATOM 625 CG TYR A 40 8.315 16.235 2.117 1.00 71.43 C ATOM 626 CD1 TYR A 40 8.428 16.438 3.494 1.00 53.34 C ATOM 627 CD2 TYR A 40 9.282 16.811 1.306 1.00 35.15 C ATOM 628 CE1 TYR A 40 9.456 17.169 4.031 1.00 51.14 C ATOM 629 CE2 TYR A 40 10.313 17.544 1.842 1.00 12.54 C ATOM 630 CZ TYR A 40 10.397 17.725 3.202 1.00 31.04 C ATOM 631 OH TYR A 40 11.441 18.446 3.734 1.00 54.22 O ATOM 0 H TYR A 40 5.950 15.029 3.709 1.00 4.43 H new ATOM 0 HA TYR A 40 5.757 17.050 1.624 1.00 62.24 H new ATOM 0 HB2 TYR A 40 7.227 14.389 1.901 1.00 61.43 H new ATOM 0 HB3 TYR A 40 7.287 15.357 0.441 1.00 61.43 H new ATOM 0 HD1 TYR A 40 7.687 16.009 4.152 1.00 53.34 H new ATOM 0 HD2 TYR A 40 9.223 16.681 0.235 1.00 35.15 H new ATOM 0 HE1 TYR A 40 9.525 17.306 5.100 1.00 51.14 H new ATOM 0 HE2 TYR A 40 11.059 17.979 1.193 1.00 12.54 H new ATOM 0 HH TYR A 40 11.657 18.100 4.625 1.00 54.22 H new ATOM 641 N ILE A 41 4.106 14.202 1.418 1.00 63.24 N ATOM 642 CA ILE A 41 2.980 13.548 0.703 1.00 5.14 C ATOM 643 C ILE A 41 1.771 14.522 0.616 1.00 33.24 C ATOM 644 O ILE A 41 1.172 14.669 -0.446 1.00 15.44 O ATOM 645 CB ILE A 41 2.550 12.154 1.353 1.00 11.23 C ATOM 646 CG1 ILE A 41 3.470 10.970 0.873 1.00 4.32 C ATOM 647 CG2 ILE A 41 1.056 11.798 1.064 1.00 41.52 C ATOM 648 CD1 ILE A 41 4.936 11.050 1.255 1.00 15.30 C ATOM 0 H ILE A 41 4.385 13.727 2.276 1.00 63.24 H new ATOM 0 HA ILE A 41 3.329 13.314 -0.303 1.00 5.14 H new ATOM 0 HB ILE A 41 2.673 12.282 2.428 1.00 11.23 H new ATOM 0 HG12 ILE A 41 3.064 10.040 1.272 1.00 4.32 H new ATOM 0 HG13 ILE A 41 3.404 10.906 -0.213 1.00 4.32 H new ATOM 0 HG21 ILE A 41 0.814 10.842 1.527 1.00 41.52 H new ATOM 0 HG22 ILE A 41 0.411 12.574 1.475 1.00 41.52 H new ATOM 0 HG23 ILE A 41 0.900 11.730 -0.013 1.00 41.52 H new ATOM 0 HD11 ILE A 41 5.461 10.178 0.866 1.00 15.30 H new ATOM 0 HD12 ILE A 41 5.373 11.955 0.833 1.00 15.30 H new ATOM 0 HD13 ILE A 41 5.028 11.075 2.341 1.00 15.30 H new ATOM 660 N GLN A 42 1.436 15.201 1.737 1.00 2.03 N ATOM 661 CA GLN A 42 0.374 16.232 1.730 1.00 32.31 C ATOM 662 C GLN A 42 0.846 17.540 1.041 1.00 4.34 C ATOM 663 O GLN A 42 0.034 18.229 0.423 1.00 70.51 O ATOM 664 CB GLN A 42 -0.144 16.551 3.156 1.00 50.21 C ATOM 665 CG GLN A 42 0.921 17.097 4.135 1.00 23.30 C ATOM 666 CD GLN A 42 0.354 17.978 5.241 1.00 23.44 C ATOM 667 OE1 GLN A 42 -0.049 17.501 6.295 1.00 15.12 O ATOM 668 NE2 GLN A 42 0.328 19.272 5.002 1.00 50.12 N ATOM 0 H GLN A 42 1.878 15.057 2.645 1.00 2.03 H new ATOM 0 HA GLN A 42 -0.450 15.810 1.154 1.00 32.31 H new ATOM 0 HB2 GLN A 42 -0.951 17.280 3.078 1.00 50.21 H new ATOM 0 HB3 GLN A 42 -0.574 15.644 3.581 1.00 50.21 H new ATOM 0 HG2 GLN A 42 1.448 16.257 4.588 1.00 23.30 H new ATOM 0 HG3 GLN A 42 1.658 17.669 3.571 1.00 23.30 H new ATOM 0 HE21 GLN A 42 0.672 19.633 4.112 1.00 50.12 H new ATOM 0 HE22 GLN A 42 -0.036 19.913 5.706 1.00 50.12 H new ATOM 677 N TRP A 43 2.162 17.865 1.150 1.00 3.32 N ATOM 678 CA TRP A 43 2.737 19.107 0.571 1.00 61.13 C ATOM 679 C TRP A 43 2.594 19.115 -0.968 1.00 53.33 C ATOM 680 O TRP A 43 2.172 20.101 -1.550 1.00 4.11 O ATOM 681 CB TRP A 43 4.229 19.286 0.957 1.00 42.30 C ATOM 682 CG TRP A 43 4.847 20.604 0.516 1.00 71.14 C ATOM 683 CD1 TRP A 43 4.768 21.808 1.164 1.00 25.51 C ATOM 684 CD2 TRP A 43 5.631 20.842 -0.669 1.00 51.40 C ATOM 685 NE1 TRP A 43 5.434 22.772 0.449 1.00 32.11 N ATOM 686 CE2 TRP A 43 5.973 22.205 -0.676 1.00 25.54 C ATOM 687 CE3 TRP A 43 6.065 20.032 -1.728 1.00 4.51 C ATOM 688 CZ2 TRP A 43 6.734 22.779 -1.692 1.00 5.00 C ATOM 689 CZ3 TRP A 43 6.823 20.603 -2.735 1.00 45.52 C ATOM 690 CH2 TRP A 43 7.148 21.966 -2.713 1.00 2.53 C ATOM 0 H TRP A 43 2.845 17.282 1.635 1.00 3.32 H new ATOM 0 HA TRP A 43 2.174 19.942 0.988 1.00 61.13 H new ATOM 0 HB2 TRP A 43 4.323 19.201 2.040 1.00 42.30 H new ATOM 0 HB3 TRP A 43 4.803 18.468 0.522 1.00 42.30 H new ATOM 0 HD1 TRP A 43 4.257 21.975 2.101 1.00 25.51 H new ATOM 0 HE1 TRP A 43 5.515 23.754 0.713 1.00 32.11 H new ATOM 0 HE3 TRP A 43 5.812 18.982 -1.757 1.00 4.51 H new ATOM 0 HZ2 TRP A 43 6.988 23.828 -1.675 1.00 5.00 H new ATOM 0 HZ3 TRP A 43 7.170 19.988 -3.552 1.00 45.52 H new ATOM 0 HH2 TRP A 43 7.736 22.383 -3.517 1.00 2.53 H new ATOM 701 N VAL A 44 2.966 18.007 -1.613 1.00 21.41 N ATOM 702 CA VAL A 44 2.804 17.854 -3.073 1.00 30.13 C ATOM 703 C VAL A 44 1.308 17.844 -3.484 1.00 62.21 C ATOM 704 O VAL A 44 0.968 18.300 -4.557 1.00 63.33 O ATOM 705 CB VAL A 44 3.525 16.569 -3.616 1.00 52.31 C ATOM 706 CG1 VAL A 44 3.059 15.305 -2.880 1.00 10.03 C ATOM 707 CG2 VAL A 44 3.328 16.417 -5.140 1.00 23.33 C ATOM 0 H VAL A 44 3.383 17.198 -1.153 1.00 21.41 H new ATOM 0 HA VAL A 44 3.280 18.722 -3.528 1.00 30.13 H new ATOM 0 HB VAL A 44 4.591 16.693 -3.422 1.00 52.31 H new ATOM 0 HG11 VAL A 44 3.580 14.436 -3.283 1.00 10.03 H new ATOM 0 HG12 VAL A 44 3.281 15.400 -1.817 1.00 10.03 H new ATOM 0 HG13 VAL A 44 1.985 15.180 -3.016 1.00 10.03 H new ATOM 0 HG21 VAL A 44 3.839 15.518 -5.485 1.00 23.33 H new ATOM 0 HG22 VAL A 44 2.264 16.338 -5.363 1.00 23.33 H new ATOM 0 HG23 VAL A 44 3.742 17.288 -5.649 1.00 23.33 H new ATOM 717 N GLU A 45 0.424 17.341 -2.617 1.00 42.44 N ATOM 718 CA GLU A 45 -1.025 17.313 -2.903 1.00 4.03 C ATOM 719 C GLU A 45 -1.654 18.730 -2.873 1.00 21.40 C ATOM 720 O GLU A 45 -2.525 19.044 -3.694 1.00 11.35 O ATOM 721 CB GLU A 45 -1.749 16.337 -1.937 1.00 40.35 C ATOM 722 CG GLU A 45 -1.423 14.845 -2.185 1.00 71.14 C ATOM 723 CD GLU A 45 -1.965 14.296 -3.525 1.00 23.13 C ATOM 724 OE1 GLU A 45 -1.432 14.653 -4.603 1.00 32.44 O ATOM 725 OE2 GLU A 45 -2.934 13.503 -3.517 1.00 62.15 O ATOM 0 H GLU A 45 0.680 16.947 -1.712 1.00 42.44 H new ATOM 0 HA GLU A 45 -1.158 16.943 -3.920 1.00 4.03 H new ATOM 0 HB2 GLU A 45 -1.480 16.591 -0.912 1.00 40.35 H new ATOM 0 HB3 GLU A 45 -2.825 16.483 -2.029 1.00 40.35 H new ATOM 0 HG2 GLU A 45 -0.342 14.711 -2.160 1.00 71.14 H new ATOM 0 HG3 GLU A 45 -1.836 14.253 -1.368 1.00 71.14 H new ATOM 732 N GLU A 46 -1.191 19.585 -1.942 1.00 3.14 N ATOM 733 CA GLU A 46 -1.692 20.977 -1.802 1.00 74.50 C ATOM 734 C GLU A 46 -1.004 21.962 -2.801 1.00 72.14 C ATOM 735 O GLU A 46 -1.649 22.881 -3.304 1.00 33.10 O ATOM 736 CB GLU A 46 -1.527 21.466 -0.330 1.00 54.15 C ATOM 737 CG GLU A 46 -0.073 21.501 0.175 1.00 61.23 C ATOM 738 CD GLU A 46 0.074 21.867 1.662 1.00 32.00 C ATOM 739 OE1 GLU A 46 0.113 23.074 1.987 1.00 35.41 O ATOM 740 OE2 GLU A 46 0.160 20.950 2.507 1.00 2.42 O ATOM 0 H GLU A 46 -0.466 19.339 -1.268 1.00 3.14 H new ATOM 0 HA GLU A 46 -2.752 20.968 -2.054 1.00 74.50 H new ATOM 0 HB2 GLU A 46 -1.952 22.466 -0.244 1.00 54.15 H new ATOM 0 HB3 GLU A 46 -2.109 20.815 0.323 1.00 54.15 H new ATOM 0 HG2 GLU A 46 0.381 20.524 0.007 1.00 61.23 H new ATOM 0 HG3 GLU A 46 0.489 22.220 -0.421 1.00 61.23 H new ATOM 747 N ASN A 47 0.304 21.763 -3.073 1.00 64.23 N ATOM 748 CA ASN A 47 1.101 22.625 -4.000 1.00 52.23 C ATOM 749 C ASN A 47 1.001 22.171 -5.481 1.00 51.12 C ATOM 750 O ASN A 47 0.961 23.002 -6.391 1.00 22.53 O ATOM 751 CB ASN A 47 2.594 22.654 -3.565 1.00 23.23 C ATOM 752 CG ASN A 47 2.840 23.502 -2.315 1.00 41.21 C ATOM 753 OD1 ASN A 47 3.138 24.683 -2.402 1.00 74.22 O ATOM 754 ND2 ASN A 47 2.721 22.917 -1.147 1.00 24.31 N ATOM 0 H ASN A 47 0.845 21.003 -2.661 1.00 64.23 H new ATOM 0 HA ASN A 47 0.674 23.626 -3.936 1.00 52.23 H new ATOM 0 HB2 ASN A 47 2.931 21.635 -3.377 1.00 23.23 H new ATOM 0 HB3 ASN A 47 3.197 23.043 -4.385 1.00 23.23 H new ATOM 0 HD21 ASN A 47 2.878 23.450 -0.291 1.00 24.31 H new ATOM 0 HD22 ASN A 47 2.471 21.929 -1.094 1.00 24.31 H new ATOM 761 N PHE A 48 0.958 20.847 -5.713 1.00 23.05 N ATOM 762 CA PHE A 48 0.975 20.244 -7.081 1.00 23.03 C ATOM 763 C PHE A 48 -0.164 19.166 -7.249 1.00 50.31 C ATOM 764 O PHE A 48 0.138 17.992 -7.517 1.00 74.41 O ATOM 765 CB PHE A 48 2.365 19.574 -7.341 1.00 41.40 C ATOM 766 CG PHE A 48 3.598 20.478 -7.220 1.00 12.12 C ATOM 767 CD1 PHE A 48 3.837 21.493 -8.148 1.00 32.00 C ATOM 768 CD2 PHE A 48 4.530 20.303 -6.187 1.00 13.04 C ATOM 769 CE1 PHE A 48 4.958 22.299 -8.046 1.00 71.44 C ATOM 770 CE2 PHE A 48 5.650 21.113 -6.094 1.00 5.42 C ATOM 771 CZ PHE A 48 5.863 22.109 -7.022 1.00 10.33 C ATOM 0 H PHE A 48 0.910 20.155 -4.965 1.00 23.05 H new ATOM 0 HA PHE A 48 0.801 21.041 -7.804 1.00 23.03 H new ATOM 0 HB2 PHE A 48 2.480 18.746 -6.641 1.00 41.40 H new ATOM 0 HB3 PHE A 48 2.354 19.145 -8.343 1.00 41.40 H new ATOM 0 HD1 PHE A 48 3.138 21.652 -8.956 1.00 32.00 H new ATOM 0 HD2 PHE A 48 4.372 19.526 -5.454 1.00 13.04 H new ATOM 0 HE1 PHE A 48 5.125 23.081 -8.772 1.00 71.44 H new ATOM 0 HE2 PHE A 48 6.358 20.963 -5.292 1.00 5.42 H new ATOM 0 HZ PHE A 48 6.737 22.740 -6.948 1.00 10.33 H new ATOM 781 N PRO A 49 -1.491 19.536 -7.101 1.00 71.50 N ATOM 782 CA PRO A 49 -2.617 18.546 -7.145 1.00 25.41 C ATOM 783 C PRO A 49 -2.687 17.713 -8.456 1.00 72.22 C ATOM 784 O PRO A 49 -2.924 16.504 -8.419 1.00 42.10 O ATOM 785 CB PRO A 49 -3.888 19.427 -6.952 1.00 50.11 C ATOM 786 CG PRO A 49 -3.450 20.825 -7.279 1.00 42.01 C ATOM 787 CD PRO A 49 -2.000 20.912 -6.858 1.00 40.14 C ATOM 0 HA PRO A 49 -2.495 17.780 -6.379 1.00 25.41 H new ATOM 0 HB2 PRO A 49 -4.695 19.103 -7.609 1.00 50.11 H new ATOM 0 HB3 PRO A 49 -4.262 19.360 -5.930 1.00 50.11 H new ATOM 0 HG2 PRO A 49 -3.561 21.031 -8.344 1.00 42.01 H new ATOM 0 HG3 PRO A 49 -4.056 21.559 -6.748 1.00 42.01 H new ATOM 0 HD2 PRO A 49 -1.455 21.652 -7.444 1.00 40.14 H new ATOM 0 HD3 PRO A 49 -1.901 21.198 -5.811 1.00 40.14 H new ATOM 795 N GLU A 50 -2.468 18.372 -9.602 1.00 75.14 N ATOM 796 CA GLU A 50 -2.498 17.720 -10.936 1.00 54.41 C ATOM 797 C GLU A 50 -1.179 16.959 -11.238 1.00 10.34 C ATOM 798 O GLU A 50 -1.161 16.035 -12.059 1.00 15.51 O ATOM 799 CB GLU A 50 -2.755 18.791 -12.026 1.00 4.31 C ATOM 800 CG GLU A 50 -4.077 19.571 -11.859 1.00 14.25 C ATOM 801 CD GLU A 50 -4.234 20.719 -12.877 1.00 4.51 C ATOM 802 OE1 GLU A 50 -4.445 20.443 -14.075 1.00 23.42 O ATOM 803 OE2 GLU A 50 -4.112 21.901 -12.490 1.00 54.33 O ATOM 0 H GLU A 50 -2.265 19.371 -9.640 1.00 75.14 H new ATOM 0 HA GLU A 50 -3.305 16.987 -10.936 1.00 54.41 H new ATOM 0 HB2 GLU A 50 -1.927 19.500 -12.023 1.00 4.31 H new ATOM 0 HB3 GLU A 50 -2.755 18.305 -13.002 1.00 4.31 H new ATOM 0 HG2 GLU A 50 -4.915 18.882 -11.965 1.00 14.25 H new ATOM 0 HG3 GLU A 50 -4.126 19.979 -10.849 1.00 14.25 H new ATOM 810 N ASN A 51 -0.082 17.352 -10.565 1.00 64.41 N ATOM 811 CA ASN A 51 1.269 16.790 -10.818 1.00 1.53 C ATOM 812 C ASN A 51 1.551 15.587 -9.882 1.00 33.33 C ATOM 813 O ASN A 51 2.186 15.730 -8.825 1.00 30.51 O ATOM 814 CB ASN A 51 2.344 17.885 -10.630 1.00 10.40 C ATOM 815 CG ASN A 51 2.067 19.145 -11.442 1.00 11.04 C ATOM 816 OD1 ASN A 51 1.358 20.036 -10.996 1.00 65.31 O ATOM 817 ND2 ASN A 51 2.635 19.245 -12.627 1.00 25.44 N ATOM 0 H ASN A 51 -0.100 18.063 -9.834 1.00 64.41 H new ATOM 0 HA ASN A 51 1.306 16.433 -11.847 1.00 1.53 H new ATOM 0 HB2 ASN A 51 2.405 18.147 -9.574 1.00 10.40 H new ATOM 0 HB3 ASN A 51 3.316 17.483 -10.915 1.00 10.40 H new ATOM 0 HD21 ASN A 51 2.487 20.080 -13.194 1.00 25.44 H new ATOM 0 HD22 ASN A 51 3.222 18.488 -12.977 1.00 25.44 H new ATOM 824 N LYS A 52 1.052 14.405 -10.279 1.00 32.43 N ATOM 825 CA LYS A 52 1.188 13.158 -9.487 1.00 3.31 C ATOM 826 C LYS A 52 2.612 12.574 -9.542 1.00 41.21 C ATOM 827 O LYS A 52 3.015 11.928 -8.590 1.00 40.03 O ATOM 828 CB LYS A 52 0.117 12.094 -9.925 1.00 64.25 C ATOM 829 CG LYS A 52 -1.109 11.994 -8.984 1.00 73.52 C ATOM 830 CD LYS A 52 -1.785 13.357 -8.753 1.00 73.12 C ATOM 831 CE LYS A 52 -2.983 13.282 -7.797 1.00 34.24 C ATOM 832 NZ LYS A 52 -2.600 12.807 -6.445 1.00 31.50 N ATOM 0 H LYS A 52 0.543 14.280 -11.154 1.00 32.43 H new ATOM 0 HA LYS A 52 1.002 13.422 -8.446 1.00 3.31 H new ATOM 0 HB2 LYS A 52 -0.230 12.338 -10.929 1.00 64.25 H new ATOM 0 HB3 LYS A 52 0.596 11.117 -9.982 1.00 64.25 H new ATOM 0 HG2 LYS A 52 -1.834 11.300 -9.409 1.00 73.52 H new ATOM 0 HG3 LYS A 52 -0.795 11.580 -8.026 1.00 73.52 H new ATOM 0 HD2 LYS A 52 -1.051 14.056 -8.352 1.00 73.12 H new ATOM 0 HD3 LYS A 52 -2.117 13.758 -9.711 1.00 73.12 H new ATOM 0 HE2 LYS A 52 -3.442 14.267 -7.716 1.00 34.24 H new ATOM 0 HE3 LYS A 52 -3.736 12.613 -8.214 1.00 34.24 H new ATOM 0 HZ1 LYS A 52 -3.305 13.129 -5.751 1.00 31.50 H new ATOM 0 HZ2 LYS A 52 -2.560 11.768 -6.441 1.00 31.50 H new ATOM 0 HZ3 LYS A 52 -1.667 13.191 -6.194 1.00 31.50 H new ATOM 846 N GLU A 53 3.372 12.827 -10.633 1.00 31.55 N ATOM 847 CA GLU A 53 4.767 12.313 -10.792 1.00 12.42 C ATOM 848 C GLU A 53 5.667 12.632 -9.559 1.00 32.14 C ATOM 849 O GLU A 53 6.522 11.831 -9.190 1.00 73.13 O ATOM 850 CB GLU A 53 5.425 12.877 -12.083 1.00 15.33 C ATOM 851 CG GLU A 53 5.421 14.410 -12.166 1.00 42.13 C ATOM 852 CD GLU A 53 6.354 14.999 -13.238 1.00 1.10 C ATOM 853 OE1 GLU A 53 5.979 15.015 -14.427 1.00 2.14 O ATOM 854 OE2 GLU A 53 7.466 15.461 -12.890 1.00 3.51 O ATOM 0 H GLU A 53 3.048 13.385 -11.423 1.00 31.55 H new ATOM 0 HA GLU A 53 4.687 11.229 -10.871 1.00 12.42 H new ATOM 0 HB2 GLU A 53 6.454 12.523 -12.139 1.00 15.33 H new ATOM 0 HB3 GLU A 53 4.902 12.475 -12.951 1.00 15.33 H new ATOM 0 HG2 GLU A 53 4.404 14.747 -12.365 1.00 42.13 H new ATOM 0 HG3 GLU A 53 5.706 14.813 -11.194 1.00 42.13 H new ATOM 861 N TYR A 54 5.422 13.798 -8.925 1.00 13.41 N ATOM 862 CA TYR A 54 6.119 14.221 -7.690 1.00 60.23 C ATOM 863 C TYR A 54 5.705 13.318 -6.507 1.00 1.42 C ATOM 864 O TYR A 54 6.545 12.657 -5.912 1.00 2.11 O ATOM 865 CB TYR A 54 5.789 15.696 -7.345 1.00 72.52 C ATOM 866 CG TYR A 54 6.200 16.737 -8.387 1.00 53.13 C ATOM 867 CD1 TYR A 54 5.599 16.766 -9.638 1.00 72.03 C ATOM 868 CD2 TYR A 54 7.190 17.682 -8.126 1.00 43.33 C ATOM 869 CE1 TYR A 54 5.958 17.679 -10.590 1.00 73.31 C ATOM 870 CE2 TYR A 54 7.555 18.600 -9.084 1.00 0.13 C ATOM 871 CZ TYR A 54 6.934 18.589 -10.317 1.00 73.23 C ATOM 872 OH TYR A 54 7.307 19.476 -11.291 1.00 74.25 O ATOM 0 H TYR A 54 4.734 14.475 -9.255 1.00 13.41 H new ATOM 0 HA TYR A 54 7.191 14.130 -7.863 1.00 60.23 H new ATOM 0 HB2 TYR A 54 4.714 15.779 -7.182 1.00 72.52 H new ATOM 0 HB3 TYR A 54 6.274 15.945 -6.401 1.00 72.52 H new ATOM 0 HD1 TYR A 54 4.826 16.047 -9.866 1.00 72.03 H new ATOM 0 HD2 TYR A 54 7.676 17.694 -7.162 1.00 43.33 H new ATOM 0 HE1 TYR A 54 5.470 17.679 -11.554 1.00 73.31 H new ATOM 0 HE2 TYR A 54 8.325 19.327 -8.872 1.00 0.13 H new ATOM 0 HH TYR A 54 8.130 19.933 -11.019 1.00 74.25 H new ATOM 882 N LEU A 55 4.387 13.290 -6.221 1.00 31.02 N ATOM 883 CA LEU A 55 3.778 12.466 -5.143 1.00 72.13 C ATOM 884 C LEU A 55 4.250 10.997 -5.198 1.00 13.33 C ATOM 885 O LEU A 55 4.719 10.452 -4.207 1.00 40.23 O ATOM 886 CB LEU A 55 2.228 12.531 -5.271 1.00 62.44 C ATOM 887 CG LEU A 55 1.403 11.619 -4.306 1.00 35.14 C ATOM 888 CD1 LEU A 55 1.556 12.037 -2.828 1.00 13.04 C ATOM 889 CD2 LEU A 55 -0.072 11.567 -4.728 1.00 12.32 C ATOM 0 H LEU A 55 3.703 13.844 -6.736 1.00 31.02 H new ATOM 0 HA LEU A 55 4.098 12.871 -4.183 1.00 72.13 H new ATOM 0 HB2 LEU A 55 1.917 13.563 -5.112 1.00 62.44 H new ATOM 0 HB3 LEU A 55 1.960 12.272 -6.295 1.00 62.44 H new ATOM 0 HG LEU A 55 1.813 10.612 -4.386 1.00 35.14 H new ATOM 0 HD11 LEU A 55 0.964 11.373 -2.199 1.00 13.04 H new ATOM 0 HD12 LEU A 55 2.605 11.972 -2.538 1.00 13.04 H new ATOM 0 HD13 LEU A 55 1.208 13.062 -2.702 1.00 13.04 H new ATOM 0 HD21 LEU A 55 -0.625 10.926 -4.041 1.00 12.32 H new ATOM 0 HD22 LEU A 55 -0.493 12.572 -4.705 1.00 12.32 H new ATOM 0 HD23 LEU A 55 -0.147 11.166 -5.739 1.00 12.32 H new ATOM 901 N ILE A 56 4.164 10.422 -6.397 1.00 13.13 N ATOM 902 CA ILE A 56 4.534 9.032 -6.687 1.00 11.52 C ATOM 903 C ILE A 56 6.038 8.776 -6.426 1.00 23.42 C ATOM 904 O ILE A 56 6.394 7.717 -5.929 1.00 22.45 O ATOM 905 CB ILE A 56 4.142 8.694 -8.171 1.00 3.24 C ATOM 906 CG1 ILE A 56 2.595 8.868 -8.357 1.00 23.23 C ATOM 907 CG2 ILE A 56 4.598 7.276 -8.582 1.00 41.13 C ATOM 908 CD1 ILE A 56 2.122 8.899 -9.797 1.00 73.11 C ATOM 0 H ILE A 56 3.826 10.922 -7.219 1.00 13.13 H new ATOM 0 HA ILE A 56 3.987 8.372 -6.014 1.00 11.52 H new ATOM 0 HB ILE A 56 4.662 9.390 -8.829 1.00 3.24 H new ATOM 0 HG12 ILE A 56 2.088 8.052 -7.841 1.00 23.23 H new ATOM 0 HG13 ILE A 56 2.287 9.793 -7.869 1.00 23.23 H new ATOM 0 HG21 ILE A 56 4.306 7.085 -9.615 1.00 41.13 H new ATOM 0 HG22 ILE A 56 5.682 7.202 -8.491 1.00 41.13 H new ATOM 0 HG23 ILE A 56 4.128 6.539 -7.930 1.00 41.13 H new ATOM 0 HD11 ILE A 56 1.039 9.022 -9.822 1.00 73.11 H new ATOM 0 HD12 ILE A 56 2.594 9.732 -10.317 1.00 73.11 H new ATOM 0 HD13 ILE A 56 2.392 7.964 -10.289 1.00 73.11 H new ATOM 920 N THR A 57 6.896 9.777 -6.729 1.00 22.54 N ATOM 921 CA THR A 57 8.349 9.740 -6.398 1.00 22.45 C ATOM 922 C THR A 57 8.581 9.584 -4.875 1.00 63.41 C ATOM 923 O THR A 57 9.411 8.776 -4.440 1.00 40.42 O ATOM 924 CB THR A 57 9.074 11.035 -6.904 1.00 21.53 C ATOM 925 OG1 THR A 57 9.031 11.092 -8.332 1.00 24.11 O ATOM 926 CG2 THR A 57 10.532 11.135 -6.444 1.00 2.04 C ATOM 0 H THR A 57 6.608 10.631 -7.207 1.00 22.54 H new ATOM 0 HA THR A 57 8.769 8.872 -6.906 1.00 22.45 H new ATOM 0 HB THR A 57 8.538 11.877 -6.465 1.00 21.53 H new ATOM 0 HG1 THR A 57 8.106 11.228 -8.626 1.00 24.11 H new ATOM 0 HG21 THR A 57 10.973 12.054 -6.829 1.00 2.04 H new ATOM 0 HG22 THR A 57 10.570 11.143 -5.355 1.00 2.04 H new ATOM 0 HG23 THR A 57 11.092 10.279 -6.820 1.00 2.04 H new ATOM 934 N LEU A 58 7.831 10.372 -4.083 1.00 1.23 N ATOM 935 CA LEU A 58 7.875 10.308 -2.604 1.00 74.33 C ATOM 936 C LEU A 58 7.311 8.956 -2.074 1.00 52.45 C ATOM 937 O LEU A 58 7.840 8.398 -1.121 1.00 4.32 O ATOM 938 CB LEU A 58 7.109 11.514 -1.969 1.00 5.41 C ATOM 939 CG LEU A 58 7.831 12.914 -1.975 1.00 44.41 C ATOM 940 CD1 LEU A 58 9.189 12.860 -1.276 1.00 11.02 C ATOM 941 CD2 LEU A 58 7.955 13.527 -3.386 1.00 62.40 C ATOM 0 H LEU A 58 7.180 11.069 -4.444 1.00 1.23 H new ATOM 0 HA LEU A 58 8.921 10.371 -2.305 1.00 74.33 H new ATOM 0 HB2 LEU A 58 6.159 11.623 -2.492 1.00 5.41 H new ATOM 0 HB3 LEU A 58 6.877 11.259 -0.935 1.00 5.41 H new ATOM 0 HG LEU A 58 7.186 13.580 -1.402 1.00 44.41 H new ATOM 0 HD11 LEU A 58 9.652 13.846 -1.303 1.00 11.02 H new ATOM 0 HD12 LEU A 58 9.053 12.552 -0.239 1.00 11.02 H new ATOM 0 HD13 LEU A 58 9.832 12.143 -1.786 1.00 11.02 H new ATOM 0 HD21 LEU A 58 8.461 14.490 -3.321 1.00 62.40 H new ATOM 0 HD22 LEU A 58 8.531 12.857 -4.025 1.00 62.40 H new ATOM 0 HD23 LEU A 58 6.961 13.667 -3.810 1.00 62.40 H new ATOM 953 N LEU A 59 6.258 8.436 -2.732 1.00 31.11 N ATOM 954 CA LEU A 59 5.562 7.187 -2.321 1.00 21.50 C ATOM 955 C LEU A 59 6.409 5.912 -2.585 1.00 35.11 C ATOM 956 O LEU A 59 6.506 5.036 -1.717 1.00 51.23 O ATOM 957 CB LEU A 59 4.203 7.086 -3.053 1.00 44.52 C ATOM 958 CG LEU A 59 3.127 8.148 -2.667 1.00 13.12 C ATOM 959 CD1 LEU A 59 1.920 8.083 -3.623 1.00 20.13 C ATOM 960 CD2 LEU A 59 2.684 7.989 -1.192 1.00 61.43 C ATOM 0 H LEU A 59 5.860 8.866 -3.567 1.00 31.11 H new ATOM 0 HA LEU A 59 5.404 7.242 -1.244 1.00 21.50 H new ATOM 0 HB2 LEU A 59 4.386 7.159 -4.125 1.00 44.52 H new ATOM 0 HB3 LEU A 59 3.788 6.096 -2.867 1.00 44.52 H new ATOM 0 HG LEU A 59 3.581 9.134 -2.768 1.00 13.12 H new ATOM 0 HD11 LEU A 59 1.185 8.833 -3.332 1.00 20.13 H new ATOM 0 HD12 LEU A 59 2.253 8.277 -4.643 1.00 20.13 H new ATOM 0 HD13 LEU A 59 1.468 7.093 -3.571 1.00 20.13 H new ATOM 0 HD21 LEU A 59 1.934 8.743 -0.954 1.00 61.43 H new ATOM 0 HD22 LEU A 59 2.259 6.996 -1.045 1.00 61.43 H new ATOM 0 HD23 LEU A 59 3.546 8.116 -0.537 1.00 61.43 H new ATOM 972 N GLU A 60 6.997 5.803 -3.793 1.00 3.22 N ATOM 973 CA GLU A 60 7.868 4.663 -4.152 1.00 13.22 C ATOM 974 C GLU A 60 9.175 4.665 -3.320 1.00 54.34 C ATOM 975 O GLU A 60 9.636 3.610 -2.903 1.00 71.03 O ATOM 976 CB GLU A 60 8.164 4.647 -5.683 1.00 21.11 C ATOM 977 CG GLU A 60 8.877 5.906 -6.263 1.00 44.31 C ATOM 978 CD GLU A 60 10.341 5.683 -6.672 1.00 64.35 C ATOM 979 OE1 GLU A 60 11.180 5.430 -5.790 1.00 74.04 O ATOM 980 OE2 GLU A 60 10.659 5.742 -7.877 1.00 13.40 O ATOM 0 H GLU A 60 6.885 6.491 -4.538 1.00 3.22 H new ATOM 0 HA GLU A 60 7.333 3.745 -3.909 1.00 13.22 H new ATOM 0 HB2 GLU A 60 8.779 3.774 -5.903 1.00 21.11 H new ATOM 0 HB3 GLU A 60 7.220 4.514 -6.212 1.00 21.11 H new ATOM 0 HG2 GLU A 60 8.320 6.254 -7.133 1.00 44.31 H new ATOM 0 HG3 GLU A 60 8.839 6.703 -5.520 1.00 44.31 H new ATOM 987 N HIS A 61 9.741 5.860 -3.059 1.00 22.34 N ATOM 988 CA HIS A 61 10.983 6.002 -2.253 1.00 22.44 C ATOM 989 C HIS A 61 10.702 5.734 -0.751 1.00 71.21 C ATOM 990 O HIS A 61 11.597 5.333 -0.008 1.00 41.13 O ATOM 991 CB HIS A 61 11.581 7.417 -2.460 1.00 12.32 C ATOM 992 CG HIS A 61 13.063 7.555 -2.167 1.00 23.24 C ATOM 993 ND1 HIS A 61 14.011 7.672 -3.166 1.00 53.44 N ATOM 994 CD2 HIS A 61 13.748 7.676 -1.004 1.00 22.31 C ATOM 995 CE1 HIS A 61 15.196 7.862 -2.629 1.00 4.54 C ATOM 996 NE2 HIS A 61 15.064 7.867 -1.326 1.00 72.24 N ATOM 0 H HIS A 61 9.361 6.746 -3.393 1.00 22.34 H new ATOM 0 HA HIS A 61 11.708 5.261 -2.590 1.00 22.44 H new ATOM 0 HB2 HIS A 61 11.404 7.718 -3.492 1.00 12.32 H new ATOM 0 HB3 HIS A 61 11.037 8.117 -1.826 1.00 12.32 H new ATOM 0 HD2 HIS A 61 13.332 7.630 -0.008 1.00 22.31 H new ATOM 0 HE1 HIS A 61 16.121 7.992 -3.171 1.00 4.54 H new ATOM 0 HE2 HIS A 61 15.823 7.993 -0.656 1.00 72.24 H new ATOM 1005 N LEU A 62 9.443 5.977 -0.341 1.00 52.31 N ATOM 1006 CA LEU A 62 8.939 5.704 1.023 1.00 63.42 C ATOM 1007 C LEU A 62 9.035 4.202 1.370 1.00 25.14 C ATOM 1008 O LEU A 62 9.559 3.832 2.428 1.00 52.45 O ATOM 1009 CB LEU A 62 7.468 6.208 1.126 1.00 50.03 C ATOM 1010 CG LEU A 62 6.686 5.893 2.438 1.00 10.23 C ATOM 1011 CD1 LEU A 62 7.420 6.436 3.668 1.00 3.31 C ATOM 1012 CD2 LEU A 62 5.238 6.428 2.367 1.00 65.35 C ATOM 0 H LEU A 62 8.734 6.375 -0.957 1.00 52.31 H new ATOM 0 HA LEU A 62 9.558 6.236 1.745 1.00 63.42 H new ATOM 0 HB2 LEU A 62 7.473 7.289 0.990 1.00 50.03 H new ATOM 0 HB3 LEU A 62 6.909 5.784 0.292 1.00 50.03 H new ATOM 0 HG LEU A 62 6.634 4.809 2.539 1.00 10.23 H new ATOM 0 HD11 LEU A 62 6.849 6.200 4.566 1.00 3.31 H new ATOM 0 HD12 LEU A 62 8.407 5.978 3.735 1.00 3.31 H new ATOM 0 HD13 LEU A 62 7.527 7.517 3.580 1.00 3.31 H new ATOM 0 HD21 LEU A 62 4.718 6.194 3.296 1.00 65.35 H new ATOM 0 HD22 LEU A 62 5.256 7.508 2.224 1.00 65.35 H new ATOM 0 HD23 LEU A 62 4.718 5.960 1.531 1.00 65.35 H new ATOM 1024 N MET A 63 8.538 3.344 0.459 1.00 41.34 N ATOM 1025 CA MET A 63 8.557 1.880 0.663 1.00 72.01 C ATOM 1026 C MET A 63 9.977 1.286 0.526 1.00 42.24 C ATOM 1027 O MET A 63 10.213 0.188 1.000 1.00 42.13 O ATOM 1028 CB MET A 63 7.546 1.170 -0.274 1.00 75.30 C ATOM 1029 CG MET A 63 7.817 1.329 -1.777 1.00 24.43 C ATOM 1030 SD MET A 63 6.420 0.833 -2.800 1.00 35.32 S ATOM 1031 CE MET A 63 5.165 2.001 -2.265 1.00 54.52 C ATOM 0 H MET A 63 8.119 3.637 -0.424 1.00 41.34 H new ATOM 0 HA MET A 63 8.243 1.697 1.691 1.00 72.01 H new ATOM 0 HB2 MET A 63 7.539 0.107 -0.034 1.00 75.30 H new ATOM 0 HB3 MET A 63 6.548 1.552 -0.060 1.00 75.30 H new ATOM 0 HG2 MET A 63 8.064 2.370 -1.988 1.00 24.43 H new ATOM 0 HG3 MET A 63 8.689 0.734 -2.048 1.00 24.43 H new ATOM 0 HE1 MET A 63 4.322 1.459 -1.836 1.00 54.52 H new ATOM 0 HE2 MET A 63 5.586 2.669 -1.514 1.00 54.52 H new ATOM 0 HE3 MET A 63 4.823 2.585 -3.120 1.00 54.52 H new ATOM 1041 N LYS A 64 10.905 2.010 -0.144 1.00 5.31 N ATOM 1042 CA LYS A 64 12.353 1.654 -0.149 1.00 30.42 C ATOM 1043 C LYS A 64 13.012 2.009 1.212 1.00 55.33 C ATOM 1044 O LYS A 64 13.787 1.222 1.766 1.00 34.42 O ATOM 1045 CB LYS A 64 13.123 2.389 -1.290 1.00 62.10 C ATOM 1046 CG LYS A 64 12.462 2.343 -2.683 1.00 74.40 C ATOM 1047 CD LYS A 64 12.143 0.914 -3.183 1.00 10.10 C ATOM 1048 CE LYS A 64 11.417 0.922 -4.541 1.00 71.35 C ATOM 1049 NZ LYS A 64 11.159 -0.455 -5.044 1.00 22.34 N ATOM 0 H LYS A 64 10.682 2.843 -0.688 1.00 5.31 H new ATOM 0 HA LYS A 64 12.414 0.579 -0.319 1.00 30.42 H new ATOM 0 HB2 LYS A 64 13.250 3.433 -1.003 1.00 62.10 H new ATOM 0 HB3 LYS A 64 14.120 1.956 -1.367 1.00 62.10 H new ATOM 0 HG2 LYS A 64 11.538 2.921 -2.655 1.00 74.40 H new ATOM 0 HG3 LYS A 64 13.121 2.830 -3.402 1.00 74.40 H new ATOM 0 HD2 LYS A 64 13.069 0.347 -3.271 1.00 10.10 H new ATOM 0 HD3 LYS A 64 11.525 0.402 -2.445 1.00 10.10 H new ATOM 0 HE2 LYS A 64 10.471 1.455 -4.443 1.00 71.35 H new ATOM 0 HE3 LYS A 64 12.017 1.468 -5.269 1.00 71.35 H new ATOM 0 HZ1 LYS A 64 10.669 -0.404 -5.960 1.00 22.34 H new ATOM 0 HZ2 LYS A 64 12.062 -0.956 -5.162 1.00 22.34 H new ATOM 0 HZ3 LYS A 64 10.565 -0.968 -4.362 1.00 22.34 H new ATOM 1063 N GLU A 65 12.671 3.207 1.728 1.00 53.32 N ATOM 1064 CA GLU A 65 13.223 3.757 2.990 1.00 63.53 C ATOM 1065 C GLU A 65 12.899 2.856 4.195 1.00 30.14 C ATOM 1066 O GLU A 65 13.764 2.574 5.020 1.00 31.32 O ATOM 1067 CB GLU A 65 12.649 5.185 3.232 1.00 11.53 C ATOM 1068 CG GLU A 65 13.057 5.867 4.570 1.00 52.13 C ATOM 1069 CD GLU A 65 14.555 6.220 4.672 1.00 4.04 C ATOM 1070 OE1 GLU A 65 14.944 7.334 4.261 1.00 2.12 O ATOM 1071 OE2 GLU A 65 15.350 5.383 5.158 1.00 52.13 O ATOM 0 H GLU A 65 11.999 3.829 1.279 1.00 53.32 H new ATOM 0 HA GLU A 65 14.307 3.802 2.890 1.00 63.53 H new ATOM 0 HB2 GLU A 65 12.965 5.826 2.409 1.00 11.53 H new ATOM 0 HB3 GLU A 65 11.561 5.129 3.193 1.00 11.53 H new ATOM 0 HG2 GLU A 65 12.472 6.778 4.693 1.00 52.13 H new ATOM 0 HG3 GLU A 65 12.795 5.206 5.396 1.00 52.13 H new ATOM 1078 N PHE A 66 11.627 2.435 4.287 1.00 72.31 N ATOM 1079 CA PHE A 66 11.123 1.611 5.414 1.00 53.02 C ATOM 1080 C PHE A 66 11.007 0.114 5.072 1.00 54.54 C ATOM 1081 O PHE A 66 10.428 -0.657 5.852 1.00 54.42 O ATOM 1082 CB PHE A 66 9.780 2.175 5.914 1.00 74.35 C ATOM 1083 CG PHE A 66 9.870 3.602 6.456 1.00 43.41 C ATOM 1084 CD1 PHE A 66 11.004 4.042 7.153 1.00 74.11 C ATOM 1085 CD2 PHE A 66 8.829 4.501 6.271 1.00 45.41 C ATOM 1086 CE1 PHE A 66 11.082 5.328 7.634 1.00 21.22 C ATOM 1087 CE2 PHE A 66 8.913 5.787 6.756 1.00 35.03 C ATOM 1088 CZ PHE A 66 10.036 6.200 7.433 1.00 11.54 C ATOM 0 H PHE A 66 10.916 2.652 3.588 1.00 72.31 H new ATOM 0 HA PHE A 66 11.862 1.673 6.213 1.00 53.02 H new ATOM 0 HB2 PHE A 66 9.061 2.153 5.096 1.00 74.35 H new ATOM 0 HB3 PHE A 66 9.392 1.523 6.697 1.00 74.35 H new ATOM 0 HD1 PHE A 66 11.827 3.362 7.314 1.00 74.11 H new ATOM 0 HD2 PHE A 66 7.942 4.188 5.740 1.00 45.41 H new ATOM 0 HE1 PHE A 66 11.962 5.653 8.168 1.00 21.22 H new ATOM 0 HE2 PHE A 66 8.094 6.474 6.604 1.00 35.03 H new ATOM 0 HZ PHE A 66 10.098 7.211 7.808 1.00 11.54 H new ATOM 1098 N LEU A 67 11.534 -0.285 3.902 1.00 5.34 N ATOM 1099 CA LEU A 67 11.591 -1.700 3.479 1.00 44.20 C ATOM 1100 C LEU A 67 12.322 -2.594 4.522 1.00 11.43 C ATOM 1101 O LEU A 67 11.721 -3.513 5.092 1.00 42.51 O ATOM 1102 CB LEU A 67 12.270 -1.814 2.083 1.00 72.31 C ATOM 1103 CG LEU A 67 11.843 -3.036 1.215 1.00 61.42 C ATOM 1104 CD1 LEU A 67 10.307 -3.066 1.007 1.00 4.24 C ATOM 1105 CD2 LEU A 67 12.593 -3.045 -0.135 1.00 24.00 C ATOM 0 H LEU A 67 11.933 0.362 3.221 1.00 5.34 H new ATOM 0 HA LEU A 67 10.567 -2.066 3.409 1.00 44.20 H new ATOM 0 HB2 LEU A 67 12.059 -0.903 1.522 1.00 72.31 H new ATOM 0 HB3 LEU A 67 13.350 -1.856 2.228 1.00 72.31 H new ATOM 0 HG LEU A 67 12.119 -3.942 1.754 1.00 61.42 H new ATOM 0 HD11 LEU A 67 10.039 -3.929 0.398 1.00 4.24 H new ATOM 0 HD12 LEU A 67 9.810 -3.136 1.975 1.00 4.24 H new ATOM 0 HD13 LEU A 67 9.990 -2.153 0.502 1.00 4.24 H new ATOM 0 HD21 LEU A 67 12.277 -3.908 -0.721 1.00 24.00 H new ATOM 0 HD22 LEU A 67 12.366 -2.131 -0.683 1.00 24.00 H new ATOM 0 HD23 LEU A 67 13.666 -3.103 0.045 1.00 24.00 H new ATOM 1117 N ASP A 68 13.608 -2.282 4.796 1.00 23.03 N ATOM 1118 CA ASP A 68 14.427 -3.015 5.792 1.00 2.35 C ATOM 1119 C ASP A 68 14.127 -2.499 7.226 1.00 50.21 C ATOM 1120 O ASP A 68 14.473 -3.156 8.219 1.00 71.02 O ATOM 1121 CB ASP A 68 15.938 -2.853 5.431 1.00 34.44 C ATOM 1122 CG ASP A 68 16.912 -3.484 6.449 1.00 35.24 C ATOM 1123 OD1 ASP A 68 17.152 -4.707 6.377 1.00 33.10 O ATOM 1124 OD2 ASP A 68 17.439 -2.756 7.327 1.00 32.04 O ATOM 0 H ASP A 68 14.107 -1.520 4.337 1.00 23.03 H new ATOM 0 HA ASP A 68 14.174 -4.075 5.769 1.00 2.35 H new ATOM 0 HB2 ASP A 68 16.115 -3.301 4.453 1.00 34.44 H new ATOM 0 HB3 ASP A 68 16.165 -1.791 5.341 1.00 34.44 H new ATOM 1129 N LYS A 69 13.461 -1.323 7.337 1.00 62.24 N ATOM 1130 CA LYS A 69 12.987 -0.802 8.638 1.00 32.12 C ATOM 1131 C LYS A 69 11.662 -1.505 9.004 1.00 24.14 C ATOM 1132 O LYS A 69 10.561 -0.986 8.781 1.00 74.50 O ATOM 1133 CB LYS A 69 12.838 0.749 8.637 1.00 61.01 C ATOM 1134 CG LYS A 69 14.031 1.516 8.016 1.00 34.13 C ATOM 1135 CD LYS A 69 15.413 1.120 8.602 1.00 21.01 C ATOM 1136 CE LYS A 69 15.591 1.530 10.070 1.00 44.43 C ATOM 1137 NZ LYS A 69 15.562 3.003 10.240 1.00 0.23 N ATOM 0 H LYS A 69 13.242 -0.721 6.543 1.00 62.24 H new ATOM 0 HA LYS A 69 13.736 -1.024 9.398 1.00 32.12 H new ATOM 0 HB2 LYS A 69 11.932 1.012 8.092 1.00 61.01 H new ATOM 0 HB3 LYS A 69 12.702 1.087 9.664 1.00 61.01 H new ATOM 0 HG2 LYS A 69 14.041 1.341 6.940 1.00 34.13 H new ATOM 0 HG3 LYS A 69 13.878 2.585 8.164 1.00 34.13 H new ATOM 0 HD2 LYS A 69 15.541 0.041 8.516 1.00 21.01 H new ATOM 0 HD3 LYS A 69 16.199 1.583 8.005 1.00 21.01 H new ATOM 0 HE2 LYS A 69 14.801 1.080 10.671 1.00 44.43 H new ATOM 0 HE3 LYS A 69 16.538 1.140 10.444 1.00 44.43 H new ATOM 0 HZ1 LYS A 69 16.256 3.283 10.962 1.00 0.23 H new ATOM 0 HZ2 LYS A 69 15.798 3.461 9.337 1.00 0.23 H new ATOM 0 HZ3 LYS A 69 14.611 3.299 10.540 1.00 0.23 H new ATOM 1151 N LYS A 70 11.814 -2.708 9.577 1.00 44.50 N ATOM 1152 CA LYS A 70 10.737 -3.711 9.707 1.00 62.43 C ATOM 1153 C LYS A 70 9.608 -3.309 10.689 1.00 51.11 C ATOM 1154 O LYS A 70 8.566 -3.970 10.735 1.00 42.01 O ATOM 1155 CB LYS A 70 11.360 -5.062 10.124 1.00 12.41 C ATOM 1156 CG LYS A 70 12.419 -5.593 9.131 1.00 41.13 C ATOM 1157 CD LYS A 70 13.111 -6.890 9.611 1.00 32.14 C ATOM 1158 CE LYS A 70 13.912 -6.684 10.914 1.00 44.45 C ATOM 1159 NZ LYS A 70 14.551 -7.943 11.390 1.00 35.24 N ATOM 0 H LYS A 70 12.702 -3.020 9.971 1.00 44.50 H new ATOM 0 HA LYS A 70 10.255 -3.787 8.732 1.00 62.43 H new ATOM 0 HB2 LYS A 70 11.819 -4.952 11.106 1.00 12.41 H new ATOM 0 HB3 LYS A 70 10.566 -5.802 10.224 1.00 12.41 H new ATOM 0 HG2 LYS A 70 11.943 -5.778 8.168 1.00 41.13 H new ATOM 0 HG3 LYS A 70 13.175 -4.824 8.971 1.00 41.13 H new ATOM 0 HD2 LYS A 70 12.358 -7.663 9.769 1.00 32.14 H new ATOM 0 HD3 LYS A 70 13.780 -7.252 8.830 1.00 32.14 H new ATOM 0 HE2 LYS A 70 14.681 -5.929 10.750 1.00 44.45 H new ATOM 0 HE3 LYS A 70 13.248 -6.300 11.689 1.00 44.45 H new ATOM 0 HZ1 LYS A 70 15.077 -7.755 12.267 1.00 35.24 H new ATOM 0 HZ2 LYS A 70 13.817 -8.657 11.573 1.00 35.24 H new ATOM 0 HZ3 LYS A 70 15.205 -8.297 10.663 1.00 35.24 H new ATOM 1173 N LYS A 71 9.815 -2.234 11.466 1.00 21.44 N ATOM 1174 CA LYS A 71 8.777 -1.704 12.377 1.00 43.02 C ATOM 1175 C LYS A 71 7.574 -1.089 11.610 1.00 15.13 C ATOM 1176 O LYS A 71 6.483 -0.942 12.165 1.00 62.30 O ATOM 1177 CB LYS A 71 9.395 -0.687 13.362 1.00 2.45 C ATOM 1178 CG LYS A 71 9.977 0.588 12.714 1.00 54.03 C ATOM 1179 CD LYS A 71 10.653 1.506 13.757 1.00 72.53 C ATOM 1180 CE LYS A 71 11.173 2.817 13.163 1.00 11.12 C ATOM 1181 NZ LYS A 71 11.825 3.660 14.197 1.00 73.33 N ATOM 0 H LYS A 71 10.691 -1.712 11.485 1.00 21.44 H new ATOM 0 HA LYS A 71 8.381 -2.545 12.947 1.00 43.02 H new ATOM 0 HB2 LYS A 71 8.631 -0.393 14.082 1.00 2.45 H new ATOM 0 HB3 LYS A 71 10.187 -1.184 13.923 1.00 2.45 H new ATOM 0 HG2 LYS A 71 10.704 0.308 11.951 1.00 54.03 H new ATOM 0 HG3 LYS A 71 9.180 1.136 12.210 1.00 54.03 H new ATOM 0 HD2 LYS A 71 9.939 1.732 14.549 1.00 72.53 H new ATOM 0 HD3 LYS A 71 11.482 0.970 14.219 1.00 72.53 H new ATOM 0 HE2 LYS A 71 11.885 2.600 12.367 1.00 11.12 H new ATOM 0 HE3 LYS A 71 10.347 3.366 12.711 1.00 11.12 H new ATOM 0 HZ1 LYS A 71 12.166 4.541 13.762 1.00 73.33 H new ATOM 0 HZ2 LYS A 71 11.138 3.886 14.944 1.00 73.33 H new ATOM 0 HZ3 LYS A 71 12.628 3.144 14.610 1.00 73.33 H new ATOM 1195 N TYR A 72 7.786 -0.747 10.324 1.00 50.21 N ATOM 1196 CA TYR A 72 6.718 -0.237 9.432 1.00 1.44 C ATOM 1197 C TYR A 72 6.035 -1.349 8.606 1.00 61.24 C ATOM 1198 O TYR A 72 5.155 -1.047 7.796 1.00 50.32 O ATOM 1199 CB TYR A 72 7.287 0.852 8.497 1.00 34.43 C ATOM 1200 CG TYR A 72 7.545 2.179 9.215 1.00 42.11 C ATOM 1201 CD1 TYR A 72 6.500 3.077 9.436 1.00 25.33 C ATOM 1202 CD2 TYR A 72 8.812 2.524 9.698 1.00 22.30 C ATOM 1203 CE1 TYR A 72 6.708 4.260 10.102 1.00 33.44 C ATOM 1204 CE2 TYR A 72 9.019 3.720 10.363 1.00 63.41 C ATOM 1205 CZ TYR A 72 7.964 4.579 10.563 1.00 32.11 C ATOM 1206 OH TYR A 72 8.158 5.767 11.229 1.00 23.12 O ATOM 0 H TYR A 72 8.698 -0.815 9.872 1.00 50.21 H new ATOM 0 HA TYR A 72 5.947 0.190 10.073 1.00 1.44 H new ATOM 0 HB2 TYR A 72 8.219 0.496 8.057 1.00 34.43 H new ATOM 0 HB3 TYR A 72 6.590 1.019 7.676 1.00 34.43 H new ATOM 0 HD1 TYR A 72 5.510 2.837 9.077 1.00 25.33 H new ATOM 0 HD2 TYR A 72 9.640 1.847 9.550 1.00 22.30 H new ATOM 0 HE1 TYR A 72 5.885 4.940 10.264 1.00 33.44 H new ATOM 0 HE2 TYR A 72 10.004 3.977 10.723 1.00 63.41 H new ATOM 0 HH TYR A 72 8.442 5.584 12.149 1.00 23.12 H new ATOM 1216 N HIS A 73 6.418 -2.626 8.832 1.00 2.13 N ATOM 1217 CA HIS A 73 5.829 -3.783 8.111 1.00 51.51 C ATOM 1218 C HIS A 73 4.290 -3.790 8.185 1.00 43.23 C ATOM 1219 O HIS A 73 3.632 -3.927 7.181 1.00 2.02 O ATOM 1220 CB HIS A 73 6.379 -5.133 8.662 1.00 51.12 C ATOM 1221 CG HIS A 73 7.636 -5.643 8.008 1.00 11.41 C ATOM 1222 ND1 HIS A 73 8.571 -5.037 7.239 1.00 34.14 N flip ATOM 1223 CD2 HIS A 73 8.032 -6.955 8.111 1.00 53.13 C flip ATOM 1224 CE1 HIS A 73 9.500 -5.987 6.904 1.00 74.43 C flip ATOM 1225 NE2 HIS A 73 9.143 -7.133 7.444 1.00 70.34 N flip ATOM 0 H HIS A 73 7.135 -2.884 9.510 1.00 2.13 H new ATOM 0 HA HIS A 73 6.122 -3.675 7.067 1.00 51.51 H new ATOM 0 HB2 HIS A 73 6.568 -5.018 9.729 1.00 51.12 H new ATOM 0 HB3 HIS A 73 5.603 -5.891 8.555 1.00 51.12 H new ATOM 0 HD2 HIS A 73 7.506 -7.722 8.659 1.00 53.13 H new ATOM 0 HE1 HIS A 73 10.379 -5.823 6.298 1.00 74.43 H new ATOM 0 HE2 HIS A 73 9.649 -8.014 7.357 1.00 70.34 H new ATOM 1234 N ASN A 74 3.738 -3.623 9.385 1.00 34.32 N ATOM 1235 CA ASN A 74 2.278 -3.729 9.623 1.00 42.45 C ATOM 1236 C ASN A 74 1.683 -2.397 10.106 1.00 65.23 C ATOM 1237 O ASN A 74 0.608 -2.371 10.717 1.00 42.31 O ATOM 1238 CB ASN A 74 2.036 -4.869 10.640 1.00 2.52 C ATOM 1239 CG ASN A 74 2.616 -6.210 10.167 1.00 11.21 C ATOM 1240 OD1 ASN A 74 2.522 -6.496 8.875 1.00 32.54 O flip ATOM 1241 ND2 ASN A 74 3.118 -6.997 10.956 1.00 52.31 N flip ATOM 0 H ASN A 74 4.277 -3.411 10.224 1.00 34.32 H new ATOM 0 HA ASN A 74 1.770 -3.961 8.687 1.00 42.45 H new ATOM 0 HB2 ASN A 74 2.484 -4.600 11.596 1.00 2.52 H new ATOM 0 HB3 ASN A 74 0.965 -4.979 10.810 1.00 2.52 H new ATOM 0 HD21 ASN A 74 3.180 -6.757 11.945 1.00 52.31 H new ATOM 0 HD22 ASN A 74 3.475 -7.893 10.625 1.00 52.31 H new ATOM 1248 N ASP A 75 2.375 -1.285 9.791 1.00 51.10 N ATOM 1249 CA ASP A 75 1.930 0.069 10.164 1.00 71.13 C ATOM 1250 C ASP A 75 0.785 0.535 9.224 1.00 64.34 C ATOM 1251 O ASP A 75 1.021 0.714 8.026 1.00 73.32 O ATOM 1252 CB ASP A 75 3.120 1.060 10.109 1.00 15.33 C ATOM 1253 CG ASP A 75 2.750 2.448 10.655 1.00 11.24 C ATOM 1254 OD1 ASP A 75 2.747 2.618 11.893 1.00 24.44 O ATOM 1255 OD2 ASP A 75 2.438 3.360 9.859 1.00 64.44 O ATOM 0 H ASP A 75 3.254 -1.301 9.273 1.00 51.10 H new ATOM 0 HA ASP A 75 1.550 0.046 11.185 1.00 71.13 H new ATOM 0 HB2 ASP A 75 3.953 0.656 10.684 1.00 15.33 H new ATOM 0 HB3 ASP A 75 3.462 1.157 9.078 1.00 15.33 H new ATOM 1260 N PRO A 76 -0.465 0.767 9.756 1.00 73.24 N ATOM 1261 CA PRO A 76 -1.653 1.100 8.918 1.00 63.51 C ATOM 1262 C PRO A 76 -1.449 2.351 8.019 1.00 34.04 C ATOM 1263 O PRO A 76 -1.939 2.382 6.892 1.00 24.35 O ATOM 1264 CB PRO A 76 -2.790 1.313 9.961 1.00 14.45 C ATOM 1265 CG PRO A 76 -2.086 1.557 11.264 1.00 65.24 C ATOM 1266 CD PRO A 76 -0.826 0.725 11.200 1.00 52.51 C ATOM 0 HA PRO A 76 -1.871 0.310 8.200 1.00 63.51 H new ATOM 0 HB2 PRO A 76 -3.421 2.160 9.689 1.00 14.45 H new ATOM 0 HB3 PRO A 76 -3.438 0.439 10.021 1.00 14.45 H new ATOM 0 HG2 PRO A 76 -1.853 2.614 11.393 1.00 65.24 H new ATOM 0 HG3 PRO A 76 -2.709 1.263 12.109 1.00 65.24 H new ATOM 0 HD2 PRO A 76 -0.036 1.141 11.825 1.00 52.51 H new ATOM 0 HD3 PRO A 76 -0.999 -0.295 11.543 1.00 52.51 H new ATOM 1274 N ARG A 77 -0.697 3.358 8.515 1.00 32.33 N ATOM 1275 CA ARG A 77 -0.411 4.592 7.746 1.00 70.15 C ATOM 1276 C ARG A 77 0.554 4.315 6.570 1.00 52.02 C ATOM 1277 O ARG A 77 0.272 4.710 5.437 1.00 74.34 O ATOM 1278 CB ARG A 77 0.152 5.708 8.664 1.00 74.24 C ATOM 1279 CG ARG A 77 -0.821 6.196 9.762 1.00 65.33 C ATOM 1280 CD ARG A 77 -2.172 6.687 9.199 1.00 73.02 C ATOM 1281 NE ARG A 77 -2.991 7.371 10.221 1.00 42.42 N ATOM 1282 CZ ARG A 77 -4.083 6.901 10.789 1.00 13.05 C ATOM 1283 NH1 ARG A 77 -4.557 5.732 10.493 1.00 61.21 N ATOM 1284 NH2 ARG A 77 -4.701 7.621 11.665 1.00 41.13 N ATOM 0 H ARG A 77 -0.277 3.342 9.444 1.00 32.33 H new ATOM 0 HA ARG A 77 -1.356 4.940 7.329 1.00 70.15 H new ATOM 0 HB2 ARG A 77 1.062 5.343 9.141 1.00 74.24 H new ATOM 0 HB3 ARG A 77 0.436 6.559 8.045 1.00 74.24 H new ATOM 0 HG2 ARG A 77 -1.001 5.384 10.466 1.00 65.33 H new ATOM 0 HG3 ARG A 77 -0.352 7.005 10.322 1.00 65.33 H new ATOM 0 HD2 ARG A 77 -1.990 7.368 8.367 1.00 73.02 H new ATOM 0 HD3 ARG A 77 -2.727 5.838 8.801 1.00 73.02 H new ATOM 0 HE ARG A 77 -2.681 8.297 10.515 1.00 42.42 H new ATOM 0 HH11 ARG A 77 -4.083 5.149 9.804 1.00 61.21 H new ATOM 0 HH12 ARG A 77 -5.405 5.395 10.949 1.00 61.21 H new ATOM 0 HH21 ARG A 77 -4.343 8.544 11.911 1.00 41.13 H new ATOM 0 HH22 ARG A 77 -5.547 7.267 12.111 1.00 41.13 H new ATOM 1298 N PHE A 78 1.664 3.606 6.849 1.00 35.33 N ATOM 1299 CA PHE A 78 2.666 3.234 5.824 1.00 71.41 C ATOM 1300 C PHE A 78 2.023 2.398 4.676 1.00 34.53 C ATOM 1301 O PHE A 78 2.240 2.684 3.491 1.00 65.13 O ATOM 1302 CB PHE A 78 3.835 2.458 6.489 1.00 12.23 C ATOM 1303 CG PHE A 78 4.890 1.952 5.507 1.00 73.23 C ATOM 1304 CD1 PHE A 78 5.722 2.840 4.826 1.00 73.51 C ATOM 1305 CD2 PHE A 78 5.036 0.589 5.249 1.00 34.54 C ATOM 1306 CE1 PHE A 78 6.663 2.373 3.926 1.00 71.41 C ATOM 1307 CE2 PHE A 78 5.971 0.130 4.354 1.00 32.13 C ATOM 1308 CZ PHE A 78 6.783 1.018 3.693 1.00 34.11 C ATOM 0 H PHE A 78 1.894 3.275 7.786 1.00 35.33 H new ATOM 0 HA PHE A 78 3.057 4.148 5.377 1.00 71.41 H new ATOM 0 HB2 PHE A 78 4.317 3.107 7.220 1.00 12.23 H new ATOM 0 HB3 PHE A 78 3.427 1.608 7.036 1.00 12.23 H new ATOM 0 HD1 PHE A 78 5.631 3.902 5.003 1.00 73.51 H new ATOM 0 HD2 PHE A 78 4.402 -0.119 5.763 1.00 34.54 H new ATOM 0 HE1 PHE A 78 7.304 3.069 3.405 1.00 71.41 H new ATOM 0 HE2 PHE A 78 6.068 -0.930 4.170 1.00 32.13 H new ATOM 0 HZ PHE A 78 7.517 0.655 2.989 1.00 34.11 H new ATOM 1318 N ILE A 79 1.216 1.386 5.061 1.00 12.21 N ATOM 1319 CA ILE A 79 0.450 0.542 4.110 1.00 75.32 C ATOM 1320 C ILE A 79 -0.583 1.391 3.330 1.00 0.23 C ATOM 1321 O ILE A 79 -0.750 1.197 2.125 1.00 21.11 O ATOM 1322 CB ILE A 79 -0.257 -0.691 4.839 1.00 23.50 C ATOM 1323 CG1 ILE A 79 0.760 -1.851 5.122 1.00 64.12 C ATOM 1324 CG2 ILE A 79 -1.480 -1.256 4.045 1.00 22.20 C ATOM 1325 CD1 ILE A 79 1.929 -1.519 6.029 1.00 13.23 C ATOM 0 H ILE A 79 1.075 1.129 6.038 1.00 12.21 H new ATOM 0 HA ILE A 79 1.163 0.127 3.398 1.00 75.32 H new ATOM 0 HB ILE A 79 -0.629 -0.294 5.784 1.00 23.50 H new ATOM 0 HG12 ILE A 79 0.213 -2.685 5.562 1.00 64.12 H new ATOM 0 HG13 ILE A 79 1.156 -2.198 4.168 1.00 64.12 H new ATOM 0 HG21 ILE A 79 -1.915 -2.091 4.593 1.00 22.20 H new ATOM 0 HG22 ILE A 79 -2.228 -0.473 3.923 1.00 22.20 H new ATOM 0 HG23 ILE A 79 -1.150 -1.598 3.064 1.00 22.20 H new ATOM 0 HD11 ILE A 79 2.559 -2.400 6.148 1.00 13.23 H new ATOM 0 HD12 ILE A 79 2.514 -0.712 5.588 1.00 13.23 H new ATOM 0 HD13 ILE A 79 1.556 -1.206 7.004 1.00 13.23 H new ATOM 1337 N SER A 80 -1.238 2.350 4.021 1.00 30.24 N ATOM 1338 CA SER A 80 -2.215 3.284 3.394 1.00 25.40 C ATOM 1339 C SER A 80 -1.587 4.088 2.233 1.00 43.34 C ATOM 1340 O SER A 80 -2.258 4.370 1.241 1.00 15.31 O ATOM 1341 CB SER A 80 -2.796 4.261 4.442 1.00 54.20 C ATOM 1342 OG SER A 80 -3.743 5.156 3.872 1.00 74.12 O ATOM 0 H SER A 80 -1.110 2.502 5.021 1.00 30.24 H new ATOM 0 HA SER A 80 -3.018 2.669 2.987 1.00 25.40 H new ATOM 0 HB2 SER A 80 -3.271 3.693 5.242 1.00 54.20 H new ATOM 0 HB3 SER A 80 -1.985 4.832 4.894 1.00 54.20 H new ATOM 0 HG SER A 80 -4.087 5.755 4.567 1.00 74.12 H new ATOM 1348 N TYR A 81 -0.293 4.447 2.372 1.00 14.33 N ATOM 1349 CA TYR A 81 0.458 5.169 1.315 1.00 3.22 C ATOM 1350 C TYR A 81 0.899 4.236 0.171 1.00 1.32 C ATOM 1351 O TYR A 81 1.079 4.695 -0.954 1.00 15.50 O ATOM 1352 CB TYR A 81 1.665 5.924 1.916 1.00 74.01 C ATOM 1353 CG TYR A 81 1.236 7.072 2.837 1.00 74.21 C ATOM 1354 CD1 TYR A 81 0.440 8.110 2.348 1.00 32.24 C ATOM 1355 CD2 TYR A 81 1.587 7.107 4.188 1.00 23.33 C ATOM 1356 CE1 TYR A 81 0.009 9.127 3.171 1.00 75.25 C ATOM 1357 CE2 TYR A 81 1.162 8.130 5.010 1.00 72.25 C ATOM 1358 CZ TYR A 81 0.370 9.133 4.496 1.00 43.32 C ATOM 1359 OH TYR A 81 -0.078 10.144 5.312 1.00 31.24 O ATOM 0 H TYR A 81 0.257 4.249 3.208 1.00 14.33 H new ATOM 0 HA TYR A 81 -0.223 5.901 0.880 1.00 3.22 H new ATOM 0 HB2 TYR A 81 2.285 5.225 2.476 1.00 74.01 H new ATOM 0 HB3 TYR A 81 2.281 6.320 1.109 1.00 74.01 H new ATOM 0 HD1 TYR A 81 0.157 8.115 1.306 1.00 32.24 H new ATOM 0 HD2 TYR A 81 2.202 6.319 4.597 1.00 23.33 H new ATOM 0 HE1 TYR A 81 -0.611 9.918 2.775 1.00 75.25 H new ATOM 0 HE2 TYR A 81 1.449 8.144 6.051 1.00 72.25 H new ATOM 0 HH TYR A 81 0.301 10.033 6.209 1.00 31.24 H new ATOM 1369 N CYS A 82 1.085 2.937 0.472 1.00 3.01 N ATOM 1370 CA CYS A 82 1.281 1.903 -0.570 1.00 3.23 C ATOM 1371 C CYS A 82 -0.018 1.700 -1.402 1.00 75.11 C ATOM 1372 O CYS A 82 0.049 1.423 -2.597 1.00 35.42 O ATOM 1373 CB CYS A 82 1.743 0.568 0.061 1.00 72.43 C ATOM 1374 SG CYS A 82 3.323 0.681 0.935 1.00 73.51 S ATOM 0 H CYS A 82 1.104 2.576 1.426 1.00 3.01 H new ATOM 0 HA CYS A 82 2.064 2.249 -1.245 1.00 3.23 H new ATOM 0 HB2 CYS A 82 0.978 0.222 0.756 1.00 72.43 H new ATOM 0 HB3 CYS A 82 1.825 -0.184 -0.723 1.00 72.43 H new ATOM 0 HG CYS A 82 3.182 1.423 1.993 1.00 73.51 H new ATOM 1380 N LEU A 83 -1.197 1.857 -0.748 1.00 45.24 N ATOM 1381 CA LEU A 83 -2.526 1.804 -1.425 1.00 41.41 C ATOM 1382 C LEU A 83 -2.760 3.071 -2.280 1.00 42.21 C ATOM 1383 O LEU A 83 -3.209 2.996 -3.428 1.00 65.20 O ATOM 1384 CB LEU A 83 -3.681 1.684 -0.396 1.00 12.32 C ATOM 1385 CG LEU A 83 -3.534 0.609 0.713 1.00 33.34 C ATOM 1386 CD1 LEU A 83 -4.799 0.553 1.577 1.00 72.43 C ATOM 1387 CD2 LEU A 83 -3.166 -0.780 0.144 1.00 52.24 C ATOM 0 H LEU A 83 -1.258 2.023 0.257 1.00 45.24 H new ATOM 0 HA LEU A 83 -2.520 0.922 -2.065 1.00 41.41 H new ATOM 0 HB2 LEU A 83 -3.805 2.653 0.087 1.00 12.32 H new ATOM 0 HB3 LEU A 83 -4.601 1.481 -0.943 1.00 12.32 H new ATOM 0 HG LEU A 83 -2.700 0.906 1.349 1.00 33.34 H new ATOM 0 HD11 LEU A 83 -4.679 -0.206 2.350 1.00 72.43 H new ATOM 0 HD12 LEU A 83 -4.963 1.524 2.045 1.00 72.43 H new ATOM 0 HD13 LEU A 83 -5.656 0.302 0.952 1.00 72.43 H new ATOM 0 HD21 LEU A 83 -3.075 -1.496 0.961 1.00 52.24 H new ATOM 0 HD22 LEU A 83 -3.946 -1.110 -0.542 1.00 52.24 H new ATOM 0 HD23 LEU A 83 -2.217 -0.715 -0.389 1.00 52.24 H new ATOM 1399 N LYS A 84 -2.458 4.234 -1.668 1.00 32.41 N ATOM 1400 CA LYS A 84 -2.478 5.562 -2.320 1.00 74.30 C ATOM 1401 C LYS A 84 -1.591 5.542 -3.590 1.00 65.02 C ATOM 1402 O LYS A 84 -1.982 6.041 -4.635 1.00 41.01 O ATOM 1403 CB LYS A 84 -2.015 6.643 -1.261 1.00 72.03 C ATOM 1404 CG LYS A 84 -1.109 7.794 -1.766 1.00 33.11 C ATOM 1405 CD LYS A 84 -1.842 8.885 -2.586 1.00 44.21 C ATOM 1406 CE LYS A 84 -2.637 9.868 -1.712 1.00 62.00 C ATOM 1407 NZ LYS A 84 -3.386 10.863 -2.529 1.00 65.20 N ATOM 0 H LYS A 84 -2.187 4.279 -0.686 1.00 32.41 H new ATOM 0 HA LYS A 84 -3.483 5.822 -2.652 1.00 74.30 H new ATOM 0 HB2 LYS A 84 -2.908 7.086 -0.820 1.00 72.03 H new ATOM 0 HB3 LYS A 84 -1.487 6.125 -0.460 1.00 72.03 H new ATOM 0 HG2 LYS A 84 -0.631 8.265 -0.907 1.00 33.11 H new ATOM 0 HG3 LYS A 84 -0.315 7.370 -2.380 1.00 33.11 H new ATOM 0 HD2 LYS A 84 -1.111 9.441 -3.174 1.00 44.21 H new ATOM 0 HD3 LYS A 84 -2.521 8.406 -3.291 1.00 44.21 H new ATOM 0 HE2 LYS A 84 -3.336 9.313 -1.087 1.00 62.00 H new ATOM 0 HE3 LYS A 84 -1.955 10.390 -1.041 1.00 62.00 H new ATOM 0 HZ1 LYS A 84 -4.281 11.099 -2.054 1.00 65.20 H new ATOM 0 HZ2 LYS A 84 -2.814 11.725 -2.637 1.00 65.20 H new ATOM 0 HZ3 LYS A 84 -3.587 10.461 -3.467 1.00 65.20 H new ATOM 1421 N PHE A 85 -0.413 4.919 -3.470 1.00 12.13 N ATOM 1422 CA PHE A 85 0.522 4.703 -4.587 1.00 3.33 C ATOM 1423 C PHE A 85 -0.021 3.678 -5.611 1.00 63.10 C ATOM 1424 O PHE A 85 0.177 3.843 -6.815 1.00 32.14 O ATOM 1425 CB PHE A 85 1.872 4.230 -4.005 1.00 2.14 C ATOM 1426 CG PHE A 85 2.932 3.845 -5.032 1.00 3.23 C ATOM 1427 CD1 PHE A 85 3.674 4.816 -5.688 1.00 74.43 C ATOM 1428 CD2 PHE A 85 3.205 2.509 -5.315 1.00 41.43 C ATOM 1429 CE1 PHE A 85 4.653 4.458 -6.591 1.00 13.12 C ATOM 1430 CE2 PHE A 85 4.176 2.156 -6.219 1.00 11.24 C ATOM 1431 CZ PHE A 85 4.904 3.128 -6.855 1.00 5.33 C ATOM 0 H PHE A 85 -0.075 4.545 -2.583 1.00 12.13 H new ATOM 0 HA PHE A 85 0.649 5.641 -5.127 1.00 3.33 H new ATOM 0 HB2 PHE A 85 2.274 5.023 -3.374 1.00 2.14 H new ATOM 0 HB3 PHE A 85 1.688 3.371 -3.359 1.00 2.14 H new ATOM 0 HD1 PHE A 85 3.484 5.861 -5.490 1.00 74.43 H new ATOM 0 HD2 PHE A 85 2.642 1.736 -4.814 1.00 41.43 H new ATOM 0 HE1 PHE A 85 5.226 5.223 -7.094 1.00 13.12 H new ATOM 0 HE2 PHE A 85 4.366 1.114 -6.429 1.00 11.24 H new ATOM 0 HZ PHE A 85 5.673 2.853 -7.562 1.00 5.33 H new ATOM 1441 N ALA A 86 -0.692 2.626 -5.104 1.00 34.55 N ATOM 1442 CA ALA A 86 -1.178 1.486 -5.916 1.00 21.40 C ATOM 1443 C ALA A 86 -2.094 1.919 -7.077 1.00 50.44 C ATOM 1444 O ALA A 86 -1.918 1.476 -8.206 1.00 40.10 O ATOM 1445 CB ALA A 86 -1.907 0.475 -5.026 1.00 2.12 C ATOM 0 H ALA A 86 -0.915 2.540 -4.113 1.00 34.55 H new ATOM 0 HA ALA A 86 -0.298 1.023 -6.362 1.00 21.40 H new ATOM 0 HB1 ALA A 86 -2.259 -0.358 -5.635 1.00 2.12 H new ATOM 0 HB2 ALA A 86 -1.224 0.103 -4.263 1.00 2.12 H new ATOM 0 HB3 ALA A 86 -2.758 0.959 -4.547 1.00 2.12 H new ATOM 1451 N GLU A 87 -3.048 2.814 -6.802 1.00 31.15 N ATOM 1452 CA GLU A 87 -4.001 3.302 -7.832 1.00 4.13 C ATOM 1453 C GLU A 87 -3.292 4.070 -8.995 1.00 21.33 C ATOM 1454 O GLU A 87 -3.864 4.243 -10.074 1.00 63.33 O ATOM 1455 CB GLU A 87 -5.076 4.202 -7.172 1.00 22.21 C ATOM 1456 CG GLU A 87 -4.505 5.438 -6.453 1.00 3.12 C ATOM 1457 CD GLU A 87 -5.582 6.403 -5.931 1.00 34.31 C ATOM 1458 OE1 GLU A 87 -6.199 6.112 -4.884 1.00 40.24 O ATOM 1459 OE2 GLU A 87 -5.817 7.453 -6.567 1.00 23.22 O ATOM 0 H GLU A 87 -3.190 3.222 -5.878 1.00 31.15 H new ATOM 0 HA GLU A 87 -4.474 2.425 -8.275 1.00 4.13 H new ATOM 0 HB2 GLU A 87 -5.778 4.532 -7.938 1.00 22.21 H new ATOM 0 HB3 GLU A 87 -5.642 3.607 -6.455 1.00 22.21 H new ATOM 0 HG2 GLU A 87 -3.889 5.108 -5.616 1.00 3.12 H new ATOM 0 HG3 GLU A 87 -3.850 5.976 -7.139 1.00 3.12 H new ATOM 1466 N TYR A 88 -2.043 4.513 -8.752 1.00 41.34 N ATOM 1467 CA TYR A 88 -1.204 5.210 -9.762 1.00 73.23 C ATOM 1468 C TYR A 88 -0.347 4.221 -10.604 1.00 41.14 C ATOM 1469 O TYR A 88 0.471 4.644 -11.426 1.00 13.14 O ATOM 1470 CB TYR A 88 -0.274 6.230 -9.058 1.00 24.52 C ATOM 1471 CG TYR A 88 -0.992 7.259 -8.163 1.00 52.42 C ATOM 1472 CD1 TYR A 88 -2.180 7.876 -8.566 1.00 42.21 C ATOM 1473 CD2 TYR A 88 -0.474 7.618 -6.917 1.00 65.21 C ATOM 1474 CE1 TYR A 88 -2.816 8.802 -7.762 1.00 44.24 C ATOM 1475 CE2 TYR A 88 -1.106 8.542 -6.121 1.00 0.52 C ATOM 1476 CZ TYR A 88 -2.273 9.130 -6.542 1.00 74.34 C ATOM 1477 OH TYR A 88 -2.896 10.053 -5.735 1.00 15.40 O ATOM 0 H TYR A 88 -1.581 4.400 -7.850 1.00 41.34 H new ATOM 0 HA TYR A 88 -1.880 5.724 -10.445 1.00 73.23 H new ATOM 0 HB2 TYR A 88 0.446 5.682 -8.450 1.00 24.52 H new ATOM 0 HB3 TYR A 88 0.293 6.766 -9.819 1.00 24.52 H new ATOM 0 HD1 TYR A 88 -2.609 7.624 -9.525 1.00 42.21 H new ATOM 0 HD2 TYR A 88 0.441 7.160 -6.572 1.00 65.21 H new ATOM 0 HE1 TYR A 88 -3.735 9.266 -8.090 1.00 44.24 H new ATOM 0 HE2 TYR A 88 -0.684 8.806 -5.163 1.00 0.52 H new ATOM 0 HH TYR A 88 -3.863 10.026 -5.893 1.00 15.40 H new ATOM 1487 N ASN A 89 -0.532 2.908 -10.376 1.00 15.40 N ATOM 1488 CA ASN A 89 0.189 1.826 -11.098 1.00 72.20 C ATOM 1489 C ASN A 89 -0.802 0.757 -11.611 1.00 13.01 C ATOM 1490 O ASN A 89 -1.883 0.581 -11.050 1.00 64.35 O ATOM 1491 CB ASN A 89 1.252 1.168 -10.177 1.00 71.44 C ATOM 1492 CG ASN A 89 2.326 2.153 -9.723 1.00 23.21 C ATOM 1493 OD1 ASN A 89 3.366 2.300 -10.349 1.00 44.44 O ATOM 1494 ND2 ASN A 89 2.063 2.858 -8.647 1.00 23.42 N ATOM 0 H ASN A 89 -1.191 2.558 -9.680 1.00 15.40 H new ATOM 0 HA ASN A 89 0.695 2.271 -11.954 1.00 72.20 H new ATOM 0 HB2 ASN A 89 0.758 0.746 -9.302 1.00 71.44 H new ATOM 0 HB3 ASN A 89 1.724 0.340 -10.707 1.00 71.44 H new ATOM 0 HD21 ASN A 89 2.735 3.550 -8.314 1.00 23.42 H new ATOM 0 HD22 ASN A 89 1.187 2.714 -8.145 1.00 23.42 H new ATOM 1501 N SER A 90 -0.404 0.041 -12.676 1.00 1.24 N ATOM 1502 CA SER A 90 -1.238 -0.996 -13.342 1.00 1.15 C ATOM 1503 C SER A 90 -0.818 -2.435 -12.936 1.00 4.13 C ATOM 1504 O SER A 90 -1.631 -3.368 -12.963 1.00 51.34 O ATOM 1505 CB SER A 90 -1.110 -0.819 -14.871 1.00 12.44 C ATOM 1506 OG SER A 90 -1.967 -1.693 -15.585 1.00 62.32 O ATOM 0 H SER A 90 0.512 0.160 -13.109 1.00 1.24 H new ATOM 0 HA SER A 90 -2.272 -0.866 -13.024 1.00 1.15 H new ATOM 0 HB2 SER A 90 -1.343 0.212 -15.136 1.00 12.44 H new ATOM 0 HB3 SER A 90 -0.078 -1.000 -15.171 1.00 12.44 H new ATOM 0 HG SER A 90 -1.855 -1.547 -16.548 1.00 62.32 H new ATOM 1512 N ASP A 91 0.455 -2.583 -12.534 1.00 11.24 N ATOM 1513 CA ASP A 91 1.120 -3.887 -12.259 1.00 65.42 C ATOM 1514 C ASP A 91 0.922 -4.374 -10.795 1.00 61.44 C ATOM 1515 O ASP A 91 1.822 -4.968 -10.196 1.00 75.31 O ATOM 1516 CB ASP A 91 2.626 -3.730 -12.593 1.00 22.21 C ATOM 1517 CG ASP A 91 3.271 -2.548 -11.842 1.00 42.43 C ATOM 1518 OD1 ASP A 91 3.243 -1.414 -12.371 1.00 35.11 O ATOM 1519 OD2 ASP A 91 3.768 -2.740 -10.710 1.00 42.45 O ATOM 0 H ASP A 91 1.073 -1.786 -12.385 1.00 11.24 H new ATOM 0 HA ASP A 91 0.661 -4.653 -12.884 1.00 65.42 H new ATOM 0 HB2 ASP A 91 3.151 -4.650 -12.337 1.00 22.21 H new ATOM 0 HB3 ASP A 91 2.745 -3.584 -13.667 1.00 22.21 H new ATOM 1524 N LEU A 92 -0.291 -4.196 -10.266 1.00 32.55 N ATOM 1525 CA LEU A 92 -0.566 -4.367 -8.821 1.00 4.32 C ATOM 1526 C LEU A 92 -0.500 -5.832 -8.315 1.00 42.23 C ATOM 1527 O LEU A 92 -0.244 -6.041 -7.127 1.00 44.31 O ATOM 1528 CB LEU A 92 -1.910 -3.703 -8.466 1.00 1.52 C ATOM 1529 CG LEU A 92 -2.014 -2.179 -8.795 1.00 53.33 C ATOM 1530 CD1 LEU A 92 -3.360 -1.581 -8.331 1.00 45.15 C ATOM 1531 CD2 LEU A 92 -0.817 -1.402 -8.207 1.00 71.50 C ATOM 0 H LEU A 92 -1.109 -3.932 -10.814 1.00 32.55 H new ATOM 0 HA LEU A 92 0.245 -3.866 -8.293 1.00 4.32 H new ATOM 0 HB2 LEU A 92 -2.705 -4.227 -8.996 1.00 1.52 H new ATOM 0 HB3 LEU A 92 -2.093 -3.840 -7.400 1.00 1.52 H new ATOM 0 HG LEU A 92 -1.978 -2.076 -9.880 1.00 53.33 H new ATOM 0 HD11 LEU A 92 -3.391 -0.520 -8.579 1.00 45.15 H new ATOM 0 HD12 LEU A 92 -4.179 -2.095 -8.834 1.00 45.15 H new ATOM 0 HD13 LEU A 92 -3.461 -1.705 -7.253 1.00 45.15 H new ATOM 0 HD21 LEU A 92 -0.915 -0.344 -8.451 1.00 71.50 H new ATOM 0 HD22 LEU A 92 -0.800 -1.525 -7.124 1.00 71.50 H new ATOM 0 HD23 LEU A 92 0.110 -1.788 -8.630 1.00 71.50 H new ATOM 1543 N HIS A 93 -0.724 -6.857 -9.177 1.00 42.42 N ATOM 1544 CA HIS A 93 -0.480 -8.272 -8.764 1.00 32.34 C ATOM 1545 C HIS A 93 1.027 -8.555 -8.524 1.00 3.14 C ATOM 1546 O HIS A 93 1.374 -9.511 -7.837 1.00 45.02 O ATOM 1547 CB HIS A 93 -1.123 -9.315 -9.739 1.00 52.44 C ATOM 1548 CG HIS A 93 -0.609 -9.383 -11.162 1.00 50.12 C ATOM 1549 ND1 HIS A 93 -1.449 -9.395 -12.256 1.00 24.24 N ATOM 1550 CD2 HIS A 93 0.637 -9.535 -11.670 1.00 33.14 C ATOM 1551 CE1 HIS A 93 -0.748 -9.549 -13.354 1.00 51.30 C ATOM 1552 NE2 HIS A 93 0.519 -9.635 -13.030 1.00 40.31 N ATOM 0 H HIS A 93 -1.062 -6.742 -10.133 1.00 42.42 H new ATOM 0 HA HIS A 93 -0.989 -8.399 -7.809 1.00 32.34 H new ATOM 0 HB2 HIS A 93 -1.002 -10.303 -9.295 1.00 52.44 H new ATOM 0 HB3 HIS A 93 -2.193 -9.113 -9.782 1.00 52.44 H new ATOM 0 HD1 HIS A 93 -2.464 -9.299 -12.217 1.00 24.24 H new ATOM 0 HD2 HIS A 93 1.557 -9.571 -11.105 1.00 33.14 H new ATOM 0 HE1 HIS A 93 -1.148 -9.597 -14.356 1.00 51.30 H new ATOM 1561 N GLN A 94 1.904 -7.722 -9.124 1.00 42.11 N ATOM 1562 CA GLN A 94 3.367 -7.761 -8.889 1.00 44.05 C ATOM 1563 C GLN A 94 3.747 -6.897 -7.662 1.00 74.31 C ATOM 1564 O GLN A 94 4.514 -7.329 -6.795 1.00 24.52 O ATOM 1565 CB GLN A 94 4.134 -7.250 -10.146 1.00 55.11 C ATOM 1566 CG GLN A 94 3.822 -8.013 -11.453 1.00 11.15 C ATOM 1567 CD GLN A 94 4.584 -7.494 -12.678 1.00 43.20 C ATOM 1568 OE1 GLN A 94 4.912 -6.317 -12.769 1.00 60.52 O ATOM 1569 NE2 GLN A 94 4.861 -8.365 -13.630 1.00 12.23 N ATOM 0 H GLN A 94 1.619 -7.001 -9.787 1.00 42.11 H new ATOM 0 HA GLN A 94 3.650 -8.795 -8.694 1.00 44.05 H new ATOM 0 HB2 GLN A 94 3.900 -6.196 -10.293 1.00 55.11 H new ATOM 0 HB3 GLN A 94 5.205 -7.314 -9.952 1.00 55.11 H new ATOM 0 HG2 GLN A 94 4.059 -9.067 -11.311 1.00 11.15 H new ATOM 0 HG3 GLN A 94 2.752 -7.951 -11.651 1.00 11.15 H new ATOM 0 HE21 GLN A 94 4.576 -9.339 -13.529 1.00 12.23 H new ATOM 0 HE22 GLN A 94 5.360 -8.064 -14.467 1.00 12.23 H new ATOM 1578 N PHE A 95 3.204 -5.663 -7.627 1.00 43.44 N ATOM 1579 CA PHE A 95 3.462 -4.669 -6.563 1.00 43.33 C ATOM 1580 C PHE A 95 3.048 -5.180 -5.154 1.00 32.22 C ATOM 1581 O PHE A 95 3.879 -5.233 -4.243 1.00 23.23 O ATOM 1582 CB PHE A 95 2.729 -3.344 -6.916 1.00 63.33 C ATOM 1583 CG PHE A 95 2.685 -2.318 -5.784 1.00 55.13 C ATOM 1584 CD1 PHE A 95 3.860 -1.788 -5.252 1.00 32.03 C ATOM 1585 CD2 PHE A 95 1.467 -1.904 -5.233 1.00 75.24 C ATOM 1586 CE1 PHE A 95 3.820 -0.884 -4.213 1.00 10.04 C ATOM 1587 CE2 PHE A 95 1.432 -0.997 -4.200 1.00 13.50 C ATOM 1588 CZ PHE A 95 2.606 -0.488 -3.689 1.00 71.41 C ATOM 0 H PHE A 95 2.565 -5.324 -8.346 1.00 43.44 H new ATOM 0 HA PHE A 95 4.537 -4.494 -6.515 1.00 43.33 H new ATOM 0 HB2 PHE A 95 3.219 -2.892 -7.779 1.00 63.33 H new ATOM 0 HB3 PHE A 95 1.708 -3.578 -7.216 1.00 63.33 H new ATOM 0 HD1 PHE A 95 4.813 -2.090 -5.660 1.00 32.03 H new ATOM 0 HD2 PHE A 95 0.542 -2.302 -5.624 1.00 75.24 H new ATOM 0 HE1 PHE A 95 4.739 -0.485 -3.809 1.00 10.04 H new ATOM 0 HE2 PHE A 95 0.484 -0.683 -3.789 1.00 13.50 H new ATOM 0 HZ PHE A 95 2.576 0.223 -2.876 1.00 71.41 H new ATOM 1598 N PHE A 96 1.765 -5.532 -4.988 1.00 51.05 N ATOM 1599 CA PHE A 96 1.235 -6.049 -3.707 1.00 15.13 C ATOM 1600 C PHE A 96 1.861 -7.413 -3.309 1.00 43.13 C ATOM 1601 O PHE A 96 1.932 -7.731 -2.123 1.00 3.25 O ATOM 1602 CB PHE A 96 -0.292 -6.192 -3.773 1.00 74.55 C ATOM 1603 CG PHE A 96 -1.096 -4.899 -3.688 1.00 70.44 C ATOM 1604 CD1 PHE A 96 -1.360 -4.314 -2.454 1.00 60.13 C ATOM 1605 CD2 PHE A 96 -1.631 -4.299 -4.824 1.00 14.03 C ATOM 1606 CE1 PHE A 96 -2.123 -3.172 -2.358 1.00 73.22 C ATOM 1607 CE2 PHE A 96 -2.403 -3.160 -4.728 1.00 2.12 C ATOM 1608 CZ PHE A 96 -2.647 -2.596 -3.494 1.00 54.03 C ATOM 0 H PHE A 96 1.066 -5.469 -5.728 1.00 51.05 H new ATOM 0 HA PHE A 96 1.508 -5.321 -2.943 1.00 15.13 H new ATOM 0 HB2 PHE A 96 -0.549 -6.694 -4.706 1.00 74.55 H new ATOM 0 HB3 PHE A 96 -0.610 -6.846 -2.961 1.00 74.55 H new ATOM 0 HD1 PHE A 96 -0.960 -4.763 -1.557 1.00 60.13 H new ATOM 0 HD2 PHE A 96 -1.439 -4.731 -5.795 1.00 14.03 H new ATOM 0 HE1 PHE A 96 -2.311 -2.728 -1.392 1.00 73.22 H new ATOM 0 HE2 PHE A 96 -2.816 -2.710 -5.619 1.00 2.12 H new ATOM 0 HZ PHE A 96 -3.249 -1.703 -3.418 1.00 54.03 H new ATOM 1618 N GLU A 97 2.272 -8.219 -4.310 1.00 3.53 N ATOM 1619 CA GLU A 97 2.972 -9.501 -4.065 1.00 51.13 C ATOM 1620 C GLU A 97 4.353 -9.258 -3.424 1.00 10.24 C ATOM 1621 O GLU A 97 4.734 -9.944 -2.475 1.00 12.22 O ATOM 1622 CB GLU A 97 3.100 -10.305 -5.382 1.00 15.12 C ATOM 1623 CG GLU A 97 3.759 -11.692 -5.240 1.00 34.12 C ATOM 1624 CD GLU A 97 3.706 -12.527 -6.527 1.00 23.10 C ATOM 1625 OE1 GLU A 97 4.572 -12.339 -7.410 1.00 31.41 O ATOM 1626 OE2 GLU A 97 2.788 -13.369 -6.667 1.00 3.23 O ATOM 0 H GLU A 97 2.132 -8.006 -5.298 1.00 3.53 H new ATOM 0 HA GLU A 97 2.381 -10.090 -3.364 1.00 51.13 H new ATOM 0 HB2 GLU A 97 2.105 -10.434 -5.809 1.00 15.12 H new ATOM 0 HB3 GLU A 97 3.678 -9.716 -6.094 1.00 15.12 H new ATOM 0 HG2 GLU A 97 4.800 -11.563 -4.942 1.00 34.12 H new ATOM 0 HG3 GLU A 97 3.264 -12.241 -4.439 1.00 34.12 H new ATOM 1633 N PHE A 98 5.065 -8.242 -3.941 1.00 1.33 N ATOM 1634 CA PHE A 98 6.321 -7.741 -3.360 1.00 32.44 C ATOM 1635 C PHE A 98 6.115 -7.324 -1.878 1.00 44.12 C ATOM 1636 O PHE A 98 6.880 -7.744 -0.998 1.00 23.21 O ATOM 1637 CB PHE A 98 6.852 -6.568 -4.254 1.00 43.40 C ATOM 1638 CG PHE A 98 7.634 -5.476 -3.526 1.00 65.52 C ATOM 1639 CD1 PHE A 98 8.963 -5.663 -3.149 1.00 3.34 C ATOM 1640 CD2 PHE A 98 7.025 -4.253 -3.223 1.00 62.14 C ATOM 1641 CE1 PHE A 98 9.653 -4.664 -2.490 1.00 10.30 C ATOM 1642 CE2 PHE A 98 7.715 -3.262 -2.564 1.00 4.15 C ATOM 1643 CZ PHE A 98 9.029 -3.464 -2.203 1.00 44.44 C ATOM 0 H PHE A 98 4.781 -7.741 -4.783 1.00 1.33 H new ATOM 0 HA PHE A 98 7.075 -8.528 -3.347 1.00 32.44 H new ATOM 0 HB2 PHE A 98 7.491 -6.989 -5.031 1.00 43.40 H new ATOM 0 HB3 PHE A 98 6.002 -6.106 -4.756 1.00 43.40 H new ATOM 0 HD1 PHE A 98 9.457 -6.597 -3.374 1.00 3.34 H new ATOM 0 HD2 PHE A 98 5.998 -4.085 -3.511 1.00 62.14 H new ATOM 0 HE1 PHE A 98 10.681 -4.821 -2.199 1.00 10.30 H new ATOM 0 HE2 PHE A 98 7.227 -2.327 -2.330 1.00 4.15 H new ATOM 0 HZ PHE A 98 9.574 -2.682 -1.694 1.00 44.44 H new ATOM 1653 N LEU A 99 5.059 -6.523 -1.628 1.00 72.22 N ATOM 1654 CA LEU A 99 4.710 -6.042 -0.276 1.00 60.42 C ATOM 1655 C LEU A 99 4.479 -7.218 0.707 1.00 63.45 C ATOM 1656 O LEU A 99 5.235 -7.376 1.670 1.00 11.22 O ATOM 1657 CB LEU A 99 3.449 -5.134 -0.338 1.00 33.13 C ATOM 1658 CG LEU A 99 3.585 -3.802 -1.148 1.00 43.11 C ATOM 1659 CD1 LEU A 99 2.235 -3.058 -1.217 1.00 62.24 C ATOM 1660 CD2 LEU A 99 4.693 -2.888 -0.567 1.00 52.14 C ATOM 0 H LEU A 99 4.426 -6.192 -2.356 1.00 72.22 H new ATOM 0 HA LEU A 99 5.552 -5.460 0.098 1.00 60.42 H new ATOM 0 HB2 LEU A 99 2.633 -5.713 -0.769 1.00 33.13 H new ATOM 0 HB3 LEU A 99 3.158 -4.884 0.682 1.00 33.13 H new ATOM 0 HG LEU A 99 3.880 -4.067 -2.163 1.00 43.11 H new ATOM 0 HD11 LEU A 99 2.356 -2.136 -1.785 1.00 62.24 H new ATOM 0 HD12 LEU A 99 1.495 -3.691 -1.707 1.00 62.24 H new ATOM 0 HD13 LEU A 99 1.898 -2.821 -0.208 1.00 62.24 H new ATOM 0 HD21 LEU A 99 4.757 -1.973 -1.157 1.00 52.14 H new ATOM 0 HD22 LEU A 99 4.453 -2.638 0.466 1.00 52.14 H new ATOM 0 HD23 LEU A 99 5.650 -3.409 -0.602 1.00 52.14 H new ATOM 1672 N TYR A 100 3.469 -8.056 0.406 1.00 4.52 N ATOM 1673 CA TYR A 100 3.066 -9.201 1.256 1.00 21.42 C ATOM 1674 C TYR A 100 4.243 -10.160 1.549 1.00 22.12 C ATOM 1675 O TYR A 100 4.471 -10.545 2.705 1.00 5.14 O ATOM 1676 CB TYR A 100 1.894 -9.974 0.591 1.00 60.32 C ATOM 1677 CG TYR A 100 1.461 -11.241 1.359 1.00 45.15 C ATOM 1678 CD1 TYR A 100 0.786 -11.152 2.580 1.00 53.35 C ATOM 1679 CD2 TYR A 100 1.746 -12.525 0.871 1.00 22.52 C ATOM 1680 CE1 TYR A 100 0.414 -12.288 3.277 1.00 71.53 C ATOM 1681 CE2 TYR A 100 1.372 -13.656 1.568 1.00 21.34 C ATOM 1682 CZ TYR A 100 0.706 -13.531 2.770 1.00 33.33 C ATOM 1683 OH TYR A 100 0.322 -14.658 3.466 1.00 20.21 O ATOM 0 H TYR A 100 2.904 -7.960 -0.438 1.00 4.52 H new ATOM 0 HA TYR A 100 2.738 -8.794 2.213 1.00 21.42 H new ATOM 0 HB2 TYR A 100 1.037 -9.306 0.500 1.00 60.32 H new ATOM 0 HB3 TYR A 100 2.186 -10.257 -0.420 1.00 60.32 H new ATOM 0 HD1 TYR A 100 0.551 -10.179 2.986 1.00 53.35 H new ATOM 0 HD2 TYR A 100 2.268 -12.631 -0.068 1.00 22.52 H new ATOM 0 HE1 TYR A 100 -0.106 -12.198 4.219 1.00 71.53 H new ATOM 0 HE2 TYR A 100 1.600 -14.635 1.174 1.00 21.34 H new ATOM 0 HH TYR A 100 0.602 -15.458 2.974 1.00 20.21 H new ATOM 1693 N ASN A 101 4.990 -10.520 0.494 1.00 74.35 N ATOM 1694 CA ASN A 101 6.125 -11.455 0.607 1.00 21.24 C ATOM 1695 C ASN A 101 7.344 -10.832 1.331 1.00 24.54 C ATOM 1696 O ASN A 101 8.188 -11.569 1.850 1.00 63.25 O ATOM 1697 CB ASN A 101 6.528 -11.993 -0.786 1.00 23.11 C ATOM 1698 CG ASN A 101 5.435 -12.850 -1.436 1.00 23.15 C ATOM 1699 OD1 ASN A 101 4.624 -13.476 -0.759 1.00 51.25 O ATOM 1700 ND2 ASN A 101 5.414 -12.907 -2.747 1.00 53.21 N ATOM 0 H ASN A 101 4.829 -10.177 -0.453 1.00 74.35 H new ATOM 0 HA ASN A 101 5.788 -12.288 1.224 1.00 21.24 H new ATOM 0 HB2 ASN A 101 6.761 -11.153 -1.440 1.00 23.11 H new ATOM 0 HB3 ASN A 101 7.438 -12.585 -0.691 1.00 23.11 H new ATOM 0 HD21 ASN A 101 4.715 -13.479 -3.221 1.00 53.21 H new ATOM 0 HD22 ASN A 101 6.096 -12.379 -3.291 1.00 53.21 H new ATOM 1707 N HIS A 102 7.446 -9.483 1.357 1.00 42.34 N ATOM 1708 CA HIS A 102 8.493 -8.786 2.151 1.00 63.15 C ATOM 1709 C HIS A 102 8.025 -8.553 3.621 1.00 65.44 C ATOM 1710 O HIS A 102 8.818 -8.156 4.477 1.00 14.42 O ATOM 1711 CB HIS A 102 8.896 -7.439 1.476 1.00 30.20 C ATOM 1712 CG HIS A 102 10.213 -6.880 1.967 1.00 72.42 C ATOM 1713 ND1 HIS A 102 10.362 -6.295 3.205 1.00 63.31 N ATOM 1714 CD2 HIS A 102 11.460 -6.898 1.419 1.00 62.22 C ATOM 1715 CE1 HIS A 102 11.624 -5.991 3.405 1.00 11.02 C ATOM 1716 NE2 HIS A 102 12.309 -6.342 2.340 1.00 41.02 N ATOM 0 H HIS A 102 6.824 -8.858 0.844 1.00 42.34 H new ATOM 0 HA HIS A 102 9.373 -9.429 2.180 1.00 63.15 H new ATOM 0 HB2 HIS A 102 8.954 -7.587 0.398 1.00 30.20 H new ATOM 0 HB3 HIS A 102 8.111 -6.704 1.655 1.00 30.20 H new ATOM 0 HD1 HIS A 102 9.606 -6.124 3.867 1.00 63.31 H new ATOM 0 HD2 HIS A 102 11.728 -7.278 0.444 1.00 62.22 H new ATOM 0 HE1 HIS A 102 12.030 -5.531 4.294 1.00 11.02 H new ATOM 1725 N GLY A 103 6.736 -8.818 3.907 1.00 2.21 N ATOM 1726 CA GLY A 103 6.158 -8.619 5.250 1.00 4.03 C ATOM 1727 C GLY A 103 5.312 -7.351 5.382 1.00 43.45 C ATOM 1728 O GLY A 103 4.680 -7.128 6.427 1.00 24.44 O ATOM 0 H GLY A 103 6.071 -9.173 3.220 1.00 2.21 H new ATOM 0 HA2 GLY A 103 5.542 -9.482 5.501 1.00 4.03 H new ATOM 0 HA3 GLY A 103 6.966 -8.582 5.980 1.00 4.03 H new ATOM 1732 N ILE A 104 5.304 -6.516 4.330 1.00 4.32 N ATOM 1733 CA ILE A 104 4.520 -5.265 4.302 1.00 32.04 C ATOM 1734 C ILE A 104 3.003 -5.585 4.140 1.00 33.11 C ATOM 1735 O ILE A 104 2.580 -6.098 3.105 1.00 51.20 O ATOM 1736 CB ILE A 104 4.980 -4.299 3.137 1.00 14.44 C ATOM 1737 CG1 ILE A 104 6.544 -4.146 3.068 1.00 24.51 C ATOM 1738 CG2 ILE A 104 4.288 -2.913 3.252 1.00 3.21 C ATOM 1739 CD1 ILE A 104 7.202 -3.551 4.301 1.00 10.24 C ATOM 0 H ILE A 104 5.837 -6.686 3.477 1.00 4.32 H new ATOM 0 HA ILE A 104 4.695 -4.755 5.250 1.00 32.04 H new ATOM 0 HB ILE A 104 4.665 -4.761 2.201 1.00 14.44 H new ATOM 0 HG12 ILE A 104 6.979 -5.128 2.885 1.00 24.51 H new ATOM 0 HG13 ILE A 104 6.792 -3.522 2.209 1.00 24.51 H new ATOM 0 HG21 ILE A 104 4.623 -2.270 2.438 1.00 3.21 H new ATOM 0 HG22 ILE A 104 3.207 -3.040 3.192 1.00 3.21 H new ATOM 0 HG23 ILE A 104 4.547 -2.455 4.206 1.00 3.21 H new ATOM 0 HD11 ILE A 104 8.279 -3.491 4.145 1.00 10.24 H new ATOM 0 HD12 ILE A 104 6.805 -2.552 4.479 1.00 10.24 H new ATOM 0 HD13 ILE A 104 6.995 -4.183 5.165 1.00 10.24 H new ATOM 1751 N GLY A 105 2.217 -5.283 5.187 1.00 52.54 N ATOM 1752 CA GLY A 105 0.762 -5.429 5.174 1.00 42.32 C ATOM 1753 C GLY A 105 0.226 -6.789 5.610 1.00 23.24 C ATOM 1754 O GLY A 105 -0.962 -7.051 5.416 1.00 55.14 O ATOM 0 H GLY A 105 2.582 -4.928 6.071 1.00 52.54 H new ATOM 0 HA2 GLY A 105 0.334 -4.666 5.824 1.00 42.32 H new ATOM 0 HA3 GLY A 105 0.405 -5.226 4.165 1.00 42.32 H new ATOM 1758 N THR A 106 1.071 -7.653 6.216 1.00 70.14 N ATOM 1759 CA THR A 106 0.636 -9.006 6.663 1.00 0.20 C ATOM 1760 C THR A 106 -0.407 -8.944 7.808 1.00 21.54 C ATOM 1761 O THR A 106 -1.316 -9.776 7.871 1.00 43.44 O ATOM 1762 CB THR A 106 1.839 -9.906 7.099 1.00 55.22 C ATOM 1763 OG1 THR A 106 2.548 -9.294 8.187 1.00 35.22 O ATOM 1764 CG2 THR A 106 2.810 -10.172 5.933 1.00 30.12 C ATOM 0 H THR A 106 2.051 -7.445 6.408 1.00 70.14 H new ATOM 0 HA THR A 106 0.164 -9.459 5.791 1.00 0.20 H new ATOM 0 HB THR A 106 1.429 -10.864 7.420 1.00 55.22 H new ATOM 0 HG1 THR A 106 2.341 -8.336 8.215 1.00 35.22 H new ATOM 0 HG21 THR A 106 3.631 -10.801 6.279 1.00 30.12 H new ATOM 0 HG22 THR A 106 2.280 -10.679 5.126 1.00 30.12 H new ATOM 0 HG23 THR A 106 3.208 -9.225 5.567 1.00 30.12 H new ATOM 1772 N LEU A 107 -0.267 -7.952 8.713 1.00 14.43 N ATOM 1773 CA LEU A 107 -1.271 -7.679 9.777 1.00 44.05 C ATOM 1774 C LEU A 107 -2.095 -6.401 9.463 1.00 34.50 C ATOM 1775 O LEU A 107 -2.658 -5.769 10.363 1.00 21.22 O ATOM 1776 CB LEU A 107 -0.582 -7.579 11.165 1.00 30.31 C ATOM 1777 CG LEU A 107 0.290 -8.808 11.583 1.00 64.52 C ATOM 1778 CD1 LEU A 107 0.933 -8.599 12.966 1.00 11.34 C ATOM 1779 CD2 LEU A 107 -0.528 -10.109 11.541 1.00 11.35 C ATOM 0 H LEU A 107 0.534 -7.321 8.732 1.00 14.43 H new ATOM 0 HA LEU A 107 -1.969 -8.516 9.805 1.00 44.05 H new ATOM 0 HB2 LEU A 107 0.049 -6.690 11.173 1.00 30.31 H new ATOM 0 HB3 LEU A 107 -1.352 -7.430 11.922 1.00 30.31 H new ATOM 0 HG LEU A 107 1.098 -8.899 10.857 1.00 64.52 H new ATOM 0 HD11 LEU A 107 1.532 -9.472 13.225 1.00 11.34 H new ATOM 0 HD12 LEU A 107 1.571 -7.716 12.941 1.00 11.34 H new ATOM 0 HD13 LEU A 107 0.152 -8.461 13.713 1.00 11.34 H new ATOM 0 HD21 LEU A 107 0.104 -10.946 11.836 1.00 11.35 H new ATOM 0 HD22 LEU A 107 -1.371 -10.031 12.228 1.00 11.35 H new ATOM 0 HD23 LEU A 107 -0.898 -10.273 10.529 1.00 11.35 H new ATOM 1791 N SER A 108 -2.202 -6.066 8.162 1.00 23.14 N ATOM 1792 CA SER A 108 -3.014 -4.926 7.681 1.00 14.14 C ATOM 1793 C SER A 108 -4.025 -5.398 6.603 1.00 24.14 C ATOM 1794 O SER A 108 -3.636 -5.656 5.463 1.00 23.23 O ATOM 1795 CB SER A 108 -2.092 -3.827 7.099 1.00 34.01 C ATOM 1796 OG SER A 108 -1.108 -3.422 8.036 1.00 21.52 O ATOM 0 H SER A 108 -1.730 -6.576 7.415 1.00 23.14 H new ATOM 0 HA SER A 108 -3.570 -4.514 8.523 1.00 14.14 H new ATOM 0 HB2 SER A 108 -1.606 -4.199 6.197 1.00 34.01 H new ATOM 0 HB3 SER A 108 -2.692 -2.966 6.805 1.00 34.01 H new ATOM 0 HG SER A 108 -0.542 -2.729 7.637 1.00 21.52 H new ATOM 1802 N SER A 109 -5.315 -5.513 6.989 1.00 72.11 N ATOM 1803 CA SER A 109 -6.449 -5.823 6.053 1.00 24.52 C ATOM 1804 C SER A 109 -6.516 -4.884 4.807 1.00 55.35 C ATOM 1805 O SER A 109 -6.714 -5.401 3.694 1.00 20.41 O ATOM 1806 CB SER A 109 -7.802 -5.786 6.810 1.00 2.33 C ATOM 1807 OG SER A 109 -8.927 -5.947 5.957 1.00 61.41 O ATOM 0 H SER A 109 -5.613 -5.396 7.957 1.00 72.11 H new ATOM 0 HA SER A 109 -6.255 -6.827 5.675 1.00 24.52 H new ATOM 0 HB2 SER A 109 -7.810 -6.573 7.564 1.00 2.33 H new ATOM 0 HB3 SER A 109 -7.889 -4.837 7.339 1.00 2.33 H new ATOM 0 HG SER A 109 -9.749 -5.917 6.490 1.00 61.41 H new ATOM 1813 N PRO A 110 -6.343 -3.507 4.956 1.00 71.00 N ATOM 1814 CA PRO A 110 -6.248 -2.547 3.812 1.00 43.14 C ATOM 1815 C PRO A 110 -5.423 -3.051 2.583 1.00 32.35 C ATOM 1816 O PRO A 110 -5.794 -2.785 1.432 1.00 53.35 O ATOM 1817 CB PRO A 110 -5.582 -1.291 4.472 1.00 12.24 C ATOM 1818 CG PRO A 110 -5.301 -1.659 5.903 1.00 72.13 C ATOM 1819 CD PRO A 110 -6.292 -2.737 6.235 1.00 40.31 C ATOM 0 HA PRO A 110 -7.229 -2.368 3.371 1.00 43.14 H new ATOM 0 HB2 PRO A 110 -4.662 -1.022 3.953 1.00 12.24 H new ATOM 0 HB3 PRO A 110 -6.244 -0.427 4.416 1.00 12.24 H new ATOM 0 HG2 PRO A 110 -4.278 -2.014 6.024 1.00 72.13 H new ATOM 0 HG3 PRO A 110 -5.420 -0.799 6.561 1.00 72.13 H new ATOM 0 HD2 PRO A 110 -5.961 -3.354 7.071 1.00 40.31 H new ATOM 0 HD3 PRO A 110 -7.266 -2.329 6.506 1.00 40.31 H new ATOM 1827 N LEU A 111 -4.322 -3.789 2.850 1.00 23.24 N ATOM 1828 CA LEU A 111 -3.458 -4.379 1.796 1.00 64.23 C ATOM 1829 C LEU A 111 -4.246 -5.380 0.911 1.00 3.01 C ATOM 1830 O LEU A 111 -4.314 -5.235 -0.315 1.00 2.14 O ATOM 1831 CB LEU A 111 -2.256 -5.132 2.433 1.00 61.15 C ATOM 1832 CG LEU A 111 -1.173 -5.642 1.414 1.00 14.21 C ATOM 1833 CD1 LEU A 111 -0.210 -4.509 1.011 1.00 43.05 C ATOM 1834 CD2 LEU A 111 -0.411 -6.885 1.927 1.00 63.15 C ATOM 0 H LEU A 111 -4.006 -3.993 3.798 1.00 23.24 H new ATOM 0 HA LEU A 111 -3.102 -3.555 1.178 1.00 64.23 H new ATOM 0 HB2 LEU A 111 -1.773 -4.471 3.152 1.00 61.15 H new ATOM 0 HB3 LEU A 111 -2.637 -5.986 2.992 1.00 61.15 H new ATOM 0 HG LEU A 111 -1.708 -5.960 0.519 1.00 14.21 H new ATOM 0 HD11 LEU A 111 0.528 -4.892 0.306 1.00 43.05 H new ATOM 0 HD12 LEU A 111 -0.774 -3.701 0.544 1.00 43.05 H new ATOM 0 HD13 LEU A 111 0.298 -4.131 1.898 1.00 43.05 H new ATOM 0 HD21 LEU A 111 0.324 -7.194 1.184 1.00 63.15 H new ATOM 0 HD22 LEU A 111 0.097 -6.641 2.860 1.00 63.15 H new ATOM 0 HD23 LEU A 111 -1.116 -7.698 2.100 1.00 63.15 H new ATOM 1846 N TYR A 112 -4.853 -6.375 1.582 1.00 72.35 N ATOM 1847 CA TYR A 112 -5.549 -7.508 0.936 1.00 24.44 C ATOM 1848 C TYR A 112 -6.813 -7.061 0.184 1.00 54.23 C ATOM 1849 O TYR A 112 -7.096 -7.563 -0.902 1.00 24.42 O ATOM 1850 CB TYR A 112 -5.930 -8.564 2.001 1.00 54.30 C ATOM 1851 CG TYR A 112 -4.739 -9.102 2.802 1.00 4.34 C ATOM 1852 CD1 TYR A 112 -4.004 -10.196 2.348 1.00 70.53 C ATOM 1853 CD2 TYR A 112 -4.357 -8.521 4.014 1.00 63.15 C ATOM 1854 CE1 TYR A 112 -2.945 -10.693 3.074 1.00 35.41 C ATOM 1855 CE2 TYR A 112 -3.295 -9.013 4.734 1.00 63.13 C ATOM 1856 CZ TYR A 112 -2.596 -10.098 4.266 1.00 61.11 C ATOM 1857 OH TYR A 112 -1.559 -10.605 5.000 1.00 44.31 O ATOM 0 H TYR A 112 -4.876 -6.418 2.601 1.00 72.35 H new ATOM 0 HA TYR A 112 -4.863 -7.938 0.206 1.00 24.44 H new ATOM 0 HB2 TYR A 112 -6.650 -8.125 2.692 1.00 54.30 H new ATOM 0 HB3 TYR A 112 -6.429 -9.398 1.508 1.00 54.30 H new ATOM 0 HD1 TYR A 112 -4.270 -10.662 1.411 1.00 70.53 H new ATOM 0 HD2 TYR A 112 -4.906 -7.671 4.391 1.00 63.15 H new ATOM 0 HE1 TYR A 112 -2.391 -11.546 2.710 1.00 35.41 H new ATOM 0 HE2 TYR A 112 -3.011 -8.547 5.666 1.00 63.13 H new ATOM 0 HH TYR A 112 -0.775 -10.719 4.423 1.00 44.31 H new ATOM 1867 N ILE A 113 -7.568 -6.128 0.793 1.00 25.45 N ATOM 1868 CA ILE A 113 -8.799 -5.562 0.193 1.00 13.25 C ATOM 1869 C ILE A 113 -8.486 -4.840 -1.148 1.00 42.52 C ATOM 1870 O ILE A 113 -9.150 -5.080 -2.164 1.00 74.41 O ATOM 1871 CB ILE A 113 -9.516 -4.569 1.191 1.00 62.22 C ATOM 1872 CG1 ILE A 113 -9.804 -5.263 2.567 1.00 62.41 C ATOM 1873 CG2 ILE A 113 -10.824 -3.987 0.586 1.00 33.42 C ATOM 1874 CD1 ILE A 113 -10.709 -6.490 2.506 1.00 40.41 C ATOM 0 H ILE A 113 -7.346 -5.744 1.712 1.00 25.45 H new ATOM 0 HA ILE A 113 -9.475 -6.393 -0.010 1.00 13.25 H new ATOM 0 HB ILE A 113 -8.833 -3.737 1.362 1.00 62.22 H new ATOM 0 HG12 ILE A 113 -8.853 -5.556 3.013 1.00 62.41 H new ATOM 0 HG13 ILE A 113 -10.257 -4.531 3.236 1.00 62.41 H new ATOM 0 HG21 ILE A 113 -11.287 -3.309 1.303 1.00 33.42 H new ATOM 0 HG22 ILE A 113 -10.591 -3.443 -0.329 1.00 33.42 H new ATOM 0 HG23 ILE A 113 -11.513 -4.800 0.359 1.00 33.42 H new ATOM 0 HD11 ILE A 113 -10.844 -6.893 3.510 1.00 40.41 H new ATOM 0 HD12 ILE A 113 -11.678 -6.207 2.095 1.00 40.41 H new ATOM 0 HD13 ILE A 113 -10.252 -7.248 1.869 1.00 40.41 H new ATOM 1886 N ALA A 114 -7.440 -3.987 -1.132 1.00 64.15 N ATOM 1887 CA ALA A 114 -7.003 -3.220 -2.324 1.00 1.00 C ATOM 1888 C ALA A 114 -6.419 -4.133 -3.434 1.00 34.41 C ATOM 1889 O ALA A 114 -6.667 -3.904 -4.626 1.00 74.34 O ATOM 1890 CB ALA A 114 -5.990 -2.142 -1.913 1.00 43.12 C ATOM 0 H ALA A 114 -6.877 -3.809 -0.300 1.00 64.15 H new ATOM 0 HA ALA A 114 -7.885 -2.740 -2.747 1.00 1.00 H new ATOM 0 HB1 ALA A 114 -5.675 -1.584 -2.795 1.00 43.12 H new ATOM 0 HB2 ALA A 114 -6.453 -1.461 -1.199 1.00 43.12 H new ATOM 0 HB3 ALA A 114 -5.122 -2.615 -1.453 1.00 43.12 H new ATOM 1896 N TRP A 115 -5.648 -5.161 -3.025 1.00 2.04 N ATOM 1897 CA TRP A 115 -5.068 -6.159 -3.954 1.00 44.33 C ATOM 1898 C TRP A 115 -6.195 -6.965 -4.660 1.00 55.32 C ATOM 1899 O TRP A 115 -6.328 -6.915 -5.885 1.00 73.01 O ATOM 1900 CB TRP A 115 -4.101 -7.112 -3.178 1.00 71.54 C ATOM 1901 CG TRP A 115 -3.230 -8.034 -4.032 1.00 11.24 C ATOM 1902 CD1 TRP A 115 -3.152 -8.094 -5.400 1.00 43.41 C ATOM 1903 CD2 TRP A 115 -2.264 -8.990 -3.550 1.00 41.32 C ATOM 1904 NE1 TRP A 115 -2.258 -9.057 -5.786 1.00 20.50 N ATOM 1905 CE2 TRP A 115 -1.691 -9.610 -4.677 1.00 1.55 C ATOM 1906 CE3 TRP A 115 -1.835 -9.387 -2.274 1.00 45.32 C ATOM 1907 CZ2 TRP A 115 -0.726 -10.605 -4.571 1.00 70.54 C ATOM 1908 CZ3 TRP A 115 -0.872 -10.374 -2.170 1.00 11.43 C ATOM 1909 CH2 TRP A 115 -0.329 -10.974 -3.313 1.00 11.31 C ATOM 0 H TRP A 115 -5.409 -5.325 -2.047 1.00 2.04 H new ATOM 0 HA TRP A 115 -4.497 -5.638 -4.722 1.00 44.33 H new ATOM 0 HB2 TRP A 115 -3.446 -6.502 -2.556 1.00 71.54 H new ATOM 0 HB3 TRP A 115 -4.696 -7.730 -2.505 1.00 71.54 H new ATOM 0 HD1 TRP A 115 -3.716 -7.470 -6.077 1.00 43.41 H new ATOM 0 HE1 TRP A 115 -2.050 -9.319 -6.750 1.00 20.50 H new ATOM 0 HE3 TRP A 115 -2.250 -8.929 -1.388 1.00 45.32 H new ATOM 0 HZ2 TRP A 115 -0.304 -11.071 -5.449 1.00 70.54 H new ATOM 0 HZ3 TRP A 115 -0.534 -10.687 -1.193 1.00 11.43 H new ATOM 0 HH2 TRP A 115 0.419 -11.745 -3.200 1.00 11.31 H new ATOM 1920 N ALA A 116 -7.010 -7.662 -3.851 1.00 4.34 N ATOM 1921 CA ALA A 116 -8.104 -8.541 -4.320 1.00 11.53 C ATOM 1922 C ALA A 116 -9.157 -7.810 -5.188 1.00 64.34 C ATOM 1923 O ALA A 116 -9.646 -8.370 -6.176 1.00 51.23 O ATOM 1924 CB ALA A 116 -8.781 -9.199 -3.119 1.00 53.32 C ATOM 0 H ALA A 116 -6.929 -7.633 -2.835 1.00 4.34 H new ATOM 0 HA ALA A 116 -7.649 -9.294 -4.963 1.00 11.53 H new ATOM 0 HB1 ALA A 116 -9.587 -9.846 -3.465 1.00 53.32 H new ATOM 0 HB2 ALA A 116 -8.050 -9.792 -2.569 1.00 53.32 H new ATOM 0 HB3 ALA A 116 -9.190 -8.429 -2.465 1.00 53.32 H new ATOM 1930 N GLY A 117 -9.500 -6.565 -4.792 1.00 4.13 N ATOM 1931 CA GLY A 117 -10.409 -5.711 -5.576 1.00 51.32 C ATOM 1932 C GLY A 117 -9.894 -5.420 -6.988 1.00 33.53 C ATOM 1933 O GLY A 117 -10.655 -5.478 -7.965 1.00 33.53 O ATOM 0 H GLY A 117 -9.159 -6.132 -3.934 1.00 4.13 H new ATOM 0 HA2 GLY A 117 -11.383 -6.195 -5.644 1.00 51.32 H new ATOM 0 HA3 GLY A 117 -10.557 -4.769 -5.049 1.00 51.32 H new ATOM 1937 N HIS A 118 -8.581 -5.130 -7.087 1.00 73.24 N ATOM 1938 CA HIS A 118 -7.895 -4.927 -8.376 1.00 20.31 C ATOM 1939 C HIS A 118 -7.943 -6.211 -9.238 1.00 22.12 C ATOM 1940 O HIS A 118 -8.296 -6.150 -10.414 1.00 62.53 O ATOM 1941 CB HIS A 118 -6.423 -4.489 -8.135 1.00 2.03 C ATOM 1942 CG HIS A 118 -5.557 -4.463 -9.376 1.00 35.22 C ATOM 1943 ND1 HIS A 118 -5.542 -3.422 -10.280 1.00 12.30 N ATOM 1944 CD2 HIS A 118 -4.683 -5.375 -9.864 1.00 64.41 C ATOM 1945 CE1 HIS A 118 -4.706 -3.698 -11.259 1.00 61.43 C ATOM 1946 NE2 HIS A 118 -4.171 -4.872 -11.031 1.00 42.31 N ATOM 0 H HIS A 118 -7.969 -5.030 -6.277 1.00 73.24 H new ATOM 0 HA HIS A 118 -8.414 -4.137 -8.920 1.00 20.31 H new ATOM 0 HB2 HIS A 118 -6.423 -3.495 -7.688 1.00 2.03 H new ATOM 0 HB3 HIS A 118 -5.972 -5.165 -7.408 1.00 2.03 H new ATOM 0 HD2 HIS A 118 -4.435 -6.325 -9.415 1.00 64.41 H new ATOM 0 HE1 HIS A 118 -4.496 -3.063 -12.107 1.00 61.43 H new ATOM 0 HE2 HIS A 118 -3.485 -5.336 -11.626 1.00 42.31 H new ATOM 1955 N LEU A 119 -7.595 -7.364 -8.624 1.00 45.11 N ATOM 1956 CA LEU A 119 -7.503 -8.664 -9.331 1.00 34.12 C ATOM 1957 C LEU A 119 -8.867 -9.086 -9.934 1.00 74.00 C ATOM 1958 O LEU A 119 -8.931 -9.531 -11.075 1.00 42.14 O ATOM 1959 CB LEU A 119 -6.997 -9.767 -8.369 1.00 73.40 C ATOM 1960 CG LEU A 119 -5.647 -9.504 -7.650 1.00 61.54 C ATOM 1961 CD1 LEU A 119 -5.299 -10.643 -6.670 1.00 15.41 C ATOM 1962 CD2 LEU A 119 -4.516 -9.270 -8.665 1.00 72.20 C ATOM 0 H LEU A 119 -7.371 -7.421 -7.631 1.00 45.11 H new ATOM 0 HA LEU A 119 -6.793 -8.540 -10.149 1.00 34.12 H new ATOM 0 HB2 LEU A 119 -7.761 -9.931 -7.609 1.00 73.40 H new ATOM 0 HB3 LEU A 119 -6.906 -10.695 -8.934 1.00 73.40 H new ATOM 0 HG LEU A 119 -5.757 -8.593 -7.062 1.00 61.54 H new ATOM 0 HD11 LEU A 119 -4.348 -10.427 -6.184 1.00 15.41 H new ATOM 0 HD12 LEU A 119 -6.082 -10.726 -5.916 1.00 15.41 H new ATOM 0 HD13 LEU A 119 -5.221 -11.583 -7.217 1.00 15.41 H new ATOM 0 HD21 LEU A 119 -3.582 -9.088 -8.133 1.00 72.20 H new ATOM 0 HD22 LEU A 119 -4.408 -10.150 -9.298 1.00 72.20 H new ATOM 0 HD23 LEU A 119 -4.756 -8.405 -9.284 1.00 72.20 H new ATOM 1974 N GLU A 120 -9.942 -8.927 -9.138 1.00 34.35 N ATOM 1975 CA GLU A 120 -11.341 -9.164 -9.576 1.00 65.14 C ATOM 1976 C GLU A 120 -11.685 -8.369 -10.859 1.00 0.41 C ATOM 1977 O GLU A 120 -12.249 -8.923 -11.814 1.00 62.10 O ATOM 1978 CB GLU A 120 -12.310 -8.750 -8.444 1.00 23.21 C ATOM 1979 CG GLU A 120 -13.801 -8.832 -8.816 1.00 32.33 C ATOM 1980 CD GLU A 120 -14.728 -8.323 -7.715 1.00 72.54 C ATOM 1981 OE1 GLU A 120 -15.099 -9.107 -6.833 1.00 3.33 O ATOM 1982 OE2 GLU A 120 -15.071 -7.126 -7.723 1.00 70.30 O ATOM 0 H GLU A 120 -9.869 -8.629 -8.165 1.00 34.35 H new ATOM 0 HA GLU A 120 -11.446 -10.226 -9.800 1.00 65.14 H new ATOM 0 HB2 GLU A 120 -12.129 -9.387 -7.578 1.00 23.21 H new ATOM 0 HB3 GLU A 120 -12.080 -7.728 -8.142 1.00 23.21 H new ATOM 0 HG2 GLU A 120 -13.974 -8.253 -9.723 1.00 32.33 H new ATOM 0 HG3 GLU A 120 -14.055 -9.867 -9.045 1.00 32.33 H new ATOM 1989 N ALA A 121 -11.310 -7.071 -10.862 1.00 2.54 N ATOM 1990 CA ALA A 121 -11.522 -6.157 -12.008 1.00 33.11 C ATOM 1991 C ALA A 121 -10.767 -6.626 -13.282 1.00 52.22 C ATOM 1992 O ALA A 121 -11.154 -6.286 -14.402 1.00 13.22 O ATOM 1993 CB ALA A 121 -11.101 -4.726 -11.617 1.00 53.00 C ATOM 0 H ALA A 121 -10.850 -6.626 -10.068 1.00 2.54 H new ATOM 0 HA ALA A 121 -12.584 -6.168 -12.252 1.00 33.11 H new ATOM 0 HB1 ALA A 121 -11.258 -4.057 -12.463 1.00 53.00 H new ATOM 0 HB2 ALA A 121 -11.700 -4.389 -10.771 1.00 53.00 H new ATOM 0 HB3 ALA A 121 -10.047 -4.720 -11.341 1.00 53.00 H new ATOM 1999 N GLN A 122 -9.687 -7.409 -13.088 1.00 75.33 N ATOM 2000 CA GLN A 122 -8.901 -8.009 -14.194 1.00 61.21 C ATOM 2001 C GLN A 122 -9.449 -9.407 -14.589 1.00 44.22 C ATOM 2002 O GLN A 122 -9.274 -9.849 -15.729 1.00 20.34 O ATOM 2003 CB GLN A 122 -7.406 -8.110 -13.777 1.00 4.13 C ATOM 2004 CG GLN A 122 -6.827 -6.804 -13.183 1.00 52.00 C ATOM 2005 CD GLN A 122 -6.951 -5.579 -14.095 1.00 22.14 C ATOM 2006 OE1 GLN A 122 -6.898 -5.679 -15.314 1.00 21.24 O ATOM 2007 NE2 GLN A 122 -7.147 -4.412 -13.512 1.00 74.53 N ATOM 0 H GLN A 122 -9.332 -7.646 -12.162 1.00 75.33 H new ATOM 0 HA GLN A 122 -8.991 -7.364 -15.068 1.00 61.21 H new ATOM 0 HB2 GLN A 122 -7.297 -8.909 -13.044 1.00 4.13 H new ATOM 0 HB3 GLN A 122 -6.815 -8.394 -14.648 1.00 4.13 H new ATOM 0 HG2 GLN A 122 -7.334 -6.593 -12.241 1.00 52.00 H new ATOM 0 HG3 GLN A 122 -5.774 -6.962 -12.950 1.00 52.00 H new ATOM 0 HE21 GLN A 122 -7.188 -4.351 -12.495 1.00 74.53 H new ATOM 0 HE22 GLN A 122 -7.258 -3.571 -14.079 1.00 74.53 H new ATOM 2016 N GLY A 123 -10.110 -10.093 -13.634 1.00 0.34 N ATOM 2017 CA GLY A 123 -10.657 -11.450 -13.847 1.00 71.11 C ATOM 2018 C GLY A 123 -10.013 -12.511 -12.948 1.00 20.24 C ATOM 2019 O GLY A 123 -10.442 -13.667 -12.944 1.00 34.23 O ATOM 0 H GLY A 123 -10.279 -9.725 -12.698 1.00 0.34 H new ATOM 0 HA2 GLY A 123 -11.732 -11.434 -13.665 1.00 71.11 H new ATOM 0 HA3 GLY A 123 -10.514 -11.732 -14.890 1.00 71.11 H new ATOM 2023 N GLU A 124 -8.977 -12.102 -12.189 1.00 52.53 N ATOM 2024 CA GLU A 124 -8.256 -12.964 -11.218 1.00 23.33 C ATOM 2025 C GLU A 124 -9.060 -13.158 -9.897 1.00 34.22 C ATOM 2026 O GLU A 124 -8.570 -12.868 -8.806 1.00 25.33 O ATOM 2027 CB GLU A 124 -6.870 -12.348 -10.906 1.00 13.23 C ATOM 2028 CG GLU A 124 -5.938 -12.171 -12.103 1.00 34.21 C ATOM 2029 CD GLU A 124 -4.583 -11.549 -11.734 1.00 51.04 C ATOM 2030 OE1 GLU A 124 -3.887 -12.100 -10.856 1.00 73.23 O ATOM 2031 OE2 GLU A 124 -4.216 -10.505 -12.296 1.00 70.44 O ATOM 0 H GLU A 124 -8.609 -11.152 -12.230 1.00 52.53 H new ATOM 0 HA GLU A 124 -8.134 -13.947 -11.673 1.00 23.33 H new ATOM 0 HB2 GLU A 124 -7.022 -11.374 -10.441 1.00 13.23 H new ATOM 0 HB3 GLU A 124 -6.370 -12.978 -10.170 1.00 13.23 H new ATOM 0 HG2 GLU A 124 -5.769 -13.142 -12.569 1.00 34.21 H new ATOM 0 HG3 GLU A 124 -6.428 -11.542 -12.846 1.00 34.21 H new ATOM 2038 N LEU A 125 -10.290 -13.662 -10.029 1.00 51.40 N ATOM 2039 CA LEU A 125 -11.210 -13.937 -8.905 1.00 72.55 C ATOM 2040 C LEU A 125 -10.666 -15.005 -7.915 1.00 55.21 C ATOM 2041 O LEU A 125 -10.731 -14.820 -6.702 1.00 55.23 O ATOM 2042 CB LEU A 125 -12.580 -14.353 -9.502 1.00 21.40 C ATOM 2043 CG LEU A 125 -13.448 -13.180 -10.071 1.00 61.31 C ATOM 2044 CD1 LEU A 125 -14.462 -13.677 -11.122 1.00 72.22 C ATOM 2045 CD2 LEU A 125 -14.165 -12.428 -8.926 1.00 51.34 C ATOM 0 H LEU A 125 -10.689 -13.898 -10.937 1.00 51.40 H new ATOM 0 HA LEU A 125 -11.315 -13.032 -8.307 1.00 72.55 H new ATOM 0 HB2 LEU A 125 -12.405 -15.074 -10.301 1.00 21.40 H new ATOM 0 HB3 LEU A 125 -13.153 -14.865 -8.730 1.00 21.40 H new ATOM 0 HG LEU A 125 -12.775 -12.485 -10.573 1.00 61.31 H new ATOM 0 HD11 LEU A 125 -15.045 -12.834 -11.493 1.00 72.22 H new ATOM 0 HD12 LEU A 125 -13.928 -14.142 -11.951 1.00 72.22 H new ATOM 0 HD13 LEU A 125 -15.130 -14.407 -10.666 1.00 72.22 H new ATOM 0 HD21 LEU A 125 -14.763 -11.617 -9.342 1.00 51.34 H new ATOM 0 HD22 LEU A 125 -14.814 -13.118 -8.388 1.00 51.34 H new ATOM 0 HD23 LEU A 125 -13.424 -12.018 -8.240 1.00 51.34 H new ATOM 2057 N GLN A 126 -10.111 -16.107 -8.433 1.00 62.44 N ATOM 2058 CA GLN A 126 -9.578 -17.205 -7.585 1.00 44.43 C ATOM 2059 C GLN A 126 -8.255 -16.794 -6.880 1.00 41.43 C ATOM 2060 O GLN A 126 -8.006 -17.187 -5.737 1.00 1.02 O ATOM 2061 CB GLN A 126 -9.393 -18.504 -8.420 1.00 4.42 C ATOM 2062 CG GLN A 126 -10.699 -19.263 -8.780 1.00 22.50 C ATOM 2063 CD GLN A 126 -11.712 -18.447 -9.589 1.00 33.24 C ATOM 2064 OE1 GLN A 126 -11.649 -18.396 -10.810 1.00 41.53 O ATOM 2065 NE2 GLN A 126 -12.657 -17.808 -8.917 1.00 24.02 N ATOM 0 H GLN A 126 -10.014 -16.272 -9.435 1.00 62.44 H new ATOM 0 HA GLN A 126 -10.310 -17.406 -6.802 1.00 44.43 H new ATOM 0 HB2 GLN A 126 -8.876 -18.249 -9.345 1.00 4.42 H new ATOM 0 HB3 GLN A 126 -8.742 -19.181 -7.866 1.00 4.42 H new ATOM 0 HG2 GLN A 126 -10.439 -20.158 -9.346 1.00 22.50 H new ATOM 0 HG3 GLN A 126 -11.175 -19.596 -7.858 1.00 22.50 H new ATOM 0 HE21 GLN A 126 -12.687 -17.867 -7.899 1.00 24.02 H new ATOM 0 HE22 GLN A 126 -13.355 -17.257 -9.417 1.00 24.02 H new ATOM 2074 N HIS A 127 -7.429 -15.987 -7.571 1.00 41.20 N ATOM 2075 CA HIS A 127 -6.174 -15.439 -7.012 1.00 73.03 C ATOM 2076 C HIS A 127 -6.478 -14.394 -5.907 1.00 72.52 C ATOM 2077 O HIS A 127 -5.800 -14.344 -4.885 1.00 13.52 O ATOM 2078 CB HIS A 127 -5.313 -14.811 -8.147 1.00 51.40 C ATOM 2079 CG HIS A 127 -4.003 -14.208 -7.691 1.00 41.01 C ATOM 2080 ND1 HIS A 127 -3.521 -13.002 -8.147 1.00 22.32 N ATOM 2081 CD2 HIS A 127 -3.075 -14.654 -6.810 1.00 5.13 C ATOM 2082 CE1 HIS A 127 -2.369 -12.739 -7.572 1.00 75.01 C ATOM 2083 NE2 HIS A 127 -2.076 -13.723 -6.757 1.00 71.32 N ATOM 0 H HIS A 127 -7.610 -15.695 -8.531 1.00 41.20 H new ATOM 0 HA HIS A 127 -5.608 -16.252 -6.558 1.00 73.03 H new ATOM 0 HB2 HIS A 127 -5.103 -15.579 -8.892 1.00 51.40 H new ATOM 0 HB3 HIS A 127 -5.900 -14.038 -8.643 1.00 51.40 H new ATOM 0 HD1 HIS A 127 -3.987 -12.403 -8.828 1.00 22.32 H new ATOM 0 HD2 HIS A 127 -3.117 -15.577 -6.251 1.00 5.13 H new ATOM 0 HE1 HIS A 127 -1.765 -11.860 -7.742 1.00 75.01 H new ATOM 2092 N ALA A 128 -7.502 -13.568 -6.149 1.00 12.00 N ATOM 2093 CA ALA A 128 -7.996 -12.562 -5.190 1.00 41.03 C ATOM 2094 C ALA A 128 -8.615 -13.198 -3.926 1.00 32.10 C ATOM 2095 O ALA A 128 -8.428 -12.694 -2.815 1.00 72.44 O ATOM 2096 CB ALA A 128 -9.000 -11.668 -5.898 1.00 2.53 C ATOM 0 H ALA A 128 -8.021 -13.576 -7.027 1.00 12.00 H new ATOM 0 HA ALA A 128 -7.148 -11.972 -4.843 1.00 41.03 H new ATOM 0 HB1 ALA A 128 -9.375 -10.918 -5.201 1.00 2.53 H new ATOM 0 HB2 ALA A 128 -8.516 -11.172 -6.739 1.00 2.53 H new ATOM 0 HB3 ALA A 128 -9.831 -12.272 -6.263 1.00 2.53 H new ATOM 2102 N SER A 129 -9.361 -14.300 -4.116 1.00 61.52 N ATOM 2103 CA SER A 129 -9.849 -15.151 -3.004 1.00 2.41 C ATOM 2104 C SER A 129 -8.664 -15.709 -2.188 1.00 24.24 C ATOM 2105 O SER A 129 -8.669 -15.666 -0.951 1.00 15.13 O ATOM 2106 CB SER A 129 -10.707 -16.313 -3.551 1.00 54.33 C ATOM 2107 OG SER A 129 -11.201 -17.131 -2.500 1.00 24.10 O ATOM 0 H SER A 129 -9.645 -14.629 -5.039 1.00 61.52 H new ATOM 0 HA SER A 129 -10.466 -14.536 -2.349 1.00 2.41 H new ATOM 0 HB2 SER A 129 -11.542 -15.912 -4.125 1.00 54.33 H new ATOM 0 HB3 SER A 129 -10.111 -16.917 -4.235 1.00 54.33 H new ATOM 0 HG SER A 129 -11.138 -16.646 -1.651 1.00 24.10 H new ATOM 2113 N ALA A 130 -7.625 -16.167 -2.922 1.00 43.41 N ATOM 2114 CA ALA A 130 -6.368 -16.680 -2.342 1.00 3.25 C ATOM 2115 C ALA A 130 -5.615 -15.593 -1.535 1.00 20.44 C ATOM 2116 O ALA A 130 -4.836 -15.916 -0.654 1.00 62.04 O ATOM 2117 CB ALA A 130 -5.469 -17.255 -3.451 1.00 21.41 C ATOM 0 H ALA A 130 -7.638 -16.190 -3.942 1.00 43.41 H new ATOM 0 HA ALA A 130 -6.626 -17.476 -1.644 1.00 3.25 H new ATOM 0 HB1 ALA A 130 -4.545 -17.630 -3.012 1.00 21.41 H new ATOM 0 HB2 ALA A 130 -5.989 -18.070 -3.955 1.00 21.41 H new ATOM 0 HB3 ALA A 130 -5.236 -16.472 -4.173 1.00 21.41 H new ATOM 2123 N VAL A 131 -5.869 -14.310 -1.850 1.00 14.14 N ATOM 2124 CA VAL A 131 -5.303 -13.159 -1.109 1.00 52.04 C ATOM 2125 C VAL A 131 -6.095 -12.872 0.194 1.00 70.24 C ATOM 2126 O VAL A 131 -5.503 -12.726 1.266 1.00 3.41 O ATOM 2127 CB VAL A 131 -5.270 -11.877 -2.035 1.00 1.12 C ATOM 2128 CG1 VAL A 131 -4.944 -10.583 -1.251 1.00 52.40 C ATOM 2129 CG2 VAL A 131 -4.279 -12.083 -3.208 1.00 54.13 C ATOM 0 H VAL A 131 -6.473 -14.038 -2.626 1.00 14.14 H new ATOM 0 HA VAL A 131 -4.283 -13.415 -0.821 1.00 52.04 H new ATOM 0 HB VAL A 131 -6.274 -11.747 -2.440 1.00 1.12 H new ATOM 0 HG11 VAL A 131 -4.935 -9.735 -1.936 1.00 52.40 H new ATOM 0 HG12 VAL A 131 -5.702 -10.422 -0.484 1.00 52.40 H new ATOM 0 HG13 VAL A 131 -3.966 -10.680 -0.780 1.00 52.40 H new ATOM 0 HG21 VAL A 131 -4.268 -11.192 -3.836 1.00 54.13 H new ATOM 0 HG22 VAL A 131 -3.279 -12.261 -2.812 1.00 54.13 H new ATOM 0 HG23 VAL A 131 -4.592 -12.942 -3.802 1.00 54.13 H new ATOM 2139 N LEU A 132 -7.429 -12.810 0.086 1.00 24.34 N ATOM 2140 CA LEU A 132 -8.319 -12.452 1.220 1.00 2.30 C ATOM 2141 C LEU A 132 -8.256 -13.504 2.362 1.00 22.02 C ATOM 2142 O LEU A 132 -8.249 -13.142 3.547 1.00 61.10 O ATOM 2143 CB LEU A 132 -9.777 -12.272 0.726 1.00 30.53 C ATOM 2144 CG LEU A 132 -10.039 -11.106 -0.277 1.00 63.23 C ATOM 2145 CD1 LEU A 132 -11.483 -11.145 -0.821 1.00 62.24 C ATOM 2146 CD2 LEU A 132 -9.723 -9.732 0.357 1.00 1.23 C ATOM 0 H LEU A 132 -7.928 -13.004 -0.782 1.00 24.34 H new ATOM 0 HA LEU A 132 -7.964 -11.506 1.630 1.00 2.30 H new ATOM 0 HB2 LEU A 132 -10.094 -13.203 0.256 1.00 30.53 H new ATOM 0 HB3 LEU A 132 -10.415 -12.121 1.597 1.00 30.53 H new ATOM 0 HG LEU A 132 -9.362 -11.246 -1.120 1.00 63.23 H new ATOM 0 HD11 LEU A 132 -11.632 -10.319 -1.517 1.00 62.24 H new ATOM 0 HD12 LEU A 132 -11.652 -12.090 -1.338 1.00 62.24 H new ATOM 0 HD13 LEU A 132 -12.186 -11.053 0.007 1.00 62.24 H new ATOM 0 HD21 LEU A 132 -9.917 -8.943 -0.370 1.00 1.23 H new ATOM 0 HD22 LEU A 132 -10.354 -9.582 1.233 1.00 1.23 H new ATOM 0 HD23 LEU A 132 -8.675 -9.701 0.655 1.00 1.23 H new ATOM 2158 N GLN A 133 -8.180 -14.804 1.983 1.00 44.10 N ATOM 2159 CA GLN A 133 -8.027 -15.919 2.957 1.00 64.14 C ATOM 2160 C GLN A 133 -6.706 -15.805 3.760 1.00 13.41 C ATOM 2161 O GLN A 133 -6.669 -16.172 4.939 1.00 71.13 O ATOM 2162 CB GLN A 133 -8.094 -17.304 2.259 1.00 70.32 C ATOM 2163 CG GLN A 133 -7.015 -17.544 1.194 1.00 70.40 C ATOM 2164 CD GLN A 133 -7.001 -18.974 0.644 1.00 3.15 C ATOM 2165 OE1 GLN A 133 -7.665 -19.283 -0.339 1.00 10.22 O ATOM 2166 NE2 GLN A 133 -6.246 -19.852 1.273 1.00 30.31 N ATOM 0 H GLN A 133 -8.222 -15.108 1.010 1.00 44.10 H new ATOM 0 HA GLN A 133 -8.863 -15.837 3.651 1.00 64.14 H new ATOM 0 HB2 GLN A 133 -8.013 -18.082 3.019 1.00 70.32 H new ATOM 0 HB3 GLN A 133 -9.074 -17.413 1.794 1.00 70.32 H new ATOM 0 HG2 GLN A 133 -7.170 -16.848 0.369 1.00 70.40 H new ATOM 0 HG3 GLN A 133 -6.038 -17.319 1.622 1.00 70.40 H new ATOM 0 HE21 GLN A 133 -5.704 -19.567 2.089 1.00 30.31 H new ATOM 0 HE22 GLN A 133 -6.204 -20.817 0.944 1.00 30.31 H new ATOM 2175 N ARG A 134 -5.635 -15.287 3.100 1.00 2.10 N ATOM 2176 CA ARG A 134 -4.331 -15.031 3.750 1.00 1.05 C ATOM 2177 C ARG A 134 -4.497 -14.059 4.919 1.00 53.13 C ATOM 2178 O ARG A 134 -4.078 -14.356 6.023 1.00 61.43 O ATOM 2179 CB ARG A 134 -3.306 -14.449 2.748 1.00 5.11 C ATOM 2180 CG ARG A 134 -2.878 -15.418 1.644 1.00 63.03 C ATOM 2181 CD ARG A 134 -1.960 -14.764 0.597 1.00 71.33 C ATOM 2182 NE ARG A 134 -1.221 -15.771 -0.183 1.00 65.04 N ATOM 2183 CZ ARG A 134 -1.340 -16.000 -1.470 1.00 53.14 C ATOM 2184 NH1 ARG A 134 -2.214 -15.368 -2.197 1.00 50.13 N ATOM 2185 NH2 ARG A 134 -0.584 -16.885 -2.023 1.00 45.14 N ATOM 0 H ARG A 134 -5.656 -15.039 2.111 1.00 2.10 H new ATOM 0 HA ARG A 134 -3.958 -15.987 4.118 1.00 1.05 H new ATOM 0 HB2 ARG A 134 -3.733 -13.558 2.287 1.00 5.11 H new ATOM 0 HB3 ARG A 134 -2.420 -14.130 3.298 1.00 5.11 H new ATOM 0 HG2 ARG A 134 -2.362 -16.267 2.092 1.00 63.03 H new ATOM 0 HG3 ARG A 134 -3.766 -15.810 1.147 1.00 63.03 H new ATOM 0 HD2 ARG A 134 -2.556 -14.148 -0.076 1.00 71.33 H new ATOM 0 HD3 ARG A 134 -1.254 -14.100 1.096 1.00 71.33 H new ATOM 0 HE ARG A 134 -0.551 -16.347 0.327 1.00 65.04 H new ATOM 0 HH11 ARG A 134 -2.828 -14.675 -1.769 1.00 50.13 H new ATOM 0 HH12 ARG A 134 -2.285 -15.565 -3.195 1.00 50.13 H new ATOM 0 HH21 ARG A 134 0.096 -17.397 -1.462 1.00 45.14 H new ATOM 0 HH22 ARG A 134 -0.666 -17.073 -3.022 1.00 45.14 H new ATOM 2199 N GLY A 135 -5.152 -12.919 4.656 1.00 32.42 N ATOM 2200 CA GLY A 135 -5.386 -11.906 5.680 1.00 35.14 C ATOM 2201 C GLY A 135 -6.198 -12.403 6.878 1.00 4.42 C ATOM 2202 O GLY A 135 -5.906 -12.046 8.018 1.00 44.34 O ATOM 0 H GLY A 135 -5.528 -12.681 3.738 1.00 32.42 H new ATOM 0 HA2 GLY A 135 -4.424 -11.535 6.035 1.00 35.14 H new ATOM 0 HA3 GLY A 135 -5.906 -11.061 5.228 1.00 35.14 H new ATOM 2206 N ILE A 136 -7.221 -13.223 6.605 1.00 40.41 N ATOM 2207 CA ILE A 136 -8.039 -13.868 7.649 1.00 11.54 C ATOM 2208 C ILE A 136 -7.169 -14.749 8.587 1.00 72.01 C ATOM 2209 O ILE A 136 -7.149 -14.531 9.797 1.00 23.02 O ATOM 2210 CB ILE A 136 -9.188 -14.729 7.003 1.00 61.33 C ATOM 2211 CG1 ILE A 136 -10.157 -13.828 6.183 1.00 71.20 C ATOM 2212 CG2 ILE A 136 -9.963 -15.529 8.076 1.00 22.22 C ATOM 2213 CD1 ILE A 136 -11.149 -14.591 5.330 1.00 73.45 C ATOM 0 H ILE A 136 -7.508 -13.460 5.655 1.00 40.41 H new ATOM 0 HA ILE A 136 -8.489 -13.078 8.250 1.00 11.54 H new ATOM 0 HB ILE A 136 -8.725 -15.445 6.324 1.00 61.33 H new ATOM 0 HG12 ILE A 136 -10.706 -13.186 6.871 1.00 71.20 H new ATOM 0 HG13 ILE A 136 -9.569 -13.175 5.538 1.00 71.20 H new ATOM 0 HG21 ILE A 136 -10.749 -16.113 7.597 1.00 22.22 H new ATOM 0 HG22 ILE A 136 -9.278 -16.199 8.595 1.00 22.22 H new ATOM 0 HG23 ILE A 136 -10.409 -14.839 8.793 1.00 22.22 H new ATOM 0 HD11 ILE A 136 -11.785 -13.887 4.793 1.00 73.45 H new ATOM 0 HD12 ILE A 136 -10.611 -15.213 4.614 1.00 73.45 H new ATOM 0 HD13 ILE A 136 -11.766 -15.224 5.968 1.00 73.45 H new ATOM 2225 N GLN A 137 -6.414 -15.700 8.000 1.00 73.13 N ATOM 2226 CA GLN A 137 -5.558 -16.642 8.776 1.00 12.21 C ATOM 2227 C GLN A 137 -4.305 -15.939 9.384 1.00 62.13 C ATOM 2228 O GLN A 137 -3.708 -16.446 10.338 1.00 31.23 O ATOM 2229 CB GLN A 137 -5.147 -17.858 7.898 1.00 5.31 C ATOM 2230 CG GLN A 137 -4.309 -17.497 6.662 1.00 51.31 C ATOM 2231 CD GLN A 137 -4.059 -18.679 5.723 1.00 34.23 C ATOM 2232 OE1 GLN A 137 -3.068 -19.389 5.840 1.00 13.21 O ATOM 2233 NE2 GLN A 137 -4.963 -18.901 4.783 1.00 25.15 N ATOM 0 H GLN A 137 -6.375 -15.842 6.991 1.00 73.13 H new ATOM 0 HA GLN A 137 -6.153 -17.004 9.614 1.00 12.21 H new ATOM 0 HB2 GLN A 137 -4.582 -18.559 8.512 1.00 5.31 H new ATOM 0 HB3 GLN A 137 -6.049 -18.376 7.571 1.00 5.31 H new ATOM 0 HG2 GLN A 137 -4.815 -16.706 6.109 1.00 51.31 H new ATOM 0 HG3 GLN A 137 -3.350 -17.095 6.989 1.00 51.31 H new ATOM 0 HE21 GLN A 137 -5.780 -18.294 4.707 1.00 25.15 H new ATOM 0 HE22 GLN A 137 -4.843 -19.679 4.134 1.00 25.15 H new ATOM 2242 N ASN A 138 -3.932 -14.764 8.830 1.00 12.12 N ATOM 2243 CA ASN A 138 -2.852 -13.903 9.379 1.00 24.10 C ATOM 2244 C ASN A 138 -3.382 -12.972 10.500 1.00 62.21 C ATOM 2245 O ASN A 138 -2.591 -12.331 11.177 1.00 71.13 O ATOM 2246 CB ASN A 138 -2.193 -13.047 8.254 1.00 4.24 C ATOM 2247 CG ASN A 138 -1.363 -13.871 7.265 1.00 45.13 C ATOM 2248 OD1 ASN A 138 -0.795 -14.895 7.618 1.00 20.00 O ATOM 2249 ND2 ASN A 138 -1.278 -13.432 6.019 1.00 75.32 N ATOM 0 H ASN A 138 -4.368 -14.383 7.991 1.00 12.12 H new ATOM 0 HA ASN A 138 -2.100 -14.566 9.807 1.00 24.10 H new ATOM 0 HB2 ASN A 138 -2.973 -12.517 7.708 1.00 4.24 H new ATOM 0 HB3 ASN A 138 -1.554 -12.291 8.711 1.00 4.24 H new ATOM 0 HD21 ASN A 138 -0.731 -13.950 5.332 1.00 75.32 H new ATOM 0 HD22 ASN A 138 -1.760 -12.575 5.746 1.00 75.32 H new ATOM 2256 N GLN A 139 -4.729 -12.902 10.666 1.00 41.15 N ATOM 2257 CA GLN A 139 -5.421 -12.045 11.684 1.00 55.12 C ATOM 2258 C GLN A 139 -5.308 -10.524 11.346 1.00 40.45 C ATOM 2259 O GLN A 139 -5.508 -9.674 12.221 1.00 33.10 O ATOM 2260 CB GLN A 139 -4.913 -12.319 13.141 1.00 52.42 C ATOM 2261 CG GLN A 139 -4.888 -13.800 13.591 1.00 51.12 C ATOM 2262 CD GLN A 139 -6.240 -14.515 13.485 1.00 64.14 C ATOM 2263 OE1 GLN A 139 -7.057 -14.468 14.393 1.00 52.51 O ATOM 2264 NE2 GLN A 139 -6.473 -15.196 12.385 1.00 13.51 N ATOM 0 H GLN A 139 -5.378 -13.442 10.094 1.00 41.15 H new ATOM 0 HA GLN A 139 -6.474 -12.324 11.642 1.00 55.12 H new ATOM 0 HB2 GLN A 139 -3.904 -11.916 13.233 1.00 52.42 H new ATOM 0 HB3 GLN A 139 -5.543 -11.761 13.834 1.00 52.42 H new ATOM 0 HG2 GLN A 139 -4.157 -14.339 12.988 1.00 51.12 H new ATOM 0 HG3 GLN A 139 -4.545 -13.848 14.625 1.00 51.12 H new ATOM 0 HE21 GLN A 139 -5.775 -15.219 11.642 1.00 13.51 H new ATOM 0 HE22 GLN A 139 -7.352 -15.701 12.275 1.00 13.51 H new ATOM 2273 N ALA A 140 -5.042 -10.214 10.061 1.00 32.22 N ATOM 2274 CA ALA A 140 -4.789 -8.841 9.558 1.00 22.00 C ATOM 2275 C ALA A 140 -5.924 -7.835 9.878 1.00 53.22 C ATOM 2276 O ALA A 140 -7.050 -8.000 9.416 1.00 45.12 O ATOM 2277 CB ALA A 140 -4.534 -8.888 8.048 1.00 2.32 C ATOM 0 H ALA A 140 -4.995 -10.921 9.327 1.00 32.22 H new ATOM 0 HA ALA A 140 -3.908 -8.474 10.085 1.00 22.00 H new ATOM 0 HB1 ALA A 140 -4.348 -7.879 7.679 1.00 2.32 H new ATOM 0 HB2 ALA A 140 -3.665 -9.514 7.845 1.00 2.32 H new ATOM 0 HB3 ALA A 140 -5.407 -9.304 7.544 1.00 2.32 H new ATOM 2283 N GLU A 141 -5.570 -6.769 10.621 1.00 4.02 N ATOM 2284 CA GLU A 141 -6.527 -5.799 11.207 1.00 72.53 C ATOM 2285 C GLU A 141 -7.102 -4.806 10.154 1.00 74.53 C ATOM 2286 O GLU A 141 -6.325 -4.196 9.412 1.00 72.32 O ATOM 2287 CB GLU A 141 -5.817 -4.996 12.328 1.00 23.13 C ATOM 2288 CG GLU A 141 -5.231 -5.856 13.462 1.00 11.24 C ATOM 2289 CD GLU A 141 -4.485 -5.021 14.517 1.00 75.44 C ATOM 2290 OE1 GLU A 141 -5.138 -4.503 15.447 1.00 13.01 O ATOM 2291 OE2 GLU A 141 -3.251 -4.858 14.402 1.00 73.32 O ATOM 0 H GLU A 141 -4.597 -6.550 10.837 1.00 4.02 H new ATOM 0 HA GLU A 141 -7.365 -6.372 11.605 1.00 72.53 H new ATOM 0 HB2 GLU A 141 -5.013 -4.409 11.883 1.00 23.13 H new ATOM 0 HB3 GLU A 141 -6.528 -4.289 12.756 1.00 23.13 H new ATOM 0 HG2 GLU A 141 -6.036 -6.409 13.946 1.00 11.24 H new ATOM 0 HG3 GLU A 141 -4.548 -6.592 13.038 1.00 11.24 H new ATOM 2298 N PRO A 142 -8.471 -4.608 10.060 1.00 62.15 N ATOM 2299 CA PRO A 142 -9.502 -5.423 10.781 1.00 31.23 C ATOM 2300 C PRO A 142 -9.833 -6.793 10.090 1.00 21.23 C ATOM 2301 O PRO A 142 -10.201 -6.838 8.907 1.00 65.34 O ATOM 2302 CB PRO A 142 -10.724 -4.473 10.792 1.00 64.22 C ATOM 2303 CG PRO A 142 -10.583 -3.625 9.557 1.00 52.12 C ATOM 2304 CD PRO A 142 -9.094 -3.484 9.298 1.00 43.13 C ATOM 0 HA PRO A 142 -9.164 -5.731 11.770 1.00 31.23 H new ATOM 0 HB2 PRO A 142 -11.658 -5.035 10.778 1.00 64.22 H new ATOM 0 HB3 PRO A 142 -10.735 -3.858 11.692 1.00 64.22 H new ATOM 0 HG2 PRO A 142 -11.082 -4.091 8.707 1.00 52.12 H new ATOM 0 HG3 PRO A 142 -11.046 -2.649 9.702 1.00 52.12 H new ATOM 0 HD2 PRO A 142 -8.868 -3.553 8.234 1.00 43.13 H new ATOM 0 HD3 PRO A 142 -8.722 -2.518 9.640 1.00 43.13 H new ATOM 2312 N ARG A 143 -9.712 -7.903 10.859 1.00 35.40 N ATOM 2313 CA ARG A 143 -9.874 -9.289 10.334 1.00 32.11 C ATOM 2314 C ARG A 143 -11.343 -9.630 10.004 1.00 5.31 C ATOM 2315 O ARG A 143 -11.612 -10.212 8.959 1.00 35.01 O ATOM 2316 CB ARG A 143 -9.323 -10.332 11.342 1.00 21.42 C ATOM 2317 CG ARG A 143 -9.436 -11.810 10.868 1.00 1.22 C ATOM 2318 CD ARG A 143 -9.188 -12.824 11.991 1.00 72.44 C ATOM 2319 NE ARG A 143 -10.125 -12.635 13.119 1.00 34.41 N ATOM 2320 CZ ARG A 143 -10.897 -13.556 13.651 1.00 60.21 C ATOM 2321 NH1 ARG A 143 -10.935 -14.767 13.180 1.00 65.31 N ATOM 2322 NH2 ARG A 143 -11.647 -13.253 14.655 1.00 34.21 N ATOM 0 H ARG A 143 -9.500 -7.867 11.856 1.00 35.40 H new ATOM 0 HA ARG A 143 -9.301 -9.332 9.408 1.00 32.11 H new ATOM 0 HB2 ARG A 143 -8.275 -10.107 11.542 1.00 21.42 H new ATOM 0 HB3 ARG A 143 -9.858 -10.224 12.286 1.00 21.42 H new ATOM 0 HG2 ARG A 143 -10.429 -11.976 10.450 1.00 1.22 H new ATOM 0 HG3 ARG A 143 -8.719 -11.983 10.065 1.00 1.22 H new ATOM 0 HD2 ARG A 143 -9.293 -13.835 11.597 1.00 72.44 H new ATOM 0 HD3 ARG A 143 -8.163 -12.726 12.349 1.00 72.44 H new ATOM 0 HE ARG A 143 -10.177 -11.700 13.523 1.00 34.41 H new ATOM 0 HH11 ARG A 143 -10.357 -15.021 12.379 1.00 65.31 H new ATOM 0 HH12 ARG A 143 -11.543 -15.463 13.611 1.00 65.31 H new ATOM 0 HH21 ARG A 143 -11.638 -12.305 15.030 1.00 34.21 H new ATOM 0 HH22 ARG A 143 -12.249 -13.962 15.074 1.00 34.21 H new ATOM 2336 N GLU A 144 -12.283 -9.279 10.908 1.00 32.43 N ATOM 2337 CA GLU A 144 -13.736 -9.548 10.710 1.00 40.11 C ATOM 2338 C GLU A 144 -14.231 -8.866 9.406 1.00 75.33 C ATOM 2339 O GLU A 144 -15.027 -9.437 8.658 1.00 41.14 O ATOM 2340 CB GLU A 144 -14.537 -9.071 11.964 1.00 35.01 C ATOM 2341 CG GLU A 144 -15.988 -9.616 12.118 1.00 3.23 C ATOM 2342 CD GLU A 144 -17.032 -8.980 11.172 1.00 2.04 C ATOM 2343 OE1 GLU A 144 -17.378 -7.798 11.374 1.00 32.34 O ATOM 2344 OE2 GLU A 144 -17.501 -9.654 10.225 1.00 52.44 O ATOM 0 H GLU A 144 -12.067 -8.807 11.786 1.00 32.43 H new ATOM 0 HA GLU A 144 -13.902 -10.620 10.599 1.00 40.11 H new ATOM 0 HB2 GLU A 144 -13.973 -9.350 12.854 1.00 35.01 H new ATOM 0 HB3 GLU A 144 -14.583 -7.982 11.944 1.00 35.01 H new ATOM 0 HG2 GLU A 144 -15.975 -10.693 11.948 1.00 3.23 H new ATOM 0 HG3 GLU A 144 -16.311 -9.460 13.147 1.00 3.23 H new ATOM 2351 N PHE A 145 -13.689 -7.660 9.131 1.00 34.04 N ATOM 2352 CA PHE A 145 -13.912 -6.943 7.861 1.00 3.01 C ATOM 2353 C PHE A 145 -13.394 -7.765 6.652 1.00 52.53 C ATOM 2354 O PHE A 145 -14.050 -7.831 5.622 1.00 3.13 O ATOM 2355 CB PHE A 145 -13.234 -5.554 7.907 1.00 2.14 C ATOM 2356 CG PHE A 145 -13.431 -4.709 6.646 1.00 51.24 C ATOM 2357 CD1 PHE A 145 -14.680 -4.155 6.353 1.00 1.10 C ATOM 2358 CD2 PHE A 145 -12.379 -4.476 5.751 1.00 72.24 C ATOM 2359 CE1 PHE A 145 -14.869 -3.393 5.214 1.00 32.04 C ATOM 2360 CE2 PHE A 145 -12.575 -3.713 4.615 1.00 53.03 C ATOM 2361 CZ PHE A 145 -13.819 -3.175 4.345 1.00 25.41 C ATOM 0 H PHE A 145 -13.086 -7.159 9.783 1.00 34.04 H new ATOM 0 HA PHE A 145 -14.986 -6.806 7.732 1.00 3.01 H new ATOM 0 HB2 PHE A 145 -13.623 -5.002 8.763 1.00 2.14 H new ATOM 0 HB3 PHE A 145 -12.166 -5.691 8.074 1.00 2.14 H new ATOM 0 HD1 PHE A 145 -15.509 -4.324 7.025 1.00 1.10 H new ATOM 0 HD2 PHE A 145 -11.405 -4.897 5.950 1.00 72.24 H new ATOM 0 HE1 PHE A 145 -15.840 -2.968 5.004 1.00 32.04 H new ATOM 0 HE2 PHE A 145 -11.753 -3.537 3.936 1.00 53.03 H new ATOM 0 HZ PHE A 145 -13.970 -2.584 3.454 1.00 25.41 H new ATOM 2371 N LEU A 146 -12.231 -8.417 6.814 1.00 11.22 N ATOM 2372 CA LEU A 146 -11.641 -9.306 5.776 1.00 51.52 C ATOM 2373 C LEU A 146 -12.515 -10.560 5.529 1.00 72.20 C ATOM 2374 O LEU A 146 -12.584 -11.059 4.408 1.00 44.23 O ATOM 2375 CB LEU A 146 -10.183 -9.722 6.172 1.00 64.53 C ATOM 2376 CG LEU A 146 -9.048 -9.097 5.314 1.00 45.01 C ATOM 2377 CD1 LEU A 146 -7.684 -9.282 5.984 1.00 22.21 C ATOM 2378 CD2 LEU A 146 -9.051 -9.674 3.884 1.00 63.20 C ATOM 0 H LEU A 146 -11.668 -8.349 7.662 1.00 11.22 H new ATOM 0 HA LEU A 146 -11.605 -8.742 4.844 1.00 51.52 H new ATOM 0 HB2 LEU A 146 -10.017 -9.450 7.214 1.00 64.53 H new ATOM 0 HB3 LEU A 146 -10.105 -10.807 6.110 1.00 64.53 H new ATOM 0 HG LEU A 146 -9.237 -8.026 5.240 1.00 45.01 H new ATOM 0 HD11 LEU A 146 -6.909 -8.835 5.361 1.00 22.21 H new ATOM 0 HD12 LEU A 146 -7.689 -8.797 6.960 1.00 22.21 H new ATOM 0 HD13 LEU A 146 -7.481 -10.346 6.108 1.00 22.21 H new ATOM 0 HD21 LEU A 146 -8.247 -9.219 3.306 1.00 63.20 H new ATOM 0 HD22 LEU A 146 -8.902 -10.753 3.927 1.00 63.20 H new ATOM 0 HD23 LEU A 146 -10.007 -9.459 3.407 1.00 63.20 H new ATOM 2390 N GLN A 147 -13.161 -11.063 6.597 1.00 0.25 N ATOM 2391 CA GLN A 147 -14.021 -12.264 6.541 1.00 60.25 C ATOM 2392 C GLN A 147 -15.370 -11.968 5.841 1.00 32.31 C ATOM 2393 O GLN A 147 -15.847 -12.777 5.027 1.00 11.05 O ATOM 2394 CB GLN A 147 -14.237 -12.814 7.979 1.00 1.31 C ATOM 2395 CG GLN A 147 -12.918 -13.102 8.733 1.00 33.01 C ATOM 2396 CD GLN A 147 -13.096 -13.803 10.079 1.00 71.34 C ATOM 2397 OE1 GLN A 147 -13.268 -13.168 11.113 1.00 4.42 O ATOM 2398 NE2 GLN A 147 -13.020 -15.118 10.075 1.00 3.13 N ATOM 0 H GLN A 147 -13.102 -10.648 7.527 1.00 0.25 H new ATOM 0 HA GLN A 147 -13.519 -13.025 5.943 1.00 60.25 H new ATOM 0 HB2 GLN A 147 -14.823 -12.095 8.550 1.00 1.31 H new ATOM 0 HB3 GLN A 147 -14.823 -13.731 7.925 1.00 1.31 H new ATOM 0 HG2 GLN A 147 -12.279 -13.717 8.099 1.00 33.01 H new ATOM 0 HG3 GLN A 147 -12.394 -12.160 8.895 1.00 33.01 H new ATOM 0 HE21 GLN A 147 -12.876 -15.618 9.198 1.00 3.13 H new ATOM 0 HE22 GLN A 147 -13.105 -15.636 10.949 1.00 3.13 H new ATOM 2407 N GLN A 148 -15.980 -10.801 6.161 1.00 35.00 N ATOM 2408 CA GLN A 148 -17.231 -10.357 5.507 1.00 11.51 C ATOM 2409 C GLN A 148 -16.973 -10.001 4.021 1.00 45.43 C ATOM 2410 O GLN A 148 -17.781 -10.327 3.159 1.00 31.11 O ATOM 2411 CB GLN A 148 -17.900 -9.166 6.266 1.00 15.43 C ATOM 2412 CG GLN A 148 -17.182 -7.811 6.136 1.00 13.20 C ATOM 2413 CD GLN A 148 -17.847 -6.673 6.912 1.00 11.21 C ATOM 2414 OE1 GLN A 148 -17.520 -6.410 8.059 1.00 0.24 O ATOM 2415 NE2 GLN A 148 -18.801 -6.002 6.296 1.00 21.52 N ATOM 0 H GLN A 148 -15.626 -10.154 6.865 1.00 35.00 H new ATOM 0 HA GLN A 148 -17.934 -11.190 5.545 1.00 11.51 H new ATOM 0 HB2 GLN A 148 -18.921 -9.053 5.901 1.00 15.43 H new ATOM 0 HB3 GLN A 148 -17.966 -9.423 7.323 1.00 15.43 H new ATOM 0 HG2 GLN A 148 -16.155 -7.922 6.484 1.00 13.20 H new ATOM 0 HG3 GLN A 148 -17.134 -7.538 5.082 1.00 13.20 H new ATOM 0 HE21 GLN A 148 -19.056 -6.241 5.338 1.00 21.52 H new ATOM 0 HE22 GLN A 148 -19.284 -5.244 6.778 1.00 21.52 H new ATOM 2424 N GLN A 149 -15.814 -9.366 3.725 1.00 10.44 N ATOM 2425 CA GLN A 149 -15.424 -9.039 2.334 1.00 34.44 C ATOM 2426 C GLN A 149 -15.028 -10.308 1.553 1.00 21.42 C ATOM 2427 O GLN A 149 -15.201 -10.346 0.342 1.00 21.35 O ATOM 2428 CB GLN A 149 -14.278 -7.993 2.288 1.00 54.32 C ATOM 2429 CG GLN A 149 -14.633 -6.605 2.876 1.00 35.41 C ATOM 2430 CD GLN A 149 -15.826 -5.917 2.206 1.00 30.14 C ATOM 2431 OE1 GLN A 149 -17.023 -6.162 2.705 1.00 30.44 O flip ATOM 2432 NE2 GLN A 149 -15.671 -5.170 1.250 1.00 32.24 N flip ATOM 0 H GLN A 149 -15.136 -9.071 4.428 1.00 10.44 H new ATOM 0 HA GLN A 149 -16.297 -8.598 1.853 1.00 34.44 H new ATOM 0 HB2 GLN A 149 -13.421 -8.392 2.830 1.00 54.32 H new ATOM 0 HB3 GLN A 149 -13.967 -7.863 1.251 1.00 54.32 H new ATOM 0 HG2 GLN A 149 -14.845 -6.718 3.939 1.00 35.41 H new ATOM 0 HG3 GLN A 149 -13.762 -5.956 2.793 1.00 35.41 H new ATOM 0 HE21 GLN A 149 -14.735 -4.998 0.884 1.00 32.24 H new ATOM 0 HE22 GLN A 149 -16.478 -4.719 0.819 1.00 32.24 H new ATOM 2441 N TYR A 150 -14.493 -11.336 2.258 1.00 63.55 N ATOM 2442 CA TYR A 150 -14.193 -12.653 1.647 1.00 10.54 C ATOM 2443 C TYR A 150 -15.487 -13.317 1.150 1.00 20.14 C ATOM 2444 O TYR A 150 -15.602 -13.606 -0.032 1.00 3.52 O ATOM 2445 CB TYR A 150 -13.465 -13.603 2.638 1.00 15.13 C ATOM 2446 CG TYR A 150 -12.993 -14.952 2.021 1.00 53.13 C ATOM 2447 CD1 TYR A 150 -11.751 -15.061 1.403 1.00 21.32 C ATOM 2448 CD2 TYR A 150 -13.791 -16.102 2.051 1.00 43.45 C ATOM 2449 CE1 TYR A 150 -11.318 -16.246 0.841 1.00 45.01 C ATOM 2450 CE2 TYR A 150 -13.362 -17.291 1.487 1.00 20.34 C ATOM 2451 CZ TYR A 150 -12.126 -17.355 0.883 1.00 42.01 C ATOM 2452 OH TYR A 150 -11.700 -18.536 0.312 1.00 70.12 O ATOM 0 H TYR A 150 -14.261 -11.277 3.250 1.00 63.55 H new ATOM 0 HA TYR A 150 -13.525 -12.473 0.804 1.00 10.54 H new ATOM 0 HB2 TYR A 150 -12.598 -13.084 3.047 1.00 15.13 H new ATOM 0 HB3 TYR A 150 -14.133 -13.815 3.473 1.00 15.13 H new ATOM 0 HD1 TYR A 150 -11.108 -14.195 1.362 1.00 21.32 H new ATOM 0 HD2 TYR A 150 -14.761 -16.061 2.524 1.00 43.45 H new ATOM 0 HE1 TYR A 150 -10.347 -16.300 0.370 1.00 45.01 H new ATOM 0 HE2 TYR A 150 -13.995 -18.166 1.520 1.00 20.34 H new ATOM 0 HH TYR A 150 -11.435 -18.373 -0.617 1.00 70.12 H new ATOM 2462 N ARG A 151 -16.461 -13.524 2.062 1.00 52.41 N ATOM 2463 CA ARG A 151 -17.715 -14.244 1.732 1.00 53.23 C ATOM 2464 C ARG A 151 -18.563 -13.487 0.670 1.00 14.15 C ATOM 2465 O ARG A 151 -19.162 -14.111 -0.216 1.00 74.12 O ATOM 2466 CB ARG A 151 -18.557 -14.535 3.006 1.00 54.44 C ATOM 2467 CG ARG A 151 -19.044 -13.294 3.790 1.00 10.32 C ATOM 2468 CD ARG A 151 -20.143 -13.632 4.814 1.00 1.34 C ATOM 2469 NE ARG A 151 -21.344 -14.156 4.137 1.00 24.11 N ATOM 2470 CZ ARG A 151 -22.520 -14.370 4.688 1.00 64.11 C ATOM 2471 NH1 ARG A 151 -22.726 -14.171 5.953 1.00 10.23 N ATOM 2472 NH2 ARG A 151 -23.501 -14.766 3.948 1.00 30.40 N ATOM 0 H ARG A 151 -16.406 -13.205 3.029 1.00 52.41 H new ATOM 0 HA ARG A 151 -17.422 -15.198 1.295 1.00 53.23 H new ATOM 0 HB2 ARG A 151 -19.428 -15.123 2.716 1.00 54.44 H new ATOM 0 HB3 ARG A 151 -17.963 -15.155 3.677 1.00 54.44 H new ATOM 0 HG2 ARG A 151 -18.198 -12.841 4.307 1.00 10.32 H new ATOM 0 HG3 ARG A 151 -19.423 -12.551 3.088 1.00 10.32 H new ATOM 0 HD2 ARG A 151 -19.770 -14.369 5.525 1.00 1.34 H new ATOM 0 HD3 ARG A 151 -20.401 -12.740 5.385 1.00 1.34 H new ATOM 0 HE ARG A 151 -21.254 -14.374 3.145 1.00 24.11 H new ATOM 0 HH11 ARG A 151 -21.966 -13.840 6.548 1.00 10.23 H new ATOM 0 HH12 ARG A 151 -23.648 -14.345 6.353 1.00 10.23 H new ATOM 0 HH21 ARG A 151 -23.360 -14.910 2.948 1.00 30.40 H new ATOM 0 HH22 ARG A 151 -24.417 -14.935 4.363 1.00 30.40 H new ATOM 2486 N LEU A 152 -18.574 -12.138 0.745 1.00 4.13 N ATOM 2487 CA LEU A 152 -19.279 -11.284 -0.238 1.00 62.53 C ATOM 2488 C LEU A 152 -18.584 -11.343 -1.612 1.00 43.22 C ATOM 2489 O LEU A 152 -19.247 -11.343 -2.642 1.00 13.34 O ATOM 2490 CB LEU A 152 -19.365 -9.821 0.271 1.00 44.43 C ATOM 2491 CG LEU A 152 -20.308 -9.582 1.494 1.00 73.24 C ATOM 2492 CD1 LEU A 152 -20.222 -8.124 1.995 1.00 32.02 C ATOM 2493 CD2 LEU A 152 -21.769 -9.990 1.171 1.00 64.44 C ATOM 0 H LEU A 152 -18.100 -11.614 1.481 1.00 4.13 H new ATOM 0 HA LEU A 152 -20.293 -11.666 -0.355 1.00 62.53 H new ATOM 0 HB2 LEU A 152 -18.362 -9.490 0.539 1.00 44.43 H new ATOM 0 HB3 LEU A 152 -19.700 -9.189 -0.551 1.00 44.43 H new ATOM 0 HG LEU A 152 -19.964 -10.224 2.305 1.00 73.24 H new ATOM 0 HD11 LEU A 152 -20.890 -7.992 2.846 1.00 32.02 H new ATOM 0 HD12 LEU A 152 -19.199 -7.904 2.299 1.00 32.02 H new ATOM 0 HD13 LEU A 152 -20.516 -7.446 1.194 1.00 32.02 H new ATOM 0 HD21 LEU A 152 -22.398 -9.811 2.043 1.00 64.44 H new ATOM 0 HD22 LEU A 152 -22.135 -9.398 0.332 1.00 64.44 H new ATOM 0 HD23 LEU A 152 -21.802 -11.048 0.911 1.00 64.44 H new ATOM 2505 N PHE A 153 -17.241 -11.389 -1.598 1.00 53.13 N ATOM 2506 CA PHE A 153 -16.425 -11.646 -2.801 1.00 72.15 C ATOM 2507 C PHE A 153 -16.771 -13.012 -3.449 1.00 55.24 C ATOM 2508 O PHE A 153 -16.880 -13.117 -4.677 1.00 0.13 O ATOM 2509 CB PHE A 153 -14.928 -11.599 -2.419 1.00 24.12 C ATOM 2510 CG PHE A 153 -13.978 -11.792 -3.578 1.00 52.42 C ATOM 2511 CD1 PHE A 153 -13.617 -10.719 -4.375 1.00 53.44 C ATOM 2512 CD2 PHE A 153 -13.459 -13.046 -3.884 1.00 10.20 C ATOM 2513 CE1 PHE A 153 -12.769 -10.889 -5.435 1.00 23.15 C ATOM 2514 CE2 PHE A 153 -12.614 -13.207 -4.941 1.00 72.31 C ATOM 2515 CZ PHE A 153 -12.274 -12.132 -5.721 1.00 51.35 C ATOM 0 H PHE A 153 -16.688 -11.249 -0.752 1.00 53.13 H new ATOM 0 HA PHE A 153 -16.645 -10.873 -3.537 1.00 72.15 H new ATOM 0 HB2 PHE A 153 -14.716 -10.639 -1.948 1.00 24.12 H new ATOM 0 HB3 PHE A 153 -14.732 -12.369 -1.673 1.00 24.12 H new ATOM 0 HD1 PHE A 153 -14.009 -9.737 -4.157 1.00 53.44 H new ATOM 0 HD2 PHE A 153 -13.728 -13.899 -3.279 1.00 10.20 H new ATOM 0 HE1 PHE A 153 -12.491 -10.043 -6.046 1.00 23.15 H new ATOM 0 HE2 PHE A 153 -12.211 -14.184 -5.165 1.00 72.31 H new ATOM 0 HZ PHE A 153 -11.613 -12.267 -6.564 1.00 51.35 H new ATOM 2525 N GLN A 154 -16.949 -14.049 -2.602 1.00 32.43 N ATOM 2526 CA GLN A 154 -17.225 -15.420 -3.081 1.00 61.33 C ATOM 2527 C GLN A 154 -18.611 -15.509 -3.726 1.00 14.01 C ATOM 2528 O GLN A 154 -18.753 -16.118 -4.781 1.00 51.32 O ATOM 2529 CB GLN A 154 -17.091 -16.487 -1.961 1.00 10.33 C ATOM 2530 CG GLN A 154 -15.759 -16.449 -1.188 1.00 14.05 C ATOM 2531 CD GLN A 154 -14.501 -16.339 -2.064 1.00 14.41 C ATOM 2532 OE1 GLN A 154 -14.410 -16.893 -3.161 1.00 13.52 O ATOM 2533 NE2 GLN A 154 -13.543 -15.566 -1.603 1.00 52.32 N ATOM 0 H GLN A 154 -16.907 -13.963 -1.587 1.00 32.43 H new ATOM 0 HA GLN A 154 -16.465 -15.639 -3.831 1.00 61.33 H new ATOM 0 HB2 GLN A 154 -17.909 -16.355 -1.253 1.00 10.33 H new ATOM 0 HB3 GLN A 154 -17.209 -17.476 -2.405 1.00 10.33 H new ATOM 0 HG2 GLN A 154 -15.779 -15.603 -0.501 1.00 14.05 H new ATOM 0 HG3 GLN A 154 -15.683 -17.351 -0.581 1.00 14.05 H new ATOM 0 HE21 GLN A 154 -13.643 -15.119 -0.692 1.00 52.32 H new ATOM 0 HE22 GLN A 154 -12.700 -15.413 -2.157 1.00 52.32 H new ATOM 2542 N THR A 155 -19.617 -14.838 -3.131 1.00 34.03 N ATOM 2543 CA THR A 155 -21.003 -14.897 -3.661 1.00 52.32 C ATOM 2544 C THR A 155 -21.117 -14.167 -5.026 1.00 54.20 C ATOM 2545 O THR A 155 -22.055 -14.407 -5.777 1.00 1.55 O ATOM 2546 CB THR A 155 -22.082 -14.346 -2.658 1.00 42.31 C ATOM 2547 OG1 THR A 155 -23.398 -14.726 -3.105 1.00 73.41 O ATOM 2548 CG2 THR A 155 -22.040 -12.817 -2.494 1.00 23.10 C ATOM 0 H THR A 155 -19.505 -14.258 -2.299 1.00 34.03 H new ATOM 0 HA THR A 155 -21.217 -15.956 -3.803 1.00 52.32 H new ATOM 0 HB THR A 155 -21.851 -14.784 -1.687 1.00 42.31 H new ATOM 0 HG1 THR A 155 -23.430 -14.705 -4.084 1.00 73.41 H new ATOM 0 HG21 THR A 155 -22.810 -12.505 -1.789 1.00 23.10 H new ATOM 0 HG22 THR A 155 -21.061 -12.518 -2.118 1.00 23.10 H new ATOM 0 HG23 THR A 155 -22.218 -12.343 -3.459 1.00 23.10 H new ATOM 2556 N ARG A 156 -20.140 -13.285 -5.344 1.00 2.13 N ATOM 2557 CA ARG A 156 -20.038 -12.651 -6.681 1.00 71.23 C ATOM 2558 C ARG A 156 -19.688 -13.708 -7.756 1.00 32.01 C ATOM 2559 O ARG A 156 -20.438 -13.910 -8.715 1.00 74.52 O ATOM 2560 CB ARG A 156 -18.960 -11.529 -6.675 1.00 31.41 C ATOM 2561 CG ARG A 156 -19.194 -10.427 -5.622 1.00 32.05 C ATOM 2562 CD ARG A 156 -18.049 -9.403 -5.549 1.00 43.32 C ATOM 2563 NE ARG A 156 -18.176 -8.501 -4.388 1.00 60.32 N ATOM 2564 CZ ARG A 156 -17.304 -7.559 -4.052 1.00 13.43 C ATOM 2565 NH1 ARG A 156 -16.241 -7.334 -4.769 1.00 32.34 N ATOM 2566 NH2 ARG A 156 -17.503 -6.839 -2.993 1.00 53.04 N ATOM 0 H ARG A 156 -19.410 -12.996 -4.692 1.00 2.13 H new ATOM 0 HA ARG A 156 -21.005 -12.208 -6.921 1.00 71.23 H new ATOM 0 HB2 ARG A 156 -17.984 -11.981 -6.500 1.00 31.41 H new ATOM 0 HB3 ARG A 156 -18.926 -11.069 -7.663 1.00 31.41 H new ATOM 0 HG2 ARG A 156 -20.124 -9.906 -5.851 1.00 32.05 H new ATOM 0 HG3 ARG A 156 -19.321 -10.890 -4.643 1.00 32.05 H new ATOM 0 HD2 ARG A 156 -17.096 -9.930 -5.494 1.00 43.32 H new ATOM 0 HD3 ARG A 156 -18.034 -8.812 -6.465 1.00 43.32 H new ATOM 0 HE ARG A 156 -19.000 -8.610 -3.797 1.00 60.32 H new ATOM 0 HH11 ARG A 156 -16.065 -7.887 -5.608 1.00 32.34 H new ATOM 0 HH12 ARG A 156 -15.584 -6.605 -4.492 1.00 32.34 H new ATOM 0 HH21 ARG A 156 -18.330 -6.996 -2.417 1.00 53.04 H new ATOM 0 HH22 ARG A 156 -16.832 -6.115 -2.735 1.00 53.04 H new ATOM 2580 N LEU A 157 -18.552 -14.406 -7.549 1.00 75.21 N ATOM 2581 CA LEU A 157 -18.006 -15.376 -8.529 1.00 3.21 C ATOM 2582 C LEU A 157 -18.827 -16.695 -8.607 1.00 70.50 C ATOM 2583 O LEU A 157 -19.019 -17.240 -9.697 1.00 15.10 O ATOM 2584 CB LEU A 157 -16.480 -15.628 -8.249 1.00 12.44 C ATOM 2585 CG LEU A 157 -16.043 -15.973 -6.771 1.00 72.53 C ATOM 2586 CD1 LEU A 157 -16.259 -17.457 -6.403 1.00 30.43 C ATOM 2587 CD2 LEU A 157 -14.587 -15.557 -6.505 1.00 75.11 C ATOM 0 H LEU A 157 -17.988 -14.316 -6.704 1.00 75.21 H new ATOM 0 HA LEU A 157 -18.100 -14.931 -9.520 1.00 3.21 H new ATOM 0 HB2 LEU A 157 -16.153 -16.445 -8.893 1.00 12.44 H new ATOM 0 HB3 LEU A 157 -15.932 -14.738 -8.560 1.00 12.44 H new ATOM 0 HG LEU A 157 -16.698 -15.390 -6.123 1.00 72.53 H new ATOM 0 HD11 LEU A 157 -15.939 -17.627 -5.375 1.00 30.43 H new ATOM 0 HD12 LEU A 157 -17.316 -17.706 -6.500 1.00 30.43 H new ATOM 0 HD13 LEU A 157 -15.675 -18.087 -7.074 1.00 30.43 H new ATOM 0 HD21 LEU A 157 -14.318 -15.809 -5.479 1.00 75.11 H new ATOM 0 HD22 LEU A 157 -13.926 -16.085 -7.193 1.00 75.11 H new ATOM 0 HD23 LEU A 157 -14.483 -14.482 -6.654 1.00 75.11 H new ATOM 2599 N THR A 158 -19.326 -17.194 -7.457 1.00 25.51 N ATOM 2600 CA THR A 158 -20.053 -18.493 -7.402 1.00 11.32 C ATOM 2601 C THR A 158 -21.580 -18.306 -7.527 1.00 73.02 C ATOM 2602 O THR A 158 -22.253 -19.128 -8.156 1.00 25.53 O ATOM 2603 CB THR A 158 -19.735 -19.305 -6.084 1.00 32.44 C ATOM 2604 OG1 THR A 158 -20.135 -20.675 -6.252 1.00 42.33 O ATOM 2605 CG2 THR A 158 -20.428 -18.739 -4.819 1.00 72.01 C ATOM 0 H THR A 158 -19.243 -16.725 -6.555 1.00 25.51 H new ATOM 0 HA THR A 158 -19.695 -19.066 -8.257 1.00 11.32 H new ATOM 0 HB THR A 158 -18.660 -19.219 -5.928 1.00 32.44 H new ATOM 0 HG1 THR A 158 -19.935 -21.177 -5.434 1.00 42.33 H new ATOM 0 HG21 THR A 158 -20.162 -19.348 -3.955 1.00 72.01 H new ATOM 0 HG22 THR A 158 -20.101 -17.713 -4.653 1.00 72.01 H new ATOM 0 HG23 THR A 158 -21.509 -18.757 -4.957 1.00 72.01 H new ATOM 2613 N GLU A 159 -22.097 -17.192 -6.947 1.00 4.24 N ATOM 2614 CA GLU A 159 -23.545 -16.929 -6.777 1.00 75.11 C ATOM 2615 C GLU A 159 -24.264 -18.092 -6.031 1.00 22.01 C ATOM 2616 O GLU A 159 -24.785 -19.023 -6.655 1.00 32.41 O ATOM 2617 CB GLU A 159 -24.198 -16.595 -8.141 1.00 62.32 C ATOM 2618 CG GLU A 159 -23.644 -15.310 -8.799 1.00 73.54 C ATOM 2619 CD GLU A 159 -24.261 -15.013 -10.177 1.00 24.00 C ATOM 2620 OE1 GLU A 159 -23.789 -15.589 -11.183 1.00 65.51 O ATOM 2621 OE2 GLU A 159 -25.233 -14.226 -10.262 1.00 43.40 O ATOM 0 H GLU A 159 -21.510 -16.443 -6.580 1.00 4.24 H new ATOM 0 HA GLU A 159 -23.661 -16.053 -6.139 1.00 75.11 H new ATOM 0 HB2 GLU A 159 -24.048 -17.434 -8.821 1.00 62.32 H new ATOM 0 HB3 GLU A 159 -25.274 -16.486 -8.002 1.00 62.32 H new ATOM 0 HG2 GLU A 159 -23.828 -14.464 -8.137 1.00 73.54 H new ATOM 0 HG3 GLU A 159 -22.563 -15.402 -8.906 1.00 73.54 H new ATOM 2628 N THR A 160 -24.234 -18.037 -4.681 1.00 32.40 N ATOM 2629 CA THR A 160 -24.848 -19.073 -3.806 1.00 33.24 C ATOM 2630 C THR A 160 -26.386 -18.842 -3.631 1.00 23.21 C ATOM 2631 O THR A 160 -26.804 -17.965 -2.837 1.00 74.21 O ATOM 2632 CB THR A 160 -24.099 -19.188 -2.411 1.00 65.24 C ATOM 2633 OG1 THR A 160 -24.828 -20.049 -1.514 1.00 20.33 O ATOM 2634 CG2 THR A 160 -23.834 -17.824 -1.730 1.00 32.23 C ATOM 2635 OXT THR A 160 -27.178 -19.536 -4.310 1.00 37.78 O ATOM 0 H THR A 160 -23.787 -17.279 -4.165 1.00 32.40 H new ATOM 0 HA THR A 160 -24.725 -20.033 -4.307 1.00 33.24 H new ATOM 0 HB THR A 160 -23.123 -19.620 -2.633 1.00 65.24 H new ATOM 0 HG1 THR A 160 -24.352 -20.110 -0.660 1.00 20.33 H new ATOM 0 HG21 THR A 160 -23.319 -17.984 -0.783 1.00 32.23 H new ATOM 0 HG22 THR A 160 -23.213 -17.207 -2.380 1.00 32.23 H new ATOM 0 HG23 THR A 160 -24.782 -17.318 -1.547 1.00 32.23 H new TER 2643 THR A 160