USER MOD reduce.3.24.130724 H: found=0, std=0, add=1350, rem=0, adj=51 USER MOD reduce.3.24.130724 removed 1339 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 157 HIS : no HE2:sc= 0.913 K(o=1.1,f=-2.9!) USER MOD Set 1.2: A 158 HIS : no HE2:sc= 0.177 K(o=1.1,f=-2.2!) USER MOD Set 2.1: A 117 ASN :FLIP amide:sc= -0.336 F(o=-2.5,f=-1.7) USER MOD Set 2.2: A 120 HIS : no HE2:sc= -1.34 K(o=-1.7,f=-5.5) USER MOD Set 3.1: A 96 HIS : no HE2:sc= -2.33 K(o=-2.1,f=-4.9!) USER MOD Set 3.2: A 100 THR OG1 : rot 79:sc= 0.189 USER MOD Set 4.1: A 33 THR OG1 : rot 82:sc= 1.19 USER MOD Set 4.2: A 71 SER OG : rot 81:sc= 0.475 USER MOD Set 4.3: B1007 TYR OH : rot -146:sc= 1.66 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 139:sc= -0.181 (180deg=-0.984) USER MOD Single : A 2 GLN : amide:sc= -0.0355 X(o=-0.035,f=-0.53) USER MOD Single : A 3 GLN : amide:sc= -0.0528 K(o=-0.053,f=-1.4) USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 9 ASN :FLIP amide:sc= -0.171 F(o=-0.96,f=-0.17) USER MOD Single : A 13 THR OG1 : rot 72:sc= 1.05 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ 142:sc= 0.105 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= -0.123 (180deg=-0.123) USER MOD Single : A 22 SER OG : rot 180:sc= -0.204 USER MOD Single : A 25 SER OG : rot 37:sc= 0.54 USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ 180:sc=-0.00355 (180deg=-0.00355) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 120:sc= -2.15 USER MOD Single : A 39 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 83:sc= 0.271 USER MOD Single : A 53 TYR OH : rot 88:sc= 0 USER MOD Single : A 54 SER OG : rot -93:sc= -2.33! USER MOD Single : A 57 CYS SG : rot 180:sc= -1.03 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HE2:sc= -5.33! C(o=-5.3!,f=-12!) USER MOD Single : A 62 LYS NZ :NH3+ -134:sc= -0.188 (180deg=-1.58!) USER MOD Single : A 65 SER OG : rot -113:sc= -1.22 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 120:sc= -2.44! USER MOD Single : A 80 THR OG1 : rot 35:sc= -0.524 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -0.588 K(o=-0.59,f=-3.5!) USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0.0336 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot -83:sc= -0.172! USER MOD Single : A 99 ASN : amide:sc= 0 X(o=0,f=-0.0091) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 SER OG : rot -78:sc= 0.653 USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 SER OG : rot 90:sc= -1.39 USER MOD Single : A 118 GLN : amide:sc= 0 K(o=0,f=-0.52) USER MOD Single : A 121 LYS NZ :NH3+ -155:sc= -0.489 (180deg=-1.27) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl 178:sc= 0 (180deg=-0.00537) USER MOD Single : A 134 SER OG : rot 180:sc= -0.0867 USER MOD Single : A 138 GLN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 139 LYS NZ :NH3+ 169:sc= -1.35 (180deg=-1.68) USER MOD Single : A 140 SER OG : rot -33:sc= 0.487 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -127:sc= 0.038 (180deg=0) USER MOD Single : A 149 CYS SG : rot 180:sc= 0 USER MOD Single : A 152 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 156 HIS : no HD1:sc= -1.6 K(o=-1.6,f=-3.2!) USER MOD Single : A 159 HIS : no HD1:sc= -0.0281 X(o=-0.028,f=-0.15) USER MOD Single : A 160 HIS : no HD1:sc= 0 X(o=0,f=-0.0013) USER MOD Single : A 161 HIS : no HD1:sc= -0.0197 X(o=-0.02,f=-0.055) USER MOD Single : B1008 ASN : amide:sc= -2.02 K(o=-2,f=-7.6!) USER MOD Single : B1010 TYR OH : rot 180:sc= 0 USER MOD Single : B1011 THR OG1 : rot -59:sc= 0.456 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.809 -12.925 -4.082 1.00 72.33 N ATOM 2 CA MET A 1 -0.190 -12.167 -4.827 1.00 1.02 C ATOM 3 C MET A 1 -1.454 -11.970 -3.996 1.00 22.12 C ATOM 4 O MET A 1 -1.912 -12.891 -3.320 1.00 71.14 O ATOM 5 CB MET A 1 -0.532 -12.881 -6.136 1.00 31.12 C ATOM 6 CG MET A 1 -1.043 -14.299 -5.939 1.00 34.02 C ATOM 7 SD MET A 1 -0.568 -15.402 -7.284 1.00 14.20 S ATOM 8 CE MET A 1 0.953 -16.090 -6.636 1.00 42.15 C ATOM 0 H1 MET A 1 1.269 -13.609 -4.716 1.00 72.33 H new ATOM 0 H2 MET A 1 1.523 -12.274 -3.698 1.00 72.33 H new ATOM 0 H3 MET A 1 0.348 -13.433 -3.301 1.00 72.33 H new ATOM 0 HA MET A 1 0.230 -11.187 -5.055 1.00 1.02 H new ATOM 0 HB2 MET A 1 -1.286 -12.303 -6.670 1.00 31.12 H new ATOM 0 HB3 MET A 1 0.355 -12.908 -6.768 1.00 31.12 H new ATOM 0 HG2 MET A 1 -0.658 -14.692 -4.998 1.00 34.02 H new ATOM 0 HG3 MET A 1 -2.130 -14.281 -5.856 1.00 34.02 H new ATOM 0 HE1 MET A 1 1.370 -16.794 -7.356 1.00 42.15 H new ATOM 0 HE2 MET A 1 1.668 -15.287 -6.457 1.00 42.15 H new ATOM 0 HE3 MET A 1 0.748 -16.608 -5.699 1.00 42.15 H new ATOM 18 N GLN A 2 -2.011 -10.765 -4.051 1.00 10.33 N ATOM 19 CA GLN A 2 -3.221 -10.448 -3.302 1.00 34.43 C ATOM 20 C GLN A 2 -3.852 -9.155 -3.808 1.00 33.43 C ATOM 21 O GLN A 2 -3.420 -8.596 -4.815 1.00 61.31 O ATOM 22 CB GLN A 2 -2.906 -10.326 -1.810 1.00 31.31 C ATOM 23 CG GLN A 2 -1.923 -9.213 -1.485 1.00 15.20 C ATOM 24 CD GLN A 2 -1.990 -8.781 -0.033 1.00 54.44 C ATOM 25 OE1 GLN A 2 -3.074 -8.605 0.525 1.00 41.24 O ATOM 26 NE2 GLN A 2 -0.829 -8.607 0.587 1.00 53.10 N ATOM 0 H GLN A 2 -1.644 -9.992 -4.606 1.00 10.33 H new ATOM 0 HA GLN A 2 -3.933 -11.260 -3.450 1.00 34.43 H new ATOM 0 HB2 GLN A 2 -3.833 -10.151 -1.264 1.00 31.31 H new ATOM 0 HB3 GLN A 2 -2.500 -11.273 -1.454 1.00 31.31 H new ATOM 0 HG2 GLN A 2 -0.911 -9.548 -1.714 1.00 15.20 H new ATOM 0 HG3 GLN A 2 -2.127 -8.355 -2.125 1.00 15.20 H new ATOM 0 HE21 GLN A 2 0.045 -8.764 0.086 1.00 53.10 H new ATOM 0 HE22 GLN A 2 -0.811 -8.316 1.565 1.00 53.10 H new ATOM 35 N GLN A 3 -4.877 -8.687 -3.102 1.00 44.10 N ATOM 36 CA GLN A 3 -5.567 -7.460 -3.481 1.00 53.02 C ATOM 37 C GLN A 3 -4.582 -6.306 -3.636 1.00 60.21 C ATOM 38 O GLN A 3 -3.542 -6.273 -2.979 1.00 24.02 O ATOM 39 CB GLN A 3 -6.628 -7.104 -2.438 1.00 52.24 C ATOM 40 CG GLN A 3 -7.700 -6.160 -2.959 1.00 11.11 C ATOM 41 CD GLN A 3 -8.676 -6.844 -3.896 1.00 25.41 C ATOM 42 OE1 GLN A 3 -8.706 -8.072 -3.991 1.00 0.34 O ATOM 43 NE2 GLN A 3 -9.480 -6.052 -4.595 1.00 32.50 N ATOM 0 H GLN A 3 -5.247 -9.139 -2.266 1.00 44.10 H new ATOM 0 HA GLN A 3 -6.054 -7.629 -4.442 1.00 53.02 H new ATOM 0 HB2 GLN A 3 -7.102 -8.020 -2.087 1.00 52.24 H new ATOM 0 HB3 GLN A 3 -6.140 -6.647 -1.577 1.00 52.24 H new ATOM 0 HG2 GLN A 3 -8.247 -5.737 -2.116 1.00 11.11 H new ATOM 0 HG3 GLN A 3 -7.225 -5.329 -3.480 1.00 11.11 H new ATOM 0 HE21 GLN A 3 -9.421 -5.040 -4.485 1.00 32.50 H new ATOM 0 HE22 GLN A 3 -10.157 -6.456 -5.242 1.00 32.50 H new ATOM 52 N ASP A 4 -4.916 -5.362 -4.509 1.00 75.51 N ATOM 53 CA ASP A 4 -4.061 -4.206 -4.750 1.00 73.01 C ATOM 54 C ASP A 4 -4.226 -3.169 -3.644 1.00 1.41 C ATOM 55 O ASP A 4 -3.486 -2.187 -3.585 1.00 4.31 O ATOM 56 CB ASP A 4 -4.386 -3.579 -6.107 1.00 3.12 C ATOM 57 CG ASP A 4 -3.503 -4.113 -7.218 1.00 21.35 C ATOM 58 OD1 ASP A 4 -3.620 -5.313 -7.542 1.00 62.23 O ATOM 59 OD2 ASP A 4 -2.694 -3.332 -7.761 1.00 55.24 O ATOM 0 H ASP A 4 -5.773 -5.375 -5.062 1.00 75.51 H new ATOM 0 HA ASP A 4 -3.025 -4.545 -4.754 1.00 73.01 H new ATOM 0 HB2 ASP A 4 -5.430 -3.772 -6.352 1.00 3.12 H new ATOM 0 HB3 ASP A 4 -4.269 -2.497 -6.042 1.00 3.12 H new ATOM 64 N ASP A 5 -5.201 -3.393 -2.770 1.00 53.42 N ATOM 65 CA ASP A 5 -5.463 -2.477 -1.666 1.00 35.34 C ATOM 66 C ASP A 5 -5.940 -1.124 -2.183 1.00 14.20 C ATOM 67 O ASP A 5 -5.385 -0.083 -1.831 1.00 15.24 O ATOM 68 CB ASP A 5 -4.205 -2.298 -0.815 1.00 14.54 C ATOM 69 CG ASP A 5 -4.525 -1.929 0.621 1.00 52.33 C ATOM 70 OD1 ASP A 5 -5.446 -1.111 0.833 1.00 64.33 O ATOM 71 OD2 ASP A 5 -3.856 -2.458 1.532 1.00 3.01 O ATOM 0 H ASP A 5 -5.823 -4.201 -2.805 1.00 53.42 H new ATOM 0 HA ASP A 5 -6.252 -2.907 -1.049 1.00 35.34 H new ATOM 0 HB2 ASP A 5 -3.626 -3.221 -0.829 1.00 14.54 H new ATOM 0 HB3 ASP A 5 -3.579 -1.522 -1.256 1.00 14.54 H new ATOM 76 N ASP A 6 -6.971 -1.146 -3.021 1.00 21.31 N ATOM 77 CA ASP A 6 -7.523 0.079 -3.587 1.00 42.02 C ATOM 78 C ASP A 6 -8.619 0.646 -2.691 1.00 12.21 C ATOM 79 O ASP A 6 -8.726 0.286 -1.519 1.00 25.55 O ATOM 80 CB ASP A 6 -8.078 -0.186 -4.988 1.00 1.14 C ATOM 81 CG ASP A 6 -7.654 0.872 -5.988 1.00 33.41 C ATOM 82 OD1 ASP A 6 -6.433 1.061 -6.170 1.00 53.41 O ATOM 83 OD2 ASP A 6 -8.544 1.509 -6.589 1.00 62.12 O ATOM 0 H ASP A 6 -7.441 -1.999 -3.323 1.00 21.31 H new ATOM 0 HA ASP A 6 -6.720 0.812 -3.656 1.00 42.02 H new ATOM 0 HB2 ASP A 6 -7.739 -1.163 -5.331 1.00 1.14 H new ATOM 0 HB3 ASP A 6 -9.166 -0.224 -4.943 1.00 1.14 H new ATOM 88 N PHE A 7 -9.432 1.537 -3.250 1.00 62.30 N ATOM 89 CA PHE A 7 -10.519 2.156 -2.501 1.00 30.31 C ATOM 90 C PHE A 7 -11.329 1.104 -1.748 1.00 63.01 C ATOM 91 O PHE A 7 -11.943 1.396 -0.722 1.00 44.34 O ATOM 92 CB PHE A 7 -11.433 2.941 -3.443 1.00 54.32 C ATOM 93 CG PHE A 7 -12.166 4.066 -2.768 1.00 70.44 C ATOM 94 CD1 PHE A 7 -11.478 5.010 -2.023 1.00 71.33 C ATOM 95 CD2 PHE A 7 -13.542 4.179 -2.880 1.00 34.44 C ATOM 96 CE1 PHE A 7 -12.150 6.045 -1.401 1.00 20.32 C ATOM 97 CE2 PHE A 7 -14.220 5.212 -2.260 1.00 22.34 C ATOM 98 CZ PHE A 7 -13.522 6.147 -1.520 1.00 73.51 C ATOM 0 H PHE A 7 -9.358 1.846 -4.219 1.00 62.30 H new ATOM 0 HA PHE A 7 -10.082 2.841 -1.775 1.00 30.31 H new ATOM 0 HB2 PHE A 7 -10.837 3.345 -4.261 1.00 54.32 H new ATOM 0 HB3 PHE A 7 -12.159 2.258 -3.885 1.00 54.32 H new ATOM 0 HD1 PHE A 7 -10.405 4.936 -1.927 1.00 71.33 H new ATOM 0 HD2 PHE A 7 -14.092 3.451 -3.459 1.00 34.44 H new ATOM 0 HE1 PHE A 7 -11.602 6.774 -0.822 1.00 20.32 H new ATOM 0 HE2 PHE A 7 -15.293 5.288 -2.354 1.00 22.34 H new ATOM 0 HZ PHE A 7 -14.048 6.956 -1.036 1.00 73.51 H new ATOM 108 N GLN A 8 -11.324 -0.120 -2.266 1.00 54.02 N ATOM 109 CA GLN A 8 -12.059 -1.215 -1.644 1.00 13.10 C ATOM 110 C GLN A 8 -11.806 -1.256 -0.141 1.00 2.34 C ATOM 111 O GLN A 8 -12.739 -1.185 0.658 1.00 62.40 O ATOM 112 CB GLN A 8 -11.661 -2.549 -2.277 1.00 23.22 C ATOM 113 CG GLN A 8 -12.090 -3.760 -1.464 1.00 63.22 C ATOM 114 CD GLN A 8 -12.698 -4.853 -2.322 1.00 2.34 C ATOM 115 OE1 GLN A 8 -13.737 -4.657 -2.953 1.00 3.53 O ATOM 116 NE2 GLN A 8 -12.052 -6.013 -2.349 1.00 42.50 N ATOM 0 H GLN A 8 -10.820 -0.378 -3.114 1.00 54.02 H new ATOM 0 HA GLN A 8 -13.123 -1.045 -1.810 1.00 13.10 H new ATOM 0 HB2 GLN A 8 -12.101 -2.615 -3.272 1.00 23.22 H new ATOM 0 HB3 GLN A 8 -10.579 -2.572 -2.405 1.00 23.22 H new ATOM 0 HG2 GLN A 8 -11.227 -4.159 -0.931 1.00 63.22 H new ATOM 0 HG3 GLN A 8 -12.814 -3.449 -0.711 1.00 63.22 H new ATOM 0 HE21 GLN A 8 -11.194 -6.132 -1.810 1.00 42.50 H new ATOM 0 HE22 GLN A 8 -12.414 -6.785 -2.908 1.00 42.50 H new ATOM 125 N ASN A 9 -10.537 -1.370 0.238 1.00 62.24 N ATOM 126 CA ASN A 9 -10.161 -1.421 1.646 1.00 64.33 C ATOM 127 C ASN A 9 -10.745 -0.236 2.408 1.00 32.44 C ATOM 128 O ASN A 9 -11.393 -0.408 3.441 1.00 2.44 O ATOM 129 CB ASN A 9 -8.637 -1.432 1.788 1.00 32.40 C ATOM 130 CG ASN A 9 -8.051 -2.820 1.618 1.00 23.51 C ATOM 131 OD1 ASN A 9 -8.151 -3.361 0.409 1.00 32.34 O flip ATOM 132 ND2 ASN A 9 -7.513 -3.399 2.562 1.00 35.34 N flip ATOM 0 H ASN A 9 -9.752 -1.429 -0.410 1.00 62.24 H new ATOM 0 HA ASN A 9 -10.566 -2.339 2.072 1.00 64.33 H new ATOM 0 HB2 ASN A 9 -8.201 -0.763 1.046 1.00 32.40 H new ATOM 0 HB3 ASN A 9 -8.363 -1.043 2.769 1.00 32.40 H new ATOM 0 HD21 ASN A 9 -7.458 -2.946 3.474 1.00 35.34 H new ATOM 0 HD22 ASN A 9 -7.122 -4.332 2.432 1.00 35.34 H new ATOM 139 N PHE A 10 -10.513 0.966 1.892 1.00 64.33 N ATOM 140 CA PHE A 10 -11.016 2.180 2.524 1.00 65.23 C ATOM 141 C PHE A 10 -12.529 2.112 2.703 1.00 13.53 C ATOM 142 O PHE A 10 -13.029 1.999 3.823 1.00 65.41 O ATOM 143 CB PHE A 10 -10.644 3.407 1.688 1.00 21.42 C ATOM 144 CG PHE A 10 -10.846 4.708 2.411 1.00 62.31 C ATOM 145 CD1 PHE A 10 -10.089 5.019 3.529 1.00 34.01 C ATOM 146 CD2 PHE A 10 -11.793 5.619 1.972 1.00 3.32 C ATOM 147 CE1 PHE A 10 -10.272 6.216 4.196 1.00 34.44 C ATOM 148 CE2 PHE A 10 -11.980 6.817 2.635 1.00 1.50 C ATOM 149 CZ PHE A 10 -11.220 7.116 3.749 1.00 22.51 C ATOM 0 H PHE A 10 -9.980 1.126 1.037 1.00 64.33 H new ATOM 0 HA PHE A 10 -10.555 2.266 3.508 1.00 65.23 H new ATOM 0 HB2 PHE A 10 -9.600 3.327 1.385 1.00 21.42 H new ATOM 0 HB3 PHE A 10 -11.241 3.410 0.776 1.00 21.42 H new ATOM 0 HD1 PHE A 10 -9.348 4.318 3.883 1.00 34.01 H new ATOM 0 HD2 PHE A 10 -12.391 5.390 1.102 1.00 3.32 H new ATOM 0 HE1 PHE A 10 -9.675 6.447 5.065 1.00 34.44 H new ATOM 0 HE2 PHE A 10 -12.720 7.520 2.282 1.00 1.50 H new ATOM 0 HZ PHE A 10 -11.367 8.051 4.269 1.00 22.51 H new ATOM 159 N VAL A 11 -13.255 2.184 1.592 1.00 41.31 N ATOM 160 CA VAL A 11 -14.712 2.131 1.625 1.00 4.11 C ATOM 161 C VAL A 11 -15.200 0.987 2.507 1.00 42.22 C ATOM 162 O VAL A 11 -16.114 1.158 3.313 1.00 24.10 O ATOM 163 CB VAL A 11 -15.299 1.962 0.212 1.00 54.05 C ATOM 164 CG1 VAL A 11 -16.377 0.889 0.206 1.00 31.41 C ATOM 165 CG2 VAL A 11 -15.851 3.285 -0.298 1.00 2.35 C ATOM 0 H VAL A 11 -12.858 2.279 0.657 1.00 41.31 H new ATOM 0 HA VAL A 11 -15.054 3.078 2.041 1.00 4.11 H new ATOM 0 HB VAL A 11 -14.500 1.645 -0.458 1.00 54.05 H new ATOM 0 HG11 VAL A 11 -16.780 0.784 -0.801 1.00 31.41 H new ATOM 0 HG12 VAL A 11 -15.947 -0.060 0.526 1.00 31.41 H new ATOM 0 HG13 VAL A 11 -17.177 1.173 0.889 1.00 31.41 H new ATOM 0 HG21 VAL A 11 -16.262 3.147 -1.298 1.00 2.35 H new ATOM 0 HG22 VAL A 11 -16.637 3.634 0.372 1.00 2.35 H new ATOM 0 HG23 VAL A 11 -15.050 4.024 -0.334 1.00 2.35 H new ATOM 175 N ALA A 12 -14.584 -0.180 2.348 1.00 45.41 N ATOM 176 CA ALA A 12 -14.953 -1.352 3.131 1.00 14.33 C ATOM 177 C ALA A 12 -14.929 -1.044 4.625 1.00 52.03 C ATOM 178 O ALA A 12 -15.878 -1.349 5.348 1.00 21.32 O ATOM 179 CB ALA A 12 -14.023 -2.513 2.815 1.00 70.23 C ATOM 0 H ALA A 12 -13.827 -0.338 1.683 1.00 45.41 H new ATOM 0 HA ALA A 12 -15.971 -1.633 2.860 1.00 14.33 H new ATOM 0 HB1 ALA A 12 -14.311 -3.381 3.407 1.00 70.23 H new ATOM 0 HB2 ALA A 12 -14.093 -2.757 1.755 1.00 70.23 H new ATOM 0 HB3 ALA A 12 -12.997 -2.233 3.056 1.00 70.23 H new ATOM 185 N THR A 13 -13.838 -0.438 5.082 1.00 42.33 N ATOM 186 CA THR A 13 -13.689 -0.090 6.489 1.00 32.33 C ATOM 187 C THR A 13 -14.822 0.818 6.954 1.00 45.31 C ATOM 188 O THR A 13 -15.493 0.533 7.946 1.00 33.31 O ATOM 189 CB THR A 13 -12.343 0.609 6.756 1.00 22.33 C ATOM 190 OG1 THR A 13 -11.272 -0.159 6.195 1.00 34.22 O ATOM 191 CG2 THR A 13 -12.115 0.791 8.249 1.00 5.22 C ATOM 0 H THR A 13 -13.044 -0.178 4.497 1.00 42.33 H new ATOM 0 HA THR A 13 -13.722 -1.024 7.050 1.00 32.33 H new ATOM 0 HB THR A 13 -12.370 1.592 6.286 1.00 22.33 H new ATOM 0 HG1 THR A 13 -11.296 -0.088 5.218 1.00 34.22 H new ATOM 0 HG21 THR A 13 -11.158 1.287 8.413 1.00 5.22 H new ATOM 0 HG22 THR A 13 -12.916 1.400 8.668 1.00 5.22 H new ATOM 0 HG23 THR A 13 -12.107 -0.183 8.737 1.00 5.22 H new ATOM 199 N LEU A 14 -15.029 1.913 6.231 1.00 13.53 N ATOM 200 CA LEU A 14 -16.082 2.865 6.569 1.00 33.23 C ATOM 201 C LEU A 14 -17.441 2.175 6.629 1.00 72.44 C ATOM 202 O LEU A 14 -18.156 2.276 7.625 1.00 22.32 O ATOM 203 CB LEU A 14 -16.119 4.001 5.545 1.00 24.52 C ATOM 204 CG LEU A 14 -16.688 5.331 6.039 1.00 44.33 C ATOM 205 CD1 LEU A 14 -15.938 5.808 7.273 1.00 65.31 C ATOM 206 CD2 LEU A 14 -16.625 6.379 4.937 1.00 53.20 C ATOM 0 H LEU A 14 -14.482 2.164 5.407 1.00 13.53 H new ATOM 0 HA LEU A 14 -15.861 3.279 7.553 1.00 33.23 H new ATOM 0 HB2 LEU A 14 -15.104 4.174 5.187 1.00 24.52 H new ATOM 0 HB3 LEU A 14 -16.708 3.672 4.689 1.00 24.52 H new ATOM 0 HG LEU A 14 -17.733 5.179 6.311 1.00 44.33 H new ATOM 0 HD11 LEU A 14 -16.357 6.756 7.610 1.00 65.31 H new ATOM 0 HD12 LEU A 14 -16.034 5.067 8.066 1.00 65.31 H new ATOM 0 HD13 LEU A 14 -14.884 5.944 7.029 1.00 65.31 H new ATOM 0 HD21 LEU A 14 -17.034 7.320 5.306 1.00 53.20 H new ATOM 0 HD22 LEU A 14 -15.588 6.528 4.635 1.00 53.20 H new ATOM 0 HD23 LEU A 14 -17.208 6.041 4.080 1.00 53.20 H new ATOM 218 N GLU A 15 -17.790 1.472 5.555 1.00 23.13 N ATOM 219 CA GLU A 15 -19.063 0.764 5.487 1.00 64.21 C ATOM 220 C GLU A 15 -19.287 -0.075 6.742 1.00 1.31 C ATOM 221 O GLU A 15 -20.263 0.121 7.466 1.00 3.33 O ATOM 222 CB GLU A 15 -19.107 -0.132 4.247 1.00 14.12 C ATOM 223 CG GLU A 15 -18.920 0.624 2.943 1.00 51.52 C ATOM 224 CD GLU A 15 -20.203 0.734 2.142 1.00 14.05 C ATOM 225 OE1 GLU A 15 -21.277 0.887 2.762 1.00 20.51 O ATOM 226 OE2 GLU A 15 -20.134 0.667 0.898 1.00 55.15 O ATOM 0 H GLU A 15 -17.210 1.378 4.722 1.00 23.13 H new ATOM 0 HA GLU A 15 -19.859 1.506 5.420 1.00 64.21 H new ATOM 0 HB2 GLU A 15 -18.331 -0.892 4.331 1.00 14.12 H new ATOM 0 HB3 GLU A 15 -20.063 -0.654 4.220 1.00 14.12 H new ATOM 0 HG2 GLU A 15 -18.544 1.624 3.158 1.00 51.52 H new ATOM 0 HG3 GLU A 15 -18.163 0.121 2.341 1.00 51.52 H new ATOM 233 N SER A 16 -18.376 -1.010 6.992 1.00 32.12 N ATOM 234 CA SER A 16 -18.476 -1.882 8.157 1.00 41.03 C ATOM 235 C SER A 16 -18.533 -1.065 9.444 1.00 45.11 C ATOM 236 O SER A 16 -19.124 -1.489 10.437 1.00 60.32 O ATOM 237 CB SER A 16 -17.288 -2.845 8.202 1.00 31.04 C ATOM 238 OG SER A 16 -17.482 -3.848 9.185 1.00 40.23 O ATOM 0 H SER A 16 -17.561 -1.183 6.404 1.00 32.12 H new ATOM 0 HA SER A 16 -19.398 -2.457 8.072 1.00 41.03 H new ATOM 0 HB2 SER A 16 -17.155 -3.310 7.225 1.00 31.04 H new ATOM 0 HB3 SER A 16 -16.375 -2.291 8.418 1.00 31.04 H new ATOM 0 HG SER A 16 -16.710 -4.452 9.193 1.00 40.23 H new ATOM 244 N PHE A 17 -17.913 0.110 9.419 1.00 43.31 N ATOM 245 CA PHE A 17 -17.891 0.988 10.583 1.00 23.03 C ATOM 246 C PHE A 17 -19.307 1.281 11.071 1.00 63.25 C ATOM 247 O PHE A 17 -19.684 0.906 12.181 1.00 71.42 O ATOM 248 CB PHE A 17 -17.174 2.297 10.248 1.00 44.40 C ATOM 249 CG PHE A 17 -16.566 2.971 11.445 1.00 44.33 C ATOM 250 CD1 PHE A 17 -17.312 3.179 12.593 1.00 31.23 C ATOM 251 CD2 PHE A 17 -15.247 3.398 11.421 1.00 75.13 C ATOM 252 CE1 PHE A 17 -16.756 3.798 13.696 1.00 5.35 C ATOM 253 CE2 PHE A 17 -14.685 4.018 12.521 1.00 74.52 C ATOM 254 CZ PHE A 17 -15.441 4.219 13.660 1.00 44.14 C ATOM 0 H PHE A 17 -17.419 0.476 8.605 1.00 43.31 H new ATOM 0 HA PHE A 17 -17.349 0.479 11.380 1.00 23.03 H new ATOM 0 HB2 PHE A 17 -16.391 2.096 9.517 1.00 44.40 H new ATOM 0 HB3 PHE A 17 -17.882 2.979 9.777 1.00 44.40 H new ATOM 0 HD1 PHE A 17 -18.341 2.853 12.627 1.00 31.23 H new ATOM 0 HD2 PHE A 17 -14.652 3.244 10.533 1.00 75.13 H new ATOM 0 HE1 PHE A 17 -17.349 3.953 14.585 1.00 5.35 H new ATOM 0 HE2 PHE A 17 -13.656 4.345 12.490 1.00 74.52 H new ATOM 0 HZ PHE A 17 -15.005 4.704 14.520 1.00 44.14 H new ATOM 264 N LYS A 18 -20.087 1.954 10.232 1.00 1.51 N ATOM 265 CA LYS A 18 -21.462 2.298 10.575 1.00 42.55 C ATOM 266 C LYS A 18 -22.272 1.047 10.895 1.00 73.55 C ATOM 267 O LYS A 18 -23.133 1.061 11.775 1.00 61.12 O ATOM 268 CB LYS A 18 -22.119 3.064 9.424 1.00 13.42 C ATOM 269 CG LYS A 18 -21.959 2.389 8.073 1.00 30.45 C ATOM 270 CD LYS A 18 -22.867 3.012 7.027 1.00 43.44 C ATOM 271 CE LYS A 18 -23.087 2.075 5.849 1.00 25.34 C ATOM 272 NZ LYS A 18 -23.136 2.811 4.556 1.00 63.42 N ATOM 0 H LYS A 18 -19.790 2.272 9.309 1.00 1.51 H new ATOM 0 HA LYS A 18 -21.442 2.932 11.461 1.00 42.55 H new ATOM 0 HB2 LYS A 18 -23.181 3.183 9.638 1.00 13.42 H new ATOM 0 HB3 LYS A 18 -21.690 4.065 9.374 1.00 13.42 H new ATOM 0 HG2 LYS A 18 -20.922 2.466 7.748 1.00 30.45 H new ATOM 0 HG3 LYS A 18 -22.186 1.327 8.167 1.00 30.45 H new ATOM 0 HD2 LYS A 18 -23.827 3.261 7.479 1.00 43.44 H new ATOM 0 HD3 LYS A 18 -22.429 3.946 6.674 1.00 43.44 H new ATOM 0 HE2 LYS A 18 -22.285 1.338 5.817 1.00 25.34 H new ATOM 0 HE3 LYS A 18 -24.018 1.527 5.990 1.00 25.34 H new ATOM 0 HZ1 LYS A 18 -22.661 2.251 3.820 1.00 63.42 H new ATOM 0 HZ2 LYS A 18 -24.127 2.970 4.284 1.00 63.42 H new ATOM 0 HZ3 LYS A 18 -22.654 3.727 4.659 1.00 63.42 H new ATOM 286 N ASP A 19 -21.991 -0.035 10.176 1.00 42.43 N ATOM 287 CA ASP A 19 -22.692 -1.296 10.385 1.00 11.11 C ATOM 288 C ASP A 19 -22.510 -1.788 11.818 1.00 42.34 C ATOM 289 O ASP A 19 -23.225 -2.681 12.275 1.00 41.54 O ATOM 290 CB ASP A 19 -22.188 -2.353 9.402 1.00 74.53 C ATOM 291 CG ASP A 19 -23.099 -3.564 9.336 1.00 12.41 C ATOM 292 OD1 ASP A 19 -24.290 -3.392 9.003 1.00 13.22 O ATOM 293 OD2 ASP A 19 -22.621 -4.683 9.618 1.00 12.55 O ATOM 0 H ASP A 19 -21.282 -0.063 9.443 1.00 42.43 H new ATOM 0 HA ASP A 19 -23.754 -1.126 10.210 1.00 11.11 H new ATOM 0 HB2 ASP A 19 -22.104 -1.911 8.409 1.00 74.53 H new ATOM 0 HB3 ASP A 19 -21.187 -2.670 9.696 1.00 74.53 H new ATOM 298 N LEU A 20 -21.548 -1.201 12.521 1.00 11.32 N ATOM 299 CA LEU A 20 -21.270 -1.580 13.902 1.00 15.54 C ATOM 300 C LEU A 20 -22.398 -1.131 14.827 1.00 22.50 C ATOM 301 O LEU A 20 -23.306 -0.411 14.413 1.00 50.31 O ATOM 302 CB LEU A 20 -19.945 -0.970 14.363 1.00 52.23 C ATOM 303 CG LEU A 20 -20.041 0.368 15.097 1.00 40.35 C ATOM 304 CD1 LEU A 20 -18.664 0.999 15.238 1.00 15.11 C ATOM 305 CD2 LEU A 20 -20.989 1.310 14.368 1.00 63.43 C ATOM 0 H LEU A 20 -20.947 -0.461 12.158 1.00 11.32 H new ATOM 0 HA LEU A 20 -21.198 -2.667 13.947 1.00 15.54 H new ATOM 0 HB2 LEU A 20 -19.447 -1.685 15.017 1.00 52.23 H new ATOM 0 HB3 LEU A 20 -19.306 -0.838 13.490 1.00 52.23 H new ATOM 0 HG LEU A 20 -20.439 0.185 16.095 1.00 40.35 H new ATOM 0 HD11 LEU A 20 -18.752 1.950 15.763 1.00 15.11 H new ATOM 0 HD12 LEU A 20 -18.014 0.331 15.803 1.00 15.11 H new ATOM 0 HD13 LEU A 20 -18.238 1.168 14.249 1.00 15.11 H new ATOM 0 HD21 LEU A 20 -21.045 2.257 14.905 1.00 63.43 H new ATOM 0 HD22 LEU A 20 -20.621 1.487 13.357 1.00 63.43 H new ATOM 0 HD23 LEU A 20 -21.981 0.862 14.319 1.00 63.43 H new ATOM 317 N LYS A 21 -22.332 -1.561 16.083 1.00 74.44 N ATOM 318 CA LYS A 21 -23.345 -1.203 17.068 1.00 1.54 C ATOM 319 C LYS A 21 -22.740 -0.361 18.188 1.00 72.21 C ATOM 320 O LYS A 21 -22.789 -0.741 19.358 1.00 42.41 O ATOM 321 CB LYS A 21 -23.986 -2.463 17.653 1.00 55.00 C ATOM 322 CG LYS A 21 -23.038 -3.646 17.735 1.00 23.22 C ATOM 323 CD LYS A 21 -21.841 -3.341 18.620 1.00 43.31 C ATOM 324 CE LYS A 21 -20.839 -4.485 18.617 1.00 61.30 C ATOM 325 NZ LYS A 21 -20.300 -4.754 19.979 1.00 71.31 N ATOM 0 H LYS A 21 -21.587 -2.158 16.442 1.00 74.44 H new ATOM 0 HA LYS A 21 -24.112 -0.613 16.566 1.00 1.54 H new ATOM 0 HB2 LYS A 21 -24.361 -2.239 18.652 1.00 55.00 H new ATOM 0 HB3 LYS A 21 -24.846 -2.739 17.043 1.00 55.00 H new ATOM 0 HG2 LYS A 21 -23.570 -4.513 18.127 1.00 23.22 H new ATOM 0 HG3 LYS A 21 -22.694 -3.908 16.734 1.00 23.22 H new ATOM 0 HD2 LYS A 21 -21.354 -2.429 18.274 1.00 43.31 H new ATOM 0 HD3 LYS A 21 -22.179 -3.155 19.639 1.00 43.31 H new ATOM 0 HE2 LYS A 21 -21.317 -5.385 18.231 1.00 61.30 H new ATOM 0 HE3 LYS A 21 -20.017 -4.246 17.942 1.00 61.30 H new ATOM 0 HZ1 LYS A 21 -19.621 -5.540 19.934 1.00 71.31 H new ATOM 0 HZ2 LYS A 21 -19.821 -3.903 20.337 1.00 71.31 H new ATOM 0 HZ3 LYS A 21 -21.081 -5.007 20.618 1.00 71.31 H new ATOM 339 N SER A 22 -22.172 0.783 17.821 1.00 12.22 N ATOM 340 CA SER A 22 -21.556 1.677 18.795 1.00 51.23 C ATOM 341 C SER A 22 -21.312 3.056 18.188 1.00 22.41 C ATOM 342 O SER A 22 -21.719 4.073 18.747 1.00 5.21 O ATOM 343 CB SER A 22 -20.237 1.087 19.297 1.00 42.42 C ATOM 344 OG SER A 22 -19.321 0.904 18.231 1.00 54.43 O ATOM 0 H SER A 22 -22.125 1.113 16.857 1.00 12.22 H new ATOM 0 HA SER A 22 -22.240 1.786 19.636 1.00 51.23 H new ATOM 0 HB2 SER A 22 -19.801 1.748 20.046 1.00 42.42 H new ATOM 0 HB3 SER A 22 -20.425 0.132 19.787 1.00 42.42 H new ATOM 0 HG SER A 22 -18.486 0.527 18.579 1.00 54.43 H new ATOM 350 N GLY A 23 -20.644 3.080 17.039 1.00 64.43 N ATOM 351 CA GLY A 23 -20.356 4.337 16.374 1.00 3.22 C ATOM 352 C GLY A 23 -18.878 4.673 16.384 1.00 64.25 C ATOM 353 O GLY A 23 -18.468 5.714 15.870 1.00 3.31 O ATOM 0 H GLY A 23 -20.297 2.251 16.557 1.00 64.43 H new ATOM 0 HA2 GLY A 23 -20.707 4.288 15.343 1.00 3.22 H new ATOM 0 HA3 GLY A 23 -20.911 5.138 16.862 1.00 3.22 H new ATOM 357 N ILE A 24 -18.076 3.790 16.970 1.00 42.32 N ATOM 358 CA ILE A 24 -16.635 3.999 17.044 1.00 12.12 C ATOM 359 C ILE A 24 -15.886 2.671 17.032 1.00 42.12 C ATOM 360 O ILE A 24 -16.319 1.696 17.646 1.00 1.55 O ATOM 361 CB ILE A 24 -16.245 4.784 18.310 1.00 2.24 C ATOM 362 CG1 ILE A 24 -16.680 6.246 18.185 1.00 23.30 C ATOM 363 CG2 ILE A 24 -14.745 4.691 18.550 1.00 33.22 C ATOM 364 CD1 ILE A 24 -18.002 6.542 18.857 1.00 1.52 C ATOM 0 H ILE A 24 -18.399 2.924 17.400 1.00 42.32 H new ATOM 0 HA ILE A 24 -16.354 4.580 16.165 1.00 12.12 H new ATOM 0 HB ILE A 24 -16.758 4.344 19.165 1.00 2.24 H new ATOM 0 HG12 ILE A 24 -15.910 6.884 18.619 1.00 23.30 H new ATOM 0 HG13 ILE A 24 -16.752 6.506 17.129 1.00 23.30 H new ATOM 0 HG21 ILE A 24 -14.485 5.251 19.448 1.00 33.22 H new ATOM 0 HG22 ILE A 24 -14.461 3.646 18.678 1.00 33.22 H new ATOM 0 HG23 ILE A 24 -14.213 5.109 17.695 1.00 33.22 H new ATOM 0 HD11 ILE A 24 -18.248 7.596 18.728 1.00 1.52 H new ATOM 0 HD12 ILE A 24 -18.784 5.930 18.407 1.00 1.52 H new ATOM 0 HD13 ILE A 24 -17.929 6.314 19.920 1.00 1.52 H new ATOM 376 N SER A 25 -14.758 2.641 16.329 1.00 71.31 N ATOM 377 CA SER A 25 -13.948 1.432 16.235 1.00 75.44 C ATOM 378 C SER A 25 -12.513 1.768 15.842 1.00 51.21 C ATOM 379 O SER A 25 -12.247 2.184 14.715 1.00 12.10 O ATOM 380 CB SER A 25 -14.555 0.465 15.216 1.00 64.34 C ATOM 381 OG SER A 25 -14.173 -0.872 15.491 1.00 43.11 O ATOM 0 H SER A 25 -14.385 3.440 15.816 1.00 71.31 H new ATOM 0 HA SER A 25 -13.935 0.956 17.215 1.00 75.44 H new ATOM 0 HB2 SER A 25 -15.642 0.547 15.235 1.00 64.34 H new ATOM 0 HB3 SER A 25 -14.232 0.740 14.212 1.00 64.34 H new ATOM 0 HG SER A 25 -14.148 -1.012 16.461 1.00 43.11 H new ATOM 387 N GLY A 26 -11.590 1.585 16.782 1.00 75.13 N ATOM 388 CA GLY A 26 -10.193 1.874 16.516 1.00 73.31 C ATOM 389 C GLY A 26 -9.681 1.169 15.275 1.00 34.03 C ATOM 390 O GLY A 26 -9.126 1.803 14.378 1.00 72.52 O ATOM 0 H GLY A 26 -11.785 1.242 17.723 1.00 75.13 H new ATOM 0 HA2 GLY A 26 -10.064 2.950 16.398 1.00 73.31 H new ATOM 0 HA3 GLY A 26 -9.593 1.573 17.375 1.00 73.31 H new ATOM 394 N SER A 27 -9.867 -0.146 15.225 1.00 64.32 N ATOM 395 CA SER A 27 -9.414 -0.939 14.087 1.00 14.24 C ATOM 396 C SER A 27 -9.808 -0.275 12.772 1.00 55.24 C ATOM 397 O SER A 27 -8.967 -0.049 11.901 1.00 14.35 O ATOM 398 CB SER A 27 -10.002 -2.350 14.156 1.00 51.31 C ATOM 399 OG SER A 27 -9.254 -3.172 15.035 1.00 41.30 O ATOM 0 H SER A 27 -10.328 -0.685 15.958 1.00 64.32 H new ATOM 0 HA SER A 27 -8.327 -1.004 14.130 1.00 14.24 H new ATOM 0 HB2 SER A 27 -11.037 -2.300 14.493 1.00 51.31 H new ATOM 0 HB3 SER A 27 -10.012 -2.792 13.160 1.00 51.31 H new ATOM 0 HG SER A 27 -9.651 -4.068 15.063 1.00 41.30 H new ATOM 405 N ARG A 28 -11.094 0.035 12.634 1.00 24.11 N ATOM 406 CA ARG A 28 -11.601 0.672 11.425 1.00 63.24 C ATOM 407 C ARG A 28 -10.821 1.945 11.113 1.00 45.52 C ATOM 408 O ARG A 28 -10.222 2.072 10.044 1.00 11.41 O ATOM 409 CB ARG A 28 -13.088 0.997 11.579 1.00 63.41 C ATOM 410 CG ARG A 28 -14.001 -0.187 11.306 1.00 72.05 C ATOM 411 CD ARG A 28 -13.768 -1.312 12.301 1.00 21.42 C ATOM 412 NE ARG A 28 -14.946 -2.162 12.453 1.00 70.12 N ATOM 413 CZ ARG A 28 -15.014 -3.180 13.304 1.00 3.51 C ATOM 414 NH1 ARG A 28 -13.977 -3.472 14.077 1.00 64.04 N ATOM 415 NH2 ARG A 28 -16.121 -3.906 13.384 1.00 21.54 N ATOM 0 H ARG A 28 -11.803 -0.145 13.345 1.00 24.11 H new ATOM 0 HA ARG A 28 -11.472 -0.025 10.597 1.00 63.24 H new ATOM 0 HB2 ARG A 28 -13.269 1.359 12.591 1.00 63.41 H new ATOM 0 HB3 ARG A 28 -13.346 1.809 10.899 1.00 63.41 H new ATOM 0 HG2 ARG A 28 -15.041 0.135 11.357 1.00 72.05 H new ATOM 0 HG3 ARG A 28 -13.830 -0.554 10.294 1.00 72.05 H new ATOM 0 HD2 ARG A 28 -12.924 -1.918 11.972 1.00 21.42 H new ATOM 0 HD3 ARG A 28 -13.499 -0.890 13.269 1.00 21.42 H new ATOM 0 HE ARG A 28 -15.762 -1.963 11.874 1.00 70.12 H new ATOM 0 HH11 ARG A 28 -13.125 -2.915 14.019 1.00 64.04 H new ATOM 0 HH12 ARG A 28 -14.032 -4.254 14.730 1.00 64.04 H new ATOM 0 HH21 ARG A 28 -16.921 -3.683 12.792 1.00 21.54 H new ATOM 0 HH22 ARG A 28 -16.172 -4.687 14.038 1.00 21.54 H new ATOM 429 N ILE A 29 -10.832 2.885 12.052 1.00 14.30 N ATOM 430 CA ILE A 29 -10.126 4.148 11.877 1.00 2.14 C ATOM 431 C ILE A 29 -8.689 3.916 11.421 1.00 33.24 C ATOM 432 O ILE A 29 -8.189 4.606 10.533 1.00 25.13 O ATOM 433 CB ILE A 29 -10.113 4.971 13.179 1.00 25.55 C ATOM 434 CG1 ILE A 29 -11.542 5.240 13.653 1.00 54.23 C ATOM 435 CG2 ILE A 29 -9.362 6.278 12.973 1.00 61.43 C ATOM 436 CD1 ILE A 29 -11.614 6.051 14.927 1.00 11.53 C ATOM 0 H ILE A 29 -11.322 2.796 12.942 1.00 14.30 H new ATOM 0 HA ILE A 29 -10.663 4.706 11.110 1.00 2.14 H new ATOM 0 HB ILE A 29 -9.598 4.396 13.949 1.00 25.55 H new ATOM 0 HG12 ILE A 29 -12.084 5.765 12.867 1.00 54.23 H new ATOM 0 HG13 ILE A 29 -12.050 4.288 13.809 1.00 54.23 H new ATOM 0 HG21 ILE A 29 -9.362 6.848 13.902 1.00 61.43 H new ATOM 0 HG22 ILE A 29 -8.335 6.065 12.678 1.00 61.43 H new ATOM 0 HG23 ILE A 29 -9.851 6.859 12.191 1.00 61.43 H new ATOM 0 HD11 ILE A 29 -12.657 6.203 15.203 1.00 11.53 H new ATOM 0 HD12 ILE A 29 -11.101 5.518 15.727 1.00 11.53 H new ATOM 0 HD13 ILE A 29 -11.136 7.018 14.770 1.00 11.53 H new ATOM 448 N LYS A 30 -8.031 2.938 12.034 1.00 61.41 N ATOM 449 CA LYS A 30 -6.652 2.610 11.690 1.00 53.30 C ATOM 450 C LYS A 30 -6.520 2.310 10.200 1.00 22.14 C ATOM 451 O LYS A 30 -5.775 2.980 9.485 1.00 52.50 O ATOM 452 CB LYS A 30 -6.172 1.409 12.508 1.00 54.11 C ATOM 453 CG LYS A 30 -5.468 1.794 13.797 1.00 24.32 C ATOM 454 CD LYS A 30 -5.609 0.711 14.854 1.00 4.21 C ATOM 455 CE LYS A 30 -5.706 1.305 16.251 1.00 43.20 C ATOM 456 NZ LYS A 30 -5.767 0.250 17.300 1.00 70.34 N ATOM 0 H LYS A 30 -8.430 2.358 12.772 1.00 61.41 H new ATOM 0 HA LYS A 30 -6.030 3.473 11.925 1.00 53.30 H new ATOM 0 HB2 LYS A 30 -7.027 0.777 12.746 1.00 54.11 H new ATOM 0 HB3 LYS A 30 -5.494 0.812 11.898 1.00 54.11 H new ATOM 0 HG2 LYS A 30 -4.412 1.973 13.596 1.00 24.32 H new ATOM 0 HG3 LYS A 30 -5.883 2.728 14.174 1.00 24.32 H new ATOM 0 HD2 LYS A 30 -6.498 0.114 14.649 1.00 4.21 H new ATOM 0 HD3 LYS A 30 -4.754 0.037 14.803 1.00 4.21 H new ATOM 0 HE2 LYS A 30 -4.845 1.948 16.433 1.00 43.20 H new ATOM 0 HE3 LYS A 30 -6.593 1.934 16.317 1.00 43.20 H new ATOM 0 HZ1 LYS A 30 -5.832 0.696 18.237 1.00 70.34 H new ATOM 0 HZ2 LYS A 30 -6.603 -0.349 17.142 1.00 70.34 H new ATOM 0 HZ3 LYS A 30 -4.908 -0.335 17.254 1.00 70.34 H new ATOM 470 N LYS A 31 -7.248 1.299 9.738 1.00 23.03 N ATOM 471 CA LYS A 31 -7.214 0.911 8.333 1.00 33.02 C ATOM 472 C LYS A 31 -7.421 2.122 7.429 1.00 5.12 C ATOM 473 O LYS A 31 -6.671 2.332 6.474 1.00 32.33 O ATOM 474 CB LYS A 31 -8.289 -0.141 8.048 1.00 44.25 C ATOM 475 CG LYS A 31 -7.857 -1.558 8.384 1.00 52.24 C ATOM 476 CD LYS A 31 -7.843 -1.795 9.884 1.00 33.44 C ATOM 477 CE LYS A 31 -7.333 -3.187 10.224 1.00 62.43 C ATOM 478 NZ LYS A 31 -5.857 -3.204 10.420 1.00 22.13 N ATOM 0 H LYS A 31 -7.869 0.733 10.317 1.00 23.03 H new ATOM 0 HA LYS A 31 -6.233 0.486 8.122 1.00 33.02 H new ATOM 0 HB2 LYS A 31 -9.184 0.102 8.620 1.00 44.25 H new ATOM 0 HB3 LYS A 31 -8.562 -0.093 6.994 1.00 44.25 H new ATOM 0 HG2 LYS A 31 -8.534 -2.268 7.909 1.00 52.24 H new ATOM 0 HG3 LYS A 31 -6.863 -1.743 7.976 1.00 52.24 H new ATOM 0 HD2 LYS A 31 -7.212 -1.048 10.366 1.00 33.44 H new ATOM 0 HD3 LYS A 31 -8.849 -1.668 10.283 1.00 33.44 H new ATOM 0 HE2 LYS A 31 -7.824 -3.542 11.130 1.00 62.43 H new ATOM 0 HE3 LYS A 31 -7.601 -3.877 9.424 1.00 62.43 H new ATOM 0 HZ1 LYS A 31 -5.548 -4.170 10.650 1.00 22.13 H new ATOM 0 HZ2 LYS A 31 -5.387 -2.889 9.547 1.00 22.13 H new ATOM 0 HZ3 LYS A 31 -5.603 -2.565 11.200 1.00 22.13 H new ATOM 492 N LEU A 32 -8.439 2.917 7.737 1.00 53.34 N ATOM 493 CA LEU A 32 -8.743 4.109 6.952 1.00 11.35 C ATOM 494 C LEU A 32 -7.547 5.055 6.913 1.00 23.30 C ATOM 495 O LEU A 32 -7.099 5.463 5.841 1.00 1.40 O ATOM 496 CB LEU A 32 -9.959 4.831 7.536 1.00 51.32 C ATOM 497 CG LEU A 32 -11.287 4.076 7.464 1.00 64.15 C ATOM 498 CD1 LEU A 32 -12.128 4.357 8.699 1.00 74.44 C ATOM 499 CD2 LEU A 32 -12.047 4.453 6.201 1.00 41.44 C ATOM 0 H LEU A 32 -9.068 2.759 8.524 1.00 53.34 H new ATOM 0 HA LEU A 32 -8.968 3.795 5.933 1.00 11.35 H new ATOM 0 HB2 LEU A 32 -9.752 5.062 8.581 1.00 51.32 H new ATOM 0 HB3 LEU A 32 -10.076 5.782 7.016 1.00 51.32 H new ATOM 0 HG LEU A 32 -11.074 3.007 7.430 1.00 64.15 H new ATOM 0 HD11 LEU A 32 -13.069 3.811 8.630 1.00 74.44 H new ATOM 0 HD12 LEU A 32 -11.587 4.036 9.589 1.00 74.44 H new ATOM 0 HD13 LEU A 32 -12.332 5.426 8.765 1.00 74.44 H new ATOM 0 HD21 LEU A 32 -12.989 3.906 6.167 1.00 41.44 H new ATOM 0 HD22 LEU A 32 -12.249 5.524 6.204 1.00 41.44 H new ATOM 0 HD23 LEU A 32 -11.448 4.199 5.326 1.00 41.44 H new ATOM 511 N THR A 33 -7.031 5.398 8.089 1.00 21.24 N ATOM 512 CA THR A 33 -5.886 6.294 8.190 1.00 61.32 C ATOM 513 C THR A 33 -4.693 5.751 7.411 1.00 52.12 C ATOM 514 O THR A 33 -4.327 6.285 6.363 1.00 31.11 O ATOM 515 CB THR A 33 -5.470 6.512 9.657 1.00 71.21 C ATOM 516 OG1 THR A 33 -6.632 6.703 10.472 1.00 42.20 O ATOM 517 CG2 THR A 33 -4.550 7.717 9.785 1.00 32.42 C ATOM 0 H THR A 33 -7.388 5.068 8.986 1.00 21.24 H new ATOM 0 HA THR A 33 -6.193 7.248 7.762 1.00 61.32 H new ATOM 0 HB THR A 33 -4.931 5.627 9.995 1.00 71.21 H new ATOM 0 HG1 THR A 33 -7.023 5.832 10.694 1.00 42.20 H new ATOM 0 HG21 THR A 33 -4.269 7.851 10.830 1.00 32.42 H new ATOM 0 HG22 THR A 33 -3.654 7.556 9.186 1.00 32.42 H new ATOM 0 HG23 THR A 33 -5.067 8.609 9.431 1.00 32.42 H new ATOM 525 N THR A 34 -4.089 4.686 7.928 1.00 34.52 N ATOM 526 CA THR A 34 -2.937 4.071 7.281 1.00 33.42 C ATOM 527 C THR A 34 -3.127 4.002 5.770 1.00 20.23 C ATOM 528 O THR A 34 -2.216 4.320 5.005 1.00 11.14 O ATOM 529 CB THR A 34 -2.682 2.650 7.820 1.00 0.43 C ATOM 530 OG1 THR A 34 -1.519 2.092 7.199 1.00 4.52 O ATOM 531 CG2 THR A 34 -3.881 1.750 7.564 1.00 52.45 C ATOM 0 H THR A 34 -4.379 4.231 8.794 1.00 34.52 H new ATOM 0 HA THR A 34 -2.075 4.698 7.508 1.00 33.42 H new ATOM 0 HB THR A 34 -2.522 2.717 8.896 1.00 0.43 H new ATOM 0 HG1 THR A 34 -1.363 1.190 7.548 1.00 4.52 H new ATOM 0 HG21 THR A 34 -3.677 0.753 7.953 1.00 52.45 H new ATOM 0 HG22 THR A 34 -4.758 2.162 8.063 1.00 52.45 H new ATOM 0 HG23 THR A 34 -4.068 1.690 6.492 1.00 52.45 H new ATOM 539 N TYR A 35 -4.315 3.585 5.346 1.00 1.33 N ATOM 540 CA TYR A 35 -4.623 3.473 3.926 1.00 53.34 C ATOM 541 C TYR A 35 -4.466 4.820 3.226 1.00 10.02 C ATOM 542 O TYR A 35 -3.707 4.948 2.266 1.00 0.51 O ATOM 543 CB TYR A 35 -6.047 2.948 3.731 1.00 3.21 C ATOM 544 CG TYR A 35 -6.515 2.986 2.294 1.00 61.21 C ATOM 545 CD1 TYR A 35 -7.004 4.159 1.733 1.00 53.11 C ATOM 546 CD2 TYR A 35 -6.469 1.848 1.497 1.00 2.54 C ATOM 547 CE1 TYR A 35 -7.434 4.198 0.420 1.00 1.24 C ATOM 548 CE2 TYR A 35 -6.895 1.879 0.184 1.00 62.33 C ATOM 549 CZ TYR A 35 -7.377 3.056 -0.350 1.00 63.31 C ATOM 550 OH TYR A 35 -7.803 3.090 -1.658 1.00 33.40 O ATOM 0 H TYR A 35 -5.080 3.319 5.966 1.00 1.33 H new ATOM 0 HA TYR A 35 -3.919 2.769 3.483 1.00 53.34 H new ATOM 0 HB2 TYR A 35 -6.100 1.922 4.094 1.00 3.21 H new ATOM 0 HB3 TYR A 35 -6.730 3.538 4.342 1.00 3.21 H new ATOM 0 HD1 TYR A 35 -7.049 5.056 2.333 1.00 53.11 H new ATOM 0 HD2 TYR A 35 -6.094 0.924 1.912 1.00 2.54 H new ATOM 0 HE1 TYR A 35 -7.813 5.118 -0.000 1.00 1.24 H new ATOM 0 HE2 TYR A 35 -6.851 0.986 -0.422 1.00 62.33 H new ATOM 0 HH TYR A 35 -7.061 2.847 -2.250 1.00 33.40 H new ATOM 560 N ALA A 36 -5.189 5.822 3.716 1.00 73.31 N ATOM 561 CA ALA A 36 -5.129 7.160 3.141 1.00 72.31 C ATOM 562 C ALA A 36 -3.685 7.602 2.929 1.00 32.20 C ATOM 563 O ALA A 36 -3.282 7.927 1.811 1.00 13.14 O ATOM 564 CB ALA A 36 -5.861 8.151 4.033 1.00 11.04 C ATOM 0 H ALA A 36 -5.823 5.732 4.510 1.00 73.31 H new ATOM 0 HA ALA A 36 -5.620 7.133 2.168 1.00 72.31 H new ATOM 0 HB1 ALA A 36 -5.808 9.146 3.591 1.00 11.04 H new ATOM 0 HB2 ALA A 36 -6.905 7.852 4.129 1.00 11.04 H new ATOM 0 HB3 ALA A 36 -5.395 8.166 5.018 1.00 11.04 H new ATOM 570 N LEU A 37 -2.910 7.612 4.008 1.00 53.30 N ATOM 571 CA LEU A 37 -1.510 8.015 3.940 1.00 0.53 C ATOM 572 C LEU A 37 -0.743 7.154 2.943 1.00 62.24 C ATOM 573 O LEU A 37 -0.018 7.669 2.091 1.00 75.24 O ATOM 574 CB LEU A 37 -0.862 7.914 5.323 1.00 54.55 C ATOM 575 CG LEU A 37 -1.199 9.037 6.305 1.00 33.42 C ATOM 576 CD1 LEU A 37 -2.287 8.592 7.270 1.00 14.21 C ATOM 577 CD2 LEU A 37 0.045 9.471 7.065 1.00 3.23 C ATOM 0 H LEU A 37 -3.227 7.346 4.940 1.00 53.30 H new ATOM 0 HA LEU A 37 -1.472 9.051 3.602 1.00 0.53 H new ATOM 0 HB2 LEU A 37 -1.156 6.965 5.772 1.00 54.55 H new ATOM 0 HB3 LEU A 37 0.220 7.884 5.194 1.00 54.55 H new ATOM 0 HG LEU A 37 -1.571 9.891 5.738 1.00 33.42 H new ATOM 0 HD11 LEU A 37 -2.514 9.403 7.961 1.00 14.21 H new ATOM 0 HD12 LEU A 37 -3.185 8.330 6.710 1.00 14.21 H new ATOM 0 HD13 LEU A 37 -1.943 7.723 7.831 1.00 14.21 H new ATOM 0 HD21 LEU A 37 -0.213 10.271 7.759 1.00 3.23 H new ATOM 0 HD22 LEU A 37 0.446 8.623 7.621 1.00 3.23 H new ATOM 0 HD23 LEU A 37 0.795 9.830 6.360 1.00 3.23 H new ATOM 589 N ASP A 38 -0.909 5.840 3.053 1.00 5.41 N ATOM 590 CA ASP A 38 -0.234 4.907 2.159 1.00 73.35 C ATOM 591 C ASP A 38 -0.574 5.208 0.702 1.00 5.41 C ATOM 592 O ASP A 38 0.184 4.867 -0.206 1.00 64.24 O ATOM 593 CB ASP A 38 -0.626 3.468 2.499 1.00 60.01 C ATOM 594 CG ASP A 38 0.326 2.452 1.900 1.00 71.53 C ATOM 595 OD1 ASP A 38 1.548 2.706 1.910 1.00 43.13 O ATOM 596 OD2 ASP A 38 -0.151 1.402 1.420 1.00 75.22 O ATOM 0 H ASP A 38 -1.505 5.398 3.752 1.00 5.41 H new ATOM 0 HA ASP A 38 0.841 5.025 2.295 1.00 73.35 H new ATOM 0 HB2 ASP A 38 -0.648 3.347 3.582 1.00 60.01 H new ATOM 0 HB3 ASP A 38 -1.635 3.274 2.136 1.00 60.01 H new ATOM 601 N HIS A 39 -1.718 5.850 0.487 1.00 61.41 N ATOM 602 CA HIS A 39 -2.158 6.197 -0.860 1.00 31.14 C ATOM 603 C HIS A 39 -2.624 7.649 -0.922 1.00 24.55 C ATOM 604 O HIS A 39 -3.816 7.934 -0.802 1.00 24.43 O ATOM 605 CB HIS A 39 -3.287 5.268 -1.305 1.00 73.54 C ATOM 606 CG HIS A 39 -2.835 3.867 -1.585 1.00 54.33 C ATOM 607 ND1 HIS A 39 -3.307 2.772 -0.893 1.00 60.34 N ATOM 608 CD2 HIS A 39 -1.950 3.387 -2.490 1.00 35.22 C ATOM 609 CE1 HIS A 39 -2.730 1.678 -1.359 1.00 14.11 C ATOM 610 NE2 HIS A 39 -1.903 2.024 -2.329 1.00 30.13 N ATOM 0 H HIS A 39 -2.357 6.140 1.227 1.00 61.41 H new ATOM 0 HA HIS A 39 -1.311 6.076 -1.535 1.00 31.14 H new ATOM 0 HB2 HIS A 39 -4.054 5.246 -0.531 1.00 73.54 H new ATOM 0 HB3 HIS A 39 -3.751 5.677 -2.202 1.00 73.54 H new ATOM 0 HD2 HIS A 39 -1.386 3.968 -3.205 1.00 35.22 H new ATOM 0 HE1 HIS A 39 -2.905 0.672 -1.007 1.00 14.11 H new ATOM 0 HE2 HIS A 39 -1.323 1.383 -2.871 1.00 30.13 H new ATOM 618 N ILE A 40 -1.676 8.561 -1.108 1.00 52.14 N ATOM 619 CA ILE A 40 -1.990 9.982 -1.186 1.00 40.42 C ATOM 620 C ILE A 40 -2.557 10.346 -2.554 1.00 44.14 C ATOM 621 O ILE A 40 -2.924 11.495 -2.800 1.00 44.32 O ATOM 622 CB ILE A 40 -0.747 10.849 -0.911 1.00 11.31 C ATOM 623 CG1 ILE A 40 -0.003 10.335 0.323 1.00 0.02 C ATOM 624 CG2 ILE A 40 -1.147 12.305 -0.726 1.00 53.42 C ATOM 625 CD1 ILE A 40 -0.828 10.384 1.590 1.00 2.33 C ATOM 0 H ILE A 40 -0.685 8.341 -1.207 1.00 52.14 H new ATOM 0 HA ILE A 40 -2.739 10.182 -0.420 1.00 40.42 H new ATOM 0 HB ILE A 40 -0.079 10.782 -1.769 1.00 11.31 H new ATOM 0 HG12 ILE A 40 0.313 9.307 0.145 1.00 0.02 H new ATOM 0 HG13 ILE A 40 0.901 10.927 0.465 1.00 0.02 H new ATOM 0 HG21 ILE A 40 -0.258 12.905 -0.532 1.00 53.42 H new ATOM 0 HG22 ILE A 40 -1.638 12.665 -1.630 1.00 53.42 H new ATOM 0 HG23 ILE A 40 -1.832 12.390 0.117 1.00 53.42 H new ATOM 0 HD11 ILE A 40 -0.237 10.005 2.424 1.00 2.33 H new ATOM 0 HD12 ILE A 40 -1.123 11.414 1.793 1.00 2.33 H new ATOM 0 HD13 ILE A 40 -1.720 9.769 1.468 1.00 2.33 H new ATOM 637 N ASP A 41 -2.627 9.359 -3.441 1.00 4.31 N ATOM 638 CA ASP A 41 -3.152 9.574 -4.784 1.00 43.03 C ATOM 639 C ASP A 41 -4.660 9.351 -4.820 1.00 74.12 C ATOM 640 O ASP A 41 -5.226 9.033 -5.867 1.00 1.40 O ATOM 641 CB ASP A 41 -2.462 8.640 -5.780 1.00 2.31 C ATOM 642 CG ASP A 41 -2.365 9.243 -7.168 1.00 32.03 C ATOM 643 OD1 ASP A 41 -1.664 10.265 -7.324 1.00 20.23 O ATOM 644 OD2 ASP A 41 -2.990 8.692 -8.098 1.00 11.41 O ATOM 0 H ASP A 41 -2.327 8.402 -3.254 1.00 4.31 H new ATOM 0 HA ASP A 41 -2.949 10.607 -5.066 1.00 43.03 H new ATOM 0 HB2 ASP A 41 -1.461 8.404 -5.419 1.00 2.31 H new ATOM 0 HB3 ASP A 41 -3.012 7.700 -5.833 1.00 2.31 H new ATOM 649 N ILE A 42 -5.306 9.518 -3.671 1.00 5.13 N ATOM 650 CA ILE A 42 -6.748 9.335 -3.571 1.00 71.13 C ATOM 651 C ILE A 42 -7.335 10.188 -2.451 1.00 63.44 C ATOM 652 O ILE A 42 -8.347 9.829 -1.851 1.00 22.04 O ATOM 653 CB ILE A 42 -7.112 7.859 -3.322 1.00 54.32 C ATOM 654 CG1 ILE A 42 -6.028 7.178 -2.486 1.00 23.24 C ATOM 655 CG2 ILE A 42 -7.305 7.131 -4.644 1.00 14.10 C ATOM 656 CD1 ILE A 42 -6.327 5.728 -2.174 1.00 65.02 C ATOM 0 H ILE A 42 -4.853 9.780 -2.796 1.00 5.13 H new ATOM 0 HA ILE A 42 -7.173 9.650 -4.524 1.00 71.13 H new ATOM 0 HB ILE A 42 -8.050 7.820 -2.768 1.00 54.32 H new ATOM 0 HG12 ILE A 42 -5.079 7.238 -3.018 1.00 23.24 H new ATOM 0 HG13 ILE A 42 -5.905 7.724 -1.551 1.00 23.24 H new ATOM 0 HG21 ILE A 42 -7.562 6.089 -4.452 1.00 14.10 H new ATOM 0 HG22 ILE A 42 -8.109 7.605 -5.206 1.00 14.10 H new ATOM 0 HG23 ILE A 42 -6.382 7.176 -5.222 1.00 14.10 H new ATOM 0 HD11 ILE A 42 -5.516 5.309 -1.578 1.00 65.02 H new ATOM 0 HD12 ILE A 42 -7.260 5.661 -1.614 1.00 65.02 H new ATOM 0 HD13 ILE A 42 -6.421 5.168 -3.104 1.00 65.02 H new ATOM 668 N GLU A 43 -6.692 11.319 -2.178 1.00 33.11 N ATOM 669 CA GLU A 43 -7.152 12.223 -1.130 1.00 43.44 C ATOM 670 C GLU A 43 -8.585 12.677 -1.393 1.00 62.12 C ATOM 671 O GLU A 43 -9.380 12.826 -0.466 1.00 31.15 O ATOM 672 CB GLU A 43 -6.229 13.441 -1.036 1.00 72.40 C ATOM 673 CG GLU A 43 -6.439 14.451 -2.151 1.00 12.31 C ATOM 674 CD GLU A 43 -7.569 15.419 -1.856 1.00 4.11 C ATOM 675 OE1 GLU A 43 -7.903 15.594 -0.665 1.00 75.24 O ATOM 676 OE2 GLU A 43 -8.117 16.001 -2.814 1.00 55.35 O ATOM 0 H GLU A 43 -5.853 11.631 -2.667 1.00 33.11 H new ATOM 0 HA GLU A 43 -7.128 11.683 -0.183 1.00 43.44 H new ATOM 0 HB2 GLU A 43 -6.388 13.933 -0.077 1.00 72.40 H new ATOM 0 HB3 GLU A 43 -5.193 13.103 -1.053 1.00 72.40 H new ATOM 0 HG2 GLU A 43 -5.517 15.011 -2.307 1.00 12.31 H new ATOM 0 HG3 GLU A 43 -6.652 13.922 -3.080 1.00 12.31 H new ATOM 683 N SER A 44 -8.907 12.895 -2.664 1.00 44.23 N ATOM 684 CA SER A 44 -10.242 13.336 -3.050 1.00 20.10 C ATOM 685 C SER A 44 -11.300 12.346 -2.573 1.00 21.35 C ATOM 686 O SER A 44 -12.032 12.612 -1.619 1.00 2.20 O ATOM 687 CB SER A 44 -10.329 13.500 -4.569 1.00 12.15 C ATOM 688 OG SER A 44 -11.528 14.157 -4.942 1.00 43.15 O ATOM 0 H SER A 44 -8.261 12.773 -3.444 1.00 44.23 H new ATOM 0 HA SER A 44 -10.431 14.299 -2.576 1.00 20.10 H new ATOM 0 HB2 SER A 44 -9.472 14.070 -4.926 1.00 12.15 H new ATOM 0 HB3 SER A 44 -10.283 12.522 -5.047 1.00 12.15 H new ATOM 0 HG SER A 44 -11.560 14.252 -5.917 1.00 43.15 H new ATOM 694 N LYS A 45 -11.375 11.201 -3.243 1.00 22.13 N ATOM 695 CA LYS A 45 -12.341 10.168 -2.888 1.00 53.25 C ATOM 696 C LYS A 45 -12.345 9.919 -1.384 1.00 4.44 C ATOM 697 O LYS A 45 -13.404 9.843 -0.760 1.00 62.03 O ATOM 698 CB LYS A 45 -12.024 8.868 -3.630 1.00 71.24 C ATOM 699 CG LYS A 45 -10.541 8.657 -3.881 1.00 60.22 C ATOM 700 CD LYS A 45 -10.131 9.158 -5.256 1.00 30.31 C ATOM 701 CE LYS A 45 -10.012 8.015 -6.253 1.00 15.11 C ATOM 702 NZ LYS A 45 -11.132 8.017 -7.235 1.00 13.15 N ATOM 0 H LYS A 45 -10.778 10.965 -4.035 1.00 22.13 H new ATOM 0 HA LYS A 45 -13.331 10.516 -3.183 1.00 53.25 H new ATOM 0 HB2 LYS A 45 -12.410 8.027 -3.053 1.00 71.24 H new ATOM 0 HB3 LYS A 45 -12.549 8.867 -4.585 1.00 71.24 H new ATOM 0 HG2 LYS A 45 -9.964 9.177 -3.116 1.00 60.22 H new ATOM 0 HG3 LYS A 45 -10.303 7.597 -3.793 1.00 60.22 H new ATOM 0 HD2 LYS A 45 -10.864 9.880 -5.615 1.00 30.31 H new ATOM 0 HD3 LYS A 45 -9.177 9.681 -5.185 1.00 30.31 H new ATOM 0 HE2 LYS A 45 -9.063 8.093 -6.784 1.00 15.11 H new ATOM 0 HE3 LYS A 45 -10.000 7.066 -5.718 1.00 15.11 H new ATOM 0 HZ1 LYS A 45 -11.015 7.223 -7.897 1.00 13.15 H new ATOM 0 HZ2 LYS A 45 -12.036 7.917 -6.731 1.00 13.15 H new ATOM 0 HZ3 LYS A 45 -11.128 8.912 -7.764 1.00 13.15 H new ATOM 716 N ILE A 46 -11.154 9.795 -0.806 1.00 53.34 N ATOM 717 CA ILE A 46 -11.021 9.558 0.626 1.00 72.04 C ATOM 718 C ILE A 46 -11.722 10.647 1.431 1.00 74.33 C ATOM 719 O ILE A 46 -12.767 10.408 2.038 1.00 3.31 O ATOM 720 CB ILE A 46 -9.542 9.493 1.050 1.00 33.15 C ATOM 721 CG1 ILE A 46 -8.885 8.227 0.497 1.00 72.04 C ATOM 722 CG2 ILE A 46 -9.424 9.538 2.567 1.00 74.54 C ATOM 723 CD1 ILE A 46 -7.376 8.237 0.596 1.00 62.31 C ATOM 0 H ILE A 46 -10.268 9.855 -1.308 1.00 53.34 H new ATOM 0 HA ILE A 46 -11.492 8.597 0.832 1.00 72.04 H new ATOM 0 HB ILE A 46 -9.023 10.358 0.638 1.00 33.15 H new ATOM 0 HG12 ILE A 46 -9.271 7.362 1.036 1.00 72.04 H new ATOM 0 HG13 ILE A 46 -9.172 8.105 -0.548 1.00 72.04 H new ATOM 0 HG21 ILE A 46 -8.373 9.491 2.852 1.00 74.54 H new ATOM 0 HG22 ILE A 46 -9.860 10.466 2.938 1.00 74.54 H new ATOM 0 HG23 ILE A 46 -9.955 8.689 2.999 1.00 74.54 H new ATOM 0 HD11 ILE A 46 -6.978 7.309 0.185 1.00 62.31 H new ATOM 0 HD12 ILE A 46 -6.980 9.082 0.033 1.00 62.31 H new ATOM 0 HD13 ILE A 46 -7.081 8.327 1.641 1.00 62.31 H new ATOM 735 N ILE A 47 -11.142 11.842 1.429 1.00 13.14 N ATOM 736 CA ILE A 47 -11.713 12.969 2.157 1.00 33.53 C ATOM 737 C ILE A 47 -13.206 13.104 1.878 1.00 73.31 C ATOM 738 O ILE A 47 -14.009 13.254 2.799 1.00 75.24 O ATOM 739 CB ILE A 47 -11.012 14.290 1.790 1.00 31.32 C ATOM 740 CG1 ILE A 47 -9.542 14.247 2.213 1.00 72.21 C ATOM 741 CG2 ILE A 47 -11.723 15.466 2.443 1.00 24.35 C ATOM 742 CD1 ILE A 47 -9.345 13.973 3.687 1.00 12.14 C ATOM 0 H ILE A 47 -10.277 12.055 0.932 1.00 13.14 H new ATOM 0 HA ILE A 47 -11.561 12.769 3.218 1.00 33.53 H new ATOM 0 HB ILE A 47 -11.056 14.420 0.709 1.00 31.32 H new ATOM 0 HG12 ILE A 47 -9.029 13.477 1.637 1.00 72.21 H new ATOM 0 HG13 ILE A 47 -9.072 15.198 1.963 1.00 72.21 H new ATOM 0 HG21 ILE A 47 -11.216 16.393 2.174 1.00 24.35 H new ATOM 0 HG22 ILE A 47 -12.756 15.504 2.097 1.00 24.35 H new ATOM 0 HG23 ILE A 47 -11.707 15.345 3.526 1.00 24.35 H new ATOM 0 HD11 ILE A 47 -8.279 13.957 3.915 1.00 12.14 H new ATOM 0 HD12 ILE A 47 -9.829 14.756 4.271 1.00 12.14 H new ATOM 0 HD13 ILE A 47 -9.785 13.008 3.940 1.00 12.14 H new ATOM 754 N SER A 48 -13.571 13.048 0.601 1.00 33.40 N ATOM 755 CA SER A 48 -14.968 13.166 0.199 1.00 31.34 C ATOM 756 C SER A 48 -15.821 12.098 0.879 1.00 42.43 C ATOM 757 O SER A 48 -16.918 12.379 1.363 1.00 72.13 O ATOM 758 CB SER A 48 -15.096 13.046 -1.320 1.00 64.54 C ATOM 759 OG SER A 48 -14.514 14.162 -1.971 1.00 1.01 O ATOM 0 H SER A 48 -12.919 12.922 -0.173 1.00 33.40 H new ATOM 0 HA SER A 48 -15.328 14.147 0.510 1.00 31.34 H new ATOM 0 HB2 SER A 48 -14.611 12.130 -1.658 1.00 64.54 H new ATOM 0 HB3 SER A 48 -16.148 12.969 -1.594 1.00 64.54 H new ATOM 0 HG SER A 48 -13.546 14.028 -2.047 1.00 1.01 H new ATOM 765 N LEU A 49 -15.308 10.873 0.911 1.00 55.23 N ATOM 766 CA LEU A 49 -16.022 9.762 1.531 1.00 64.35 C ATOM 767 C LEU A 49 -16.333 10.062 2.993 1.00 12.41 C ATOM 768 O LEU A 49 -17.493 10.237 3.368 1.00 52.05 O ATOM 769 CB LEU A 49 -15.195 8.479 1.427 1.00 75.54 C ATOM 770 CG LEU A 49 -15.953 7.171 1.663 1.00 51.52 C ATOM 771 CD1 LEU A 49 -16.954 6.925 0.544 1.00 23.15 C ATOM 772 CD2 LEU A 49 -14.982 6.006 1.779 1.00 61.42 C ATOM 0 H LEU A 49 -14.401 10.624 0.515 1.00 55.23 H new ATOM 0 HA LEU A 49 -16.964 9.625 1.000 1.00 64.35 H new ATOM 0 HB2 LEU A 49 -14.744 8.441 0.435 1.00 75.54 H new ATOM 0 HB3 LEU A 49 -14.378 8.537 2.147 1.00 75.54 H new ATOM 0 HG LEU A 49 -16.502 7.255 2.601 1.00 51.52 H new ATOM 0 HD11 LEU A 49 -17.484 5.990 0.729 1.00 23.15 H new ATOM 0 HD12 LEU A 49 -17.669 7.747 0.509 1.00 23.15 H new ATOM 0 HD13 LEU A 49 -16.427 6.861 -0.408 1.00 23.15 H new ATOM 0 HD21 LEU A 49 -15.538 5.084 1.947 1.00 61.42 H new ATOM 0 HD22 LEU A 49 -14.406 5.920 0.858 1.00 61.42 H new ATOM 0 HD23 LEU A 49 -14.305 6.178 2.616 1.00 61.42 H new ATOM 784 N ILE A 50 -15.290 10.123 3.814 1.00 14.43 N ATOM 785 CA ILE A 50 -15.453 10.407 5.235 1.00 61.42 C ATOM 786 C ILE A 50 -16.422 11.562 5.458 1.00 53.54 C ATOM 787 O ILE A 50 -17.309 11.487 6.309 1.00 60.23 O ATOM 788 CB ILE A 50 -14.105 10.746 5.899 1.00 54.31 C ATOM 789 CG1 ILE A 50 -13.345 11.777 5.062 1.00 12.32 C ATOM 790 CG2 ILE A 50 -13.273 9.486 6.082 1.00 44.33 C ATOM 791 CD1 ILE A 50 -11.963 12.086 5.594 1.00 51.23 C ATOM 0 H ILE A 50 -14.324 9.980 3.520 1.00 14.43 H new ATOM 0 HA ILE A 50 -15.858 9.504 5.693 1.00 61.42 H new ATOM 0 HB ILE A 50 -14.298 11.175 6.882 1.00 54.31 H new ATOM 0 HG12 ILE A 50 -13.258 11.410 4.039 1.00 12.32 H new ATOM 0 HG13 ILE A 50 -13.925 12.699 5.022 1.00 12.32 H new ATOM 0 HG21 ILE A 50 -12.324 9.742 6.552 1.00 44.33 H new ATOM 0 HG22 ILE A 50 -13.813 8.782 6.715 1.00 44.33 H new ATOM 0 HG23 ILE A 50 -13.085 9.030 5.110 1.00 44.33 H new ATOM 0 HD11 ILE A 50 -11.482 12.824 4.952 1.00 51.23 H new ATOM 0 HD12 ILE A 50 -12.043 12.483 6.606 1.00 51.23 H new ATOM 0 HD13 ILE A 50 -11.366 11.174 5.608 1.00 51.23 H new ATOM 803 N ILE A 51 -16.248 12.630 4.686 1.00 13.33 N ATOM 804 CA ILE A 51 -17.110 13.801 4.797 1.00 23.15 C ATOM 805 C ILE A 51 -18.575 13.425 4.607 1.00 32.03 C ATOM 806 O ILE A 51 -19.413 13.698 5.467 1.00 54.43 O ATOM 807 CB ILE A 51 -16.730 14.879 3.766 1.00 41.34 C ATOM 808 CG1 ILE A 51 -15.418 15.558 4.164 1.00 11.45 C ATOM 809 CG2 ILE A 51 -17.846 15.905 3.637 1.00 41.33 C ATOM 810 CD1 ILE A 51 -14.893 16.519 3.120 1.00 30.34 C ATOM 0 H ILE A 51 -15.519 12.709 3.977 1.00 13.33 H new ATOM 0 HA ILE A 51 -16.968 14.203 5.800 1.00 23.15 H new ATOM 0 HB ILE A 51 -16.589 14.400 2.797 1.00 41.34 H new ATOM 0 HG12 ILE A 51 -15.567 16.097 5.100 1.00 11.45 H new ATOM 0 HG13 ILE A 51 -14.665 14.793 4.353 1.00 11.45 H new ATOM 0 HG21 ILE A 51 -17.563 16.661 2.904 1.00 41.33 H new ATOM 0 HG22 ILE A 51 -18.760 15.409 3.311 1.00 41.33 H new ATOM 0 HG23 ILE A 51 -18.016 16.381 4.603 1.00 41.33 H new ATOM 0 HD11 ILE A 51 -13.961 16.963 3.470 1.00 30.34 H new ATOM 0 HD12 ILE A 51 -14.712 15.982 2.189 1.00 30.34 H new ATOM 0 HD13 ILE A 51 -15.627 17.306 2.948 1.00 30.34 H new ATOM 822 N ASP A 52 -18.877 12.795 3.477 1.00 2.23 N ATOM 823 CA ASP A 52 -20.241 12.378 3.175 1.00 51.31 C ATOM 824 C ASP A 52 -20.787 11.469 4.271 1.00 12.14 C ATOM 825 O ASP A 52 -21.937 11.605 4.689 1.00 14.21 O ATOM 826 CB ASP A 52 -20.290 11.658 1.826 1.00 11.15 C ATOM 827 CG ASP A 52 -21.519 12.025 1.018 1.00 11.23 C ATOM 828 OD1 ASP A 52 -21.546 13.138 0.453 1.00 14.44 O ATOM 829 OD2 ASP A 52 -22.454 11.200 0.951 1.00 20.43 O ATOM 0 H ASP A 52 -18.195 12.562 2.755 1.00 2.23 H new ATOM 0 HA ASP A 52 -20.865 13.271 3.125 1.00 51.31 H new ATOM 0 HB2 ASP A 52 -19.396 11.904 1.254 1.00 11.15 H new ATOM 0 HB3 ASP A 52 -20.276 10.581 1.992 1.00 11.15 H new ATOM 834 N TYR A 53 -19.955 10.542 4.732 1.00 34.33 N ATOM 835 CA TYR A 53 -20.356 9.607 5.778 1.00 42.43 C ATOM 836 C TYR A 53 -20.827 10.352 7.023 1.00 52.52 C ATOM 837 O TYR A 53 -21.786 9.945 7.678 1.00 32.20 O ATOM 838 CB TYR A 53 -19.193 8.680 6.134 1.00 32.34 C ATOM 839 CG TYR A 53 -19.432 7.863 7.384 1.00 22.12 C ATOM 840 CD1 TYR A 53 -19.416 8.458 8.640 1.00 64.41 C ATOM 841 CD2 TYR A 53 -19.672 6.497 7.310 1.00 74.43 C ATOM 842 CE1 TYR A 53 -19.632 7.715 9.785 1.00 54.33 C ATOM 843 CE2 TYR A 53 -19.892 5.747 8.449 1.00 63.30 C ATOM 844 CZ TYR A 53 -19.870 6.361 9.684 1.00 35.50 C ATOM 845 OH TYR A 53 -20.087 5.617 10.821 1.00 30.24 O ATOM 0 H TYR A 53 -18.999 10.417 4.399 1.00 34.33 H new ATOM 0 HA TYR A 53 -21.185 9.010 5.399 1.00 42.43 H new ATOM 0 HB2 TYR A 53 -19.008 8.005 5.298 1.00 32.34 H new ATOM 0 HB3 TYR A 53 -18.291 9.277 6.267 1.00 32.34 H new ATOM 0 HD1 TYR A 53 -19.232 9.519 8.723 1.00 64.41 H new ATOM 0 HD2 TYR A 53 -19.687 6.013 6.345 1.00 74.43 H new ATOM 0 HE1 TYR A 53 -19.614 8.192 10.754 1.00 54.33 H new ATOM 0 HE2 TYR A 53 -20.080 4.686 8.373 1.00 63.30 H new ATOM 0 HH TYR A 53 -21.041 5.631 11.044 1.00 30.24 H new ATOM 855 N SER A 54 -20.145 11.448 7.342 1.00 34.25 N ATOM 856 CA SER A 54 -20.491 12.250 8.510 1.00 30.44 C ATOM 857 C SER A 54 -21.887 12.847 8.366 1.00 75.34 C ATOM 858 O SER A 54 -22.821 12.447 9.062 1.00 4.34 O ATOM 859 CB SER A 54 -19.465 13.366 8.710 1.00 3.45 C ATOM 860 OG SER A 54 -19.674 14.422 7.789 1.00 11.40 O ATOM 0 H SER A 54 -19.350 11.800 6.808 1.00 34.25 H new ATOM 0 HA SER A 54 -20.483 11.597 9.383 1.00 30.44 H new ATOM 0 HB2 SER A 54 -19.533 13.749 9.728 1.00 3.45 H new ATOM 0 HB3 SER A 54 -18.459 12.966 8.587 1.00 3.45 H new ATOM 0 HG SER A 54 -19.119 14.278 6.994 1.00 11.40 H new ATOM 866 N ARG A 55 -22.023 13.806 7.456 1.00 64.24 N ATOM 867 CA ARG A 55 -23.304 14.460 7.219 1.00 20.32 C ATOM 868 C ARG A 55 -24.379 13.437 6.865 1.00 33.41 C ATOM 869 O ARG A 55 -25.568 13.663 7.098 1.00 65.12 O ATOM 870 CB ARG A 55 -23.175 15.490 6.096 1.00 74.13 C ATOM 871 CG ARG A 55 -23.887 15.086 4.815 1.00 54.41 C ATOM 872 CD ARG A 55 -22.976 14.284 3.900 1.00 61.31 C ATOM 873 NE ARG A 55 -23.696 13.217 3.209 1.00 25.13 N ATOM 874 CZ ARG A 55 -24.619 13.436 2.280 1.00 62.44 C ATOM 875 NH1 ARG A 55 -24.933 14.676 1.931 1.00 64.31 N ATOM 876 NH2 ARG A 55 -25.230 12.412 1.696 1.00 1.42 N ATOM 0 H ARG A 55 -21.261 14.147 6.870 1.00 64.24 H new ATOM 0 HA ARG A 55 -23.599 14.969 8.137 1.00 20.32 H new ATOM 0 HB2 ARG A 55 -23.577 16.443 6.440 1.00 74.13 H new ATOM 0 HB3 ARG A 55 -22.119 15.649 5.880 1.00 74.13 H new ATOM 0 HG2 ARG A 55 -24.770 14.496 5.059 1.00 54.41 H new ATOM 0 HG3 ARG A 55 -24.234 15.978 4.294 1.00 54.41 H new ATOM 0 HD2 ARG A 55 -22.522 14.950 3.166 1.00 61.31 H new ATOM 0 HD3 ARG A 55 -22.163 13.853 4.485 1.00 61.31 H new ATOM 0 HE ARG A 55 -23.478 12.251 3.454 1.00 25.13 H new ATOM 0 HH11 ARG A 55 -24.465 15.465 2.377 1.00 64.31 H new ATOM 0 HH12 ARG A 55 -25.643 14.841 1.217 1.00 64.31 H new ATOM 0 HH21 ARG A 55 -24.990 11.457 1.961 1.00 1.42 H new ATOM 0 HH22 ARG A 55 -25.939 12.581 0.982 1.00 1.42 H new ATOM 890 N LEU A 56 -23.955 12.311 6.301 1.00 42.30 N ATOM 891 CA LEU A 56 -24.881 11.253 5.914 1.00 71.21 C ATOM 892 C LEU A 56 -25.915 11.007 7.008 1.00 55.54 C ATOM 893 O LEU A 56 -27.067 11.430 6.893 1.00 4.32 O ATOM 894 CB LEU A 56 -24.116 9.961 5.620 1.00 33.03 C ATOM 895 CG LEU A 56 -23.990 9.576 4.146 1.00 74.30 C ATOM 896 CD1 LEU A 56 -23.245 8.258 4.000 1.00 3.33 C ATOM 897 CD2 LEU A 56 -25.365 9.487 3.499 1.00 43.24 C ATOM 0 H LEU A 56 -22.976 12.108 6.102 1.00 42.30 H new ATOM 0 HA LEU A 56 -25.403 11.573 5.012 1.00 71.21 H new ATOM 0 HB2 LEU A 56 -23.113 10.053 6.038 1.00 33.03 H new ATOM 0 HB3 LEU A 56 -24.607 9.143 6.148 1.00 33.03 H new ATOM 0 HG LEU A 56 -23.419 10.351 3.635 1.00 74.30 H new ATOM 0 HD11 LEU A 56 -23.165 8.000 2.944 1.00 3.33 H new ATOM 0 HD12 LEU A 56 -22.247 8.355 4.426 1.00 3.33 H new ATOM 0 HD13 LEU A 56 -23.789 7.473 4.525 1.00 3.33 H new ATOM 0 HD21 LEU A 56 -25.256 9.212 2.450 1.00 43.24 H new ATOM 0 HD22 LEU A 56 -25.960 8.732 4.012 1.00 43.24 H new ATOM 0 HD23 LEU A 56 -25.864 10.453 3.571 1.00 43.24 H new ATOM 909 N CYS A 57 -25.497 10.324 8.067 1.00 14.43 N ATOM 910 CA CYS A 57 -26.388 10.024 9.183 1.00 25.02 C ATOM 911 C CYS A 57 -26.257 11.075 10.281 1.00 60.21 C ATOM 912 O CYS A 57 -25.357 11.915 10.266 1.00 30.24 O ATOM 913 CB CYS A 57 -26.080 8.637 9.749 1.00 23.11 C ATOM 914 SG CYS A 57 -27.289 7.371 9.298 1.00 61.43 S ATOM 0 H CYS A 57 -24.548 9.967 8.177 1.00 14.43 H new ATOM 0 HA CYS A 57 -27.413 10.038 8.812 1.00 25.02 H new ATOM 0 HB2 CYS A 57 -25.096 8.325 9.401 1.00 23.11 H new ATOM 0 HB3 CYS A 57 -26.027 8.703 10.836 1.00 23.11 H new ATOM 0 HG CYS A 57 -26.941 6.233 9.821 1.00 61.43 H new ATOM 920 N PRO A 58 -27.177 11.030 11.256 1.00 70.21 N ATOM 921 CA PRO A 58 -27.187 11.972 12.379 1.00 22.42 C ATOM 922 C PRO A 58 -26.020 11.746 13.335 1.00 34.21 C ATOM 923 O PRO A 58 -25.000 11.168 12.959 1.00 12.22 O ATOM 924 CB PRO A 58 -28.516 11.676 13.078 1.00 10.04 C ATOM 925 CG PRO A 58 -28.825 10.263 12.722 1.00 33.14 C ATOM 926 CD PRO A 58 -28.278 10.056 11.337 1.00 33.41 C ATOM 0 HA PRO A 58 -27.086 13.005 12.046 1.00 22.42 H new ATOM 0 HB2 PRO A 58 -28.432 11.803 14.157 1.00 10.04 H new ATOM 0 HB3 PRO A 58 -29.301 12.351 12.737 1.00 10.04 H new ATOM 0 HG2 PRO A 58 -28.366 9.573 13.430 1.00 33.14 H new ATOM 0 HG3 PRO A 58 -29.899 10.080 12.749 1.00 33.14 H new ATOM 0 HD2 PRO A 58 -27.923 9.035 11.194 1.00 33.41 H new ATOM 0 HD3 PRO A 58 -29.035 10.240 10.574 1.00 33.41 H new ATOM 934 N ASP A 59 -26.178 12.204 14.572 1.00 50.31 N ATOM 935 CA ASP A 59 -25.138 12.051 15.583 1.00 70.24 C ATOM 936 C ASP A 59 -24.318 10.789 15.332 1.00 53.05 C ATOM 937 O ASP A 59 -23.091 10.839 15.256 1.00 4.14 O ATOM 938 CB ASP A 59 -25.758 12.001 16.980 1.00 52.42 C ATOM 939 CG ASP A 59 -24.721 11.797 18.067 1.00 52.23 C ATOM 940 OD1 ASP A 59 -23.516 11.791 17.742 1.00 24.21 O ATOM 941 OD2 ASP A 59 -25.115 11.643 19.242 1.00 73.01 O ATOM 0 H ASP A 59 -27.016 12.684 14.899 1.00 50.31 H new ATOM 0 HA ASP A 59 -24.474 12.913 15.519 1.00 70.24 H new ATOM 0 HB2 ASP A 59 -26.299 12.928 17.168 1.00 52.42 H new ATOM 0 HB3 ASP A 59 -26.488 11.192 17.022 1.00 52.42 H new ATOM 946 N SER A 60 -25.006 9.659 15.204 1.00 64.53 N ATOM 947 CA SER A 60 -24.341 8.383 14.966 1.00 20.51 C ATOM 948 C SER A 60 -23.095 8.571 14.106 1.00 71.11 C ATOM 949 O SER A 60 -21.971 8.560 14.609 1.00 33.14 O ATOM 950 CB SER A 60 -25.300 7.403 14.287 1.00 21.43 C ATOM 951 OG SER A 60 -26.353 7.032 15.161 1.00 65.45 O ATOM 0 H SER A 60 -26.023 9.601 15.261 1.00 64.53 H new ATOM 0 HA SER A 60 -24.037 7.975 15.930 1.00 20.51 H new ATOM 0 HB2 SER A 60 -25.713 7.858 13.387 1.00 21.43 H new ATOM 0 HB3 SER A 60 -24.754 6.514 13.972 1.00 21.43 H new ATOM 0 HG SER A 60 -26.953 6.407 14.703 1.00 65.45 H new ATOM 957 N HIS A 61 -23.303 8.744 12.804 1.00 21.43 N ATOM 958 CA HIS A 61 -22.197 8.935 11.872 1.00 12.15 C ATOM 959 C HIS A 61 -21.386 10.174 12.239 1.00 10.22 C ATOM 960 O HIS A 61 -20.162 10.190 12.105 1.00 12.33 O ATOM 961 CB HIS A 61 -22.724 9.061 10.442 1.00 23.35 C ATOM 962 CG HIS A 61 -22.976 7.742 9.779 1.00 34.23 C ATOM 963 ND1 HIS A 61 -22.698 7.502 8.450 1.00 2.12 N ATOM 964 CD2 HIS A 61 -23.484 6.587 10.270 1.00 24.21 C ATOM 965 CE1 HIS A 61 -23.024 6.257 8.152 1.00 53.32 C ATOM 966 NE2 HIS A 61 -23.503 5.680 9.239 1.00 12.10 N ATOM 0 H HIS A 61 -24.226 8.756 12.371 1.00 21.43 H new ATOM 0 HA HIS A 61 -21.545 8.064 11.936 1.00 12.15 H new ATOM 0 HB2 HIS A 61 -23.650 9.635 10.454 1.00 23.35 H new ATOM 0 HB3 HIS A 61 -22.006 9.626 9.847 1.00 23.35 H new ATOM 0 HD1 HIS A 61 -22.302 8.180 7.799 1.00 2.12 H new ATOM 0 HD2 HIS A 61 -23.813 6.412 11.284 1.00 24.21 H new ATOM 0 HE1 HIS A 61 -22.917 5.790 7.184 1.00 53.32 H new ATOM 974 N LYS A 62 -22.076 11.211 12.702 1.00 42.42 N ATOM 975 CA LYS A 62 -21.421 12.455 13.089 1.00 43.34 C ATOM 976 C LYS A 62 -20.214 12.180 13.981 1.00 55.42 C ATOM 977 O LYS A 62 -19.072 12.429 13.592 1.00 14.11 O ATOM 978 CB LYS A 62 -22.408 13.371 13.816 1.00 71.04 C ATOM 979 CG LYS A 62 -23.647 13.698 13.001 1.00 52.54 C ATOM 980 CD LYS A 62 -23.580 15.102 12.423 1.00 44.23 C ATOM 981 CE LYS A 62 -23.663 15.084 10.904 1.00 0.31 C ATOM 982 NZ LYS A 62 -22.879 16.193 10.292 1.00 23.44 N ATOM 0 H LYS A 62 -23.089 11.214 12.818 1.00 42.42 H new ATOM 0 HA LYS A 62 -21.075 12.951 12.182 1.00 43.34 H new ATOM 0 HB2 LYS A 62 -22.712 12.896 14.749 1.00 71.04 H new ATOM 0 HB3 LYS A 62 -21.902 14.299 14.081 1.00 71.04 H new ATOM 0 HG2 LYS A 62 -23.753 12.975 12.192 1.00 52.54 H new ATOM 0 HG3 LYS A 62 -24.532 13.604 13.630 1.00 52.54 H new ATOM 0 HD2 LYS A 62 -24.396 15.702 12.826 1.00 44.23 H new ATOM 0 HD3 LYS A 62 -22.650 15.580 12.732 1.00 44.23 H new ATOM 0 HE2 LYS A 62 -23.293 14.129 10.531 1.00 0.31 H new ATOM 0 HE3 LYS A 62 -24.706 15.164 10.596 1.00 0.31 H new ATOM 0 HZ1 LYS A 62 -23.449 16.656 9.555 1.00 23.44 H new ATOM 0 HZ2 LYS A 62 -22.630 16.888 11.025 1.00 23.44 H new ATOM 0 HZ3 LYS A 62 -22.010 15.811 9.868 1.00 23.44 H new ATOM 996 N LEU A 63 -20.475 11.665 15.177 1.00 24.02 N ATOM 997 CA LEU A 63 -19.410 11.354 16.125 1.00 44.45 C ATOM 998 C LEU A 63 -18.341 10.480 15.476 1.00 54.24 C ATOM 999 O LEU A 63 -17.165 10.839 15.445 1.00 11.22 O ATOM 1000 CB LEU A 63 -19.984 10.649 17.355 1.00 41.34 C ATOM 1001 CG LEU A 63 -18.973 10.240 18.427 1.00 52.34 C ATOM 1002 CD1 LEU A 63 -18.049 11.401 18.760 1.00 50.23 C ATOM 1003 CD2 LEU A 63 -19.690 9.751 19.677 1.00 52.34 C ATOM 0 H LEU A 63 -21.414 11.454 15.514 1.00 24.02 H new ATOM 0 HA LEU A 63 -18.948 12.292 16.434 1.00 44.45 H new ATOM 0 HB2 LEU A 63 -20.724 11.306 17.813 1.00 41.34 H new ATOM 0 HB3 LEU A 63 -20.513 9.756 17.023 1.00 41.34 H new ATOM 0 HG LEU A 63 -18.368 9.422 18.036 1.00 52.34 H new ATOM 0 HD11 LEU A 63 -17.337 11.091 19.525 1.00 50.23 H new ATOM 0 HD12 LEU A 63 -17.509 11.705 17.863 1.00 50.23 H new ATOM 0 HD13 LEU A 63 -18.638 12.240 19.131 1.00 50.23 H new ATOM 0 HD21 LEU A 63 -18.955 9.464 20.429 1.00 52.34 H new ATOM 0 HD22 LEU A 63 -20.320 10.549 20.071 1.00 52.34 H new ATOM 0 HD23 LEU A 63 -20.309 8.889 19.428 1.00 52.34 H new ATOM 1015 N GLY A 64 -18.760 9.331 14.955 1.00 35.40 N ATOM 1016 CA GLY A 64 -17.828 8.424 14.312 1.00 62.14 C ATOM 1017 C GLY A 64 -16.942 9.125 13.300 1.00 34.52 C ATOM 1018 O GLY A 64 -15.728 8.923 13.283 1.00 11.33 O ATOM 0 H GLY A 64 -19.729 9.012 14.967 1.00 35.40 H new ATOM 0 HA2 GLY A 64 -17.204 7.951 15.070 1.00 62.14 H new ATOM 0 HA3 GLY A 64 -18.384 7.629 13.815 1.00 62.14 H new ATOM 1022 N SER A 65 -17.551 9.949 12.453 1.00 32.53 N ATOM 1023 CA SER A 65 -16.811 10.677 11.430 1.00 3.21 C ATOM 1024 C SER A 65 -15.706 11.523 12.057 1.00 34.23 C ATOM 1025 O SER A 65 -14.540 11.424 11.675 1.00 43.54 O ATOM 1026 CB SER A 65 -17.757 11.570 10.624 1.00 24.42 C ATOM 1027 OG SER A 65 -17.217 12.870 10.463 1.00 61.14 O ATOM 0 H SER A 65 -18.555 10.129 12.455 1.00 32.53 H new ATOM 0 HA SER A 65 -16.352 9.949 10.761 1.00 3.21 H new ATOM 0 HB2 SER A 65 -17.938 11.124 9.646 1.00 24.42 H new ATOM 0 HB3 SER A 65 -18.721 11.633 11.129 1.00 24.42 H new ATOM 0 HG SER A 65 -17.765 13.515 10.956 1.00 61.14 H new ATOM 1033 N LEU A 66 -16.083 12.354 13.023 1.00 23.40 N ATOM 1034 CA LEU A 66 -15.125 13.218 13.705 1.00 75.20 C ATOM 1035 C LEU A 66 -13.859 12.448 14.068 1.00 53.35 C ATOM 1036 O LEU A 66 -12.749 12.876 13.751 1.00 61.55 O ATOM 1037 CB LEU A 66 -15.754 13.812 14.967 1.00 43.02 C ATOM 1038 CG LEU A 66 -17.029 14.630 14.760 1.00 2.42 C ATOM 1039 CD1 LEU A 66 -17.211 15.629 15.892 1.00 12.24 C ATOM 1040 CD2 LEU A 66 -16.992 15.345 13.417 1.00 33.40 C ATOM 0 H LEU A 66 -17.044 12.448 13.351 1.00 23.40 H new ATOM 0 HA LEU A 66 -14.854 14.026 13.026 1.00 75.20 H new ATOM 0 HB2 LEU A 66 -15.977 12.997 15.656 1.00 43.02 H new ATOM 0 HB3 LEU A 66 -15.014 14.447 15.453 1.00 43.02 H new ATOM 0 HG LEU A 66 -17.880 13.948 14.763 1.00 2.42 H new ATOM 0 HD11 LEU A 66 -18.123 16.202 15.728 1.00 12.24 H new ATOM 0 HD12 LEU A 66 -17.283 15.096 16.840 1.00 12.24 H new ATOM 0 HD13 LEU A 66 -16.357 16.306 15.921 1.00 12.24 H new ATOM 0 HD21 LEU A 66 -17.907 15.922 13.287 1.00 33.40 H new ATOM 0 HD22 LEU A 66 -16.133 16.015 13.385 1.00 33.40 H new ATOM 0 HD23 LEU A 66 -16.909 14.610 12.616 1.00 33.40 H new ATOM 1052 N TYR A 67 -14.034 11.311 14.731 1.00 12.24 N ATOM 1053 CA TYR A 67 -12.906 10.482 15.137 1.00 23.22 C ATOM 1054 C TYR A 67 -12.060 10.084 13.931 1.00 35.10 C ATOM 1055 O TYR A 67 -10.839 10.239 13.937 1.00 21.41 O ATOM 1056 CB TYR A 67 -13.401 9.229 15.862 1.00 10.44 C ATOM 1057 CG TYR A 67 -13.713 9.459 17.324 1.00 50.51 C ATOM 1058 CD1 TYR A 67 -13.835 10.746 17.834 1.00 0.20 C ATOM 1059 CD2 TYR A 67 -13.885 8.391 18.195 1.00 62.33 C ATOM 1060 CE1 TYR A 67 -14.119 10.961 19.169 1.00 52.53 C ATOM 1061 CE2 TYR A 67 -14.171 8.596 19.530 1.00 3.44 C ATOM 1062 CZ TYR A 67 -14.287 9.883 20.013 1.00 43.43 C ATOM 1063 OH TYR A 67 -14.570 10.093 21.343 1.00 60.40 O ATOM 0 H TYR A 67 -14.946 10.942 14.999 1.00 12.24 H new ATOM 0 HA TYR A 67 -12.286 11.066 15.817 1.00 23.22 H new ATOM 0 HB2 TYR A 67 -14.296 8.860 15.362 1.00 10.44 H new ATOM 0 HB3 TYR A 67 -12.645 8.449 15.779 1.00 10.44 H new ATOM 0 HD1 TYR A 67 -13.706 11.592 17.176 1.00 0.20 H new ATOM 0 HD2 TYR A 67 -13.793 7.382 17.821 1.00 62.33 H new ATOM 0 HE1 TYR A 67 -14.209 11.968 19.550 1.00 52.53 H new ATOM 0 HE2 TYR A 67 -14.303 7.753 20.193 1.00 3.44 H new ATOM 0 HH TYR A 67 -14.659 9.230 21.799 1.00 60.40 H new ATOM 1073 N ILE A 68 -12.720 9.571 12.898 1.00 52.41 N ATOM 1074 CA ILE A 68 -12.031 9.153 11.684 1.00 60.24 C ATOM 1075 C ILE A 68 -11.235 10.304 11.079 1.00 64.01 C ATOM 1076 O ILE A 68 -10.028 10.190 10.860 1.00 32.30 O ATOM 1077 CB ILE A 68 -13.020 8.619 10.631 1.00 61.43 C ATOM 1078 CG1 ILE A 68 -13.597 7.274 11.077 1.00 21.31 C ATOM 1079 CG2 ILE A 68 -12.334 8.484 9.280 1.00 45.44 C ATOM 1080 CD1 ILE A 68 -14.784 6.823 10.255 1.00 62.41 C ATOM 0 H ILE A 68 -13.731 9.435 12.878 1.00 52.41 H new ATOM 0 HA ILE A 68 -11.348 8.353 11.969 1.00 60.24 H new ATOM 0 HB ILE A 68 -13.840 9.330 10.531 1.00 61.43 H new ATOM 0 HG12 ILE A 68 -12.816 6.516 11.019 1.00 21.31 H new ATOM 0 HG13 ILE A 68 -13.896 7.345 12.123 1.00 21.31 H new ATOM 0 HG21 ILE A 68 -13.046 8.106 8.547 1.00 45.44 H new ATOM 0 HG22 ILE A 68 -11.967 9.459 8.959 1.00 45.44 H new ATOM 0 HG23 ILE A 68 -11.497 7.791 9.365 1.00 45.44 H new ATOM 0 HD11 ILE A 68 -15.141 5.863 10.627 1.00 62.41 H new ATOM 0 HD12 ILE A 68 -15.582 7.561 10.333 1.00 62.41 H new ATOM 0 HD13 ILE A 68 -14.486 6.719 9.212 1.00 62.41 H new ATOM 1092 N ILE A 69 -11.917 11.413 10.813 1.00 61.30 N ATOM 1093 CA ILE A 69 -11.272 12.586 10.236 1.00 32.04 C ATOM 1094 C ILE A 69 -10.110 13.056 11.104 1.00 44.41 C ATOM 1095 O ILE A 69 -9.093 13.527 10.595 1.00 45.35 O ATOM 1096 CB ILE A 69 -12.269 13.747 10.060 1.00 32.45 C ATOM 1097 CG1 ILE A 69 -13.383 13.348 9.091 1.00 54.04 C ATOM 1098 CG2 ILE A 69 -11.550 14.993 9.566 1.00 64.51 C ATOM 1099 CD1 ILE A 69 -14.678 14.098 9.316 1.00 44.00 C ATOM 0 H ILE A 69 -12.916 11.524 10.988 1.00 61.30 H new ATOM 0 HA ILE A 69 -10.895 12.290 9.257 1.00 32.04 H new ATOM 0 HB ILE A 69 -12.718 13.971 11.028 1.00 32.45 H new ATOM 0 HG12 ILE A 69 -13.045 13.522 8.070 1.00 54.04 H new ATOM 0 HG13 ILE A 69 -13.571 12.279 9.187 1.00 54.04 H new ATOM 0 HG21 ILE A 69 -12.268 15.804 9.447 1.00 64.51 H new ATOM 0 HG22 ILE A 69 -10.789 15.285 10.290 1.00 64.51 H new ATOM 0 HG23 ILE A 69 -11.076 14.784 8.607 1.00 64.51 H new ATOM 0 HD11 ILE A 69 -15.422 13.764 8.593 1.00 44.00 H new ATOM 0 HD12 ILE A 69 -15.040 13.904 10.326 1.00 44.00 H new ATOM 0 HD13 ILE A 69 -14.506 15.167 9.191 1.00 44.00 H new ATOM 1111 N ASP A 70 -10.267 12.924 12.416 1.00 24.13 N ATOM 1112 CA ASP A 70 -9.229 13.333 13.356 1.00 63.44 C ATOM 1113 C ASP A 70 -7.914 12.617 13.058 1.00 14.51 C ATOM 1114 O ASP A 70 -6.885 13.256 12.837 1.00 73.42 O ATOM 1115 CB ASP A 70 -9.668 13.043 14.792 1.00 62.43 C ATOM 1116 CG ASP A 70 -8.506 12.656 15.685 1.00 22.25 C ATOM 1117 OD1 ASP A 70 -7.762 13.562 16.117 1.00 30.54 O ATOM 1118 OD2 ASP A 70 -8.341 11.448 15.954 1.00 62.43 O ATOM 0 H ASP A 70 -11.103 12.537 12.854 1.00 24.13 H new ATOM 0 HA ASP A 70 -9.072 14.406 13.242 1.00 63.44 H new ATOM 0 HB2 ASP A 70 -10.161 13.924 15.203 1.00 62.43 H new ATOM 0 HB3 ASP A 70 -10.404 12.239 14.789 1.00 62.43 H new ATOM 1123 N SER A 71 -7.957 11.289 13.056 1.00 63.02 N ATOM 1124 CA SER A 71 -6.768 10.487 12.790 1.00 33.25 C ATOM 1125 C SER A 71 -6.153 10.856 11.444 1.00 1.22 C ATOM 1126 O SER A 71 -4.984 11.234 11.367 1.00 44.51 O ATOM 1127 CB SER A 71 -7.117 8.997 12.813 1.00 1.32 C ATOM 1128 OG SER A 71 -6.023 8.224 13.275 1.00 2.43 O ATOM 0 H SER A 71 -8.801 10.746 13.235 1.00 63.02 H new ATOM 0 HA SER A 71 -6.038 10.694 13.572 1.00 33.25 H new ATOM 0 HB2 SER A 71 -7.980 8.832 13.458 1.00 1.32 H new ATOM 0 HB3 SER A 71 -7.400 8.671 11.812 1.00 1.32 H new ATOM 0 HG SER A 71 -5.994 8.251 14.254 1.00 2.43 H new ATOM 1134 N ILE A 72 -6.949 10.743 10.386 1.00 2.42 N ATOM 1135 CA ILE A 72 -6.484 11.066 9.043 1.00 4.31 C ATOM 1136 C ILE A 72 -5.912 12.479 8.984 1.00 72.21 C ATOM 1137 O ILE A 72 -4.847 12.705 8.412 1.00 4.24 O ATOM 1138 CB ILE A 72 -7.618 10.940 8.009 1.00 62.31 C ATOM 1139 CG1 ILE A 72 -8.075 9.484 7.896 1.00 23.24 C ATOM 1140 CG2 ILE A 72 -7.161 11.463 6.655 1.00 13.44 C ATOM 1141 CD1 ILE A 72 -9.200 9.278 6.906 1.00 3.43 C ATOM 0 H ILE A 72 -7.919 10.430 10.433 1.00 2.42 H new ATOM 0 HA ILE A 72 -5.700 10.349 8.800 1.00 4.31 H new ATOM 0 HB ILE A 72 -8.463 11.542 8.343 1.00 62.31 H new ATOM 0 HG12 ILE A 72 -7.226 8.867 7.602 1.00 23.24 H new ATOM 0 HG13 ILE A 72 -8.397 9.136 8.877 1.00 23.24 H new ATOM 0 HG21 ILE A 72 -7.974 11.367 5.935 1.00 13.44 H new ATOM 0 HG22 ILE A 72 -6.879 12.512 6.746 1.00 13.44 H new ATOM 0 HG23 ILE A 72 -6.303 10.885 6.313 1.00 13.44 H new ATOM 0 HD11 ILE A 72 -9.472 8.223 6.879 1.00 3.43 H new ATOM 0 HD12 ILE A 72 -10.065 9.868 7.210 1.00 3.43 H new ATOM 0 HD13 ILE A 72 -8.875 9.595 5.915 1.00 3.43 H new ATOM 1153 N GLY A 73 -6.628 13.427 9.581 1.00 75.21 N ATOM 1154 CA GLY A 73 -6.176 14.806 9.586 1.00 31.33 C ATOM 1155 C GLY A 73 -4.772 14.953 10.138 1.00 11.24 C ATOM 1156 O GLY A 73 -3.870 15.420 9.443 1.00 53.43 O ATOM 0 H GLY A 73 -7.513 13.265 10.061 1.00 75.21 H new ATOM 0 HA2 GLY A 73 -6.207 15.199 8.570 1.00 31.33 H new ATOM 0 HA3 GLY A 73 -6.862 15.408 10.181 1.00 31.33 H new ATOM 1160 N ARG A 74 -4.587 14.555 11.393 1.00 45.51 N ATOM 1161 CA ARG A 74 -3.283 14.649 12.039 1.00 61.41 C ATOM 1162 C ARG A 74 -2.194 14.048 11.155 1.00 61.02 C ATOM 1163 O ARG A 74 -1.196 14.701 10.852 1.00 41.21 O ATOM 1164 CB ARG A 74 -3.308 13.934 13.392 1.00 51.55 C ATOM 1165 CG ARG A 74 -3.996 14.731 14.488 1.00 3.21 C ATOM 1166 CD ARG A 74 -3.564 14.265 15.870 1.00 70.13 C ATOM 1167 NE ARG A 74 -4.598 13.471 16.527 1.00 33.23 N ATOM 1168 CZ ARG A 74 -4.768 12.170 16.321 1.00 72.41 C ATOM 1169 NH1 ARG A 74 -3.976 11.519 15.480 1.00 41.53 N ATOM 1170 NH2 ARG A 74 -5.732 11.516 16.957 1.00 60.11 N ATOM 0 H ARG A 74 -5.323 14.165 11.982 1.00 45.51 H new ATOM 0 HA ARG A 74 -3.059 15.704 12.197 1.00 61.41 H new ATOM 0 HB2 ARG A 74 -3.815 12.976 13.278 1.00 51.55 H new ATOM 0 HB3 ARG A 74 -2.284 13.718 13.699 1.00 51.55 H new ATOM 0 HG2 ARG A 74 -3.763 15.789 14.370 1.00 3.21 H new ATOM 0 HG3 ARG A 74 -5.077 14.629 14.390 1.00 3.21 H new ATOM 0 HD2 ARG A 74 -2.652 13.674 15.785 1.00 70.13 H new ATOM 0 HD3 ARG A 74 -3.326 15.132 16.487 1.00 70.13 H new ATOM 0 HE ARG A 74 -5.224 13.941 17.180 1.00 33.23 H new ATOM 0 HH11 ARG A 74 -3.234 12.017 14.989 1.00 41.53 H new ATOM 0 HH12 ARG A 74 -4.109 10.520 15.324 1.00 41.53 H new ATOM 0 HH21 ARG A 74 -6.344 12.013 17.605 1.00 60.11 H new ATOM 0 HH22 ARG A 74 -5.861 10.517 16.798 1.00 60.11 H new ATOM 1184 N ALA A 75 -2.393 12.800 10.745 1.00 73.42 N ATOM 1185 CA ALA A 75 -1.430 12.112 9.895 1.00 63.43 C ATOM 1186 C ALA A 75 -1.154 12.906 8.623 1.00 44.50 C ATOM 1187 O ALA A 75 -0.015 13.288 8.353 1.00 44.12 O ATOM 1188 CB ALA A 75 -1.931 10.717 9.549 1.00 15.34 C ATOM 0 H ALA A 75 -3.213 12.244 10.988 1.00 73.42 H new ATOM 0 HA ALA A 75 -0.495 12.024 10.448 1.00 63.43 H new ATOM 0 HB1 ALA A 75 -1.201 10.215 8.914 1.00 15.34 H new ATOM 0 HB2 ALA A 75 -2.070 10.143 10.465 1.00 15.34 H new ATOM 0 HB3 ALA A 75 -2.881 10.792 9.020 1.00 15.34 H new ATOM 1194 N TYR A 76 -2.202 13.152 7.845 1.00 10.13 N ATOM 1195 CA TYR A 76 -2.072 13.899 6.600 1.00 45.11 C ATOM 1196 C TYR A 76 -1.290 15.191 6.819 1.00 63.22 C ATOM 1197 O TYR A 76 -0.358 15.501 6.075 1.00 71.51 O ATOM 1198 CB TYR A 76 -3.453 14.217 6.024 1.00 4.03 C ATOM 1199 CG TYR A 76 -3.931 13.207 5.006 1.00 14.01 C ATOM 1200 CD1 TYR A 76 -3.541 11.876 5.082 1.00 62.12 C ATOM 1201 CD2 TYR A 76 -4.775 13.584 3.969 1.00 54.04 C ATOM 1202 CE1 TYR A 76 -3.975 10.950 4.153 1.00 13.12 C ATOM 1203 CE2 TYR A 76 -5.216 12.665 3.036 1.00 30.33 C ATOM 1204 CZ TYR A 76 -4.813 11.349 3.133 1.00 42.24 C ATOM 1205 OH TYR A 76 -5.249 10.430 2.206 1.00 20.44 O ATOM 0 H TYR A 76 -3.152 12.845 8.055 1.00 10.13 H new ATOM 0 HA TYR A 76 -1.524 13.279 5.890 1.00 45.11 H new ATOM 0 HB2 TYR A 76 -4.175 14.268 6.839 1.00 4.03 H new ATOM 0 HB3 TYR A 76 -3.426 15.203 5.560 1.00 4.03 H new ATOM 0 HD1 TYR A 76 -2.887 11.559 5.881 1.00 62.12 H new ATOM 0 HD2 TYR A 76 -5.092 14.613 3.891 1.00 54.04 H new ATOM 0 HE1 TYR A 76 -3.660 9.920 4.225 1.00 13.12 H new ATOM 0 HE2 TYR A 76 -5.872 12.975 2.236 1.00 30.33 H new ATOM 0 HH TYR A 76 -6.227 10.380 2.230 1.00 20.44 H new ATOM 1215 N LEU A 77 -1.675 15.941 7.845 1.00 31.12 N ATOM 1216 CA LEU A 77 -1.011 17.200 8.165 1.00 60.13 C ATOM 1217 C LEU A 77 0.496 17.003 8.296 1.00 71.35 C ATOM 1218 O LEU A 77 1.276 17.588 7.545 1.00 41.44 O ATOM 1219 CB LEU A 77 -1.575 17.782 9.462 1.00 72.01 C ATOM 1220 CG LEU A 77 -0.948 19.093 9.938 1.00 71.20 C ATOM 1221 CD1 LEU A 77 -1.700 20.284 9.364 1.00 63.43 C ATOM 1222 CD2 LEU A 77 -0.930 19.154 11.458 1.00 1.04 C ATOM 0 H LEU A 77 -2.444 15.699 8.470 1.00 31.12 H new ATOM 0 HA LEU A 77 -1.198 17.898 7.349 1.00 60.13 H new ATOM 0 HB2 LEU A 77 -2.645 17.941 9.330 1.00 72.01 H new ATOM 0 HB3 LEU A 77 -1.458 17.039 10.251 1.00 72.01 H new ATOM 0 HG LEU A 77 0.081 19.132 9.580 1.00 71.20 H new ATOM 0 HD11 LEU A 77 -1.239 21.208 9.714 1.00 63.43 H new ATOM 0 HD12 LEU A 77 -1.661 20.249 8.275 1.00 63.43 H new ATOM 0 HD13 LEU A 77 -2.739 20.250 9.691 1.00 63.43 H new ATOM 0 HD21 LEU A 77 -0.480 20.094 11.779 1.00 1.04 H new ATOM 0 HD22 LEU A 77 -1.950 19.092 11.837 1.00 1.04 H new ATOM 0 HD23 LEU A 77 -0.346 18.320 11.849 1.00 1.04 H new ATOM 1234 N ASP A 78 0.898 16.173 9.252 1.00 12.21 N ATOM 1235 CA ASP A 78 2.311 15.896 9.479 1.00 23.24 C ATOM 1236 C ASP A 78 2.989 15.437 8.192 1.00 71.21 C ATOM 1237 O ASP A 78 4.120 15.825 7.903 1.00 50.33 O ATOM 1238 CB ASP A 78 2.476 14.831 10.565 1.00 71.34 C ATOM 1239 CG ASP A 78 3.269 15.334 11.755 1.00 51.25 C ATOM 1240 OD1 ASP A 78 4.376 15.873 11.545 1.00 63.20 O ATOM 1241 OD2 ASP A 78 2.782 15.191 12.895 1.00 30.42 O ATOM 0 H ASP A 78 0.265 15.680 9.882 1.00 12.21 H new ATOM 0 HA ASP A 78 2.788 16.819 9.810 1.00 23.24 H new ATOM 0 HB2 ASP A 78 1.492 14.503 10.900 1.00 71.34 H new ATOM 0 HB3 ASP A 78 2.975 13.959 10.142 1.00 71.34 H new ATOM 1246 N GLU A 79 2.289 14.607 7.424 1.00 1.31 N ATOM 1247 CA GLU A 79 2.825 14.094 6.169 1.00 51.33 C ATOM 1248 C GLU A 79 3.253 15.237 5.252 1.00 13.13 C ATOM 1249 O GLU A 79 4.444 15.484 5.062 1.00 22.04 O ATOM 1250 CB GLU A 79 1.784 13.222 5.463 1.00 44.31 C ATOM 1251 CG GLU A 79 1.890 11.747 5.810 1.00 23.22 C ATOM 1252 CD GLU A 79 3.133 11.099 5.231 1.00 73.21 C ATOM 1253 OE1 GLU A 79 3.159 10.854 4.007 1.00 72.52 O ATOM 1254 OE2 GLU A 79 4.079 10.837 6.002 1.00 3.25 O ATOM 0 H GLU A 79 1.351 14.276 7.649 1.00 1.31 H new ATOM 0 HA GLU A 79 3.701 13.488 6.399 1.00 51.33 H new ATOM 0 HB2 GLU A 79 0.787 13.577 5.724 1.00 44.31 H new ATOM 0 HB3 GLU A 79 1.893 13.342 4.385 1.00 44.31 H new ATOM 0 HG2 GLU A 79 1.896 11.632 6.894 1.00 23.22 H new ATOM 0 HG3 GLU A 79 1.007 11.226 5.439 1.00 23.22 H new ATOM 1261 N THR A 80 2.271 15.932 4.685 1.00 5.11 N ATOM 1262 CA THR A 80 2.545 17.047 3.787 1.00 13.35 C ATOM 1263 C THR A 80 3.436 18.087 4.457 1.00 21.33 C ATOM 1264 O THR A 80 4.371 18.603 3.845 1.00 1.33 O ATOM 1265 CB THR A 80 1.243 17.727 3.323 1.00 34.13 C ATOM 1266 OG1 THR A 80 1.546 18.919 2.591 1.00 4.42 O ATOM 1267 CG2 THR A 80 0.356 18.067 4.512 1.00 45.40 C ATOM 0 H THR A 80 1.280 15.742 4.832 1.00 5.11 H new ATOM 0 HA THR A 80 3.061 16.635 2.920 1.00 13.35 H new ATOM 0 HB THR A 80 0.707 17.032 2.677 1.00 34.13 H new ATOM 0 HG1 THR A 80 2.372 18.788 2.080 1.00 4.42 H new ATOM 0 HG21 THR A 80 -0.557 18.546 4.159 1.00 45.40 H new ATOM 0 HG22 THR A 80 0.102 17.153 5.050 1.00 45.40 H new ATOM 0 HG23 THR A 80 0.887 18.745 5.180 1.00 45.40 H new ATOM 1275 N ARG A 81 3.141 18.388 5.718 1.00 43.44 N ATOM 1276 CA ARG A 81 3.917 19.367 6.470 1.00 15.13 C ATOM 1277 C ARG A 81 5.402 19.018 6.448 1.00 33.53 C ATOM 1278 O ARG A 81 6.257 19.901 6.381 1.00 35.40 O ATOM 1279 CB ARG A 81 3.420 19.440 7.916 1.00 42.05 C ATOM 1280 CG ARG A 81 4.084 20.536 8.733 1.00 62.00 C ATOM 1281 CD ARG A 81 3.165 21.047 9.831 1.00 33.42 C ATOM 1282 NE ARG A 81 3.285 20.260 11.056 1.00 60.34 N ATOM 1283 CZ ARG A 81 4.268 20.415 11.936 1.00 53.53 C ATOM 1284 NH1 ARG A 81 5.210 21.325 11.728 1.00 22.41 N ATOM 1285 NH2 ARG A 81 4.309 19.661 13.027 1.00 53.23 N ATOM 0 H ARG A 81 2.371 17.968 6.240 1.00 43.44 H new ATOM 0 HA ARG A 81 3.784 20.340 5.997 1.00 15.13 H new ATOM 0 HB2 ARG A 81 2.342 19.603 7.913 1.00 42.05 H new ATOM 0 HB3 ARG A 81 3.596 18.480 8.401 1.00 42.05 H new ATOM 0 HG2 ARG A 81 5.004 20.155 9.176 1.00 62.00 H new ATOM 0 HG3 ARG A 81 4.364 21.361 8.078 1.00 62.00 H new ATOM 0 HD2 ARG A 81 3.401 22.089 10.045 1.00 33.42 H new ATOM 0 HD3 ARG A 81 2.133 21.019 9.482 1.00 33.42 H new ATOM 0 HE ARG A 81 2.575 19.553 11.246 1.00 60.34 H new ATOM 0 HH11 ARG A 81 5.181 21.907 10.891 1.00 22.41 H new ATOM 0 HH12 ARG A 81 5.964 21.442 12.405 1.00 22.41 H new ATOM 0 HH21 ARG A 81 3.585 18.961 13.191 1.00 53.23 H new ATOM 0 HH22 ARG A 81 5.064 19.781 13.702 1.00 53.23 H new ATOM 1299 N SER A 82 5.701 17.724 6.506 1.00 33.30 N ATOM 1300 CA SER A 82 7.082 17.257 6.497 1.00 3.31 C ATOM 1301 C SER A 82 7.851 17.859 5.325 1.00 4.41 C ATOM 1302 O SER A 82 9.062 18.064 5.403 1.00 51.43 O ATOM 1303 CB SER A 82 7.127 15.730 6.420 1.00 12.03 C ATOM 1304 OG SER A 82 8.373 15.232 6.877 1.00 54.52 O ATOM 0 H SER A 82 5.005 16.980 6.560 1.00 33.30 H new ATOM 0 HA SER A 82 7.554 17.581 7.425 1.00 3.31 H new ATOM 0 HB2 SER A 82 6.321 15.309 7.021 1.00 12.03 H new ATOM 0 HB3 SER A 82 6.959 15.410 5.392 1.00 12.03 H new ATOM 0 HG SER A 82 8.375 14.254 6.819 1.00 54.52 H new ATOM 1310 N ASN A 83 7.138 18.140 4.239 1.00 1.43 N ATOM 1311 CA ASN A 83 7.753 18.719 3.050 1.00 75.43 C ATOM 1312 C ASN A 83 7.192 20.110 2.770 1.00 65.23 C ATOM 1313 O ASN A 83 7.854 21.118 3.017 1.00 21.12 O ATOM 1314 CB ASN A 83 7.523 17.811 1.839 1.00 10.14 C ATOM 1315 CG ASN A 83 8.608 16.763 1.689 1.00 62.41 C ATOM 1316 OD1 ASN A 83 9.523 16.912 0.878 1.00 34.41 O ATOM 1317 ND2 ASN A 83 8.511 15.694 2.472 1.00 42.33 N ATOM 0 H ASN A 83 6.135 17.976 4.158 1.00 1.43 H new ATOM 0 HA ASN A 83 8.824 18.808 3.232 1.00 75.43 H new ATOM 0 HB2 ASN A 83 6.556 17.318 1.937 1.00 10.14 H new ATOM 0 HB3 ASN A 83 7.481 18.419 0.935 1.00 10.14 H new ATOM 0 HD21 ASN A 83 9.212 14.955 2.415 1.00 42.33 H new ATOM 0 HD22 ASN A 83 7.736 15.612 3.130 1.00 42.33 H new ATOM 1324 N SER A 84 5.969 20.156 2.253 1.00 51.24 N ATOM 1325 CA SER A 84 5.320 21.423 1.936 1.00 44.22 C ATOM 1326 C SER A 84 3.866 21.203 1.531 1.00 31.13 C ATOM 1327 O SER A 84 3.546 20.253 0.819 1.00 73.52 O ATOM 1328 CB SER A 84 6.072 22.138 0.811 1.00 72.20 C ATOM 1329 OG SER A 84 6.713 21.208 -0.045 1.00 30.01 O ATOM 0 H SER A 84 5.407 19.331 2.045 1.00 51.24 H new ATOM 0 HA SER A 84 5.339 22.046 2.830 1.00 44.22 H new ATOM 0 HB2 SER A 84 5.376 22.748 0.235 1.00 72.20 H new ATOM 0 HB3 SER A 84 6.812 22.815 1.237 1.00 72.20 H new ATOM 0 HG SER A 84 7.185 21.689 -0.756 1.00 30.01 H new ATOM 1335 N ASN A 85 2.989 22.089 1.992 1.00 3.31 N ATOM 1336 CA ASN A 85 1.568 21.992 1.679 1.00 1.45 C ATOM 1337 C ASN A 85 1.231 22.795 0.427 1.00 52.23 C ATOM 1338 O ASN A 85 0.716 23.910 0.511 1.00 34.13 O ATOM 1339 CB ASN A 85 0.730 22.490 2.859 1.00 41.32 C ATOM 1340 CG ASN A 85 1.233 23.811 3.408 1.00 14.42 C ATOM 1341 OD1 ASN A 85 1.949 24.547 2.729 1.00 63.41 O ATOM 1342 ND2 ASN A 85 0.858 24.119 4.645 1.00 71.34 N ATOM 0 H ASN A 85 3.237 22.882 2.583 1.00 3.31 H new ATOM 0 HA ASN A 85 1.333 20.944 1.491 1.00 1.45 H new ATOM 0 HB2 ASN A 85 -0.307 22.602 2.543 1.00 41.32 H new ATOM 0 HB3 ASN A 85 0.743 21.742 3.652 1.00 41.32 H new ATOM 0 HD21 ASN A 85 1.165 24.995 5.068 1.00 71.34 H new ATOM 0 HD22 ASN A 85 0.264 23.479 5.172 1.00 71.34 H new ATOM 1349 N SER A 86 1.525 22.220 -0.735 1.00 74.00 N ATOM 1350 CA SER A 86 1.256 22.883 -2.006 1.00 34.32 C ATOM 1351 C SER A 86 -0.196 23.346 -2.080 1.00 72.13 C ATOM 1352 O SER A 86 -1.114 22.533 -2.184 1.00 33.52 O ATOM 1353 CB SER A 86 1.563 21.941 -3.172 1.00 34.45 C ATOM 1354 OG SER A 86 2.957 21.721 -3.296 1.00 40.00 O ATOM 0 H SER A 86 1.949 21.297 -0.823 1.00 74.00 H new ATOM 0 HA SER A 86 1.902 23.758 -2.075 1.00 34.32 H new ATOM 0 HB2 SER A 86 1.054 20.990 -3.019 1.00 34.45 H new ATOM 0 HB3 SER A 86 1.175 22.365 -4.098 1.00 34.45 H new ATOM 0 HG SER A 86 3.127 21.115 -4.047 1.00 40.00 H new ATOM 1360 N SER A 87 -0.395 24.659 -2.027 1.00 12.04 N ATOM 1361 CA SER A 87 -1.735 25.232 -2.084 1.00 1.00 C ATOM 1362 C SER A 87 -2.345 25.050 -3.471 1.00 4.24 C ATOM 1363 O SER A 87 -1.679 25.256 -4.485 1.00 50.24 O ATOM 1364 CB SER A 87 -1.693 26.718 -1.724 1.00 4.41 C ATOM 1365 OG SER A 87 -0.543 27.342 -2.268 1.00 44.41 O ATOM 0 H SER A 87 0.354 25.346 -1.945 1.00 12.04 H new ATOM 0 HA SER A 87 -2.359 24.708 -1.360 1.00 1.00 H new ATOM 0 HB2 SER A 87 -2.590 27.212 -2.098 1.00 4.41 H new ATOM 0 HB3 SER A 87 -1.695 26.833 -0.640 1.00 4.41 H new ATOM 0 HG SER A 87 -0.540 28.291 -2.025 1.00 44.41 H new ATOM 1371 N SER A 88 -3.616 24.663 -3.505 1.00 64.51 N ATOM 1372 CA SER A 88 -4.316 24.449 -4.766 1.00 64.43 C ATOM 1373 C SER A 88 -5.820 24.335 -4.540 1.00 71.01 C ATOM 1374 O SER A 88 -6.268 23.893 -3.483 1.00 51.01 O ATOM 1375 CB SER A 88 -3.795 23.186 -5.455 1.00 71.41 C ATOM 1376 OG SER A 88 -4.348 23.047 -6.752 1.00 53.23 O ATOM 0 H SER A 88 -4.182 24.491 -2.674 1.00 64.51 H new ATOM 0 HA SER A 88 -4.127 25.309 -5.408 1.00 64.43 H new ATOM 0 HB2 SER A 88 -2.708 23.227 -5.522 1.00 71.41 H new ATOM 0 HB3 SER A 88 -4.044 22.311 -4.854 1.00 71.41 H new ATOM 0 HG SER A 88 -3.998 22.233 -7.171 1.00 53.23 H new ATOM 1382 N ASN A 89 -6.595 24.738 -5.542 1.00 62.31 N ATOM 1383 CA ASN A 89 -8.049 24.682 -5.454 1.00 15.25 C ATOM 1384 C ASN A 89 -8.586 23.410 -6.102 1.00 62.33 C ATOM 1385 O ASN A 89 -9.660 23.411 -6.704 1.00 42.32 O ATOM 1386 CB ASN A 89 -8.669 25.910 -6.124 1.00 33.02 C ATOM 1387 CG ASN A 89 -8.197 27.209 -5.501 1.00 3.24 C ATOM 1388 OD1 ASN A 89 -7.287 27.861 -6.013 1.00 3.33 O ATOM 1389 ND2 ASN A 89 -8.815 27.591 -4.389 1.00 3.21 N ATOM 0 H ASN A 89 -6.240 25.107 -6.424 1.00 62.31 H new ATOM 0 HA ASN A 89 -8.323 24.674 -4.399 1.00 15.25 H new ATOM 0 HB2 ASN A 89 -8.418 25.907 -7.185 1.00 33.02 H new ATOM 0 HB3 ASN A 89 -9.755 25.850 -6.053 1.00 33.02 H new ATOM 0 HD21 ASN A 89 -8.540 28.456 -3.924 1.00 3.21 H new ATOM 0 HD22 ASN A 89 -9.564 27.019 -4.000 1.00 3.21 H new ATOM 1396 N LYS A 90 -7.831 22.324 -5.975 1.00 63.20 N ATOM 1397 CA LYS A 90 -8.229 21.043 -6.546 1.00 72.04 C ATOM 1398 C LYS A 90 -7.544 19.888 -5.823 1.00 61.14 C ATOM 1399 O LYS A 90 -6.532 20.062 -5.144 1.00 42.13 O ATOM 1400 CB LYS A 90 -7.889 20.999 -8.038 1.00 32.42 C ATOM 1401 CG LYS A 90 -9.045 21.400 -8.937 1.00 52.44 C ATOM 1402 CD LYS A 90 -8.947 20.737 -10.301 1.00 51.52 C ATOM 1403 CE LYS A 90 -7.726 21.220 -11.069 1.00 21.02 C ATOM 1404 NZ LYS A 90 -7.743 20.760 -12.485 1.00 33.41 N ATOM 0 H LYS A 90 -6.939 22.306 -5.481 1.00 63.20 H new ATOM 0 HA LYS A 90 -9.307 20.937 -6.422 1.00 72.04 H new ATOM 0 HB2 LYS A 90 -7.044 21.661 -8.229 1.00 32.42 H new ATOM 0 HB3 LYS A 90 -7.569 19.990 -8.300 1.00 32.42 H new ATOM 0 HG2 LYS A 90 -9.987 21.124 -8.464 1.00 52.44 H new ATOM 0 HG3 LYS A 90 -9.054 22.483 -9.058 1.00 52.44 H new ATOM 0 HD2 LYS A 90 -8.896 19.655 -10.178 1.00 51.52 H new ATOM 0 HD3 LYS A 90 -9.848 20.951 -10.876 1.00 51.52 H new ATOM 0 HE2 LYS A 90 -7.687 22.309 -11.041 1.00 21.02 H new ATOM 0 HE3 LYS A 90 -6.822 20.856 -10.580 1.00 21.02 H new ATOM 0 HZ1 LYS A 90 -6.894 21.110 -12.974 1.00 33.41 H new ATOM 0 HZ2 LYS A 90 -7.754 19.720 -12.512 1.00 33.41 H new ATOM 0 HZ3 LYS A 90 -8.592 21.128 -12.959 1.00 33.41 H new ATOM 1418 N PRO A 91 -8.105 18.679 -5.972 1.00 75.11 N ATOM 1419 CA PRO A 91 -7.563 17.471 -5.342 1.00 54.33 C ATOM 1420 C PRO A 91 -6.238 17.040 -5.961 1.00 10.01 C ATOM 1421 O PRO A 91 -5.968 17.317 -7.129 1.00 24.14 O ATOM 1422 CB PRO A 91 -8.644 16.419 -5.605 1.00 25.13 C ATOM 1423 CG PRO A 91 -9.348 16.896 -6.828 1.00 65.41 C ATOM 1424 CD PRO A 91 -9.313 18.398 -6.767 1.00 63.31 C ATOM 0 HA PRO A 91 -7.346 17.624 -4.285 1.00 54.33 H new ATOM 0 HB2 PRO A 91 -8.207 15.432 -5.759 1.00 25.13 H new ATOM 0 HB3 PRO A 91 -9.329 16.336 -4.761 1.00 25.13 H new ATOM 0 HG2 PRO A 91 -8.856 16.531 -7.729 1.00 65.41 H new ATOM 0 HG3 PRO A 91 -10.374 16.530 -6.855 1.00 65.41 H new ATOM 0 HD2 PRO A 91 -9.251 18.839 -7.762 1.00 63.31 H new ATOM 0 HD3 PRO A 91 -10.208 18.802 -6.294 1.00 63.31 H new ATOM 1432 N GLY A 92 -5.414 16.360 -5.169 1.00 72.54 N ATOM 1433 CA GLY A 92 -4.127 15.901 -5.658 1.00 21.34 C ATOM 1434 C GLY A 92 -3.314 15.206 -4.584 1.00 22.34 C ATOM 1435 O GLY A 92 -2.713 14.159 -4.828 1.00 71.30 O ATOM 0 H GLY A 92 -5.615 16.119 -4.198 1.00 72.54 H new ATOM 0 HA2 GLY A 92 -4.282 15.217 -6.492 1.00 21.34 H new ATOM 0 HA3 GLY A 92 -3.564 16.751 -6.043 1.00 21.34 H new ATOM 1439 N THR A 93 -3.292 15.789 -3.389 1.00 41.32 N ATOM 1440 CA THR A 93 -2.544 15.221 -2.275 1.00 11.44 C ATOM 1441 C THR A 93 -3.086 15.718 -0.939 1.00 44.42 C ATOM 1442 O THR A 93 -4.092 16.427 -0.892 1.00 21.14 O ATOM 1443 CB THR A 93 -1.046 15.567 -2.369 1.00 10.10 C ATOM 1444 OG1 THR A 93 -0.871 16.798 -3.079 1.00 51.04 O ATOM 1445 CG2 THR A 93 -0.278 14.457 -3.070 1.00 44.34 C ATOM 0 H THR A 93 -3.784 16.655 -3.168 1.00 41.32 H new ATOM 0 HA THR A 93 -2.663 14.139 -2.333 1.00 11.44 H new ATOM 0 HB THR A 93 -0.656 15.674 -1.357 1.00 10.10 H new ATOM 0 HG1 THR A 93 0.084 17.012 -3.133 1.00 51.04 H new ATOM 0 HG21 THR A 93 0.778 14.723 -3.125 1.00 44.34 H new ATOM 0 HG22 THR A 93 -0.389 13.528 -2.511 1.00 44.34 H new ATOM 0 HG23 THR A 93 -0.671 14.323 -4.078 1.00 44.34 H new ATOM 1453 N CYS A 94 -2.412 15.344 0.143 1.00 75.10 N ATOM 1454 CA CYS A 94 -2.827 15.752 1.481 1.00 42.24 C ATOM 1455 C CYS A 94 -3.193 17.233 1.508 1.00 24.42 C ATOM 1456 O CYS A 94 -4.123 17.640 2.204 1.00 25.50 O ATOM 1457 CB CYS A 94 -1.713 15.471 2.490 1.00 32.32 C ATOM 1458 SG CYS A 94 -1.422 13.713 2.797 1.00 31.31 S ATOM 0 H CYS A 94 -1.576 14.759 0.120 1.00 75.10 H new ATOM 0 HA CYS A 94 -3.709 15.173 1.754 1.00 42.24 H new ATOM 0 HB2 CYS A 94 -0.789 15.924 2.131 1.00 32.32 H new ATOM 0 HB3 CYS A 94 -1.961 15.958 3.433 1.00 32.32 H new ATOM 0 HG CYS A 94 -2.273 13.280 3.679 1.00 31.31 H new ATOM 1464 N ALA A 95 -2.454 18.034 0.748 1.00 64.32 N ATOM 1465 CA ALA A 95 -2.700 19.469 0.685 1.00 73.12 C ATOM 1466 C ALA A 95 -4.191 19.765 0.561 1.00 71.33 C ATOM 1467 O ALA A 95 -4.816 20.259 1.499 1.00 14.32 O ATOM 1468 CB ALA A 95 -1.939 20.085 -0.480 1.00 33.40 C ATOM 0 H ALA A 95 -1.680 17.713 0.167 1.00 64.32 H new ATOM 0 HA ALA A 95 -2.343 19.915 1.614 1.00 73.12 H new ATOM 0 HB1 ALA A 95 -2.132 21.157 -0.515 1.00 33.40 H new ATOM 0 HB2 ALA A 95 -0.871 19.913 -0.348 1.00 33.40 H new ATOM 0 HB3 ALA A 95 -2.268 19.627 -1.413 1.00 33.40 H new ATOM 1474 N HIS A 96 -4.755 19.460 -0.604 1.00 34.44 N ATOM 1475 CA HIS A 96 -6.174 19.693 -0.850 1.00 41.32 C ATOM 1476 C HIS A 96 -7.029 19.031 0.226 1.00 23.10 C ATOM 1477 O HIS A 96 -8.051 19.575 0.642 1.00 72.10 O ATOM 1478 CB HIS A 96 -6.568 19.163 -2.229 1.00 64.40 C ATOM 1479 CG HIS A 96 -7.956 19.542 -2.643 1.00 11.12 C ATOM 1480 ND1 HIS A 96 -9.001 18.643 -2.687 1.00 24.10 N ATOM 1481 CD2 HIS A 96 -8.470 20.733 -3.031 1.00 20.32 C ATOM 1482 CE1 HIS A 96 -10.096 19.264 -3.086 1.00 34.40 C ATOM 1483 NE2 HIS A 96 -9.801 20.533 -3.301 1.00 15.02 N ATOM 0 H HIS A 96 -4.252 19.051 -1.391 1.00 34.44 H new ATOM 0 HA HIS A 96 -6.351 20.768 -0.818 1.00 41.32 H new ATOM 0 HB2 HIS A 96 -5.862 19.539 -2.969 1.00 64.40 H new ATOM 0 HB3 HIS A 96 -6.482 18.076 -2.230 1.00 64.40 H new ATOM 0 HD1 HIS A 96 -8.938 17.653 -2.449 1.00 24.10 H new ATOM 0 HD2 HIS A 96 -7.933 21.666 -3.113 1.00 20.32 H new ATOM 0 HE1 HIS A 96 -11.068 18.811 -3.215 1.00 34.40 H new ATOM 1491 N ALA A 97 -6.603 17.854 0.672 1.00 62.42 N ATOM 1492 CA ALA A 97 -7.328 17.118 1.700 1.00 54.10 C ATOM 1493 C ALA A 97 -7.520 17.968 2.951 1.00 1.43 C ATOM 1494 O ALA A 97 -8.645 18.174 3.407 1.00 33.20 O ATOM 1495 CB ALA A 97 -6.597 15.829 2.042 1.00 25.15 C ATOM 0 H ALA A 97 -5.759 17.390 0.337 1.00 62.42 H new ATOM 0 HA ALA A 97 -8.314 16.869 1.307 1.00 54.10 H new ATOM 0 HB1 ALA A 97 -7.150 15.290 2.811 1.00 25.15 H new ATOM 0 HB2 ALA A 97 -6.518 15.208 1.150 1.00 25.15 H new ATOM 0 HB3 ALA A 97 -5.598 16.064 2.411 1.00 25.15 H new ATOM 1501 N ILE A 98 -6.415 18.459 3.502 1.00 1.22 N ATOM 1502 CA ILE A 98 -6.462 19.287 4.701 1.00 54.43 C ATOM 1503 C ILE A 98 -7.364 20.500 4.496 1.00 74.22 C ATOM 1504 O ILE A 98 -8.258 20.764 5.299 1.00 72.33 O ATOM 1505 CB ILE A 98 -5.058 19.770 5.108 1.00 64.23 C ATOM 1506 CG1 ILE A 98 -4.175 18.578 5.486 1.00 13.44 C ATOM 1507 CG2 ILE A 98 -5.150 20.756 6.263 1.00 70.33 C ATOM 1508 CD1 ILE A 98 -2.698 18.901 5.501 1.00 44.25 C ATOM 0 H ILE A 98 -5.476 18.298 3.137 1.00 1.22 H new ATOM 0 HA ILE A 98 -6.868 18.664 5.498 1.00 54.43 H new ATOM 0 HB ILE A 98 -4.604 20.279 4.258 1.00 64.23 H new ATOM 0 HG12 ILE A 98 -4.469 18.216 6.471 1.00 13.44 H new ATOM 0 HG13 ILE A 98 -4.354 17.766 4.781 1.00 13.44 H new ATOM 0 HG21 ILE A 98 -4.149 21.088 6.539 1.00 70.33 H new ATOM 0 HG22 ILE A 98 -5.747 21.616 5.960 1.00 70.33 H new ATOM 0 HG23 ILE A 98 -5.620 20.271 7.119 1.00 70.33 H new ATOM 0 HD11 ILE A 98 -2.134 18.010 5.777 1.00 44.25 H new ATOM 0 HD12 ILE A 98 -2.388 19.234 4.511 1.00 44.25 H new ATOM 0 HD13 ILE A 98 -2.506 19.692 6.226 1.00 44.25 H new ATOM 1520 N ASN A 99 -7.124 21.233 3.414 1.00 51.04 N ATOM 1521 CA ASN A 99 -7.916 22.417 3.102 1.00 42.53 C ATOM 1522 C ASN A 99 -9.399 22.071 3.007 1.00 3.22 C ATOM 1523 O ASN A 99 -10.227 22.638 3.721 1.00 72.22 O ATOM 1524 CB ASN A 99 -7.442 23.042 1.788 1.00 63.12 C ATOM 1525 CG ASN A 99 -6.123 23.776 1.939 1.00 32.21 C ATOM 1526 OD1 ASN A 99 -6.024 24.750 2.685 1.00 33.14 O ATOM 1527 ND2 ASN A 99 -5.102 23.310 1.229 1.00 12.11 N ATOM 0 H ASN A 99 -6.388 21.028 2.739 1.00 51.04 H new ATOM 0 HA ASN A 99 -7.780 23.137 3.909 1.00 42.53 H new ATOM 0 HB2 ASN A 99 -7.336 22.261 1.035 1.00 63.12 H new ATOM 0 HB3 ASN A 99 -8.201 23.735 1.424 1.00 63.12 H new ATOM 0 HD21 ASN A 99 -4.190 23.763 1.290 1.00 12.11 H new ATOM 0 HD22 ASN A 99 -5.230 22.499 0.623 1.00 12.11 H new ATOM 1534 N THR A 100 -9.727 21.136 2.121 1.00 32.03 N ATOM 1535 CA THR A 100 -11.109 20.714 1.932 1.00 34.04 C ATOM 1536 C THR A 100 -11.778 20.408 3.268 1.00 53.54 C ATOM 1537 O THR A 100 -12.801 21.003 3.612 1.00 61.22 O ATOM 1538 CB THR A 100 -11.198 19.469 1.030 1.00 72.12 C ATOM 1539 OG1 THR A 100 -10.756 19.791 -0.294 1.00 21.44 O ATOM 1540 CG2 THR A 100 -12.623 18.938 0.979 1.00 41.12 C ATOM 0 H THR A 100 -9.054 20.657 1.523 1.00 32.03 H new ATOM 0 HA THR A 100 -11.629 21.541 1.449 1.00 34.04 H new ATOM 0 HB THR A 100 -10.554 18.696 1.450 1.00 72.12 H new ATOM 0 HG1 THR A 100 -9.776 19.802 -0.318 1.00 21.44 H new ATOM 0 HG21 THR A 100 -12.661 18.059 0.336 1.00 41.12 H new ATOM 0 HG22 THR A 100 -12.946 18.667 1.984 1.00 41.12 H new ATOM 0 HG23 THR A 100 -13.284 19.708 0.581 1.00 41.12 H new ATOM 1548 N LEU A 101 -11.195 19.479 4.017 1.00 55.20 N ATOM 1549 CA LEU A 101 -11.735 19.095 5.317 1.00 52.03 C ATOM 1550 C LEU A 101 -12.016 20.324 6.175 1.00 45.41 C ATOM 1551 O LEU A 101 -13.149 20.558 6.591 1.00 54.52 O ATOM 1552 CB LEU A 101 -10.761 18.165 6.041 1.00 64.21 C ATOM 1553 CG LEU A 101 -10.711 16.722 5.538 1.00 21.40 C ATOM 1554 CD1 LEU A 101 -9.533 15.982 6.153 1.00 1.23 C ATOM 1555 CD2 LEU A 101 -12.016 16.003 5.850 1.00 44.04 C ATOM 0 H LEU A 101 -10.349 18.978 3.747 1.00 55.20 H new ATOM 0 HA LEU A 101 -12.675 18.569 5.151 1.00 52.03 H new ATOM 0 HB2 LEU A 101 -9.760 18.590 5.965 1.00 64.21 H new ATOM 0 HB3 LEU A 101 -11.022 18.151 7.099 1.00 64.21 H new ATOM 0 HG LEU A 101 -10.578 16.739 4.456 1.00 21.40 H new ATOM 0 HD11 LEU A 101 -9.514 14.957 5.783 1.00 1.23 H new ATOM 0 HD12 LEU A 101 -8.605 16.484 5.879 1.00 1.23 H new ATOM 0 HD13 LEU A 101 -9.635 15.974 7.238 1.00 1.23 H new ATOM 0 HD21 LEU A 101 -11.963 14.977 5.485 1.00 44.04 H new ATOM 0 HD22 LEU A 101 -12.179 15.997 6.928 1.00 44.04 H new ATOM 0 HD23 LEU A 101 -12.842 16.520 5.361 1.00 44.04 H new ATOM 1567 N GLY A 102 -10.974 21.109 6.435 1.00 64.33 N ATOM 1568 CA GLY A 102 -11.129 22.306 7.240 1.00 21.11 C ATOM 1569 C GLY A 102 -12.129 23.278 6.646 1.00 4.45 C ATOM 1570 O GLY A 102 -12.582 24.201 7.322 1.00 10.33 O ATOM 0 H GLY A 102 -10.025 20.937 6.102 1.00 64.33 H new ATOM 0 HA2 GLY A 102 -11.451 22.026 8.243 1.00 21.11 H new ATOM 0 HA3 GLY A 102 -10.163 22.800 7.341 1.00 21.11 H new ATOM 1574 N GLU A 103 -12.472 23.072 5.379 1.00 45.33 N ATOM 1575 CA GLU A 103 -13.422 23.941 4.694 1.00 31.33 C ATOM 1576 C GLU A 103 -14.851 23.442 4.887 1.00 33.04 C ATOM 1577 O GLU A 103 -15.814 24.155 4.601 1.00 25.35 O ATOM 1578 CB GLU A 103 -13.094 24.017 3.202 1.00 72.34 C ATOM 1579 CG GLU A 103 -14.167 23.413 2.311 1.00 13.22 C ATOM 1580 CD GLU A 103 -13.793 23.446 0.842 1.00 24.32 C ATOM 1581 OE1 GLU A 103 -13.238 24.471 0.395 1.00 51.44 O ATOM 1582 OE2 GLU A 103 -14.054 22.447 0.140 1.00 22.54 O ATOM 0 H GLU A 103 -12.107 22.311 4.806 1.00 45.33 H new ATOM 0 HA GLU A 103 -13.341 24.938 5.127 1.00 31.33 H new ATOM 0 HB2 GLU A 103 -12.948 25.061 2.924 1.00 72.34 H new ATOM 0 HB3 GLU A 103 -12.150 23.503 3.019 1.00 72.34 H new ATOM 0 HG2 GLU A 103 -14.346 22.381 2.613 1.00 13.22 H new ATOM 0 HG3 GLU A 103 -15.102 23.955 2.456 1.00 13.22 H new ATOM 1589 N VAL A 104 -14.982 22.212 5.374 1.00 20.13 N ATOM 1590 CA VAL A 104 -16.293 21.617 5.607 1.00 64.14 C ATOM 1591 C VAL A 104 -16.473 21.239 7.073 1.00 44.15 C ATOM 1592 O VAL A 104 -17.595 21.046 7.541 1.00 40.12 O ATOM 1593 CB VAL A 104 -16.502 20.364 4.735 1.00 15.14 C ATOM 1594 CG1 VAL A 104 -16.033 20.619 3.311 1.00 14.22 C ATOM 1595 CG2 VAL A 104 -15.779 19.169 5.338 1.00 42.30 C ATOM 0 H VAL A 104 -14.196 21.608 5.615 1.00 20.13 H new ATOM 0 HA VAL A 104 -17.035 22.368 5.336 1.00 64.14 H new ATOM 0 HB VAL A 104 -17.568 20.137 4.705 1.00 15.14 H new ATOM 0 HG11 VAL A 104 -16.189 19.723 2.711 1.00 14.22 H new ATOM 0 HG12 VAL A 104 -16.601 21.445 2.883 1.00 14.22 H new ATOM 0 HG13 VAL A 104 -14.973 20.872 3.317 1.00 14.22 H new ATOM 0 HG21 VAL A 104 -15.937 18.293 4.709 1.00 42.30 H new ATOM 0 HG22 VAL A 104 -14.712 19.383 5.400 1.00 42.30 H new ATOM 0 HG23 VAL A 104 -16.169 18.974 6.337 1.00 42.30 H new ATOM 1605 N ILE A 105 -15.360 21.136 7.792 1.00 73.40 N ATOM 1606 CA ILE A 105 -15.396 20.783 9.206 1.00 64.53 C ATOM 1607 C ILE A 105 -16.384 21.659 9.967 1.00 53.32 C ATOM 1608 O ILE A 105 -16.962 21.235 10.967 1.00 4.14 O ATOM 1609 CB ILE A 105 -14.005 20.915 9.854 1.00 61.31 C ATOM 1610 CG1 ILE A 105 -13.896 19.995 11.072 1.00 71.44 C ATOM 1611 CG2 ILE A 105 -13.740 22.360 10.250 1.00 71.42 C ATOM 1612 CD1 ILE A 105 -13.467 18.585 10.728 1.00 53.34 C ATOM 0 H ILE A 105 -14.423 21.292 7.419 1.00 73.40 H new ATOM 0 HA ILE A 105 -15.718 19.743 9.263 1.00 64.53 H new ATOM 0 HB ILE A 105 -13.252 20.614 9.126 1.00 61.31 H new ATOM 0 HG12 ILE A 105 -13.182 20.422 11.777 1.00 71.44 H new ATOM 0 HG13 ILE A 105 -14.861 19.959 11.578 1.00 71.44 H new ATOM 0 HG21 ILE A 105 -12.753 22.437 10.707 1.00 71.42 H new ATOM 0 HG22 ILE A 105 -13.780 22.993 9.364 1.00 71.42 H new ATOM 0 HG23 ILE A 105 -14.496 22.686 10.964 1.00 71.42 H new ATOM 0 HD11 ILE A 105 -13.411 17.989 11.639 1.00 53.34 H new ATOM 0 HD12 ILE A 105 -14.193 18.140 10.047 1.00 53.34 H new ATOM 0 HD13 ILE A 105 -12.488 18.609 10.249 1.00 53.34 H new ATOM 1624 N GLN A 106 -16.575 22.883 9.484 1.00 20.12 N ATOM 1625 CA GLN A 106 -17.495 23.819 10.119 1.00 52.01 C ATOM 1626 C GLN A 106 -18.866 23.182 10.322 1.00 22.22 C ATOM 1627 O GLN A 106 -19.257 22.876 11.448 1.00 12.20 O ATOM 1628 CB GLN A 106 -17.629 25.087 9.274 1.00 55.11 C ATOM 1629 CG GLN A 106 -17.385 24.859 7.791 1.00 21.30 C ATOM 1630 CD GLN A 106 -18.180 25.807 6.916 1.00 53.04 C ATOM 1631 OE1 GLN A 106 -17.968 27.020 6.941 1.00 20.33 O ATOM 1632 NE2 GLN A 106 -19.103 25.258 6.134 1.00 42.42 N ATOM 0 H GLN A 106 -16.105 23.249 8.656 1.00 20.12 H new ATOM 0 HA GLN A 106 -17.089 24.082 11.096 1.00 52.01 H new ATOM 0 HB2 GLN A 106 -18.629 25.500 9.410 1.00 55.11 H new ATOM 0 HB3 GLN A 106 -16.923 25.833 9.639 1.00 55.11 H new ATOM 0 HG2 GLN A 106 -16.323 24.980 7.579 1.00 21.30 H new ATOM 0 HG3 GLN A 106 -17.646 23.832 7.538 1.00 21.30 H new ATOM 0 HE21 GLN A 106 -19.246 24.248 6.145 1.00 42.42 H new ATOM 0 HE22 GLN A 106 -19.669 25.846 5.523 1.00 42.42 H new ATOM 1641 N GLU A 107 -19.590 22.985 9.225 1.00 32.10 N ATOM 1642 CA GLU A 107 -20.918 22.385 9.284 1.00 21.05 C ATOM 1643 C GLU A 107 -20.867 21.017 9.959 1.00 51.02 C ATOM 1644 O GLU A 107 -21.750 20.665 10.742 1.00 0.24 O ATOM 1645 CB GLU A 107 -21.505 22.251 7.878 1.00 63.23 C ATOM 1646 CG GLU A 107 -20.883 21.129 7.063 1.00 31.34 C ATOM 1647 CD GLU A 107 -21.429 21.062 5.650 1.00 33.44 C ATOM 1648 OE1 GLU A 107 -21.190 22.011 4.875 1.00 21.24 O ATOM 1649 OE2 GLU A 107 -22.096 20.059 5.320 1.00 33.40 O ATOM 0 H GLU A 107 -19.280 23.232 8.285 1.00 32.10 H new ATOM 0 HA GLU A 107 -21.558 23.039 9.875 1.00 21.05 H new ATOM 0 HB2 GLU A 107 -22.579 22.080 7.956 1.00 63.23 H new ATOM 0 HB3 GLU A 107 -21.371 23.193 7.346 1.00 63.23 H new ATOM 0 HG2 GLU A 107 -19.803 21.269 7.025 1.00 31.34 H new ATOM 0 HG3 GLU A 107 -21.064 20.178 7.564 1.00 31.34 H new ATOM 1656 N LEU A 108 -19.828 20.249 9.648 1.00 13.45 N ATOM 1657 CA LEU A 108 -19.661 18.919 10.223 1.00 12.14 C ATOM 1658 C LEU A 108 -19.709 18.974 11.747 1.00 41.31 C ATOM 1659 O LEU A 108 -20.591 18.386 12.373 1.00 74.51 O ATOM 1660 CB LEU A 108 -18.336 18.307 9.765 1.00 34.31 C ATOM 1661 CG LEU A 108 -18.222 17.995 8.272 1.00 4.45 C ATOM 1662 CD1 LEU A 108 -16.967 17.183 7.992 1.00 41.14 C ATOM 1663 CD2 LEU A 108 -19.459 17.255 7.785 1.00 24.04 C ATOM 0 H LEU A 108 -19.089 20.525 9.001 1.00 13.45 H new ATOM 0 HA LEU A 108 -20.483 18.294 9.875 1.00 12.14 H new ATOM 0 HB2 LEU A 108 -17.531 18.990 10.036 1.00 34.31 H new ATOM 0 HB3 LEU A 108 -18.173 17.384 10.322 1.00 34.31 H new ATOM 0 HG LEU A 108 -18.150 18.937 7.728 1.00 4.45 H new ATOM 0 HD11 LEU A 108 -16.902 16.970 6.925 1.00 41.14 H new ATOM 0 HD12 LEU A 108 -16.090 17.750 8.303 1.00 41.14 H new ATOM 0 HD13 LEU A 108 -17.009 16.246 8.547 1.00 41.14 H new ATOM 0 HD21 LEU A 108 -19.360 17.042 6.721 1.00 24.04 H new ATOM 0 HD22 LEU A 108 -19.563 16.319 8.335 1.00 24.04 H new ATOM 0 HD23 LEU A 108 -20.341 17.873 7.950 1.00 24.04 H new ATOM 1675 N LEU A 109 -18.756 19.687 12.338 1.00 72.21 N ATOM 1676 CA LEU A 109 -18.690 19.822 13.789 1.00 33.50 C ATOM 1677 C LEU A 109 -20.005 20.357 14.346 1.00 35.45 C ATOM 1678 O LEU A 109 -20.764 19.626 14.984 1.00 3.23 O ATOM 1679 CB LEU A 109 -17.541 20.751 14.183 1.00 23.51 C ATOM 1680 CG LEU A 109 -16.157 20.106 14.273 1.00 72.42 C ATOM 1681 CD1 LEU A 109 -15.075 21.109 13.906 1.00 54.54 C ATOM 1682 CD2 LEU A 109 -15.918 19.548 15.668 1.00 33.23 C ATOM 0 H LEU A 109 -18.019 20.180 11.835 1.00 72.21 H new ATOM 0 HA LEU A 109 -18.512 18.834 14.213 1.00 33.50 H new ATOM 0 HB2 LEU A 109 -17.494 21.565 13.460 1.00 23.51 H new ATOM 0 HB3 LEU A 109 -17.776 21.197 15.150 1.00 23.51 H new ATOM 0 HG LEU A 109 -16.115 19.281 13.561 1.00 72.42 H new ATOM 0 HD11 LEU A 109 -14.098 20.632 13.976 1.00 54.54 H new ATOM 0 HD12 LEU A 109 -15.235 21.460 12.887 1.00 54.54 H new ATOM 0 HD13 LEU A 109 -15.115 21.955 14.592 1.00 54.54 H new ATOM 0 HD21 LEU A 109 -14.929 19.093 15.713 1.00 33.23 H new ATOM 0 HD22 LEU A 109 -15.980 20.355 16.398 1.00 33.23 H new ATOM 0 HD23 LEU A 109 -16.674 18.796 15.893 1.00 33.23 H new ATOM 1694 N SER A 110 -20.270 21.635 14.099 1.00 13.54 N ATOM 1695 CA SER A 110 -21.493 22.269 14.578 1.00 54.11 C ATOM 1696 C SER A 110 -22.662 21.289 14.544 1.00 52.13 C ATOM 1697 O SER A 110 -23.304 21.035 15.563 1.00 1.43 O ATOM 1698 CB SER A 110 -21.820 23.500 13.730 1.00 13.24 C ATOM 1699 OG SER A 110 -21.962 23.155 12.363 1.00 2.23 O ATOM 0 H SER A 110 -19.654 22.253 13.570 1.00 13.54 H new ATOM 0 HA SER A 110 -21.332 22.580 15.610 1.00 54.11 H new ATOM 0 HB2 SER A 110 -22.741 23.959 14.090 1.00 13.24 H new ATOM 0 HB3 SER A 110 -21.029 24.242 13.841 1.00 13.24 H new ATOM 0 HG SER A 110 -21.076 23.039 11.961 1.00 2.23 H new ATOM 1705 N ASP A 111 -22.932 20.742 13.364 1.00 74.41 N ATOM 1706 CA ASP A 111 -24.023 19.788 13.195 1.00 1.32 C ATOM 1707 C ASP A 111 -23.885 18.626 14.174 1.00 52.21 C ATOM 1708 O ASP A 111 -24.820 18.305 14.907 1.00 51.12 O ATOM 1709 CB ASP A 111 -24.051 19.262 11.760 1.00 62.45 C ATOM 1710 CG ASP A 111 -24.574 20.290 10.776 1.00 72.42 C ATOM 1711 OD1 ASP A 111 -24.452 21.499 11.061 1.00 14.02 O ATOM 1712 OD2 ASP A 111 -25.106 19.885 9.721 1.00 74.31 O ATOM 0 H ASP A 111 -22.411 20.942 12.510 1.00 74.41 H new ATOM 0 HA ASP A 111 -24.960 20.305 13.402 1.00 1.32 H new ATOM 0 HB2 ASP A 111 -23.045 18.962 11.467 1.00 62.45 H new ATOM 0 HB3 ASP A 111 -24.676 18.370 11.715 1.00 62.45 H new ATOM 1717 N ALA A 112 -22.713 17.999 14.179 1.00 55.13 N ATOM 1718 CA ALA A 112 -22.453 16.874 15.068 1.00 72.55 C ATOM 1719 C ALA A 112 -22.854 17.202 16.502 1.00 42.43 C ATOM 1720 O ALA A 112 -23.563 16.432 17.150 1.00 53.43 O ATOM 1721 CB ALA A 112 -20.985 16.480 15.005 1.00 43.03 C ATOM 0 H ALA A 112 -21.929 18.251 13.577 1.00 55.13 H new ATOM 0 HA ALA A 112 -23.059 16.032 14.734 1.00 72.55 H new ATOM 0 HB1 ALA A 112 -20.805 15.638 15.674 1.00 43.03 H new ATOM 0 HB2 ALA A 112 -20.729 16.194 13.985 1.00 43.03 H new ATOM 0 HB3 ALA A 112 -20.368 17.325 15.311 1.00 43.03 H new ATOM 1727 N ILE A 113 -22.394 18.349 16.991 1.00 15.02 N ATOM 1728 CA ILE A 113 -22.706 18.779 18.349 1.00 61.23 C ATOM 1729 C ILE A 113 -24.213 18.837 18.575 1.00 42.22 C ATOM 1730 O ILE A 113 -24.726 18.287 19.549 1.00 53.54 O ATOM 1731 CB ILE A 113 -22.098 20.160 18.655 1.00 12.41 C ATOM 1732 CG1 ILE A 113 -20.686 20.261 18.074 1.00 13.11 C ATOM 1733 CG2 ILE A 113 -22.078 20.409 20.156 1.00 52.21 C ATOM 1734 CD1 ILE A 113 -19.903 21.447 18.592 1.00 50.14 C ATOM 0 H ILE A 113 -21.805 18.997 16.468 1.00 15.02 H new ATOM 0 HA ILE A 113 -22.269 18.042 19.022 1.00 61.23 H new ATOM 0 HB ILE A 113 -22.718 20.925 18.187 1.00 12.41 H new ATOM 0 HG12 ILE A 113 -20.140 19.346 18.306 1.00 13.11 H new ATOM 0 HG13 ILE A 113 -20.752 20.326 16.988 1.00 13.11 H new ATOM 0 HG21 ILE A 113 -21.645 21.389 20.356 1.00 52.21 H new ATOM 0 HG22 ILE A 113 -23.096 20.375 20.544 1.00 52.21 H new ATOM 0 HG23 ILE A 113 -21.478 19.641 20.644 1.00 52.21 H new ATOM 0 HD11 ILE A 113 -18.912 21.455 18.138 1.00 50.14 H new ATOM 0 HD12 ILE A 113 -20.427 22.368 18.337 1.00 50.14 H new ATOM 0 HD13 ILE A 113 -19.805 21.373 19.675 1.00 50.14 H new ATOM 1746 N ALA A 114 -24.916 19.506 17.667 1.00 13.10 N ATOM 1747 CA ALA A 114 -26.365 19.633 17.765 1.00 10.10 C ATOM 1748 C ALA A 114 -27.034 18.264 17.811 1.00 73.43 C ATOM 1749 O ALA A 114 -27.686 17.912 18.794 1.00 22.24 O ATOM 1750 CB ALA A 114 -26.904 20.447 16.598 1.00 44.21 C ATOM 0 H ALA A 114 -24.506 19.968 16.856 1.00 13.10 H new ATOM 0 HA ALA A 114 -26.597 20.153 18.694 1.00 10.10 H new ATOM 0 HB1 ALA A 114 -27.987 20.534 16.684 1.00 44.21 H new ATOM 0 HB2 ALA A 114 -26.458 21.442 16.611 1.00 44.21 H new ATOM 0 HB3 ALA A 114 -26.653 19.950 15.661 1.00 44.21 H new ATOM 1756 N LYS A 115 -26.870 17.494 16.740 1.00 53.10 N ATOM 1757 CA LYS A 115 -27.458 16.162 16.657 1.00 1.31 C ATOM 1758 C LYS A 115 -27.028 15.303 17.842 1.00 44.12 C ATOM 1759 O LYS A 115 -27.714 14.351 18.212 1.00 15.22 O ATOM 1760 CB LYS A 115 -27.051 15.484 15.347 1.00 33.31 C ATOM 1761 CG LYS A 115 -28.110 15.573 14.262 1.00 73.32 C ATOM 1762 CD LYS A 115 -28.576 17.004 14.053 1.00 33.14 C ATOM 1763 CE LYS A 115 -27.412 17.928 13.732 1.00 63.12 C ATOM 1764 NZ LYS A 115 -27.637 18.685 12.469 1.00 24.22 N ATOM 0 H LYS A 115 -26.334 17.770 15.917 1.00 53.10 H new ATOM 0 HA LYS A 115 -28.543 16.268 16.683 1.00 1.31 H new ATOM 0 HB2 LYS A 115 -26.130 15.940 14.983 1.00 33.31 H new ATOM 0 HB3 LYS A 115 -26.831 14.435 15.544 1.00 33.31 H new ATOM 0 HG2 LYS A 115 -27.709 15.180 13.328 1.00 73.32 H new ATOM 0 HG3 LYS A 115 -28.961 14.948 14.531 1.00 73.32 H new ATOM 0 HD2 LYS A 115 -29.302 17.036 13.241 1.00 33.14 H new ATOM 0 HD3 LYS A 115 -29.085 17.357 14.950 1.00 33.14 H new ATOM 0 HE2 LYS A 115 -27.267 18.629 14.554 1.00 63.12 H new ATOM 0 HE3 LYS A 115 -26.496 17.343 13.646 1.00 63.12 H new ATOM 0 HZ1 LYS A 115 -26.821 19.304 12.285 1.00 24.22 H new ATOM 0 HZ2 LYS A 115 -27.750 18.017 11.680 1.00 24.22 H new ATOM 0 HZ3 LYS A 115 -28.497 19.263 12.559 1.00 24.22 H new ATOM 1778 N SER A 116 -25.888 15.646 18.433 1.00 44.41 N ATOM 1779 CA SER A 116 -25.365 14.905 19.574 1.00 21.35 C ATOM 1780 C SER A 116 -25.981 15.407 20.877 1.00 73.33 C ATOM 1781 O SER A 116 -26.496 16.522 20.943 1.00 74.12 O ATOM 1782 CB SER A 116 -23.841 15.030 19.637 1.00 74.14 C ATOM 1783 OG SER A 116 -23.219 14.137 18.729 1.00 20.24 O ATOM 0 H SER A 116 -25.309 16.433 18.140 1.00 44.41 H new ATOM 0 HA SER A 116 -25.631 13.856 19.446 1.00 21.35 H new ATOM 0 HB2 SER A 116 -23.547 16.054 19.405 1.00 74.14 H new ATOM 0 HB3 SER A 116 -23.497 14.822 20.650 1.00 74.14 H new ATOM 0 HG SER A 116 -23.106 14.579 17.862 1.00 20.24 H new ATOM 1789 N ASN A 117 -25.924 14.574 21.911 1.00 71.32 N ATOM 1790 CA ASN A 117 -26.477 14.932 23.212 1.00 21.40 C ATOM 1791 C ASN A 117 -25.370 15.337 24.180 1.00 21.05 C ATOM 1792 O ASN A 117 -24.200 15.408 23.806 1.00 40.34 O ATOM 1793 CB ASN A 117 -27.273 13.760 23.791 1.00 44.00 C ATOM 1794 CG ASN A 117 -26.639 12.419 23.476 1.00 24.23 C ATOM 1795 OD1 ASN A 117 -25.787 11.941 24.377 1.00 33.51 O flip ATOM 1796 ND2 ASN A 117 -26.911 11.820 22.436 1.00 55.22 N flip ATOM 0 H ASN A 117 -25.501 13.647 21.873 1.00 71.32 H new ATOM 0 HA ASN A 117 -27.144 15.783 23.074 1.00 21.40 H new ATOM 0 HB2 ASN A 117 -27.352 13.877 24.872 1.00 44.00 H new ATOM 0 HB3 ASN A 117 -28.288 13.782 23.393 1.00 44.00 H new ATOM 0 HD21 ASN A 117 -27.571 12.225 21.772 1.00 55.22 H new ATOM 0 HD22 ASN A 117 -26.476 10.919 22.238 1.00 55.22 H new ATOM 1803 N GLN A 118 -25.749 15.601 25.427 1.00 61.51 N ATOM 1804 CA GLN A 118 -24.788 15.999 26.449 1.00 71.32 C ATOM 1805 C GLN A 118 -23.518 15.160 26.358 1.00 64.11 C ATOM 1806 O GLN A 118 -22.410 15.696 26.314 1.00 71.32 O ATOM 1807 CB GLN A 118 -25.406 15.861 27.841 1.00 30.43 C ATOM 1808 CG GLN A 118 -24.528 16.410 28.954 1.00 62.11 C ATOM 1809 CD GLN A 118 -24.984 15.966 30.330 1.00 4.40 C ATOM 1810 OE1 GLN A 118 -26.115 15.514 30.506 1.00 13.40 O ATOM 1811 NE2 GLN A 118 -24.102 16.093 31.315 1.00 14.42 N ATOM 0 H GLN A 118 -26.714 15.546 25.753 1.00 61.51 H new ATOM 0 HA GLN A 118 -24.525 17.043 26.278 1.00 71.32 H new ATOM 0 HB2 GLN A 118 -26.365 16.379 27.857 1.00 30.43 H new ATOM 0 HB3 GLN A 118 -25.610 14.808 28.036 1.00 30.43 H new ATOM 0 HG2 GLN A 118 -23.500 16.086 28.794 1.00 62.11 H new ATOM 0 HG3 GLN A 118 -24.529 17.499 28.909 1.00 62.11 H new ATOM 0 HE21 GLN A 118 -23.175 16.473 31.124 1.00 14.42 H new ATOM 0 HE22 GLN A 118 -24.352 15.811 32.263 1.00 14.42 H new ATOM 1820 N ASP A 119 -23.685 13.842 26.331 1.00 53.43 N ATOM 1821 CA ASP A 119 -22.552 12.929 26.244 1.00 22.14 C ATOM 1822 C ASP A 119 -21.781 13.140 24.945 1.00 54.22 C ATOM 1823 O ASP A 119 -20.668 13.666 24.949 1.00 11.52 O ATOM 1824 CB ASP A 119 -23.030 11.479 26.339 1.00 45.03 C ATOM 1825 CG ASP A 119 -23.861 11.223 27.581 1.00 64.15 C ATOM 1826 OD1 ASP A 119 -23.277 11.157 28.683 1.00 45.03 O ATOM 1827 OD2 ASP A 119 -25.095 11.089 27.450 1.00 12.35 O ATOM 0 H ASP A 119 -24.595 13.382 26.368 1.00 53.43 H new ATOM 0 HA ASP A 119 -21.884 13.139 27.079 1.00 22.14 H new ATOM 0 HB2 ASP A 119 -23.619 11.235 25.455 1.00 45.03 H new ATOM 0 HB3 ASP A 119 -22.166 10.814 26.340 1.00 45.03 H new ATOM 1832 N HIS A 120 -22.381 12.725 23.833 1.00 0.42 N ATOM 1833 CA HIS A 120 -21.751 12.869 22.526 1.00 62.34 C ATOM 1834 C HIS A 120 -21.175 14.271 22.351 1.00 72.23 C ATOM 1835 O HIS A 120 -19.976 14.438 22.130 1.00 44.12 O ATOM 1836 CB HIS A 120 -22.760 12.577 21.415 1.00 72.01 C ATOM 1837 CG HIS A 120 -23.053 11.119 21.239 1.00 24.41 C ATOM 1838 ND1 HIS A 120 -22.784 10.432 20.074 1.00 44.21 N ATOM 1839 CD2 HIS A 120 -23.592 10.215 22.090 1.00 14.12 C ATOM 1840 CE1 HIS A 120 -23.147 9.170 20.215 1.00 21.02 C ATOM 1841 NE2 HIS A 120 -23.640 9.012 21.430 1.00 34.11 N ATOM 0 H HIS A 120 -23.302 12.287 23.812 1.00 0.42 H new ATOM 0 HA HIS A 120 -20.934 12.150 22.463 1.00 62.34 H new ATOM 0 HB2 HIS A 120 -23.690 13.102 21.633 1.00 72.01 H new ATOM 0 HB3 HIS A 120 -22.380 12.979 20.476 1.00 72.01 H new ATOM 0 HD1 HIS A 120 -22.369 10.836 19.234 1.00 44.21 H new ATOM 0 HD2 HIS A 120 -23.923 10.405 23.100 1.00 14.12 H new ATOM 0 HE1 HIS A 120 -23.056 8.399 19.465 1.00 21.02 H new ATOM 1849 N LYS A 121 -22.038 15.276 22.450 1.00 14.11 N ATOM 1850 CA LYS A 121 -21.617 16.664 22.304 1.00 50.33 C ATOM 1851 C LYS A 121 -20.337 16.930 23.089 1.00 64.01 C ATOM 1852 O LYS A 121 -19.456 17.656 22.629 1.00 12.44 O ATOM 1853 CB LYS A 121 -22.724 17.608 22.779 1.00 74.32 C ATOM 1854 CG LYS A 121 -22.750 17.806 24.284 1.00 3.34 C ATOM 1855 CD LYS A 121 -21.900 18.994 24.705 1.00 65.54 C ATOM 1856 CE LYS A 121 -21.294 18.785 26.084 1.00 12.03 C ATOM 1857 NZ LYS A 121 -20.046 19.576 26.268 1.00 41.14 N ATOM 0 H LYS A 121 -23.034 15.155 22.631 1.00 14.11 H new ATOM 0 HA LYS A 121 -21.420 16.848 21.248 1.00 50.33 H new ATOM 0 HB2 LYS A 121 -22.596 18.577 22.296 1.00 74.32 H new ATOM 0 HB3 LYS A 121 -23.688 17.215 22.456 1.00 74.32 H new ATOM 0 HG2 LYS A 121 -23.778 17.957 24.614 1.00 3.34 H new ATOM 0 HG3 LYS A 121 -22.386 16.904 24.777 1.00 3.34 H new ATOM 0 HD2 LYS A 121 -21.104 19.150 23.977 1.00 65.54 H new ATOM 0 HD3 LYS A 121 -22.511 19.897 24.708 1.00 65.54 H new ATOM 0 HE2 LYS A 121 -22.020 19.069 26.846 1.00 12.03 H new ATOM 0 HE3 LYS A 121 -21.078 17.727 26.229 1.00 12.03 H new ATOM 0 HZ1 LYS A 121 -19.450 19.122 26.989 1.00 41.14 H new ATOM 0 HZ2 LYS A 121 -19.527 19.620 25.368 1.00 41.14 H new ATOM 0 HZ3 LYS A 121 -20.288 20.539 26.576 1.00 41.14 H new ATOM 1871 N GLU A 122 -20.240 16.336 24.274 1.00 34.51 N ATOM 1872 CA GLU A 122 -19.066 16.509 25.122 1.00 75.34 C ATOM 1873 C GLU A 122 -17.815 15.968 24.435 1.00 13.22 C ATOM 1874 O GLU A 122 -16.760 16.602 24.453 1.00 0.15 O ATOM 1875 CB GLU A 122 -19.270 15.803 26.464 1.00 74.32 C ATOM 1876 CG GLU A 122 -18.312 14.647 26.695 1.00 21.23 C ATOM 1877 CD GLU A 122 -18.457 14.036 28.076 1.00 43.42 C ATOM 1878 OE1 GLU A 122 -18.792 14.779 29.022 1.00 51.45 O ATOM 1879 OE2 GLU A 122 -18.235 12.815 28.210 1.00 64.42 O ATOM 0 H GLU A 122 -20.960 15.731 24.669 1.00 34.51 H new ATOM 0 HA GLU A 122 -18.931 17.576 25.298 1.00 75.34 H new ATOM 0 HB2 GLU A 122 -19.151 16.529 27.269 1.00 74.32 H new ATOM 0 HB3 GLU A 122 -20.294 15.432 26.518 1.00 74.32 H new ATOM 0 HG2 GLU A 122 -18.487 13.879 25.942 1.00 21.23 H new ATOM 0 HG3 GLU A 122 -17.288 14.996 26.562 1.00 21.23 H new ATOM 1886 N LYS A 123 -17.941 14.792 23.830 1.00 20.14 N ATOM 1887 CA LYS A 123 -16.822 14.164 23.137 1.00 55.32 C ATOM 1888 C LYS A 123 -16.277 15.079 22.044 1.00 35.24 C ATOM 1889 O LYS A 123 -15.068 15.287 21.942 1.00 31.44 O ATOM 1890 CB LYS A 123 -17.257 12.829 22.529 1.00 72.21 C ATOM 1891 CG LYS A 123 -17.748 11.824 23.557 1.00 64.45 C ATOM 1892 CD LYS A 123 -16.667 11.493 24.573 1.00 55.02 C ATOM 1893 CE LYS A 123 -16.947 10.173 25.274 1.00 72.41 C ATOM 1894 NZ LYS A 123 -15.758 9.679 26.023 1.00 53.42 N ATOM 0 H LYS A 123 -18.807 14.254 23.805 1.00 20.14 H new ATOM 0 HA LYS A 123 -16.031 13.984 23.865 1.00 55.32 H new ATOM 0 HB2 LYS A 123 -18.050 13.011 21.803 1.00 72.21 H new ATOM 0 HB3 LYS A 123 -16.418 12.397 21.983 1.00 72.21 H new ATOM 0 HG2 LYS A 123 -18.621 12.225 24.071 1.00 64.45 H new ATOM 0 HG3 LYS A 123 -18.066 10.912 23.052 1.00 64.45 H new ATOM 0 HD2 LYS A 123 -15.700 11.443 24.073 1.00 55.02 H new ATOM 0 HD3 LYS A 123 -16.603 12.292 25.312 1.00 55.02 H new ATOM 0 HE2 LYS A 123 -17.783 10.297 25.962 1.00 72.41 H new ATOM 0 HE3 LYS A 123 -17.248 9.428 24.538 1.00 72.41 H new ATOM 0 HZ1 LYS A 123 -15.990 8.777 26.487 1.00 53.42 H new ATOM 0 HZ2 LYS A 123 -14.967 9.536 25.363 1.00 53.42 H new ATOM 0 HZ3 LYS A 123 -15.486 10.379 26.743 1.00 53.42 H new ATOM 1908 N ILE A 124 -17.177 15.623 21.232 1.00 43.04 N ATOM 1909 CA ILE A 124 -16.785 16.517 20.149 1.00 12.11 C ATOM 1910 C ILE A 124 -16.028 17.728 20.683 1.00 25.01 C ATOM 1911 O ILE A 124 -14.979 18.100 20.155 1.00 73.51 O ATOM 1912 CB ILE A 124 -18.009 17.003 19.350 1.00 63.23 C ATOM 1913 CG1 ILE A 124 -18.845 15.810 18.881 1.00 42.45 C ATOM 1914 CG2 ILE A 124 -17.565 17.846 18.163 1.00 35.41 C ATOM 1915 CD1 ILE A 124 -20.137 16.208 18.202 1.00 43.14 C ATOM 0 H ILE A 124 -18.181 15.461 21.303 1.00 43.04 H new ATOM 0 HA ILE A 124 -16.133 15.946 19.488 1.00 12.11 H new ATOM 0 HB ILE A 124 -18.627 17.623 20.000 1.00 63.23 H new ATOM 0 HG12 ILE A 124 -18.252 15.209 18.192 1.00 42.45 H new ATOM 0 HG13 ILE A 124 -19.074 15.178 19.739 1.00 42.45 H new ATOM 0 HG21 ILE A 124 -18.441 18.182 17.608 1.00 35.41 H new ATOM 0 HG22 ILE A 124 -17.007 18.712 18.520 1.00 35.41 H new ATOM 0 HG23 ILE A 124 -16.929 17.248 17.510 1.00 35.41 H new ATOM 0 HD11 ILE A 124 -20.678 15.313 17.896 1.00 43.14 H new ATOM 0 HD12 ILE A 124 -20.750 16.783 18.896 1.00 43.14 H new ATOM 0 HD13 ILE A 124 -19.915 16.815 17.325 1.00 43.14 H new ATOM 1927 N ARG A 125 -16.564 18.338 21.735 1.00 52.45 N ATOM 1928 CA ARG A 125 -15.939 19.507 22.341 1.00 45.30 C ATOM 1929 C ARG A 125 -14.487 19.217 22.710 1.00 63.31 C ATOM 1930 O ARG A 125 -13.572 19.908 22.262 1.00 71.41 O ATOM 1931 CB ARG A 125 -16.715 19.940 23.586 1.00 74.12 C ATOM 1932 CG ARG A 125 -16.346 21.328 24.083 1.00 42.05 C ATOM 1933 CD ARG A 125 -15.512 21.262 25.353 1.00 71.55 C ATOM 1934 NE ARG A 125 -15.516 22.530 26.077 1.00 64.24 N ATOM 1935 CZ ARG A 125 -14.766 22.767 27.147 1.00 22.12 C ATOM 1936 NH1 ARG A 125 -13.956 21.827 27.615 1.00 34.22 N ATOM 1937 NH2 ARG A 125 -14.824 23.947 27.752 1.00 74.34 N ATOM 0 H ARG A 125 -17.430 18.042 22.185 1.00 52.45 H new ATOM 0 HA ARG A 125 -15.957 20.316 21.611 1.00 45.30 H new ATOM 0 HB2 ARG A 125 -17.782 19.914 23.365 1.00 74.12 H new ATOM 0 HB3 ARG A 125 -16.537 19.219 24.384 1.00 74.12 H new ATOM 0 HG2 ARG A 125 -15.790 21.857 23.309 1.00 42.05 H new ATOM 0 HG3 ARG A 125 -17.254 21.901 24.272 1.00 42.05 H new ATOM 0 HD2 ARG A 125 -15.898 20.474 26.000 1.00 71.55 H new ATOM 0 HD3 ARG A 125 -14.487 20.992 25.100 1.00 71.55 H new ATOM 0 HE ARG A 125 -16.128 23.274 25.743 1.00 64.24 H new ATOM 0 HH11 ARG A 125 -13.908 20.919 27.153 1.00 34.22 H new ATOM 0 HH12 ARG A 125 -13.381 22.012 28.437 1.00 34.22 H new ATOM 0 HH21 ARG A 125 -15.445 24.673 27.395 1.00 74.34 H new ATOM 0 HH22 ARG A 125 -14.247 24.128 28.574 1.00 74.34 H new ATOM 1951 N MET A 126 -14.284 18.190 23.530 1.00 42.54 N ATOM 1952 CA MET A 126 -12.943 17.809 23.958 1.00 32.50 C ATOM 1953 C MET A 126 -12.051 17.515 22.756 1.00 52.41 C ATOM 1954 O MET A 126 -10.878 17.890 22.734 1.00 11.53 O ATOM 1955 CB MET A 126 -13.006 16.583 24.872 1.00 54.12 C ATOM 1956 CG MET A 126 -12.614 15.288 24.180 1.00 71.05 C ATOM 1957 SD MET A 126 -12.751 13.853 25.262 1.00 24.33 S ATOM 1958 CE MET A 126 -11.150 13.881 26.065 1.00 21.05 C ATOM 0 H MET A 126 -15.030 17.608 23.911 1.00 42.54 H new ATOM 0 HA MET A 126 -12.514 18.645 24.511 1.00 32.50 H new ATOM 0 HB2 MET A 126 -12.348 16.743 25.726 1.00 54.12 H new ATOM 0 HB3 MET A 126 -14.018 16.484 25.264 1.00 54.12 H new ATOM 0 HG2 MET A 126 -13.249 15.141 23.306 1.00 71.05 H new ATOM 0 HG3 MET A 126 -11.589 15.369 23.819 1.00 71.05 H new ATOM 0 HE1 MET A 126 -11.094 13.072 26.793 1.00 21.05 H new ATOM 0 HE2 MET A 126 -10.366 13.752 25.319 1.00 21.05 H new ATOM 0 HE3 MET A 126 -11.014 14.836 26.573 1.00 21.05 H new ATOM 1968 N LEU A 127 -12.614 16.843 21.758 1.00 44.24 N ATOM 1969 CA LEU A 127 -11.869 16.499 20.551 1.00 4.53 C ATOM 1970 C LEU A 127 -11.241 17.741 19.926 1.00 0.35 C ATOM 1971 O LEU A 127 -10.038 17.777 19.664 1.00 1.25 O ATOM 1972 CB LEU A 127 -12.788 15.814 19.539 1.00 44.04 C ATOM 1973 CG LEU A 127 -12.200 15.586 18.146 1.00 42.14 C ATOM 1974 CD1 LEU A 127 -10.959 14.711 18.227 1.00 61.44 C ATOM 1975 CD2 LEU A 127 -13.237 14.960 17.225 1.00 52.22 C ATOM 0 H LEU A 127 -13.583 16.525 21.760 1.00 44.24 H new ATOM 0 HA LEU A 127 -11.070 15.812 20.830 1.00 4.53 H new ATOM 0 HB2 LEU A 127 -13.089 14.849 19.947 1.00 44.04 H new ATOM 0 HB3 LEU A 127 -13.693 16.413 19.436 1.00 44.04 H new ATOM 0 HG LEU A 127 -11.912 16.552 17.732 1.00 42.14 H new ATOM 0 HD11 LEU A 127 -10.555 14.560 17.226 1.00 61.44 H new ATOM 0 HD12 LEU A 127 -10.210 15.199 18.851 1.00 61.44 H new ATOM 0 HD13 LEU A 127 -11.222 13.747 18.662 1.00 61.44 H new ATOM 0 HD21 LEU A 127 -12.801 14.805 16.238 1.00 52.22 H new ATOM 0 HD22 LEU A 127 -13.557 14.002 17.635 1.00 52.22 H new ATOM 0 HD23 LEU A 127 -14.097 15.624 17.141 1.00 52.22 H new ATOM 1987 N LEU A 128 -12.062 18.759 19.692 1.00 74.42 N ATOM 1988 CA LEU A 128 -11.588 20.004 19.100 1.00 43.53 C ATOM 1989 C LEU A 128 -10.447 20.597 19.920 1.00 2.44 C ATOM 1990 O LEU A 128 -9.432 21.026 19.372 1.00 65.04 O ATOM 1991 CB LEU A 128 -12.734 21.012 18.996 1.00 1.12 C ATOM 1992 CG LEU A 128 -13.736 20.775 17.865 1.00 4.44 C ATOM 1993 CD1 LEU A 128 -15.120 21.258 18.269 1.00 32.20 C ATOM 1994 CD2 LEU A 128 -13.277 21.471 16.592 1.00 24.01 C ATOM 0 H LEU A 128 -13.060 18.746 19.904 1.00 74.42 H new ATOM 0 HA LEU A 128 -11.216 19.783 18.100 1.00 43.53 H new ATOM 0 HB2 LEU A 128 -13.277 21.013 19.941 1.00 1.12 H new ATOM 0 HB3 LEU A 128 -12.306 22.007 18.873 1.00 1.12 H new ATOM 0 HG LEU A 128 -13.790 19.704 17.671 1.00 4.44 H new ATOM 0 HD11 LEU A 128 -15.820 21.081 17.452 1.00 32.20 H new ATOM 0 HD12 LEU A 128 -15.451 20.715 19.154 1.00 32.20 H new ATOM 0 HD13 LEU A 128 -15.083 22.325 18.491 1.00 32.20 H new ATOM 0 HD21 LEU A 128 -14.002 21.292 15.798 1.00 24.01 H new ATOM 0 HD22 LEU A 128 -13.194 22.543 16.773 1.00 24.01 H new ATOM 0 HD23 LEU A 128 -12.306 21.078 16.292 1.00 24.01 H new ATOM 2006 N ASP A 129 -10.620 20.617 21.237 1.00 32.43 N ATOM 2007 CA ASP A 129 -9.604 21.154 22.135 1.00 62.34 C ATOM 2008 C ASP A 129 -8.249 20.503 21.873 1.00 71.13 C ATOM 2009 O ASP A 129 -7.244 21.191 21.691 1.00 70.30 O ATOM 2010 CB ASP A 129 -10.014 20.938 23.592 1.00 31.31 C ATOM 2011 CG ASP A 129 -9.441 21.993 24.517 1.00 23.14 C ATOM 2012 OD1 ASP A 129 -9.126 23.100 24.032 1.00 0.24 O ATOM 2013 OD2 ASP A 129 -9.307 21.712 25.727 1.00 74.14 O ATOM 0 H ASP A 129 -11.455 20.267 21.707 1.00 32.43 H new ATOM 0 HA ASP A 129 -9.516 22.224 21.946 1.00 62.34 H new ATOM 0 HB2 ASP A 129 -11.101 20.947 23.665 1.00 31.31 H new ATOM 0 HB3 ASP A 129 -9.680 19.953 23.918 1.00 31.31 H new ATOM 2018 N ILE A 130 -8.230 19.174 21.856 1.00 10.41 N ATOM 2019 CA ILE A 130 -6.999 18.432 21.617 1.00 70.43 C ATOM 2020 C ILE A 130 -6.393 18.793 20.265 1.00 70.12 C ATOM 2021 O ILE A 130 -5.177 18.930 20.136 1.00 44.55 O ATOM 2022 CB ILE A 130 -7.240 16.911 21.669 1.00 43.31 C ATOM 2023 CG1 ILE A 130 -7.797 16.508 23.035 1.00 31.25 C ATOM 2024 CG2 ILE A 130 -5.950 16.160 21.374 1.00 2.41 C ATOM 2025 CD1 ILE A 130 -8.393 15.118 23.059 1.00 63.54 C ATOM 0 H ILE A 130 -9.053 18.590 22.005 1.00 10.41 H new ATOM 0 HA ILE A 130 -6.304 18.709 22.410 1.00 70.43 H new ATOM 0 HB ILE A 130 -7.973 16.648 20.907 1.00 43.31 H new ATOM 0 HG12 ILE A 130 -6.999 16.565 23.775 1.00 31.25 H new ATOM 0 HG13 ILE A 130 -8.560 17.227 23.334 1.00 31.25 H new ATOM 0 HG21 ILE A 130 -6.136 15.087 21.414 1.00 2.41 H new ATOM 0 HG22 ILE A 130 -5.592 16.429 20.380 1.00 2.41 H new ATOM 0 HG23 ILE A 130 -5.197 16.426 22.116 1.00 2.41 H new ATOM 0 HD11 ILE A 130 -8.768 14.900 24.059 1.00 63.54 H new ATOM 0 HD12 ILE A 130 -9.213 15.061 22.343 1.00 63.54 H new ATOM 0 HD13 ILE A 130 -7.628 14.389 22.792 1.00 63.54 H new ATOM 2037 N TRP A 131 -7.249 18.947 19.261 1.00 31.33 N ATOM 2038 CA TRP A 131 -6.798 19.294 17.919 1.00 51.35 C ATOM 2039 C TRP A 131 -5.919 20.540 17.945 1.00 24.50 C ATOM 2040 O TRP A 131 -4.737 20.484 17.604 1.00 71.54 O ATOM 2041 CB TRP A 131 -7.998 19.522 16.998 1.00 13.01 C ATOM 2042 CG TRP A 131 -8.677 18.252 16.582 1.00 50.20 C ATOM 2043 CD1 TRP A 131 -8.229 16.978 16.786 1.00 43.41 C ATOM 2044 CD2 TRP A 131 -9.924 18.135 15.889 1.00 35.53 C ATOM 2045 NE1 TRP A 131 -9.122 16.076 16.262 1.00 74.14 N ATOM 2046 CE2 TRP A 131 -10.172 16.760 15.707 1.00 64.31 C ATOM 2047 CE3 TRP A 131 -10.858 19.056 15.407 1.00 3.24 C ATOM 2048 CZ2 TRP A 131 -11.312 16.288 15.062 1.00 20.13 C ATOM 2049 CZ3 TRP A 131 -11.989 18.586 14.768 1.00 41.33 C ATOM 2050 CH2 TRP A 131 -12.209 17.213 14.600 1.00 22.44 C ATOM 0 H TRP A 131 -8.259 18.837 19.351 1.00 31.33 H new ATOM 0 HA TRP A 131 -6.207 18.462 17.536 1.00 51.35 H new ATOM 0 HB2 TRP A 131 -8.720 20.162 17.505 1.00 13.01 H new ATOM 0 HB3 TRP A 131 -7.667 20.057 16.108 1.00 13.01 H new ATOM 0 HD1 TRP A 131 -7.308 16.718 17.286 1.00 43.41 H new ATOM 0 HE1 TRP A 131 -9.020 15.061 16.283 1.00 74.14 H new ATOM 0 HE3 TRP A 131 -10.698 20.117 15.532 1.00 3.24 H new ATOM 0 HZ2 TRP A 131 -11.483 15.230 14.931 1.00 20.13 H new ATOM 0 HZ3 TRP A 131 -12.716 19.290 14.391 1.00 41.33 H new ATOM 0 HH2 TRP A 131 -13.104 16.878 14.096 1.00 22.44 H new ATOM 2061 N ASP A 132 -6.502 21.662 18.352 1.00 25.43 N ATOM 2062 CA ASP A 132 -5.770 22.921 18.424 1.00 24.25 C ATOM 2063 C ASP A 132 -4.529 22.779 19.301 1.00 14.14 C ATOM 2064 O ASP A 132 -3.482 23.357 19.010 1.00 20.24 O ATOM 2065 CB ASP A 132 -6.671 24.029 18.970 1.00 14.03 C ATOM 2066 CG ASP A 132 -6.846 23.945 20.474 1.00 41.41 C ATOM 2067 OD1 ASP A 132 -5.893 24.293 21.202 1.00 24.35 O ATOM 2068 OD2 ASP A 132 -7.936 23.534 20.922 1.00 31.32 O ATOM 0 H ASP A 132 -7.479 21.725 18.637 1.00 25.43 H new ATOM 0 HA ASP A 132 -5.452 23.186 17.416 1.00 24.25 H new ATOM 0 HB2 ASP A 132 -6.247 24.999 18.710 1.00 14.03 H new ATOM 0 HB3 ASP A 132 -7.648 23.969 18.490 1.00 14.03 H new ATOM 2073 N ARG A 133 -4.656 22.008 20.376 1.00 30.23 N ATOM 2074 CA ARG A 133 -3.546 21.792 21.297 1.00 54.20 C ATOM 2075 C ARG A 133 -2.327 21.247 20.560 1.00 24.30 C ATOM 2076 O ARG A 133 -1.288 21.904 20.486 1.00 34.22 O ATOM 2077 CB ARG A 133 -3.959 20.825 22.409 1.00 45.35 C ATOM 2078 CG ARG A 133 -2.948 20.732 23.540 1.00 61.51 C ATOM 2079 CD ARG A 133 -2.940 21.995 24.386 1.00 50.10 C ATOM 2080 NE ARG A 133 -1.609 22.297 24.907 1.00 73.04 N ATOM 2081 CZ ARG A 133 -1.333 23.370 25.639 1.00 21.24 C ATOM 2082 NH1 ARG A 133 -2.290 24.238 25.937 1.00 43.11 N ATOM 2083 NH2 ARG A 133 -0.097 23.576 26.077 1.00 71.42 N ATOM 0 H ARG A 133 -5.516 21.523 20.631 1.00 30.23 H new ATOM 0 HA ARG A 133 -3.282 22.752 21.740 1.00 54.20 H new ATOM 0 HB2 ARG A 133 -4.919 21.141 22.816 1.00 45.35 H new ATOM 0 HB3 ARG A 133 -4.105 19.833 21.981 1.00 45.35 H new ATOM 0 HG2 ARG A 133 -3.182 19.873 24.169 1.00 61.51 H new ATOM 0 HG3 ARG A 133 -1.953 20.563 23.127 1.00 61.51 H new ATOM 0 HD2 ARG A 133 -3.294 22.834 23.787 1.00 50.10 H new ATOM 0 HD3 ARG A 133 -3.637 21.879 25.216 1.00 50.10 H new ATOM 0 HE ARG A 133 -0.850 21.648 24.697 1.00 73.04 H new ATOM 0 HH11 ARG A 133 -3.241 24.082 25.604 1.00 43.11 H new ATOM 0 HH12 ARG A 133 -2.075 25.061 26.499 1.00 43.11 H new ATOM 0 HH21 ARG A 133 0.642 22.910 25.851 1.00 71.42 H new ATOM 0 HH22 ARG A 133 0.114 24.400 26.639 1.00 71.42 H new ATOM 2097 N SER A 134 -2.460 20.041 20.017 1.00 72.12 N ATOM 2098 CA SER A 134 -1.368 19.405 19.289 1.00 1.05 C ATOM 2099 C SER A 134 -0.876 20.300 18.156 1.00 1.44 C ATOM 2100 O SER A 134 0.180 20.924 18.257 1.00 55.42 O ATOM 2101 CB SER A 134 -1.818 18.055 18.729 1.00 75.23 C ATOM 2102 OG SER A 134 -1.034 17.680 17.609 1.00 14.14 O ATOM 0 H SER A 134 -3.313 19.485 20.067 1.00 72.12 H new ATOM 0 HA SER A 134 -0.545 19.245 19.986 1.00 1.05 H new ATOM 0 HB2 SER A 134 -1.739 17.292 19.504 1.00 75.23 H new ATOM 0 HB3 SER A 134 -2.868 18.109 18.440 1.00 75.23 H new ATOM 0 HG SER A 134 -1.341 16.813 17.271 1.00 14.14 H new ATOM 2108 N GLY A 135 -1.650 20.358 17.077 1.00 72.11 N ATOM 2109 CA GLY A 135 -1.278 21.179 15.940 1.00 63.34 C ATOM 2110 C GLY A 135 -2.151 20.921 14.728 1.00 64.44 C ATOM 2111 O GLY A 135 -1.676 20.958 13.592 1.00 42.54 O ATOM 0 H GLY A 135 -2.528 19.851 16.970 1.00 72.11 H new ATOM 0 HA2 GLY A 135 -1.348 22.231 16.217 1.00 63.34 H new ATOM 0 HA3 GLY A 135 -0.237 20.986 15.682 1.00 63.34 H new ATOM 2115 N LEU A 136 -3.430 20.656 14.968 1.00 70.33 N ATOM 2116 CA LEU A 136 -4.372 20.388 13.886 1.00 0.33 C ATOM 2117 C LEU A 136 -4.614 21.642 13.052 1.00 1.22 C ATOM 2118 O LEU A 136 -3.867 22.616 13.146 1.00 44.34 O ATOM 2119 CB LEU A 136 -5.697 19.875 14.453 1.00 51.41 C ATOM 2120 CG LEU A 136 -6.372 18.751 13.668 1.00 74.45 C ATOM 2121 CD1 LEU A 136 -6.185 17.418 14.375 1.00 24.24 C ATOM 2122 CD2 LEU A 136 -7.852 19.050 13.473 1.00 22.42 C ATOM 0 H LEU A 136 -3.839 20.621 15.902 1.00 70.33 H new ATOM 0 HA LEU A 136 -3.939 19.623 13.241 1.00 0.33 H new ATOM 0 HB2 LEU A 136 -5.523 19.526 15.471 1.00 51.41 H new ATOM 0 HB3 LEU A 136 -6.391 20.713 14.517 1.00 51.41 H new ATOM 0 HG LEU A 136 -5.902 18.687 12.687 1.00 74.45 H new ATOM 0 HD11 LEU A 136 -6.673 16.630 13.801 1.00 24.24 H new ATOM 0 HD12 LEU A 136 -5.121 17.198 14.462 1.00 24.24 H new ATOM 0 HD13 LEU A 136 -6.627 17.469 15.370 1.00 24.24 H new ATOM 0 HD21 LEU A 136 -8.316 18.239 12.912 1.00 22.42 H new ATOM 0 HD22 LEU A 136 -8.336 19.142 14.445 1.00 22.42 H new ATOM 0 HD23 LEU A 136 -7.965 19.983 12.922 1.00 22.42 H new ATOM 2134 N PHE A 137 -5.664 21.612 12.238 1.00 21.23 N ATOM 2135 CA PHE A 137 -6.006 22.746 11.388 1.00 5.44 C ATOM 2136 C PHE A 137 -6.298 23.986 12.228 1.00 3.52 C ATOM 2137 O PHE A 137 -6.014 24.018 13.425 1.00 3.41 O ATOM 2138 CB PHE A 137 -7.217 22.411 10.516 1.00 63.33 C ATOM 2139 CG PHE A 137 -7.136 21.055 9.875 1.00 34.51 C ATOM 2140 CD1 PHE A 137 -5.910 20.504 9.538 1.00 13.24 C ATOM 2141 CD2 PHE A 137 -8.287 20.330 9.609 1.00 14.22 C ATOM 2142 CE1 PHE A 137 -5.833 19.256 8.949 1.00 1.31 C ATOM 2143 CE2 PHE A 137 -8.216 19.082 9.021 1.00 72.25 C ATOM 2144 CZ PHE A 137 -6.988 18.545 8.689 1.00 64.31 C ATOM 0 H PHE A 137 -6.293 20.814 12.149 1.00 21.23 H new ATOM 0 HA PHE A 137 -5.151 22.956 10.745 1.00 5.44 H new ATOM 0 HB2 PHE A 137 -8.119 22.463 11.125 1.00 63.33 H new ATOM 0 HB3 PHE A 137 -7.314 23.167 9.737 1.00 63.33 H new ATOM 0 HD1 PHE A 137 -5.004 21.056 9.738 1.00 13.24 H new ATOM 0 HD2 PHE A 137 -9.251 20.746 9.864 1.00 14.22 H new ATOM 0 HE1 PHE A 137 -4.871 18.837 8.692 1.00 1.31 H new ATOM 0 HE2 PHE A 137 -9.120 18.527 8.821 1.00 72.25 H new ATOM 0 HZ PHE A 137 -6.931 17.571 8.227 1.00 64.31 H new ATOM 2154 N GLN A 138 -6.866 25.005 11.591 1.00 71.12 N ATOM 2155 CA GLN A 138 -7.195 26.248 12.279 1.00 75.24 C ATOM 2156 C GLN A 138 -8.404 26.062 13.190 1.00 73.23 C ATOM 2157 O GLN A 138 -9.506 26.513 12.877 1.00 75.52 O ATOM 2158 CB GLN A 138 -7.473 27.359 11.264 1.00 24.32 C ATOM 2159 CG GLN A 138 -8.494 26.975 10.206 1.00 60.04 C ATOM 2160 CD GLN A 138 -7.884 26.853 8.823 1.00 21.42 C ATOM 2161 OE1 GLN A 138 -7.330 27.814 8.289 1.00 13.10 O ATOM 2162 NE2 GLN A 138 -7.982 25.666 8.236 1.00 62.14 N ATOM 0 H GLN A 138 -7.108 24.994 10.600 1.00 71.12 H new ATOM 0 HA GLN A 138 -6.340 26.532 12.893 1.00 75.24 H new ATOM 0 HB2 GLN A 138 -7.826 28.244 11.794 1.00 24.32 H new ATOM 0 HB3 GLN A 138 -6.539 27.633 10.773 1.00 24.32 H new ATOM 0 HG2 GLN A 138 -8.956 26.027 10.480 1.00 60.04 H new ATOM 0 HG3 GLN A 138 -9.288 27.722 10.184 1.00 60.04 H new ATOM 0 HE21 GLN A 138 -8.450 24.897 8.716 1.00 62.14 H new ATOM 0 HE22 GLN A 138 -7.589 25.523 7.305 1.00 62.14 H new ATOM 2171 N LYS A 139 -8.191 25.395 14.319 1.00 62.32 N ATOM 2172 CA LYS A 139 -9.262 25.149 15.277 1.00 2.02 C ATOM 2173 C LYS A 139 -9.326 26.262 16.319 1.00 61.25 C ATOM 2174 O LYS A 139 -10.247 26.309 17.134 1.00 42.40 O ATOM 2175 CB LYS A 139 -9.055 23.800 15.969 1.00 34.31 C ATOM 2176 CG LYS A 139 -8.851 22.646 15.003 1.00 32.30 C ATOM 2177 CD LYS A 139 -10.100 22.381 14.178 1.00 3.24 C ATOM 2178 CE LYS A 139 -10.038 23.085 12.832 1.00 44.25 C ATOM 2179 NZ LYS A 139 -10.521 22.212 11.726 1.00 23.33 N ATOM 0 H LYS A 139 -7.285 25.015 14.593 1.00 62.32 H new ATOM 0 HA LYS A 139 -10.206 25.130 14.732 1.00 2.02 H new ATOM 0 HB2 LYS A 139 -8.190 23.868 16.628 1.00 34.31 H new ATOM 0 HB3 LYS A 139 -9.919 23.588 16.598 1.00 34.31 H new ATOM 0 HG2 LYS A 139 -8.016 22.870 14.339 1.00 32.30 H new ATOM 0 HG3 LYS A 139 -8.584 21.748 15.559 1.00 32.30 H new ATOM 0 HD2 LYS A 139 -10.215 21.308 14.024 1.00 3.24 H new ATOM 0 HD3 LYS A 139 -10.979 22.720 14.727 1.00 3.24 H new ATOM 0 HE2 LYS A 139 -10.641 23.992 12.869 1.00 44.25 H new ATOM 0 HE3 LYS A 139 -9.012 23.393 12.630 1.00 44.25 H new ATOM 0 HZ1 LYS A 139 -10.640 22.779 10.863 1.00 23.33 H new ATOM 0 HZ2 LYS A 139 -9.827 21.457 11.551 1.00 23.33 H new ATOM 0 HZ3 LYS A 139 -11.434 21.789 11.991 1.00 23.33 H new ATOM 2193 N SER A 140 -8.343 27.156 16.284 1.00 22.31 N ATOM 2194 CA SER A 140 -8.287 28.267 17.227 1.00 63.14 C ATOM 2195 C SER A 140 -9.200 29.405 16.780 1.00 64.21 C ATOM 2196 O SER A 140 -9.361 30.400 17.486 1.00 0.15 O ATOM 2197 CB SER A 140 -6.850 28.775 17.364 1.00 31.53 C ATOM 2198 OG SER A 140 -6.766 29.815 18.323 1.00 34.41 O ATOM 0 H SER A 140 -7.575 27.133 15.613 1.00 22.31 H new ATOM 0 HA SER A 140 -8.632 27.907 18.196 1.00 63.14 H new ATOM 0 HB2 SER A 140 -6.197 27.953 17.656 1.00 31.53 H new ATOM 0 HB3 SER A 140 -6.495 29.136 16.399 1.00 31.53 H new ATOM 0 HG SER A 140 -7.592 30.342 18.308 1.00 34.41 H new ATOM 2204 N TYR A 141 -9.794 29.250 15.602 1.00 32.12 N ATOM 2205 CA TYR A 141 -10.689 30.264 15.059 1.00 52.44 C ATOM 2206 C TYR A 141 -11.700 29.642 14.100 1.00 45.24 C ATOM 2207 O TYR A 141 -12.237 30.318 13.221 1.00 61.43 O ATOM 2208 CB TYR A 141 -9.887 31.349 14.338 1.00 3.32 C ATOM 2209 CG TYR A 141 -9.144 32.275 15.275 1.00 44.14 C ATOM 2210 CD1 TYR A 141 -9.824 33.220 16.033 1.00 22.02 C ATOM 2211 CD2 TYR A 141 -7.762 32.206 15.400 1.00 23.01 C ATOM 2212 CE1 TYR A 141 -9.149 34.069 16.890 1.00 71.54 C ATOM 2213 CE2 TYR A 141 -7.079 33.049 16.255 1.00 40.41 C ATOM 2214 CZ TYR A 141 -7.777 33.979 16.997 1.00 0.03 C ATOM 2215 OH TYR A 141 -7.100 34.822 17.849 1.00 74.11 O ATOM 0 H TYR A 141 -9.672 28.432 15.005 1.00 32.12 H new ATOM 0 HA TYR A 141 -11.233 30.714 15.890 1.00 52.44 H new ATOM 0 HB2 TYR A 141 -9.172 30.875 13.666 1.00 3.32 H new ATOM 0 HB3 TYR A 141 -10.563 31.938 13.719 1.00 3.32 H new ATOM 0 HD1 TYR A 141 -10.898 33.293 15.951 1.00 22.02 H new ATOM 0 HD2 TYR A 141 -7.212 31.481 14.819 1.00 23.01 H new ATOM 0 HE1 TYR A 141 -9.693 34.798 17.472 1.00 71.54 H new ATOM 0 HE2 TYR A 141 -6.005 32.980 16.342 1.00 40.41 H new ATOM 0 HH TYR A 141 -6.140 34.628 17.807 1.00 74.11 H new ATOM 2225 N LEU A 142 -11.954 28.350 14.275 1.00 2.33 N ATOM 2226 CA LEU A 142 -12.900 27.635 13.427 1.00 74.51 C ATOM 2227 C LEU A 142 -14.306 28.207 13.576 1.00 13.12 C ATOM 2228 O LEU A 142 -14.914 28.116 14.642 1.00 50.41 O ATOM 2229 CB LEU A 142 -12.904 26.145 13.777 1.00 51.43 C ATOM 2230 CG LEU A 142 -13.451 25.205 12.702 1.00 23.21 C ATOM 2231 CD1 LEU A 142 -12.505 25.146 11.513 1.00 43.12 C ATOM 2232 CD2 LEU A 142 -13.676 23.813 13.276 1.00 53.53 C ATOM 0 H LEU A 142 -11.518 27.776 14.997 1.00 2.33 H new ATOM 0 HA LEU A 142 -12.586 27.758 12.391 1.00 74.51 H new ATOM 0 HB2 LEU A 142 -11.882 25.844 14.009 1.00 51.43 H new ATOM 0 HB3 LEU A 142 -13.491 26.007 14.685 1.00 51.43 H new ATOM 0 HG LEU A 142 -14.409 25.595 12.359 1.00 23.21 H new ATOM 0 HD11 LEU A 142 -12.911 24.472 10.758 1.00 43.12 H new ATOM 0 HD12 LEU A 142 -12.393 26.143 11.087 1.00 43.12 H new ATOM 0 HD13 LEU A 142 -11.532 24.780 11.840 1.00 43.12 H new ATOM 0 HD21 LEU A 142 -14.065 23.157 12.497 1.00 53.53 H new ATOM 0 HD22 LEU A 142 -12.731 23.415 13.647 1.00 53.53 H new ATOM 0 HD23 LEU A 142 -14.393 23.869 14.095 1.00 53.53 H new ATOM 2244 N ASN A 143 -14.818 28.795 12.499 1.00 24.04 N ATOM 2245 CA ASN A 143 -16.153 29.381 12.510 1.00 31.11 C ATOM 2246 C ASN A 143 -17.148 28.455 13.204 1.00 42.21 C ATOM 2247 O ASN A 143 -18.020 28.908 13.944 1.00 32.03 O ATOM 2248 CB ASN A 143 -16.618 29.668 11.081 1.00 11.30 C ATOM 2249 CG ASN A 143 -17.655 30.773 11.022 1.00 52.13 C ATOM 2250 OD1 ASN A 143 -17.322 31.943 10.829 1.00 32.43 O ATOM 2251 ND2 ASN A 143 -18.921 30.406 11.187 1.00 4.15 N ATOM 0 H ASN A 143 -14.328 28.878 11.608 1.00 24.04 H new ATOM 0 HA ASN A 143 -16.107 30.318 13.065 1.00 31.11 H new ATOM 0 HB2 ASN A 143 -15.759 29.947 10.471 1.00 11.30 H new ATOM 0 HB3 ASN A 143 -17.035 28.759 10.648 1.00 11.30 H new ATOM 0 HD21 ASN A 143 -19.663 31.105 11.156 1.00 4.15 H new ATOM 0 HD22 ASN A 143 -19.151 29.425 11.344 1.00 4.15 H new ATOM 2258 N ALA A 144 -17.009 27.156 12.959 1.00 0.41 N ATOM 2259 CA ALA A 144 -17.893 26.167 13.562 1.00 71.41 C ATOM 2260 C ALA A 144 -18.185 26.507 15.019 1.00 34.03 C ATOM 2261 O ALA A 144 -19.164 27.190 15.323 1.00 51.15 O ATOM 2262 CB ALA A 144 -17.281 24.778 13.455 1.00 73.42 C ATOM 0 H ALA A 144 -16.293 26.765 12.347 1.00 0.41 H new ATOM 0 HA ALA A 144 -18.837 26.180 13.017 1.00 71.41 H new ATOM 0 HB1 ALA A 144 -17.952 24.049 13.909 1.00 73.42 H new ATOM 0 HB2 ALA A 144 -17.130 24.527 12.405 1.00 73.42 H new ATOM 0 HB3 ALA A 144 -16.322 24.762 13.974 1.00 73.42 H new ATOM 2268 N ILE A 145 -17.332 26.026 15.917 1.00 41.20 N ATOM 2269 CA ILE A 145 -17.499 26.281 17.342 1.00 34.54 C ATOM 2270 C ILE A 145 -17.299 27.757 17.665 1.00 45.43 C ATOM 2271 O ILE A 145 -17.860 28.274 18.630 1.00 13.45 O ATOM 2272 CB ILE A 145 -16.516 25.445 18.183 1.00 62.12 C ATOM 2273 CG1 ILE A 145 -15.093 25.596 17.642 1.00 44.02 C ATOM 2274 CG2 ILE A 145 -16.934 23.982 18.188 1.00 42.00 C ATOM 2275 CD1 ILE A 145 -14.632 24.416 16.815 1.00 22.24 C ATOM 0 H ILE A 145 -16.518 25.457 15.683 1.00 41.20 H new ATOM 0 HA ILE A 145 -18.519 25.992 17.596 1.00 34.54 H new ATOM 0 HB ILE A 145 -16.536 25.811 19.209 1.00 62.12 H new ATOM 0 HG12 ILE A 145 -15.038 26.499 17.034 1.00 44.02 H new ATOM 0 HG13 ILE A 145 -14.408 25.733 18.478 1.00 44.02 H new ATOM 0 HG21 ILE A 145 -16.229 23.404 18.786 1.00 42.00 H new ATOM 0 HG22 ILE A 145 -17.933 23.890 18.615 1.00 42.00 H new ATOM 0 HG23 ILE A 145 -16.939 23.602 17.167 1.00 42.00 H new ATOM 0 HD11 ILE A 145 -13.615 24.592 16.465 1.00 22.24 H new ATOM 0 HD12 ILE A 145 -14.654 23.513 17.425 1.00 22.24 H new ATOM 0 HD13 ILE A 145 -15.294 24.291 15.958 1.00 22.24 H new ATOM 2287 N ARG A 146 -16.495 28.432 16.848 1.00 32.44 N ATOM 2288 CA ARG A 146 -16.221 29.850 17.046 1.00 25.31 C ATOM 2289 C ARG A 146 -17.449 30.570 17.594 1.00 40.21 C ATOM 2290 O ARG A 146 -17.382 31.233 18.629 1.00 32.42 O ATOM 2291 CB ARG A 146 -15.783 30.494 15.730 1.00 44.43 C ATOM 2292 CG ARG A 146 -16.031 31.993 15.673 1.00 23.04 C ATOM 2293 CD ARG A 146 -14.868 32.726 15.023 1.00 70.04 C ATOM 2294 NE ARG A 146 -15.009 34.176 15.124 1.00 35.03 N ATOM 2295 CZ ARG A 146 -14.194 35.038 14.527 1.00 70.45 C ATOM 2296 NH1 ARG A 146 -13.185 34.597 13.788 1.00 3.21 N ATOM 2297 NH2 ARG A 146 -14.388 36.343 14.667 1.00 62.25 N ATOM 0 H ARG A 146 -16.023 28.019 16.044 1.00 32.44 H new ATOM 0 HA ARG A 146 -15.414 29.941 17.773 1.00 25.31 H new ATOM 0 HB2 ARG A 146 -14.720 30.304 15.578 1.00 44.43 H new ATOM 0 HB3 ARG A 146 -16.313 30.015 14.907 1.00 44.43 H new ATOM 0 HG2 ARG A 146 -16.945 32.191 15.113 1.00 23.04 H new ATOM 0 HG3 ARG A 146 -16.186 32.376 16.682 1.00 23.04 H new ATOM 0 HD2 ARG A 146 -13.936 32.419 15.497 1.00 70.04 H new ATOM 0 HD3 ARG A 146 -14.801 32.441 13.973 1.00 70.04 H new ATOM 0 HE ARG A 146 -15.776 34.547 15.684 1.00 35.03 H new ATOM 0 HH11 ARG A 146 -13.034 33.594 13.677 1.00 3.21 H new ATOM 0 HH12 ARG A 146 -12.560 35.260 13.330 1.00 3.21 H new ATOM 0 HH21 ARG A 146 -15.164 36.685 15.234 1.00 62.25 H new ATOM 0 HH22 ARG A 146 -13.761 37.004 14.208 1.00 62.25 H new ATOM 2311 N SER A 147 -18.569 30.436 16.891 1.00 15.24 N ATOM 2312 CA SER A 147 -19.812 31.078 17.305 1.00 70.23 C ATOM 2313 C SER A 147 -20.343 30.455 18.592 1.00 2.04 C ATOM 2314 O SER A 147 -21.091 29.477 18.561 1.00 3.53 O ATOM 2315 CB SER A 147 -20.863 30.963 16.198 1.00 25.25 C ATOM 2316 OG SER A 147 -21.643 32.142 16.112 1.00 14.21 O ATOM 0 H SER A 147 -18.642 29.889 16.033 1.00 15.24 H new ATOM 0 HA SER A 147 -19.604 32.132 17.491 1.00 70.23 H new ATOM 0 HB2 SER A 147 -20.371 30.778 15.243 1.00 25.25 H new ATOM 0 HB3 SER A 147 -21.510 30.108 16.394 1.00 25.25 H new ATOM 0 HG SER A 147 -22.306 32.044 15.397 1.00 14.21 H new ATOM 2322 N LYS A 148 -19.950 31.028 19.725 1.00 53.41 N ATOM 2323 CA LYS A 148 -20.386 30.533 21.025 1.00 22.41 C ATOM 2324 C LYS A 148 -21.875 30.203 21.011 1.00 51.32 C ATOM 2325 O LYS A 148 -22.318 29.261 21.669 1.00 54.32 O ATOM 2326 CB LYS A 148 -20.092 31.568 22.113 1.00 30.22 C ATOM 2327 CG LYS A 148 -18.620 31.919 22.237 1.00 45.22 C ATOM 2328 CD LYS A 148 -17.928 31.063 23.285 1.00 50.24 C ATOM 2329 CE LYS A 148 -17.808 31.796 24.612 1.00 21.11 C ATOM 2330 NZ LYS A 148 -18.902 31.425 25.552 1.00 71.35 N ATOM 0 H LYS A 148 -19.330 31.836 19.769 1.00 53.41 H new ATOM 0 HA LYS A 148 -19.832 29.620 21.242 1.00 22.41 H new ATOM 0 HB2 LYS A 148 -20.657 32.476 21.901 1.00 30.22 H new ATOM 0 HB3 LYS A 148 -20.448 31.187 23.070 1.00 30.22 H new ATOM 0 HG2 LYS A 148 -18.130 31.782 21.273 1.00 45.22 H new ATOM 0 HG3 LYS A 148 -18.517 32.972 22.500 1.00 45.22 H new ATOM 0 HD2 LYS A 148 -18.487 30.138 23.428 1.00 50.24 H new ATOM 0 HD3 LYS A 148 -16.936 30.784 22.931 1.00 50.24 H new ATOM 0 HE2 LYS A 148 -16.845 31.567 25.068 1.00 21.11 H new ATOM 0 HE3 LYS A 148 -17.830 32.871 24.436 1.00 21.11 H new ATOM 0 HZ1 LYS A 148 -19.373 32.287 25.894 1.00 71.35 H new ATOM 0 HZ2 LYS A 148 -19.594 30.825 25.060 1.00 71.35 H new ATOM 0 HZ3 LYS A 148 -18.504 30.904 26.359 1.00 71.35 H new ATOM 2344 N CYS A 149 -22.641 30.983 20.257 1.00 55.34 N ATOM 2345 CA CYS A 149 -24.081 30.774 20.156 1.00 35.43 C ATOM 2346 C CYS A 149 -24.404 29.294 19.978 1.00 73.35 C ATOM 2347 O CYS A 149 -25.421 28.805 20.471 1.00 52.35 O ATOM 2348 CB CYS A 149 -24.655 31.578 18.989 1.00 62.24 C ATOM 2349 SG CYS A 149 -26.370 32.098 19.223 1.00 54.52 S ATOM 0 H CYS A 149 -22.289 31.766 19.706 1.00 55.34 H new ATOM 0 HA CYS A 149 -24.539 31.119 21.083 1.00 35.43 H new ATOM 0 HB2 CYS A 149 -24.037 32.462 18.832 1.00 62.24 H new ATOM 0 HB3 CYS A 149 -24.589 30.978 18.081 1.00 62.24 H new ATOM 0 HG CYS A 149 -26.764 32.773 18.184 1.00 54.52 H new ATOM 2355 N PHE A 150 -23.533 28.585 19.268 1.00 64.13 N ATOM 2356 CA PHE A 150 -23.726 27.161 19.021 1.00 20.31 C ATOM 2357 C PHE A 150 -23.805 26.387 20.334 1.00 52.20 C ATOM 2358 O PHE A 150 -24.872 26.276 20.938 1.00 62.13 O ATOM 2359 CB PHE A 150 -22.587 26.611 18.160 1.00 5.24 C ATOM 2360 CG PHE A 150 -22.809 26.791 16.686 1.00 43.02 C ATOM 2361 CD1 PHE A 150 -23.846 26.134 16.043 1.00 43.40 C ATOM 2362 CD2 PHE A 150 -21.981 27.617 15.943 1.00 61.03 C ATOM 2363 CE1 PHE A 150 -24.052 26.298 14.686 1.00 23.41 C ATOM 2364 CE2 PHE A 150 -22.182 27.784 14.585 1.00 13.45 C ATOM 2365 CZ PHE A 150 -23.220 27.124 13.957 1.00 41.53 C ATOM 0 H PHE A 150 -22.686 28.974 18.853 1.00 64.13 H new ATOM 0 HA PHE A 150 -24.668 27.035 18.488 1.00 20.31 H new ATOM 0 HB2 PHE A 150 -21.658 27.105 18.442 1.00 5.24 H new ATOM 0 HB3 PHE A 150 -22.461 25.550 18.373 1.00 5.24 H new ATOM 0 HD1 PHE A 150 -24.500 25.487 16.608 1.00 43.40 H new ATOM 0 HD2 PHE A 150 -21.169 28.137 16.430 1.00 61.03 H new ATOM 0 HE1 PHE A 150 -24.863 25.780 14.196 1.00 23.41 H new ATOM 0 HE2 PHE A 150 -21.529 28.429 14.017 1.00 13.45 H new ATOM 0 HZ PHE A 150 -23.381 27.254 12.897 1.00 41.53 H new ATOM 2375 N ALA A 151 -22.668 25.854 20.769 1.00 13.13 N ATOM 2376 CA ALA A 151 -22.608 25.092 22.011 1.00 42.35 C ATOM 2377 C ALA A 151 -23.570 25.658 23.049 1.00 12.13 C ATOM 2378 O ALA A 151 -24.299 24.914 23.704 1.00 32.40 O ATOM 2379 CB ALA A 151 -21.187 25.082 22.555 1.00 40.13 C ATOM 0 H ALA A 151 -21.776 25.936 20.280 1.00 13.13 H new ATOM 0 HA ALA A 151 -22.910 24.067 21.795 1.00 42.35 H new ATOM 0 HB1 ALA A 151 -21.156 24.510 23.482 1.00 40.13 H new ATOM 0 HB2 ALA A 151 -20.521 24.624 21.824 1.00 40.13 H new ATOM 0 HB3 ALA A 151 -20.865 26.105 22.749 1.00 40.13 H new ATOM 2385 N MET A 152 -23.566 26.979 23.195 1.00 12.04 N ATOM 2386 CA MET A 152 -24.440 27.644 24.155 1.00 30.01 C ATOM 2387 C MET A 152 -25.906 27.352 23.849 1.00 44.43 C ATOM 2388 O MET A 152 -26.559 26.592 24.563 1.00 14.10 O ATOM 2389 CB MET A 152 -24.194 29.154 24.140 1.00 73.11 C ATOM 2390 CG MET A 152 -23.086 29.599 25.080 1.00 23.40 C ATOM 2391 SD MET A 152 -21.474 28.938 24.615 1.00 21.40 S ATOM 2392 CE MET A 152 -21.122 27.884 26.020 1.00 3.43 C ATOM 0 H MET A 152 -22.968 27.610 22.661 1.00 12.04 H new ATOM 0 HA MET A 152 -24.211 27.256 25.147 1.00 30.01 H new ATOM 0 HB2 MET A 152 -23.944 29.463 23.125 1.00 73.11 H new ATOM 0 HB3 MET A 152 -25.117 29.667 24.411 1.00 73.11 H new ATOM 0 HG2 MET A 152 -23.039 30.688 25.090 1.00 23.40 H new ATOM 0 HG3 MET A 152 -23.326 29.281 26.095 1.00 23.40 H new ATOM 0 HE1 MET A 152 -20.154 27.403 25.880 1.00 3.43 H new ATOM 0 HE2 MET A 152 -21.101 28.485 26.929 1.00 3.43 H new ATOM 0 HE3 MET A 152 -21.897 27.122 26.106 1.00 3.43 H new ATOM 2402 N ASP A 153 -26.415 27.961 22.784 1.00 52.42 N ATOM 2403 CA ASP A 153 -27.804 27.766 22.383 1.00 43.42 C ATOM 2404 C ASP A 153 -28.072 26.302 22.049 1.00 52.33 C ATOM 2405 O ASP A 153 -28.907 25.653 22.680 1.00 12.33 O ATOM 2406 CB ASP A 153 -28.137 28.647 21.178 1.00 73.14 C ATOM 2407 CG ASP A 153 -29.618 28.956 21.079 1.00 52.31 C ATOM 2408 OD1 ASP A 153 -30.375 28.087 20.599 1.00 62.21 O ATOM 2409 OD2 ASP A 153 -30.020 30.068 21.481 1.00 54.40 O ATOM 0 H ASP A 153 -25.887 28.594 22.183 1.00 52.42 H new ATOM 0 HA ASP A 153 -28.442 28.052 23.219 1.00 43.42 H new ATOM 0 HB2 ASP A 153 -27.578 29.580 21.248 1.00 73.14 H new ATOM 0 HB3 ASP A 153 -27.811 28.148 20.265 1.00 73.14 H new ATOM 2414 N LEU A 154 -27.360 25.788 21.052 1.00 54.32 N ATOM 2415 CA LEU A 154 -27.522 24.400 20.632 1.00 13.44 C ATOM 2416 C LEU A 154 -27.724 23.487 21.837 1.00 1.34 C ATOM 2417 O LEU A 154 -28.476 22.516 21.772 1.00 21.43 O ATOM 2418 CB LEU A 154 -26.302 23.944 19.831 1.00 72.24 C ATOM 2419 CG LEU A 154 -25.681 22.612 20.254 1.00 40.22 C ATOM 2420 CD1 LEU A 154 -24.783 22.068 19.153 1.00 14.22 C ATOM 2421 CD2 LEU A 154 -24.900 22.776 21.549 1.00 2.04 C ATOM 0 H LEU A 154 -26.665 26.311 20.519 1.00 54.32 H new ATOM 0 HA LEU A 154 -28.408 24.338 20.000 1.00 13.44 H new ATOM 0 HB2 LEU A 154 -26.588 23.872 18.782 1.00 72.24 H new ATOM 0 HB3 LEU A 154 -25.537 24.717 19.901 1.00 72.24 H new ATOM 0 HG LEU A 154 -26.485 21.896 20.426 1.00 40.22 H new ATOM 0 HD11 LEU A 154 -24.350 21.120 19.472 1.00 14.22 H new ATOM 0 HD12 LEU A 154 -25.370 21.913 18.248 1.00 14.22 H new ATOM 0 HD13 LEU A 154 -23.984 22.781 18.949 1.00 14.22 H new ATOM 0 HD21 LEU A 154 -24.465 21.818 21.835 1.00 2.04 H new ATOM 0 HD22 LEU A 154 -24.105 23.507 21.404 1.00 2.04 H new ATOM 0 HD23 LEU A 154 -25.570 23.120 22.337 1.00 2.04 H new ATOM 2433 N GLU A 155 -27.048 23.809 22.936 1.00 35.55 N ATOM 2434 CA GLU A 155 -27.155 23.017 24.157 1.00 54.24 C ATOM 2435 C GLU A 155 -28.606 22.931 24.624 1.00 65.22 C ATOM 2436 O GLU A 155 -29.256 21.895 24.479 1.00 24.01 O ATOM 2437 CB GLU A 155 -26.287 23.623 25.261 1.00 33.15 C ATOM 2438 CG GLU A 155 -24.991 22.867 25.500 1.00 1.12 C ATOM 2439 CD GLU A 155 -24.970 22.153 26.838 1.00 44.50 C ATOM 2440 OE1 GLU A 155 -25.963 21.469 27.161 1.00 53.15 O ATOM 2441 OE2 GLU A 155 -23.960 22.279 27.562 1.00 12.31 O ATOM 0 H GLU A 155 -26.422 24.611 23.006 1.00 35.55 H new ATOM 0 HA GLU A 155 -26.802 22.009 23.939 1.00 54.24 H new ATOM 0 HB2 GLU A 155 -26.053 24.656 25.002 1.00 33.15 H new ATOM 0 HB3 GLU A 155 -26.859 23.649 26.188 1.00 33.15 H new ATOM 0 HG2 GLU A 155 -24.847 22.139 24.702 1.00 1.12 H new ATOM 0 HG3 GLU A 155 -24.154 23.564 25.451 1.00 1.12 H new ATOM 2448 N HIS A 156 -29.106 24.027 25.186 1.00 73.54 N ATOM 2449 CA HIS A 156 -30.480 24.076 25.675 1.00 64.44 C ATOM 2450 C HIS A 156 -31.472 23.954 24.522 1.00 65.43 C ATOM 2451 O HIS A 156 -31.281 24.548 23.460 1.00 71.51 O ATOM 2452 CB HIS A 156 -30.725 25.377 26.438 1.00 12.24 C ATOM 2453 CG HIS A 156 -30.865 26.575 25.551 1.00 41.33 C ATOM 2454 ND1 HIS A 156 -32.026 26.877 24.871 1.00 61.14 N ATOM 2455 CD2 HIS A 156 -29.981 27.551 25.235 1.00 73.13 C ATOM 2456 CE1 HIS A 156 -31.850 27.985 24.173 1.00 1.03 C ATOM 2457 NE2 HIS A 156 -30.618 28.414 24.377 1.00 4.54 N ATOM 0 H HIS A 156 -28.581 24.892 25.314 1.00 73.54 H new ATOM 0 HA HIS A 156 -30.630 23.234 26.350 1.00 64.44 H new ATOM 0 HB2 HIS A 156 -31.629 25.272 27.038 1.00 12.24 H new ATOM 0 HB3 HIS A 156 -29.900 25.543 27.131 1.00 12.24 H new ATOM 0 HD2 HIS A 156 -28.965 27.635 25.591 1.00 73.13 H new ATOM 0 HE1 HIS A 156 -32.588 28.459 23.543 1.00 1.03 H new ATOM 0 HE2 HIS A 156 -30.206 29.251 23.964 1.00 4.54 H new ATOM 2465 N HIS A 157 -32.530 23.179 24.738 1.00 52.23 N ATOM 2466 CA HIS A 157 -33.552 22.979 23.716 1.00 11.23 C ATOM 2467 C HIS A 157 -34.734 22.195 24.277 1.00 35.30 C ATOM 2468 O HIS A 157 -34.838 21.988 25.487 1.00 50.14 O ATOM 2469 CB HIS A 157 -32.963 22.244 22.512 1.00 4.30 C ATOM 2470 CG HIS A 157 -32.576 20.827 22.805 1.00 14.23 C ATOM 2471 ND1 HIS A 157 -31.527 20.489 23.634 1.00 14.20 N ATOM 2472 CD2 HIS A 157 -33.107 19.658 22.376 1.00 1.24 C ATOM 2473 CE1 HIS A 157 -31.428 19.174 23.701 1.00 72.43 C ATOM 2474 NE2 HIS A 157 -32.375 18.646 22.947 1.00 75.52 N ATOM 0 H HIS A 157 -32.702 22.680 25.611 1.00 52.23 H new ATOM 0 HA HIS A 157 -33.907 23.959 23.396 1.00 11.23 H new ATOM 0 HB2 HIS A 157 -33.690 22.253 21.700 1.00 4.30 H new ATOM 0 HB3 HIS A 157 -32.085 22.786 22.160 1.00 4.30 H new ATOM 0 HD1 HIS A 157 -30.922 21.151 24.120 1.00 14.20 H new ATOM 0 HD2 HIS A 157 -33.949 19.543 21.709 1.00 1.24 H new ATOM 0 HE1 HIS A 157 -30.697 18.624 24.275 1.00 72.43 H new ATOM 2482 N HIS A 158 -35.625 21.761 23.390 1.00 25.53 N ATOM 2483 CA HIS A 158 -36.800 20.999 23.797 1.00 30.21 C ATOM 2484 C HIS A 158 -36.400 19.788 24.635 1.00 42.13 C ATOM 2485 O HIS A 158 -35.289 19.272 24.507 1.00 1.15 O ATOM 2486 CB HIS A 158 -37.590 20.545 22.569 1.00 10.31 C ATOM 2487 CG HIS A 158 -36.807 19.664 21.645 1.00 50.41 C ATOM 2488 ND1 HIS A 158 -36.520 18.345 21.926 1.00 52.23 N ATOM 2489 CD2 HIS A 158 -36.251 19.920 20.437 1.00 32.15 C ATOM 2490 CE1 HIS A 158 -35.820 17.828 20.932 1.00 73.11 C ATOM 2491 NE2 HIS A 158 -35.644 18.763 20.016 1.00 62.23 N ATOM 0 H HIS A 158 -35.555 21.924 22.386 1.00 25.53 H new ATOM 0 HA HIS A 158 -37.430 21.648 24.406 1.00 30.21 H new ATOM 0 HB2 HIS A 158 -38.482 20.011 22.898 1.00 10.31 H new ATOM 0 HB3 HIS A 158 -37.929 21.424 22.020 1.00 10.31 H new ATOM 0 HD1 HIS A 158 -36.804 17.846 22.769 1.00 52.23 H new ATOM 0 HD2 HIS A 158 -36.280 20.859 19.904 1.00 32.15 H new ATOM 0 HE1 HIS A 158 -35.454 16.813 20.878 1.00 73.11 H new ATOM 2499 N HIS A 159 -37.312 19.340 25.492 1.00 64.11 N ATOM 2500 CA HIS A 159 -37.053 18.190 26.351 1.00 72.21 C ATOM 2501 C HIS A 159 -36.576 16.995 25.530 1.00 11.25 C ATOM 2502 O HIS A 159 -37.085 16.735 24.440 1.00 41.24 O ATOM 2503 CB HIS A 159 -38.314 17.816 27.132 1.00 43.34 C ATOM 2504 CG HIS A 159 -38.460 18.559 28.424 1.00 52.53 C ATOM 2505 ND1 HIS A 159 -37.864 19.780 28.662 1.00 65.41 N ATOM 2506 CD2 HIS A 159 -39.142 18.249 29.551 1.00 53.40 C ATOM 2507 CE1 HIS A 159 -38.171 20.187 29.880 1.00 23.05 C ATOM 2508 NE2 HIS A 159 -38.946 19.277 30.441 1.00 32.51 N ATOM 0 H HIS A 159 -38.236 19.755 25.610 1.00 64.11 H new ATOM 0 HA HIS A 159 -36.266 18.463 27.054 1.00 72.21 H new ATOM 0 HB2 HIS A 159 -39.188 18.010 26.510 1.00 43.34 H new ATOM 0 HB3 HIS A 159 -38.300 16.746 27.337 1.00 43.34 H new ATOM 0 HD2 HIS A 159 -39.731 17.359 29.719 1.00 53.40 H new ATOM 0 HE1 HIS A 159 -37.844 21.108 30.339 1.00 23.05 H new ATOM 0 HE2 HIS A 159 -39.336 19.329 31.382 1.00 32.51 H new ATOM 2516 N HIS A 160 -35.596 16.272 26.062 1.00 45.00 N ATOM 2517 CA HIS A 160 -35.049 15.105 25.379 1.00 75.15 C ATOM 2518 C HIS A 160 -34.119 14.322 26.300 1.00 62.12 C ATOM 2519 O HIS A 160 -33.133 14.859 26.806 1.00 15.53 O ATOM 2520 CB HIS A 160 -34.297 15.531 24.118 1.00 55.45 C ATOM 2521 CG HIS A 160 -34.291 14.489 23.043 1.00 63.44 C ATOM 2522 ND1 HIS A 160 -33.146 13.841 22.630 1.00 65.14 N ATOM 2523 CD2 HIS A 160 -35.299 13.980 22.296 1.00 43.43 C ATOM 2524 CE1 HIS A 160 -33.449 12.981 21.674 1.00 72.31 C ATOM 2525 NE2 HIS A 160 -34.750 13.046 21.453 1.00 63.52 N ATOM 0 H HIS A 160 -35.164 16.474 26.964 1.00 45.00 H new ATOM 0 HA HIS A 160 -35.880 14.459 25.096 1.00 75.15 H new ATOM 0 HB2 HIS A 160 -34.748 16.443 23.726 1.00 55.45 H new ATOM 0 HB3 HIS A 160 -33.268 15.773 24.383 1.00 55.45 H new ATOM 0 HD2 HIS A 160 -36.341 14.257 22.353 1.00 43.43 H new ATOM 0 HE1 HIS A 160 -32.752 12.335 21.161 1.00 72.31 H new ATOM 0 HE2 HIS A 160 -35.263 12.492 20.767 1.00 63.52 H new ATOM 2533 N HIS A 161 -34.438 13.049 26.513 1.00 13.32 N ATOM 2534 CA HIS A 161 -33.631 12.192 27.374 1.00 43.41 C ATOM 2535 C HIS A 161 -32.190 12.125 26.876 1.00 72.13 C ATOM 2536 O HIS A 161 -31.962 11.672 25.755 1.00 25.12 O ATOM 2537 CB HIS A 161 -34.228 10.786 27.434 1.00 11.24 C ATOM 2538 CG HIS A 161 -35.645 10.758 27.918 1.00 74.11 C ATOM 2539 ND1 HIS A 161 -36.106 11.554 28.945 1.00 31.24 N ATOM 2540 CD2 HIS A 161 -36.706 10.025 27.507 1.00 33.42 C ATOM 2541 CE1 HIS A 161 -37.389 11.310 29.147 1.00 63.10 C ATOM 2542 NE2 HIS A 161 -37.777 10.386 28.287 1.00 54.02 N ATOM 0 H HIS A 161 -35.250 12.588 26.101 1.00 13.32 H new ATOM 0 HA HIS A 161 -33.631 12.621 28.376 1.00 43.41 H new ATOM 0 HB2 HIS A 161 -34.183 10.338 26.441 1.00 11.24 H new ATOM 0 HB3 HIS A 161 -33.616 10.168 28.091 1.00 11.24 H new ATOM 0 HD2 HIS A 161 -36.710 9.293 26.713 1.00 33.42 H new ATOM 0 HE1 HIS A 161 -38.014 11.785 29.889 1.00 63.10 H new ATOM 0 HE2 HIS A 161 -38.719 10.003 28.214 1.00 54.02 H new TER 2550 HIS A 161 ATOM 2551 N ASP B1001 -15.233 -4.302 23.619 1.00 71.24 N ATOM 2552 CA ASP B1001 -15.723 -5.595 24.083 1.00 4.01 C ATOM 2553 C ASP B1001 -14.628 -6.654 23.994 1.00 34.23 C ATOM 2554 O ASP B1001 -14.091 -7.092 25.012 1.00 63.25 O ATOM 2555 CB ASP B1001 -16.938 -6.029 23.262 1.00 22.10 C ATOM 2556 CG ASP B1001 -18.092 -5.053 23.376 1.00 34.44 C ATOM 2557 OD1 ASP B1001 -18.144 -4.310 24.379 1.00 51.45 O ATOM 2558 OD2 ASP B1001 -18.944 -5.033 22.463 1.00 2.33 O ATOM 0 HA ASP B1001 -16.019 -5.491 25.127 1.00 4.01 H new ATOM 0 HB2 ASP B1001 -16.650 -6.126 22.215 1.00 22.10 H new ATOM 0 HB3 ASP B1001 -17.265 -7.014 23.595 1.00 22.10 H new ATOM 2563 N ASP B1002 -14.305 -7.062 22.772 1.00 2.02 N ATOM 2564 CA ASP B1002 -13.275 -8.070 22.550 1.00 23.12 C ATOM 2565 C ASP B1002 -12.640 -7.904 21.173 1.00 61.40 C ATOM 2566 O ASP B1002 -12.224 -8.881 20.549 1.00 41.42 O ATOM 2567 CB ASP B1002 -13.867 -9.474 22.687 1.00 3.32 C ATOM 2568 CG ASP B1002 -14.622 -9.659 23.989 1.00 62.14 C ATOM 2569 OD1 ASP B1002 -13.971 -9.939 25.018 1.00 75.03 O ATOM 2570 OD2 ASP B1002 -15.863 -9.523 23.978 1.00 21.44 O ATOM 0 H ASP B1002 -14.742 -6.710 21.920 1.00 2.02 H new ATOM 0 HA ASP B1002 -12.501 -7.936 23.306 1.00 23.12 H new ATOM 0 HB2 ASP B1002 -14.539 -9.665 21.850 1.00 3.32 H new ATOM 0 HB3 ASP B1002 -13.066 -10.211 22.627 1.00 3.32 H new ATOM 2575 N ASP B1003 -12.570 -6.663 20.705 1.00 72.11 N ATOM 2576 CA ASP B1003 -11.986 -6.369 19.401 1.00 34.23 C ATOM 2577 C ASP B1003 -11.011 -5.200 19.494 1.00 51.11 C ATOM 2578 O ASP B1003 -10.801 -4.477 18.521 1.00 40.32 O ATOM 2579 CB ASP B1003 -13.086 -6.053 18.386 1.00 63.41 C ATOM 2580 CG ASP B1003 -12.564 -6.011 16.963 1.00 55.31 C ATOM 2581 OD1 ASP B1003 -11.570 -6.708 16.674 1.00 64.42 O ATOM 2582 OD2 ASP B1003 -13.152 -5.280 16.138 1.00 21.21 O ATOM 0 H ASP B1003 -12.910 -5.844 21.209 1.00 72.11 H new ATOM 0 HA ASP B1003 -11.438 -7.250 19.068 1.00 34.23 H new ATOM 0 HB2 ASP B1003 -13.872 -6.805 18.460 1.00 63.41 H new ATOM 0 HB3 ASP B1003 -13.539 -5.093 18.632 1.00 63.41 H new ATOM 2587 N GLU B1004 -10.420 -5.021 20.671 1.00 44.21 N ATOM 2588 CA GLU B1004 -9.468 -3.938 20.890 1.00 12.31 C ATOM 2589 C GLU B1004 -10.065 -2.597 20.472 1.00 3.31 C ATOM 2590 O GLU B1004 -9.358 -1.719 19.976 1.00 14.32 O ATOM 2591 CB GLU B1004 -8.177 -4.198 20.112 1.00 24.53 C ATOM 2592 CG GLU B1004 -6.953 -3.539 20.726 1.00 61.21 C ATOM 2593 CD GLU B1004 -5.984 -3.021 19.681 1.00 2.01 C ATOM 2594 OE1 GLU B1004 -6.381 -2.144 18.886 1.00 61.34 O ATOM 2595 OE2 GLU B1004 -4.828 -3.493 19.660 1.00 45.34 O ATOM 0 H GLU B1004 -10.583 -5.611 21.487 1.00 44.21 H new ATOM 0 HA GLU B1004 -9.240 -3.899 21.955 1.00 12.31 H new ATOM 0 HB2 GLU B1004 -8.009 -5.273 20.053 1.00 24.53 H new ATOM 0 HB3 GLU B1004 -8.299 -3.838 19.091 1.00 24.53 H new ATOM 0 HG2 GLU B1004 -7.270 -2.713 21.363 1.00 61.21 H new ATOM 0 HG3 GLU B1004 -6.441 -4.257 21.367 1.00 61.21 H new ATOM 2602 N ASP B1005 -11.369 -2.447 20.676 1.00 62.15 N ATOM 2603 CA ASP B1005 -12.061 -1.214 20.321 1.00 54.33 C ATOM 2604 C ASP B1005 -11.486 -0.027 21.088 1.00 61.32 C ATOM 2605 O ASP B1005 -10.503 -0.163 21.815 1.00 31.22 O ATOM 2606 CB ASP B1005 -13.558 -1.344 20.606 1.00 13.05 C ATOM 2607 CG ASP B1005 -14.409 -1.018 19.395 1.00 15.41 C ATOM 2608 OD1 ASP B1005 -13.988 -1.349 18.268 1.00 44.45 O ATOM 2609 OD2 ASP B1005 -15.497 -0.430 19.575 1.00 72.44 O ATOM 0 H ASP B1005 -11.968 -3.164 21.085 1.00 62.15 H new ATOM 0 HA ASP B1005 -11.916 -1.039 19.255 1.00 54.33 H new ATOM 0 HB2 ASP B1005 -13.775 -2.360 20.936 1.00 13.05 H new ATOM 0 HB3 ASP B1005 -13.828 -0.678 21.426 1.00 13.05 H new ATOM 2614 N GLY B1006 -12.105 1.137 20.919 1.00 52.13 N ATOM 2615 CA GLY B1006 -11.640 2.331 21.600 1.00 24.33 C ATOM 2616 C GLY B1006 -10.578 3.071 20.812 1.00 5.43 C ATOM 2617 O GLY B1006 -9.788 2.459 20.094 1.00 65.33 O ATOM 0 H GLY B1006 -12.921 1.275 20.322 1.00 52.13 H new ATOM 0 HA2 GLY B1006 -12.485 2.996 21.779 1.00 24.33 H new ATOM 0 HA3 GLY B1006 -11.239 2.056 22.576 1.00 24.33 H new ATOM 2621 N TYR B1007 -10.559 4.393 20.945 1.00 23.12 N ATOM 2622 CA TYR B1007 -9.588 5.219 20.236 1.00 32.44 C ATOM 2623 C TYR B1007 -9.684 6.675 20.681 1.00 73.04 C ATOM 2624 O TYR B1007 -10.690 7.342 20.445 1.00 54.35 O ATOM 2625 CB TYR B1007 -9.809 5.119 18.726 1.00 22.11 C ATOM 2626 CG TYR B1007 -9.072 6.176 17.935 1.00 2.13 C ATOM 2627 CD1 TYR B1007 -7.694 6.113 17.770 1.00 42.43 C ATOM 2628 CD2 TYR B1007 -9.754 7.237 17.353 1.00 50.31 C ATOM 2629 CE1 TYR B1007 -7.016 7.078 17.049 1.00 75.43 C ATOM 2630 CE2 TYR B1007 -9.085 8.205 16.629 1.00 51.30 C ATOM 2631 CZ TYR B1007 -7.716 8.121 16.480 1.00 14.32 C ATOM 2632 OH TYR B1007 -7.045 9.083 15.760 1.00 15.00 O ATOM 0 H TYR B1007 -11.205 4.915 21.537 1.00 23.12 H new ATOM 0 HA TYR B1007 -8.591 4.850 20.475 1.00 32.44 H new ATOM 0 HB2 TYR B1007 -9.490 4.134 18.385 1.00 22.11 H new ATOM 0 HB3 TYR B1007 -10.876 5.199 18.517 1.00 22.11 H new ATOM 0 HD1 TYR B1007 -7.143 5.296 18.213 1.00 42.43 H new ATOM 0 HD2 TYR B1007 -10.826 7.306 17.468 1.00 50.31 H new ATOM 0 HE1 TYR B1007 -5.944 7.015 16.932 1.00 75.43 H new ATOM 0 HE2 TYR B1007 -9.631 9.023 16.182 1.00 51.30 H new ATOM 0 HH TYR B1007 -7.484 9.950 15.885 1.00 15.00 H new ATOM 2642 N ASN B1008 -8.629 7.161 21.325 1.00 5.03 N ATOM 2643 CA ASN B1008 -8.592 8.538 21.803 1.00 13.43 C ATOM 2644 C ASN B1008 -7.875 9.442 20.805 1.00 24.11 C ATOM 2645 O ASN B1008 -6.833 9.091 20.250 1.00 51.31 O ATOM 2646 CB ASN B1008 -7.897 8.610 23.164 1.00 31.33 C ATOM 2647 CG ASN B1008 -8.397 9.766 24.009 1.00 44.02 C ATOM 2648 OD1 ASN B1008 -7.966 10.906 23.837 1.00 43.41 O ATOM 2649 ND2 ASN B1008 -9.310 9.476 24.928 1.00 73.12 N ATOM 0 H ASN B1008 -7.788 6.622 21.528 1.00 5.03 H new ATOM 0 HA ASN B1008 -9.619 8.886 21.909 1.00 13.43 H new ATOM 0 HB2 ASN B1008 -8.058 7.675 23.701 1.00 31.33 H new ATOM 0 HB3 ASN B1008 -6.822 8.711 23.015 1.00 31.33 H new ATOM 0 HD21 ASN B1008 -9.683 10.213 25.527 1.00 73.12 H new ATOM 0 HD22 ASN B1008 -9.639 8.516 25.035 1.00 73.12 H new ATOM 2656 N PRO B1009 -8.443 10.634 20.571 1.00 32.00 N ATOM 2657 CA PRO B1009 -7.874 11.613 19.640 1.00 13.22 C ATOM 2658 C PRO B1009 -6.578 12.224 20.162 1.00 72.11 C ATOM 2659 O PRO B1009 -5.829 12.849 19.411 1.00 1.21 O ATOM 2660 CB PRO B1009 -8.966 12.681 19.538 1.00 2.53 C ATOM 2661 CG PRO B1009 -9.723 12.572 20.816 1.00 14.14 C ATOM 2662 CD PRO B1009 -9.685 11.118 21.197 1.00 22.05 C ATOM 0 HA PRO B1009 -7.610 11.161 18.684 1.00 13.22 H new ATOM 0 HB2 PRO B1009 -8.537 13.675 19.416 1.00 2.53 H new ATOM 0 HB3 PRO B1009 -9.613 12.505 18.678 1.00 2.53 H new ATOM 0 HG2 PRO B1009 -9.271 13.191 21.591 1.00 14.14 H new ATOM 0 HG3 PRO B1009 -10.750 12.916 20.692 1.00 14.14 H new ATOM 0 HD2 PRO B1009 -9.668 10.986 22.279 1.00 22.05 H new ATOM 0 HD3 PRO B1009 -10.558 10.582 20.825 1.00 22.05 H new ATOM 2670 N TYR B1010 -6.320 12.039 21.452 1.00 64.35 N ATOM 2671 CA TYR B1010 -5.114 12.573 22.074 1.00 53.41 C ATOM 2672 C TYR B1010 -3.915 11.671 21.803 1.00 64.25 C ATOM 2673 O TYR B1010 -2.804 11.938 22.262 1.00 43.31 O ATOM 2674 CB TYR B1010 -5.319 12.728 23.582 1.00 53.32 C ATOM 2675 CG TYR B1010 -4.868 14.067 24.120 1.00 52.42 C ATOM 2676 CD1 TYR B1010 -3.679 14.645 23.692 1.00 52.25 C ATOM 2677 CD2 TYR B1010 -5.630 14.754 25.057 1.00 41.31 C ATOM 2678 CE1 TYR B1010 -3.262 15.868 24.181 1.00 55.13 C ATOM 2679 CE2 TYR B1010 -5.222 15.978 25.550 1.00 3.34 C ATOM 2680 CZ TYR B1010 -4.037 16.531 25.110 1.00 74.15 C ATOM 2681 OH TYR B1010 -3.627 17.749 25.600 1.00 44.31 O ATOM 0 H TYR B1010 -6.929 11.524 22.087 1.00 64.35 H new ATOM 0 HA TYR B1010 -4.914 13.552 21.638 1.00 53.41 H new ATOM 0 HB2 TYR B1010 -6.375 12.590 23.813 1.00 53.32 H new ATOM 0 HB3 TYR B1010 -4.775 11.937 24.097 1.00 53.32 H new ATOM 0 HD1 TYR B1010 -3.070 14.129 22.964 1.00 52.25 H new ATOM 0 HD2 TYR B1010 -6.557 14.324 25.406 1.00 41.31 H new ATOM 0 HE1 TYR B1010 -2.335 16.303 23.838 1.00 55.13 H new ATOM 0 HE2 TYR B1010 -5.828 16.500 26.276 1.00 3.34 H new ATOM 0 HH TYR B1010 -4.287 18.081 26.244 1.00 44.31 H new ATOM 2691 N THR B1011 -4.147 10.599 21.051 1.00 22.33 N ATOM 2692 CA THR B1011 -3.087 9.655 20.718 1.00 54.11 C ATOM 2693 C THR B1011 -2.926 9.521 19.208 1.00 5.11 C ATOM 2694 O THR B1011 -3.817 9.891 18.442 1.00 3.35 O ATOM 2695 CB THR B1011 -3.365 8.264 21.318 1.00 24.14 C ATOM 2696 OG1 THR B1011 -4.263 7.536 20.474 1.00 65.35 O ATOM 2697 CG2 THR B1011 -3.959 8.385 22.713 1.00 10.45 C ATOM 0 H THR B1011 -5.060 10.363 20.661 1.00 22.33 H new ATOM 0 HA THR B1011 -2.166 10.050 21.146 1.00 54.11 H new ATOM 0 HB THR B1011 -2.418 7.728 21.388 1.00 24.14 H new ATOM 0 HG1 THR B1011 -5.100 8.036 20.379 1.00 65.35 H new ATOM 0 HG21 THR B1011 -4.147 7.390 23.116 1.00 10.45 H new ATOM 0 HG22 THR B1011 -3.260 8.913 23.361 1.00 10.45 H new ATOM 0 HG23 THR B1011 -4.896 8.939 22.662 1.00 10.45 H new ATOM 2705 N LEU B1012 -1.784 8.989 18.785 1.00 0.51 N ATOM 2706 CA LEU B1012 -1.505 8.806 17.365 1.00 74.40 C ATOM 2707 C LEU B1012 -1.571 10.135 16.621 1.00 53.34 C ATOM 2708 O LEU B1012 -0.592 10.880 16.571 1.00 73.44 O ATOM 2709 CB LEU B1012 -2.499 7.816 16.754 1.00 14.31 C ATOM 2710 CG LEU B1012 -2.705 7.918 15.242 1.00 5.22 C ATOM 2711 CD1 LEU B1012 -1.373 7.816 14.515 1.00 41.42 C ATOM 2712 CD2 LEU B1012 -3.662 6.838 14.760 1.00 42.01 C ATOM 0 H LEU B1012 -1.037 8.677 19.405 1.00 0.51 H new ATOM 0 HA LEU B1012 -0.496 8.406 17.267 1.00 74.40 H new ATOM 0 HB2 LEU B1012 -2.164 6.805 16.987 1.00 14.31 H new ATOM 0 HB3 LEU B1012 -3.464 7.953 17.242 1.00 14.31 H new ATOM 0 HG LEU B1012 -3.145 8.890 15.019 1.00 5.22 H new ATOM 0 HD11 LEU B1012 -1.538 7.890 13.440 1.00 41.42 H new ATOM 0 HD12 LEU B1012 -0.719 8.626 14.838 1.00 41.42 H new ATOM 0 HD13 LEU B1012 -0.906 6.858 14.745 1.00 41.42 H new ATOM 0 HD21 LEU B1012 -3.797 6.926 13.682 1.00 42.01 H new ATOM 0 HD22 LEU B1012 -3.251 5.856 14.995 1.00 42.01 H new ATOM 0 HD23 LEU B1012 -4.625 6.957 15.257 1.00 42.01 H new TER 2724 LEU B1012