USER MOD reduce.3.24.130724 H: found=0, std=0, add=1200, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1200 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 86 LYS NZ :NH3+ 179:sc= 2.16 (180deg=2.13) USER MOD Set 1.2: A 139 ASN : amide:sc= -2.64! C(o=-0.48!,f=-0.042!) USER MOD Set 2.1: A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 115 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 6 HIS : no HD1:sc= -0.258 K(o=-0.52,f=0.32) USER MOD Set 3.2: A 103 SER OG : rot -60:sc= -0.259 USER MOD Single : A 1 MET CE :methyl -178:sc= -0.877 (180deg=-0.927) USER MOD Single : A 1 MET N :NH3+ -106:sc= 0.0537 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0.219 K(o=0.22,f=-2.5!) USER MOD Single : A 4 HIS : no HD1:sc= -0.353 X(o=-0.35,f=-0.06) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=-0.076) USER MOD Single : A 7 HIS : no HE2:sc= -0.907 X(o=-0.91,f=-1.4) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= -0.0329 USER MOD Single : A 10 HIS : no HD1:sc= -0.202 X(o=-0.2,f=-0.54) USER MOD Single : A 11 MET CE :methyl 139:sc= -0.233 (180deg=-1) USER MOD Single : A 14 HIS : no HE2:sc= 0.0615 K(o=0.062,f=-3.3!) USER MOD Single : A 18 THR OG1 : rot 168:sc= 0.515 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -1.61! C(o=-1.6!,f=-3.2!) USER MOD Single : A 24 LYS NZ :NH3+ 162:sc= 0.986 (180deg=0.429) USER MOD Single : A 25 GLN : amide:sc= 0.91 K(o=0.91,f=-0.0042) USER MOD Single : A 27 TYR OH : rot -29:sc= 0.07 USER MOD Single : A 34 LYS NZ :NH3+ -174:sc= 0.993 (180deg=0.93) USER MOD Single : A 36 LYS NZ :NH3+ -170:sc= -0.0161 (180deg=-0.111) USER MOD Single : A 44 SER OG : rot 87:sc= 0.852 USER MOD Single : A 46 MET CE :methyl -175:sc= -3.14 (180deg=-3.29) USER MOD Single : A 47 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 48 LYS NZ :NH3+ -169:sc= -0.0107 (180deg=-0.143) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 59 MET CE :methyl 168:sc= 0 (180deg=-0.15) USER MOD Single : A 61 LYS NZ :NH3+ -171:sc=-0.00417 (180deg=-0.0837) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 MET CE :methyl -142:sc= -0.0395 (180deg=-1.05) USER MOD Single : A 70 TYR OH : rot 87:sc= 0.0155 USER MOD Single : A 74 THR OG1 : rot -75:sc= 0.843 USER MOD Single : A 76 LYS NZ :NH3+ -168:sc= 1.09 (180deg=0.932) USER MOD Single : A 84 ASN : amide:sc= -0.711 K(o=-0.71,f=-1.7) USER MOD Single : A 85 LYS NZ :NH3+ 169:sc= -0.0291 (180deg=-0.179) USER MOD Single : A 92 THR OG1 : rot 180:sc=-0.000578 USER MOD Single : A 93 LYS NZ :NH3+ 158:sc= -0.111 (180deg=-0.56) USER MOD Single : A 96 ASN : amide:sc= -1.37! K(o=-1.4!,f=-0.26) USER MOD Single : A 99 THR OG1 : rot -29:sc= 0.0625 USER MOD Single : A 100 SER OG : rot -35:sc= 0.943 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 70:sc= 0.0145 USER MOD Single : A 110 THR OG1 : rot 70:sc= -0.551 USER MOD Single : A 111 GLN : amide:sc= -1.01 K(o=-1,f=-0.037) USER MOD Single : A 112 TYR OH : rot 112:sc= 0.12 USER MOD Single : A 113 MET CE :methyl 134:sc= -4.2! (180deg=-4.66) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 CYS SG : rot 154:sc= -1.5 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 86:sc= 0.725 USER MOD Single : A 128 ASN : amide:sc= 0.825 K(o=0.83,f=-0.0047) USER MOD Single : A 130 ASN : amide:sc= -0.177 X(o=-0.18,f=-0.032) USER MOD Single : A 133 GLN : amide:sc= 0.289 X(o=0.29,f=-0.16) USER MOD Single : A 138 SER OG : rot 74:sc= 0.178 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 21.229 0.230 0.493 1.00 50.32 N ATOM 2 CA MET A 1 19.821 0.670 0.296 1.00 32.13 C ATOM 3 C MET A 1 19.384 0.466 -1.164 1.00 72.22 C ATOM 4 O MET A 1 20.221 0.367 -2.060 1.00 64.45 O ATOM 5 CB MET A 1 19.676 2.149 0.689 1.00 12.41 C ATOM 6 CG MET A 1 18.236 2.648 0.733 1.00 11.41 C ATOM 7 SD MET A 1 18.120 4.417 1.064 1.00 72.12 S ATOM 8 CE MET A 1 18.938 4.523 2.659 1.00 23.41 C ATOM 0 H1 MET A 1 21.242 -0.672 1.011 1.00 50.32 H new ATOM 0 H2 MET A 1 21.686 0.104 -0.433 1.00 50.32 H new ATOM 0 H3 MET A 1 21.745 0.950 1.038 1.00 50.32 H new ATOM 0 HA MET A 1 19.177 0.064 0.933 1.00 32.13 H new ATOM 0 HB2 MET A 1 20.130 2.299 1.668 1.00 12.41 H new ATOM 0 HB3 MET A 1 20.238 2.758 -0.019 1.00 12.41 H new ATOM 0 HG2 MET A 1 17.751 2.428 -0.218 1.00 11.41 H new ATOM 0 HG3 MET A 1 17.690 2.102 1.503 1.00 11.41 H new ATOM 0 HE1 MET A 1 18.914 5.554 3.013 1.00 23.41 H new ATOM 0 HE2 MET A 1 18.424 3.881 3.375 1.00 23.41 H new ATOM 0 HE3 MET A 1 19.974 4.198 2.559 1.00 23.41 H new ATOM 20 N GLY A 2 18.073 0.402 -1.395 1.00 42.02 N ATOM 21 CA GLY A 2 17.546 0.209 -2.745 1.00 32.21 C ATOM 22 C GLY A 2 17.838 1.366 -3.708 1.00 30.21 C ATOM 23 O GLY A 2 16.967 2.186 -3.991 1.00 62.25 O ATOM 0 H GLY A 2 17.360 0.480 -0.669 1.00 42.02 H new ATOM 0 HA2 GLY A 2 17.966 -0.708 -3.159 1.00 32.21 H new ATOM 0 HA3 GLY A 2 16.467 0.066 -2.684 1.00 32.21 H new ATOM 27 N HIS A 3 19.073 1.431 -4.205 1.00 40.42 N ATOM 28 CA HIS A 3 19.460 2.410 -5.231 1.00 35.03 C ATOM 29 C HIS A 3 20.315 1.737 -6.315 1.00 21.34 C ATOM 30 O HIS A 3 21.537 1.631 -6.186 1.00 20.44 O ATOM 31 CB HIS A 3 20.219 3.593 -4.604 1.00 22.11 C ATOM 32 CG HIS A 3 19.384 4.411 -3.663 1.00 32.14 C ATOM 33 ND1 HIS A 3 18.463 5.342 -4.092 1.00 53.05 N ATOM 34 CD2 HIS A 3 19.322 4.424 -2.311 1.00 50.24 C ATOM 35 CE1 HIS A 3 17.873 5.888 -3.052 1.00 74.55 C ATOM 36 NE2 HIS A 3 18.373 5.353 -1.955 1.00 63.14 N ATOM 0 H HIS A 3 19.831 0.814 -3.913 1.00 40.42 H new ATOM 0 HA HIS A 3 18.552 2.797 -5.692 1.00 35.03 H new ATOM 0 HB2 HIS A 3 21.089 3.213 -4.068 1.00 22.11 H new ATOM 0 HB3 HIS A 3 20.592 4.238 -5.400 1.00 22.11 H new ATOM 0 HD2 HIS A 3 19.909 3.817 -1.637 1.00 50.24 H new ATOM 0 HE1 HIS A 3 17.107 6.648 -3.090 1.00 74.55 H new ATOM 0 HE2 HIS A 3 18.101 5.589 -1.001 1.00 63.14 H new ATOM 45 N HIS A 4 19.652 1.270 -7.372 1.00 72.53 N ATOM 46 CA HIS A 4 20.301 0.485 -8.428 1.00 2.44 C ATOM 47 C HIS A 4 19.419 0.462 -9.692 1.00 2.43 C ATOM 48 O HIS A 4 18.217 0.731 -9.623 1.00 30.02 O ATOM 49 CB HIS A 4 20.541 -0.946 -7.908 1.00 11.01 C ATOM 50 CG HIS A 4 21.348 -1.835 -8.814 1.00 51.42 C ATOM 51 ND1 HIS A 4 22.709 -1.998 -8.686 1.00 11.54 N ATOM 52 CD2 HIS A 4 20.975 -2.648 -9.835 1.00 53.33 C ATOM 53 CE1 HIS A 4 23.136 -2.867 -9.578 1.00 44.22 C ATOM 54 NE2 HIS A 4 22.107 -3.277 -10.288 1.00 40.43 N ATOM 0 H HIS A 4 18.655 1.423 -7.523 1.00 72.53 H new ATOM 0 HA HIS A 4 21.256 0.939 -8.692 1.00 2.44 H new ATOM 0 HB2 HIS A 4 21.046 -0.884 -6.944 1.00 11.01 H new ATOM 0 HB3 HIS A 4 19.574 -1.417 -7.732 1.00 11.01 H new ATOM 0 HD2 HIS A 4 19.974 -2.776 -10.219 1.00 53.33 H new ATOM 0 HE1 HIS A 4 24.159 -3.189 -9.706 1.00 44.22 H new ATOM 0 HE2 HIS A 4 22.145 -3.953 -11.051 1.00 40.43 H new ATOM 63 N HIS A 5 20.020 0.159 -10.845 1.00 24.44 N ATOM 64 CA HIS A 5 19.271 0.030 -12.105 1.00 11.14 C ATOM 65 C HIS A 5 18.083 -0.945 -11.962 1.00 71.02 C ATOM 66 O HIS A 5 18.264 -2.100 -11.569 1.00 64.12 O ATOM 67 CB HIS A 5 20.212 -0.447 -13.222 1.00 14.53 C ATOM 68 CG HIS A 5 19.525 -0.707 -14.531 1.00 62.13 C ATOM 69 ND1 HIS A 5 19.111 -1.961 -14.919 1.00 63.14 N ATOM 70 CD2 HIS A 5 19.181 0.128 -15.545 1.00 32.11 C ATOM 71 CE1 HIS A 5 18.551 -1.893 -16.107 1.00 35.43 C ATOM 72 NE2 HIS A 5 18.578 -0.641 -16.506 1.00 22.55 N ATOM 0 H HIS A 5 21.023 -0.002 -10.936 1.00 24.44 H new ATOM 0 HA HIS A 5 18.868 1.010 -12.360 1.00 11.14 H new ATOM 0 HB2 HIS A 5 20.988 0.303 -13.374 1.00 14.53 H new ATOM 0 HB3 HIS A 5 20.710 -1.360 -12.897 1.00 14.53 H new ATOM 0 HD2 HIS A 5 19.350 1.194 -15.586 1.00 32.11 H new ATOM 0 HE1 HIS A 5 18.139 -2.724 -16.660 1.00 35.43 H new ATOM 0 HE2 HIS A 5 18.208 -0.296 -17.392 1.00 22.55 H new ATOM 81 N HIS A 6 16.875 -0.470 -12.282 1.00 10.13 N ATOM 82 CA HIS A 6 15.664 -1.304 -12.198 1.00 11.53 C ATOM 83 C HIS A 6 15.793 -2.576 -13.062 1.00 44.43 C ATOM 84 O HIS A 6 16.154 -2.502 -14.239 1.00 22.14 O ATOM 85 CB HIS A 6 14.422 -0.520 -12.658 1.00 24.43 C ATOM 86 CG HIS A 6 14.208 0.796 -11.965 1.00 3.42 C ATOM 87 ND1 HIS A 6 13.881 1.951 -12.644 1.00 65.21 N ATOM 88 CD2 HIS A 6 14.249 1.138 -10.653 1.00 64.24 C ATOM 89 CE1 HIS A 6 13.735 2.941 -11.789 1.00 23.23 C ATOM 90 NE2 HIS A 6 13.950 2.481 -10.574 1.00 41.44 N ATOM 0 H HIS A 6 16.706 0.484 -12.601 1.00 10.13 H new ATOM 0 HA HIS A 6 15.551 -1.591 -11.153 1.00 11.53 H new ATOM 0 HB2 HIS A 6 14.501 -0.340 -13.730 1.00 24.43 H new ATOM 0 HB3 HIS A 6 13.541 -1.142 -12.503 1.00 24.43 H new ATOM 0 HD2 HIS A 6 14.474 0.481 -9.826 1.00 64.24 H new ATOM 0 HE1 HIS A 6 13.481 3.960 -12.042 1.00 23.23 H new ATOM 0 HE2 HIS A 6 13.903 3.029 -9.715 1.00 41.44 H new ATOM 99 N HIS A 7 15.495 -3.737 -12.475 1.00 32.44 N ATOM 100 CA HIS A 7 15.508 -5.007 -13.215 1.00 35.11 C ATOM 101 C HIS A 7 14.722 -6.098 -12.476 1.00 12.30 C ATOM 102 O HIS A 7 14.375 -5.947 -11.304 1.00 54.44 O ATOM 103 CB HIS A 7 16.947 -5.484 -13.470 1.00 20.25 C ATOM 104 CG HIS A 7 17.690 -5.890 -12.232 1.00 33.12 C ATOM 105 ND1 HIS A 7 17.648 -7.170 -11.719 1.00 65.20 N ATOM 106 CD2 HIS A 7 18.508 -5.189 -11.412 1.00 43.12 C ATOM 107 CE1 HIS A 7 18.403 -7.236 -10.642 1.00 35.54 C ATOM 108 NE2 HIS A 7 18.939 -6.051 -10.433 1.00 61.01 N ATOM 0 H HIS A 7 15.242 -3.827 -11.491 1.00 32.44 H new ATOM 0 HA HIS A 7 15.023 -4.823 -14.173 1.00 35.11 H new ATOM 0 HB2 HIS A 7 16.921 -6.329 -14.158 1.00 20.25 H new ATOM 0 HB3 HIS A 7 17.499 -4.686 -13.966 1.00 20.25 H new ATOM 0 HD1 HIS A 7 17.115 -7.945 -12.113 1.00 65.20 H new ATOM 0 HD2 HIS A 7 18.772 -4.146 -11.509 1.00 43.12 H new ATOM 0 HE1 HIS A 7 18.557 -8.114 -10.032 1.00 35.54 H new ATOM 117 N HIS A 8 14.457 -7.204 -13.165 1.00 40.23 N ATOM 118 CA HIS A 8 13.714 -8.330 -12.589 1.00 44.43 C ATOM 119 C HIS A 8 14.585 -9.599 -12.525 1.00 24.52 C ATOM 120 O HIS A 8 15.796 -9.546 -12.748 1.00 22.04 O ATOM 121 CB HIS A 8 12.444 -8.586 -13.411 1.00 45.32 C ATOM 122 CG HIS A 8 11.476 -7.440 -13.384 1.00 11.33 C ATOM 123 ND1 HIS A 8 11.450 -6.448 -14.340 1.00 61.03 N ATOM 124 CD2 HIS A 8 10.498 -7.125 -12.499 1.00 45.14 C ATOM 125 CE1 HIS A 8 10.507 -5.575 -14.045 1.00 44.22 C ATOM 126 NE2 HIS A 8 9.914 -5.962 -12.934 1.00 53.25 N ATOM 0 H HIS A 8 14.747 -7.349 -14.132 1.00 40.23 H new ATOM 0 HA HIS A 8 13.433 -8.073 -11.568 1.00 44.43 H new ATOM 0 HB2 HIS A 8 12.724 -8.791 -14.444 1.00 45.32 H new ATOM 0 HB3 HIS A 8 11.948 -9.480 -13.032 1.00 45.32 H new ATOM 0 HD2 HIS A 8 10.229 -7.685 -11.616 1.00 45.14 H new ATOM 0 HE1 HIS A 8 10.262 -4.692 -14.617 1.00 44.22 H new ATOM 0 HE2 HIS A 8 9.145 -5.476 -12.472 1.00 53.25 H new ATOM 135 N SER A 9 13.963 -10.733 -12.199 1.00 14.52 N ATOM 136 CA SER A 9 14.671 -12.023 -12.110 1.00 1.23 C ATOM 137 C SER A 9 13.727 -13.181 -12.468 1.00 14.03 C ATOM 138 O SER A 9 12.590 -12.950 -12.878 1.00 61.11 O ATOM 139 CB SER A 9 15.239 -12.220 -10.694 1.00 3.11 C ATOM 140 OG SER A 9 15.966 -13.436 -10.586 1.00 63.23 O ATOM 0 H SER A 9 12.966 -10.790 -11.990 1.00 14.52 H new ATOM 0 HA SER A 9 15.496 -12.015 -12.823 1.00 1.23 H new ATOM 0 HB2 SER A 9 15.890 -11.383 -10.443 1.00 3.11 H new ATOM 0 HB3 SER A 9 14.424 -12.218 -9.971 1.00 3.11 H new ATOM 0 HG SER A 9 16.314 -13.529 -9.675 1.00 63.23 H new ATOM 146 N HIS A 10 14.187 -14.424 -12.318 1.00 15.21 N ATOM 147 CA HIS A 10 13.347 -15.590 -12.632 1.00 40.44 C ATOM 148 C HIS A 10 13.642 -16.782 -11.702 1.00 64.02 C ATOM 149 O HIS A 10 14.608 -17.525 -11.898 1.00 62.11 O ATOM 150 CB HIS A 10 13.504 -15.993 -14.111 1.00 71.44 C ATOM 151 CG HIS A 10 14.916 -16.279 -14.535 1.00 22.12 C ATOM 152 ND1 HIS A 10 15.411 -17.558 -14.691 1.00 22.14 N ATOM 153 CD2 HIS A 10 15.938 -15.446 -14.850 1.00 71.23 C ATOM 154 CE1 HIS A 10 16.668 -17.500 -15.078 1.00 74.44 C ATOM 155 NE2 HIS A 10 17.011 -16.234 -15.183 1.00 40.51 N ATOM 0 H HIS A 10 15.124 -14.652 -11.986 1.00 15.21 H new ATOM 0 HA HIS A 10 12.311 -15.299 -12.461 1.00 40.44 H new ATOM 0 HB2 HIS A 10 12.896 -16.878 -14.299 1.00 71.44 H new ATOM 0 HB3 HIS A 10 13.106 -15.194 -14.736 1.00 71.44 H new ATOM 0 HD2 HIS A 10 15.913 -14.366 -14.841 1.00 71.23 H new ATOM 0 HE1 HIS A 10 17.308 -18.347 -15.276 1.00 74.44 H new ATOM 0 HE2 HIS A 10 17.929 -15.892 -15.467 1.00 40.51 H new ATOM 164 N MET A 11 12.812 -16.932 -10.667 1.00 24.24 N ATOM 165 CA MET A 11 12.917 -18.045 -9.707 1.00 31.34 C ATOM 166 C MET A 11 11.524 -18.430 -9.167 1.00 13.43 C ATOM 167 O MET A 11 10.571 -17.664 -9.307 1.00 71.04 O ATOM 168 CB MET A 11 13.830 -17.665 -8.523 1.00 13.21 C ATOM 169 CG MET A 11 15.298 -17.475 -8.887 1.00 30.45 C ATOM 170 SD MET A 11 16.331 -17.144 -7.444 1.00 12.13 S ATOM 171 CE MET A 11 16.082 -18.642 -6.487 1.00 2.13 C ATOM 0 H MET A 11 12.047 -16.288 -10.467 1.00 24.24 H new ATOM 0 HA MET A 11 13.349 -18.896 -10.234 1.00 31.34 H new ATOM 0 HB2 MET A 11 13.458 -16.743 -8.076 1.00 13.21 H new ATOM 0 HB3 MET A 11 13.756 -18.441 -7.761 1.00 13.21 H new ATOM 0 HG2 MET A 11 15.662 -18.369 -9.393 1.00 30.45 H new ATOM 0 HG3 MET A 11 15.390 -16.649 -9.593 1.00 30.45 H new ATOM 0 HE1 MET A 11 17.031 -18.959 -6.053 1.00 2.13 H new ATOM 0 HE2 MET A 11 15.365 -18.449 -5.689 1.00 2.13 H new ATOM 0 HE3 MET A 11 15.699 -19.429 -7.136 1.00 2.13 H new ATOM 181 N PRO A 12 11.376 -19.624 -8.556 1.00 74.43 N ATOM 182 CA PRO A 12 10.134 -20.016 -7.858 1.00 42.24 C ATOM 183 C PRO A 12 9.979 -19.301 -6.497 1.00 71.22 C ATOM 184 O PRO A 12 9.797 -19.944 -5.460 1.00 24.21 O ATOM 185 CB PRO A 12 10.294 -21.543 -7.663 1.00 52.53 C ATOM 186 CG PRO A 12 11.501 -21.932 -8.462 1.00 34.10 C ATOM 187 CD PRO A 12 12.368 -20.708 -8.523 1.00 65.33 C ATOM 0 HA PRO A 12 9.243 -19.743 -8.423 1.00 42.24 H new ATOM 0 HB2 PRO A 12 10.426 -21.791 -6.610 1.00 52.53 H new ATOM 0 HB3 PRO A 12 9.408 -22.076 -8.008 1.00 52.53 H new ATOM 0 HG2 PRO A 12 12.029 -22.762 -7.992 1.00 34.10 H new ATOM 0 HG3 PRO A 12 11.218 -22.260 -9.462 1.00 34.10 H new ATOM 0 HD2 PRO A 12 13.025 -20.632 -7.657 1.00 65.33 H new ATOM 0 HD3 PRO A 12 13.005 -20.704 -9.408 1.00 65.33 H new ATOM 195 N ASP A 13 10.020 -17.964 -6.521 1.00 20.12 N ATOM 196 CA ASP A 13 9.991 -17.148 -5.300 1.00 21.03 C ATOM 197 C ASP A 13 8.640 -17.234 -4.566 1.00 72.34 C ATOM 198 O ASP A 13 8.571 -17.031 -3.353 1.00 51.24 O ATOM 199 CB ASP A 13 10.313 -15.687 -5.642 1.00 42.25 C ATOM 200 CG ASP A 13 9.313 -15.085 -6.619 1.00 74.02 C ATOM 201 OD1 ASP A 13 9.392 -15.397 -7.826 1.00 4.55 O ATOM 202 OD2 ASP A 13 8.439 -14.307 -6.186 1.00 22.14 O ATOM 0 H ASP A 13 10.074 -17.419 -7.381 1.00 20.12 H new ATOM 0 HA ASP A 13 10.748 -17.546 -4.625 1.00 21.03 H new ATOM 0 HB2 ASP A 13 10.323 -15.096 -4.726 1.00 42.25 H new ATOM 0 HB3 ASP A 13 11.314 -15.629 -6.069 1.00 42.25 H new ATOM 207 N HIS A 14 7.574 -17.529 -5.306 1.00 3.44 N ATOM 208 CA HIS A 14 6.231 -17.650 -4.723 1.00 21.40 C ATOM 209 C HIS A 14 6.122 -18.844 -3.758 1.00 54.34 C ATOM 210 O HIS A 14 6.924 -19.778 -3.805 1.00 30.34 O ATOM 211 CB HIS A 14 5.180 -17.796 -5.833 1.00 41.32 C ATOM 212 CG HIS A 14 4.835 -16.513 -6.529 1.00 75.00 C ATOM 213 ND1 HIS A 14 3.576 -15.959 -6.485 1.00 5.10 N ATOM 214 CD2 HIS A 14 5.576 -15.686 -7.301 1.00 63.24 C ATOM 215 CE1 HIS A 14 3.556 -14.854 -7.198 1.00 34.45 C ATOM 216 NE2 HIS A 14 4.754 -14.664 -7.707 1.00 45.15 N ATOM 0 H HIS A 14 7.610 -17.690 -6.313 1.00 3.44 H new ATOM 0 HA HIS A 14 6.047 -16.739 -4.154 1.00 21.40 H new ATOM 0 HB2 HIS A 14 5.545 -18.510 -6.572 1.00 41.32 H new ATOM 0 HB3 HIS A 14 4.272 -18.219 -5.404 1.00 41.32 H new ATOM 0 HD1 HIS A 14 2.780 -16.346 -5.977 1.00 5.10 H new ATOM 0 HD2 HIS A 14 6.620 -15.807 -7.551 1.00 63.24 H new ATOM 0 HE1 HIS A 14 2.700 -14.211 -7.341 1.00 34.45 H new ATOM 225 N GLY A 15 5.126 -18.791 -2.877 1.00 4.33 N ATOM 226 CA GLY A 15 4.804 -19.929 -2.013 1.00 52.21 C ATOM 227 C GLY A 15 3.407 -20.478 -2.297 1.00 2.05 C ATOM 228 O GLY A 15 3.030 -21.556 -1.834 1.00 53.01 O ATOM 0 H GLY A 15 4.528 -17.976 -2.741 1.00 4.33 H new ATOM 0 HA2 GLY A 15 5.542 -20.718 -2.161 1.00 52.21 H new ATOM 0 HA3 GLY A 15 4.869 -19.623 -0.969 1.00 52.21 H new ATOM 232 N ASP A 16 2.656 -19.727 -3.095 1.00 33.12 N ATOM 233 CA ASP A 16 1.266 -20.048 -3.457 1.00 63.03 C ATOM 234 C ASP A 16 1.168 -21.134 -4.554 1.00 15.43 C ATOM 235 O ASP A 16 0.293 -21.083 -5.420 1.00 1.31 O ATOM 236 CB ASP A 16 0.579 -18.754 -3.921 1.00 51.42 C ATOM 237 CG ASP A 16 1.481 -17.920 -4.823 1.00 73.10 C ATOM 238 OD1 ASP A 16 2.347 -17.195 -4.290 1.00 40.21 O ATOM 239 OD2 ASP A 16 1.349 -17.995 -6.062 1.00 34.10 O ATOM 0 H ASP A 16 2.994 -18.863 -3.519 1.00 33.12 H new ATOM 0 HA ASP A 16 0.768 -20.459 -2.579 1.00 63.03 H new ATOM 0 HB2 ASP A 16 -0.338 -19.002 -4.455 1.00 51.42 H new ATOM 0 HB3 ASP A 16 0.291 -18.164 -3.051 1.00 51.42 H new ATOM 244 N TRP A 17 2.039 -22.142 -4.486 1.00 22.13 N ATOM 245 CA TRP A 17 2.066 -23.217 -5.494 1.00 52.04 C ATOM 246 C TRP A 17 1.090 -24.356 -5.149 1.00 32.03 C ATOM 247 O TRP A 17 1.039 -25.373 -5.846 1.00 64.30 O ATOM 248 CB TRP A 17 3.482 -23.800 -5.617 1.00 60.52 C ATOM 249 CG TRP A 17 4.533 -22.785 -5.954 1.00 32.55 C ATOM 250 CD1 TRP A 17 5.513 -22.312 -5.127 1.00 40.30 C ATOM 251 CD2 TRP A 17 4.714 -22.121 -7.210 1.00 32.00 C ATOM 252 NE1 TRP A 17 6.289 -21.397 -5.793 1.00 71.34 N ATOM 253 CE2 TRP A 17 5.817 -21.258 -7.070 1.00 43.23 C ATOM 254 CE3 TRP A 17 4.046 -22.168 -8.438 1.00 11.23 C ATOM 255 CZ2 TRP A 17 6.270 -20.457 -8.114 1.00 52.51 C ATOM 256 CZ3 TRP A 17 4.497 -21.368 -9.472 1.00 34.01 C ATOM 257 CH2 TRP A 17 5.599 -20.521 -9.302 1.00 1.30 C ATOM 0 H TRP A 17 2.736 -22.242 -3.748 1.00 22.13 H new ATOM 0 HA TRP A 17 1.758 -22.771 -6.440 1.00 52.04 H new ATOM 0 HB2 TRP A 17 3.747 -24.284 -4.677 1.00 60.52 H new ATOM 0 HB3 TRP A 17 3.480 -24.574 -6.385 1.00 60.52 H new ATOM 0 HD1 TRP A 17 5.656 -22.614 -4.100 1.00 40.30 H new ATOM 0 HE1 TRP A 17 7.089 -20.901 -5.400 1.00 71.34 H new ATOM 0 HE3 TRP A 17 3.194 -22.817 -8.576 1.00 11.23 H new ATOM 0 HZ2 TRP A 17 7.123 -19.807 -7.989 1.00 52.51 H new ATOM 0 HZ3 TRP A 17 3.991 -21.397 -10.426 1.00 34.01 H new ATOM 0 HH2 TRP A 17 5.925 -19.906 -10.127 1.00 1.30 H new ATOM 268 N THR A 18 0.321 -24.191 -4.079 1.00 43.44 N ATOM 269 CA THR A 18 -0.564 -25.256 -3.587 1.00 61.15 C ATOM 270 C THR A 18 -2.030 -25.033 -3.989 1.00 74.50 C ATOM 271 O THR A 18 -2.398 -23.983 -4.519 1.00 2.11 O ATOM 272 CB THR A 18 -0.491 -25.377 -2.045 1.00 42.04 C ATOM 273 OG1 THR A 18 -1.008 -24.188 -1.434 1.00 75.01 O ATOM 274 CG2 THR A 18 0.946 -25.604 -1.583 1.00 13.05 C ATOM 0 H THR A 18 0.288 -23.331 -3.531 1.00 43.44 H new ATOM 0 HA THR A 18 -0.210 -26.176 -4.051 1.00 61.15 H new ATOM 0 HB THR A 18 -1.093 -26.234 -1.744 1.00 42.04 H new ATOM 0 HG1 THR A 18 -1.133 -24.341 -0.474 1.00 75.01 H new ATOM 0 HG21 THR A 18 0.970 -25.686 -0.496 1.00 13.05 H new ATOM 0 HG22 THR A 18 1.329 -26.524 -2.025 1.00 13.05 H new ATOM 0 HG23 THR A 18 1.566 -24.765 -1.898 1.00 13.05 H new ATOM 282 N TYR A 19 -2.856 -26.048 -3.739 1.00 11.12 N ATOM 283 CA TYR A 19 -4.306 -25.982 -3.982 1.00 13.52 C ATOM 284 C TYR A 19 -4.993 -24.916 -3.108 1.00 63.32 C ATOM 285 O TYR A 19 -6.124 -24.504 -3.381 1.00 31.42 O ATOM 286 CB TYR A 19 -4.932 -27.355 -3.702 1.00 44.01 C ATOM 287 CG TYR A 19 -4.786 -27.814 -2.255 1.00 75.12 C ATOM 288 CD1 TYR A 19 -3.553 -28.216 -1.752 1.00 3.13 C ATOM 289 CD2 TYR A 19 -5.880 -27.839 -1.393 1.00 41.13 C ATOM 290 CE1 TYR A 19 -3.413 -28.627 -0.442 1.00 25.13 C ATOM 291 CE2 TYR A 19 -5.745 -28.250 -0.078 1.00 11.23 C ATOM 292 CZ TYR A 19 -4.508 -28.643 0.390 1.00 1.35 C ATOM 293 OH TYR A 19 -4.364 -29.053 1.700 1.00 23.01 O ATOM 0 H TYR A 19 -2.543 -26.943 -3.362 1.00 11.12 H new ATOM 0 HA TYR A 19 -4.456 -25.700 -5.024 1.00 13.52 H new ATOM 0 HB2 TYR A 19 -5.991 -27.320 -3.957 1.00 44.01 H new ATOM 0 HB3 TYR A 19 -4.471 -28.095 -4.356 1.00 44.01 H new ATOM 0 HD1 TYR A 19 -2.688 -28.206 -2.399 1.00 3.13 H new ATOM 0 HD2 TYR A 19 -6.850 -27.533 -1.757 1.00 41.13 H new ATOM 0 HE1 TYR A 19 -2.447 -28.935 -0.071 1.00 25.13 H new ATOM 0 HE2 TYR A 19 -6.603 -28.263 0.578 1.00 11.23 H new ATOM 0 HH TYR A 19 -5.231 -29.005 2.155 1.00 23.01 H new ATOM 303 N GLU A 20 -4.303 -24.482 -2.059 1.00 44.21 N ATOM 304 CA GLU A 20 -4.851 -23.511 -1.110 1.00 43.15 C ATOM 305 C GLU A 20 -5.046 -22.140 -1.781 1.00 62.42 C ATOM 306 O GLU A 20 -4.093 -21.388 -1.991 1.00 71.15 O ATOM 307 CB GLU A 20 -3.920 -23.422 0.108 1.00 15.51 C ATOM 308 CG GLU A 20 -3.665 -24.787 0.750 1.00 1.12 C ATOM 309 CD GLU A 20 -2.598 -24.764 1.836 1.00 4.21 C ATOM 310 OE1 GLU A 20 -1.405 -24.591 1.498 1.00 24.14 O ATOM 311 OE2 GLU A 20 -2.945 -24.949 3.024 1.00 53.42 O ATOM 0 H GLU A 20 -3.355 -24.789 -1.841 1.00 44.21 H new ATOM 0 HA GLU A 20 -5.835 -23.840 -0.775 1.00 43.15 H new ATOM 0 HB2 GLU A 20 -2.970 -22.984 -0.196 1.00 15.51 H new ATOM 0 HB3 GLU A 20 -4.358 -22.752 0.848 1.00 15.51 H new ATOM 0 HG2 GLU A 20 -4.597 -25.157 1.177 1.00 1.12 H new ATOM 0 HG3 GLU A 20 -3.367 -25.493 -0.025 1.00 1.12 H new ATOM 318 N GLU A 21 -6.296 -21.843 -2.138 1.00 1.40 N ATOM 319 CA GLU A 21 -6.626 -20.646 -2.922 1.00 42.25 C ATOM 320 C GLU A 21 -6.393 -19.345 -2.132 1.00 43.23 C ATOM 321 O GLU A 21 -5.704 -18.436 -2.606 1.00 71.32 O ATOM 322 CB GLU A 21 -8.082 -20.730 -3.403 1.00 64.33 C ATOM 323 CG GLU A 21 -8.467 -19.665 -4.425 1.00 11.10 C ATOM 324 CD GLU A 21 -9.841 -19.908 -5.033 1.00 35.33 C ATOM 325 OE1 GLU A 21 -10.064 -21.007 -5.584 1.00 32.24 O ATOM 326 OE2 GLU A 21 -10.701 -19.003 -4.978 1.00 13.12 O ATOM 0 H GLU A 21 -7.103 -22.417 -1.896 1.00 1.40 H new ATOM 0 HA GLU A 21 -5.956 -20.617 -3.781 1.00 42.25 H new ATOM 0 HB2 GLU A 21 -8.252 -21.714 -3.839 1.00 64.33 H new ATOM 0 HB3 GLU A 21 -8.743 -20.645 -2.540 1.00 64.33 H new ATOM 0 HG2 GLU A 21 -8.453 -18.686 -3.947 1.00 11.10 H new ATOM 0 HG3 GLU A 21 -7.721 -19.642 -5.219 1.00 11.10 H new ATOM 333 N GLN A 22 -6.974 -19.250 -0.935 1.00 21.14 N ATOM 334 CA GLN A 22 -6.777 -18.070 -0.082 1.00 73.45 C ATOM 335 C GLN A 22 -5.587 -18.276 0.869 1.00 11.01 C ATOM 336 O GLN A 22 -5.550 -19.223 1.656 1.00 74.15 O ATOM 337 CB GLN A 22 -8.070 -17.719 0.686 1.00 0.42 C ATOM 338 CG GLN A 22 -8.597 -18.801 1.638 1.00 52.12 C ATOM 339 CD GLN A 22 -8.388 -18.457 3.108 1.00 60.13 C ATOM 340 OE1 GLN A 22 -7.394 -18.831 3.717 1.00 51.21 O ATOM 341 NE2 GLN A 22 -9.318 -17.718 3.684 1.00 30.51 N ATOM 0 H GLN A 22 -7.579 -19.966 -0.534 1.00 21.14 H new ATOM 0 HA GLN A 22 -6.541 -17.220 -0.723 1.00 73.45 H new ATOM 0 HB2 GLN A 22 -7.893 -16.811 1.262 1.00 0.42 H new ATOM 0 HB3 GLN A 22 -8.850 -17.489 -0.040 1.00 0.42 H new ATOM 0 HG2 GLN A 22 -9.661 -18.952 1.454 1.00 52.12 H new ATOM 0 HG3 GLN A 22 -8.098 -19.745 1.417 1.00 52.12 H new ATOM 0 HE21 GLN A 22 -10.136 -17.421 3.152 1.00 30.51 H new ATOM 0 HE22 GLN A 22 -9.219 -17.444 4.661 1.00 30.51 H new ATOM 350 N PHE A 23 -4.602 -17.390 0.769 1.00 30.34 N ATOM 351 CA PHE A 23 -3.372 -17.495 1.556 1.00 22.52 C ATOM 352 C PHE A 23 -3.578 -16.902 2.966 1.00 34.20 C ATOM 353 O PHE A 23 -3.294 -15.728 3.221 1.00 52.52 O ATOM 354 CB PHE A 23 -2.237 -16.784 0.801 1.00 54.13 C ATOM 355 CG PHE A 23 -0.843 -17.184 1.213 1.00 22.32 C ATOM 356 CD1 PHE A 23 -0.343 -18.438 0.884 1.00 10.13 C ATOM 357 CD2 PHE A 23 -0.022 -16.302 1.901 1.00 74.24 C ATOM 358 CE1 PHE A 23 0.945 -18.800 1.233 1.00 54.41 C ATOM 359 CE2 PHE A 23 1.264 -16.663 2.256 1.00 35.04 C ATOM 360 CZ PHE A 23 1.749 -17.912 1.921 1.00 0.33 C ATOM 0 H PHE A 23 -4.630 -16.583 0.146 1.00 30.34 H new ATOM 0 HA PHE A 23 -3.103 -18.543 1.687 1.00 22.52 H new ATOM 0 HB2 PHE A 23 -2.354 -16.979 -0.265 1.00 54.13 H new ATOM 0 HB3 PHE A 23 -2.346 -15.709 0.942 1.00 54.13 H new ATOM 0 HD1 PHE A 23 -0.968 -19.138 0.349 1.00 10.13 H new ATOM 0 HD2 PHE A 23 -0.392 -15.322 2.162 1.00 74.24 H new ATOM 0 HE1 PHE A 23 1.322 -19.777 0.968 1.00 54.41 H new ATOM 0 HE2 PHE A 23 1.890 -15.968 2.796 1.00 35.04 H new ATOM 0 HZ PHE A 23 2.755 -18.194 2.196 1.00 0.33 H new ATOM 370 N LYS A 24 -4.085 -17.740 3.871 1.00 71.34 N ATOM 371 CA LYS A 24 -4.506 -17.316 5.220 1.00 65.34 C ATOM 372 C LYS A 24 -3.356 -16.742 6.077 1.00 63.35 C ATOM 373 O LYS A 24 -3.597 -16.150 7.130 1.00 60.54 O ATOM 374 CB LYS A 24 -5.184 -18.500 5.935 1.00 75.30 C ATOM 375 CG LYS A 24 -5.855 -18.141 7.262 1.00 15.33 C ATOM 376 CD LYS A 24 -6.959 -19.136 7.633 1.00 4.44 C ATOM 377 CE LYS A 24 -6.447 -20.569 7.756 1.00 45.02 C ATOM 378 NZ LYS A 24 -5.541 -20.745 8.920 1.00 11.43 N ATOM 0 H LYS A 24 -4.218 -18.736 3.695 1.00 71.34 H new ATOM 0 HA LYS A 24 -5.213 -16.496 5.095 1.00 65.34 H new ATOM 0 HB2 LYS A 24 -5.932 -18.930 5.269 1.00 75.30 H new ATOM 0 HB3 LYS A 24 -4.438 -19.273 6.117 1.00 75.30 H new ATOM 0 HG2 LYS A 24 -5.106 -18.119 8.053 1.00 15.33 H new ATOM 0 HG3 LYS A 24 -6.278 -17.138 7.195 1.00 15.33 H new ATOM 0 HD2 LYS A 24 -7.411 -18.834 8.578 1.00 4.44 H new ATOM 0 HD3 LYS A 24 -7.744 -19.099 6.878 1.00 4.44 H new ATOM 0 HE2 LYS A 24 -7.294 -21.248 7.851 1.00 45.02 H new ATOM 0 HE3 LYS A 24 -5.919 -20.844 6.843 1.00 45.02 H new ATOM 0 HZ1 LYS A 24 -5.462 -21.756 9.148 1.00 11.43 H new ATOM 0 HZ2 LYS A 24 -4.600 -20.368 8.688 1.00 11.43 H new ATOM 0 HZ3 LYS A 24 -5.926 -20.234 9.740 1.00 11.43 H new ATOM 392 N GLN A 25 -2.114 -16.900 5.624 1.00 23.35 N ATOM 393 CA GLN A 25 -0.943 -16.408 6.373 1.00 51.20 C ATOM 394 C GLN A 25 -1.097 -14.934 6.808 1.00 13.12 C ATOM 395 O GLN A 25 -0.815 -14.592 7.958 1.00 12.40 O ATOM 396 CB GLN A 25 0.329 -16.571 5.532 1.00 3.22 C ATOM 397 CG GLN A 25 1.589 -15.990 6.174 1.00 43.34 C ATOM 398 CD GLN A 25 1.942 -16.639 7.503 1.00 72.52 C ATOM 399 OE1 GLN A 25 2.667 -17.624 7.555 1.00 64.13 O ATOM 400 NE2 GLN A 25 1.444 -16.085 8.590 1.00 73.32 N ATOM 0 H GLN A 25 -1.885 -17.363 4.744 1.00 23.35 H new ATOM 0 HA GLN A 25 -0.868 -17.009 7.279 1.00 51.20 H new ATOM 0 HB2 GLN A 25 0.490 -17.632 5.340 1.00 3.22 H new ATOM 0 HB3 GLN A 25 0.175 -16.092 4.565 1.00 3.22 H new ATOM 0 HG2 GLN A 25 2.426 -16.108 5.486 1.00 43.34 H new ATOM 0 HG3 GLN A 25 1.450 -14.920 6.326 1.00 43.34 H new ATOM 0 HE21 GLN A 25 0.843 -15.265 8.515 1.00 73.32 H new ATOM 0 HE22 GLN A 25 1.660 -16.477 9.507 1.00 73.32 H new ATOM 409 N LEU A 26 -1.548 -14.065 5.901 1.00 30.45 N ATOM 410 CA LEU A 26 -1.742 -12.643 6.237 1.00 41.21 C ATOM 411 C LEU A 26 -2.750 -12.463 7.384 1.00 1.11 C ATOM 412 O LEU A 26 -2.631 -11.543 8.195 1.00 0.12 O ATOM 413 CB LEU A 26 -2.200 -11.837 5.013 1.00 4.23 C ATOM 414 CG LEU A 26 -1.131 -11.587 3.936 1.00 14.14 C ATOM 415 CD1 LEU A 26 -1.662 -10.633 2.868 1.00 74.25 C ATOM 416 CD2 LEU A 26 0.151 -11.036 4.557 1.00 11.21 C ATOM 0 H LEU A 26 -1.784 -14.311 4.940 1.00 30.45 H new ATOM 0 HA LEU A 26 -0.775 -12.263 6.565 1.00 41.21 H new ATOM 0 HB2 LEU A 26 -3.038 -12.359 4.551 1.00 4.23 H new ATOM 0 HB3 LEU A 26 -2.575 -10.873 5.356 1.00 4.23 H new ATOM 0 HG LEU A 26 -0.895 -12.541 3.464 1.00 14.14 H new ATOM 0 HD11 LEU A 26 -0.893 -10.467 2.114 1.00 74.25 H new ATOM 0 HD12 LEU A 26 -2.544 -11.068 2.398 1.00 74.25 H new ATOM 0 HD13 LEU A 26 -1.929 -9.682 3.330 1.00 74.25 H new ATOM 0 HD21 LEU A 26 0.891 -10.868 3.775 1.00 11.21 H new ATOM 0 HD22 LEU A 26 -0.065 -10.094 5.061 1.00 11.21 H new ATOM 0 HD23 LEU A 26 0.543 -11.753 5.279 1.00 11.21 H new ATOM 428 N TYR A 27 -3.734 -13.350 7.449 1.00 32.30 N ATOM 429 CA TYR A 27 -4.746 -13.312 8.507 1.00 73.22 C ATOM 430 C TYR A 27 -4.139 -13.734 9.858 1.00 55.32 C ATOM 431 O TYR A 27 -4.541 -13.248 10.919 1.00 64.45 O ATOM 432 CB TYR A 27 -5.920 -14.236 8.142 1.00 34.31 C ATOM 433 CG TYR A 27 -6.639 -13.855 6.851 1.00 44.53 C ATOM 434 CD1 TYR A 27 -6.040 -14.045 5.607 1.00 25.24 C ATOM 435 CD2 TYR A 27 -7.915 -13.305 6.878 1.00 13.42 C ATOM 436 CE1 TYR A 27 -6.693 -13.697 4.438 1.00 32.33 C ATOM 437 CE2 TYR A 27 -8.573 -12.955 5.715 1.00 1.22 C ATOM 438 CZ TYR A 27 -7.957 -13.151 4.497 1.00 23.54 C ATOM 439 OH TYR A 27 -8.610 -12.801 3.336 1.00 2.23 O ATOM 0 H TYR A 27 -3.857 -14.110 6.780 1.00 32.30 H new ATOM 0 HA TYR A 27 -5.111 -12.289 8.601 1.00 73.22 H new ATOM 0 HB2 TYR A 27 -5.549 -15.257 8.050 1.00 34.31 H new ATOM 0 HB3 TYR A 27 -6.640 -14.231 8.961 1.00 34.31 H new ATOM 0 HD1 TYR A 27 -5.049 -14.471 5.555 1.00 25.24 H new ATOM 0 HD2 TYR A 27 -8.403 -13.148 7.829 1.00 13.42 H new ATOM 0 HE1 TYR A 27 -6.214 -13.853 3.483 1.00 32.33 H new ATOM 0 HE2 TYR A 27 -9.565 -12.530 5.759 1.00 1.22 H new ATOM 0 HH TYR A 27 -7.952 -12.558 2.651 1.00 2.23 H new ATOM 449 N GLU A 28 -3.150 -14.626 9.803 1.00 72.12 N ATOM 450 CA GLU A 28 -2.535 -15.197 11.010 1.00 65.11 C ATOM 451 C GLU A 28 -1.146 -14.605 11.323 1.00 14.30 C ATOM 452 O GLU A 28 -0.399 -15.182 12.112 1.00 53.23 O ATOM 453 CB GLU A 28 -2.406 -16.717 10.851 1.00 23.20 C ATOM 454 CG GLU A 28 -3.727 -17.424 10.577 1.00 33.43 C ATOM 455 CD GLU A 28 -3.572 -18.931 10.469 1.00 14.25 C ATOM 456 OE1 GLU A 28 -3.249 -19.425 9.367 1.00 62.14 O ATOM 457 OE2 GLU A 28 -3.781 -19.630 11.485 1.00 50.03 O ATOM 0 H GLU A 28 -2.752 -14.973 8.930 1.00 72.12 H new ATOM 0 HA GLU A 28 -3.190 -14.944 11.844 1.00 65.11 H new ATOM 0 HB2 GLU A 28 -1.715 -16.930 10.035 1.00 23.20 H new ATOM 0 HB3 GLU A 28 -1.965 -17.131 11.758 1.00 23.20 H new ATOM 0 HG2 GLU A 28 -4.432 -17.191 11.375 1.00 33.43 H new ATOM 0 HG3 GLU A 28 -4.155 -17.039 9.651 1.00 33.43 H new ATOM 464 N LEU A 29 -0.806 -13.455 10.730 1.00 71.43 N ATOM 465 CA LEU A 29 0.510 -12.823 10.969 1.00 40.24 C ATOM 466 C LEU A 29 0.808 -12.677 12.471 1.00 42.52 C ATOM 467 O LEU A 29 1.845 -13.124 12.960 1.00 30.34 O ATOM 468 CB LEU A 29 0.567 -11.438 10.305 1.00 13.40 C ATOM 469 CG LEU A 29 0.497 -11.429 8.770 1.00 3.44 C ATOM 470 CD1 LEU A 29 0.449 -9.996 8.236 1.00 22.54 C ATOM 471 CD2 LEU A 29 1.677 -12.191 8.168 1.00 62.25 C ATOM 0 H LEU A 29 -1.411 -12.943 10.088 1.00 71.43 H new ATOM 0 HA LEU A 29 1.265 -13.475 10.530 1.00 40.24 H new ATOM 0 HB2 LEU A 29 -0.256 -10.837 10.691 1.00 13.40 H new ATOM 0 HB3 LEU A 29 1.491 -10.947 10.611 1.00 13.40 H new ATOM 0 HG LEU A 29 -0.422 -11.934 8.471 1.00 3.44 H new ATOM 0 HD11 LEU A 29 0.400 -10.015 7.147 1.00 22.54 H new ATOM 0 HD12 LEU A 29 -0.432 -9.490 8.630 1.00 22.54 H new ATOM 0 HD13 LEU A 29 1.345 -9.461 8.549 1.00 22.54 H new ATOM 0 HD21 LEU A 29 1.606 -12.171 7.080 1.00 62.25 H new ATOM 0 HD22 LEU A 29 2.610 -11.722 8.479 1.00 62.25 H new ATOM 0 HD23 LEU A 29 1.657 -13.224 8.514 1.00 62.25 H new ATOM 483 N ASP A 30 -0.116 -12.049 13.191 1.00 11.53 N ATOM 484 CA ASP A 30 0.012 -11.865 14.641 1.00 51.42 C ATOM 485 C ASP A 30 -1.135 -12.559 15.397 1.00 60.15 C ATOM 486 O ASP A 30 -1.283 -12.384 16.607 1.00 65.24 O ATOM 487 CB ASP A 30 0.023 -10.369 14.975 1.00 60.13 C ATOM 488 CG ASP A 30 1.166 -9.632 14.303 1.00 10.43 C ATOM 489 OD1 ASP A 30 1.079 -9.381 13.082 1.00 51.25 O ATOM 490 OD2 ASP A 30 2.153 -9.300 14.992 1.00 70.11 O ATOM 0 H ASP A 30 -0.969 -11.655 12.795 1.00 11.53 H new ATOM 0 HA ASP A 30 0.951 -12.319 14.958 1.00 51.42 H new ATOM 0 HB2 ASP A 30 -0.923 -9.924 14.666 1.00 60.13 H new ATOM 0 HB3 ASP A 30 0.098 -10.242 16.055 1.00 60.13 H new ATOM 495 N GLY A 31 -1.938 -13.349 14.679 1.00 73.44 N ATOM 496 CA GLY A 31 -3.160 -13.903 15.264 1.00 13.53 C ATOM 497 C GLY A 31 -4.074 -12.814 15.821 1.00 54.02 C ATOM 498 O GLY A 31 -4.637 -12.948 16.907 1.00 10.34 O ATOM 0 H GLY A 31 -1.768 -13.615 13.709 1.00 73.44 H new ATOM 0 HA2 GLY A 31 -3.697 -14.475 14.507 1.00 13.53 H new ATOM 0 HA3 GLY A 31 -2.897 -14.598 16.061 1.00 13.53 H new ATOM 502 N ASP A 32 -4.218 -11.735 15.056 1.00 21.04 N ATOM 503 CA ASP A 32 -4.903 -10.521 15.512 1.00 24.30 C ATOM 504 C ASP A 32 -6.312 -10.386 14.896 1.00 5.40 C ATOM 505 O ASP A 32 -6.502 -10.640 13.704 1.00 42.00 O ATOM 506 CB ASP A 32 -4.032 -9.310 15.148 1.00 21.13 C ATOM 507 CG ASP A 32 -4.680 -7.979 15.483 1.00 33.43 C ATOM 508 OD1 ASP A 32 -4.628 -7.568 16.659 1.00 62.13 O ATOM 509 OD2 ASP A 32 -5.241 -7.335 14.569 1.00 63.14 O ATOM 0 H ASP A 32 -3.864 -11.674 14.101 1.00 21.04 H new ATOM 0 HA ASP A 32 -5.042 -10.576 16.592 1.00 24.30 H new ATOM 0 HB2 ASP A 32 -3.080 -9.385 15.674 1.00 21.13 H new ATOM 0 HB3 ASP A 32 -3.810 -9.339 14.081 1.00 21.13 H new ATOM 514 N PRO A 33 -7.316 -9.970 15.704 1.00 12.51 N ATOM 515 CA PRO A 33 -8.704 -9.774 15.233 1.00 54.00 C ATOM 516 C PRO A 33 -8.814 -8.800 14.040 1.00 61.03 C ATOM 517 O PRO A 33 -9.354 -9.149 12.987 1.00 1.32 O ATOM 518 CB PRO A 33 -9.433 -9.211 16.471 1.00 43.33 C ATOM 519 CG PRO A 33 -8.351 -8.752 17.389 1.00 22.12 C ATOM 520 CD PRO A 33 -7.191 -9.673 17.143 1.00 11.53 C ATOM 0 HA PRO A 33 -9.130 -10.705 14.858 1.00 54.00 H new ATOM 0 HB2 PRO A 33 -10.093 -8.388 16.198 1.00 43.33 H new ATOM 0 HB3 PRO A 33 -10.053 -9.973 16.943 1.00 43.33 H new ATOM 0 HG2 PRO A 33 -8.078 -7.716 17.186 1.00 22.12 H new ATOM 0 HG3 PRO A 33 -8.674 -8.798 18.429 1.00 22.12 H new ATOM 0 HD2 PRO A 33 -6.239 -9.197 17.378 1.00 11.53 H new ATOM 0 HD3 PRO A 33 -7.254 -10.576 17.750 1.00 11.53 H new ATOM 528 N LYS A 34 -8.287 -7.589 14.196 1.00 25.31 N ATOM 529 CA LYS A 34 -8.353 -6.579 13.130 1.00 52.45 C ATOM 530 C LYS A 34 -7.523 -6.979 11.903 1.00 22.32 C ATOM 531 O LYS A 34 -7.699 -6.420 10.821 1.00 70.11 O ATOM 532 CB LYS A 34 -7.905 -5.207 13.658 1.00 73.05 C ATOM 533 CG LYS A 34 -8.995 -4.455 14.419 1.00 25.31 C ATOM 534 CD LYS A 34 -10.141 -4.044 13.492 1.00 51.14 C ATOM 535 CE LYS A 34 -11.263 -3.338 14.243 1.00 22.24 C ATOM 536 NZ LYS A 34 -11.922 -4.235 15.229 1.00 65.40 N ATOM 0 H LYS A 34 -7.811 -7.279 15.043 1.00 25.31 H new ATOM 0 HA LYS A 34 -9.393 -6.514 12.811 1.00 52.45 H new ATOM 0 HB2 LYS A 34 -7.045 -5.343 14.314 1.00 73.05 H new ATOM 0 HB3 LYS A 34 -7.573 -4.596 12.819 1.00 73.05 H new ATOM 0 HG2 LYS A 34 -9.381 -5.084 15.221 1.00 25.31 H new ATOM 0 HG3 LYS A 34 -8.568 -3.568 14.887 1.00 25.31 H new ATOM 0 HD2 LYS A 34 -9.757 -3.386 12.712 1.00 51.14 H new ATOM 0 HD3 LYS A 34 -10.539 -4.929 12.995 1.00 51.14 H new ATOM 0 HE2 LYS A 34 -10.862 -2.465 14.758 1.00 22.24 H new ATOM 0 HE3 LYS A 34 -12.004 -2.975 13.531 1.00 22.24 H new ATOM 0 HZ1 LYS A 34 -12.743 -3.750 15.645 1.00 65.40 H new ATOM 0 HZ2 LYS A 34 -12.238 -5.103 14.751 1.00 65.40 H new ATOM 0 HZ3 LYS A 34 -11.247 -4.480 15.981 1.00 65.40 H new ATOM 550 N ARG A 35 -6.622 -7.946 12.072 1.00 44.20 N ATOM 551 CA ARG A 35 -5.824 -8.447 10.950 1.00 11.40 C ATOM 552 C ARG A 35 -6.730 -9.082 9.883 1.00 1.42 C ATOM 553 O ARG A 35 -6.722 -8.674 8.723 1.00 14.32 O ATOM 554 CB ARG A 35 -4.779 -9.471 11.436 1.00 42.20 C ATOM 555 CG ARG A 35 -3.423 -9.354 10.728 1.00 42.52 C ATOM 556 CD ARG A 35 -2.323 -8.867 11.675 1.00 32.52 C ATOM 557 NE ARG A 35 -2.748 -7.723 12.482 1.00 54.25 N ATOM 558 CZ ARG A 35 -1.962 -7.053 13.284 1.00 64.14 C ATOM 559 NH1 ARG A 35 -0.705 -7.348 13.390 1.00 11.53 N ATOM 560 NH2 ARG A 35 -2.444 -6.084 13.988 1.00 4.53 N ATOM 0 H ARG A 35 -6.426 -8.396 12.966 1.00 44.20 H new ATOM 0 HA ARG A 35 -5.299 -7.601 10.505 1.00 11.40 H new ATOM 0 HB2 ARG A 35 -4.631 -9.344 12.508 1.00 42.20 H new ATOM 0 HB3 ARG A 35 -5.172 -10.477 11.285 1.00 42.20 H new ATOM 0 HG2 ARG A 35 -3.144 -10.324 10.316 1.00 42.52 H new ATOM 0 HG3 ARG A 35 -3.510 -8.664 9.888 1.00 42.52 H new ATOM 0 HD2 ARG A 35 -2.027 -9.683 12.334 1.00 32.52 H new ATOM 0 HD3 ARG A 35 -1.443 -8.591 11.094 1.00 32.52 H new ATOM 0 HE ARG A 35 -3.722 -7.428 12.415 1.00 54.25 H new ATOM 0 HH11 ARG A 35 -0.313 -8.114 12.843 1.00 11.53 H new ATOM 0 HH12 ARG A 35 -0.107 -6.814 14.021 1.00 11.53 H new ATOM 0 HH21 ARG A 35 -3.433 -5.845 13.917 1.00 4.53 H new ATOM 0 HH22 ARG A 35 -1.836 -5.558 14.615 1.00 4.53 H new ATOM 574 N LYS A 36 -7.526 -10.074 10.289 1.00 53.04 N ATOM 575 CA LYS A 36 -8.437 -10.744 9.355 1.00 13.32 C ATOM 576 C LYS A 36 -9.625 -9.842 8.989 1.00 65.11 C ATOM 577 O LYS A 36 -10.146 -9.919 7.877 1.00 15.10 O ATOM 578 CB LYS A 36 -8.943 -12.092 9.908 1.00 11.22 C ATOM 579 CG LYS A 36 -9.850 -12.003 11.138 1.00 14.14 C ATOM 580 CD LYS A 36 -9.070 -12.049 12.449 1.00 53.13 C ATOM 581 CE LYS A 36 -8.297 -13.353 12.621 1.00 43.53 C ATOM 582 NZ LYS A 36 -9.187 -14.545 12.605 1.00 62.52 N ATOM 0 H LYS A 36 -7.560 -10.428 11.245 1.00 53.04 H new ATOM 0 HA LYS A 36 -7.863 -10.947 8.451 1.00 13.32 H new ATOM 0 HB2 LYS A 36 -9.485 -12.609 9.116 1.00 11.22 H new ATOM 0 HB3 LYS A 36 -8.080 -12.709 10.159 1.00 11.22 H new ATOM 0 HG2 LYS A 36 -10.425 -11.078 11.094 1.00 14.14 H new ATOM 0 HG3 LYS A 36 -10.566 -12.825 11.117 1.00 14.14 H new ATOM 0 HD2 LYS A 36 -8.375 -11.210 12.484 1.00 53.13 H new ATOM 0 HD3 LYS A 36 -9.760 -11.926 13.284 1.00 53.13 H new ATOM 0 HE2 LYS A 36 -7.559 -13.443 11.824 1.00 43.53 H new ATOM 0 HE3 LYS A 36 -7.748 -13.325 13.562 1.00 43.53 H new ATOM 0 HZ1 LYS A 36 -8.646 -15.386 12.892 1.00 62.52 H new ATOM 0 HZ2 LYS A 36 -9.976 -14.398 13.266 1.00 62.52 H new ATOM 0 HZ3 LYS A 36 -9.562 -14.686 11.645 1.00 62.52 H new ATOM 596 N GLU A 37 -10.046 -8.988 9.926 1.00 61.13 N ATOM 597 CA GLU A 37 -11.127 -8.024 9.670 1.00 73.44 C ATOM 598 C GLU A 37 -10.757 -7.059 8.532 1.00 20.54 C ATOM 599 O GLU A 37 -11.500 -6.920 7.558 1.00 32.14 O ATOM 600 CB GLU A 37 -11.457 -7.235 10.951 1.00 70.32 C ATOM 601 CG GLU A 37 -12.164 -8.064 12.019 1.00 62.54 C ATOM 602 CD GLU A 37 -12.308 -7.335 13.350 1.00 5.13 C ATOM 603 OE1 GLU A 37 -12.757 -6.172 13.359 1.00 32.34 O ATOM 604 OE2 GLU A 37 -11.963 -7.926 14.396 1.00 53.13 O ATOM 0 H GLU A 37 -9.657 -8.942 10.868 1.00 61.13 H new ATOM 0 HA GLU A 37 -12.009 -8.585 9.362 1.00 73.44 H new ATOM 0 HB2 GLU A 37 -10.533 -6.834 11.368 1.00 70.32 H new ATOM 0 HB3 GLU A 37 -12.085 -6.383 10.690 1.00 70.32 H new ATOM 0 HG2 GLU A 37 -13.153 -8.343 11.657 1.00 62.54 H new ATOM 0 HG3 GLU A 37 -11.610 -8.989 12.177 1.00 62.54 H new ATOM 611 N PHE A 38 -9.601 -6.406 8.650 1.00 5.55 N ATOM 612 CA PHE A 38 -9.125 -5.488 7.610 1.00 3.33 C ATOM 613 C PHE A 38 -9.019 -6.191 6.249 1.00 3.42 C ATOM 614 O PHE A 38 -9.511 -5.687 5.241 1.00 3.31 O ATOM 615 CB PHE A 38 -7.766 -4.891 7.997 1.00 34.41 C ATOM 616 CG PHE A 38 -7.160 -4.007 6.928 1.00 24.32 C ATOM 617 CD1 PHE A 38 -7.541 -2.679 6.805 1.00 10.24 C ATOM 618 CD2 PHE A 38 -6.212 -4.509 6.040 1.00 64.41 C ATOM 619 CE1 PHE A 38 -6.994 -1.872 5.824 1.00 1.42 C ATOM 620 CE2 PHE A 38 -5.663 -3.705 5.058 1.00 54.24 C ATOM 621 CZ PHE A 38 -6.054 -2.386 4.951 1.00 65.33 C ATOM 0 H PHE A 38 -8.977 -6.494 9.452 1.00 5.55 H new ATOM 0 HA PHE A 38 -9.855 -4.683 7.523 1.00 3.33 H new ATOM 0 HB2 PHE A 38 -7.882 -4.311 8.912 1.00 34.41 H new ATOM 0 HB3 PHE A 38 -7.073 -5.703 8.220 1.00 34.41 H new ATOM 0 HD1 PHE A 38 -8.274 -2.270 7.484 1.00 10.24 H new ATOM 0 HD2 PHE A 38 -5.901 -5.540 6.119 1.00 64.41 H new ATOM 0 HE1 PHE A 38 -7.301 -0.840 5.740 1.00 1.42 H new ATOM 0 HE2 PHE A 38 -4.929 -4.109 4.376 1.00 54.24 H new ATOM 0 HZ PHE A 38 -5.626 -1.756 4.186 1.00 65.33 H new ATOM 631 N LEU A 39 -8.373 -7.356 6.229 1.00 24.54 N ATOM 632 CA LEU A 39 -8.207 -8.127 4.990 1.00 12.21 C ATOM 633 C LEU A 39 -9.562 -8.548 4.397 1.00 34.04 C ATOM 634 O LEU A 39 -9.759 -8.504 3.183 1.00 43.41 O ATOM 635 CB LEU A 39 -7.338 -9.363 5.252 1.00 42.31 C ATOM 636 CG LEU A 39 -5.903 -9.067 5.719 1.00 14.43 C ATOM 637 CD1 LEU A 39 -5.193 -10.357 6.111 1.00 23.53 C ATOM 638 CD2 LEU A 39 -5.118 -8.326 4.636 1.00 15.40 C ATOM 0 H LEU A 39 -7.956 -7.789 7.053 1.00 24.54 H new ATOM 0 HA LEU A 39 -7.712 -7.484 4.262 1.00 12.21 H new ATOM 0 HB2 LEU A 39 -7.828 -9.979 6.006 1.00 42.31 H new ATOM 0 HB3 LEU A 39 -7.291 -9.955 4.338 1.00 42.31 H new ATOM 0 HG LEU A 39 -5.957 -8.422 6.596 1.00 14.43 H new ATOM 0 HD11 LEU A 39 -4.179 -10.129 6.439 1.00 23.53 H new ATOM 0 HD12 LEU A 39 -5.737 -10.839 6.923 1.00 23.53 H new ATOM 0 HD13 LEU A 39 -5.155 -11.027 5.252 1.00 23.53 H new ATOM 0 HD21 LEU A 39 -4.106 -8.128 4.991 1.00 15.40 H new ATOM 0 HD22 LEU A 39 -5.074 -8.938 3.735 1.00 15.40 H new ATOM 0 HD23 LEU A 39 -5.614 -7.382 4.409 1.00 15.40 H new ATOM 650 N ASP A 40 -10.491 -8.955 5.260 1.00 40.53 N ATOM 651 CA ASP A 40 -11.837 -9.340 4.826 1.00 11.22 C ATOM 652 C ASP A 40 -12.549 -8.168 4.121 1.00 33.51 C ATOM 653 O ASP A 40 -13.074 -8.321 3.012 1.00 62.12 O ATOM 654 CB ASP A 40 -12.651 -9.821 6.032 1.00 74.10 C ATOM 655 CG ASP A 40 -14.070 -10.211 5.666 1.00 62.33 C ATOM 656 OD1 ASP A 40 -14.258 -11.269 5.027 1.00 0.15 O ATOM 657 OD2 ASP A 40 -15.005 -9.459 6.014 1.00 64.14 O ATOM 0 H ASP A 40 -10.338 -9.028 6.266 1.00 40.53 H new ATOM 0 HA ASP A 40 -11.751 -10.155 4.107 1.00 11.22 H new ATOM 0 HB2 ASP A 40 -12.150 -10.676 6.485 1.00 74.10 H new ATOM 0 HB3 ASP A 40 -12.678 -9.032 6.784 1.00 74.10 H new ATOM 662 N ASP A 41 -12.558 -7.001 4.768 1.00 41.41 N ATOM 663 CA ASP A 41 -13.106 -5.780 4.163 1.00 64.33 C ATOM 664 C ASP A 41 -12.350 -5.400 2.879 1.00 4.33 C ATOM 665 O ASP A 41 -12.959 -5.041 1.875 1.00 42.33 O ATOM 666 CB ASP A 41 -13.049 -4.614 5.158 1.00 73.22 C ATOM 667 CG ASP A 41 -14.129 -4.694 6.226 1.00 55.03 C ATOM 668 OD1 ASP A 41 -13.895 -5.313 7.284 1.00 42.11 O ATOM 669 OD2 ASP A 41 -15.220 -4.122 6.014 1.00 23.45 O ATOM 0 H ASP A 41 -12.192 -6.873 5.712 1.00 41.41 H new ATOM 0 HA ASP A 41 -14.145 -5.983 3.903 1.00 64.33 H new ATOM 0 HB2 ASP A 41 -12.071 -4.600 5.638 1.00 73.22 H new ATOM 0 HB3 ASP A 41 -13.151 -3.674 4.615 1.00 73.22 H new ATOM 674 N LEU A 42 -11.021 -5.486 2.926 1.00 70.13 N ATOM 675 CA LEU A 42 -10.162 -5.123 1.787 1.00 75.11 C ATOM 676 C LEU A 42 -10.483 -5.959 0.535 1.00 54.11 C ATOM 677 O LEU A 42 -10.838 -5.414 -0.514 1.00 64.34 O ATOM 678 CB LEU A 42 -8.687 -5.317 2.172 1.00 3.31 C ATOM 679 CG LEU A 42 -7.663 -5.033 1.059 1.00 3.43 C ATOM 680 CD1 LEU A 42 -7.664 -3.553 0.681 1.00 62.52 C ATOM 681 CD2 LEU A 42 -6.267 -5.488 1.483 1.00 42.22 C ATOM 0 H LEU A 42 -10.507 -5.807 3.747 1.00 70.13 H new ATOM 0 HA LEU A 42 -10.354 -4.077 1.546 1.00 75.11 H new ATOM 0 HB2 LEU A 42 -8.464 -4.669 3.020 1.00 3.31 H new ATOM 0 HB3 LEU A 42 -8.551 -6.344 2.512 1.00 3.31 H new ATOM 0 HG LEU A 42 -7.953 -5.603 0.176 1.00 3.43 H new ATOM 0 HD11 LEU A 42 -6.932 -3.378 -0.107 1.00 62.52 H new ATOM 0 HD12 LEU A 42 -8.655 -3.269 0.326 1.00 62.52 H new ATOM 0 HD13 LEU A 42 -7.406 -2.954 1.555 1.00 62.52 H new ATOM 0 HD21 LEU A 42 -5.557 -5.279 0.683 1.00 42.22 H new ATOM 0 HD22 LEU A 42 -5.967 -4.952 2.383 1.00 42.22 H new ATOM 0 HD23 LEU A 42 -6.279 -6.559 1.686 1.00 42.22 H new ATOM 693 N PHE A 43 -10.365 -7.281 0.662 1.00 31.34 N ATOM 694 CA PHE A 43 -10.625 -8.204 -0.453 1.00 51.24 C ATOM 695 C PHE A 43 -12.035 -8.001 -1.029 1.00 53.22 C ATOM 696 O PHE A 43 -12.216 -7.890 -2.244 1.00 53.03 O ATOM 697 CB PHE A 43 -10.453 -9.663 0.011 1.00 32.21 C ATOM 698 CG PHE A 43 -9.020 -10.079 0.280 1.00 32.31 C ATOM 699 CD1 PHE A 43 -8.098 -9.187 0.813 1.00 51.13 C ATOM 700 CD2 PHE A 43 -8.600 -11.375 0.004 1.00 32.22 C ATOM 701 CE1 PHE A 43 -6.794 -9.574 1.061 1.00 13.21 C ATOM 702 CE2 PHE A 43 -7.295 -11.766 0.251 1.00 13.20 C ATOM 703 CZ PHE A 43 -6.393 -10.864 0.780 1.00 51.24 C ATOM 0 H PHE A 43 -10.090 -7.742 1.529 1.00 31.34 H new ATOM 0 HA PHE A 43 -9.902 -7.989 -1.240 1.00 51.24 H new ATOM 0 HB2 PHE A 43 -11.037 -9.812 0.920 1.00 32.21 H new ATOM 0 HB3 PHE A 43 -10.872 -10.323 -0.749 1.00 32.21 H new ATOM 0 HD1 PHE A 43 -8.404 -8.176 1.037 1.00 51.13 H new ATOM 0 HD2 PHE A 43 -9.301 -12.086 -0.408 1.00 32.22 H new ATOM 0 HE1 PHE A 43 -6.090 -8.867 1.474 1.00 13.21 H new ATOM 0 HE2 PHE A 43 -6.983 -12.776 0.030 1.00 13.20 H new ATOM 0 HZ PHE A 43 -5.375 -11.168 0.974 1.00 51.24 H new ATOM 713 N SER A 44 -13.028 -7.942 -0.143 1.00 23.31 N ATOM 714 CA SER A 44 -14.425 -7.737 -0.551 1.00 63.51 C ATOM 715 C SER A 44 -14.622 -6.363 -1.211 1.00 34.23 C ATOM 716 O SER A 44 -15.352 -6.232 -2.194 1.00 51.31 O ATOM 717 CB SER A 44 -15.360 -7.869 0.662 1.00 11.42 C ATOM 718 OG SER A 44 -15.192 -9.120 1.313 1.00 52.12 O ATOM 0 H SER A 44 -12.895 -8.033 0.864 1.00 23.31 H new ATOM 0 HA SER A 44 -14.671 -8.506 -1.284 1.00 63.51 H new ATOM 0 HB2 SER A 44 -15.161 -7.061 1.366 1.00 11.42 H new ATOM 0 HB3 SER A 44 -16.395 -7.762 0.338 1.00 11.42 H new ATOM 0 HG SER A 44 -14.469 -9.052 1.971 1.00 52.12 H new ATOM 724 N PHE A 45 -13.959 -5.343 -0.668 1.00 1.23 N ATOM 725 CA PHE A 45 -14.070 -3.966 -1.174 1.00 1.31 C ATOM 726 C PHE A 45 -13.571 -3.847 -2.623 1.00 12.31 C ATOM 727 O PHE A 45 -14.295 -3.381 -3.512 1.00 61.45 O ATOM 728 CB PHE A 45 -13.276 -3.010 -0.269 1.00 3.32 C ATOM 729 CG PHE A 45 -13.298 -1.570 -0.716 1.00 43.23 C ATOM 730 CD1 PHE A 45 -14.371 -0.750 -0.401 1.00 21.52 C ATOM 731 CD2 PHE A 45 -12.244 -1.036 -1.446 1.00 0.00 C ATOM 732 CE1 PHE A 45 -14.393 0.569 -0.806 1.00 12.24 C ATOM 733 CE2 PHE A 45 -12.263 0.283 -1.853 1.00 62.54 C ATOM 734 CZ PHE A 45 -13.338 1.086 -1.531 1.00 1.23 C ATOM 0 H PHE A 45 -13.332 -5.441 0.131 1.00 1.23 H new ATOM 0 HA PHE A 45 -15.125 -3.693 -1.162 1.00 1.31 H new ATOM 0 HB2 PHE A 45 -13.676 -3.070 0.743 1.00 3.32 H new ATOM 0 HB3 PHE A 45 -12.241 -3.348 -0.223 1.00 3.32 H new ATOM 0 HD1 PHE A 45 -15.199 -1.148 0.168 1.00 21.52 H new ATOM 0 HD2 PHE A 45 -11.399 -1.660 -1.698 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -15.235 1.197 -0.556 1.00 12.24 H new ATOM 0 HE2 PHE A 45 -11.438 0.686 -2.422 1.00 62.54 H new ATOM 0 HZ PHE A 45 -13.354 2.119 -1.846 1.00 1.23 H new ATOM 744 N MET A 46 -12.326 -4.258 -2.860 1.00 75.02 N ATOM 745 CA MET A 46 -11.741 -4.197 -4.202 1.00 13.44 C ATOM 746 C MET A 46 -12.466 -5.154 -5.167 1.00 0.33 C ATOM 747 O MET A 46 -12.615 -4.861 -6.355 1.00 62.23 O ATOM 748 CB MET A 46 -10.232 -4.490 -4.152 1.00 22.13 C ATOM 749 CG MET A 46 -9.868 -5.847 -3.567 1.00 11.30 C ATOM 750 SD MET A 46 -8.095 -6.025 -3.295 1.00 75.24 S ATOM 751 CE MET A 46 -7.453 -5.698 -4.935 1.00 74.14 C ATOM 0 H MET A 46 -11.704 -4.635 -2.145 1.00 75.02 H new ATOM 0 HA MET A 46 -11.873 -3.185 -4.584 1.00 13.44 H new ATOM 0 HB2 MET A 46 -9.829 -4.425 -5.163 1.00 22.13 H new ATOM 0 HB3 MET A 46 -9.744 -3.713 -3.564 1.00 22.13 H new ATOM 0 HG2 MET A 46 -10.393 -5.985 -2.622 1.00 11.30 H new ATOM 0 HG3 MET A 46 -10.210 -6.633 -4.240 1.00 11.30 H new ATOM 0 HE1 MET A 46 -6.375 -5.859 -4.943 1.00 74.14 H new ATOM 0 HE2 MET A 46 -7.926 -6.370 -5.651 1.00 74.14 H new ATOM 0 HE3 MET A 46 -7.667 -4.665 -5.210 1.00 74.14 H new ATOM 761 N GLN A 47 -12.937 -6.288 -4.648 1.00 51.32 N ATOM 762 CA GLN A 47 -13.755 -7.220 -5.434 1.00 61.14 C ATOM 763 C GLN A 47 -15.035 -6.529 -5.940 1.00 71.22 C ATOM 764 O GLN A 47 -15.354 -6.572 -7.131 1.00 12.35 O ATOM 765 CB GLN A 47 -14.113 -8.451 -4.584 1.00 64.34 C ATOM 766 CG GLN A 47 -14.970 -9.491 -5.304 1.00 60.44 C ATOM 767 CD GLN A 47 -15.238 -10.724 -4.452 1.00 44.22 C ATOM 768 OE1 GLN A 47 -15.298 -10.652 -3.228 1.00 41.34 O ATOM 769 NE2 GLN A 47 -15.399 -11.868 -5.088 1.00 11.32 N ATOM 0 H GLN A 47 -12.768 -6.586 -3.687 1.00 51.32 H new ATOM 0 HA GLN A 47 -13.177 -7.543 -6.300 1.00 61.14 H new ATOM 0 HB2 GLN A 47 -13.191 -8.927 -4.250 1.00 64.34 H new ATOM 0 HB3 GLN A 47 -14.642 -8.119 -3.691 1.00 64.34 H new ATOM 0 HG2 GLN A 47 -15.920 -9.038 -5.590 1.00 60.44 H new ATOM 0 HG3 GLN A 47 -14.471 -9.792 -6.225 1.00 60.44 H new ATOM 0 HE21 GLN A 47 -15.344 -11.898 -6.106 1.00 11.32 H new ATOM 0 HE22 GLN A 47 -15.579 -12.723 -4.562 1.00 11.32 H new ATOM 778 N LYS A 48 -15.745 -5.870 -5.024 1.00 52.42 N ATOM 779 CA LYS A 48 -16.980 -5.142 -5.352 1.00 42.54 C ATOM 780 C LYS A 48 -16.734 -3.990 -6.348 1.00 14.24 C ATOM 781 O LYS A 48 -17.609 -3.656 -7.146 1.00 53.21 O ATOM 782 CB LYS A 48 -17.630 -4.593 -4.071 1.00 32.30 C ATOM 783 CG LYS A 48 -18.198 -5.673 -3.152 1.00 65.40 C ATOM 784 CD LYS A 48 -18.738 -5.079 -1.853 1.00 54.23 C ATOM 785 CE LYS A 48 -19.397 -6.135 -0.969 1.00 23.44 C ATOM 786 NZ LYS A 48 -20.627 -6.695 -1.592 1.00 13.42 N ATOM 0 H LYS A 48 -15.486 -5.823 -4.039 1.00 52.42 H new ATOM 0 HA LYS A 48 -17.653 -5.853 -5.831 1.00 42.54 H new ATOM 0 HB2 LYS A 48 -16.890 -4.013 -3.520 1.00 32.30 H new ATOM 0 HB3 LYS A 48 -18.431 -3.907 -4.347 1.00 32.30 H new ATOM 0 HG2 LYS A 48 -18.996 -6.207 -3.668 1.00 65.40 H new ATOM 0 HG3 LYS A 48 -17.421 -6.403 -2.924 1.00 65.40 H new ATOM 0 HD2 LYS A 48 -17.923 -4.605 -1.305 1.00 54.23 H new ATOM 0 HD3 LYS A 48 -19.462 -4.298 -2.085 1.00 54.23 H new ATOM 0 HE2 LYS A 48 -18.689 -6.941 -0.777 1.00 23.44 H new ATOM 0 HE3 LYS A 48 -19.648 -5.695 -0.004 1.00 23.44 H new ATOM 0 HZ1 LYS A 48 -21.143 -7.264 -0.891 1.00 13.42 H new ATOM 0 HZ2 LYS A 48 -21.234 -5.918 -1.921 1.00 13.42 H new ATOM 0 HZ3 LYS A 48 -20.365 -7.295 -2.400 1.00 13.42 H new ATOM 800 N ARG A 49 -15.547 -3.381 -6.305 1.00 41.33 N ATOM 801 CA ARG A 49 -15.233 -2.272 -7.219 1.00 11.23 C ATOM 802 C ARG A 49 -14.767 -2.785 -8.598 1.00 65.42 C ATOM 803 O ARG A 49 -14.547 -1.997 -9.524 1.00 20.41 O ATOM 804 CB ARG A 49 -14.173 -1.334 -6.611 1.00 73.54 C ATOM 805 CG ARG A 49 -12.725 -1.754 -6.861 1.00 22.12 C ATOM 806 CD ARG A 49 -11.735 -0.742 -6.288 1.00 33.44 C ATOM 807 NE ARG A 49 -12.082 0.635 -6.648 1.00 62.03 N ATOM 808 CZ ARG A 49 -11.239 1.540 -7.068 1.00 71.24 C ATOM 809 NH1 ARG A 49 -9.990 1.255 -7.262 1.00 13.43 N ATOM 810 NH2 ARG A 49 -11.665 2.738 -7.310 1.00 1.31 N ATOM 0 H ARG A 49 -14.797 -3.629 -5.660 1.00 41.33 H new ATOM 0 HA ARG A 49 -16.153 -1.706 -7.364 1.00 11.23 H new ATOM 0 HB2 ARG A 49 -14.321 -0.332 -7.015 1.00 73.54 H new ATOM 0 HB3 ARG A 49 -14.338 -1.272 -5.535 1.00 73.54 H new ATOM 0 HG2 ARG A 49 -12.547 -2.731 -6.412 1.00 22.12 H new ATOM 0 HG3 ARG A 49 -12.557 -1.860 -7.933 1.00 22.12 H new ATOM 0 HD2 ARG A 49 -11.709 -0.836 -5.202 1.00 33.44 H new ATOM 0 HD3 ARG A 49 -10.733 -0.970 -6.652 1.00 33.44 H new ATOM 0 HE ARG A 49 -13.061 0.909 -6.564 1.00 62.03 H new ATOM 0 HH11 ARG A 49 -9.649 0.310 -7.086 1.00 13.43 H new ATOM 0 HH12 ARG A 49 -9.347 1.976 -7.590 1.00 13.43 H new ATOM 0 HH21 ARG A 49 -12.649 2.967 -7.172 1.00 1.31 H new ATOM 0 HH22 ARG A 49 -11.016 3.453 -7.638 1.00 1.31 H new ATOM 824 N GLY A 50 -14.613 -4.103 -8.728 1.00 41.44 N ATOM 825 CA GLY A 50 -14.253 -4.699 -10.014 1.00 2.51 C ATOM 826 C GLY A 50 -12.809 -5.197 -10.096 1.00 12.23 C ATOM 827 O GLY A 50 -12.189 -5.134 -11.159 1.00 74.14 O ATOM 0 H GLY A 50 -14.730 -4.772 -7.967 1.00 41.44 H new ATOM 0 HA2 GLY A 50 -14.925 -5.534 -10.215 1.00 2.51 H new ATOM 0 HA3 GLY A 50 -14.416 -3.962 -10.801 1.00 2.51 H new ATOM 831 N THR A 51 -12.264 -5.686 -8.981 1.00 2.01 N ATOM 832 CA THR A 51 -10.904 -6.254 -8.966 1.00 13.40 C ATOM 833 C THR A 51 -10.651 -7.121 -7.722 1.00 23.12 C ATOM 834 O THR A 51 -10.094 -6.654 -6.727 1.00 23.10 O ATOM 835 CB THR A 51 -9.800 -5.164 -9.067 1.00 43.10 C ATOM 836 OG1 THR A 51 -8.504 -5.745 -8.833 1.00 65.44 O ATOM 837 CG2 THR A 51 -10.040 -4.029 -8.076 1.00 2.25 C ATOM 0 H THR A 51 -12.737 -5.703 -8.077 1.00 2.01 H new ATOM 0 HA THR A 51 -10.846 -6.885 -9.853 1.00 13.40 H new ATOM 0 HB THR A 51 -9.838 -4.750 -10.074 1.00 43.10 H new ATOM 0 HG1 THR A 51 -7.817 -5.050 -8.901 1.00 65.44 H new ATOM 0 HG21 THR A 51 -9.249 -3.286 -8.175 1.00 2.25 H new ATOM 0 HG22 THR A 51 -11.003 -3.563 -8.283 1.00 2.25 H new ATOM 0 HG23 THR A 51 -10.039 -4.426 -7.061 1.00 2.25 H new ATOM 845 N PRO A 52 -11.072 -8.400 -7.753 1.00 2.00 N ATOM 846 CA PRO A 52 -10.839 -9.337 -6.641 1.00 62.20 C ATOM 847 C PRO A 52 -9.365 -9.760 -6.526 1.00 75.13 C ATOM 848 O PRO A 52 -8.610 -9.698 -7.501 1.00 34.03 O ATOM 849 CB PRO A 52 -11.727 -10.551 -6.990 1.00 52.42 C ATOM 850 CG PRO A 52 -12.579 -10.115 -8.142 1.00 23.31 C ATOM 851 CD PRO A 52 -11.807 -9.040 -8.852 1.00 40.51 C ATOM 0 HA PRO A 52 -11.078 -8.885 -5.678 1.00 62.20 H new ATOM 0 HB2 PRO A 52 -11.120 -11.416 -7.258 1.00 52.42 H new ATOM 0 HB3 PRO A 52 -12.341 -10.844 -6.138 1.00 52.42 H new ATOM 0 HG2 PRO A 52 -12.787 -10.951 -8.810 1.00 23.31 H new ATOM 0 HG3 PRO A 52 -13.541 -9.738 -7.794 1.00 23.31 H new ATOM 0 HD2 PRO A 52 -11.135 -9.452 -9.604 1.00 40.51 H new ATOM 0 HD3 PRO A 52 -12.465 -8.338 -9.363 1.00 40.51 H new ATOM 859 N VAL A 53 -8.959 -10.199 -5.337 1.00 62.24 N ATOM 860 CA VAL A 53 -7.570 -10.600 -5.091 1.00 31.11 C ATOM 861 C VAL A 53 -7.291 -12.018 -5.609 1.00 25.21 C ATOM 862 O VAL A 53 -7.788 -13.002 -5.056 1.00 1.31 O ATOM 863 CB VAL A 53 -7.219 -10.537 -3.581 1.00 2.04 C ATOM 864 CG1 VAL A 53 -5.753 -10.904 -3.343 1.00 70.12 C ATOM 865 CG2 VAL A 53 -7.535 -9.154 -3.015 1.00 4.04 C ATOM 0 H VAL A 53 -9.571 -10.287 -4.526 1.00 62.24 H new ATOM 0 HA VAL A 53 -6.944 -9.892 -5.634 1.00 31.11 H new ATOM 0 HB VAL A 53 -7.834 -11.269 -3.057 1.00 2.04 H new ATOM 0 HG11 VAL A 53 -5.533 -10.852 -2.277 1.00 70.12 H new ATOM 0 HG12 VAL A 53 -5.568 -11.916 -3.703 1.00 70.12 H new ATOM 0 HG13 VAL A 53 -5.111 -10.206 -3.880 1.00 70.12 H new ATOM 0 HG21 VAL A 53 -7.283 -9.128 -1.955 1.00 4.04 H new ATOM 0 HG22 VAL A 53 -6.951 -8.402 -3.545 1.00 4.04 H new ATOM 0 HG23 VAL A 53 -8.597 -8.944 -3.140 1.00 4.04 H new ATOM 875 N ASN A 54 -6.506 -12.111 -6.680 1.00 33.13 N ATOM 876 CA ASN A 54 -6.091 -13.407 -7.226 1.00 43.45 C ATOM 877 C ASN A 54 -5.130 -14.119 -6.258 1.00 31.52 C ATOM 878 O ASN A 54 -5.476 -15.132 -5.650 1.00 41.22 O ATOM 879 CB ASN A 54 -5.429 -13.204 -8.600 1.00 70.33 C ATOM 880 CG ASN A 54 -4.943 -14.497 -9.230 1.00 62.44 C ATOM 881 OD1 ASN A 54 -5.475 -15.568 -8.979 1.00 71.44 O ATOM 882 ND2 ASN A 54 -3.928 -14.403 -10.066 1.00 44.20 N ATOM 0 H ASN A 54 -6.143 -11.305 -7.189 1.00 33.13 H new ATOM 0 HA ASN A 54 -6.971 -14.038 -7.350 1.00 43.45 H new ATOM 0 HB2 ASN A 54 -6.142 -12.726 -9.272 1.00 70.33 H new ATOM 0 HB3 ASN A 54 -4.586 -12.521 -8.492 1.00 70.33 H new ATOM 0 HD21 ASN A 54 -3.565 -15.239 -10.524 1.00 44.20 H new ATOM 0 HD22 ASN A 54 -3.505 -13.494 -10.255 1.00 44.20 H new ATOM 889 N ARG A 55 -3.927 -13.570 -6.115 1.00 52.24 N ATOM 890 CA ARG A 55 -2.925 -14.091 -5.174 1.00 71.43 C ATOM 891 C ARG A 55 -2.136 -12.943 -4.524 1.00 12.41 C ATOM 892 O ARG A 55 -2.222 -11.791 -4.956 1.00 12.10 O ATOM 893 CB ARG A 55 -1.977 -15.077 -5.878 1.00 54.32 C ATOM 894 CG ARG A 55 -2.629 -16.419 -6.209 1.00 23.14 C ATOM 895 CD ARG A 55 -1.683 -17.352 -6.953 1.00 72.03 C ATOM 896 NE ARG A 55 -2.275 -18.674 -7.171 1.00 4.43 N ATOM 897 CZ ARG A 55 -2.956 -19.010 -8.232 1.00 5.24 C ATOM 898 NH1 ARG A 55 -3.199 -18.140 -9.161 1.00 61.33 N ATOM 899 NH2 ARG A 55 -3.407 -20.215 -8.355 1.00 73.33 N ATOM 0 H ARG A 55 -3.615 -12.755 -6.643 1.00 52.24 H new ATOM 0 HA ARG A 55 -3.449 -14.630 -4.384 1.00 71.43 H new ATOM 0 HB2 ARG A 55 -1.612 -14.623 -6.799 1.00 54.32 H new ATOM 0 HB3 ARG A 55 -1.109 -15.251 -5.242 1.00 54.32 H new ATOM 0 HG2 ARG A 55 -2.958 -16.898 -5.287 1.00 23.14 H new ATOM 0 HG3 ARG A 55 -3.519 -16.249 -6.815 1.00 23.14 H new ATOM 0 HD2 ARG A 55 -1.419 -16.910 -7.914 1.00 72.03 H new ATOM 0 HD3 ARG A 55 -0.758 -17.458 -6.386 1.00 72.03 H new ATOM 0 HE ARG A 55 -2.146 -19.379 -6.445 1.00 4.43 H new ATOM 0 HH11 ARG A 55 -2.857 -17.184 -9.066 1.00 61.33 H new ATOM 0 HH12 ARG A 55 -3.732 -18.411 -9.987 1.00 61.33 H new ATOM 0 HH21 ARG A 55 -3.231 -20.903 -7.623 1.00 73.33 H new ATOM 0 HH22 ARG A 55 -3.939 -20.478 -9.184 1.00 73.33 H new ATOM 913 N ILE A 56 -1.375 -13.263 -3.484 1.00 42.31 N ATOM 914 CA ILE A 56 -0.665 -12.246 -2.696 1.00 34.30 C ATOM 915 C ILE A 56 0.763 -11.993 -3.224 1.00 11.12 C ATOM 916 O ILE A 56 1.493 -12.935 -3.537 1.00 32.33 O ATOM 917 CB ILE A 56 -0.602 -12.663 -1.205 1.00 4.03 C ATOM 918 CG1 ILE A 56 -2.023 -12.895 -0.664 1.00 72.31 C ATOM 919 CG2 ILE A 56 0.130 -11.608 -0.371 1.00 4.33 C ATOM 920 CD1 ILE A 56 -2.066 -13.345 0.779 1.00 11.04 C ATOM 0 H ILE A 56 -1.230 -14.220 -3.161 1.00 42.31 H new ATOM 0 HA ILE A 56 -1.227 -11.317 -2.794 1.00 34.30 H new ATOM 0 HB ILE A 56 -0.041 -13.594 -1.129 1.00 4.03 H new ATOM 0 HG12 ILE A 56 -2.594 -11.972 -0.763 1.00 72.31 H new ATOM 0 HG13 ILE A 56 -2.518 -13.644 -1.282 1.00 72.31 H new ATOM 0 HG21 ILE A 56 0.160 -11.925 0.671 1.00 4.33 H new ATOM 0 HG22 ILE A 56 1.147 -11.491 -0.744 1.00 4.33 H new ATOM 0 HG23 ILE A 56 -0.396 -10.656 -0.446 1.00 4.33 H new ATOM 0 HD11 ILE A 56 -3.102 -13.487 1.085 1.00 11.04 H new ATOM 0 HD12 ILE A 56 -1.525 -14.286 0.883 1.00 11.04 H new ATOM 0 HD13 ILE A 56 -1.602 -12.588 1.410 1.00 11.04 H new ATOM 932 N PRO A 57 1.168 -10.707 -3.342 1.00 70.50 N ATOM 933 CA PRO A 57 2.530 -10.332 -3.768 1.00 41.24 C ATOM 934 C PRO A 57 3.640 -10.956 -2.899 1.00 62.15 C ATOM 935 O PRO A 57 3.511 -11.053 -1.676 1.00 35.30 O ATOM 936 CB PRO A 57 2.543 -8.802 -3.621 1.00 40.15 C ATOM 937 CG PRO A 57 1.110 -8.396 -3.704 1.00 21.33 C ATOM 938 CD PRO A 57 0.325 -9.521 -3.089 1.00 0.33 C ATOM 0 HA PRO A 57 2.737 -10.690 -4.777 1.00 41.24 H new ATOM 0 HB2 PRO A 57 2.985 -8.500 -2.671 1.00 40.15 H new ATOM 0 HB3 PRO A 57 3.132 -8.334 -4.410 1.00 40.15 H new ATOM 0 HG2 PRO A 57 0.937 -7.462 -3.169 1.00 21.33 H new ATOM 0 HG3 PRO A 57 0.810 -8.231 -4.739 1.00 21.33 H new ATOM 0 HD2 PRO A 57 0.164 -9.363 -2.023 1.00 0.33 H new ATOM 0 HD3 PRO A 57 -0.659 -9.622 -3.548 1.00 0.33 H new ATOM 946 N ILE A 58 4.736 -11.362 -3.543 1.00 74.31 N ATOM 947 CA ILE A 58 5.876 -11.968 -2.843 1.00 54.44 C ATOM 948 C ILE A 58 7.117 -11.057 -2.902 1.00 34.22 C ATOM 949 O ILE A 58 7.496 -10.573 -3.971 1.00 21.14 O ATOM 950 CB ILE A 58 6.226 -13.356 -3.448 1.00 11.23 C ATOM 951 CG1 ILE A 58 5.023 -14.313 -3.338 1.00 0.04 C ATOM 952 CG2 ILE A 58 7.458 -13.959 -2.767 1.00 31.23 C ATOM 953 CD1 ILE A 58 4.585 -14.604 -1.916 1.00 55.05 C ATOM 0 H ILE A 58 4.861 -11.283 -4.552 1.00 74.31 H new ATOM 0 HA ILE A 58 5.583 -12.096 -1.801 1.00 54.44 H new ATOM 0 HB ILE A 58 6.461 -13.214 -4.503 1.00 11.23 H new ATOM 0 HG12 ILE A 58 4.182 -13.885 -3.884 1.00 0.04 H new ATOM 0 HG13 ILE A 58 5.276 -15.253 -3.827 1.00 0.04 H new ATOM 0 HG21 ILE A 58 7.680 -14.930 -3.210 1.00 31.23 H new ATOM 0 HG22 ILE A 58 8.311 -13.294 -2.903 1.00 31.23 H new ATOM 0 HG23 ILE A 58 7.261 -14.083 -1.702 1.00 31.23 H new ATOM 0 HD11 ILE A 58 3.734 -15.285 -1.930 1.00 55.05 H new ATOM 0 HD12 ILE A 58 5.408 -15.063 -1.368 1.00 55.05 H new ATOM 0 HD13 ILE A 58 4.298 -13.674 -1.426 1.00 55.05 H new ATOM 965 N MET A 59 7.742 -10.835 -1.747 1.00 73.24 N ATOM 966 CA MET A 59 8.948 -10.001 -1.647 1.00 43.45 C ATOM 967 C MET A 59 10.008 -10.673 -0.761 1.00 11.53 C ATOM 968 O MET A 59 9.681 -11.239 0.277 1.00 1.34 O ATOM 969 CB MET A 59 8.590 -8.625 -1.063 1.00 72.11 C ATOM 970 CG MET A 59 9.801 -7.737 -0.791 1.00 11.04 C ATOM 971 SD MET A 59 10.688 -7.278 -2.293 1.00 62.40 S ATOM 972 CE MET A 59 9.544 -6.107 -3.022 1.00 62.15 C ATOM 0 H MET A 59 7.432 -11.224 -0.856 1.00 73.24 H new ATOM 0 HA MET A 59 9.358 -9.877 -2.649 1.00 43.45 H new ATOM 0 HB2 MET A 59 7.922 -8.110 -1.753 1.00 72.11 H new ATOM 0 HB3 MET A 59 8.039 -8.767 -0.133 1.00 72.11 H new ATOM 0 HG2 MET A 59 9.474 -6.833 -0.278 1.00 11.04 H new ATOM 0 HG3 MET A 59 10.482 -8.257 -0.118 1.00 11.04 H new ATOM 0 HE1 MET A 59 10.036 -5.577 -3.838 1.00 62.15 H new ATOM 0 HE2 MET A 59 8.675 -6.640 -3.407 1.00 62.15 H new ATOM 0 HE3 MET A 59 9.225 -5.391 -2.265 1.00 62.15 H new ATOM 982 N ALA A 60 11.274 -10.610 -1.180 1.00 72.23 N ATOM 983 CA ALA A 60 12.390 -11.166 -0.394 1.00 21.11 C ATOM 984 C ALA A 60 12.198 -12.667 -0.096 1.00 41.33 C ATOM 985 O ALA A 60 12.608 -13.158 0.957 1.00 14.12 O ATOM 986 CB ALA A 60 12.564 -10.369 0.900 1.00 3.45 C ATOM 0 H ALA A 60 11.557 -10.180 -2.060 1.00 72.23 H new ATOM 0 HA ALA A 60 13.297 -11.077 -0.992 1.00 21.11 H new ATOM 0 HB1 ALA A 60 13.391 -10.786 1.476 1.00 3.45 H new ATOM 0 HB2 ALA A 60 12.778 -9.327 0.660 1.00 3.45 H new ATOM 0 HB3 ALA A 60 11.648 -10.425 1.488 1.00 3.45 H new ATOM 992 N LYS A 61 11.586 -13.381 -1.048 1.00 41.12 N ATOM 993 CA LYS A 61 11.312 -14.828 -0.929 1.00 10.44 C ATOM 994 C LYS A 61 10.211 -15.138 0.111 1.00 25.20 C ATOM 995 O LYS A 61 9.957 -16.303 0.422 1.00 4.21 O ATOM 996 CB LYS A 61 12.591 -15.618 -0.582 1.00 0.13 C ATOM 997 CG LYS A 61 13.730 -15.459 -1.590 1.00 54.43 C ATOM 998 CD LYS A 61 13.318 -15.876 -3.001 1.00 2.53 C ATOM 999 CE LYS A 61 14.511 -15.903 -3.953 1.00 33.21 C ATOM 1000 NZ LYS A 61 15.267 -14.620 -3.950 1.00 3.15 N ATOM 0 H LYS A 61 11.264 -12.976 -1.927 1.00 41.12 H new ATOM 0 HA LYS A 61 10.950 -15.147 -1.907 1.00 10.44 H new ATOM 0 HB2 LYS A 61 12.944 -15.300 0.399 1.00 0.13 H new ATOM 0 HB3 LYS A 61 12.339 -16.675 -0.502 1.00 0.13 H new ATOM 0 HG2 LYS A 61 14.059 -14.420 -1.602 1.00 54.43 H new ATOM 0 HG3 LYS A 61 14.582 -16.059 -1.270 1.00 54.43 H new ATOM 0 HD2 LYS A 61 12.856 -16.863 -2.969 1.00 2.53 H new ATOM 0 HD3 LYS A 61 12.566 -15.184 -3.380 1.00 2.53 H new ATOM 0 HE2 LYS A 61 15.179 -16.716 -3.671 1.00 33.21 H new ATOM 0 HE3 LYS A 61 14.161 -16.114 -4.964 1.00 33.21 H new ATOM 0 HZ1 LYS A 61 15.970 -14.630 -4.716 1.00 3.15 H new ATOM 0 HZ2 LYS A 61 14.608 -13.828 -4.095 1.00 3.15 H new ATOM 0 HZ3 LYS A 61 15.751 -14.505 -3.037 1.00 3.15 H new ATOM 1014 N GLN A 62 9.550 -14.104 0.632 1.00 21.12 N ATOM 1015 CA GLN A 62 8.465 -14.287 1.612 1.00 53.41 C ATOM 1016 C GLN A 62 7.189 -13.539 1.190 1.00 72.22 C ATOM 1017 O GLN A 62 7.199 -12.746 0.247 1.00 3.02 O ATOM 1018 CB GLN A 62 8.907 -13.805 3.005 1.00 0.34 C ATOM 1019 CG GLN A 62 9.283 -12.327 3.057 1.00 21.33 C ATOM 1020 CD GLN A 62 9.454 -11.804 4.473 1.00 40.20 C ATOM 1021 OE1 GLN A 62 10.541 -11.850 5.045 1.00 52.41 O ATOM 1022 NE2 GLN A 62 8.380 -11.301 5.049 1.00 23.45 N ATOM 0 H GLN A 62 9.742 -13.130 0.396 1.00 21.12 H new ATOM 0 HA GLN A 62 8.241 -15.353 1.652 1.00 53.41 H new ATOM 0 HB2 GLN A 62 8.101 -13.990 3.715 1.00 0.34 H new ATOM 0 HB3 GLN A 62 9.761 -14.399 3.330 1.00 0.34 H new ATOM 0 HG2 GLN A 62 10.211 -12.175 2.506 1.00 21.33 H new ATOM 0 HG3 GLN A 62 8.513 -11.744 2.552 1.00 21.33 H new ATOM 0 HE21 GLN A 62 7.494 -11.279 4.544 1.00 23.45 H new ATOM 0 HE22 GLN A 62 8.435 -10.934 5.999 1.00 23.45 H new ATOM 1031 N VAL A 63 6.092 -13.795 1.901 1.00 33.21 N ATOM 1032 CA VAL A 63 4.824 -13.109 1.639 1.00 4.53 C ATOM 1033 C VAL A 63 4.894 -11.624 2.046 1.00 22.05 C ATOM 1034 O VAL A 63 5.539 -11.268 3.035 1.00 71.25 O ATOM 1035 CB VAL A 63 3.652 -13.802 2.387 1.00 30.33 C ATOM 1036 CG1 VAL A 63 3.861 -13.761 3.900 1.00 60.41 C ATOM 1037 CG2 VAL A 63 2.312 -13.175 2.004 1.00 22.42 C ATOM 0 H VAL A 63 6.054 -14.472 2.663 1.00 33.21 H new ATOM 0 HA VAL A 63 4.642 -13.166 0.566 1.00 4.53 H new ATOM 0 HB VAL A 63 3.635 -14.848 2.081 1.00 30.33 H new ATOM 0 HG11 VAL A 63 3.025 -14.254 4.396 1.00 60.41 H new ATOM 0 HG12 VAL A 63 4.788 -14.276 4.153 1.00 60.41 H new ATOM 0 HG13 VAL A 63 3.920 -12.724 4.231 1.00 60.41 H new ATOM 0 HG21 VAL A 63 1.508 -13.678 2.541 1.00 22.42 H new ATOM 0 HG22 VAL A 63 2.317 -12.117 2.266 1.00 22.42 H new ATOM 0 HG23 VAL A 63 2.154 -13.282 0.931 1.00 22.42 H new ATOM 1047 N LEU A 64 4.244 -10.762 1.264 1.00 42.11 N ATOM 1048 CA LEU A 64 4.209 -9.324 1.556 1.00 50.20 C ATOM 1049 C LEU A 64 3.060 -8.975 2.522 1.00 2.13 C ATOM 1050 O LEU A 64 1.883 -9.148 2.192 1.00 72.13 O ATOM 1051 CB LEU A 64 4.063 -8.532 0.246 1.00 62.44 C ATOM 1052 CG LEU A 64 4.073 -7.000 0.391 1.00 62.43 C ATOM 1053 CD1 LEU A 64 5.393 -6.518 0.987 1.00 41.11 C ATOM 1054 CD2 LEU A 64 3.816 -6.330 -0.960 1.00 71.42 C ATOM 0 H LEU A 64 3.734 -11.032 0.423 1.00 42.11 H new ATOM 0 HA LEU A 64 5.145 -9.051 2.042 1.00 50.20 H new ATOM 0 HB2 LEU A 64 4.872 -8.821 -0.424 1.00 62.44 H new ATOM 0 HB3 LEU A 64 3.130 -8.828 -0.234 1.00 62.44 H new ATOM 0 HG LEU A 64 3.271 -6.719 1.073 1.00 62.43 H new ATOM 0 HD11 LEU A 64 5.375 -5.432 1.079 1.00 41.11 H new ATOM 0 HD12 LEU A 64 5.532 -6.964 1.972 1.00 41.11 H new ATOM 0 HD13 LEU A 64 6.216 -6.813 0.336 1.00 41.11 H new ATOM 0 HD21 LEU A 64 3.827 -5.247 -0.837 1.00 71.42 H new ATOM 0 HD22 LEU A 64 4.594 -6.623 -1.665 1.00 71.42 H new ATOM 0 HD23 LEU A 64 2.844 -6.642 -1.342 1.00 71.42 H new ATOM 1066 N ASP A 65 3.409 -8.501 3.718 1.00 64.30 N ATOM 1067 CA ASP A 65 2.416 -8.078 4.713 1.00 12.41 C ATOM 1068 C ASP A 65 1.551 -6.913 4.195 1.00 24.43 C ATOM 1069 O ASP A 65 1.838 -5.749 4.468 1.00 45.43 O ATOM 1070 CB ASP A 65 3.118 -7.658 6.012 1.00 53.24 C ATOM 1071 CG ASP A 65 4.015 -8.746 6.576 1.00 13.44 C ATOM 1072 OD1 ASP A 65 5.091 -8.989 5.997 1.00 52.05 O ATOM 1073 OD2 ASP A 65 3.656 -9.347 7.611 1.00 74.21 O ATOM 0 H ASP A 65 4.376 -8.399 4.025 1.00 64.30 H new ATOM 0 HA ASP A 65 1.761 -8.927 4.905 1.00 12.41 H new ATOM 0 HB2 ASP A 65 3.713 -6.764 5.825 1.00 53.24 H new ATOM 0 HB3 ASP A 65 2.367 -7.391 6.755 1.00 53.24 H new ATOM 1078 N LEU A 66 0.500 -7.230 3.435 1.00 1.42 N ATOM 1079 CA LEU A 66 -0.403 -6.203 2.890 1.00 12.45 C ATOM 1080 C LEU A 66 -1.055 -5.357 4.002 1.00 11.43 C ATOM 1081 O LEU A 66 -1.191 -4.139 3.867 1.00 3.05 O ATOM 1082 CB LEU A 66 -1.486 -6.850 2.014 1.00 21.11 C ATOM 1083 CG LEU A 66 -0.971 -7.580 0.759 1.00 35.53 C ATOM 1084 CD1 LEU A 66 -2.133 -8.185 -0.026 1.00 45.13 C ATOM 1085 CD2 LEU A 66 -0.150 -6.636 -0.121 1.00 10.15 C ATOM 0 H LEU A 66 0.250 -8.186 3.181 1.00 1.42 H new ATOM 0 HA LEU A 66 0.201 -5.533 2.278 1.00 12.45 H new ATOM 0 HB2 LEU A 66 -2.046 -7.560 2.623 1.00 21.11 H new ATOM 0 HB3 LEU A 66 -2.187 -6.076 1.702 1.00 21.11 H new ATOM 0 HG LEU A 66 -0.319 -8.392 1.080 1.00 35.53 H new ATOM 0 HD11 LEU A 66 -1.749 -8.696 -0.909 1.00 45.13 H new ATOM 0 HD12 LEU A 66 -2.665 -8.898 0.603 1.00 45.13 H new ATOM 0 HD13 LEU A 66 -2.816 -7.393 -0.334 1.00 45.13 H new ATOM 0 HD21 LEU A 66 0.203 -7.174 -1.001 1.00 10.15 H new ATOM 0 HD22 LEU A 66 -0.772 -5.797 -0.434 1.00 10.15 H new ATOM 0 HD23 LEU A 66 0.705 -6.264 0.444 1.00 10.15 H new ATOM 1097 N PHE A 67 -1.446 -6.007 5.098 1.00 4.22 N ATOM 1098 CA PHE A 67 -2.034 -5.307 6.250 1.00 64.42 C ATOM 1099 C PHE A 67 -1.091 -4.208 6.774 1.00 10.33 C ATOM 1100 O PHE A 67 -1.484 -3.049 6.933 1.00 35.21 O ATOM 1101 CB PHE A 67 -2.342 -6.320 7.368 1.00 65.04 C ATOM 1102 CG PHE A 67 -2.891 -5.699 8.637 1.00 72.54 C ATOM 1103 CD1 PHE A 67 -4.258 -5.513 8.804 1.00 22.11 C ATOM 1104 CD2 PHE A 67 -2.039 -5.301 9.660 1.00 54.41 C ATOM 1105 CE1 PHE A 67 -4.759 -4.944 9.962 1.00 21.04 C ATOM 1106 CE2 PHE A 67 -2.538 -4.733 10.817 1.00 34.21 C ATOM 1107 CZ PHE A 67 -3.898 -4.553 10.967 1.00 13.23 C ATOM 0 H PHE A 67 -1.368 -7.017 5.217 1.00 4.22 H new ATOM 0 HA PHE A 67 -2.959 -4.828 5.928 1.00 64.42 H new ATOM 0 HB2 PHE A 67 -3.060 -7.049 6.994 1.00 65.04 H new ATOM 0 HB3 PHE A 67 -1.430 -6.866 7.609 1.00 65.04 H new ATOM 0 HD1 PHE A 67 -4.937 -5.816 8.021 1.00 22.11 H new ATOM 0 HD2 PHE A 67 -0.973 -5.437 9.550 1.00 54.41 H new ATOM 0 HE1 PHE A 67 -5.824 -4.806 10.079 1.00 21.04 H new ATOM 0 HE2 PHE A 67 -1.863 -4.430 11.604 1.00 34.21 H new ATOM 0 HZ PHE A 67 -4.288 -4.107 11.870 1.00 13.23 H new ATOM 1117 N MET A 68 0.164 -4.579 7.015 1.00 54.23 N ATOM 1118 CA MET A 68 1.160 -3.634 7.527 1.00 74.44 C ATOM 1119 C MET A 68 1.584 -2.639 6.443 1.00 34.25 C ATOM 1120 O MET A 68 1.848 -1.479 6.730 1.00 21.25 O ATOM 1121 CB MET A 68 2.382 -4.387 8.061 1.00 74.11 C ATOM 1122 CG MET A 68 2.041 -5.388 9.150 1.00 72.25 C ATOM 1123 SD MET A 68 1.260 -4.619 10.584 1.00 64.10 S ATOM 1124 CE MET A 68 2.606 -3.611 11.207 1.00 52.43 C ATOM 0 H MET A 68 0.517 -5.524 6.865 1.00 54.23 H new ATOM 0 HA MET A 68 0.705 -3.073 8.343 1.00 74.44 H new ATOM 0 HB2 MET A 68 2.868 -4.909 7.236 1.00 74.11 H new ATOM 0 HB3 MET A 68 3.102 -3.667 8.451 1.00 74.11 H new ATOM 0 HG2 MET A 68 1.375 -6.149 8.743 1.00 72.25 H new ATOM 0 HG3 MET A 68 2.951 -5.898 9.467 1.00 72.25 H new ATOM 0 HE1 MET A 68 2.597 -3.625 12.297 1.00 52.43 H new ATOM 0 HE2 MET A 68 3.555 -4.009 10.847 1.00 52.43 H new ATOM 0 HE3 MET A 68 2.486 -2.586 10.856 1.00 52.43 H new ATOM 1134 N LEU A 69 1.640 -3.102 5.196 1.00 11.34 N ATOM 1135 CA LEU A 69 1.981 -2.232 4.066 1.00 60.40 C ATOM 1136 C LEU A 69 1.033 -1.026 4.012 1.00 41.52 C ATOM 1137 O LEU A 69 1.463 0.109 3.812 1.00 70.41 O ATOM 1138 CB LEU A 69 1.922 -3.017 2.746 1.00 52.32 C ATOM 1139 CG LEU A 69 2.435 -2.263 1.509 1.00 55.41 C ATOM 1140 CD1 LEU A 69 3.901 -1.885 1.687 1.00 51.53 C ATOM 1141 CD2 LEU A 69 2.239 -3.104 0.247 1.00 62.01 C ATOM 0 H LEU A 69 1.455 -4.072 4.940 1.00 11.34 H new ATOM 0 HA LEU A 69 2.998 -1.867 4.207 1.00 60.40 H new ATOM 0 HB2 LEU A 69 2.504 -3.932 2.860 1.00 52.32 H new ATOM 0 HB3 LEU A 69 0.889 -3.316 2.566 1.00 52.32 H new ATOM 0 HG LEU A 69 1.857 -1.346 1.397 1.00 55.41 H new ATOM 0 HD11 LEU A 69 4.249 -1.352 0.802 1.00 51.53 H new ATOM 0 HD12 LEU A 69 4.008 -1.244 2.562 1.00 51.53 H new ATOM 0 HD13 LEU A 69 4.496 -2.788 1.824 1.00 51.53 H new ATOM 0 HD21 LEU A 69 2.608 -2.553 -0.618 1.00 62.01 H new ATOM 0 HD22 LEU A 69 2.790 -4.039 0.344 1.00 62.01 H new ATOM 0 HD23 LEU A 69 1.179 -3.320 0.114 1.00 62.01 H new ATOM 1153 N TYR A 70 -0.259 -1.281 4.215 1.00 4.31 N ATOM 1154 CA TYR A 70 -1.250 -0.209 4.303 1.00 71.12 C ATOM 1155 C TYR A 70 -0.932 0.741 5.469 1.00 33.32 C ATOM 1156 O TYR A 70 -0.803 1.951 5.279 1.00 53.13 O ATOM 1157 CB TYR A 70 -2.663 -0.790 4.471 1.00 33.14 C ATOM 1158 CG TYR A 70 -3.744 0.270 4.594 1.00 21.32 C ATOM 1159 CD1 TYR A 70 -4.334 0.829 3.463 1.00 64.42 C ATOM 1160 CD2 TYR A 70 -4.164 0.720 5.842 1.00 44.11 C ATOM 1161 CE1 TYR A 70 -5.308 1.803 3.577 1.00 22.21 C ATOM 1162 CE2 TYR A 70 -5.138 1.690 5.961 1.00 50.13 C ATOM 1163 CZ TYR A 70 -5.708 2.229 4.827 1.00 3.31 C ATOM 1164 OH TYR A 70 -6.673 3.206 4.947 1.00 42.22 O ATOM 0 H TYR A 70 -0.644 -2.220 4.322 1.00 4.31 H new ATOM 0 HA TYR A 70 -1.210 0.359 3.373 1.00 71.12 H new ATOM 0 HB2 TYR A 70 -2.888 -1.430 3.617 1.00 33.14 H new ATOM 0 HB3 TYR A 70 -2.684 -1.423 5.358 1.00 33.14 H new ATOM 0 HD1 TYR A 70 -4.026 0.497 2.483 1.00 64.42 H new ATOM 0 HD2 TYR A 70 -3.720 0.303 6.733 1.00 44.11 H new ATOM 0 HE1 TYR A 70 -5.754 2.229 2.691 1.00 22.21 H new ATOM 0 HE2 TYR A 70 -5.453 2.026 6.938 1.00 50.13 H new ATOM 0 HH TYR A 70 -7.561 2.791 4.945 1.00 42.22 H new ATOM 1174 N VAL A 71 -0.797 0.182 6.673 1.00 31.51 N ATOM 1175 CA VAL A 71 -0.556 0.983 7.883 1.00 52.53 C ATOM 1176 C VAL A 71 0.731 1.829 7.779 1.00 2.41 C ATOM 1177 O VAL A 71 0.689 3.054 7.905 1.00 23.12 O ATOM 1178 CB VAL A 71 -0.475 0.084 9.144 1.00 3.21 C ATOM 1179 CG1 VAL A 71 -0.251 0.923 10.404 1.00 52.24 C ATOM 1180 CG2 VAL A 71 -1.733 -0.775 9.281 1.00 75.23 C ATOM 0 H VAL A 71 -0.850 -0.823 6.840 1.00 31.51 H new ATOM 0 HA VAL A 71 -1.405 1.661 7.973 1.00 52.53 H new ATOM 0 HB VAL A 71 0.380 -0.581 9.027 1.00 3.21 H new ATOM 0 HG11 VAL A 71 -0.198 0.267 11.273 1.00 52.24 H new ATOM 0 HG12 VAL A 71 0.683 1.478 10.311 1.00 52.24 H new ATOM 0 HG13 VAL A 71 -1.078 1.623 10.527 1.00 52.24 H new ATOM 0 HG21 VAL A 71 -1.653 -1.397 10.172 1.00 75.23 H new ATOM 0 HG22 VAL A 71 -2.607 -0.129 9.366 1.00 75.23 H new ATOM 0 HG23 VAL A 71 -1.836 -1.412 8.402 1.00 75.23 H new ATOM 1190 N LEU A 72 1.861 1.171 7.528 1.00 75.15 N ATOM 1191 CA LEU A 72 3.166 1.844 7.446 1.00 73.13 C ATOM 1192 C LEU A 72 3.171 2.990 6.416 1.00 61.12 C ATOM 1193 O LEU A 72 3.748 4.046 6.661 1.00 14.14 O ATOM 1194 CB LEU A 72 4.277 0.827 7.111 1.00 14.32 C ATOM 1195 CG LEU A 72 4.835 0.016 8.301 1.00 70.12 C ATOM 1196 CD1 LEU A 72 5.531 0.934 9.300 1.00 44.42 C ATOM 1197 CD2 LEU A 72 3.740 -0.794 8.992 1.00 53.53 C ATOM 0 H LEU A 72 1.904 0.163 7.376 1.00 75.15 H new ATOM 0 HA LEU A 72 3.360 2.284 8.424 1.00 73.13 H new ATOM 0 HB2 LEU A 72 3.890 0.127 6.370 1.00 14.32 H new ATOM 0 HB3 LEU A 72 5.103 1.363 6.643 1.00 14.32 H new ATOM 0 HG LEU A 72 5.567 -0.687 7.904 1.00 70.12 H new ATOM 0 HD11 LEU A 72 5.917 0.342 10.130 1.00 44.42 H new ATOM 0 HD12 LEU A 72 6.356 1.449 8.807 1.00 44.42 H new ATOM 0 HD13 LEU A 72 4.819 1.668 9.677 1.00 44.42 H new ATOM 0 HD21 LEU A 72 4.170 -1.352 9.824 1.00 53.53 H new ATOM 0 HD22 LEU A 72 2.970 -0.120 9.367 1.00 53.53 H new ATOM 0 HD23 LEU A 72 3.297 -1.490 8.279 1.00 53.53 H new ATOM 1209 N VAL A 73 2.534 2.780 5.267 1.00 14.13 N ATOM 1210 CA VAL A 73 2.475 3.811 4.220 1.00 22.42 C ATOM 1211 C VAL A 73 1.498 4.948 4.584 1.00 51.22 C ATOM 1212 O VAL A 73 1.822 6.130 4.442 1.00 5.03 O ATOM 1213 CB VAL A 73 2.079 3.197 2.852 1.00 21.52 C ATOM 1214 CG1 VAL A 73 1.870 4.277 1.790 1.00 71.11 C ATOM 1215 CG2 VAL A 73 3.132 2.191 2.390 1.00 53.12 C ATOM 0 H VAL A 73 2.052 1.912 5.033 1.00 14.13 H new ATOM 0 HA VAL A 73 3.476 4.236 4.142 1.00 22.42 H new ATOM 0 HB VAL A 73 1.131 2.676 2.987 1.00 21.52 H new ATOM 0 HG11 VAL A 73 1.594 3.809 0.845 1.00 71.11 H new ATOM 0 HG12 VAL A 73 1.074 4.951 2.108 1.00 71.11 H new ATOM 0 HG13 VAL A 73 2.793 4.842 1.659 1.00 71.11 H new ATOM 0 HG21 VAL A 73 2.837 1.771 1.429 1.00 53.12 H new ATOM 0 HG22 VAL A 73 4.094 2.693 2.287 1.00 53.12 H new ATOM 0 HG23 VAL A 73 3.218 1.390 3.125 1.00 53.12 H new ATOM 1225 N THR A 74 0.307 4.593 5.064 1.00 43.23 N ATOM 1226 CA THR A 74 -0.714 5.600 5.405 1.00 71.03 C ATOM 1227 C THR A 74 -0.262 6.512 6.549 1.00 22.23 C ATOM 1228 O THR A 74 -0.448 7.729 6.481 1.00 4.02 O ATOM 1229 CB THR A 74 -2.075 4.967 5.780 1.00 34.44 C ATOM 1230 OG1 THR A 74 -1.910 4.025 6.850 1.00 13.43 O ATOM 1231 CG2 THR A 74 -2.710 4.277 4.578 1.00 64.40 C ATOM 0 H THR A 74 0.021 3.628 5.227 1.00 43.23 H new ATOM 0 HA THR A 74 -0.843 6.193 4.500 1.00 71.03 H new ATOM 0 HB THR A 74 -2.737 5.769 6.107 1.00 34.44 H new ATOM 0 HG1 THR A 74 -1.507 3.202 6.502 1.00 13.43 H new ATOM 0 HG21 THR A 74 -3.665 3.841 4.871 1.00 64.40 H new ATOM 0 HG22 THR A 74 -2.872 5.006 3.784 1.00 64.40 H new ATOM 0 HG23 THR A 74 -2.047 3.490 4.218 1.00 64.40 H new ATOM 1239 N GLU A 75 0.353 5.936 7.585 1.00 21.30 N ATOM 1240 CA GLU A 75 0.822 6.724 8.737 1.00 72.55 C ATOM 1241 C GLU A 75 1.785 7.848 8.312 1.00 41.12 C ATOM 1242 O GLU A 75 1.944 8.840 9.028 1.00 5.24 O ATOM 1243 CB GLU A 75 1.517 5.837 9.784 1.00 23.13 C ATOM 1244 CG GLU A 75 2.850 5.251 9.317 1.00 55.15 C ATOM 1245 CD GLU A 75 3.806 4.945 10.464 1.00 72.32 C ATOM 1246 OE1 GLU A 75 4.485 5.883 10.941 1.00 60.21 O ATOM 1247 OE2 GLU A 75 3.900 3.776 10.887 1.00 31.52 O ATOM 0 H GLU A 75 0.539 4.935 7.654 1.00 21.30 H new ATOM 0 HA GLU A 75 -0.068 7.172 9.180 1.00 72.55 H new ATOM 0 HB2 GLU A 75 1.686 6.423 10.687 1.00 23.13 H new ATOM 0 HB3 GLU A 75 0.848 5.020 10.055 1.00 23.13 H new ATOM 0 HG2 GLU A 75 2.661 4.336 8.756 1.00 55.15 H new ATOM 0 HG3 GLU A 75 3.327 5.951 8.632 1.00 55.15 H new ATOM 1254 N LYS A 76 2.434 7.691 7.154 1.00 61.44 N ATOM 1255 CA LYS A 76 3.384 8.702 6.667 1.00 1.23 C ATOM 1256 C LYS A 76 2.657 9.866 5.970 1.00 32.42 C ATOM 1257 O LYS A 76 3.129 11.001 5.989 1.00 22.31 O ATOM 1258 CB LYS A 76 4.390 8.063 5.691 1.00 43.24 C ATOM 1259 CG LYS A 76 5.062 6.795 6.216 1.00 34.41 C ATOM 1260 CD LYS A 76 5.759 7.018 7.555 1.00 71.41 C ATOM 1261 CE LYS A 76 6.397 5.734 8.077 1.00 43.25 C ATOM 1262 NZ LYS A 76 6.912 5.889 9.463 1.00 44.31 N ATOM 0 H LYS A 76 2.323 6.884 6.541 1.00 61.44 H new ATOM 0 HA LYS A 76 3.917 9.098 7.531 1.00 1.23 H new ATOM 0 HB2 LYS A 76 3.875 7.827 4.760 1.00 43.24 H new ATOM 0 HB3 LYS A 76 5.161 8.796 5.452 1.00 43.24 H new ATOM 0 HG2 LYS A 76 4.314 6.009 6.325 1.00 34.41 H new ATOM 0 HG3 LYS A 76 5.790 6.443 5.485 1.00 34.41 H new ATOM 0 HD2 LYS A 76 6.524 7.786 7.444 1.00 71.41 H new ATOM 0 HD3 LYS A 76 5.038 7.389 8.284 1.00 71.41 H new ATOM 0 HE2 LYS A 76 5.663 4.929 8.051 1.00 43.25 H new ATOM 0 HE3 LYS A 76 7.214 5.442 7.418 1.00 43.25 H new ATOM 0 HZ1 LYS A 76 7.511 5.073 9.704 1.00 44.31 H new ATOM 0 HZ2 LYS A 76 7.473 6.762 9.529 1.00 44.31 H new ATOM 0 HZ3 LYS A 76 6.113 5.940 10.127 1.00 44.31 H new ATOM 1276 N GLY A 77 1.474 9.593 5.418 1.00 51.20 N ATOM 1277 CA GLY A 77 0.722 10.625 4.704 1.00 42.50 C ATOM 1278 C GLY A 77 0.200 10.180 3.336 1.00 12.00 C ATOM 1279 O GLY A 77 -0.145 11.017 2.497 1.00 11.32 O ATOM 0 H GLY A 77 1.021 8.680 5.450 1.00 51.20 H new ATOM 0 HA2 GLY A 77 -0.122 10.937 5.320 1.00 42.50 H new ATOM 0 HA3 GLY A 77 1.360 11.499 4.571 1.00 42.50 H new ATOM 1283 N GLY A 78 0.146 8.868 3.098 1.00 42.22 N ATOM 1284 CA GLY A 78 -0.446 8.350 1.861 1.00 43.44 C ATOM 1285 C GLY A 78 0.569 7.764 0.881 1.00 31.21 C ATOM 1286 O GLY A 78 1.773 7.986 1.009 1.00 45.31 O ATOM 0 H GLY A 78 0.499 8.153 3.734 1.00 42.22 H new ATOM 0 HA2 GLY A 78 -1.176 7.581 2.114 1.00 43.44 H new ATOM 0 HA3 GLY A 78 -0.990 9.155 1.366 1.00 43.44 H new ATOM 1290 N LEU A 79 0.070 7.027 -0.113 1.00 43.51 N ATOM 1291 CA LEU A 79 0.926 6.363 -1.108 1.00 53.30 C ATOM 1292 C LEU A 79 1.888 7.344 -1.803 1.00 21.24 C ATOM 1293 O LEU A 79 3.102 7.134 -1.817 1.00 5.45 O ATOM 1294 CB LEU A 79 0.051 5.661 -2.162 1.00 24.44 C ATOM 1295 CG LEU A 79 0.808 5.018 -3.343 1.00 15.32 C ATOM 1296 CD1 LEU A 79 1.789 3.953 -2.857 1.00 40.51 C ATOM 1297 CD2 LEU A 79 -0.172 4.424 -4.356 1.00 1.13 C ATOM 0 H LEU A 79 -0.928 6.872 -0.254 1.00 43.51 H new ATOM 0 HA LEU A 79 1.534 5.631 -0.576 1.00 53.30 H new ATOM 0 HB2 LEU A 79 -0.533 4.887 -1.665 1.00 24.44 H new ATOM 0 HB3 LEU A 79 -0.657 6.387 -2.561 1.00 24.44 H new ATOM 0 HG LEU A 79 1.381 5.802 -3.837 1.00 15.32 H new ATOM 0 HD11 LEU A 79 2.307 3.518 -3.712 1.00 40.51 H new ATOM 0 HD12 LEU A 79 2.516 4.408 -2.185 1.00 40.51 H new ATOM 0 HD13 LEU A 79 1.245 3.172 -2.327 1.00 40.51 H new ATOM 0 HD21 LEU A 79 0.383 3.976 -5.180 1.00 1.13 H new ATOM 0 HD22 LEU A 79 -0.779 3.660 -3.870 1.00 1.13 H new ATOM 0 HD23 LEU A 79 -0.820 5.212 -4.741 1.00 1.13 H new ATOM 1309 N VAL A 80 1.339 8.416 -2.370 1.00 4.52 N ATOM 1310 CA VAL A 80 2.131 9.357 -3.170 1.00 54.13 C ATOM 1311 C VAL A 80 3.203 10.078 -2.335 1.00 52.45 C ATOM 1312 O VAL A 80 4.338 10.243 -2.788 1.00 54.34 O ATOM 1313 CB VAL A 80 1.227 10.394 -3.877 1.00 22.50 C ATOM 1314 CG1 VAL A 80 2.060 11.430 -4.628 1.00 53.53 C ATOM 1315 CG2 VAL A 80 0.264 9.686 -4.827 1.00 20.33 C ATOM 0 H VAL A 80 0.351 8.657 -2.293 1.00 4.52 H new ATOM 0 HA VAL A 80 2.643 8.761 -3.926 1.00 54.13 H new ATOM 0 HB VAL A 80 0.650 10.921 -3.117 1.00 22.50 H new ATOM 0 HG11 VAL A 80 1.398 12.146 -5.115 1.00 53.53 H new ATOM 0 HG12 VAL A 80 2.708 11.955 -3.926 1.00 53.53 H new ATOM 0 HG13 VAL A 80 2.670 10.930 -5.380 1.00 53.53 H new ATOM 0 HG21 VAL A 80 -0.369 10.424 -5.320 1.00 20.33 H new ATOM 0 HG22 VAL A 80 0.832 9.135 -5.577 1.00 20.33 H new ATOM 0 HG23 VAL A 80 -0.360 8.993 -4.263 1.00 20.33 H new ATOM 1325 N GLU A 81 2.851 10.490 -1.119 1.00 54.23 N ATOM 1326 CA GLU A 81 3.816 11.139 -0.221 1.00 60.44 C ATOM 1327 C GLU A 81 5.054 10.248 -0.027 1.00 34.50 C ATOM 1328 O GLU A 81 6.195 10.710 -0.132 1.00 2.05 O ATOM 1329 CB GLU A 81 3.160 11.454 1.138 1.00 13.41 C ATOM 1330 CG GLU A 81 3.975 12.406 2.028 1.00 31.53 C ATOM 1331 CD GLU A 81 4.669 11.732 3.208 1.00 14.13 C ATOM 1332 OE1 GLU A 81 5.098 10.570 3.080 1.00 50.20 O ATOM 1333 OE2 GLU A 81 4.810 12.392 4.264 1.00 1.20 O ATOM 0 H GLU A 81 1.913 10.389 -0.731 1.00 54.23 H new ATOM 0 HA GLU A 81 4.134 12.077 -0.676 1.00 60.44 H new ATOM 0 HB2 GLU A 81 2.178 11.892 0.961 1.00 13.41 H new ATOM 0 HB3 GLU A 81 3.000 10.520 1.676 1.00 13.41 H new ATOM 0 HG2 GLU A 81 4.728 12.901 1.415 1.00 31.53 H new ATOM 0 HG3 GLU A 81 3.313 13.183 2.408 1.00 31.53 H new ATOM 1340 N VAL A 82 4.815 8.961 0.224 1.00 55.22 N ATOM 1341 CA VAL A 82 5.896 7.985 0.385 1.00 34.21 C ATOM 1342 C VAL A 82 6.716 7.826 -0.913 1.00 13.21 C ATOM 1343 O VAL A 82 7.946 7.707 -0.877 1.00 1.33 O ATOM 1344 CB VAL A 82 5.338 6.609 0.841 1.00 44.41 C ATOM 1345 CG1 VAL A 82 6.462 5.594 1.036 1.00 74.13 C ATOM 1346 CG2 VAL A 82 4.525 6.763 2.127 1.00 75.45 C ATOM 0 H VAL A 82 3.879 8.568 0.321 1.00 55.22 H new ATOM 0 HA VAL A 82 6.562 8.365 1.159 1.00 34.21 H new ATOM 0 HB VAL A 82 4.682 6.234 0.055 1.00 44.41 H new ATOM 0 HG11 VAL A 82 6.040 4.641 1.355 1.00 74.13 H new ATOM 0 HG12 VAL A 82 6.996 5.458 0.096 1.00 74.13 H new ATOM 0 HG13 VAL A 82 7.153 5.958 1.797 1.00 74.13 H new ATOM 0 HG21 VAL A 82 4.141 5.790 2.433 1.00 75.45 H new ATOM 0 HG22 VAL A 82 5.162 7.166 2.914 1.00 75.45 H new ATOM 0 HG23 VAL A 82 3.692 7.443 1.951 1.00 75.45 H new ATOM 1356 N ILE A 83 6.031 7.844 -2.059 1.00 24.43 N ATOM 1357 CA ILE A 83 6.698 7.785 -3.369 1.00 11.35 C ATOM 1358 C ILE A 83 7.614 9.003 -3.585 1.00 54.43 C ATOM 1359 O ILE A 83 8.692 8.895 -4.182 1.00 44.53 O ATOM 1360 CB ILE A 83 5.662 7.724 -4.525 1.00 72.43 C ATOM 1361 CG1 ILE A 83 4.754 6.492 -4.379 1.00 41.41 C ATOM 1362 CG2 ILE A 83 6.362 7.714 -5.886 1.00 10.51 C ATOM 1363 CD1 ILE A 83 3.624 6.449 -5.387 1.00 62.10 C ATOM 0 H ILE A 83 5.014 7.899 -2.110 1.00 24.43 H new ATOM 0 HA ILE A 83 7.300 6.877 -3.376 1.00 11.35 H new ATOM 0 HB ILE A 83 5.041 8.618 -4.467 1.00 72.43 H new ATOM 0 HG12 ILE A 83 5.358 5.591 -4.484 1.00 41.41 H new ATOM 0 HG13 ILE A 83 4.334 6.478 -3.373 1.00 41.41 H new ATOM 0 HG21 ILE A 83 5.615 7.671 -6.679 1.00 10.51 H new ATOM 0 HG22 ILE A 83 6.956 8.621 -5.996 1.00 10.51 H new ATOM 0 HG23 ILE A 83 7.014 6.843 -5.954 1.00 10.51 H new ATOM 0 HD11 ILE A 83 3.025 5.553 -5.224 1.00 62.10 H new ATOM 0 HD12 ILE A 83 2.996 7.332 -5.268 1.00 62.10 H new ATOM 0 HD13 ILE A 83 4.037 6.431 -6.396 1.00 62.10 H new ATOM 1375 N ASN A 84 7.181 10.160 -3.091 1.00 33.23 N ATOM 1376 CA ASN A 84 7.935 11.408 -3.247 1.00 43.42 C ATOM 1377 C ASN A 84 9.139 11.488 -2.290 1.00 71.53 C ATOM 1378 O ASN A 84 10.255 11.789 -2.713 1.00 40.21 O ATOM 1379 CB ASN A 84 7.009 12.611 -3.029 1.00 51.22 C ATOM 1380 CG ASN A 84 5.949 12.729 -4.110 1.00 31.43 C ATOM 1381 OD1 ASN A 84 6.171 12.354 -5.255 1.00 73.14 O ATOM 1382 ND2 ASN A 84 4.792 13.251 -3.760 1.00 13.32 N ATOM 0 H ASN A 84 6.307 10.263 -2.576 1.00 33.23 H new ATOM 0 HA ASN A 84 8.328 11.425 -4.264 1.00 43.42 H new ATOM 0 HB2 ASN A 84 6.524 12.521 -2.057 1.00 51.22 H new ATOM 0 HB3 ASN A 84 7.604 13.524 -3.006 1.00 51.22 H new ATOM 0 HD21 ASN A 84 4.049 13.353 -4.451 1.00 13.32 H new ATOM 0 HD22 ASN A 84 4.639 13.553 -2.798 1.00 13.32 H new ATOM 1389 N LYS A 85 8.916 11.206 -1.006 1.00 24.52 N ATOM 1390 CA LYS A 85 9.979 11.314 0.008 1.00 33.25 C ATOM 1391 C LYS A 85 10.951 10.122 -0.041 1.00 10.25 C ATOM 1392 O LYS A 85 12.044 10.183 0.524 1.00 63.40 O ATOM 1393 CB LYS A 85 9.369 11.410 1.411 1.00 22.34 C ATOM 1394 CG LYS A 85 8.420 12.587 1.603 1.00 41.53 C ATOM 1395 CD LYS A 85 7.887 12.659 3.032 1.00 45.35 C ATOM 1396 CE LYS A 85 8.996 12.871 4.054 1.00 40.42 C ATOM 1397 NZ LYS A 85 9.745 14.131 3.807 1.00 11.52 N ATOM 0 H LYS A 85 8.014 10.902 -0.639 1.00 24.52 H new ATOM 0 HA LYS A 85 10.542 12.220 -0.217 1.00 33.25 H new ATOM 0 HB2 LYS A 85 8.831 10.486 1.625 1.00 22.34 H new ATOM 0 HB3 LYS A 85 10.175 11.486 2.141 1.00 22.34 H new ATOM 0 HG2 LYS A 85 8.938 13.515 1.361 1.00 41.53 H new ATOM 0 HG3 LYS A 85 7.585 12.498 0.908 1.00 41.53 H new ATOM 0 HD2 LYS A 85 7.166 13.473 3.108 1.00 45.35 H new ATOM 0 HD3 LYS A 85 7.353 11.738 3.265 1.00 45.35 H new ATOM 0 HE2 LYS A 85 8.567 12.894 5.056 1.00 40.42 H new ATOM 0 HE3 LYS A 85 9.685 12.027 4.022 1.00 40.42 H new ATOM 0 HZ1 LYS A 85 10.361 14.334 4.620 1.00 11.52 H new ATOM 0 HZ2 LYS A 85 10.326 14.028 2.950 1.00 11.52 H new ATOM 0 HZ3 LYS A 85 9.073 14.914 3.677 1.00 11.52 H new ATOM 1411 N LYS A 86 10.532 9.038 -0.703 1.00 11.13 N ATOM 1412 CA LYS A 86 11.361 7.828 -0.864 1.00 53.41 C ATOM 1413 C LYS A 86 11.665 7.125 0.475 1.00 45.40 C ATOM 1414 O LYS A 86 12.573 6.296 0.552 1.00 2.41 O ATOM 1415 CB LYS A 86 12.677 8.161 -1.592 1.00 43.41 C ATOM 1416 CG LYS A 86 12.496 8.605 -3.042 1.00 64.45 C ATOM 1417 CD LYS A 86 11.820 7.522 -3.886 1.00 33.41 C ATOM 1418 CE LYS A 86 11.762 7.908 -5.357 1.00 12.02 C ATOM 1419 NZ LYS A 86 11.054 9.197 -5.565 1.00 53.31 N ATOM 0 H LYS A 86 9.614 8.970 -1.142 1.00 11.13 H new ATOM 0 HA LYS A 86 10.776 7.134 -1.467 1.00 53.41 H new ATOM 0 HB2 LYS A 86 13.193 8.950 -1.044 1.00 43.41 H new ATOM 0 HB3 LYS A 86 13.323 7.283 -1.571 1.00 43.41 H new ATOM 0 HG2 LYS A 86 11.898 9.516 -3.072 1.00 64.45 H new ATOM 0 HG3 LYS A 86 13.468 8.848 -3.472 1.00 64.45 H new ATOM 0 HD2 LYS A 86 12.364 6.584 -3.777 1.00 33.41 H new ATOM 0 HD3 LYS A 86 10.810 7.350 -3.515 1.00 33.41 H new ATOM 0 HE2 LYS A 86 12.775 7.982 -5.753 1.00 12.02 H new ATOM 0 HE3 LYS A 86 11.257 7.122 -5.919 1.00 12.02 H new ATOM 0 HZ1 LYS A 86 11.051 9.432 -6.578 1.00 53.31 H new ATOM 0 HZ2 LYS A 86 10.074 9.114 -5.226 1.00 53.31 H new ATOM 0 HZ3 LYS A 86 11.540 9.949 -5.036 1.00 53.31 H new ATOM 1433 N LEU A 87 10.878 7.409 1.515 1.00 2.52 N ATOM 1434 CA LEU A 87 11.084 6.771 2.829 1.00 42.23 C ATOM 1435 C LEU A 87 10.527 5.333 2.860 1.00 5.12 C ATOM 1436 O LEU A 87 10.210 4.799 3.924 1.00 33.30 O ATOM 1437 CB LEU A 87 10.476 7.616 3.977 1.00 34.30 C ATOM 1438 CG LEU A 87 8.937 7.628 4.117 1.00 45.32 C ATOM 1439 CD1 LEU A 87 8.504 8.583 5.227 1.00 44.25 C ATOM 1440 CD2 LEU A 87 8.260 8.012 2.814 1.00 43.21 C ATOM 0 H LEU A 87 10.100 8.067 1.481 1.00 2.52 H new ATOM 0 HA LEU A 87 12.161 6.716 2.986 1.00 42.23 H new ATOM 0 HB2 LEU A 87 10.896 7.258 4.917 1.00 34.30 H new ATOM 0 HB3 LEU A 87 10.810 8.646 3.850 1.00 34.30 H new ATOM 0 HG LEU A 87 8.627 6.615 4.375 1.00 45.32 H new ATOM 0 HD11 LEU A 87 7.417 8.577 5.309 1.00 44.25 H new ATOM 0 HD12 LEU A 87 8.941 8.264 6.173 1.00 44.25 H new ATOM 0 HD13 LEU A 87 8.844 9.592 4.992 1.00 44.25 H new ATOM 0 HD21 LEU A 87 7.179 8.010 2.951 1.00 43.21 H new ATOM 0 HD22 LEU A 87 8.586 9.008 2.515 1.00 43.21 H new ATOM 0 HD23 LEU A 87 8.529 7.294 2.039 1.00 43.21 H new ATOM 1452 N TRP A 88 10.442 4.693 1.687 1.00 62.55 N ATOM 1453 CA TRP A 88 10.060 3.277 1.595 1.00 42.22 C ATOM 1454 C TRP A 88 10.978 2.391 2.454 1.00 44.22 C ATOM 1455 O TRP A 88 10.612 1.278 2.823 1.00 63.13 O ATOM 1456 CB TRP A 88 10.095 2.792 0.135 1.00 13.23 C ATOM 1457 CG TRP A 88 8.959 3.292 -0.714 1.00 74.21 C ATOM 1458 CD1 TRP A 88 8.997 4.297 -1.639 1.00 32.04 C ATOM 1459 CD2 TRP A 88 7.615 2.791 -0.725 1.00 64.04 C ATOM 1460 NE1 TRP A 88 7.763 4.446 -2.224 1.00 1.04 N ATOM 1461 CE2 TRP A 88 6.897 3.539 -1.676 1.00 73.41 C ATOM 1462 CE3 TRP A 88 6.948 1.786 -0.017 1.00 52.40 C ATOM 1463 CZ2 TRP A 88 5.551 3.310 -1.942 1.00 11.03 C ATOM 1464 CZ3 TRP A 88 5.611 1.559 -0.281 1.00 15.42 C ATOM 1465 CH2 TRP A 88 4.923 2.321 -1.236 1.00 53.04 C ATOM 0 H TRP A 88 10.633 5.133 0.787 1.00 62.55 H new ATOM 0 HA TRP A 88 9.042 3.193 1.974 1.00 42.22 H new ATOM 0 HB2 TRP A 88 11.036 3.106 -0.317 1.00 13.23 H new ATOM 0 HB3 TRP A 88 10.086 1.702 0.127 1.00 13.23 H new ATOM 0 HD1 TRP A 88 9.870 4.888 -1.876 1.00 32.04 H new ATOM 0 HE1 TRP A 88 7.530 5.124 -2.950 1.00 1.04 H new ATOM 0 HE3 TRP A 88 7.469 1.197 0.723 1.00 52.40 H new ATOM 0 HZ2 TRP A 88 5.020 3.893 -2.680 1.00 11.03 H new ATOM 0 HZ3 TRP A 88 5.088 0.782 0.257 1.00 15.42 H new ATOM 0 HH2 TRP A 88 3.877 2.123 -1.418 1.00 53.04 H new ATOM 1476 N ARG A 89 12.173 2.897 2.758 1.00 63.22 N ATOM 1477 CA ARG A 89 13.107 2.219 3.668 1.00 51.23 C ATOM 1478 C ARG A 89 12.498 2.061 5.080 1.00 3.23 C ATOM 1479 O ARG A 89 12.754 1.074 5.775 1.00 12.44 O ATOM 1480 CB ARG A 89 14.418 3.015 3.744 1.00 42.33 C ATOM 1481 CG ARG A 89 14.221 4.447 4.227 1.00 73.24 C ATOM 1482 CD ARG A 89 15.536 5.187 4.436 1.00 43.12 C ATOM 1483 NE ARG A 89 15.327 6.452 5.137 1.00 31.34 N ATOM 1484 CZ ARG A 89 16.225 7.390 5.252 1.00 14.34 C ATOM 1485 NH1 ARG A 89 17.385 7.267 4.690 1.00 1.13 N ATOM 1486 NH2 ARG A 89 15.960 8.459 5.925 1.00 52.12 N ATOM 0 H ARG A 89 12.522 3.780 2.386 1.00 63.22 H new ATOM 0 HA ARG A 89 13.307 1.221 3.277 1.00 51.23 H new ATOM 0 HB2 ARG A 89 15.108 2.503 4.415 1.00 42.33 H new ATOM 0 HB3 ARG A 89 14.884 3.031 2.759 1.00 42.33 H new ATOM 0 HG2 ARG A 89 13.615 4.990 3.501 1.00 73.24 H new ATOM 0 HG3 ARG A 89 13.663 4.436 5.163 1.00 73.24 H new ATOM 0 HD2 ARG A 89 16.221 4.561 5.007 1.00 43.12 H new ATOM 0 HD3 ARG A 89 16.007 5.377 3.471 1.00 43.12 H new ATOM 0 HE ARG A 89 14.416 6.612 5.566 1.00 31.34 H new ATOM 0 HH11 ARG A 89 17.604 6.430 4.150 1.00 1.13 H new ATOM 0 HH12 ARG A 89 18.080 8.008 4.787 1.00 1.13 H new ATOM 0 HH21 ARG A 89 15.048 8.570 6.367 1.00 52.12 H new ATOM 0 HH22 ARG A 89 16.663 9.193 6.015 1.00 52.12 H new ATOM 1500 N GLU A 90 11.703 3.050 5.502 1.00 12.52 N ATOM 1501 CA GLU A 90 10.955 2.971 6.764 1.00 34.14 C ATOM 1502 C GLU A 90 9.809 1.947 6.652 1.00 74.23 C ATOM 1503 O GLU A 90 9.445 1.286 7.631 1.00 41.14 O ATOM 1504 CB GLU A 90 10.389 4.356 7.145 1.00 43.44 C ATOM 1505 CG GLU A 90 11.363 5.279 7.884 1.00 71.24 C ATOM 1506 CD GLU A 90 12.631 5.599 7.107 1.00 42.14 C ATOM 1507 OE1 GLU A 90 12.581 6.459 6.204 1.00 12.32 O ATOM 1508 OE2 GLU A 90 13.690 5.007 7.414 1.00 21.20 O ATOM 0 H GLU A 90 11.560 3.918 4.987 1.00 12.52 H new ATOM 0 HA GLU A 90 11.641 2.644 7.546 1.00 34.14 H new ATOM 0 HB2 GLU A 90 10.057 4.858 6.236 1.00 43.44 H new ATOM 0 HB3 GLU A 90 9.507 4.211 7.769 1.00 43.44 H new ATOM 0 HG2 GLU A 90 10.852 6.212 8.123 1.00 71.24 H new ATOM 0 HG3 GLU A 90 11.638 4.815 8.831 1.00 71.24 H new ATOM 1515 N ILE A 91 9.251 1.822 5.446 1.00 31.21 N ATOM 1516 CA ILE A 91 8.163 0.874 5.180 1.00 43.20 C ATOM 1517 C ILE A 91 8.676 -0.574 5.222 1.00 31.20 C ATOM 1518 O ILE A 91 8.125 -1.419 5.932 1.00 53.13 O ATOM 1519 CB ILE A 91 7.501 1.143 3.802 1.00 30.23 C ATOM 1520 CG1 ILE A 91 7.124 2.629 3.662 1.00 72.45 C ATOM 1521 CG2 ILE A 91 6.273 0.252 3.607 1.00 74.12 C ATOM 1522 CD1 ILE A 91 6.202 3.141 4.747 1.00 32.32 C ATOM 0 H ILE A 91 9.536 2.368 4.633 1.00 31.21 H new ATOM 0 HA ILE A 91 7.416 1.015 5.961 1.00 43.20 H new ATOM 0 HB ILE A 91 8.224 0.899 3.023 1.00 30.23 H new ATOM 0 HG12 ILE A 91 8.036 3.225 3.665 1.00 72.45 H new ATOM 0 HG13 ILE A 91 6.647 2.781 2.694 1.00 72.45 H new ATOM 0 HG21 ILE A 91 5.825 0.457 2.635 1.00 74.12 H new ATOM 0 HG22 ILE A 91 6.572 -0.795 3.655 1.00 74.12 H new ATOM 0 HG23 ILE A 91 5.546 0.458 4.392 1.00 74.12 H new ATOM 0 HD11 ILE A 91 5.986 4.195 4.574 1.00 32.32 H new ATOM 0 HD12 ILE A 91 5.272 2.573 4.732 1.00 32.32 H new ATOM 0 HD13 ILE A 91 6.683 3.024 5.718 1.00 32.32 H new ATOM 1534 N THR A 92 9.743 -0.851 4.468 1.00 5.24 N ATOM 1535 CA THR A 92 10.368 -2.181 4.464 1.00 54.24 C ATOM 1536 C THR A 92 10.770 -2.603 5.880 1.00 50.40 C ATOM 1537 O THR A 92 10.499 -3.726 6.302 1.00 15.10 O ATOM 1538 CB THR A 92 11.621 -2.234 3.556 1.00 24.11 C ATOM 1539 OG1 THR A 92 12.561 -1.226 3.958 1.00 74.53 O ATOM 1540 CG2 THR A 92 11.248 -2.043 2.088 1.00 13.33 C ATOM 0 H THR A 92 10.194 -0.174 3.852 1.00 5.24 H new ATOM 0 HA THR A 92 9.620 -2.869 4.070 1.00 54.24 H new ATOM 0 HB THR A 92 12.077 -3.218 3.665 1.00 24.11 H new ATOM 0 HG1 THR A 92 13.351 -1.267 3.380 1.00 74.53 H new ATOM 0 HG21 THR A 92 12.149 -2.085 1.475 1.00 13.33 H new ATOM 0 HG22 THR A 92 10.563 -2.833 1.781 1.00 13.33 H new ATOM 0 HG23 THR A 92 10.766 -1.074 1.958 1.00 13.33 H new ATOM 1548 N LYS A 93 11.411 -1.694 6.615 1.00 25.05 N ATOM 1549 CA LYS A 93 11.745 -1.922 8.014 1.00 72.11 C ATOM 1550 C LYS A 93 10.503 -2.330 8.833 1.00 70.10 C ATOM 1551 O LYS A 93 10.582 -3.184 9.722 1.00 1.33 O ATOM 1552 CB LYS A 93 12.371 -0.653 8.606 1.00 1.44 C ATOM 1553 CG LYS A 93 13.016 -0.885 9.961 1.00 61.02 C ATOM 1554 CD LYS A 93 14.215 -1.820 9.850 1.00 43.44 C ATOM 1555 CE LYS A 93 15.467 -1.097 9.364 1.00 70.41 C ATOM 1556 NZ LYS A 93 15.895 -0.028 10.308 1.00 11.00 N ATOM 0 H LYS A 93 11.710 -0.787 6.257 1.00 25.05 H new ATOM 0 HA LYS A 93 12.460 -2.743 8.064 1.00 72.11 H new ATOM 0 HB2 LYS A 93 13.120 -0.268 7.914 1.00 1.44 H new ATOM 0 HB3 LYS A 93 11.602 0.114 8.702 1.00 1.44 H new ATOM 0 HG2 LYS A 93 13.333 0.068 10.383 1.00 61.02 H new ATOM 0 HG3 LYS A 93 12.283 -1.309 10.647 1.00 61.02 H new ATOM 0 HD2 LYS A 93 14.413 -2.271 10.822 1.00 43.44 H new ATOM 0 HD3 LYS A 93 13.977 -2.633 9.164 1.00 43.44 H new ATOM 0 HE2 LYS A 93 16.276 -1.817 9.240 1.00 70.41 H new ATOM 0 HE3 LYS A 93 15.276 -0.660 8.384 1.00 70.41 H new ATOM 0 HZ1 LYS A 93 16.904 0.180 10.163 1.00 11.00 H new ATOM 0 HZ2 LYS A 93 15.336 0.832 10.136 1.00 11.00 H new ATOM 0 HZ3 LYS A 93 15.745 -0.348 11.286 1.00 11.00 H new ATOM 1570 N GLY A 94 9.361 -1.711 8.529 1.00 2.44 N ATOM 1571 CA GLY A 94 8.107 -2.049 9.203 1.00 3.42 C ATOM 1572 C GLY A 94 7.556 -3.416 8.795 1.00 64.24 C ATOM 1573 O GLY A 94 6.795 -4.038 9.536 1.00 5.22 O ATOM 0 H GLY A 94 9.279 -0.978 7.825 1.00 2.44 H new ATOM 0 HA2 GLY A 94 8.266 -2.035 10.281 1.00 3.42 H new ATOM 0 HA3 GLY A 94 7.364 -1.283 8.980 1.00 3.42 H new ATOM 1577 N LEU A 95 7.937 -3.881 7.607 1.00 60.11 N ATOM 1578 CA LEU A 95 7.522 -5.199 7.112 1.00 34.10 C ATOM 1579 C LEU A 95 8.600 -6.258 7.398 1.00 65.34 C ATOM 1580 O LEU A 95 8.496 -7.398 6.951 1.00 4.21 O ATOM 1581 CB LEU A 95 7.257 -5.128 5.601 1.00 31.22 C ATOM 1582 CG LEU A 95 6.297 -4.020 5.144 1.00 53.41 C ATOM 1583 CD1 LEU A 95 6.155 -4.023 3.624 1.00 34.04 C ATOM 1584 CD2 LEU A 95 4.936 -4.175 5.814 1.00 1.04 C ATOM 0 H LEU A 95 8.536 -3.364 6.963 1.00 60.11 H new ATOM 0 HA LEU A 95 6.608 -5.487 7.631 1.00 34.10 H new ATOM 0 HB2 LEU A 95 8.210 -4.991 5.090 1.00 31.22 H new ATOM 0 HB3 LEU A 95 6.856 -6.088 5.276 1.00 31.22 H new ATOM 0 HG LEU A 95 6.716 -3.060 5.445 1.00 53.41 H new ATOM 0 HD11 LEU A 95 5.471 -3.231 3.321 1.00 34.04 H new ATOM 0 HD12 LEU A 95 7.130 -3.855 3.167 1.00 34.04 H new ATOM 0 HD13 LEU A 95 5.763 -4.986 3.297 1.00 34.04 H new ATOM 0 HD21 LEU A 95 4.271 -3.380 5.476 1.00 1.04 H new ATOM 0 HD22 LEU A 95 4.508 -5.142 5.550 1.00 1.04 H new ATOM 0 HD23 LEU A 95 5.054 -4.114 6.896 1.00 1.04 H new ATOM 1596 N ASN A 96 9.641 -5.853 8.135 1.00 31.01 N ATOM 1597 CA ASN A 96 10.773 -6.730 8.466 1.00 12.02 C ATOM 1598 C ASN A 96 11.556 -7.135 7.196 1.00 11.14 C ATOM 1599 O ASN A 96 12.272 -8.138 7.180 1.00 52.14 O ATOM 1600 CB ASN A 96 10.284 -7.973 9.237 1.00 23.21 C ATOM 1601 CG ASN A 96 11.412 -8.738 9.914 1.00 32.40 C ATOM 1602 OD1 ASN A 96 11.383 -9.960 10.007 1.00 71.01 O ATOM 1603 ND2 ASN A 96 12.396 -8.026 10.431 1.00 30.22 N ATOM 0 H ASN A 96 9.724 -4.911 8.518 1.00 31.01 H new ATOM 0 HA ASN A 96 11.456 -6.176 9.109 1.00 12.02 H new ATOM 0 HB2 ASN A 96 9.559 -7.664 9.990 1.00 23.21 H new ATOM 0 HB3 ASN A 96 9.764 -8.639 8.548 1.00 23.21 H new ATOM 0 HD21 ASN A 96 13.158 -8.492 10.923 1.00 30.22 H new ATOM 0 HD22 ASN A 96 12.394 -7.010 10.338 1.00 30.22 H new ATOM 1610 N LEU A 97 11.433 -6.327 6.143 1.00 51.33 N ATOM 1611 CA LEU A 97 12.117 -6.584 4.867 1.00 71.34 C ATOM 1612 C LEU A 97 13.486 -5.881 4.813 1.00 22.04 C ATOM 1613 O LEU A 97 13.668 -4.807 5.394 1.00 71.01 O ATOM 1614 CB LEU A 97 11.249 -6.104 3.692 1.00 64.24 C ATOM 1615 CG LEU A 97 9.809 -6.635 3.668 1.00 3.04 C ATOM 1616 CD1 LEU A 97 9.060 -6.127 2.436 1.00 72.30 C ATOM 1617 CD2 LEU A 97 9.787 -8.157 3.730 1.00 72.34 C ATOM 0 H LEU A 97 10.862 -5.482 6.145 1.00 51.33 H new ATOM 0 HA LEU A 97 12.277 -7.659 4.789 1.00 71.34 H new ATOM 0 HB2 LEU A 97 11.215 -5.015 3.711 1.00 64.24 H new ATOM 0 HB3 LEU A 97 11.738 -6.392 2.761 1.00 64.24 H new ATOM 0 HG LEU A 97 9.297 -6.256 4.553 1.00 3.04 H new ATOM 0 HD11 LEU A 97 8.042 -6.517 2.442 1.00 72.30 H new ATOM 0 HD12 LEU A 97 9.031 -5.037 2.451 1.00 72.30 H new ATOM 0 HD13 LEU A 97 9.572 -6.464 1.534 1.00 72.30 H new ATOM 0 HD21 LEU A 97 8.755 -8.507 3.712 1.00 72.34 H new ATOM 0 HD22 LEU A 97 10.324 -8.564 2.873 1.00 72.34 H new ATOM 0 HD23 LEU A 97 10.267 -8.491 4.650 1.00 72.34 H new ATOM 1629 N PRO A 98 14.470 -6.474 4.108 1.00 74.02 N ATOM 1630 CA PRO A 98 15.806 -5.871 3.948 1.00 3.01 C ATOM 1631 C PRO A 98 15.794 -4.618 3.047 1.00 54.41 C ATOM 1632 O PRO A 98 15.148 -4.597 2.000 1.00 53.44 O ATOM 1633 CB PRO A 98 16.625 -6.998 3.300 1.00 4.20 C ATOM 1634 CG PRO A 98 15.618 -7.835 2.584 1.00 65.34 C ATOM 1635 CD PRO A 98 14.367 -7.780 3.422 1.00 11.11 C ATOM 0 HA PRO A 98 16.209 -5.521 4.898 1.00 3.01 H new ATOM 0 HB2 PRO A 98 17.371 -6.600 2.612 1.00 4.20 H new ATOM 0 HB3 PRO A 98 17.162 -7.579 4.050 1.00 4.20 H new ATOM 0 HG2 PRO A 98 15.433 -7.452 1.581 1.00 65.34 H new ATOM 0 HG3 PRO A 98 15.970 -8.861 2.474 1.00 65.34 H new ATOM 0 HD2 PRO A 98 13.469 -7.841 2.807 1.00 11.11 H new ATOM 0 HD3 PRO A 98 14.323 -8.605 4.133 1.00 11.11 H new ATOM 1643 N THR A 99 16.529 -3.582 3.452 1.00 3.45 N ATOM 1644 CA THR A 99 16.595 -2.324 2.683 1.00 72.13 C ATOM 1645 C THR A 99 17.535 -2.451 1.471 1.00 42.23 C ATOM 1646 O THR A 99 17.562 -1.588 0.592 1.00 3.11 O ATOM 1647 CB THR A 99 17.060 -1.136 3.570 1.00 62.43 C ATOM 1648 OG1 THR A 99 17.060 0.088 2.814 1.00 71.03 O ATOM 1649 CG2 THR A 99 18.455 -1.381 4.142 1.00 54.24 C ATOM 0 H THR A 99 17.088 -3.582 4.305 1.00 3.45 H new ATOM 0 HA THR A 99 15.584 -2.125 2.327 1.00 72.13 H new ATOM 0 HB THR A 99 16.356 -1.051 4.398 1.00 62.43 H new ATOM 0 HG1 THR A 99 17.226 -0.111 1.869 1.00 71.03 H new ATOM 0 HG21 THR A 99 18.750 -0.531 4.758 1.00 54.24 H new ATOM 0 HG22 THR A 99 18.445 -2.285 4.752 1.00 54.24 H new ATOM 0 HG23 THR A 99 19.167 -1.502 3.326 1.00 54.24 H new ATOM 1657 N SER A 100 18.300 -3.544 1.423 1.00 54.12 N ATOM 1658 CA SER A 100 19.249 -3.789 0.324 1.00 2.42 C ATOM 1659 C SER A 100 18.559 -4.308 -0.952 1.00 41.55 C ATOM 1660 O SER A 100 19.228 -4.679 -1.918 1.00 13.13 O ATOM 1661 CB SER A 100 20.331 -4.789 0.764 1.00 4.41 C ATOM 1662 OG SER A 100 21.308 -4.984 -0.255 1.00 35.44 O ATOM 0 H SER A 100 18.284 -4.277 2.132 1.00 54.12 H new ATOM 0 HA SER A 100 19.704 -2.828 0.085 1.00 2.42 H new ATOM 0 HB2 SER A 100 20.816 -4.426 1.670 1.00 4.41 H new ATOM 0 HB3 SER A 100 19.867 -5.744 1.012 1.00 4.41 H new ATOM 0 HG SER A 100 20.878 -4.937 -1.134 1.00 35.44 H new ATOM 1668 N ILE A 101 17.227 -4.347 -0.958 1.00 45.52 N ATOM 1669 CA ILE A 101 16.477 -4.774 -2.147 1.00 72.20 C ATOM 1670 C ILE A 101 16.650 -3.767 -3.300 1.00 31.31 C ATOM 1671 O ILE A 101 16.317 -2.590 -3.161 1.00 62.11 O ATOM 1672 CB ILE A 101 14.968 -4.949 -1.833 1.00 23.02 C ATOM 1673 CG1 ILE A 101 14.762 -6.023 -0.752 1.00 41.44 C ATOM 1674 CG2 ILE A 101 14.187 -5.301 -3.102 1.00 73.55 C ATOM 1675 CD1 ILE A 101 13.323 -6.171 -0.297 1.00 75.42 C ATOM 0 H ILE A 101 16.645 -4.091 -0.161 1.00 45.52 H new ATOM 0 HA ILE A 101 16.883 -5.738 -2.452 1.00 72.20 H new ATOM 0 HB ILE A 101 14.586 -4.002 -1.452 1.00 23.02 H new ATOM 0 HG12 ILE A 101 15.112 -6.982 -1.135 1.00 41.44 H new ATOM 0 HG13 ILE A 101 15.382 -5.779 0.111 1.00 41.44 H new ATOM 0 HG21 ILE A 101 13.131 -5.419 -2.858 1.00 73.55 H new ATOM 0 HG22 ILE A 101 14.303 -4.502 -3.834 1.00 73.55 H new ATOM 0 HG23 ILE A 101 14.570 -6.233 -3.518 1.00 73.55 H new ATOM 0 HD11 ILE A 101 13.261 -6.947 0.466 1.00 75.42 H new ATOM 0 HD12 ILE A 101 12.974 -5.226 0.118 1.00 75.42 H new ATOM 0 HD13 ILE A 101 12.699 -6.447 -1.147 1.00 75.42 H new ATOM 1687 N THR A 102 17.152 -4.264 -4.437 1.00 1.14 N ATOM 1688 CA THR A 102 17.502 -3.438 -5.614 1.00 52.32 C ATOM 1689 C THR A 102 16.532 -2.270 -5.875 1.00 72.20 C ATOM 1690 O THR A 102 16.964 -1.140 -6.109 1.00 33.01 O ATOM 1691 CB THR A 102 17.580 -4.308 -6.895 1.00 20.52 C ATOM 1692 OG1 THR A 102 18.622 -5.290 -6.773 1.00 64.03 O ATOM 1693 CG2 THR A 102 17.833 -3.460 -8.142 1.00 20.21 C ATOM 0 H THR A 102 17.331 -5.259 -4.574 1.00 1.14 H new ATOM 0 HA THR A 102 18.475 -3.008 -5.375 1.00 52.32 H new ATOM 0 HB THR A 102 16.616 -4.804 -7.005 1.00 20.52 H new ATOM 0 HG1 THR A 102 18.658 -5.832 -7.589 1.00 64.03 H new ATOM 0 HG21 THR A 102 17.881 -4.107 -9.018 1.00 20.21 H new ATOM 0 HG22 THR A 102 17.022 -2.742 -8.265 1.00 20.21 H new ATOM 0 HG23 THR A 102 18.777 -2.926 -8.033 1.00 20.21 H new ATOM 1701 N SER A 103 15.231 -2.540 -5.853 1.00 21.20 N ATOM 1702 CA SER A 103 14.233 -1.505 -6.169 1.00 2.25 C ATOM 1703 C SER A 103 12.944 -1.687 -5.359 1.00 30.41 C ATOM 1704 O SER A 103 11.844 -1.524 -5.889 1.00 14.42 O ATOM 1705 CB SER A 103 13.913 -1.517 -7.675 1.00 2.12 C ATOM 1706 OG SER A 103 15.055 -1.184 -8.458 1.00 32.43 O ATOM 0 H SER A 103 14.839 -3.453 -5.623 1.00 21.20 H new ATOM 0 HA SER A 103 14.663 -0.542 -5.896 1.00 2.25 H new ATOM 0 HB2 SER A 103 13.550 -2.504 -7.962 1.00 2.12 H new ATOM 0 HB3 SER A 103 13.110 -0.809 -7.882 1.00 2.12 H new ATOM 0 HG SER A 103 15.366 -0.287 -8.217 1.00 32.43 H new ATOM 1712 N ALA A 104 13.090 -1.983 -4.065 1.00 3.30 N ATOM 1713 CA ALA A 104 11.935 -2.176 -3.168 1.00 0.11 C ATOM 1714 C ALA A 104 10.904 -1.046 -3.302 1.00 22.43 C ATOM 1715 O ALA A 104 9.704 -1.297 -3.407 1.00 63.24 O ATOM 1716 CB ALA A 104 12.401 -2.279 -1.721 1.00 44.34 C ATOM 0 H ALA A 104 13.996 -2.096 -3.609 1.00 3.30 H new ATOM 0 HA ALA A 104 11.449 -3.106 -3.464 1.00 0.11 H new ATOM 0 HB1 ALA A 104 11.538 -2.421 -1.070 1.00 44.34 H new ATOM 0 HB2 ALA A 104 13.078 -3.127 -1.616 1.00 44.34 H new ATOM 0 HB3 ALA A 104 12.920 -1.363 -1.440 1.00 44.34 H new ATOM 1722 N ALA A 105 11.389 0.193 -3.307 1.00 63.03 N ATOM 1723 CA ALA A 105 10.528 1.375 -3.440 1.00 21.52 C ATOM 1724 C ALA A 105 9.648 1.312 -4.700 1.00 1.22 C ATOM 1725 O ALA A 105 8.441 1.552 -4.642 1.00 34.22 O ATOM 1726 CB ALA A 105 11.385 2.638 -3.462 1.00 45.33 C ATOM 0 H ALA A 105 12.382 0.410 -3.220 1.00 63.03 H new ATOM 0 HA ALA A 105 9.861 1.396 -2.579 1.00 21.52 H new ATOM 0 HB1 ALA A 105 10.742 3.512 -3.561 1.00 45.33 H new ATOM 0 HB2 ALA A 105 11.953 2.708 -2.534 1.00 45.33 H new ATOM 0 HB3 ALA A 105 12.073 2.596 -4.306 1.00 45.33 H new ATOM 1732 N PHE A 106 10.259 0.970 -5.830 1.00 42.54 N ATOM 1733 CA PHE A 106 9.554 0.919 -7.114 1.00 53.34 C ATOM 1734 C PHE A 106 8.517 -0.218 -7.140 1.00 73.01 C ATOM 1735 O PHE A 106 7.397 -0.039 -7.632 1.00 23.35 O ATOM 1736 CB PHE A 106 10.570 0.745 -8.253 1.00 31.05 C ATOM 1737 CG PHE A 106 9.973 0.813 -9.641 1.00 30.53 C ATOM 1738 CD1 PHE A 106 9.697 2.039 -10.233 1.00 73.21 C ATOM 1739 CD2 PHE A 106 9.690 -0.346 -10.353 1.00 34.21 C ATOM 1740 CE1 PHE A 106 9.154 2.106 -11.504 1.00 51.13 C ATOM 1741 CE2 PHE A 106 9.147 -0.283 -11.623 1.00 21.33 C ATOM 1742 CZ PHE A 106 8.879 0.945 -12.198 1.00 4.13 C ATOM 0 H PHE A 106 11.247 0.722 -5.886 1.00 42.54 H new ATOM 0 HA PHE A 106 9.016 1.857 -7.249 1.00 53.34 H new ATOM 0 HB2 PHE A 106 11.335 1.516 -8.162 1.00 31.05 H new ATOM 0 HB3 PHE A 106 11.070 -0.216 -8.133 1.00 31.05 H new ATOM 0 HD1 PHE A 106 9.909 2.951 -9.695 1.00 73.21 H new ATOM 0 HD2 PHE A 106 9.897 -1.308 -9.909 1.00 34.21 H new ATOM 0 HE1 PHE A 106 8.946 3.066 -11.953 1.00 51.13 H new ATOM 0 HE2 PHE A 106 8.933 -1.192 -12.165 1.00 21.33 H new ATOM 0 HZ PHE A 106 8.455 0.996 -13.190 1.00 4.13 H new ATOM 1752 N THR A 107 8.897 -1.378 -6.603 1.00 14.33 N ATOM 1753 CA THR A 107 8.013 -2.554 -6.569 1.00 71.35 C ATOM 1754 C THR A 107 6.817 -2.345 -5.623 1.00 31.34 C ATOM 1755 O THR A 107 5.664 -2.532 -6.015 1.00 4.32 O ATOM 1756 CB THR A 107 8.782 -3.825 -6.125 1.00 61.40 C ATOM 1757 OG1 THR A 107 9.948 -4.011 -6.943 1.00 34.22 O ATOM 1758 CG2 THR A 107 7.894 -5.065 -6.213 1.00 3.41 C ATOM 0 H THR A 107 9.814 -1.533 -6.183 1.00 14.33 H new ATOM 0 HA THR A 107 7.643 -2.687 -7.586 1.00 71.35 H new ATOM 0 HB THR A 107 9.084 -3.687 -5.087 1.00 61.40 H new ATOM 0 HG1 THR A 107 10.604 -3.311 -6.741 1.00 34.22 H new ATOM 0 HG21 THR A 107 8.460 -5.941 -5.896 1.00 3.41 H new ATOM 0 HG22 THR A 107 7.027 -4.938 -5.565 1.00 3.41 H new ATOM 0 HG23 THR A 107 7.561 -5.202 -7.242 1.00 3.41 H new ATOM 1766 N LEU A 108 7.098 -1.956 -4.377 1.00 61.11 N ATOM 1767 CA LEU A 108 6.045 -1.708 -3.378 1.00 52.02 C ATOM 1768 C LEU A 108 5.068 -0.627 -3.866 1.00 43.41 C ATOM 1769 O LEU A 108 3.859 -0.715 -3.643 1.00 60.31 O ATOM 1770 CB LEU A 108 6.669 -1.289 -2.039 1.00 63.54 C ATOM 1771 CG LEU A 108 7.559 -2.346 -1.365 1.00 64.03 C ATOM 1772 CD1 LEU A 108 8.197 -1.785 -0.095 1.00 30.22 C ATOM 1773 CD2 LEU A 108 6.758 -3.610 -1.057 1.00 2.11 C ATOM 0 H LEU A 108 8.046 -1.805 -4.032 1.00 61.11 H new ATOM 0 HA LEU A 108 5.488 -2.634 -3.236 1.00 52.02 H new ATOM 0 HB2 LEU A 108 7.262 -0.389 -2.200 1.00 63.54 H new ATOM 0 HB3 LEU A 108 5.866 -1.023 -1.351 1.00 63.54 H new ATOM 0 HG LEU A 108 8.358 -2.611 -2.058 1.00 64.03 H new ATOM 0 HD11 LEU A 108 8.823 -2.549 0.366 1.00 30.22 H new ATOM 0 HD12 LEU A 108 8.809 -0.919 -0.347 1.00 30.22 H new ATOM 0 HD13 LEU A 108 7.415 -1.486 0.603 1.00 30.22 H new ATOM 0 HD21 LEU A 108 7.407 -4.345 -0.580 1.00 2.11 H new ATOM 0 HD22 LEU A 108 5.934 -3.364 -0.387 1.00 2.11 H new ATOM 0 HD23 LEU A 108 6.361 -4.024 -1.984 1.00 2.11 H new ATOM 1785 N ARG A 109 5.617 0.385 -4.541 1.00 31.12 N ATOM 1786 CA ARG A 109 4.824 1.445 -5.180 1.00 23.31 C ATOM 1787 C ARG A 109 3.747 0.846 -6.106 1.00 35.14 C ATOM 1788 O ARG A 109 2.606 1.314 -6.135 1.00 13.41 O ATOM 1789 CB ARG A 109 5.787 2.381 -5.952 1.00 13.43 C ATOM 1790 CG ARG A 109 5.147 3.560 -6.698 1.00 32.43 C ATOM 1791 CD ARG A 109 4.476 3.151 -8.014 1.00 33.31 C ATOM 1792 NE ARG A 109 5.304 2.246 -8.813 1.00 3.52 N ATOM 1793 CZ ARG A 109 5.247 2.154 -10.114 1.00 73.14 C ATOM 1794 NH1 ARG A 109 4.492 2.951 -10.801 1.00 60.13 N ATOM 1795 NH2 ARG A 109 5.955 1.261 -10.724 1.00 74.15 N ATOM 0 H ARG A 109 6.624 0.496 -4.662 1.00 31.12 H new ATOM 0 HA ARG A 109 4.296 2.022 -4.421 1.00 23.31 H new ATOM 0 HB2 ARG A 109 6.515 2.780 -5.245 1.00 13.43 H new ATOM 0 HB3 ARG A 109 6.340 1.780 -6.674 1.00 13.43 H new ATOM 0 HG2 ARG A 109 4.407 4.031 -6.052 1.00 32.43 H new ATOM 0 HG3 ARG A 109 5.912 4.308 -6.905 1.00 32.43 H new ATOM 0 HD2 ARG A 109 3.523 2.668 -7.797 1.00 33.31 H new ATOM 0 HD3 ARG A 109 4.255 4.045 -8.597 1.00 33.31 H new ATOM 0 HE ARG A 109 5.969 1.649 -8.321 1.00 3.52 H new ATOM 0 HH11 ARG A 109 3.934 3.660 -10.326 1.00 60.13 H new ATOM 0 HH12 ARG A 109 4.456 2.870 -11.817 1.00 60.13 H new ATOM 0 HH21 ARG A 109 6.554 0.633 -10.189 1.00 74.15 H new ATOM 0 HH22 ARG A 109 5.914 1.185 -11.740 1.00 74.15 H new ATOM 1809 N THR A 110 4.122 -0.184 -6.863 1.00 30.23 N ATOM 1810 CA THR A 110 3.192 -0.862 -7.780 1.00 4.24 C ATOM 1811 C THR A 110 2.194 -1.750 -7.023 1.00 64.14 C ATOM 1812 O THR A 110 0.987 -1.701 -7.272 1.00 73.33 O ATOM 1813 CB THR A 110 3.950 -1.737 -8.809 1.00 44.21 C ATOM 1814 OG1 THR A 110 4.889 -0.936 -9.539 1.00 74.32 O ATOM 1815 CG2 THR A 110 2.988 -2.405 -9.790 1.00 0.41 C ATOM 0 H THR A 110 5.065 -0.572 -6.863 1.00 30.23 H new ATOM 0 HA THR A 110 2.648 -0.074 -8.301 1.00 4.24 H new ATOM 0 HB THR A 110 4.477 -2.515 -8.257 1.00 44.21 H new ATOM 0 HG1 THR A 110 5.620 -0.665 -8.945 1.00 74.32 H new ATOM 0 HG21 THR A 110 3.553 -3.011 -10.498 1.00 0.41 H new ATOM 0 HG22 THR A 110 2.293 -3.041 -9.242 1.00 0.41 H new ATOM 0 HG23 THR A 110 2.431 -1.640 -10.331 1.00 0.41 H new ATOM 1823 N GLN A 111 2.706 -2.565 -6.097 1.00 50.11 N ATOM 1824 CA GLN A 111 1.868 -3.503 -5.335 1.00 34.14 C ATOM 1825 C GLN A 111 0.768 -2.771 -4.544 1.00 33.13 C ATOM 1826 O GLN A 111 -0.410 -3.131 -4.617 1.00 64.25 O ATOM 1827 CB GLN A 111 2.730 -4.339 -4.372 1.00 1.11 C ATOM 1828 CG GLN A 111 3.898 -5.060 -5.045 1.00 40.53 C ATOM 1829 CD GLN A 111 3.475 -5.977 -6.188 1.00 42.41 C ATOM 1830 OE1 GLN A 111 4.220 -6.181 -7.139 1.00 52.52 O ATOM 1831 NE2 GLN A 111 2.290 -6.554 -6.101 1.00 4.34 N ATOM 0 H GLN A 111 3.696 -2.596 -5.855 1.00 50.11 H new ATOM 0 HA GLN A 111 1.386 -4.164 -6.055 1.00 34.14 H new ATOM 0 HB2 GLN A 111 3.121 -3.686 -3.592 1.00 1.11 H new ATOM 0 HB3 GLN A 111 2.096 -5.077 -3.881 1.00 1.11 H new ATOM 0 HG2 GLN A 111 4.600 -4.319 -5.426 1.00 40.53 H new ATOM 0 HG3 GLN A 111 4.430 -5.648 -4.297 1.00 40.53 H new ATOM 0 HE21 GLN A 111 1.689 -6.367 -5.298 1.00 4.34 H new ATOM 0 HE22 GLN A 111 1.976 -7.187 -6.837 1.00 4.34 H new ATOM 1840 N TYR A 112 1.163 -1.741 -3.798 1.00 21.12 N ATOM 1841 CA TYR A 112 0.218 -0.935 -3.014 1.00 12.13 C ATOM 1842 C TYR A 112 -0.869 -0.335 -3.920 1.00 4.42 C ATOM 1843 O TYR A 112 -2.058 -0.374 -3.598 1.00 22.50 O ATOM 1844 CB TYR A 112 0.967 0.189 -2.281 1.00 14.00 C ATOM 1845 CG TYR A 112 0.140 0.919 -1.230 1.00 73.31 C ATOM 1846 CD1 TYR A 112 -0.830 1.853 -1.588 1.00 55.21 C ATOM 1847 CD2 TYR A 112 0.338 0.674 0.126 1.00 71.04 C ATOM 1848 CE1 TYR A 112 -1.575 2.515 -0.630 1.00 3.42 C ATOM 1849 CE2 TYR A 112 -0.404 1.332 1.086 1.00 24.35 C ATOM 1850 CZ TYR A 112 -1.357 2.252 0.705 1.00 30.52 C ATOM 1851 OH TYR A 112 -2.098 2.906 1.664 1.00 75.00 O ATOM 0 H TYR A 112 2.135 -1.441 -3.717 1.00 21.12 H new ATOM 0 HA TYR A 112 -0.262 -1.584 -2.282 1.00 12.13 H new ATOM 0 HB2 TYR A 112 1.850 -0.233 -1.801 1.00 14.00 H new ATOM 0 HB3 TYR A 112 1.319 0.913 -3.016 1.00 14.00 H new ATOM 0 HD1 TYR A 112 -1.003 2.064 -2.633 1.00 55.21 H new ATOM 0 HD2 TYR A 112 1.085 -0.043 0.432 1.00 71.04 H new ATOM 0 HE1 TYR A 112 -2.324 3.235 -0.926 1.00 3.42 H new ATOM 0 HE2 TYR A 112 -0.238 1.126 2.133 1.00 24.35 H new ATOM 0 HH TYR A 112 -2.689 2.266 2.113 1.00 75.00 H new ATOM 1861 N MET A 113 -0.438 0.202 -5.062 1.00 42.41 N ATOM 1862 CA MET A 113 -1.338 0.843 -6.026 1.00 74.32 C ATOM 1863 C MET A 113 -2.454 -0.106 -6.497 1.00 44.22 C ATOM 1864 O MET A 113 -3.599 0.307 -6.681 1.00 43.02 O ATOM 1865 CB MET A 113 -0.528 1.326 -7.234 1.00 44.32 C ATOM 1866 CG MET A 113 -1.337 2.122 -8.252 1.00 65.13 C ATOM 1867 SD MET A 113 -0.361 2.578 -9.700 1.00 21.52 S ATOM 1868 CE MET A 113 0.980 3.479 -8.926 1.00 73.41 C ATOM 0 H MET A 113 0.542 0.206 -5.346 1.00 42.41 H new ATOM 0 HA MET A 113 -1.814 1.687 -5.527 1.00 74.32 H new ATOM 0 HB2 MET A 113 0.298 1.943 -6.880 1.00 44.32 H new ATOM 0 HB3 MET A 113 -0.089 0.461 -7.732 1.00 44.32 H new ATOM 0 HG2 MET A 113 -2.198 1.533 -8.568 1.00 65.13 H new ATOM 0 HG3 MET A 113 -1.724 3.025 -7.779 1.00 65.13 H new ATOM 0 HE1 MET A 113 1.930 3.150 -9.347 1.00 73.41 H new ATOM 0 HE2 MET A 113 0.853 4.546 -9.106 1.00 73.41 H new ATOM 0 HE3 MET A 113 0.974 3.289 -7.853 1.00 73.41 H new ATOM 1878 N LYS A 114 -2.109 -1.376 -6.690 1.00 40.20 N ATOM 1879 CA LYS A 114 -3.064 -2.372 -7.189 1.00 4.53 C ATOM 1880 C LYS A 114 -4.120 -2.753 -6.138 1.00 64.23 C ATOM 1881 O LYS A 114 -5.318 -2.773 -6.425 1.00 25.13 O ATOM 1882 CB LYS A 114 -2.320 -3.642 -7.630 1.00 51.22 C ATOM 1883 CG LYS A 114 -1.339 -3.432 -8.778 1.00 53.55 C ATOM 1884 CD LYS A 114 -0.636 -4.732 -9.168 1.00 4.43 C ATOM 1885 CE LYS A 114 -1.633 -5.815 -9.577 1.00 11.30 C ATOM 1886 NZ LYS A 114 -0.957 -7.068 -10.014 1.00 65.34 N ATOM 0 H LYS A 114 -1.175 -1.744 -6.509 1.00 40.20 H new ATOM 0 HA LYS A 114 -3.579 -1.918 -8.035 1.00 4.53 H new ATOM 0 HB2 LYS A 114 -1.778 -4.046 -6.775 1.00 51.22 H new ATOM 0 HB3 LYS A 114 -3.052 -4.393 -7.927 1.00 51.22 H new ATOM 0 HG2 LYS A 114 -1.870 -3.033 -9.642 1.00 53.55 H new ATOM 0 HG3 LYS A 114 -0.596 -2.689 -8.490 1.00 53.55 H new ATOM 0 HD2 LYS A 114 0.051 -4.541 -9.992 1.00 4.43 H new ATOM 0 HD3 LYS A 114 -0.037 -5.087 -8.329 1.00 4.43 H new ATOM 0 HE2 LYS A 114 -2.293 -6.034 -8.738 1.00 11.30 H new ATOM 0 HE3 LYS A 114 -2.260 -5.442 -10.386 1.00 11.30 H new ATOM 0 HZ1 LYS A 114 -1.673 -7.773 -10.282 1.00 65.34 H new ATOM 0 HZ2 LYS A 114 -0.347 -6.866 -10.832 1.00 65.34 H new ATOM 0 HZ3 LYS A 114 -0.379 -7.441 -9.234 1.00 65.34 H new ATOM 1900 N TYR A 115 -3.668 -3.062 -4.923 1.00 3.24 N ATOM 1901 CA TYR A 115 -4.539 -3.682 -3.910 1.00 44.34 C ATOM 1902 C TYR A 115 -5.000 -2.697 -2.814 1.00 74.33 C ATOM 1903 O TYR A 115 -6.187 -2.618 -2.500 1.00 20.04 O ATOM 1904 CB TYR A 115 -3.810 -4.878 -3.271 1.00 13.21 C ATOM 1905 CG TYR A 115 -3.273 -5.873 -4.291 1.00 50.21 C ATOM 1906 CD1 TYR A 115 -4.080 -6.886 -4.801 1.00 4.13 C ATOM 1907 CD2 TYR A 115 -1.964 -5.786 -4.753 1.00 12.53 C ATOM 1908 CE1 TYR A 115 -3.597 -7.779 -5.741 1.00 3.12 C ATOM 1909 CE2 TYR A 115 -1.475 -6.676 -5.689 1.00 52.10 C ATOM 1910 CZ TYR A 115 -2.293 -7.669 -6.181 1.00 33.42 C ATOM 1911 OH TYR A 115 -1.808 -8.551 -7.124 1.00 53.25 O ATOM 0 H TYR A 115 -2.711 -2.897 -4.612 1.00 3.24 H new ATOM 0 HA TYR A 115 -5.441 -4.014 -4.424 1.00 44.34 H new ATOM 0 HB2 TYR A 115 -2.983 -4.508 -2.665 1.00 13.21 H new ATOM 0 HB3 TYR A 115 -4.494 -5.393 -2.597 1.00 13.21 H new ATOM 0 HD1 TYR A 115 -5.100 -6.976 -4.457 1.00 4.13 H new ATOM 0 HD2 TYR A 115 -1.318 -5.008 -4.373 1.00 12.53 H new ATOM 0 HE1 TYR A 115 -4.237 -8.558 -6.129 1.00 3.12 H new ATOM 0 HE2 TYR A 115 -0.455 -6.594 -6.034 1.00 52.10 H new ATOM 0 HH TYR A 115 -0.874 -8.334 -7.325 1.00 53.25 H new ATOM 1921 N LEU A 116 -4.065 -1.944 -2.241 1.00 14.13 N ATOM 1922 CA LEU A 116 -4.354 -1.127 -1.049 1.00 3.21 C ATOM 1923 C LEU A 116 -4.786 0.311 -1.392 1.00 3.21 C ATOM 1924 O LEU A 116 -5.424 0.988 -0.581 1.00 73.34 O ATOM 1925 CB LEU A 116 -3.119 -1.103 -0.142 1.00 25.42 C ATOM 1926 CG LEU A 116 -2.659 -2.484 0.360 1.00 65.32 C ATOM 1927 CD1 LEU A 116 -1.317 -2.381 1.076 1.00 11.43 C ATOM 1928 CD2 LEU A 116 -3.709 -3.100 1.281 1.00 43.10 C ATOM 0 H LEU A 116 -3.103 -1.877 -2.575 1.00 14.13 H new ATOM 0 HA LEU A 116 -5.197 -1.589 -0.535 1.00 3.21 H new ATOM 0 HB2 LEU A 116 -2.296 -0.637 -0.684 1.00 25.42 H new ATOM 0 HB3 LEU A 116 -3.331 -0.471 0.720 1.00 25.42 H new ATOM 0 HG LEU A 116 -2.536 -3.134 -0.506 1.00 65.32 H new ATOM 0 HD11 LEU A 116 -1.012 -3.369 1.422 1.00 11.43 H new ATOM 0 HD12 LEU A 116 -0.567 -1.990 0.389 1.00 11.43 H new ATOM 0 HD13 LEU A 116 -1.411 -1.711 1.930 1.00 11.43 H new ATOM 0 HD21 LEU A 116 -3.364 -4.075 1.625 1.00 43.10 H new ATOM 0 HD22 LEU A 116 -3.867 -2.448 2.140 1.00 43.10 H new ATOM 0 HD23 LEU A 116 -4.646 -3.217 0.737 1.00 43.10 H new ATOM 1940 N TYR A 117 -4.450 0.767 -2.597 1.00 74.23 N ATOM 1941 CA TYR A 117 -4.729 2.152 -3.015 1.00 62.22 C ATOM 1942 C TYR A 117 -6.236 2.501 -2.968 1.00 33.34 C ATOM 1943 O TYR A 117 -6.606 3.551 -2.436 1.00 3.11 O ATOM 1944 CB TYR A 117 -4.160 2.410 -4.418 1.00 12.41 C ATOM 1945 CG TYR A 117 -4.306 3.843 -4.900 1.00 32.11 C ATOM 1946 CD1 TYR A 117 -3.645 4.884 -4.256 1.00 45.44 C ATOM 1947 CD2 TYR A 117 -5.103 4.153 -5.999 1.00 61.22 C ATOM 1948 CE1 TYR A 117 -3.772 6.190 -4.693 1.00 23.15 C ATOM 1949 CE2 TYR A 117 -5.234 5.456 -6.442 1.00 61.03 C ATOM 1950 CZ TYR A 117 -4.566 6.472 -5.785 1.00 34.45 C ATOM 1951 OH TYR A 117 -4.696 7.771 -6.223 1.00 65.43 O ATOM 0 H TYR A 117 -3.983 0.202 -3.307 1.00 74.23 H new ATOM 0 HA TYR A 117 -4.234 2.806 -2.298 1.00 62.22 H new ATOM 0 HB2 TYR A 117 -3.103 2.144 -4.423 1.00 12.41 H new ATOM 0 HB3 TYR A 117 -4.659 1.749 -5.126 1.00 12.41 H new ATOM 0 HD1 TYR A 117 -3.022 4.669 -3.400 1.00 45.44 H new ATOM 0 HD2 TYR A 117 -5.628 3.362 -6.514 1.00 61.22 H new ATOM 0 HE1 TYR A 117 -3.251 6.986 -4.181 1.00 23.15 H new ATOM 0 HE2 TYR A 117 -5.855 5.679 -7.297 1.00 61.03 H new ATOM 0 HH TYR A 117 -5.290 7.796 -7.002 1.00 65.43 H new ATOM 1961 N PRO A 118 -7.135 1.644 -3.519 1.00 34.22 N ATOM 1962 CA PRO A 118 -8.590 1.895 -3.470 1.00 3.22 C ATOM 1963 C PRO A 118 -9.111 2.116 -2.036 1.00 71.43 C ATOM 1964 O PRO A 118 -10.012 2.928 -1.808 1.00 5.22 O ATOM 1965 CB PRO A 118 -9.204 0.619 -4.079 1.00 1.02 C ATOM 1966 CG PRO A 118 -8.107 -0.394 -4.069 1.00 32.43 C ATOM 1967 CD PRO A 118 -6.834 0.387 -4.233 1.00 2.40 C ATOM 0 HA PRO A 118 -8.855 2.807 -4.006 1.00 3.22 H new ATOM 0 HB2 PRO A 118 -10.059 0.278 -3.496 1.00 1.02 H new ATOM 0 HB3 PRO A 118 -9.562 0.800 -5.093 1.00 1.02 H new ATOM 0 HG2 PRO A 118 -8.103 -0.958 -3.136 1.00 32.43 H new ATOM 0 HG3 PRO A 118 -8.232 -1.115 -4.877 1.00 32.43 H new ATOM 0 HD2 PRO A 118 -5.980 -0.132 -3.798 1.00 2.40 H new ATOM 0 HD3 PRO A 118 -6.598 0.563 -5.283 1.00 2.40 H new ATOM 1975 N TYR A 119 -8.534 1.392 -1.075 1.00 14.22 N ATOM 1976 CA TYR A 119 -8.944 1.498 0.331 1.00 62.44 C ATOM 1977 C TYR A 119 -8.450 2.820 0.944 1.00 35.31 C ATOM 1978 O TYR A 119 -9.204 3.514 1.634 1.00 54.54 O ATOM 1979 CB TYR A 119 -8.409 0.297 1.132 1.00 21.41 C ATOM 1980 CG TYR A 119 -9.093 0.093 2.477 1.00 23.32 C ATOM 1981 CD1 TYR A 119 -8.684 0.794 3.606 1.00 33.35 C ATOM 1982 CD2 TYR A 119 -10.150 -0.807 2.617 1.00 34.21 C ATOM 1983 CE1 TYR A 119 -9.302 0.609 4.827 1.00 25.21 C ATOM 1984 CE2 TYR A 119 -10.771 -0.998 3.838 1.00 11.32 C ATOM 1985 CZ TYR A 119 -10.344 -0.288 4.938 1.00 23.40 C ATOM 1986 OH TYR A 119 -10.961 -0.471 6.156 1.00 62.53 O ATOM 0 H TYR A 119 -7.781 0.725 -1.243 1.00 14.22 H new ATOM 0 HA TYR A 119 -10.033 1.490 0.376 1.00 62.44 H new ATOM 0 HB2 TYR A 119 -8.529 -0.607 0.535 1.00 21.41 H new ATOM 0 HB3 TYR A 119 -7.340 0.431 1.297 1.00 21.41 H new ATOM 0 HD1 TYR A 119 -7.868 1.496 3.527 1.00 33.35 H new ATOM 0 HD2 TYR A 119 -10.489 -1.364 1.756 1.00 34.21 H new ATOM 0 HE1 TYR A 119 -8.971 1.165 5.692 1.00 25.21 H new ATOM 0 HE2 TYR A 119 -11.587 -1.700 3.928 1.00 11.32 H new ATOM 0 HH TYR A 119 -11.676 -1.135 6.064 1.00 62.53 H new ATOM 1996 N GLU A 120 -7.185 3.167 0.678 1.00 41.41 N ATOM 1997 CA GLU A 120 -6.607 4.434 1.151 1.00 70.33 C ATOM 1998 C GLU A 120 -7.432 5.622 0.634 1.00 51.30 C ATOM 1999 O GLU A 120 -7.861 6.478 1.408 1.00 44.34 O ATOM 2000 CB GLU A 120 -5.132 4.550 0.696 1.00 20.13 C ATOM 2001 CG GLU A 120 -4.307 5.635 1.412 1.00 34.34 C ATOM 2002 CD GLU A 120 -4.289 6.992 0.703 1.00 60.22 C ATOM 2003 OE1 GLU A 120 -5.258 7.765 0.861 1.00 41.24 O ATOM 2004 OE2 GLU A 120 -3.287 7.300 0.010 1.00 65.03 O ATOM 0 H GLU A 120 -6.541 2.589 0.138 1.00 41.41 H new ATOM 0 HA GLU A 120 -6.633 4.449 2.241 1.00 70.33 H new ATOM 0 HB2 GLU A 120 -4.645 3.587 0.848 1.00 20.13 H new ATOM 0 HB3 GLU A 120 -5.114 4.751 -0.375 1.00 20.13 H new ATOM 0 HG2 GLU A 120 -4.704 5.770 2.418 1.00 34.34 H new ATOM 0 HG3 GLU A 120 -3.281 5.282 1.519 1.00 34.34 H new ATOM 2011 N CYS A 121 -7.678 5.642 -0.676 1.00 60.25 N ATOM 2012 CA CYS A 121 -8.469 6.706 -1.310 1.00 50.52 C ATOM 2013 C CYS A 121 -9.876 6.828 -0.703 1.00 32.31 C ATOM 2014 O CYS A 121 -10.362 7.934 -0.458 1.00 42.02 O ATOM 2015 CB CYS A 121 -8.594 6.451 -2.818 1.00 33.40 C ATOM 2016 SG CYS A 121 -7.029 6.529 -3.721 1.00 54.13 S ATOM 0 H CYS A 121 -7.340 4.931 -1.325 1.00 60.25 H new ATOM 0 HA CYS A 121 -7.940 7.642 -1.129 1.00 50.52 H new ATOM 0 HB2 CYS A 121 -9.040 5.468 -2.972 1.00 33.40 H new ATOM 0 HB3 CYS A 121 -9.281 7.183 -3.242 1.00 33.40 H new ATOM 0 HG CYS A 121 -7.112 5.803 -4.796 1.00 54.13 H new ATOM 2022 N GLU A 122 -10.523 5.688 -0.462 1.00 74.12 N ATOM 2023 CA GLU A 122 -11.907 5.672 0.029 1.00 22.21 C ATOM 2024 C GLU A 122 -12.011 6.151 1.488 1.00 20.42 C ATOM 2025 O GLU A 122 -12.754 7.082 1.796 1.00 51.12 O ATOM 2026 CB GLU A 122 -12.497 4.258 -0.088 1.00 23.12 C ATOM 2027 CG GLU A 122 -13.987 4.177 0.243 1.00 0.01 C ATOM 2028 CD GLU A 122 -14.868 4.821 -0.821 1.00 32.11 C ATOM 2029 OE1 GLU A 122 -14.963 6.068 -0.859 1.00 65.15 O ATOM 2030 OE2 GLU A 122 -15.462 4.083 -1.638 1.00 55.11 O ATOM 0 H GLU A 122 -10.115 4.763 -0.597 1.00 74.12 H new ATOM 0 HA GLU A 122 -12.475 6.364 -0.593 1.00 22.21 H new ATOM 0 HB2 GLU A 122 -12.340 3.893 -1.103 1.00 23.12 H new ATOM 0 HB3 GLU A 122 -11.950 3.591 0.579 1.00 23.12 H new ATOM 0 HG2 GLU A 122 -14.272 3.131 0.359 1.00 0.01 H new ATOM 0 HG3 GLU A 122 -14.168 4.665 1.201 1.00 0.01 H new ATOM 2037 N LYS A 123 -11.262 5.507 2.381 1.00 11.33 N ATOM 2038 CA LYS A 123 -11.357 5.786 3.822 1.00 64.01 C ATOM 2039 C LYS A 123 -10.577 7.048 4.226 1.00 62.25 C ATOM 2040 O LYS A 123 -10.974 7.760 5.149 1.00 64.25 O ATOM 2041 CB LYS A 123 -10.853 4.579 4.622 1.00 65.23 C ATOM 2042 CG LYS A 123 -11.639 3.295 4.362 1.00 4.30 C ATOM 2043 CD LYS A 123 -13.095 3.412 4.813 1.00 61.43 C ATOM 2044 CE LYS A 123 -13.872 2.123 4.560 1.00 25.44 C ATOM 2045 NZ LYS A 123 -15.264 2.205 5.079 1.00 40.01 N ATOM 0 H LYS A 123 -10.581 4.788 2.137 1.00 11.33 H new ATOM 0 HA LYS A 123 -12.407 5.968 4.050 1.00 64.01 H new ATOM 0 HB2 LYS A 123 -9.804 4.407 4.380 1.00 65.23 H new ATOM 0 HB3 LYS A 123 -10.901 4.814 5.685 1.00 65.23 H new ATOM 0 HG2 LYS A 123 -11.607 3.060 3.298 1.00 4.30 H new ATOM 0 HG3 LYS A 123 -11.163 2.466 4.886 1.00 4.30 H new ATOM 0 HD2 LYS A 123 -13.128 3.654 5.875 1.00 61.43 H new ATOM 0 HD3 LYS A 123 -13.574 4.235 4.284 1.00 61.43 H new ATOM 0 HE2 LYS A 123 -13.895 1.917 3.490 1.00 25.44 H new ATOM 0 HE3 LYS A 123 -13.356 1.289 5.035 1.00 25.44 H new ATOM 0 HZ1 LYS A 123 -15.759 1.311 4.888 1.00 40.01 H new ATOM 0 HZ2 LYS A 123 -15.243 2.377 6.104 1.00 40.01 H new ATOM 0 HZ3 LYS A 123 -15.765 2.985 4.608 1.00 40.01 H new ATOM 2059 N ARG A 124 -9.468 7.316 3.541 1.00 64.12 N ATOM 2060 CA ARG A 124 -8.632 8.490 3.836 1.00 72.45 C ATOM 2061 C ARG A 124 -8.670 9.526 2.700 1.00 32.34 C ATOM 2062 O ARG A 124 -9.324 10.568 2.814 1.00 4.44 O ATOM 2063 CB ARG A 124 -7.180 8.059 4.098 1.00 30.42 C ATOM 2064 CG ARG A 124 -6.958 7.393 5.452 1.00 33.31 C ATOM 2065 CD ARG A 124 -7.158 8.380 6.601 1.00 30.23 C ATOM 2066 NE ARG A 124 -6.849 7.783 7.896 1.00 1.14 N ATOM 2067 CZ ARG A 124 -6.461 8.459 8.943 1.00 62.05 C ATOM 2068 NH1 ARG A 124 -6.306 9.745 8.881 1.00 51.11 N ATOM 2069 NH2 ARG A 124 -6.224 7.837 10.051 1.00 0.20 N ATOM 0 H ARG A 124 -9.122 6.738 2.775 1.00 64.12 H new ATOM 0 HA ARG A 124 -9.041 8.961 4.730 1.00 72.45 H new ATOM 0 HB2 ARG A 124 -6.870 7.370 3.312 1.00 30.42 H new ATOM 0 HB3 ARG A 124 -6.535 8.935 4.027 1.00 30.42 H new ATOM 0 HG2 ARG A 124 -7.648 6.557 5.565 1.00 33.31 H new ATOM 0 HG3 ARG A 124 -5.949 6.982 5.495 1.00 33.31 H new ATOM 0 HD2 ARG A 124 -6.524 9.252 6.444 1.00 30.23 H new ATOM 0 HD3 ARG A 124 -8.190 8.732 6.601 1.00 30.23 H new ATOM 0 HE ARG A 124 -6.942 6.772 7.989 1.00 1.14 H new ATOM 0 HH11 ARG A 124 -6.488 10.239 8.007 1.00 51.11 H new ATOM 0 HH12 ARG A 124 -6.002 10.262 9.706 1.00 51.11 H new ATOM 0 HH21 ARG A 124 -6.341 6.825 10.103 1.00 0.20 H new ATOM 0 HH22 ARG A 124 -5.920 8.358 10.874 1.00 0.20 H new ATOM 2083 N GLY A 125 -7.972 9.236 1.604 1.00 12.31 N ATOM 2084 CA GLY A 125 -7.829 10.204 0.522 1.00 32.41 C ATOM 2085 C GLY A 125 -6.577 11.063 0.683 1.00 44.24 C ATOM 2086 O GLY A 125 -6.549 12.229 0.278 1.00 0.55 O ATOM 0 H GLY A 125 -7.501 8.346 1.443 1.00 12.31 H new ATOM 0 HA2 GLY A 125 -7.787 9.678 -0.432 1.00 32.41 H new ATOM 0 HA3 GLY A 125 -8.708 10.847 0.493 1.00 32.41 H new ATOM 2090 N LEU A 126 -5.539 10.479 1.276 1.00 22.42 N ATOM 2091 CA LEU A 126 -4.275 11.178 1.527 1.00 53.25 C ATOM 2092 C LEU A 126 -3.532 11.471 0.218 1.00 53.34 C ATOM 2093 O LEU A 126 -2.799 12.459 0.111 1.00 44.23 O ATOM 2094 CB LEU A 126 -3.388 10.332 2.453 1.00 54.43 C ATOM 2095 CG LEU A 126 -3.973 10.048 3.848 1.00 73.31 C ATOM 2096 CD1 LEU A 126 -3.096 9.061 4.618 1.00 43.42 C ATOM 2097 CD2 LEU A 126 -4.140 11.347 4.637 1.00 73.31 C ATOM 0 H LEU A 126 -5.547 9.511 1.596 1.00 22.42 H new ATOM 0 HA LEU A 126 -4.502 12.130 2.007 1.00 53.25 H new ATOM 0 HB2 LEU A 126 -3.184 9.380 1.963 1.00 54.43 H new ATOM 0 HB3 LEU A 126 -2.431 10.840 2.575 1.00 54.43 H new ATOM 0 HG LEU A 126 -4.956 9.596 3.716 1.00 73.31 H new ATOM 0 HD11 LEU A 126 -3.531 8.877 5.600 1.00 43.42 H new ATOM 0 HD12 LEU A 126 -3.034 8.123 4.067 1.00 43.42 H new ATOM 0 HD13 LEU A 126 -2.096 9.478 4.737 1.00 43.42 H new ATOM 0 HD21 LEU A 126 -4.555 11.125 5.620 1.00 73.31 H new ATOM 0 HD22 LEU A 126 -3.170 11.829 4.753 1.00 73.31 H new ATOM 0 HD23 LEU A 126 -4.815 12.014 4.101 1.00 73.31 H new ATOM 2109 N SER A 127 -3.713 10.602 -0.773 1.00 43.51 N ATOM 2110 CA SER A 127 -3.100 10.799 -2.093 1.00 22.04 C ATOM 2111 C SER A 127 -4.163 10.941 -3.189 1.00 52.42 C ATOM 2112 O SER A 127 -5.290 10.458 -3.051 1.00 64.15 O ATOM 2113 CB SER A 127 -2.174 9.630 -2.449 1.00 74.15 C ATOM 2114 OG SER A 127 -1.379 9.228 -1.345 1.00 65.31 O ATOM 0 H SER A 127 -4.277 9.756 -0.692 1.00 43.51 H new ATOM 0 HA SER A 127 -2.520 11.720 -2.038 1.00 22.04 H new ATOM 0 HB2 SER A 127 -2.772 8.785 -2.792 1.00 74.15 H new ATOM 0 HB3 SER A 127 -1.526 9.919 -3.276 1.00 74.15 H new ATOM 0 HG SER A 127 -1.879 8.587 -0.798 1.00 65.31 H new ATOM 2120 N ASN A 128 -3.797 11.608 -4.278 1.00 44.44 N ATOM 2121 CA ASN A 128 -4.681 11.749 -5.440 1.00 52.32 C ATOM 2122 C ASN A 128 -4.119 10.982 -6.651 1.00 62.35 C ATOM 2123 O ASN A 128 -2.904 10.849 -6.801 1.00 24.32 O ATOM 2124 CB ASN A 128 -4.842 13.228 -5.808 1.00 24.31 C ATOM 2125 CG ASN A 128 -5.291 14.086 -4.637 1.00 55.43 C ATOM 2126 OD1 ASN A 128 -6.480 14.264 -4.402 1.00 11.42 O ATOM 2127 ND2 ASN A 128 -4.346 14.622 -3.895 1.00 2.04 N ATOM 0 H ASN A 128 -2.891 12.063 -4.385 1.00 44.44 H new ATOM 0 HA ASN A 128 -5.653 11.331 -5.176 1.00 52.32 H new ATOM 0 HB2 ASN A 128 -3.893 13.608 -6.187 1.00 24.31 H new ATOM 0 HB3 ASN A 128 -5.567 13.319 -6.617 1.00 24.31 H new ATOM 0 HD21 ASN A 128 -4.594 15.206 -3.096 1.00 2.04 H new ATOM 0 HD22 ASN A 128 -3.365 14.454 -4.118 1.00 2.04 H new ATOM 2134 N PRO A 129 -4.992 10.477 -7.542 1.00 2.45 N ATOM 2135 CA PRO A 129 -4.556 9.789 -8.772 1.00 71.43 C ATOM 2136 C PRO A 129 -3.815 10.731 -9.736 1.00 74.53 C ATOM 2137 O PRO A 129 -3.040 10.288 -10.587 1.00 75.12 O ATOM 2138 CB PRO A 129 -5.873 9.294 -9.393 1.00 44.51 C ATOM 2139 CG PRO A 129 -6.921 10.188 -8.821 1.00 4.24 C ATOM 2140 CD PRO A 129 -6.463 10.520 -7.428 1.00 71.10 C ATOM 0 HA PRO A 129 -3.847 8.988 -8.564 1.00 71.43 H new ATOM 0 HB2 PRO A 129 -5.847 9.360 -10.481 1.00 44.51 H new ATOM 0 HB3 PRO A 129 -6.062 8.251 -9.141 1.00 44.51 H new ATOM 0 HG2 PRO A 129 -7.034 11.091 -9.421 1.00 4.24 H new ATOM 0 HG3 PRO A 129 -7.892 9.692 -8.805 1.00 4.24 H new ATOM 0 HD2 PRO A 129 -6.815 11.502 -7.111 1.00 71.10 H new ATOM 0 HD3 PRO A 129 -6.832 9.799 -6.699 1.00 71.10 H new ATOM 2148 N ASN A 130 -4.052 12.036 -9.585 1.00 34.41 N ATOM 2149 CA ASN A 130 -3.393 13.051 -10.415 1.00 65.13 C ATOM 2150 C ASN A 130 -1.923 13.231 -9.996 1.00 72.52 C ATOM 2151 O ASN A 130 -1.011 13.055 -10.805 1.00 51.50 O ATOM 2152 CB ASN A 130 -4.142 14.387 -10.323 1.00 0.34 C ATOM 2153 CG ASN A 130 -5.645 14.211 -10.465 1.00 23.33 C ATOM 2154 OD1 ASN A 130 -6.172 14.140 -11.569 1.00 53.30 O ATOM 2155 ND2 ASN A 130 -6.352 14.166 -9.351 1.00 43.30 N ATOM 0 H ASN A 130 -4.698 12.417 -8.893 1.00 34.41 H new ATOM 0 HA ASN A 130 -3.414 12.710 -11.450 1.00 65.13 H new ATOM 0 HB2 ASN A 130 -3.922 14.860 -9.366 1.00 0.34 H new ATOM 0 HB3 ASN A 130 -3.781 15.059 -11.102 1.00 0.34 H new ATOM 0 HD21 ASN A 130 -7.367 14.070 -9.394 1.00 43.30 H new ATOM 0 HD22 ASN A 130 -5.884 14.228 -8.447 1.00 43.30 H new ATOM 2162 N GLU A 131 -1.702 13.580 -8.724 1.00 40.13 N ATOM 2163 CA GLU A 131 -0.341 13.723 -8.183 1.00 60.33 C ATOM 2164 C GLU A 131 0.442 12.404 -8.293 1.00 23.04 C ATOM 2165 O GLU A 131 1.656 12.407 -8.492 1.00 50.43 O ATOM 2166 CB GLU A 131 -0.380 14.197 -6.719 1.00 63.13 C ATOM 2167 CG GLU A 131 -0.965 13.186 -5.736 1.00 43.45 C ATOM 2168 CD GLU A 131 -0.839 13.638 -4.289 1.00 70.43 C ATOM 2169 OE1 GLU A 131 0.245 14.123 -3.902 1.00 3.24 O ATOM 2170 OE2 GLU A 131 -1.823 13.515 -3.538 1.00 72.22 O ATOM 0 H GLU A 131 -2.444 13.769 -8.050 1.00 40.13 H new ATOM 0 HA GLU A 131 0.173 14.477 -8.779 1.00 60.33 H new ATOM 0 HB2 GLU A 131 0.634 14.444 -6.404 1.00 63.13 H new ATOM 0 HB3 GLU A 131 -0.964 15.116 -6.664 1.00 63.13 H new ATOM 0 HG2 GLU A 131 -2.017 13.022 -5.972 1.00 43.45 H new ATOM 0 HG3 GLU A 131 -0.458 12.229 -5.860 1.00 43.45 H new ATOM 2177 N LEU A 132 -0.269 11.281 -8.165 1.00 33.54 N ATOM 2178 CA LEU A 132 0.329 9.946 -8.304 1.00 30.11 C ATOM 2179 C LEU A 132 1.168 9.825 -9.587 1.00 62.22 C ATOM 2180 O LEU A 132 2.323 9.399 -9.550 1.00 63.52 O ATOM 2181 CB LEU A 132 -0.778 8.878 -8.298 1.00 75.21 C ATOM 2182 CG LEU A 132 -0.306 7.418 -8.435 1.00 14.45 C ATOM 2183 CD1 LEU A 132 0.620 7.030 -7.285 1.00 73.11 C ATOM 2184 CD2 LEU A 132 -1.505 6.473 -8.503 1.00 43.32 C ATOM 0 H LEU A 132 -1.269 11.268 -7.963 1.00 33.54 H new ATOM 0 HA LEU A 132 0.998 9.790 -7.457 1.00 30.11 H new ATOM 0 HB2 LEU A 132 -1.341 8.972 -7.369 1.00 75.21 H new ATOM 0 HB3 LEU A 132 -1.469 9.094 -9.113 1.00 75.21 H new ATOM 0 HG LEU A 132 0.258 7.330 -9.364 1.00 14.45 H new ATOM 0 HD11 LEU A 132 0.938 5.995 -7.407 1.00 73.11 H new ATOM 0 HD12 LEU A 132 1.495 7.681 -7.287 1.00 73.11 H new ATOM 0 HD13 LEU A 132 0.090 7.137 -6.339 1.00 73.11 H new ATOM 0 HD21 LEU A 132 -1.154 5.446 -8.600 1.00 43.32 H new ATOM 0 HD22 LEU A 132 -2.097 6.570 -7.593 1.00 43.32 H new ATOM 0 HD23 LEU A 132 -2.121 6.728 -9.365 1.00 43.32 H new ATOM 2196 N GLN A 133 0.585 10.216 -10.719 1.00 4.32 N ATOM 2197 CA GLN A 133 1.278 10.137 -12.010 1.00 14.33 C ATOM 2198 C GLN A 133 2.502 11.071 -12.046 1.00 33.21 C ATOM 2199 O GLN A 133 3.521 10.751 -12.660 1.00 62.00 O ATOM 2200 CB GLN A 133 0.311 10.473 -13.154 1.00 23.53 C ATOM 2201 CG GLN A 133 0.905 10.288 -14.550 1.00 23.23 C ATOM 2202 CD GLN A 133 1.439 8.881 -14.781 1.00 43.22 C ATOM 2203 OE1 GLN A 133 0.712 7.987 -15.201 1.00 51.13 O ATOM 2204 NE2 GLN A 133 2.715 8.675 -14.515 1.00 64.43 N ATOM 0 H GLN A 133 -0.362 10.590 -10.772 1.00 4.32 H new ATOM 0 HA GLN A 133 1.635 9.115 -12.139 1.00 14.33 H new ATOM 0 HB2 GLN A 133 -0.575 9.845 -13.062 1.00 23.53 H new ATOM 0 HB3 GLN A 133 -0.018 11.506 -13.045 1.00 23.53 H new ATOM 0 HG2 GLN A 133 0.143 10.510 -15.297 1.00 23.23 H new ATOM 0 HG3 GLN A 133 1.712 11.006 -14.695 1.00 23.23 H new ATOM 0 HE21 GLN A 133 3.293 9.440 -14.167 1.00 64.43 H new ATOM 0 HE22 GLN A 133 3.123 7.751 -14.658 1.00 64.43 H new ATOM 2213 N ALA A 134 2.394 12.218 -11.378 1.00 41.41 N ATOM 2214 CA ALA A 134 3.507 13.169 -11.279 1.00 5.14 C ATOM 2215 C ALA A 134 4.663 12.583 -10.450 1.00 11.01 C ATOM 2216 O ALA A 134 5.839 12.735 -10.795 1.00 34.33 O ATOM 2217 CB ALA A 134 3.017 14.473 -10.663 1.00 52.24 C ATOM 0 H ALA A 134 1.546 12.515 -10.895 1.00 41.41 H new ATOM 0 HA ALA A 134 3.884 13.367 -12.282 1.00 5.14 H new ATOM 0 HB1 ALA A 134 3.847 15.176 -10.591 1.00 52.24 H new ATOM 0 HB2 ALA A 134 2.233 14.899 -11.289 1.00 52.24 H new ATOM 0 HB3 ALA A 134 2.620 14.278 -9.667 1.00 52.24 H new ATOM 2223 N ALA A 135 4.313 11.908 -9.355 1.00 34.34 N ATOM 2224 CA ALA A 135 5.294 11.215 -8.513 1.00 33.10 C ATOM 2225 C ALA A 135 6.070 10.165 -9.319 1.00 31.01 C ATOM 2226 O ALA A 135 7.304 10.144 -9.331 1.00 73.43 O ATOM 2227 CB ALA A 135 4.590 10.546 -7.337 1.00 71.03 C ATOM 0 H ALA A 135 3.351 11.825 -9.027 1.00 34.34 H new ATOM 0 HA ALA A 135 6.003 11.954 -8.140 1.00 33.10 H new ATOM 0 HB1 ALA A 135 5.325 10.034 -6.717 1.00 71.03 H new ATOM 0 HB2 ALA A 135 4.077 11.302 -6.742 1.00 71.03 H new ATOM 0 HB3 ALA A 135 3.864 9.824 -7.711 1.00 71.03 H new ATOM 2233 N ILE A 136 5.323 9.300 -10.000 1.00 23.54 N ATOM 2234 CA ILE A 136 5.902 8.226 -10.817 1.00 14.24 C ATOM 2235 C ILE A 136 6.735 8.782 -11.985 1.00 5.34 C ATOM 2236 O ILE A 136 7.797 8.249 -12.310 1.00 14.41 O ATOM 2237 CB ILE A 136 4.781 7.306 -11.355 1.00 73.01 C ATOM 2238 CG1 ILE A 136 3.957 6.762 -10.177 1.00 40.23 C ATOM 2239 CG2 ILE A 136 5.363 6.161 -12.190 1.00 30.52 C ATOM 2240 CD1 ILE A 136 2.663 6.103 -10.588 1.00 21.51 C ATOM 0 H ILE A 136 4.303 9.319 -10.004 1.00 23.54 H new ATOM 0 HA ILE A 136 6.571 7.649 -10.179 1.00 14.24 H new ATOM 0 HB ILE A 136 4.129 7.887 -12.008 1.00 73.01 H new ATOM 0 HG12 ILE A 136 4.561 6.041 -9.626 1.00 40.23 H new ATOM 0 HG13 ILE A 136 3.735 7.581 -9.493 1.00 40.23 H new ATOM 0 HG21 ILE A 136 4.553 5.530 -12.556 1.00 30.52 H new ATOM 0 HG22 ILE A 136 5.914 6.571 -13.036 1.00 30.52 H new ATOM 0 HG23 ILE A 136 6.036 5.566 -11.573 1.00 30.52 H new ATOM 0 HD11 ILE A 136 2.139 5.745 -9.702 1.00 21.51 H new ATOM 0 HD12 ILE A 136 2.037 6.825 -11.112 1.00 21.51 H new ATOM 0 HD13 ILE A 136 2.877 5.262 -11.247 1.00 21.51 H new ATOM 2252 N ASP A 137 6.251 9.859 -12.606 1.00 42.11 N ATOM 2253 CA ASP A 137 7.005 10.556 -13.655 1.00 54.31 C ATOM 2254 C ASP A 137 8.405 10.929 -13.137 1.00 51.14 C ATOM 2255 O ASP A 137 9.419 10.691 -13.798 1.00 33.04 O ATOM 2256 CB ASP A 137 6.242 11.818 -14.083 1.00 73.42 C ATOM 2257 CG ASP A 137 6.813 12.469 -15.333 1.00 4.15 C ATOM 2258 OD1 ASP A 137 7.861 13.141 -15.247 1.00 12.21 O ATOM 2259 OD2 ASP A 137 6.196 12.334 -16.411 1.00 73.31 O ATOM 0 H ASP A 137 5.340 10.269 -12.402 1.00 42.11 H new ATOM 0 HA ASP A 137 7.117 9.898 -14.517 1.00 54.31 H new ATOM 0 HB2 ASP A 137 5.198 11.561 -14.260 1.00 73.42 H new ATOM 0 HB3 ASP A 137 6.258 12.539 -13.266 1.00 73.42 H new ATOM 2264 N SER A 138 8.440 11.494 -11.929 1.00 74.35 N ATOM 2265 CA SER A 138 9.701 11.826 -11.257 1.00 14.23 C ATOM 2266 C SER A 138 10.531 10.563 -10.980 1.00 4.45 C ATOM 2267 O SER A 138 11.743 10.558 -11.177 1.00 10.32 O ATOM 2268 CB SER A 138 9.431 12.573 -9.942 1.00 45.43 C ATOM 2269 OG SER A 138 8.730 13.790 -10.171 1.00 4.53 O ATOM 0 H SER A 138 7.606 11.733 -11.392 1.00 74.35 H new ATOM 0 HA SER A 138 10.271 12.473 -11.923 1.00 14.23 H new ATOM 0 HB2 SER A 138 8.851 11.937 -9.273 1.00 45.43 H new ATOM 0 HB3 SER A 138 10.376 12.784 -9.441 1.00 45.43 H new ATOM 0 HG SER A 138 7.794 13.593 -10.383 1.00 4.53 H new ATOM 2275 N ASN A 139 9.867 9.484 -10.550 1.00 75.14 N ATOM 2276 CA ASN A 139 10.556 8.214 -10.250 1.00 54.25 C ATOM 2277 C ASN A 139 11.310 7.668 -11.476 1.00 5.22 C ATOM 2278 O ASN A 139 12.343 7.005 -11.337 1.00 52.13 O ATOM 2279 CB ASN A 139 9.566 7.157 -9.734 1.00 73.13 C ATOM 2280 CG ASN A 139 9.102 7.404 -8.305 1.00 62.23 C ATOM 2281 OD1 ASN A 139 8.815 6.470 -7.568 1.00 63.44 O ATOM 2282 ND2 ASN A 139 9.026 8.655 -7.894 1.00 61.04 N ATOM 0 H ASN A 139 8.858 9.460 -10.401 1.00 75.14 H new ATOM 0 HA ASN A 139 11.286 8.427 -9.469 1.00 54.25 H new ATOM 0 HB2 ASN A 139 8.696 7.134 -10.391 1.00 73.13 H new ATOM 0 HB3 ASN A 139 10.034 6.174 -9.791 1.00 73.13 H new ATOM 0 HD21 ASN A 139 8.722 8.862 -6.942 1.00 61.04 H new ATOM 0 HD22 ASN A 139 9.271 9.416 -8.528 1.00 61.04 H new ATOM 2289 N ARG A 140 10.785 7.932 -12.671 1.00 50.24 N ATOM 2290 CA ARG A 140 11.478 7.570 -13.913 1.00 52.44 C ATOM 2291 C ARG A 140 12.622 8.558 -14.188 1.00 2.42 C ATOM 2292 O ARG A 140 13.729 8.167 -14.555 1.00 24.32 O ATOM 2293 CB ARG A 140 10.504 7.568 -15.102 1.00 70.33 C ATOM 2294 CG ARG A 140 9.206 6.805 -14.847 1.00 3.24 C ATOM 2295 CD ARG A 140 8.307 6.785 -16.082 1.00 12.15 C ATOM 2296 NE ARG A 140 8.227 8.099 -16.724 1.00 31.33 N ATOM 2297 CZ ARG A 140 7.130 8.781 -16.906 1.00 14.34 C ATOM 2298 NH1 ARG A 140 5.986 8.333 -16.500 1.00 54.03 N ATOM 2299 NH2 ARG A 140 7.188 9.928 -17.495 1.00 2.24 N ATOM 0 H ARG A 140 9.886 8.393 -12.809 1.00 50.24 H new ATOM 0 HA ARG A 140 11.886 6.566 -13.793 1.00 52.44 H new ATOM 0 HB2 ARG A 140 10.262 8.599 -15.360 1.00 70.33 H new ATOM 0 HB3 ARG A 140 11.005 7.132 -15.967 1.00 70.33 H new ATOM 0 HG2 ARG A 140 9.438 5.782 -14.550 1.00 3.24 H new ATOM 0 HG3 ARG A 140 8.671 7.265 -14.016 1.00 3.24 H new ATOM 0 HD2 ARG A 140 8.688 6.055 -16.796 1.00 12.15 H new ATOM 0 HD3 ARG A 140 7.307 6.459 -15.797 1.00 12.15 H new ATOM 0 HE ARG A 140 9.098 8.514 -17.055 1.00 31.33 H new ATOM 0 HH11 ARG A 140 5.930 7.431 -16.028 1.00 54.03 H new ATOM 0 HH12 ARG A 140 5.140 8.882 -16.652 1.00 54.03 H new ATOM 0 HH21 ARG A 140 8.086 10.293 -17.813 1.00 2.24 H new ATOM 0 HH22 ARG A 140 6.336 10.469 -17.642 1.00 2.24 H new ATOM 2313 N ARG A 141 12.334 9.843 -13.985 1.00 40.34 N ATOM 2314 CA ARG A 141 13.305 10.922 -14.211 1.00 30.53 C ATOM 2315 C ARG A 141 14.541 10.778 -13.300 1.00 71.55 C ATOM 2316 O ARG A 141 15.649 11.177 -13.663 1.00 3.14 O ATOM 2317 CB ARG A 141 12.620 12.273 -13.959 1.00 21.33 C ATOM 2318 CG ARG A 141 13.400 13.481 -14.467 1.00 32.53 C ATOM 2319 CD ARG A 141 12.648 14.785 -14.213 1.00 51.03 C ATOM 2320 NE ARG A 141 11.258 14.714 -14.666 1.00 5.21 N ATOM 2321 CZ ARG A 141 10.462 15.743 -14.775 1.00 55.12 C ATOM 2322 NH1 ARG A 141 10.900 16.943 -14.569 1.00 15.13 N ATOM 2323 NH2 ARG A 141 9.224 15.567 -15.098 1.00 54.53 N ATOM 0 H ARG A 141 11.424 10.169 -13.660 1.00 40.34 H new ATOM 0 HA ARG A 141 13.652 10.863 -15.243 1.00 30.53 H new ATOM 0 HB2 ARG A 141 11.639 12.263 -14.435 1.00 21.33 H new ATOM 0 HB3 ARG A 141 12.454 12.388 -12.888 1.00 21.33 H new ATOM 0 HG2 ARG A 141 14.372 13.520 -13.975 1.00 32.53 H new ATOM 0 HG3 ARG A 141 13.587 13.371 -15.535 1.00 32.53 H new ATOM 0 HD2 ARG A 141 12.671 15.015 -13.148 1.00 51.03 H new ATOM 0 HD3 ARG A 141 13.155 15.602 -14.726 1.00 51.03 H new ATOM 0 HE ARG A 141 10.886 13.797 -14.914 1.00 5.21 H new ATOM 0 HH11 ARG A 141 11.877 17.093 -14.318 1.00 15.13 H new ATOM 0 HH12 ARG A 141 10.268 17.739 -14.657 1.00 15.13 H new ATOM 0 HH21 ARG A 141 8.870 14.626 -15.267 1.00 54.53 H new ATOM 0 HH22 ARG A 141 8.600 16.369 -15.184 1.00 54.53 H new ATOM 2337 N GLU A 142 14.332 10.205 -12.112 1.00 65.44 N ATOM 2338 CA GLU A 142 15.418 9.958 -11.150 1.00 62.45 C ATOM 2339 C GLU A 142 16.390 8.871 -11.646 1.00 3.33 C ATOM 2340 O GLU A 142 17.495 8.722 -11.116 1.00 23.03 O ATOM 2341 CB GLU A 142 14.831 9.555 -9.786 1.00 73.21 C ATOM 2342 CG GLU A 142 14.035 10.666 -9.106 1.00 32.40 C ATOM 2343 CD GLU A 142 13.322 10.204 -7.844 1.00 22.04 C ATOM 2344 OE1 GLU A 142 13.966 10.152 -6.774 1.00 0.31 O ATOM 2345 OE2 GLU A 142 12.109 9.904 -7.909 1.00 23.45 O ATOM 0 H GLU A 142 13.414 9.900 -11.788 1.00 65.44 H new ATOM 0 HA GLU A 142 15.983 10.884 -11.047 1.00 62.45 H new ATOM 0 HB2 GLU A 142 14.185 8.688 -9.921 1.00 73.21 H new ATOM 0 HB3 GLU A 142 15.644 9.248 -9.128 1.00 73.21 H new ATOM 0 HG2 GLU A 142 14.708 11.486 -8.856 1.00 32.40 H new ATOM 0 HG3 GLU A 142 13.300 11.060 -9.808 1.00 32.40 H new ATOM 2352 N GLY A 143 15.972 8.113 -12.659 1.00 42.21 N ATOM 2353 CA GLY A 143 16.819 7.068 -13.226 1.00 74.45 C ATOM 2354 C GLY A 143 17.093 7.278 -14.713 1.00 25.24 C ATOM 2355 O GLY A 143 16.359 6.772 -15.564 1.00 32.22 O ATOM 0 H GLY A 143 15.057 8.203 -13.101 1.00 42.21 H new ATOM 0 HA2 GLY A 143 17.766 7.040 -12.686 1.00 74.45 H new ATOM 0 HA3 GLY A 143 16.341 6.099 -13.082 1.00 74.45 H new ATOM 2359 N ARG A 144 18.152 8.025 -15.028 1.00 30.14 N ATOM 2360 CA ARG A 144 18.509 8.325 -16.423 1.00 52.34 C ATOM 2361 C ARG A 144 20.026 8.250 -16.668 1.00 61.44 C ATOM 2362 O ARG A 144 20.815 8.077 -15.740 1.00 51.43 O ATOM 2363 CB ARG A 144 17.957 9.707 -16.838 1.00 22.14 C ATOM 2364 CG ARG A 144 18.104 10.817 -15.788 1.00 1.35 C ATOM 2365 CD ARG A 144 19.560 11.194 -15.504 1.00 35.23 C ATOM 2366 NE ARG A 144 20.287 11.581 -16.719 1.00 25.32 N ATOM 2367 CZ ARG A 144 20.604 12.809 -17.036 1.00 1.01 C ATOM 2368 NH1 ARG A 144 20.200 13.804 -16.317 1.00 55.15 N ATOM 2369 NH2 ARG A 144 21.320 13.039 -18.086 1.00 64.11 N ATOM 0 H ARG A 144 18.781 8.436 -14.338 1.00 30.14 H new ATOM 0 HA ARG A 144 18.048 7.558 -17.045 1.00 52.34 H new ATOM 0 HB2 ARG A 144 18.464 10.023 -17.750 1.00 22.14 H new ATOM 0 HB3 ARG A 144 16.900 9.599 -17.082 1.00 22.14 H new ATOM 0 HG2 ARG A 144 17.567 11.702 -16.128 1.00 1.35 H new ATOM 0 HG3 ARG A 144 17.632 10.494 -14.860 1.00 1.35 H new ATOM 0 HD2 ARG A 144 19.586 12.018 -14.791 1.00 35.23 H new ATOM 0 HD3 ARG A 144 20.066 10.350 -15.035 1.00 35.23 H new ATOM 0 HE ARG A 144 20.565 10.839 -17.362 1.00 25.32 H new ATOM 0 HH11 ARG A 144 19.626 13.636 -15.490 1.00 55.15 H new ATOM 0 HH12 ARG A 144 20.455 14.757 -16.576 1.00 55.15 H new ATOM 0 HH21 ARG A 144 21.637 12.263 -18.667 1.00 64.11 H new ATOM 0 HH22 ARG A 144 21.568 13.997 -18.334 1.00 64.11 H new ATOM 2383 N ARG A 145 20.422 8.374 -17.933 1.00 14.03 N ATOM 2384 CA ARG A 145 21.843 8.381 -18.314 1.00 24.13 C ATOM 2385 C ARG A 145 22.451 9.793 -18.209 1.00 41.45 C ATOM 2386 O ARG A 145 23.156 10.071 -17.212 1.00 37.49 O ATOM 2387 CB ARG A 145 22.003 7.837 -19.741 1.00 55.31 C ATOM 2388 CG ARG A 145 21.643 6.358 -19.880 1.00 12.51 C ATOM 2389 CD ARG A 145 22.587 5.470 -19.075 1.00 4.22 C ATOM 2390 NE ARG A 145 23.981 5.673 -19.469 1.00 71.24 N ATOM 2391 CZ ARG A 145 25.011 5.208 -18.816 1.00 2.44 C ATOM 2392 NH1 ARG A 145 24.849 4.494 -17.749 1.00 60.10 N ATOM 2393 NH2 ARG A 145 26.205 5.464 -19.242 1.00 22.43 N ATOM 2394 OXT ARG A 145 22.199 10.624 -19.109 1.00 37.49 O ATOM 0 H ARG A 145 19.779 8.472 -18.719 1.00 14.03 H new ATOM 0 HA ARG A 145 22.382 7.738 -17.619 1.00 24.13 H new ATOM 0 HB2 ARG A 145 21.375 8.419 -20.415 1.00 55.31 H new ATOM 0 HB3 ARG A 145 23.034 7.982 -20.062 1.00 55.31 H new ATOM 0 HG2 ARG A 145 20.618 6.200 -19.543 1.00 12.51 H new ATOM 0 HG3 ARG A 145 21.681 6.071 -20.931 1.00 12.51 H new ATOM 0 HD2 ARG A 145 22.473 5.685 -18.013 1.00 4.22 H new ATOM 0 HD3 ARG A 145 22.316 4.424 -19.219 1.00 4.22 H new ATOM 0 HE ARG A 145 24.161 6.216 -20.313 1.00 71.24 H new ATOM 0 HH11 ARG A 145 23.909 4.289 -17.410 1.00 60.10 H new ATOM 0 HH12 ARG A 145 25.661 4.136 -17.247 1.00 60.10 H new ATOM 0 HH21 ARG A 145 26.337 6.026 -20.083 1.00 22.43 H new ATOM 0 HH22 ARG A 145 27.015 5.104 -18.737 1.00 22.43 H new TER 2408 ARG A 145