USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1035 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 57 CYS SG : rot 8:sc= 1 USER MOD Set 1.2: A 68 CYS SG : rot -90:sc= 0.41 USER MOD Set 2.1: A 46 LYS NZ :NH3+ -167:sc= 2.47 (180deg=2.02) USER MOD Set 2.2: B 117 ASN : amide:sc= 0.496 K(o=3,f=-8.5!) USER MOD Set 3.1: A 30 GLN : amide:sc= 0.331 K(o=0.5,f=-0.32) USER MOD Set 3.2: A 36 SER OG : rot 115:sc= 0.172 USER MOD Single : A 5 SER OG : rot 21:sc= 0.637 USER MOD Single : A 8 CYS SG : rot 0:sc= 0.197 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 SER OG : rot -70:sc= 0.666 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 TYR OH : rot 30:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 THR OG1 : rot 110:sc= -0.75 USER MOD Single : A 24 MET CE :methyl 156:sc= -0.111 (180deg=-0.639) USER MOD Single : A 25 SER OG : rot -66:sc= 1.4 USER MOD Single : A 29 CYS SG : rot -126:sc= -0.936! USER MOD Single : A 34 SER OG : rot -170:sc= -2.68! USER MOD Single : A 35 GLN :FLIP amide:sc= -0.397 F(o=-0.96,f=-0.4) USER MOD Single : A 38 HIS : no HD1:sc= -0.516 X(o=-0.52,f=-0.38) USER MOD Single : A 40 HIS : no HD1:sc= 0.702 K(o=0.7,f=-4.7!) USER MOD Single : A 42 TYR OH : rot 90:sc= -1.75 USER MOD Single : A 45 SER OG : rot 180:sc= 0.0256 USER MOD Single : A 49 ASN : amide:sc= 0.21 K(o=0.21,f=-4.5!) USER MOD Single : A 50 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.07) USER MOD Single : A 51 ASN : amide:sc=-0.00797 K(o=-0.008,f=-1.2) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= 0.0743 K(o=0.074,f=-4.3!) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 59 ASN : amide:sc= 0.0597 K(o=0.06,f=-8.8!) USER MOD Single : A 70 THR OG1 : rot 74:sc= -0.138 USER MOD Single : A 71 THR OG1 : rot 140:sc= -0.376 USER MOD Single : A 74 ASN : amide:sc= -0.064 K(o=-0.064,f=-2.4) USER MOD Single : A 75 LYS NZ :NH3+ 160:sc= 1.27 (180deg=0.963) USER MOD Single : A 79 TYR OH : rot -85:sc= 0.014 USER MOD Single : A 80 CYS SG : rot 113:sc= 0.502 USER MOD Single : A 85 CYS SG : rot 67:sc= -0.354 USER MOD Single : B 102 SER OG : rot 180:sc= 0.0788 USER MOD Single : B 105 LYS NZ :NH3+ -168:sc= 2.29 (180deg=2.2) USER MOD Single : B 107 THR OG1 : rot -67:sc= 1.26 USER MOD Single : B 113 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.19) USER MOD Single : B 116 LYS NZ :NH3+ 166:sc= 1.29 (180deg=1.16) USER MOD Single : B 129 LYS NZ :NH3+ -145:sc= 2.4 (180deg=1.63) USER MOD Single : B 130 SER OG : rot -21:sc= 1.23 USER MOD Single : B 133 HIS : no HD1:sc= -0.29 K(o=-0.29,f=-0.94) USER MOD Single : B 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 137 LYS NZ :NH3+ -153:sc= 1.23 (180deg=1.23) USER MOD Single : B 138 LYS NZ :NH3+ -125:sc= -0.0557 (180deg=-0.361) USER MOD Single : B 143 LYS NZ :NH3+ -165:sc= 3.4 (180deg=3.11) USER MOD Single : B 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 152 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N SER A 5 -24.915 7.590 -5.062 1.00 15.00 N ATOM 76 CA SER A 5 -24.679 6.177 -4.810 1.00 15.00 C ATOM 77 C SER A 5 -24.994 5.844 -3.352 1.00 15.00 C ATOM 78 O SER A 5 -24.747 6.656 -2.457 1.00 15.00 O ATOM 79 CB SER A 5 -23.226 5.816 -5.135 1.00 15.00 C ATOM 80 OG SER A 5 -22.674 6.705 -6.097 1.00 15.00 O ATOM 0 HA SER A 5 -25.335 5.591 -5.453 1.00 15.00 H new ATOM 0 HB2 SER A 5 -22.629 5.847 -4.224 1.00 15.00 H new ATOM 0 HB3 SER A 5 -23.179 4.794 -5.512 1.00 15.00 H new ATOM 0 HG SER A 5 -23.190 7.538 -6.107 1.00 15.00 H new ATOM 86 N GLU A 6 -25.541 4.659 -3.114 1.00 15.00 N ATOM 87 CA GLU A 6 -25.886 4.238 -1.759 1.00 15.00 C ATOM 88 C GLU A 6 -25.591 2.754 -1.569 1.00 15.00 C ATOM 89 O GLU A 6 -26.207 1.903 -2.213 1.00 15.00 O ATOM 90 CB GLU A 6 -27.364 4.530 -1.464 1.00 15.00 C ATOM 91 CG GLU A 6 -27.765 4.263 -0.020 1.00 15.00 C ATOM 92 CD GLU A 6 -26.820 4.908 0.969 1.00 15.00 C ATOM 93 OE1 GLU A 6 -25.971 4.190 1.538 1.00 15.00 O ATOM 94 OE2 GLU A 6 -26.910 6.135 1.166 1.00 15.00 O1- ATOM 0 H GLU A 6 -25.755 3.973 -3.838 1.00 15.00 H new ATOM 0 HA GLU A 6 -25.274 4.806 -1.058 1.00 15.00 H new ATOM 0 HB2 GLU A 6 -27.574 5.573 -1.703 1.00 15.00 H new ATOM 0 HB3 GLU A 6 -27.984 3.921 -2.122 1.00 15.00 H new ATOM 0 HG2 GLU A 6 -28.775 4.637 0.149 1.00 15.00 H new ATOM 0 HG3 GLU A 6 -27.790 3.187 0.154 1.00 15.00 H new ATOM 101 N GLU A 7 -24.650 2.458 -0.680 1.00 15.00 N ATOM 102 CA GLU A 7 -24.245 1.087 -0.395 1.00 15.00 C ATOM 103 C GLU A 7 -23.458 1.036 0.912 1.00 15.00 C ATOM 104 O GLU A 7 -23.090 2.076 1.463 1.00 15.00 O ATOM 105 CB GLU A 7 -23.402 0.532 -1.548 1.00 15.00 C ATOM 106 CG GLU A 7 -22.291 1.473 -1.990 1.00 15.00 C ATOM 107 CD GLU A 7 -21.872 1.247 -3.425 1.00 15.00 C ATOM 108 OE1 GLU A 7 -20.709 0.852 -3.657 1.00 15.00 O ATOM 109 OE2 GLU A 7 -22.704 1.469 -4.334 1.00 15.00 O1- ATOM 0 H GLU A 7 -24.147 3.160 -0.137 1.00 15.00 H new ATOM 0 HA GLU A 7 -25.137 0.470 -0.291 1.00 15.00 H new ATOM 0 HB2 GLU A 7 -22.964 -0.418 -1.243 1.00 15.00 H new ATOM 0 HB3 GLU A 7 -24.053 0.325 -2.398 1.00 15.00 H new ATOM 0 HG2 GLU A 7 -22.625 2.504 -1.871 1.00 15.00 H new ATOM 0 HG3 GLU A 7 -21.427 1.340 -1.338 1.00 15.00 H new ATOM 116 N CYS A 8 -23.218 -0.170 1.413 1.00 15.00 N ATOM 117 CA CYS A 8 -22.476 -0.360 2.657 1.00 15.00 C ATOM 118 C CYS A 8 -21.638 -1.637 2.594 1.00 15.00 C ATOM 119 O CYS A 8 -22.052 -2.627 1.991 1.00 15.00 O ATOM 120 CB CYS A 8 -23.433 -0.434 3.853 1.00 15.00 C ATOM 121 SG CYS A 8 -24.405 1.066 4.125 1.00 15.00 S ATOM 0 H CYS A 8 -23.528 -1.037 0.975 1.00 15.00 H new ATOM 0 HA CYS A 8 -21.813 0.496 2.785 1.00 15.00 H new ATOM 0 HB2 CYS A 8 -24.114 -1.272 3.707 1.00 15.00 H new ATOM 0 HB3 CYS A 8 -22.855 -0.646 4.753 1.00 15.00 H new ATOM 0 HG CYS A 8 -24.099 1.951 3.223 1.00 15.00 H new ATOM 127 N MET A 9 -20.454 -1.605 3.194 1.00 15.00 N ATOM 128 CA MET A 9 -19.567 -2.766 3.218 1.00 15.00 C ATOM 129 C MET A 9 -19.381 -3.268 4.648 1.00 15.00 C ATOM 130 O MET A 9 -19.729 -2.570 5.606 1.00 15.00 O ATOM 131 CB MET A 9 -18.210 -2.421 2.597 1.00 15.00 C ATOM 132 CG MET A 9 -18.270 -2.222 1.094 1.00 15.00 C ATOM 133 SD MET A 9 -18.753 -3.719 0.208 1.00 15.00 S ATOM 134 CE MET A 9 -19.382 -3.013 -1.316 1.00 15.00 C ATOM 0 H MET A 9 -20.083 -0.784 3.673 1.00 15.00 H new ATOM 0 HA MET A 9 -20.027 -3.559 2.628 1.00 15.00 H new ATOM 0 HB2 MET A 9 -17.826 -1.513 3.062 1.00 15.00 H new ATOM 0 HB3 MET A 9 -17.502 -3.218 2.823 1.00 15.00 H new ATOM 0 HG2 MET A 9 -18.978 -1.426 0.866 1.00 15.00 H new ATOM 0 HG3 MET A 9 -17.294 -1.893 0.737 1.00 15.00 H new ATOM 0 HE1 MET A 9 -19.722 -3.813 -1.974 1.00 15.00 H new ATOM 0 HE2 MET A 9 -20.216 -2.348 -1.092 1.00 15.00 H new ATOM 0 HE3 MET A 9 -18.591 -2.448 -1.809 1.00 15.00 H new ATOM 144 N HIS A 10 -18.839 -4.471 4.794 1.00 15.00 N ATOM 145 CA HIS A 10 -18.628 -5.062 6.113 1.00 15.00 C ATOM 146 C HIS A 10 -17.353 -4.523 6.762 1.00 15.00 C ATOM 147 O HIS A 10 -16.260 -5.037 6.525 1.00 15.00 O ATOM 148 CB HIS A 10 -18.565 -6.594 5.995 1.00 15.00 C ATOM 149 CG HIS A 10 -18.215 -7.312 7.270 1.00 15.00 C ATOM 150 ND1 HIS A 10 -19.066 -7.325 8.352 1.00 15.00 N ATOM 151 CD2 HIS A 10 -17.110 -8.039 7.570 1.00 15.00 C ATOM 152 CE1 HIS A 10 -18.463 -8.054 9.278 1.00 15.00 C ATOM 153 NE2 HIS A 10 -17.279 -8.502 8.847 1.00 15.00 N ATOM 0 H HIS A 10 -18.537 -5.058 4.016 1.00 15.00 H new ATOM 0 HA HIS A 10 -19.468 -4.787 6.751 1.00 15.00 H new ATOM 0 HB2 HIS A 10 -19.531 -6.957 5.644 1.00 15.00 H new ATOM 0 HB3 HIS A 10 -17.830 -6.856 5.234 1.00 15.00 H new ATOM 0 HD2 HIS A 10 -16.261 -8.218 6.926 1.00 15.00 H new ATOM 0 HE1 HIS A 10 -18.874 -8.260 10.255 1.00 15.00 H new ATOM 0 HE2 HIS A 10 -16.624 -9.081 9.372 1.00 15.00 H new ATOM 161 N GLY A 11 -17.524 -3.502 7.596 1.00 15.00 N ATOM 162 CA GLY A 11 -16.413 -2.890 8.309 1.00 15.00 C ATOM 163 C GLY A 11 -15.214 -2.576 7.434 1.00 15.00 C ATOM 164 O GLY A 11 -15.261 -1.669 6.601 1.00 15.00 O ATOM 0 H GLY A 11 -18.431 -3.079 7.794 1.00 15.00 H new ATOM 0 HA2 GLY A 11 -16.759 -1.968 8.777 1.00 15.00 H new ATOM 0 HA3 GLY A 11 -16.099 -3.557 9.112 1.00 15.00 H new ATOM 168 N SER A 12 -14.140 -3.330 7.633 1.00 15.00 N ATOM 169 CA SER A 12 -12.911 -3.146 6.878 1.00 15.00 C ATOM 170 C SER A 12 -13.074 -3.612 5.435 1.00 15.00 C ATOM 171 O SER A 12 -12.502 -3.029 4.517 1.00 15.00 O ATOM 172 CB SER A 12 -11.783 -3.919 7.561 1.00 15.00 C ATOM 173 OG SER A 12 -11.689 -3.559 8.931 1.00 15.00 O ATOM 0 H SER A 12 -14.098 -4.083 8.320 1.00 15.00 H new ATOM 0 HA SER A 12 -12.668 -2.084 6.855 1.00 15.00 H new ATOM 0 HB2 SER A 12 -11.963 -4.990 7.472 1.00 15.00 H new ATOM 0 HB3 SER A 12 -10.838 -3.712 7.059 1.00 15.00 H new ATOM 0 HG SER A 12 -11.354 -2.641 9.006 1.00 15.00 H new ATOM 179 N GLY A 13 -13.875 -4.647 5.239 1.00 15.00 N ATOM 180 CA GLY A 13 -14.087 -5.170 3.909 1.00 15.00 C ATOM 181 C GLY A 13 -12.856 -5.866 3.370 1.00 15.00 C ATOM 182 O GLY A 13 -12.291 -5.454 2.361 1.00 15.00 O ATOM 0 H GLY A 13 -14.382 -5.134 5.978 1.00 15.00 H new ATOM 0 HA2 GLY A 13 -14.922 -5.870 3.924 1.00 15.00 H new ATOM 0 HA3 GLY A 13 -14.365 -4.356 3.240 1.00 15.00 H new ATOM 186 N GLU A 14 -12.434 -6.920 4.052 1.00 15.00 N ATOM 187 CA GLU A 14 -11.261 -7.677 3.636 1.00 15.00 C ATOM 188 C GLU A 14 -11.503 -8.325 2.276 1.00 15.00 C ATOM 189 O GLU A 14 -10.587 -8.479 1.466 1.00 15.00 O ATOM 190 CB GLU A 14 -10.947 -8.754 4.673 1.00 15.00 C ATOM 191 CG GLU A 14 -9.669 -9.528 4.385 1.00 15.00 C ATOM 192 CD GLU A 14 -9.778 -11.000 4.743 1.00 15.00 C ATOM 193 OE1 GLU A 14 -9.552 -11.849 3.857 1.00 15.00 O ATOM 194 OE2 GLU A 14 -10.087 -11.314 5.912 1.00 15.00 O1- ATOM 0 H GLU A 14 -12.886 -7.271 4.896 1.00 15.00 H new ATOM 0 HA GLU A 14 -10.414 -6.996 3.554 1.00 15.00 H new ATOM 0 HB2 GLU A 14 -10.865 -8.287 5.655 1.00 15.00 H new ATOM 0 HB3 GLU A 14 -11.782 -9.453 4.721 1.00 15.00 H new ATOM 0 HG2 GLU A 14 -9.423 -9.433 3.327 1.00 15.00 H new ATOM 0 HG3 GLU A 14 -8.846 -9.083 4.945 1.00 15.00 H new ATOM 201 N ASN A 15 -12.754 -8.675 2.032 1.00 15.00 N ATOM 202 CA ASN A 15 -13.150 -9.319 0.789 1.00 15.00 C ATOM 203 C ASN A 15 -13.681 -8.300 -0.209 1.00 15.00 C ATOM 204 O ASN A 15 -14.530 -8.617 -1.043 1.00 15.00 O ATOM 205 CB ASN A 15 -14.211 -10.385 1.064 1.00 15.00 C ATOM 206 CG ASN A 15 -13.637 -11.601 1.762 1.00 15.00 C ATOM 207 OD1 ASN A 15 -13.125 -12.511 1.117 1.00 15.00 O ATOM 208 ND2 ASN A 15 -13.719 -11.629 3.083 1.00 15.00 N ATOM 0 H ASN A 15 -13.522 -8.522 2.686 1.00 15.00 H new ATOM 0 HA ASN A 15 -12.269 -9.793 0.356 1.00 15.00 H new ATOM 0 HB2 ASN A 15 -15.003 -9.956 1.678 1.00 15.00 H new ATOM 0 HB3 ASN A 15 -14.668 -10.691 0.123 1.00 15.00 H new ATOM 0 HD21 ASN A 15 -13.349 -12.427 3.600 1.00 15.00 H new ATOM 0 HD22 ASN A 15 -14.152 -10.853 3.584 1.00 15.00 H new ATOM 215 N TYR A 16 -13.201 -7.068 -0.107 1.00 15.00 N ATOM 216 CA TYR A 16 -13.628 -6.007 -1.007 1.00 15.00 C ATOM 217 C TYR A 16 -13.147 -6.282 -2.430 1.00 15.00 C ATOM 218 O TYR A 16 -11.956 -6.187 -2.725 1.00 15.00 O ATOM 219 CB TYR A 16 -13.092 -4.655 -0.526 1.00 15.00 C ATOM 220 CG TYR A 16 -13.600 -3.474 -1.324 1.00 15.00 C ATOM 221 CD1 TYR A 16 -14.944 -3.125 -1.303 1.00 15.00 C ATOM 222 CD2 TYR A 16 -12.735 -2.708 -2.096 1.00 15.00 C ATOM 223 CE1 TYR A 16 -15.413 -2.048 -2.030 1.00 15.00 C ATOM 224 CE2 TYR A 16 -13.197 -1.627 -2.824 1.00 15.00 C ATOM 225 CZ TYR A 16 -14.537 -1.302 -2.787 1.00 15.00 C ATOM 226 OH TYR A 16 -15.005 -0.227 -3.509 1.00 15.00 O ATOM 0 H TYR A 16 -12.515 -6.779 0.591 1.00 15.00 H new ATOM 0 HA TYR A 16 -14.718 -5.977 -1.008 1.00 15.00 H new ATOM 0 HB2 TYR A 16 -13.365 -4.518 0.520 1.00 15.00 H new ATOM 0 HB3 TYR A 16 -12.003 -4.670 -0.571 1.00 15.00 H new ATOM 0 HD1 TYR A 16 -15.634 -3.705 -0.708 1.00 15.00 H new ATOM 0 HD2 TYR A 16 -11.686 -2.961 -2.128 1.00 15.00 H new ATOM 0 HE1 TYR A 16 -16.462 -1.792 -2.005 1.00 15.00 H new ATOM 0 HE2 TYR A 16 -12.512 -1.040 -3.418 1.00 15.00 H new ATOM 0 HH TYR A 16 -15.780 0.161 -3.052 1.00 15.00 H new ATOM 236 N ASP A 17 -14.081 -6.619 -3.311 1.00 15.00 N ATOM 237 CA ASP A 17 -13.753 -6.911 -4.700 1.00 15.00 C ATOM 238 C ASP A 17 -14.327 -5.836 -5.611 1.00 15.00 C ATOM 239 O ASP A 17 -14.434 -6.016 -6.826 1.00 15.00 O ATOM 240 CB ASP A 17 -14.296 -8.282 -5.107 1.00 15.00 C ATOM 241 CG ASP A 17 -13.381 -9.015 -6.073 1.00 15.00 C ATOM 242 OD1 ASP A 17 -13.315 -10.262 -6.001 1.00 15.00 O ATOM 243 OD2 ASP A 17 -12.721 -8.360 -6.907 1.00 15.00 O1- ATOM 0 H ASP A 17 -15.073 -6.697 -3.087 1.00 15.00 H new ATOM 0 HA ASP A 17 -12.668 -6.923 -4.801 1.00 15.00 H new ATOM 0 HB2 ASP A 17 -14.437 -8.891 -4.214 1.00 15.00 H new ATOM 0 HB3 ASP A 17 -15.277 -8.157 -5.566 1.00 15.00 H new ATOM 248 N GLY A 18 -14.695 -4.713 -5.012 1.00 15.00 N ATOM 249 CA GLY A 18 -15.253 -3.614 -5.773 1.00 15.00 C ATOM 250 C GLY A 18 -14.240 -3.023 -6.731 1.00 15.00 C ATOM 251 O GLY A 18 -13.041 -2.983 -6.433 1.00 15.00 O ATOM 0 H GLY A 18 -14.617 -4.543 -4.009 1.00 15.00 H new ATOM 0 HA2 GLY A 18 -16.122 -3.963 -6.332 1.00 15.00 H new ATOM 0 HA3 GLY A 18 -15.603 -2.840 -5.090 1.00 15.00 H new ATOM 255 N LYS A 19 -14.715 -2.575 -7.884 1.00 15.00 N ATOM 256 CA LYS A 19 -13.844 -1.989 -8.890 1.00 15.00 C ATOM 257 C LYS A 19 -13.592 -0.519 -8.586 1.00 15.00 C ATOM 258 O LYS A 19 -14.471 0.325 -8.763 1.00 15.00 O ATOM 259 CB LYS A 19 -14.454 -2.134 -10.287 1.00 15.00 C ATOM 260 CG LYS A 19 -14.773 -3.569 -10.676 1.00 15.00 C ATOM 261 CD LYS A 19 -15.317 -3.645 -12.094 1.00 15.00 C ATOM 262 CE LYS A 19 -15.904 -5.010 -12.408 1.00 15.00 C ATOM 263 NZ LYS A 19 -16.446 -5.065 -13.792 1.00 15.00 N1+ ATOM 0 H LYS A 19 -15.700 -2.607 -8.146 1.00 15.00 H new ATOM 0 HA LYS A 19 -12.894 -2.523 -8.866 1.00 15.00 H new ATOM 0 HB2 LYS A 19 -15.369 -1.543 -10.336 1.00 15.00 H new ATOM 0 HB3 LYS A 19 -13.764 -1.715 -11.019 1.00 15.00 H new ATOM 0 HG2 LYS A 19 -13.873 -4.179 -10.595 1.00 15.00 H new ATOM 0 HG3 LYS A 19 -15.503 -3.984 -9.981 1.00 15.00 H new ATOM 0 HD2 LYS A 19 -16.083 -2.882 -12.229 1.00 15.00 H new ATOM 0 HD3 LYS A 19 -14.518 -3.423 -12.801 1.00 15.00 H new ATOM 0 HE2 LYS A 19 -15.136 -5.774 -12.286 1.00 15.00 H new ATOM 0 HE3 LYS A 19 -16.697 -5.239 -11.696 1.00 15.00 H new ATOM 0 HZ1 LYS A 19 -16.839 -6.011 -13.974 1.00 15.00 H new ATOM 0 HZ2 LYS A 19 -17.195 -4.352 -13.900 1.00 15.00 H new ATOM 0 HZ3 LYS A 19 -15.683 -4.871 -14.472 1.00 15.00 H new ATOM 277 N ILE A 20 -12.394 -0.228 -8.108 1.00 15.00 N ATOM 278 CA ILE A 20 -12.003 1.136 -7.782 1.00 15.00 C ATOM 279 C ILE A 20 -10.484 1.268 -7.837 1.00 15.00 C ATOM 280 O ILE A 20 -9.756 0.419 -7.317 1.00 15.00 O ATOM 281 CB ILE A 20 -12.540 1.574 -6.396 1.00 15.00 C ATOM 282 CG1 ILE A 20 -12.141 3.023 -6.094 1.00 15.00 C ATOM 283 CG2 ILE A 20 -12.048 0.638 -5.298 1.00 15.00 C ATOM 284 CD1 ILE A 20 -12.833 3.606 -4.880 1.00 15.00 C ATOM 0 H ILE A 20 -11.669 -0.924 -7.935 1.00 15.00 H new ATOM 0 HA ILE A 20 -12.448 1.800 -8.524 1.00 15.00 H new ATOM 0 HB ILE A 20 -13.628 1.517 -6.423 1.00 15.00 H new ATOM 0 HG12 ILE A 20 -11.062 3.069 -5.943 1.00 15.00 H new ATOM 0 HG13 ILE A 20 -12.368 3.641 -6.962 1.00 15.00 H new ATOM 0 HG21 ILE A 20 -12.440 0.968 -4.336 1.00 15.00 H new ATOM 0 HG22 ILE A 20 -12.394 -0.375 -5.502 1.00 15.00 H new ATOM 0 HG23 ILE A 20 -10.958 0.651 -5.270 1.00 15.00 H new ATOM 0 HD11 ILE A 20 -12.500 4.633 -4.730 1.00 15.00 H new ATOM 0 HD12 ILE A 20 -13.912 3.593 -5.035 1.00 15.00 H new ATOM 0 HD13 ILE A 20 -12.586 3.012 -4.000 1.00 15.00 H new ATOM 296 N SER A 21 -10.011 2.319 -8.487 1.00 15.00 N ATOM 297 CA SER A 21 -8.584 2.552 -8.630 1.00 15.00 C ATOM 298 C SER A 21 -8.218 3.954 -8.158 1.00 15.00 C ATOM 299 O SER A 21 -7.336 4.605 -8.717 1.00 15.00 O ATOM 300 CB SER A 21 -8.182 2.361 -10.094 1.00 15.00 C ATOM 301 OG SER A 21 -9.311 2.018 -10.887 1.00 15.00 O ATOM 0 H SER A 21 -10.599 3.028 -8.926 1.00 15.00 H new ATOM 0 HA SER A 21 -8.043 1.836 -8.011 1.00 15.00 H new ATOM 0 HB2 SER A 21 -7.730 3.277 -10.474 1.00 15.00 H new ATOM 0 HB3 SER A 21 -7.428 1.578 -10.169 1.00 15.00 H new ATOM 0 HG SER A 21 -9.033 1.902 -11.819 1.00 15.00 H new ATOM 307 N LYS A 22 -8.901 4.413 -7.119 1.00 15.00 N ATOM 308 CA LYS A 22 -8.660 5.739 -6.577 1.00 15.00 C ATOM 309 C LYS A 22 -8.548 5.687 -5.062 1.00 15.00 C ATOM 310 O LYS A 22 -9.171 4.846 -4.410 1.00 15.00 O ATOM 311 CB LYS A 22 -9.787 6.690 -6.987 1.00 15.00 C ATOM 312 CG LYS A 22 -10.005 6.759 -8.490 1.00 15.00 C ATOM 313 CD LYS A 22 -11.141 7.700 -8.856 1.00 15.00 C ATOM 314 CE LYS A 22 -12.487 7.159 -8.407 1.00 15.00 C ATOM 315 NZ LYS A 22 -13.616 7.937 -8.980 1.00 15.00 N1+ ATOM 0 H LYS A 22 -9.627 3.885 -6.635 1.00 15.00 H new ATOM 0 HA LYS A 22 -7.718 6.109 -6.981 1.00 15.00 H new ATOM 0 HB2 LYS A 22 -10.713 6.372 -6.508 1.00 15.00 H new ATOM 0 HB3 LYS A 22 -9.562 7.689 -6.614 1.00 15.00 H new ATOM 0 HG2 LYS A 22 -9.087 7.092 -8.975 1.00 15.00 H new ATOM 0 HG3 LYS A 22 -10.223 5.761 -8.871 1.00 15.00 H new ATOM 0 HD2 LYS A 22 -10.969 8.674 -8.397 1.00 15.00 H new ATOM 0 HD3 LYS A 22 -11.152 7.854 -9.935 1.00 15.00 H new ATOM 0 HE2 LYS A 22 -12.577 6.115 -8.706 1.00 15.00 H new ATOM 0 HE3 LYS A 22 -12.544 7.185 -7.319 1.00 15.00 H new ATOM 0 HZ1 LYS A 22 -14.517 7.536 -8.650 1.00 15.00 H new ATOM 0 HZ2 LYS A 22 -13.545 8.928 -8.674 1.00 15.00 H new ATOM 0 HZ3 LYS A 22 -13.577 7.892 -10.018 1.00 15.00 H new ATOM 329 N THR A 23 -7.747 6.581 -4.513 1.00 15.00 N ATOM 330 CA THR A 23 -7.545 6.655 -3.079 1.00 15.00 C ATOM 331 C THR A 23 -8.475 7.698 -2.463 1.00 15.00 C ATOM 332 O THR A 23 -9.296 8.295 -3.166 1.00 15.00 O ATOM 333 CB THR A 23 -6.084 7.015 -2.766 1.00 15.00 C ATOM 334 OG1 THR A 23 -5.639 8.036 -3.666 1.00 15.00 O ATOM 335 CG2 THR A 23 -5.183 5.798 -2.897 1.00 15.00 C ATOM 0 H THR A 23 -7.220 7.273 -5.046 1.00 15.00 H new ATOM 0 HA THR A 23 -7.773 5.680 -2.649 1.00 15.00 H new ATOM 0 HB THR A 23 -6.031 7.375 -1.739 1.00 15.00 H new ATOM 0 HG1 THR A 23 -5.524 8.877 -3.176 1.00 15.00 H new ATOM 0 HG21 THR A 23 -4.155 6.080 -2.670 1.00 15.00 H new ATOM 0 HG22 THR A 23 -5.510 5.027 -2.200 1.00 15.00 H new ATOM 0 HG23 THR A 23 -5.237 5.413 -3.915 1.00 15.00 H new ATOM 343 N MET A 24 -8.339 7.934 -1.160 1.00 15.00 N ATOM 344 CA MET A 24 -9.176 8.915 -0.467 1.00 15.00 C ATOM 345 C MET A 24 -8.913 10.329 -0.979 1.00 15.00 C ATOM 346 O MET A 24 -9.770 11.200 -0.879 1.00 15.00 O ATOM 347 CB MET A 24 -8.953 8.852 1.053 1.00 15.00 C ATOM 348 CG MET A 24 -7.521 9.128 1.492 1.00 15.00 C ATOM 349 SD MET A 24 -7.184 10.880 1.755 1.00 15.00 S ATOM 350 CE MET A 24 -8.186 11.209 3.205 1.00 15.00 C ATOM 0 H MET A 24 -7.660 7.462 -0.563 1.00 15.00 H new ATOM 0 HA MET A 24 -10.216 8.663 -0.677 1.00 15.00 H new ATOM 0 HB2 MET A 24 -9.613 9.573 1.535 1.00 15.00 H new ATOM 0 HB3 MET A 24 -9.245 7.865 1.410 1.00 15.00 H new ATOM 0 HG2 MET A 24 -7.319 8.583 2.414 1.00 15.00 H new ATOM 0 HG3 MET A 24 -6.836 8.742 0.737 1.00 15.00 H new ATOM 0 HE1 MET A 24 -7.785 12.072 3.736 1.00 15.00 H new ATOM 0 HE2 MET A 24 -9.212 11.415 2.899 1.00 15.00 H new ATOM 0 HE3 MET A 24 -8.171 10.340 3.862 1.00 15.00 H new ATOM 360 N SER A 25 -7.729 10.548 -1.532 1.00 15.00 N ATOM 361 CA SER A 25 -7.363 11.859 -2.055 1.00 15.00 C ATOM 362 C SER A 25 -7.595 11.929 -3.563 1.00 15.00 C ATOM 363 O SER A 25 -7.288 12.931 -4.204 1.00 15.00 O ATOM 364 CB SER A 25 -5.897 12.158 -1.739 1.00 15.00 C ATOM 365 OG SER A 25 -5.404 11.280 -0.737 1.00 15.00 O ATOM 0 H SER A 25 -7.005 9.836 -1.631 1.00 15.00 H new ATOM 0 HA SER A 25 -7.995 12.607 -1.575 1.00 15.00 H new ATOM 0 HB2 SER A 25 -5.298 12.056 -2.644 1.00 15.00 H new ATOM 0 HB3 SER A 25 -5.796 13.191 -1.405 1.00 15.00 H new ATOM 0 HG SER A 25 -5.868 11.455 0.108 1.00 15.00 H new ATOM 371 N GLY A 26 -8.138 10.853 -4.123 1.00 15.00 N ATOM 372 CA GLY A 26 -8.395 10.808 -5.550 1.00 15.00 C ATOM 373 C GLY A 26 -7.132 10.579 -6.357 1.00 15.00 C ATOM 374 O GLY A 26 -7.134 10.727 -7.577 1.00 15.00 O ATOM 0 H GLY A 26 -8.405 10.011 -3.613 1.00 15.00 H new ATOM 0 HA2 GLY A 26 -9.109 10.012 -5.763 1.00 15.00 H new ATOM 0 HA3 GLY A 26 -8.858 11.744 -5.863 1.00 15.00 H new ATOM 378 N LEU A 27 -6.056 10.212 -5.674 1.00 15.00 N ATOM 379 CA LEU A 27 -4.785 9.964 -6.335 1.00 15.00 C ATOM 380 C LEU A 27 -4.827 8.658 -7.111 1.00 15.00 C ATOM 381 O LEU A 27 -5.585 7.744 -6.772 1.00 15.00 O ATOM 382 CB LEU A 27 -3.639 9.930 -5.320 1.00 15.00 C ATOM 383 CG LEU A 27 -3.206 11.291 -4.767 1.00 15.00 C ATOM 384 CD1 LEU A 27 -2.046 11.121 -3.799 1.00 15.00 C ATOM 385 CD2 LEU A 27 -2.816 12.231 -5.896 1.00 15.00 C ATOM 0 H LEU A 27 -6.039 10.080 -4.663 1.00 15.00 H new ATOM 0 HA LEU A 27 -4.608 10.782 -7.033 1.00 15.00 H new ATOM 0 HB2 LEU A 27 -3.936 9.296 -4.485 1.00 15.00 H new ATOM 0 HB3 LEU A 27 -2.776 9.457 -5.789 1.00 15.00 H new ATOM 0 HG LEU A 27 -4.049 11.728 -4.232 1.00 15.00 H new ATOM 0 HD11 LEU A 27 -1.748 12.096 -3.413 1.00 15.00 H new ATOM 0 HD12 LEU A 27 -2.353 10.482 -2.971 1.00 15.00 H new ATOM 0 HD13 LEU A 27 -1.204 10.663 -4.317 1.00 15.00 H new ATOM 0 HD21 LEU A 27 -2.512 13.192 -5.481 1.00 15.00 H new ATOM 0 HD22 LEU A 27 -1.988 11.800 -6.458 1.00 15.00 H new ATOM 0 HD23 LEU A 27 -3.668 12.376 -6.560 1.00 15.00 H new ATOM 397 N GLU A 28 -4.002 8.580 -8.143 1.00 15.00 N ATOM 398 CA GLU A 28 -3.932 7.403 -8.995 1.00 15.00 C ATOM 399 C GLU A 28 -3.385 6.197 -8.244 1.00 15.00 C ATOM 400 O GLU A 28 -2.424 6.305 -7.479 1.00 15.00 O ATOM 401 CB GLU A 28 -3.054 7.692 -10.210 1.00 15.00 C ATOM 402 CG GLU A 28 -3.569 8.834 -11.073 1.00 15.00 C ATOM 403 CD GLU A 28 -4.832 8.467 -11.823 1.00 15.00 C ATOM 404 OE1 GLU A 28 -5.832 8.092 -11.177 1.00 15.00 O ATOM 405 OE2 GLU A 28 -4.836 8.558 -13.066 1.00 15.00 O1- ATOM 0 H GLU A 28 -3.364 9.328 -8.413 1.00 15.00 H new ATOM 0 HA GLU A 28 -4.946 7.167 -9.319 1.00 15.00 H new ATOM 0 HB2 GLU A 28 -2.045 7.929 -9.871 1.00 15.00 H new ATOM 0 HB3 GLU A 28 -2.982 6.791 -10.819 1.00 15.00 H new ATOM 0 HG2 GLU A 28 -3.763 9.702 -10.444 1.00 15.00 H new ATOM 0 HG3 GLU A 28 -2.797 9.123 -11.786 1.00 15.00 H new ATOM 412 N CYS A 29 -4.011 5.056 -8.468 1.00 15.00 N ATOM 413 CA CYS A 29 -3.602 3.816 -7.837 1.00 15.00 C ATOM 414 C CYS A 29 -2.752 2.991 -8.800 1.00 15.00 C ATOM 415 O CYS A 29 -3.117 2.796 -9.964 1.00 15.00 O ATOM 416 CB CYS A 29 -4.839 3.029 -7.392 1.00 15.00 C ATOM 417 SG CYS A 29 -4.518 1.308 -6.953 1.00 15.00 S ATOM 0 H CYS A 29 -4.814 4.963 -9.090 1.00 15.00 H new ATOM 0 HA CYS A 29 -2.998 4.042 -6.958 1.00 15.00 H new ATOM 0 HB2 CYS A 29 -5.284 3.532 -6.533 1.00 15.00 H new ATOM 0 HB3 CYS A 29 -5.577 3.054 -8.194 1.00 15.00 H new ATOM 0 HG CYS A 29 -5.307 0.532 -7.635 1.00 15.00 H new ATOM 423 N GLN A 30 -1.610 2.530 -8.316 1.00 15.00 N ATOM 424 CA GLN A 30 -0.708 1.725 -9.121 1.00 15.00 C ATOM 425 C GLN A 30 -1.142 0.266 -9.090 1.00 15.00 C ATOM 426 O GLN A 30 -1.683 -0.206 -8.090 1.00 15.00 O ATOM 427 CB GLN A 30 0.727 1.849 -8.609 1.00 15.00 C ATOM 428 CG GLN A 30 1.755 1.250 -9.554 1.00 15.00 C ATOM 429 CD GLN A 30 2.981 0.731 -8.835 1.00 15.00 C ATOM 430 OE1 GLN A 30 3.960 1.451 -8.660 1.00 15.00 O ATOM 431 NE2 GLN A 30 2.942 -0.528 -8.429 1.00 15.00 N ATOM 0 H GLN A 30 -1.285 2.701 -7.364 1.00 15.00 H new ATOM 0 HA GLN A 30 -0.745 2.090 -10.148 1.00 15.00 H new ATOM 0 HB2 GLN A 30 0.959 2.902 -8.450 1.00 15.00 H new ATOM 0 HB3 GLN A 30 0.804 1.356 -7.640 1.00 15.00 H new ATOM 0 HG2 GLN A 30 1.296 0.435 -10.114 1.00 15.00 H new ATOM 0 HG3 GLN A 30 2.058 2.005 -10.280 1.00 15.00 H new ATOM 0 HE21 GLN A 30 2.108 -1.092 -8.595 1.00 15.00 H new ATOM 0 HE22 GLN A 30 3.746 -0.935 -7.950 1.00 15.00 H new ATOM 440 N ALA A 31 -0.920 -0.438 -10.190 1.00 15.00 N ATOM 441 CA ALA A 31 -1.280 -1.839 -10.271 1.00 15.00 C ATOM 442 C ALA A 31 -0.336 -2.681 -9.428 1.00 15.00 C ATOM 443 O ALA A 31 0.843 -2.346 -9.269 1.00 15.00 O ATOM 444 CB ALA A 31 -1.280 -2.313 -11.716 1.00 15.00 C ATOM 0 H ALA A 31 -0.493 -0.060 -11.036 1.00 15.00 H new ATOM 0 HA ALA A 31 -2.289 -1.957 -9.877 1.00 15.00 H new ATOM 0 HB1 ALA A 31 -1.553 -3.368 -11.753 1.00 15.00 H new ATOM 0 HB2 ALA A 31 -2.001 -1.731 -12.290 1.00 15.00 H new ATOM 0 HB3 ALA A 31 -0.286 -2.181 -12.142 1.00 15.00 H new ATOM 450 N TRP A 32 -0.855 -3.775 -8.894 1.00 15.00 N ATOM 451 CA TRP A 32 -0.063 -4.667 -8.061 1.00 15.00 C ATOM 452 C TRP A 32 0.959 -5.411 -8.912 1.00 15.00 C ATOM 453 O TRP A 32 1.955 -5.924 -8.404 1.00 15.00 O ATOM 454 CB TRP A 32 -0.970 -5.663 -7.332 1.00 15.00 C ATOM 455 CG TRP A 32 -2.053 -5.001 -6.533 1.00 15.00 C ATOM 456 CD1 TRP A 32 -3.331 -4.747 -6.941 1.00 15.00 C ATOM 457 CD2 TRP A 32 -1.953 -4.509 -5.191 1.00 15.00 C ATOM 458 NE1 TRP A 32 -4.029 -4.120 -5.938 1.00 15.00 N ATOM 459 CE2 TRP A 32 -3.206 -3.965 -4.852 1.00 15.00 C ATOM 460 CE3 TRP A 32 -0.925 -4.472 -4.243 1.00 15.00 C ATOM 461 CZ2 TRP A 32 -3.460 -3.394 -3.606 1.00 15.00 C ATOM 462 CZ3 TRP A 32 -1.178 -3.908 -3.007 1.00 15.00 C ATOM 463 CH2 TRP A 32 -2.436 -3.374 -2.697 1.00 15.00 C ATOM 0 H TRP A 32 -1.824 -4.068 -9.023 1.00 15.00 H new ATOM 0 HA TRP A 32 0.466 -4.071 -7.317 1.00 15.00 H new ATOM 0 HB2 TRP A 32 -1.424 -6.333 -8.062 1.00 15.00 H new ATOM 0 HB3 TRP A 32 -0.363 -6.279 -6.669 1.00 15.00 H new ATOM 0 HD1 TRP A 32 -3.734 -5.002 -7.910 1.00 15.00 H new ATOM 0 HE1 TRP A 32 -5.002 -3.818 -5.992 1.00 15.00 H new ATOM 0 HE3 TRP A 32 0.049 -4.877 -4.473 1.00 15.00 H new ATOM 0 HZ2 TRP A 32 -4.429 -2.982 -3.366 1.00 15.00 H new ATOM 0 HZ3 TRP A 32 -0.392 -3.878 -2.267 1.00 15.00 H new ATOM 0 HH2 TRP A 32 -2.601 -2.938 -1.723 1.00 15.00 H new ATOM 474 N ASP A 33 0.703 -5.461 -10.215 1.00 15.00 N ATOM 475 CA ASP A 33 1.591 -6.138 -11.149 1.00 15.00 C ATOM 476 C ASP A 33 2.435 -5.141 -11.943 1.00 15.00 C ATOM 477 O ASP A 33 3.084 -5.509 -12.925 1.00 15.00 O ATOM 478 CB ASP A 33 0.791 -7.028 -12.100 1.00 15.00 C ATOM 479 CG ASP A 33 -0.072 -6.242 -13.069 1.00 15.00 C ATOM 480 OD1 ASP A 33 0.229 -6.247 -14.282 1.00 15.00 O ATOM 481 OD2 ASP A 33 -1.071 -5.640 -12.628 1.00 15.00 O1- ATOM 0 H ASP A 33 -0.117 -5.038 -10.649 1.00 15.00 H new ATOM 0 HA ASP A 33 2.269 -6.762 -10.566 1.00 15.00 H new ATOM 0 HB2 ASP A 33 1.479 -7.657 -12.664 1.00 15.00 H new ATOM 0 HB3 ASP A 33 0.156 -7.694 -11.516 1.00 15.00 H new ATOM 486 N SER A 34 2.434 -3.883 -11.520 1.00 15.00 N ATOM 487 CA SER A 34 3.213 -2.857 -12.200 1.00 15.00 C ATOM 488 C SER A 34 4.695 -3.004 -11.873 1.00 15.00 C ATOM 489 O SER A 34 5.061 -3.332 -10.744 1.00 15.00 O ATOM 490 CB SER A 34 2.737 -1.461 -11.807 1.00 15.00 C ATOM 491 OG SER A 34 1.443 -1.197 -12.318 1.00 15.00 O ATOM 0 H SER A 34 1.905 -3.550 -10.714 1.00 15.00 H new ATOM 0 HA SER A 34 3.070 -2.987 -13.273 1.00 15.00 H new ATOM 0 HB2 SER A 34 2.727 -1.370 -10.721 1.00 15.00 H new ATOM 0 HB3 SER A 34 3.438 -0.716 -12.183 1.00 15.00 H new ATOM 0 HG SER A 34 1.227 -0.250 -12.189 1.00 15.00 H new ATOM 497 N GLN A 35 5.544 -2.750 -12.859 1.00 15.00 N ATOM 498 CA GLN A 35 6.979 -2.864 -12.667 1.00 15.00 C ATOM 499 C GLN A 35 7.615 -1.489 -12.470 1.00 15.00 C ATOM 500 O GLN A 35 8.822 -1.316 -12.655 1.00 15.00 O ATOM 501 CB GLN A 35 7.624 -3.604 -13.847 1.00 15.00 C ATOM 502 CG GLN A 35 9.024 -4.132 -13.557 1.00 15.00 C ATOM 503 CD GLN A 35 9.113 -4.963 -12.286 1.00 15.00 C ATOM 504 OE1 GLN A 35 8.074 -5.728 -11.985 1.00 15.00 O flip ATOM 505 NE2 GLN A 35 10.123 -4.926 -11.586 1.00 15.00 N flip ATOM 0 H GLN A 35 5.263 -2.464 -13.797 1.00 15.00 H new ATOM 0 HA GLN A 35 7.157 -3.446 -11.762 1.00 15.00 H new ATOM 0 HB2 GLN A 35 6.984 -4.439 -14.133 1.00 15.00 H new ATOM 0 HB3 GLN A 35 7.671 -2.931 -14.703 1.00 15.00 H new ATOM 0 HG2 GLN A 35 9.356 -4.737 -14.400 1.00 15.00 H new ATOM 0 HG3 GLN A 35 9.711 -3.290 -13.479 1.00 15.00 H new ATOM 0 HE21 GLN A 35 10.904 -4.325 -11.849 1.00 15.00 H new ATOM 0 HE22 GLN A 35 10.180 -5.496 -10.742 1.00 15.00 H new ATOM 514 N SER A 36 6.797 -0.504 -12.115 1.00 15.00 N ATOM 515 CA SER A 36 7.302 0.832 -11.841 1.00 15.00 C ATOM 516 C SER A 36 8.138 0.731 -10.570 1.00 15.00 C ATOM 517 O SER A 36 7.790 -0.049 -9.682 1.00 15.00 O ATOM 518 CB SER A 36 6.134 1.804 -11.655 1.00 15.00 C ATOM 519 OG SER A 36 4.932 1.101 -11.377 1.00 15.00 O ATOM 0 H SER A 36 5.787 -0.607 -12.011 1.00 15.00 H new ATOM 0 HA SER A 36 7.907 1.209 -12.666 1.00 15.00 H new ATOM 0 HB2 SER A 36 6.355 2.493 -10.840 1.00 15.00 H new ATOM 0 HB3 SER A 36 6.009 2.406 -12.555 1.00 15.00 H new ATOM 0 HG SER A 36 4.631 1.313 -10.469 1.00 15.00 H new ATOM 525 N PRO A 37 9.247 1.475 -10.425 1.00 15.00 N ATOM 526 CA PRO A 37 10.061 1.315 -9.228 1.00 15.00 C ATOM 527 C PRO A 37 9.385 1.873 -7.978 1.00 15.00 C ATOM 528 O PRO A 37 9.333 3.084 -7.749 1.00 15.00 O ATOM 529 CB PRO A 37 11.323 2.115 -9.568 1.00 15.00 C ATOM 530 CG PRO A 37 10.889 3.124 -10.577 1.00 15.00 C ATOM 531 CD PRO A 37 9.770 2.487 -11.357 1.00 15.00 C ATOM 0 HA PRO A 37 10.248 0.268 -8.992 1.00 15.00 H new ATOM 0 HB2 PRO A 37 11.734 2.597 -8.681 1.00 15.00 H new ATOM 0 HB3 PRO A 37 12.103 1.468 -9.969 1.00 15.00 H new ATOM 0 HG2 PRO A 37 10.552 4.040 -10.091 1.00 15.00 H new ATOM 0 HG3 PRO A 37 11.715 3.397 -11.234 1.00 15.00 H new ATOM 0 HD2 PRO A 37 9.006 3.214 -11.633 1.00 15.00 H new ATOM 0 HD3 PRO A 37 10.129 2.036 -12.282 1.00 15.00 H new ATOM 539 N HIS A 38 8.856 0.950 -7.193 1.00 15.00 N ATOM 540 CA HIS A 38 8.225 1.240 -5.918 1.00 15.00 C ATOM 541 C HIS A 38 8.986 0.497 -4.825 1.00 15.00 C ATOM 542 O HIS A 38 9.740 -0.425 -5.132 1.00 15.00 O ATOM 543 CB HIS A 38 6.747 0.823 -5.941 1.00 15.00 C ATOM 544 CG HIS A 38 5.899 1.533 -4.931 1.00 15.00 C ATOM 545 ND1 HIS A 38 5.090 2.605 -5.230 1.00 15.00 N ATOM 546 CD2 HIS A 38 5.751 1.310 -3.601 1.00 15.00 C ATOM 547 CE1 HIS A 38 4.491 2.995 -4.100 1.00 15.00 C ATOM 548 NE2 HIS A 38 4.860 2.239 -3.080 1.00 15.00 N ATOM 0 H HIS A 38 8.853 -0.042 -7.430 1.00 15.00 H new ATOM 0 HA HIS A 38 8.257 2.312 -5.721 1.00 15.00 H new ATOM 0 HB2 HIS A 38 6.343 1.010 -6.936 1.00 15.00 H new ATOM 0 HB3 HIS A 38 6.680 -0.251 -5.766 1.00 15.00 H new ATOM 0 HD2 HIS A 38 6.247 0.534 -3.037 1.00 15.00 H new ATOM 0 HE1 HIS A 38 3.797 3.819 -4.030 1.00 15.00 H new ATOM 0 HE2 HIS A 38 4.554 2.321 -2.111 1.00 15.00 H new ATOM 556 N ALA A 39 8.809 0.870 -3.570 1.00 15.00 N ATOM 557 CA ALA A 39 9.459 0.140 -2.494 1.00 15.00 C ATOM 558 C ALA A 39 8.411 -0.719 -1.797 1.00 15.00 C ATOM 559 O ALA A 39 7.506 -0.186 -1.153 1.00 15.00 O ATOM 560 CB ALA A 39 10.112 1.104 -1.510 1.00 15.00 C ATOM 0 H ALA A 39 8.233 1.658 -3.273 1.00 15.00 H new ATOM 0 HA ALA A 39 10.246 -0.496 -2.898 1.00 15.00 H new ATOM 0 HB1 ALA A 39 10.593 0.539 -0.712 1.00 15.00 H new ATOM 0 HB2 ALA A 39 10.858 1.705 -2.030 1.00 15.00 H new ATOM 0 HB3 ALA A 39 9.352 1.759 -1.084 1.00 15.00 H new ATOM 566 N HIS A 40 8.520 -2.039 -1.935 1.00 15.00 N ATOM 567 CA HIS A 40 7.565 -2.954 -1.316 1.00 15.00 C ATOM 568 C HIS A 40 8.014 -4.407 -1.469 1.00 15.00 C ATOM 569 O HIS A 40 9.091 -4.687 -1.998 1.00 15.00 O ATOM 570 CB HIS A 40 6.153 -2.768 -1.906 1.00 15.00 C ATOM 571 CG HIS A 40 5.976 -3.295 -3.300 1.00 15.00 C ATOM 572 ND1 HIS A 40 5.307 -4.473 -3.536 1.00 15.00 N ATOM 573 CD2 HIS A 40 6.372 -2.765 -4.482 1.00 15.00 C ATOM 574 CE1 HIS A 40 5.306 -4.631 -4.849 1.00 15.00 C ATOM 575 NE2 HIS A 40 5.939 -3.621 -5.460 1.00 15.00 N ATOM 0 H HIS A 40 9.258 -2.497 -2.469 1.00 15.00 H new ATOM 0 HA HIS A 40 7.528 -2.716 -0.253 1.00 15.00 H new ATOM 0 HB2 HIS A 40 5.434 -3.262 -1.252 1.00 15.00 H new ATOM 0 HB3 HIS A 40 5.910 -1.705 -1.901 1.00 15.00 H new ATOM 0 HD2 HIS A 40 6.922 -1.847 -4.625 1.00 15.00 H new ATOM 0 HE1 HIS A 40 4.853 -5.466 -5.362 1.00 15.00 H new ATOM 0 HE2 HIS A 40 6.073 -3.510 -6.465 1.00 15.00 H new ATOM 583 N GLY A 41 7.170 -5.321 -1.000 1.00 15.00 N ATOM 584 CA GLY A 41 7.457 -6.739 -1.100 1.00 15.00 C ATOM 585 C GLY A 41 6.190 -7.551 -1.286 1.00 15.00 C ATOM 586 O GLY A 41 6.088 -8.684 -0.811 1.00 15.00 O ATOM 0 H GLY A 41 6.283 -5.100 -0.548 1.00 15.00 H new ATOM 0 HA2 GLY A 41 8.131 -6.917 -1.938 1.00 15.00 H new ATOM 0 HA3 GLY A 41 7.974 -7.071 -0.200 1.00 15.00 H new ATOM 590 N TYR A 42 5.220 -6.969 -1.982 1.00 15.00 N ATOM 591 CA TYR A 42 3.944 -7.633 -2.209 1.00 15.00 C ATOM 592 C TYR A 42 3.745 -7.977 -3.680 1.00 15.00 C ATOM 593 O TYR A 42 3.460 -7.109 -4.501 1.00 15.00 O ATOM 594 CB TYR A 42 2.791 -6.751 -1.725 1.00 15.00 C ATOM 595 CG TYR A 42 2.918 -6.313 -0.286 1.00 15.00 C ATOM 596 CD1 TYR A 42 2.752 -4.981 0.066 1.00 15.00 C ATOM 597 CD2 TYR A 42 3.208 -7.228 0.718 1.00 15.00 C ATOM 598 CE1 TYR A 42 2.872 -4.573 1.379 1.00 15.00 C ATOM 599 CE2 TYR A 42 3.327 -6.827 2.031 1.00 15.00 C ATOM 600 CZ TYR A 42 3.159 -5.500 2.357 1.00 15.00 C ATOM 601 OH TYR A 42 3.285 -5.101 3.663 1.00 15.00 O ATOM 0 H TYR A 42 5.294 -6.040 -2.398 1.00 15.00 H new ATOM 0 HA TYR A 42 3.953 -8.563 -1.640 1.00 15.00 H new ATOM 0 HB2 TYR A 42 2.732 -5.867 -2.360 1.00 15.00 H new ATOM 0 HB3 TYR A 42 1.854 -7.295 -1.848 1.00 15.00 H new ATOM 0 HD1 TYR A 42 2.526 -4.253 -0.699 1.00 15.00 H new ATOM 0 HD2 TYR A 42 3.342 -8.270 0.466 1.00 15.00 H new ATOM 0 HE1 TYR A 42 2.742 -3.533 1.638 1.00 15.00 H new ATOM 0 HE2 TYR A 42 3.551 -7.550 2.801 1.00 15.00 H new ATOM 0 HH TYR A 42 2.411 -5.147 4.105 1.00 15.00 H new ATOM 611 N ILE A 43 3.893 -9.250 -4.000 1.00 15.00 N ATOM 612 CA ILE A 43 3.713 -9.722 -5.364 1.00 15.00 C ATOM 613 C ILE A 43 2.387 -10.479 -5.460 1.00 15.00 C ATOM 614 O ILE A 43 2.072 -11.280 -4.578 1.00 15.00 O ATOM 615 CB ILE A 43 4.879 -10.648 -5.795 1.00 15.00 C ATOM 616 CG1 ILE A 43 6.230 -10.046 -5.383 1.00 15.00 C ATOM 617 CG2 ILE A 43 4.846 -10.892 -7.298 1.00 15.00 C ATOM 618 CD1 ILE A 43 6.578 -8.755 -6.099 1.00 15.00 C ATOM 0 H ILE A 43 4.139 -9.980 -3.331 1.00 15.00 H new ATOM 0 HA ILE A 43 3.703 -8.862 -6.033 1.00 15.00 H new ATOM 0 HB ILE A 43 4.757 -11.605 -5.287 1.00 15.00 H new ATOM 0 HG12 ILE A 43 6.221 -9.862 -4.309 1.00 15.00 H new ATOM 0 HG13 ILE A 43 7.015 -10.778 -5.574 1.00 15.00 H new ATOM 0 HG21 ILE A 43 5.673 -11.544 -7.579 1.00 15.00 H new ATOM 0 HG22 ILE A 43 3.902 -11.365 -7.569 1.00 15.00 H new ATOM 0 HG23 ILE A 43 4.939 -9.941 -7.823 1.00 15.00 H new ATOM 0 HD11 ILE A 43 7.547 -8.396 -5.751 1.00 15.00 H new ATOM 0 HD12 ILE A 43 6.622 -8.935 -7.173 1.00 15.00 H new ATOM 0 HD13 ILE A 43 5.816 -8.005 -5.888 1.00 15.00 H new ATOM 630 N PRO A 44 1.578 -10.221 -6.508 1.00 15.00 N ATOM 631 CA PRO A 44 0.276 -10.885 -6.701 1.00 15.00 C ATOM 632 C PRO A 44 0.345 -12.413 -6.620 1.00 15.00 C ATOM 633 O PRO A 44 -0.603 -13.057 -6.169 1.00 15.00 O ATOM 634 CB PRO A 44 -0.138 -10.448 -8.107 1.00 15.00 C ATOM 635 CG PRO A 44 0.541 -9.142 -8.315 1.00 15.00 C ATOM 636 CD PRO A 44 1.848 -9.229 -7.573 1.00 15.00 C ATOM 0 HA PRO A 44 -0.426 -10.606 -5.916 1.00 15.00 H new ATOM 0 HB2 PRO A 44 0.171 -11.178 -8.855 1.00 15.00 H new ATOM 0 HB3 PRO A 44 -1.220 -10.348 -8.187 1.00 15.00 H new ATOM 0 HG2 PRO A 44 0.707 -8.953 -9.376 1.00 15.00 H new ATOM 0 HG3 PRO A 44 -0.068 -8.321 -7.937 1.00 15.00 H new ATOM 0 HD2 PRO A 44 2.659 -9.552 -8.226 1.00 15.00 H new ATOM 0 HD3 PRO A 44 2.138 -8.264 -7.158 1.00 15.00 H new ATOM 644 N SER A 45 1.470 -12.987 -7.031 1.00 15.00 N ATOM 645 CA SER A 45 1.644 -14.435 -7.005 1.00 15.00 C ATOM 646 C SER A 45 1.891 -14.948 -5.584 1.00 15.00 C ATOM 647 O SER A 45 1.912 -16.156 -5.341 1.00 15.00 O ATOM 648 CB SER A 45 2.798 -14.833 -7.918 1.00 15.00 C ATOM 649 OG SER A 45 3.798 -13.829 -7.933 1.00 15.00 O ATOM 0 H SER A 45 2.276 -12.472 -7.386 1.00 15.00 H new ATOM 0 HA SER A 45 0.722 -14.892 -7.364 1.00 15.00 H new ATOM 0 HB2 SER A 45 3.228 -15.775 -7.578 1.00 15.00 H new ATOM 0 HB3 SER A 45 2.427 -14.998 -8.930 1.00 15.00 H new ATOM 0 HG SER A 45 4.530 -14.105 -8.523 1.00 15.00 H new ATOM 655 N LYS A 46 2.090 -14.022 -4.653 1.00 15.00 N ATOM 656 CA LYS A 46 2.322 -14.370 -3.257 1.00 15.00 C ATOM 657 C LYS A 46 1.008 -14.371 -2.488 1.00 15.00 C ATOM 658 O LYS A 46 0.889 -15.006 -1.442 1.00 15.00 O ATOM 659 CB LYS A 46 3.301 -13.386 -2.609 1.00 15.00 C ATOM 660 CG LYS A 46 4.762 -13.678 -2.916 1.00 15.00 C ATOM 661 CD LYS A 46 5.667 -12.531 -2.486 1.00 15.00 C ATOM 662 CE LYS A 46 5.569 -12.255 -0.991 1.00 15.00 C ATOM 663 NZ LYS A 46 6.689 -11.399 -0.507 1.00 15.00 N1+ ATOM 0 H LYS A 46 2.095 -13.020 -4.842 1.00 15.00 H new ATOM 0 HA LYS A 46 2.757 -15.369 -3.223 1.00 15.00 H new ATOM 0 HB2 LYS A 46 3.064 -12.377 -2.946 1.00 15.00 H new ATOM 0 HB3 LYS A 46 3.156 -13.403 -1.529 1.00 15.00 H new ATOM 0 HG2 LYS A 46 5.066 -14.592 -2.406 1.00 15.00 H new ATOM 0 HG3 LYS A 46 4.881 -13.855 -3.985 1.00 15.00 H new ATOM 0 HD2 LYS A 46 6.699 -12.768 -2.744 1.00 15.00 H new ATOM 0 HD3 LYS A 46 5.399 -11.631 -3.039 1.00 15.00 H new ATOM 0 HE2 LYS A 46 4.619 -11.766 -0.774 1.00 15.00 H new ATOM 0 HE3 LYS A 46 5.573 -13.199 -0.447 1.00 15.00 H new ATOM 0 HZ1 LYS A 46 6.714 -11.415 0.533 1.00 15.00 H new ATOM 0 HZ2 LYS A 46 7.589 -11.761 -0.880 1.00 15.00 H new ATOM 0 HZ3 LYS A 46 6.546 -10.422 -0.835 1.00 15.00 H new ATOM 677 N PHE A 47 0.021 -13.651 -3.014 1.00 15.00 N ATOM 678 CA PHE A 47 -1.292 -13.563 -2.379 1.00 15.00 C ATOM 679 C PHE A 47 -2.407 -13.756 -3.413 1.00 15.00 C ATOM 680 O PHE A 47 -3.203 -12.845 -3.663 1.00 15.00 O ATOM 681 CB PHE A 47 -1.472 -12.204 -1.683 1.00 15.00 C ATOM 682 CG PHE A 47 -0.248 -11.710 -0.960 1.00 15.00 C ATOM 683 CD1 PHE A 47 0.105 -12.232 0.274 1.00 15.00 C ATOM 684 CD2 PHE A 47 0.551 -10.726 -1.520 1.00 15.00 C ATOM 685 CE1 PHE A 47 1.230 -11.777 0.936 1.00 15.00 C ATOM 686 CE2 PHE A 47 1.675 -10.268 -0.864 1.00 15.00 C ATOM 687 CZ PHE A 47 2.017 -10.796 0.365 1.00 15.00 C ATOM 0 H PHE A 47 0.105 -13.119 -3.880 1.00 15.00 H new ATOM 0 HA PHE A 47 -1.353 -14.356 -1.633 1.00 15.00 H new ATOM 0 HB2 PHE A 47 -1.763 -11.463 -2.428 1.00 15.00 H new ATOM 0 HB3 PHE A 47 -2.294 -12.280 -0.971 1.00 15.00 H new ATOM 0 HD1 PHE A 47 -0.505 -13.002 0.723 1.00 15.00 H new ATOM 0 HD2 PHE A 47 0.290 -10.312 -2.483 1.00 15.00 H new ATOM 0 HE1 PHE A 47 1.493 -12.188 1.899 1.00 15.00 H new ATOM 0 HE2 PHE A 47 2.286 -9.498 -1.311 1.00 15.00 H new ATOM 0 HZ PHE A 47 2.899 -10.443 0.879 1.00 15.00 H new ATOM 697 N PRO A 48 -2.496 -14.951 -4.023 1.00 15.00 N ATOM 698 CA PRO A 48 -3.515 -15.237 -5.032 1.00 15.00 C ATOM 699 C PRO A 48 -4.889 -15.482 -4.412 1.00 15.00 C ATOM 700 O PRO A 48 -5.901 -15.530 -5.111 1.00 15.00 O ATOM 701 CB PRO A 48 -2.999 -16.509 -5.703 1.00 15.00 C ATOM 702 CG PRO A 48 -2.183 -17.194 -4.663 1.00 15.00 C ATOM 703 CD PRO A 48 -1.620 -16.116 -3.776 1.00 15.00 C ATOM 0 HA PRO A 48 -3.656 -14.403 -5.719 1.00 15.00 H new ATOM 0 HB2 PRO A 48 -3.823 -17.140 -6.037 1.00 15.00 H new ATOM 0 HB3 PRO A 48 -2.400 -16.275 -6.583 1.00 15.00 H new ATOM 0 HG2 PRO A 48 -2.794 -17.889 -4.087 1.00 15.00 H new ATOM 0 HG3 PRO A 48 -1.383 -17.776 -5.120 1.00 15.00 H new ATOM 0 HD2 PRO A 48 -1.638 -16.413 -2.727 1.00 15.00 H new ATOM 0 HD3 PRO A 48 -0.583 -15.895 -4.027 1.00 15.00 H new ATOM 711 N ASN A 49 -4.917 -15.625 -3.091 1.00 15.00 N ATOM 712 CA ASN A 49 -6.160 -15.874 -2.370 1.00 15.00 C ATOM 713 C ASN A 49 -6.882 -14.566 -2.055 1.00 15.00 C ATOM 714 O ASN A 49 -8.088 -14.557 -1.815 1.00 15.00 O ATOM 715 CB ASN A 49 -5.891 -16.656 -1.075 1.00 15.00 C ATOM 716 CG ASN A 49 -5.021 -15.900 -0.080 1.00 15.00 C ATOM 717 OD1 ASN A 49 -4.142 -15.121 -0.457 1.00 15.00 O ATOM 718 ND2 ASN A 49 -5.260 -16.125 1.207 1.00 15.00 N ATOM 0 H ASN A 49 -4.090 -15.572 -2.496 1.00 15.00 H new ATOM 0 HA ASN A 49 -6.803 -16.475 -3.013 1.00 15.00 H new ATOM 0 HB2 ASN A 49 -6.843 -16.899 -0.602 1.00 15.00 H new ATOM 0 HB3 ASN A 49 -5.408 -17.601 -1.324 1.00 15.00 H new ATOM 0 HD21 ASN A 49 -4.708 -15.647 1.919 1.00 15.00 H new ATOM 0 HD22 ASN A 49 -5.995 -16.776 1.483 1.00 15.00 H new ATOM 725 N LYS A 50 -6.145 -13.461 -2.075 1.00 15.00 N ATOM 726 CA LYS A 50 -6.730 -12.154 -1.792 1.00 15.00 C ATOM 727 C LYS A 50 -7.182 -11.478 -3.080 1.00 15.00 C ATOM 728 O LYS A 50 -7.654 -10.338 -3.069 1.00 15.00 O ATOM 729 CB LYS A 50 -5.734 -11.269 -1.036 1.00 15.00 C ATOM 730 CG LYS A 50 -5.377 -11.805 0.344 1.00 15.00 C ATOM 731 CD LYS A 50 -6.619 -12.016 1.200 1.00 15.00 C ATOM 732 CE LYS A 50 -6.263 -12.525 2.587 1.00 15.00 C ATOM 733 NZ LYS A 50 -7.409 -13.200 3.250 1.00 15.00 N1+ ATOM 0 H LYS A 50 -5.147 -13.443 -2.283 1.00 15.00 H new ATOM 0 HA LYS A 50 -7.605 -12.300 -1.159 1.00 15.00 H new ATOM 0 HB2 LYS A 50 -4.823 -11.172 -1.627 1.00 15.00 H new ATOM 0 HB3 LYS A 50 -6.154 -10.269 -0.932 1.00 15.00 H new ATOM 0 HG2 LYS A 50 -4.840 -12.748 0.241 1.00 15.00 H new ATOM 0 HG3 LYS A 50 -4.704 -11.108 0.843 1.00 15.00 H new ATOM 0 HD2 LYS A 50 -7.166 -11.077 1.286 1.00 15.00 H new ATOM 0 HD3 LYS A 50 -7.283 -12.728 0.710 1.00 15.00 H new ATOM 0 HE2 LYS A 50 -5.427 -13.221 2.513 1.00 15.00 H new ATOM 0 HE3 LYS A 50 -5.929 -11.690 3.204 1.00 15.00 H new ATOM 0 HZ1 LYS A 50 -7.060 -13.786 4.035 1.00 15.00 H new ATOM 0 HZ2 LYS A 50 -8.067 -12.484 3.619 1.00 15.00 H new ATOM 0 HZ3 LYS A 50 -7.903 -13.802 2.561 1.00 15.00 H new ATOM 747 N ASN A 51 -7.028 -12.208 -4.182 1.00 15.00 N ATOM 748 CA ASN A 51 -7.418 -11.740 -5.511 1.00 15.00 C ATOM 749 C ASN A 51 -6.773 -10.399 -5.861 1.00 15.00 C ATOM 750 O ASN A 51 -7.463 -9.399 -6.079 1.00 15.00 O ATOM 751 CB ASN A 51 -8.945 -11.644 -5.627 1.00 15.00 C ATOM 752 CG ASN A 51 -9.405 -11.497 -7.066 1.00 15.00 C ATOM 753 OD1 ASN A 51 -8.758 -11.986 -7.990 1.00 15.00 O ATOM 754 ND2 ASN A 51 -10.535 -10.838 -7.266 1.00 15.00 N ATOM 0 H ASN A 51 -6.627 -13.146 -4.179 1.00 15.00 H new ATOM 0 HA ASN A 51 -7.054 -12.476 -6.228 1.00 15.00 H new ATOM 0 HB2 ASN A 51 -9.397 -12.536 -5.193 1.00 15.00 H new ATOM 0 HB3 ASN A 51 -9.299 -10.792 -5.046 1.00 15.00 H new ATOM 0 HD21 ASN A 51 -10.897 -10.722 -8.213 1.00 15.00 H new ATOM 0 HD22 ASN A 51 -11.044 -10.446 -6.474 1.00 15.00 H new ATOM 761 N LEU A 52 -5.447 -10.375 -5.894 1.00 15.00 N ATOM 762 CA LEU A 52 -4.727 -9.166 -6.256 1.00 15.00 C ATOM 763 C LEU A 52 -4.563 -9.125 -7.766 1.00 15.00 C ATOM 764 O LEU A 52 -3.800 -9.907 -8.333 1.00 15.00 O ATOM 765 CB LEU A 52 -3.353 -9.130 -5.581 1.00 15.00 C ATOM 766 CG LEU A 52 -3.250 -8.246 -4.335 1.00 15.00 C ATOM 767 CD1 LEU A 52 -4.145 -8.766 -3.224 1.00 15.00 C ATOM 768 CD2 LEU A 52 -1.809 -8.170 -3.860 1.00 15.00 C ATOM 0 H LEU A 52 -4.853 -11.175 -5.676 1.00 15.00 H new ATOM 0 HA LEU A 52 -5.293 -8.298 -5.919 1.00 15.00 H new ATOM 0 HB2 LEU A 52 -3.077 -10.148 -5.306 1.00 15.00 H new ATOM 0 HB3 LEU A 52 -2.619 -8.786 -6.310 1.00 15.00 H new ATOM 0 HG LEU A 52 -3.586 -7.244 -4.601 1.00 15.00 H new ATOM 0 HD11 LEU A 52 -4.053 -8.120 -2.351 1.00 15.00 H new ATOM 0 HD12 LEU A 52 -5.181 -8.772 -3.564 1.00 15.00 H new ATOM 0 HD13 LEU A 52 -3.844 -9.780 -2.959 1.00 15.00 H new ATOM 0 HD21 LEU A 52 -1.751 -7.538 -2.974 1.00 15.00 H new ATOM 0 HD22 LEU A 52 -1.453 -9.171 -3.616 1.00 15.00 H new ATOM 0 HD23 LEU A 52 -1.188 -7.746 -4.649 1.00 15.00 H new ATOM 780 N LYS A 53 -5.280 -8.218 -8.413 1.00 15.00 N ATOM 781 CA LYS A 53 -5.231 -8.094 -9.863 1.00 15.00 C ATOM 782 C LYS A 53 -5.396 -6.640 -10.277 1.00 15.00 C ATOM 783 O LYS A 53 -6.131 -5.886 -9.634 1.00 15.00 O ATOM 784 CB LYS A 53 -6.343 -8.930 -10.523 1.00 15.00 C ATOM 785 CG LYS A 53 -6.312 -10.415 -10.185 1.00 15.00 C ATOM 786 CD LYS A 53 -5.207 -11.143 -10.931 1.00 15.00 C ATOM 787 CE LYS A 53 -5.015 -12.554 -10.396 1.00 15.00 C ATOM 788 NZ LYS A 53 -3.974 -13.296 -11.149 1.00 15.00 N1+ ATOM 0 H LYS A 53 -5.905 -7.555 -7.955 1.00 15.00 H new ATOM 0 HA LYS A 53 -4.260 -8.462 -10.194 1.00 15.00 H new ATOM 0 HB2 LYS A 53 -7.309 -8.524 -10.224 1.00 15.00 H new ATOM 0 HB3 LYS A 53 -6.270 -8.816 -11.605 1.00 15.00 H new ATOM 0 HG2 LYS A 53 -6.169 -10.540 -9.112 1.00 15.00 H new ATOM 0 HG3 LYS A 53 -7.274 -10.864 -10.433 1.00 15.00 H new ATOM 0 HD2 LYS A 53 -5.449 -11.184 -11.993 1.00 15.00 H new ATOM 0 HD3 LYS A 53 -4.274 -10.586 -10.838 1.00 15.00 H new ATOM 0 HE2 LYS A 53 -4.737 -12.508 -9.343 1.00 15.00 H new ATOM 0 HE3 LYS A 53 -5.959 -13.095 -10.453 1.00 15.00 H new ATOM 0 HZ1 LYS A 53 -3.874 -14.252 -10.753 1.00 15.00 H new ATOM 0 HZ2 LYS A 53 -4.250 -13.363 -12.149 1.00 15.00 H new ATOM 0 HZ3 LYS A 53 -3.066 -12.794 -11.073 1.00 15.00 H new ATOM 802 N LYS A 54 -4.700 -6.261 -11.345 1.00 15.00 N ATOM 803 CA LYS A 54 -4.759 -4.908 -11.891 1.00 15.00 C ATOM 804 C LYS A 54 -4.427 -3.846 -10.841 1.00 15.00 C ATOM 805 O LYS A 54 -3.600 -4.074 -9.955 1.00 15.00 O ATOM 806 CB LYS A 54 -6.139 -4.648 -12.507 1.00 15.00 C ATOM 807 CG LYS A 54 -6.577 -5.716 -13.503 1.00 15.00 C ATOM 808 CD LYS A 54 -5.654 -5.786 -14.708 1.00 15.00 C ATOM 809 CE LYS A 54 -5.845 -7.083 -15.479 1.00 15.00 C ATOM 810 NZ LYS A 54 -5.077 -7.096 -16.749 1.00 15.00 N1+ ATOM 0 H LYS A 54 -4.077 -6.885 -11.858 1.00 15.00 H new ATOM 0 HA LYS A 54 -4.000 -4.834 -12.669 1.00 15.00 H new ATOM 0 HB2 LYS A 54 -6.878 -4.584 -11.708 1.00 15.00 H new ATOM 0 HB3 LYS A 54 -6.127 -3.680 -13.008 1.00 15.00 H new ATOM 0 HG2 LYS A 54 -6.599 -6.686 -13.007 1.00 15.00 H new ATOM 0 HG3 LYS A 54 -7.593 -5.505 -13.837 1.00 15.00 H new ATOM 0 HD2 LYS A 54 -5.847 -4.938 -15.366 1.00 15.00 H new ATOM 0 HD3 LYS A 54 -4.618 -5.705 -14.380 1.00 15.00 H new ATOM 0 HE2 LYS A 54 -5.532 -7.923 -14.858 1.00 15.00 H new ATOM 0 HE3 LYS A 54 -6.904 -7.223 -15.695 1.00 15.00 H new ATOM 0 HZ1 LYS A 54 -5.236 -7.998 -17.242 1.00 15.00 H new ATOM 0 HZ2 LYS A 54 -5.392 -6.311 -17.354 1.00 15.00 H new ATOM 0 HZ3 LYS A 54 -4.063 -6.988 -16.543 1.00 15.00 H new ATOM 824 N ASN A 55 -5.065 -2.687 -10.948 1.00 15.00 N ATOM 825 CA ASN A 55 -4.825 -1.584 -10.024 1.00 15.00 C ATOM 826 C ASN A 55 -6.048 -1.294 -9.162 1.00 15.00 C ATOM 827 O ASN A 55 -6.346 -0.140 -8.850 1.00 15.00 O ATOM 828 CB ASN A 55 -4.403 -0.324 -10.796 1.00 15.00 C ATOM 829 CG ASN A 55 -5.483 0.217 -11.720 1.00 15.00 C ATOM 830 OD1 ASN A 55 -6.321 -0.528 -12.240 1.00 15.00 O ATOM 831 ND2 ASN A 55 -5.466 1.524 -11.940 1.00 15.00 N ATOM 0 H ASN A 55 -5.757 -2.485 -11.670 1.00 15.00 H new ATOM 0 HA ASN A 55 -4.015 -1.881 -9.357 1.00 15.00 H new ATOM 0 HB2 ASN A 55 -4.125 0.452 -10.083 1.00 15.00 H new ATOM 0 HB3 ASN A 55 -3.514 -0.550 -11.384 1.00 15.00 H new ATOM 0 HD21 ASN A 55 -6.160 1.946 -12.556 1.00 15.00 H new ATOM 0 HD22 ASN A 55 -4.759 2.107 -11.493 1.00 15.00 H new ATOM 838 N TYR A 56 -6.738 -2.345 -8.754 1.00 15.00 N ATOM 839 CA TYR A 56 -7.917 -2.193 -7.918 1.00 15.00 C ATOM 840 C TYR A 56 -7.533 -2.244 -6.448 1.00 15.00 C ATOM 841 O TYR A 56 -6.643 -3.004 -6.060 1.00 15.00 O ATOM 842 CB TYR A 56 -8.953 -3.276 -8.238 1.00 15.00 C ATOM 843 CG TYR A 56 -9.403 -3.267 -9.681 1.00 15.00 C ATOM 844 CD1 TYR A 56 -9.336 -4.417 -10.454 1.00 15.00 C ATOM 845 CD2 TYR A 56 -9.889 -2.104 -10.270 1.00 15.00 C ATOM 846 CE1 TYR A 56 -9.741 -4.411 -11.774 1.00 15.00 C ATOM 847 CE2 TYR A 56 -10.295 -2.090 -11.590 1.00 15.00 C ATOM 848 CZ TYR A 56 -10.220 -3.247 -12.337 1.00 15.00 C ATOM 849 OH TYR A 56 -10.618 -3.239 -13.653 1.00 15.00 O ATOM 0 H TYR A 56 -6.504 -3.310 -8.987 1.00 15.00 H new ATOM 0 HA TYR A 56 -8.363 -1.221 -8.128 1.00 15.00 H new ATOM 0 HB2 TYR A 56 -8.531 -4.253 -8.003 1.00 15.00 H new ATOM 0 HB3 TYR A 56 -9.821 -3.140 -7.593 1.00 15.00 H new ATOM 0 HD1 TYR A 56 -8.961 -5.331 -10.017 1.00 15.00 H new ATOM 0 HD2 TYR A 56 -9.950 -1.198 -9.686 1.00 15.00 H new ATOM 0 HE1 TYR A 56 -9.683 -5.314 -12.363 1.00 15.00 H new ATOM 0 HE2 TYR A 56 -10.669 -1.179 -12.034 1.00 15.00 H new ATOM 0 HH TYR A 56 -10.930 -2.342 -13.895 1.00 15.00 H new ATOM 859 N CYS A 57 -8.191 -1.412 -5.649 1.00 15.00 N ATOM 860 CA CYS A 57 -7.936 -1.354 -4.216 1.00 15.00 C ATOM 861 C CYS A 57 -8.192 -2.715 -3.577 1.00 15.00 C ATOM 862 O CYS A 57 -9.245 -3.323 -3.792 1.00 15.00 O ATOM 863 CB CYS A 57 -8.823 -0.289 -3.565 1.00 15.00 C ATOM 864 SG CYS A 57 -8.304 0.195 -1.903 1.00 15.00 S ATOM 0 H CYS A 57 -8.910 -0.765 -5.973 1.00 15.00 H new ATOM 0 HA CYS A 57 -6.891 -1.086 -4.058 1.00 15.00 H new ATOM 0 HB2 CYS A 57 -8.835 0.596 -4.201 1.00 15.00 H new ATOM 0 HB3 CYS A 57 -9.846 -0.663 -3.519 1.00 15.00 H new ATOM 0 HG CYS A 57 -7.158 -0.354 -1.629 1.00 15.00 H new ATOM 870 N ARG A 58 -7.227 -3.188 -2.799 1.00 15.00 N ATOM 871 CA ARG A 58 -7.329 -4.482 -2.135 1.00 15.00 C ATOM 872 C ARG A 58 -6.845 -4.373 -0.700 1.00 15.00 C ATOM 873 O ARG A 58 -6.267 -3.359 -0.309 1.00 15.00 O ATOM 874 CB ARG A 58 -6.479 -5.532 -2.863 1.00 15.00 C ATOM 875 CG ARG A 58 -6.937 -5.849 -4.276 1.00 15.00 C ATOM 876 CD ARG A 58 -8.223 -6.660 -4.281 1.00 15.00 C ATOM 877 NE ARG A 58 -9.345 -5.899 -4.820 1.00 15.00 N ATOM 878 CZ ARG A 58 -10.205 -6.373 -5.718 1.00 15.00 C ATOM 879 NH1 ARG A 58 -10.081 -7.612 -6.184 1.00 15.00 N1+ ATOM 880 NH2 ARG A 58 -11.182 -5.600 -6.170 1.00 15.00 N ATOM 0 H ARG A 58 -6.357 -2.690 -2.611 1.00 15.00 H new ATOM 0 HA ARG A 58 -8.375 -4.787 -2.152 1.00 15.00 H new ATOM 0 HB2 ARG A 58 -5.447 -5.183 -2.900 1.00 15.00 H new ATOM 0 HB3 ARG A 58 -6.484 -6.452 -2.279 1.00 15.00 H new ATOM 0 HG2 ARG A 58 -7.090 -4.920 -4.826 1.00 15.00 H new ATOM 0 HG3 ARG A 58 -6.155 -6.403 -4.796 1.00 15.00 H new ATOM 0 HD2 ARG A 58 -8.080 -7.564 -4.873 1.00 15.00 H new ATOM 0 HD3 ARG A 58 -8.455 -6.978 -3.265 1.00 15.00 H new ATOM 0 HE ARG A 58 -9.479 -4.944 -4.488 1.00 15.00 H new ATOM 0 HH11 ARG A 58 -9.322 -8.208 -5.853 1.00 15.00 H new ATOM 0 HH12 ARG A 58 -10.745 -7.967 -6.872 1.00 15.00 H new ATOM 0 HH21 ARG A 58 -11.274 -4.643 -5.830 1.00 15.00 H new ATOM 0 HH22 ARG A 58 -11.842 -5.962 -6.858 1.00 15.00 H new ATOM 894 N ASN A 59 -7.074 -5.416 0.079 1.00 15.00 N ATOM 895 CA ASN A 59 -6.630 -5.443 1.464 1.00 15.00 C ATOM 896 C ASN A 59 -6.159 -6.843 1.835 1.00 15.00 C ATOM 897 O ASN A 59 -6.919 -7.653 2.366 1.00 15.00 O ATOM 898 CB ASN A 59 -7.737 -4.984 2.418 1.00 15.00 C ATOM 899 CG ASN A 59 -7.200 -4.673 3.806 1.00 15.00 C ATOM 900 OD1 ASN A 59 -6.244 -5.295 4.271 1.00 15.00 O ATOM 901 ND2 ASN A 59 -7.804 -3.705 4.476 1.00 15.00 N ATOM 0 H ASN A 59 -7.565 -6.257 -0.224 1.00 15.00 H new ATOM 0 HA ASN A 59 -5.797 -4.747 1.563 1.00 15.00 H new ATOM 0 HB2 ASN A 59 -8.223 -4.097 2.010 1.00 15.00 H new ATOM 0 HB3 ASN A 59 -8.499 -5.760 2.490 1.00 15.00 H new ATOM 0 HD21 ASN A 59 -7.480 -3.452 5.410 1.00 15.00 H new ATOM 0 HD22 ASN A 59 -8.593 -3.211 4.059 1.00 15.00 H new ATOM 908 N PRO A 60 -4.889 -7.152 1.542 1.00 15.00 N ATOM 909 CA PRO A 60 -4.314 -8.450 1.844 1.00 15.00 C ATOM 910 C PRO A 60 -3.740 -8.517 3.258 1.00 15.00 C ATOM 911 O PRO A 60 -3.287 -9.573 3.706 1.00 15.00 O ATOM 912 CB PRO A 60 -3.202 -8.580 0.800 1.00 15.00 C ATOM 913 CG PRO A 60 -2.820 -7.183 0.417 1.00 15.00 C ATOM 914 CD PRO A 60 -3.918 -6.259 0.879 1.00 15.00 C ATOM 0 HA PRO A 60 -5.053 -9.251 1.807 1.00 15.00 H new ATOM 0 HB2 PRO A 60 -2.347 -9.119 1.208 1.00 15.00 H new ATOM 0 HB3 PRO A 60 -3.548 -9.141 -0.069 1.00 15.00 H new ATOM 0 HG2 PRO A 60 -1.871 -6.907 0.877 1.00 15.00 H new ATOM 0 HG3 PRO A 60 -2.686 -7.106 -0.662 1.00 15.00 H new ATOM 0 HD2 PRO A 60 -3.539 -5.503 1.566 1.00 15.00 H new ATOM 0 HD3 PRO A 60 -4.372 -5.730 0.041 1.00 15.00 H new ATOM 922 N ASP A 61 -3.773 -7.392 3.958 1.00 15.00 N ATOM 923 CA ASP A 61 -3.241 -7.315 5.315 1.00 15.00 C ATOM 924 C ASP A 61 -4.328 -7.612 6.339 1.00 15.00 C ATOM 925 O ASP A 61 -4.038 -8.052 7.450 1.00 15.00 O ATOM 926 CB ASP A 61 -2.645 -5.926 5.574 1.00 15.00 C ATOM 927 CG ASP A 61 -2.085 -5.778 6.978 1.00 15.00 C ATOM 928 OD1 ASP A 61 -2.785 -5.230 7.850 1.00 15.00 O ATOM 929 OD2 ASP A 61 -0.949 -6.220 7.216 1.00 15.00 O1- ATOM 0 H ASP A 61 -4.163 -6.517 3.609 1.00 15.00 H new ATOM 0 HA ASP A 61 -2.456 -8.064 5.416 1.00 15.00 H new ATOM 0 HB2 ASP A 61 -1.853 -5.735 4.850 1.00 15.00 H new ATOM 0 HB3 ASP A 61 -3.414 -5.170 5.413 1.00 15.00 H new ATOM 934 N ARG A 62 -5.582 -7.376 5.938 1.00 15.00 N ATOM 935 CA ARG A 62 -6.749 -7.591 6.796 1.00 15.00 C ATOM 936 C ARG A 62 -6.823 -6.494 7.853 1.00 15.00 C ATOM 937 O ARG A 62 -7.414 -6.678 8.920 1.00 15.00 O ATOM 938 CB ARG A 62 -6.716 -8.972 7.472 1.00 15.00 C ATOM 939 CG ARG A 62 -6.590 -10.137 6.502 1.00 15.00 C ATOM 940 CD ARG A 62 -6.662 -11.473 7.224 1.00 15.00 C ATOM 941 NE ARG A 62 -5.353 -11.924 7.695 1.00 15.00 N ATOM 942 CZ ARG A 62 -4.889 -11.730 8.932 1.00 15.00 C ATOM 943 NH1 ARG A 62 -5.622 -11.094 9.839 1.00 15.00 N1+ ATOM 944 NH2 ARG A 62 -3.688 -12.184 9.263 1.00 15.00 N ATOM 0 H ARG A 62 -5.815 -7.030 5.007 1.00 15.00 H new ATOM 0 HA ARG A 62 -7.637 -7.554 6.165 1.00 15.00 H new ATOM 0 HB2 ARG A 62 -5.879 -9.003 8.170 1.00 15.00 H new ATOM 0 HB3 ARG A 62 -7.626 -9.099 8.059 1.00 15.00 H new ATOM 0 HG2 ARG A 62 -7.385 -10.081 5.759 1.00 15.00 H new ATOM 0 HG3 ARG A 62 -5.645 -10.063 5.964 1.00 15.00 H new ATOM 0 HD2 ARG A 62 -7.341 -11.388 8.073 1.00 15.00 H new ATOM 0 HD3 ARG A 62 -7.082 -12.223 6.554 1.00 15.00 H new ATOM 0 HE ARG A 62 -4.754 -12.420 7.034 1.00 15.00 H new ATOM 0 HH11 ARG A 62 -6.550 -10.748 9.594 1.00 15.00 H new ATOM 0 HH12 ARG A 62 -5.257 -10.952 10.781 1.00 15.00 H new ATOM 0 HH21 ARG A 62 -3.122 -12.679 8.574 1.00 15.00 H new ATOM 0 HH22 ARG A 62 -3.330 -12.038 10.207 1.00 15.00 H new ATOM 958 N ASP A 63 -6.233 -5.346 7.536 1.00 15.00 N ATOM 959 CA ASP A 63 -6.199 -4.207 8.449 1.00 15.00 C ATOM 960 C ASP A 63 -7.546 -3.482 8.518 1.00 15.00 C ATOM 961 O ASP A 63 -8.552 -3.954 7.982 1.00 15.00 O ATOM 962 CB ASP A 63 -5.078 -3.232 8.072 1.00 15.00 C ATOM 963 CG ASP A 63 -5.404 -2.381 6.866 1.00 15.00 C ATOM 964 OD1 ASP A 63 -5.945 -1.269 7.055 1.00 15.00 O ATOM 965 OD2 ASP A 63 -5.109 -2.815 5.737 1.00 15.00 O1- ATOM 0 H ASP A 63 -5.767 -5.178 6.644 1.00 15.00 H new ATOM 0 HA ASP A 63 -5.993 -4.603 9.443 1.00 15.00 H new ATOM 0 HB2 ASP A 63 -4.871 -2.581 8.922 1.00 15.00 H new ATOM 0 HB3 ASP A 63 -4.167 -3.796 7.874 1.00 15.00 H new ATOM 970 N LEU A 64 -7.541 -2.340 9.198 1.00 15.00 N ATOM 971 CA LEU A 64 -8.736 -1.530 9.422 1.00 15.00 C ATOM 972 C LEU A 64 -9.458 -1.098 8.140 1.00 15.00 C ATOM 973 O LEU A 64 -10.690 -1.028 8.133 1.00 15.00 O ATOM 974 CB LEU A 64 -8.384 -0.281 10.239 1.00 15.00 C ATOM 975 CG LEU A 64 -8.188 -0.508 11.741 1.00 15.00 C ATOM 976 CD1 LEU A 64 -6.790 -1.026 12.028 1.00 15.00 C ATOM 977 CD2 LEU A 64 -8.450 0.776 12.510 1.00 15.00 C ATOM 0 H LEU A 64 -6.698 -1.945 9.614 1.00 15.00 H new ATOM 0 HA LEU A 64 -9.424 -2.176 9.967 1.00 15.00 H new ATOM 0 HB2 LEU A 64 -7.470 0.152 9.833 1.00 15.00 H new ATOM 0 HB3 LEU A 64 -9.175 0.457 10.101 1.00 15.00 H new ATOM 0 HG LEU A 64 -8.904 -1.261 12.071 1.00 15.00 H new ATOM 0 HD11 LEU A 64 -6.672 -1.180 13.101 1.00 15.00 H new ATOM 0 HD12 LEU A 64 -6.638 -1.971 11.507 1.00 15.00 H new ATOM 0 HD13 LEU A 64 -6.055 -0.299 11.683 1.00 15.00 H new ATOM 0 HD21 LEU A 64 -8.306 0.598 13.576 1.00 15.00 H new ATOM 0 HD22 LEU A 64 -7.758 1.548 12.175 1.00 15.00 H new ATOM 0 HD23 LEU A 64 -9.474 1.104 12.332 1.00 15.00 H new ATOM 989 N ARG A 65 -8.730 -0.797 7.069 1.00 15.00 N ATOM 990 CA ARG A 65 -9.381 -0.345 5.839 1.00 15.00 C ATOM 991 C ARG A 65 -8.513 -0.580 4.606 1.00 15.00 C ATOM 992 O ARG A 65 -7.290 -0.531 4.687 1.00 15.00 O ATOM 993 CB ARG A 65 -9.730 1.141 5.952 1.00 15.00 C ATOM 994 CG ARG A 65 -8.597 1.994 6.496 1.00 15.00 C ATOM 995 CD ARG A 65 -9.085 3.379 6.878 1.00 15.00 C ATOM 996 NE ARG A 65 -8.180 4.037 7.823 1.00 15.00 N ATOM 997 CZ ARG A 65 -8.347 5.282 8.271 1.00 15.00 C ATOM 998 NH1 ARG A 65 -9.378 6.011 7.857 1.00 15.00 N1+ ATOM 999 NH2 ARG A 65 -7.489 5.791 9.144 1.00 15.00 N ATOM 0 H ARG A 65 -7.713 -0.855 7.024 1.00 15.00 H new ATOM 0 HA ARG A 65 -10.290 -0.933 5.716 1.00 15.00 H new ATOM 0 HB2 ARG A 65 -10.014 1.514 4.968 1.00 15.00 H new ATOM 0 HB3 ARG A 65 -10.600 1.253 6.599 1.00 15.00 H new ATOM 0 HG2 ARG A 65 -8.158 1.507 7.367 1.00 15.00 H new ATOM 0 HG3 ARG A 65 -7.809 2.077 5.747 1.00 15.00 H new ATOM 0 HD2 ARG A 65 -9.180 3.991 5.981 1.00 15.00 H new ATOM 0 HD3 ARG A 65 -10.079 3.305 7.319 1.00 15.00 H new ATOM 0 HE ARG A 65 -7.373 3.511 8.159 1.00 15.00 H new ATOM 0 HH11 ARG A 65 -10.046 5.619 7.194 1.00 15.00 H new ATOM 0 HH12 ARG A 65 -9.501 6.963 8.203 1.00 15.00 H new ATOM 0 HH21 ARG A 65 -6.702 5.231 9.472 1.00 15.00 H new ATOM 0 HH22 ARG A 65 -7.615 6.743 9.488 1.00 15.00 H new ATOM 1013 N PRO A 66 -9.150 -0.836 3.443 1.00 15.00 N ATOM 1014 CA PRO A 66 -8.440 -1.077 2.178 1.00 15.00 C ATOM 1015 C PRO A 66 -7.546 0.094 1.774 1.00 15.00 C ATOM 1016 O PRO A 66 -7.844 1.259 2.060 1.00 15.00 O ATOM 1017 CB PRO A 66 -9.566 -1.268 1.156 1.00 15.00 C ATOM 1018 CG PRO A 66 -10.767 -1.625 1.958 1.00 15.00 C ATOM 1019 CD PRO A 66 -10.613 -0.904 3.264 1.00 15.00 C ATOM 0 HA PRO A 66 -7.769 -1.932 2.253 1.00 15.00 H new ATOM 0 HB2 PRO A 66 -9.734 -0.358 0.581 1.00 15.00 H new ATOM 0 HB3 PRO A 66 -9.321 -2.055 0.443 1.00 15.00 H new ATOM 0 HG2 PRO A 66 -11.682 -1.322 1.449 1.00 15.00 H new ATOM 0 HG3 PRO A 66 -10.830 -2.702 2.111 1.00 15.00 H new ATOM 0 HD2 PRO A 66 -11.061 0.089 3.231 1.00 15.00 H new ATOM 0 HD3 PRO A 66 -11.094 -1.443 4.080 1.00 15.00 H new ATOM 1027 N TRP A 67 -6.456 -0.230 1.102 1.00 15.00 N ATOM 1028 CA TRP A 67 -5.498 0.764 0.655 1.00 15.00 C ATOM 1029 C TRP A 67 -4.926 0.366 -0.695 1.00 15.00 C ATOM 1030 O TRP A 67 -5.255 -0.696 -1.231 1.00 15.00 O ATOM 1031 CB TRP A 67 -4.368 0.916 1.680 1.00 15.00 C ATOM 1032 CG TRP A 67 -3.855 -0.396 2.194 1.00 15.00 C ATOM 1033 CD1 TRP A 67 -4.413 -1.154 3.180 1.00 15.00 C ATOM 1034 CD2 TRP A 67 -2.686 -1.102 1.757 1.00 15.00 C ATOM 1035 NE1 TRP A 67 -3.676 -2.291 3.378 1.00 15.00 N ATOM 1036 CE2 TRP A 67 -2.607 -2.284 2.518 1.00 15.00 C ATOM 1037 CE3 TRP A 67 -1.701 -0.853 0.797 1.00 15.00 C ATOM 1038 CZ2 TRP A 67 -1.582 -3.212 2.348 1.00 15.00 C ATOM 1039 CZ3 TRP A 67 -0.685 -1.774 0.628 1.00 15.00 C ATOM 1040 CH2 TRP A 67 -0.632 -2.942 1.399 1.00 15.00 C ATOM 0 H TRP A 67 -6.211 -1.188 0.851 1.00 15.00 H new ATOM 0 HA TRP A 67 -6.010 1.721 0.556 1.00 15.00 H new ATOM 0 HB2 TRP A 67 -3.545 1.467 1.225 1.00 15.00 H new ATOM 0 HB3 TRP A 67 -4.725 1.513 2.519 1.00 15.00 H new ATOM 0 HD1 TRP A 67 -5.308 -0.895 3.727 1.00 15.00 H new ATOM 0 HE1 TRP A 67 -3.887 -3.024 4.055 1.00 15.00 H new ATOM 0 HE3 TRP A 67 -1.734 0.045 0.197 1.00 15.00 H new ATOM 0 HZ2 TRP A 67 -1.538 -4.112 2.943 1.00 15.00 H new ATOM 0 HZ3 TRP A 67 0.081 -1.590 -0.111 1.00 15.00 H new ATOM 0 HH2 TRP A 67 0.174 -3.644 1.242 1.00 15.00 H new ATOM 1051 N CYS A 68 -4.091 1.224 -1.250 1.00 15.00 N ATOM 1052 CA CYS A 68 -3.466 0.957 -2.530 1.00 15.00 C ATOM 1053 C CYS A 68 -2.224 1.815 -2.696 1.00 15.00 C ATOM 1054 O CYS A 68 -2.096 2.866 -2.063 1.00 15.00 O ATOM 1055 CB CYS A 68 -4.449 1.210 -3.674 1.00 15.00 C ATOM 1056 SG CYS A 68 -5.740 2.418 -3.294 1.00 15.00 S ATOM 0 H CYS A 68 -3.829 2.116 -0.831 1.00 15.00 H new ATOM 0 HA CYS A 68 -3.172 -0.092 -2.560 1.00 15.00 H new ATOM 0 HB2 CYS A 68 -3.892 1.553 -4.546 1.00 15.00 H new ATOM 0 HB3 CYS A 68 -4.920 0.266 -3.948 1.00 15.00 H new ATOM 0 HG CYS A 68 -6.766 1.809 -2.778 1.00 15.00 H new ATOM 1062 N PHE A 69 -1.306 1.356 -3.533 1.00 15.00 N ATOM 1063 CA PHE A 69 -0.069 2.077 -3.778 1.00 15.00 C ATOM 1064 C PHE A 69 -0.316 3.243 -4.721 1.00 15.00 C ATOM 1065 O PHE A 69 -1.009 3.102 -5.730 1.00 15.00 O ATOM 1066 CB PHE A 69 0.990 1.141 -4.363 1.00 15.00 C ATOM 1067 CG PHE A 69 1.548 0.159 -3.368 1.00 15.00 C ATOM 1068 CD1 PHE A 69 2.153 0.607 -2.202 1.00 15.00 C ATOM 1069 CD2 PHE A 69 1.468 -1.207 -3.596 1.00 15.00 C ATOM 1070 CE1 PHE A 69 2.669 -0.287 -1.287 1.00 15.00 C ATOM 1071 CE2 PHE A 69 1.984 -2.105 -2.681 1.00 15.00 C ATOM 1072 CZ PHE A 69 2.585 -1.643 -1.524 1.00 15.00 C ATOM 0 H PHE A 69 -1.396 0.484 -4.055 1.00 15.00 H new ATOM 0 HA PHE A 69 0.298 2.465 -2.828 1.00 15.00 H new ATOM 0 HB2 PHE A 69 0.555 0.591 -5.197 1.00 15.00 H new ATOM 0 HB3 PHE A 69 1.807 1.739 -4.767 1.00 15.00 H new ATOM 0 HD1 PHE A 69 2.221 1.667 -2.009 1.00 15.00 H new ATOM 0 HD2 PHE A 69 0.998 -1.572 -4.497 1.00 15.00 H new ATOM 0 HE1 PHE A 69 3.139 0.075 -0.385 1.00 15.00 H new ATOM 0 HE2 PHE A 69 1.918 -3.166 -2.869 1.00 15.00 H new ATOM 0 HZ PHE A 69 2.988 -2.343 -0.807 1.00 15.00 H new ATOM 1082 N THR A 70 0.244 4.389 -4.389 1.00 15.00 N ATOM 1083 CA THR A 70 0.086 5.574 -5.205 1.00 15.00 C ATOM 1084 C THR A 70 1.276 5.755 -6.137 1.00 15.00 C ATOM 1085 O THR A 70 2.395 5.349 -5.816 1.00 15.00 O ATOM 1086 CB THR A 70 -0.076 6.823 -4.324 1.00 15.00 C ATOM 1087 OG1 THR A 70 0.659 6.656 -3.107 1.00 15.00 O ATOM 1088 CG2 THR A 70 -1.542 7.069 -4.005 1.00 15.00 C ATOM 0 H THR A 70 0.815 4.524 -3.555 1.00 15.00 H new ATOM 0 HA THR A 70 -0.814 5.445 -5.806 1.00 15.00 H new ATOM 0 HB THR A 70 0.311 7.683 -4.870 1.00 15.00 H new ATOM 0 HG1 THR A 70 1.618 6.742 -3.290 1.00 15.00 H new ATOM 0 HG21 THR A 70 -1.634 7.958 -3.381 1.00 15.00 H new ATOM 0 HG22 THR A 70 -2.096 7.218 -4.932 1.00 15.00 H new ATOM 0 HG23 THR A 70 -1.948 6.208 -3.474 1.00 15.00 H new ATOM 1096 N THR A 71 1.028 6.346 -7.294 1.00 15.00 N ATOM 1097 CA THR A 71 2.083 6.582 -8.267 1.00 15.00 C ATOM 1098 C THR A 71 2.856 7.860 -7.946 1.00 15.00 C ATOM 1099 O THR A 71 3.962 8.070 -8.450 1.00 15.00 O ATOM 1100 CB THR A 71 1.497 6.681 -9.685 1.00 15.00 C ATOM 1101 OG1 THR A 71 0.173 7.224 -9.616 1.00 15.00 O ATOM 1102 CG2 THR A 71 1.456 5.317 -10.359 1.00 15.00 C ATOM 0 H THR A 71 0.105 6.671 -7.583 1.00 15.00 H new ATOM 0 HA THR A 71 2.770 5.737 -8.218 1.00 15.00 H new ATOM 0 HB THR A 71 2.137 7.334 -10.278 1.00 15.00 H new ATOM 0 HG1 THR A 71 0.038 7.851 -10.357 1.00 15.00 H new ATOM 0 HG21 THR A 71 1.037 5.418 -11.360 1.00 15.00 H new ATOM 0 HG22 THR A 71 2.467 4.915 -10.428 1.00 15.00 H new ATOM 0 HG23 THR A 71 0.835 4.640 -9.773 1.00 15.00 H new ATOM 1110 N ASP A 72 2.267 8.702 -7.098 1.00 15.00 N ATOM 1111 CA ASP A 72 2.885 9.966 -6.708 1.00 15.00 C ATOM 1112 C ASP A 72 4.177 9.719 -5.939 1.00 15.00 C ATOM 1113 O ASP A 72 4.184 8.992 -4.949 1.00 15.00 O ATOM 1114 CB ASP A 72 1.917 10.797 -5.866 1.00 15.00 C ATOM 1115 CG ASP A 72 1.331 11.960 -6.645 1.00 15.00 C ATOM 1116 OD1 ASP A 72 1.677 13.123 -6.340 1.00 15.00 O ATOM 1117 OD2 ASP A 72 0.518 11.719 -7.564 1.00 15.00 O1- ATOM 0 H ASP A 72 1.359 8.529 -6.667 1.00 15.00 H new ATOM 0 HA ASP A 72 3.125 10.522 -7.614 1.00 15.00 H new ATOM 0 HB2 ASP A 72 1.110 10.158 -5.508 1.00 15.00 H new ATOM 0 HB3 ASP A 72 2.437 11.177 -4.986 1.00 15.00 H new ATOM 1122 N PRO A 73 5.285 10.341 -6.380 1.00 15.00 N ATOM 1123 CA PRO A 73 6.608 10.169 -5.757 1.00 15.00 C ATOM 1124 C PRO A 73 6.685 10.577 -4.279 1.00 15.00 C ATOM 1125 O PRO A 73 7.675 10.277 -3.604 1.00 15.00 O ATOM 1126 CB PRO A 73 7.516 11.080 -6.590 1.00 15.00 C ATOM 1127 CG PRO A 73 6.799 11.300 -7.873 1.00 15.00 C ATOM 1128 CD PRO A 73 5.338 11.256 -7.540 1.00 15.00 C ATOM 0 HA PRO A 73 6.884 9.115 -5.753 1.00 15.00 H new ATOM 0 HB2 PRO A 73 7.699 12.024 -6.077 1.00 15.00 H new ATOM 0 HB3 PRO A 73 8.487 10.615 -6.759 1.00 15.00 H new ATOM 0 HG2 PRO A 73 7.071 12.260 -8.313 1.00 15.00 H new ATOM 0 HG3 PRO A 73 7.057 10.531 -8.601 1.00 15.00 H new ATOM 0 HD2 PRO A 73 4.951 12.244 -7.292 1.00 15.00 H new ATOM 0 HD3 PRO A 73 4.745 10.883 -8.375 1.00 15.00 H new ATOM 1136 N ASN A 74 5.663 11.252 -3.768 1.00 15.00 N ATOM 1137 CA ASN A 74 5.675 11.689 -2.374 1.00 15.00 C ATOM 1138 C ASN A 74 4.812 10.796 -1.483 1.00 15.00 C ATOM 1139 O ASN A 74 4.801 10.965 -0.261 1.00 15.00 O ATOM 1140 CB ASN A 74 5.207 13.147 -2.257 1.00 15.00 C ATOM 1141 CG ASN A 74 3.695 13.298 -2.277 1.00 15.00 C ATOM 1142 OD1 ASN A 74 2.989 12.594 -2.999 1.00 15.00 O ATOM 1143 ND2 ASN A 74 3.189 14.222 -1.479 1.00 15.00 N ATOM 0 H ASN A 74 4.824 11.507 -4.289 1.00 15.00 H new ATOM 0 HA ASN A 74 6.706 11.611 -2.028 1.00 15.00 H new ATOM 0 HB2 ASN A 74 5.595 13.572 -1.332 1.00 15.00 H new ATOM 0 HB3 ASN A 74 5.633 13.725 -3.077 1.00 15.00 H new ATOM 0 HD21 ASN A 74 2.181 14.371 -1.447 1.00 15.00 H new ATOM 0 HD22 ASN A 74 3.807 14.786 -0.895 1.00 15.00 H new ATOM 1150 N LYS A 75 4.105 9.842 -2.079 1.00 15.00 N ATOM 1151 CA LYS A 75 3.236 8.957 -1.310 1.00 15.00 C ATOM 1152 C LYS A 75 3.438 7.502 -1.706 1.00 15.00 C ATOM 1153 O LYS A 75 3.460 7.161 -2.890 1.00 15.00 O ATOM 1154 CB LYS A 75 1.766 9.357 -1.504 1.00 15.00 C ATOM 1155 CG LYS A 75 1.019 9.603 -0.199 1.00 15.00 C ATOM 1156 CD LYS A 75 1.588 10.792 0.556 1.00 15.00 C ATOM 1157 CE LYS A 75 0.731 11.163 1.757 1.00 15.00 C ATOM 1158 NZ LYS A 75 0.663 10.066 2.758 1.00 15.00 N1+ ATOM 0 H LYS A 75 4.115 9.662 -3.083 1.00 15.00 H new ATOM 0 HA LYS A 75 3.500 9.060 -0.257 1.00 15.00 H new ATOM 0 HB2 LYS A 75 1.722 10.260 -2.113 1.00 15.00 H new ATOM 0 HB3 LYS A 75 1.256 8.572 -2.062 1.00 15.00 H new ATOM 0 HG2 LYS A 75 -0.036 9.777 -0.410 1.00 15.00 H new ATOM 0 HG3 LYS A 75 1.076 8.713 0.427 1.00 15.00 H new ATOM 0 HD2 LYS A 75 2.600 10.560 0.889 1.00 15.00 H new ATOM 0 HD3 LYS A 75 1.662 11.647 -0.116 1.00 15.00 H new ATOM 0 HE2 LYS A 75 1.137 12.058 2.228 1.00 15.00 H new ATOM 0 HE3 LYS A 75 -0.276 11.409 1.421 1.00 15.00 H new ATOM 0 HZ1 LYS A 75 0.374 10.454 3.679 1.00 15.00 H new ATOM 0 HZ2 LYS A 75 -0.031 9.356 2.448 1.00 15.00 H new ATOM 0 HZ3 LYS A 75 1.598 9.620 2.848 1.00 15.00 H new ATOM 1172 N ARG A 76 3.583 6.644 -0.710 1.00 15.00 N ATOM 1173 CA ARG A 76 3.778 5.222 -0.954 1.00 15.00 C ATOM 1174 C ARG A 76 2.431 4.535 -1.151 1.00 15.00 C ATOM 1175 O ARG A 76 2.165 3.939 -2.196 1.00 15.00 O ATOM 1176 CB ARG A 76 4.533 4.577 0.212 1.00 15.00 C ATOM 1177 CG ARG A 76 5.866 5.239 0.514 1.00 15.00 C ATOM 1178 CD ARG A 76 7.036 4.344 0.142 1.00 15.00 C ATOM 1179 NE ARG A 76 7.513 3.561 1.285 1.00 15.00 N ATOM 1180 CZ ARG A 76 8.741 3.654 1.805 1.00 15.00 C ATOM 1181 NH1 ARG A 76 9.627 4.503 1.292 1.00 15.00 N1+ ATOM 1182 NH2 ARG A 76 9.092 2.886 2.825 1.00 15.00 N ATOM 0 H ARG A 76 3.570 6.906 0.276 1.00 15.00 H new ATOM 0 HA ARG A 76 4.372 5.103 -1.860 1.00 15.00 H new ATOM 0 HB2 ARG A 76 3.908 4.615 1.104 1.00 15.00 H new ATOM 0 HB3 ARG A 76 4.703 3.524 -0.014 1.00 15.00 H new ATOM 0 HG2 ARG A 76 5.938 6.178 -0.034 1.00 15.00 H new ATOM 0 HG3 ARG A 76 5.918 5.484 1.575 1.00 15.00 H new ATOM 0 HD2 ARG A 76 6.736 3.669 -0.660 1.00 15.00 H new ATOM 0 HD3 ARG A 76 7.852 4.955 -0.244 1.00 15.00 H new ATOM 0 HE ARG A 76 6.864 2.900 1.713 1.00 15.00 H new ATOM 0 HH11 ARG A 76 9.371 5.088 0.497 1.00 15.00 H new ATOM 0 HH12 ARG A 76 10.562 4.569 1.694 1.00 15.00 H new ATOM 0 HH21 ARG A 76 8.425 2.221 3.216 1.00 15.00 H new ATOM 0 HH22 ARG A 76 10.030 2.959 3.220 1.00 15.00 H new ATOM 1196 N TRP A 77 1.580 4.637 -0.141 1.00 15.00 N ATOM 1197 CA TRP A 77 0.250 4.041 -0.184 1.00 15.00 C ATOM 1198 C TRP A 77 -0.717 4.883 0.631 1.00 15.00 C ATOM 1199 O TRP A 77 -0.338 5.465 1.647 1.00 15.00 O ATOM 1200 CB TRP A 77 0.275 2.603 0.350 1.00 15.00 C ATOM 1201 CG TRP A 77 1.111 2.433 1.583 1.00 15.00 C ATOM 1202 CD1 TRP A 77 2.440 2.144 1.626 1.00 15.00 C ATOM 1203 CD2 TRP A 77 0.679 2.541 2.945 1.00 15.00 C ATOM 1204 NE1 TRP A 77 2.866 2.072 2.926 1.00 15.00 N ATOM 1205 CE2 TRP A 77 1.805 2.308 3.757 1.00 15.00 C ATOM 1206 CE3 TRP A 77 -0.545 2.811 3.555 1.00 15.00 C ATOM 1207 CZ2 TRP A 77 1.740 2.341 5.148 1.00 15.00 C ATOM 1208 CZ3 TRP A 77 -0.610 2.843 4.932 1.00 15.00 C ATOM 1209 CH2 TRP A 77 0.525 2.609 5.718 1.00 15.00 C ATOM 0 H TRP A 77 1.788 5.131 0.727 1.00 15.00 H new ATOM 0 HA TRP A 77 -0.082 4.012 -1.222 1.00 15.00 H new ATOM 0 HB2 TRP A 77 -0.746 2.288 0.567 1.00 15.00 H new ATOM 0 HB3 TRP A 77 0.654 1.942 -0.429 1.00 15.00 H new ATOM 0 HD1 TRP A 77 3.068 1.993 0.760 1.00 15.00 H new ATOM 0 HE1 TRP A 77 3.821 1.874 3.226 1.00 15.00 H new ATOM 0 HE3 TRP A 77 -1.427 2.992 2.959 1.00 15.00 H new ATOM 0 HZ2 TRP A 77 2.616 2.162 5.754 1.00 15.00 H new ATOM 0 HZ3 TRP A 77 -1.554 3.052 5.413 1.00 15.00 H new ATOM 0 HH2 TRP A 77 0.440 2.641 6.794 1.00 15.00 H new ATOM 1220 N GLU A 78 -1.956 4.958 0.176 1.00 15.00 N ATOM 1221 CA GLU A 78 -2.975 5.730 0.870 1.00 15.00 C ATOM 1222 C GLU A 78 -4.211 4.874 1.112 1.00 15.00 C ATOM 1223 O GLU A 78 -4.523 3.980 0.322 1.00 15.00 O ATOM 1224 CB GLU A 78 -3.351 6.976 0.063 1.00 15.00 C ATOM 1225 CG GLU A 78 -2.272 8.048 0.039 1.00 15.00 C ATOM 1226 CD GLU A 78 -2.138 8.778 1.361 1.00 15.00 C ATOM 1227 OE1 GLU A 78 -1.299 8.375 2.192 1.00 15.00 O ATOM 1228 OE2 GLU A 78 -2.865 9.776 1.569 1.00 15.00 O1- ATOM 0 H GLU A 78 -2.282 4.494 -0.672 1.00 15.00 H new ATOM 0 HA GLU A 78 -2.570 6.047 1.831 1.00 15.00 H new ATOM 0 HB2 GLU A 78 -3.576 6.678 -0.961 1.00 15.00 H new ATOM 0 HB3 GLU A 78 -4.264 7.403 0.478 1.00 15.00 H new ATOM 0 HG2 GLU A 78 -1.317 7.589 -0.216 1.00 15.00 H new ATOM 0 HG3 GLU A 78 -2.500 8.768 -0.747 1.00 15.00 H new ATOM 1235 N TYR A 79 -4.903 5.148 2.208 1.00 15.00 N ATOM 1236 CA TYR A 79 -6.107 4.408 2.561 1.00 15.00 C ATOM 1237 C TYR A 79 -7.300 4.901 1.752 1.00 15.00 C ATOM 1238 O TYR A 79 -7.287 6.013 1.216 1.00 15.00 O ATOM 1239 CB TYR A 79 -6.419 4.569 4.051 1.00 15.00 C ATOM 1240 CG TYR A 79 -5.436 3.897 4.978 1.00 15.00 C ATOM 1241 CD1 TYR A 79 -4.654 4.645 5.850 1.00 15.00 C ATOM 1242 CD2 TYR A 79 -5.300 2.513 4.997 1.00 15.00 C ATOM 1243 CE1 TYR A 79 -3.765 4.035 6.710 1.00 15.00 C ATOM 1244 CE2 TYR A 79 -4.412 1.899 5.854 1.00 15.00 C ATOM 1245 CZ TYR A 79 -3.649 2.664 6.707 1.00 15.00 C ATOM 1246 OH TYR A 79 -2.765 2.054 7.566 1.00 15.00 O ATOM 0 H TYR A 79 -4.650 5.881 2.871 1.00 15.00 H new ATOM 0 HA TYR A 79 -5.927 3.357 2.337 1.00 15.00 H new ATOM 0 HB2 TYR A 79 -6.453 5.632 4.288 1.00 15.00 H new ATOM 0 HB3 TYR A 79 -7.414 4.167 4.245 1.00 15.00 H new ATOM 0 HD1 TYR A 79 -4.744 5.721 5.854 1.00 15.00 H new ATOM 0 HD2 TYR A 79 -5.899 1.910 4.330 1.00 15.00 H new ATOM 0 HE1 TYR A 79 -3.164 4.630 7.382 1.00 15.00 H new ATOM 0 HE2 TYR A 79 -4.315 0.823 5.856 1.00 15.00 H new ATOM 0 HH TYR A 79 -1.874 2.033 7.158 1.00 15.00 H new ATOM 1256 N CYS A 80 -8.323 4.074 1.657 1.00 15.00 N ATOM 1257 CA CYS A 80 -9.534 4.437 0.945 1.00 15.00 C ATOM 1258 C CYS A 80 -10.722 4.350 1.898 1.00 15.00 C ATOM 1259 O CYS A 80 -10.849 3.380 2.645 1.00 15.00 O ATOM 1260 CB CYS A 80 -9.744 3.516 -0.259 1.00 15.00 C ATOM 1261 SG CYS A 80 -10.750 4.243 -1.579 1.00 15.00 S ATOM 0 H CYS A 80 -8.340 3.140 2.067 1.00 15.00 H new ATOM 0 HA CYS A 80 -9.443 5.458 0.576 1.00 15.00 H new ATOM 0 HB2 CYS A 80 -8.771 3.242 -0.667 1.00 15.00 H new ATOM 0 HB3 CYS A 80 -10.219 2.595 0.080 1.00 15.00 H new ATOM 0 HG CYS A 80 -10.013 4.432 -2.633 1.00 15.00 H new ATOM 1267 N ASP A 81 -11.572 5.368 1.896 1.00 15.00 N ATOM 1268 CA ASP A 81 -12.734 5.384 2.777 1.00 15.00 C ATOM 1269 C ASP A 81 -13.965 4.880 2.044 1.00 15.00 C ATOM 1270 O ASP A 81 -14.431 5.504 1.090 1.00 15.00 O ATOM 1271 CB ASP A 81 -12.989 6.791 3.314 1.00 15.00 C ATOM 1272 CG ASP A 81 -14.156 6.833 4.281 1.00 15.00 C ATOM 1273 OD1 ASP A 81 -14.141 6.071 5.274 1.00 15.00 O ATOM 1274 OD2 ASP A 81 -15.089 7.632 4.056 1.00 15.00 O1- ATOM 0 H ASP A 81 -11.481 6.189 1.298 1.00 15.00 H new ATOM 0 HA ASP A 81 -12.527 4.722 3.618 1.00 15.00 H new ATOM 0 HB2 ASP A 81 -12.092 7.155 3.814 1.00 15.00 H new ATOM 0 HB3 ASP A 81 -13.185 7.466 2.481 1.00 15.00 H new ATOM 1279 N ILE A 82 -14.470 3.738 2.480 1.00 15.00 N ATOM 1280 CA ILE A 82 -15.646 3.139 1.873 1.00 15.00 C ATOM 1281 C ILE A 82 -16.755 3.008 2.916 1.00 15.00 C ATOM 1282 O ILE A 82 -16.504 2.522 4.021 1.00 15.00 O ATOM 1283 CB ILE A 82 -15.311 1.750 1.285 1.00 15.00 C ATOM 1284 CG1 ILE A 82 -14.172 1.867 0.268 1.00 15.00 C ATOM 1285 CG2 ILE A 82 -16.541 1.125 0.634 1.00 15.00 C ATOM 1286 CD1 ILE A 82 -13.315 0.625 0.168 1.00 15.00 C ATOM 0 H ILE A 82 -14.081 3.205 3.257 1.00 15.00 H new ATOM 0 HA ILE A 82 -15.985 3.784 1.062 1.00 15.00 H new ATOM 0 HB ILE A 82 -14.991 1.101 2.100 1.00 15.00 H new ATOM 0 HG12 ILE A 82 -14.594 2.086 -0.713 1.00 15.00 H new ATOM 0 HG13 ILE A 82 -13.540 2.713 0.539 1.00 15.00 H new ATOM 0 HG21 ILE A 82 -16.280 0.148 0.227 1.00 15.00 H new ATOM 0 HG22 ILE A 82 -17.328 1.010 1.379 1.00 15.00 H new ATOM 0 HG23 ILE A 82 -16.894 1.770 -0.170 1.00 15.00 H new ATOM 0 HD11 ILE A 82 -12.530 0.783 -0.572 1.00 15.00 H new ATOM 0 HD12 ILE A 82 -12.863 0.416 1.138 1.00 15.00 H new ATOM 0 HD13 ILE A 82 -13.933 -0.220 -0.134 1.00 15.00 H new ATOM 1298 N PRO A 83 -17.978 3.478 2.594 1.00 15.00 N ATOM 1299 CA PRO A 83 -19.132 3.406 3.504 1.00 15.00 C ATOM 1300 C PRO A 83 -19.334 2.012 4.095 1.00 15.00 C ATOM 1301 O PRO A 83 -19.477 1.024 3.370 1.00 15.00 O ATOM 1302 CB PRO A 83 -20.313 3.779 2.605 1.00 15.00 C ATOM 1303 CG PRO A 83 -19.731 4.629 1.532 1.00 15.00 C ATOM 1304 CD PRO A 83 -18.326 4.136 1.318 1.00 15.00 C ATOM 0 HA PRO A 83 -19.006 4.059 4.367 1.00 15.00 H new ATOM 0 HB2 PRO A 83 -20.788 2.890 2.190 1.00 15.00 H new ATOM 0 HB3 PRO A 83 -21.078 4.318 3.163 1.00 15.00 H new ATOM 0 HG2 PRO A 83 -20.314 4.551 0.615 1.00 15.00 H new ATOM 0 HG3 PRO A 83 -19.734 5.679 1.823 1.00 15.00 H new ATOM 0 HD2 PRO A 83 -18.271 3.439 0.482 1.00 15.00 H new ATOM 0 HD3 PRO A 83 -17.645 4.957 1.094 1.00 15.00 H new ATOM 1312 N ARG A 84 -19.343 1.942 5.415 1.00 15.00 N ATOM 1313 CA ARG A 84 -19.513 0.680 6.118 1.00 15.00 C ATOM 1314 C ARG A 84 -20.918 0.575 6.701 1.00 15.00 C ATOM 1315 O ARG A 84 -21.658 1.559 6.738 1.00 15.00 O ATOM 1316 CB ARG A 84 -18.459 0.555 7.227 1.00 15.00 C ATOM 1317 CG ARG A 84 -18.679 1.502 8.400 1.00 15.00 C ATOM 1318 CD ARG A 84 -17.387 1.777 9.156 1.00 15.00 C ATOM 1319 NE ARG A 84 -16.634 2.896 8.581 1.00 15.00 N ATOM 1320 CZ ARG A 84 -15.709 3.591 9.247 1.00 15.00 C ATOM 1321 NH1 ARG A 84 -15.418 3.288 10.505 1.00 15.00 N1+ ATOM 1322 NH2 ARG A 84 -15.080 4.602 8.657 1.00 15.00 N ATOM 0 H ARG A 84 -19.234 2.751 6.027 1.00 15.00 H new ATOM 0 HA ARG A 84 -19.379 -0.138 5.410 1.00 15.00 H new ATOM 0 HB2 ARG A 84 -18.455 -0.470 7.597 1.00 15.00 H new ATOM 0 HB3 ARG A 84 -17.474 0.744 6.801 1.00 15.00 H new ATOM 0 HG2 ARG A 84 -19.094 2.442 8.035 1.00 15.00 H new ATOM 0 HG3 ARG A 84 -19.414 1.072 9.081 1.00 15.00 H new ATOM 0 HD2 ARG A 84 -17.618 1.995 10.199 1.00 15.00 H new ATOM 0 HD3 ARG A 84 -16.766 0.881 9.148 1.00 15.00 H new ATOM 0 HE ARG A 84 -16.828 3.159 7.615 1.00 15.00 H new ATOM 0 HH11 ARG A 84 -15.902 2.520 10.970 1.00 15.00 H new ATOM 0 HH12 ARG A 84 -14.710 3.823 11.008 1.00 15.00 H new ATOM 0 HH21 ARG A 84 -15.304 4.849 7.693 1.00 15.00 H new ATOM 0 HH22 ARG A 84 -14.374 5.131 9.168 1.00 15.00 H new ATOM 1336 N CYS A 85 -21.286 -0.618 7.137 1.00 15.00 N ATOM 1337 CA CYS A 85 -22.597 -0.839 7.726 1.00 15.00 C ATOM 1338 C CYS A 85 -22.576 -0.434 9.195 1.00 15.00 C ATOM 1339 O CYS A 85 -21.510 -0.383 9.814 1.00 15.00 O ATOM 1340 CB CYS A 85 -23.006 -2.309 7.592 1.00 15.00 C ATOM 1341 SG CYS A 85 -22.698 -3.015 5.957 1.00 15.00 S ATOM 0 H CYS A 85 -20.696 -1.449 7.094 1.00 15.00 H new ATOM 0 HA CYS A 85 -23.327 -0.228 7.195 1.00 15.00 H new ATOM 0 HB2 CYS A 85 -22.466 -2.894 8.336 1.00 15.00 H new ATOM 0 HB3 CYS A 85 -24.067 -2.402 7.822 1.00 15.00 H new ATOM 0 HG CYS A 85 -21.417 -3.086 5.749 1.00 15.00 H new ATOM 1347 N ALA A 86 -23.740 -0.140 9.750 1.00 15.00 N ATOM 1348 CA ALA A 86 -23.826 0.252 11.149 1.00 15.00 C ATOM 1349 C ALA A 86 -23.567 -0.948 12.053 1.00 15.00 C ATOM 1350 O ALA A 86 -22.857 -0.843 13.057 1.00 15.00 O ATOM 1351 CB ALA A 86 -25.183 0.871 11.453 1.00 15.00 C ATOM 0 H ALA A 86 -24.633 -0.165 9.258 1.00 15.00 H new ATOM 0 HA ALA A 86 -23.060 1.003 11.344 1.00 15.00 H new ATOM 0 HB1 ALA A 86 -25.225 1.157 12.504 1.00 15.00 H new ATOM 0 HB2 ALA A 86 -25.328 1.754 10.831 1.00 15.00 H new ATOM 0 HB3 ALA A 86 -25.969 0.146 11.242 1.00 15.00 H new ATOM 1357 N ALA A 87 -24.138 -2.091 11.681 1.00 15.00 N ATOM 1358 CA ALA A 87 -23.974 -3.322 12.441 1.00 15.00 C ATOM 1359 C ALA A 87 -23.784 -4.504 11.502 1.00 15.00 C ATOM 1360 O ALA A 87 -24.733 -4.831 10.758 1.00 15.00 O ATOM 1361 CB ALA A 87 -25.169 -3.551 13.351 1.00 15.00 C ATOM 1362 OXT ALA A 87 -22.684 -5.097 11.508 1.00 15.00 O1- ATOM 0 H ALA A 87 -24.722 -2.188 10.851 1.00 15.00 H new ATOM 0 HA ALA A 87 -23.083 -3.228 13.062 1.00 15.00 H new ATOM 0 HB1 ALA A 87 -25.028 -4.476 13.911 1.00 15.00 H new ATOM 0 HB2 ALA A 87 -25.262 -2.717 14.046 1.00 15.00 H new ATOM 0 HB3 ALA A 87 -26.075 -3.625 12.750 1.00 15.00 H new ATOM 1369 N GLY B 101 22.082 2.680 -14.739 1.00 15.00 N ATOM 1370 CA GLY B 101 21.622 2.016 -13.497 1.00 15.00 C ATOM 1371 C GLY B 101 20.150 2.245 -13.250 1.00 15.00 C ATOM 1372 O GLY B 101 19.407 2.589 -14.170 1.00 15.00 O ATOM 0 HA2 GLY B 101 21.817 0.946 -13.564 1.00 15.00 H new ATOM 0 HA3 GLY B 101 22.195 2.392 -12.650 1.00 15.00 H new ATOM 1378 N SER B 102 19.727 2.054 -12.014 1.00 15.00 N ATOM 1379 CA SER B 102 18.338 2.241 -11.640 1.00 15.00 C ATOM 1380 C SER B 102 18.264 2.815 -10.228 1.00 15.00 C ATOM 1381 O SER B 102 19.169 3.540 -9.803 1.00 15.00 O ATOM 1382 CB SER B 102 17.597 0.902 -11.718 1.00 15.00 C ATOM 1383 OG SER B 102 16.201 1.090 -11.895 1.00 15.00 O ATOM 0 H SER B 102 20.333 1.767 -11.245 1.00 15.00 H new ATOM 0 HA SER B 102 17.863 2.940 -12.328 1.00 15.00 H new ATOM 0 HB2 SER B 102 17.994 0.313 -12.545 1.00 15.00 H new ATOM 0 HB3 SER B 102 17.776 0.332 -10.806 1.00 15.00 H new ATOM 0 HG SER B 102 15.757 0.218 -11.943 1.00 15.00 H new ATOM 1389 N VAL B 103 17.191 2.508 -9.509 1.00 15.00 N ATOM 1390 CA VAL B 103 17.028 2.983 -8.144 1.00 15.00 C ATOM 1391 C VAL B 103 17.959 2.207 -7.200 1.00 15.00 C ATOM 1392 O VAL B 103 17.554 1.291 -6.475 1.00 15.00 O ATOM 1393 CB VAL B 103 15.545 2.900 -7.682 1.00 15.00 C ATOM 1394 CG1 VAL B 103 14.976 1.501 -7.887 1.00 15.00 C ATOM 1395 CG2 VAL B 103 15.391 3.349 -6.233 1.00 15.00 C ATOM 0 H VAL B 103 16.422 1.932 -9.850 1.00 15.00 H new ATOM 0 HA VAL B 103 17.308 4.036 -8.112 1.00 15.00 H new ATOM 0 HB VAL B 103 14.970 3.585 -8.305 1.00 15.00 H new ATOM 0 HG11 VAL B 103 13.938 1.478 -7.554 1.00 15.00 H new ATOM 0 HG12 VAL B 103 15.024 1.240 -8.944 1.00 15.00 H new ATOM 0 HG13 VAL B 103 15.558 0.783 -7.310 1.00 15.00 H new ATOM 0 HG21 VAL B 103 14.343 3.280 -5.940 1.00 15.00 H new ATOM 0 HG22 VAL B 103 15.992 2.708 -5.588 1.00 15.00 H new ATOM 0 HG23 VAL B 103 15.728 4.381 -6.134 1.00 15.00 H new ATOM 1405 N GLU B 104 19.232 2.571 -7.240 1.00 15.00 N ATOM 1406 CA GLU B 104 20.245 1.928 -6.418 1.00 15.00 C ATOM 1407 C GLU B 104 20.413 2.649 -5.086 1.00 15.00 C ATOM 1408 O GLU B 104 21.120 2.168 -4.200 1.00 15.00 O ATOM 1409 CB GLU B 104 21.586 1.873 -7.160 1.00 15.00 C ATOM 1410 CG GLU B 104 21.808 0.583 -7.937 1.00 15.00 C ATOM 1411 CD GLU B 104 21.124 0.573 -9.289 1.00 15.00 C ATOM 1412 OE1 GLU B 104 19.973 0.096 -9.378 1.00 15.00 O ATOM 1413 OE2 GLU B 104 21.747 1.021 -10.280 1.00 15.00 O1- ATOM 0 H GLU B 104 19.590 3.315 -7.839 1.00 15.00 H new ATOM 0 HA GLU B 104 19.911 0.910 -6.216 1.00 15.00 H new ATOM 0 HB2 GLU B 104 21.644 2.715 -7.849 1.00 15.00 H new ATOM 0 HB3 GLU B 104 22.394 1.995 -6.439 1.00 15.00 H new ATOM 0 HG2 GLU B 104 22.878 0.431 -8.078 1.00 15.00 H new ATOM 0 HG3 GLU B 104 21.442 -0.257 -7.346 1.00 15.00 H new ATOM 1420 N LYS B 105 19.769 3.807 -4.949 1.00 15.00 N ATOM 1421 CA LYS B 105 19.846 4.588 -3.714 1.00 15.00 C ATOM 1422 C LYS B 105 19.304 3.778 -2.543 1.00 15.00 C ATOM 1423 O LYS B 105 19.838 3.825 -1.434 1.00 15.00 O ATOM 1424 CB LYS B 105 19.067 5.896 -3.855 1.00 15.00 C ATOM 1425 CG LYS B 105 19.364 6.899 -2.753 1.00 15.00 C ATOM 1426 CD LYS B 105 18.602 8.194 -2.960 1.00 15.00 C ATOM 1427 CE LYS B 105 19.051 9.259 -1.972 1.00 15.00 C ATOM 1428 NZ LYS B 105 18.290 10.524 -2.132 1.00 15.00 N1+ ATOM 0 H LYS B 105 19.189 4.225 -5.676 1.00 15.00 H new ATOM 0 HA LYS B 105 20.892 4.827 -3.523 1.00 15.00 H new ATOM 0 HB2 LYS B 105 19.301 6.347 -4.819 1.00 15.00 H new ATOM 0 HB3 LYS B 105 17.999 5.676 -3.857 1.00 15.00 H new ATOM 0 HG2 LYS B 105 19.098 6.469 -1.787 1.00 15.00 H new ATOM 0 HG3 LYS B 105 20.434 7.105 -2.726 1.00 15.00 H new ATOM 0 HD2 LYS B 105 18.756 8.551 -3.978 1.00 15.00 H new ATOM 0 HD3 LYS B 105 17.533 8.013 -2.843 1.00 15.00 H new ATOM 0 HE2 LYS B 105 18.925 8.886 -0.955 1.00 15.00 H new ATOM 0 HE3 LYS B 105 20.114 9.456 -2.110 1.00 15.00 H new ATOM 0 HZ1 LYS B 105 18.755 11.280 -1.590 1.00 15.00 H new ATOM 0 HZ2 LYS B 105 18.261 10.787 -3.138 1.00 15.00 H new ATOM 0 HZ3 LYS B 105 17.320 10.392 -1.781 1.00 15.00 H new ATOM 1442 N LEU B 106 18.243 3.029 -2.805 1.00 15.00 N ATOM 1443 CA LEU B 106 17.635 2.185 -1.792 1.00 15.00 C ATOM 1444 C LEU B 106 18.360 0.846 -1.752 1.00 15.00 C ATOM 1445 O LEU B 106 17.853 -0.161 -2.234 1.00 15.00 O ATOM 1446 CB LEU B 106 16.147 1.975 -2.093 1.00 15.00 C ATOM 1447 CG LEU B 106 15.181 2.911 -1.356 1.00 15.00 C ATOM 1448 CD1 LEU B 106 15.228 2.656 0.143 1.00 15.00 C ATOM 1449 CD2 LEU B 106 15.497 4.369 -1.658 1.00 15.00 C ATOM 0 H LEU B 106 17.785 2.990 -3.716 1.00 15.00 H new ATOM 0 HA LEU B 106 17.720 2.672 -0.820 1.00 15.00 H new ATOM 0 HB2 LEU B 106 15.992 2.094 -3.165 1.00 15.00 H new ATOM 0 HB3 LEU B 106 15.887 0.946 -1.845 1.00 15.00 H new ATOM 0 HG LEU B 106 14.172 2.702 -1.712 1.00 15.00 H new ATOM 0 HD11 LEU B 106 14.536 3.330 0.649 1.00 15.00 H new ATOM 0 HD12 LEU B 106 14.943 1.624 0.346 1.00 15.00 H new ATOM 0 HD13 LEU B 106 16.239 2.832 0.510 1.00 15.00 H new ATOM 0 HD21 LEU B 106 14.797 5.011 -1.123 1.00 15.00 H new ATOM 0 HD22 LEU B 106 16.514 4.595 -1.338 1.00 15.00 H new ATOM 0 HD23 LEU B 106 15.406 4.547 -2.730 1.00 15.00 H new ATOM 1461 N THR B 107 19.564 0.853 -1.205 1.00 15.00 N ATOM 1462 CA THR B 107 20.373 -0.351 -1.120 1.00 15.00 C ATOM 1463 C THR B 107 20.202 -1.056 0.222 1.00 15.00 C ATOM 1464 O THR B 107 19.656 -2.156 0.286 1.00 15.00 O ATOM 1465 CB THR B 107 21.863 -0.020 -1.336 1.00 15.00 C ATOM 1466 OG1 THR B 107 21.998 1.334 -1.798 1.00 15.00 O ATOM 1467 CG2 THR B 107 22.490 -0.969 -2.348 1.00 15.00 C ATOM 0 H THR B 107 20.005 1.684 -0.811 1.00 15.00 H new ATOM 0 HA THR B 107 20.029 -1.022 -1.907 1.00 15.00 H new ATOM 0 HB THR B 107 22.381 -0.137 -0.384 1.00 15.00 H new ATOM 0 HG1 THR B 107 21.612 1.413 -2.695 1.00 15.00 H new ATOM 0 HG21 THR B 107 23.541 -0.714 -2.483 1.00 15.00 H new ATOM 0 HG22 THR B 107 22.408 -1.994 -1.985 1.00 15.00 H new ATOM 0 HG23 THR B 107 21.970 -0.879 -3.302 1.00 15.00 H new ATOM 1475 N ALA B 108 20.642 -0.399 1.289 1.00 15.00 N ATOM 1476 CA ALA B 108 20.575 -0.968 2.631 1.00 15.00 C ATOM 1477 C ALA B 108 19.152 -1.319 3.048 1.00 15.00 C ATOM 1478 O ALA B 108 18.891 -2.428 3.512 1.00 15.00 O ATOM 1479 CB ALA B 108 21.186 -0.002 3.633 1.00 15.00 C ATOM 0 H ALA B 108 21.052 0.534 1.250 1.00 15.00 H new ATOM 0 HA ALA B 108 21.143 -1.898 2.616 1.00 15.00 H new ATOM 0 HB1 ALA B 108 21.133 -0.433 4.633 1.00 15.00 H new ATOM 0 HB2 ALA B 108 22.228 0.182 3.372 1.00 15.00 H new ATOM 0 HB3 ALA B 108 20.636 0.939 3.614 1.00 15.00 H new ATOM 1485 N ASP B 109 18.234 -0.376 2.874 1.00 15.00 N ATOM 1486 CA ASP B 109 16.839 -0.589 3.255 1.00 15.00 C ATOM 1487 C ASP B 109 16.213 -1.736 2.474 1.00 15.00 C ATOM 1488 O ASP B 109 15.565 -2.605 3.055 1.00 15.00 O ATOM 1489 CB ASP B 109 16.023 0.687 3.056 1.00 15.00 C ATOM 1490 CG ASP B 109 16.117 1.621 4.245 1.00 15.00 C ATOM 1491 OD1 ASP B 109 16.409 2.819 4.041 1.00 15.00 O ATOM 1492 OD2 ASP B 109 15.906 1.164 5.387 1.00 15.00 O1- ATOM 0 H ASP B 109 18.427 0.542 2.473 1.00 15.00 H new ATOM 0 HA ASP B 109 16.828 -0.855 4.312 1.00 15.00 H new ATOM 0 HB2 ASP B 109 16.373 1.204 2.162 1.00 15.00 H new ATOM 0 HB3 ASP B 109 14.979 0.425 2.884 1.00 15.00 H new ATOM 1497 N ALA B 110 16.433 -1.753 1.165 1.00 15.00 N ATOM 1498 CA ALA B 110 15.878 -2.798 0.317 1.00 15.00 C ATOM 1499 C ALA B 110 16.471 -4.155 0.666 1.00 15.00 C ATOM 1500 O ALA B 110 15.770 -5.164 0.663 1.00 15.00 O ATOM 1501 CB ALA B 110 16.111 -2.479 -1.149 1.00 15.00 C ATOM 0 H ALA B 110 16.990 -1.057 0.670 1.00 15.00 H new ATOM 0 HA ALA B 110 14.804 -2.840 0.496 1.00 15.00 H new ATOM 0 HB1 ALA B 110 15.689 -3.272 -1.766 1.00 15.00 H new ATOM 0 HB2 ALA B 110 15.630 -1.532 -1.396 1.00 15.00 H new ATOM 0 HB3 ALA B 110 17.182 -2.403 -1.339 1.00 15.00 H new ATOM 1507 N GLU B 111 17.763 -4.165 0.974 1.00 15.00 N ATOM 1508 CA GLU B 111 18.462 -5.391 1.336 1.00 15.00 C ATOM 1509 C GLU B 111 17.863 -5.994 2.602 1.00 15.00 C ATOM 1510 O GLU B 111 17.465 -7.157 2.615 1.00 15.00 O ATOM 1511 CB GLU B 111 19.956 -5.108 1.543 1.00 15.00 C ATOM 1512 CG GLU B 111 20.761 -6.333 1.951 1.00 15.00 C ATOM 1513 CD GLU B 111 22.253 -6.081 1.952 1.00 15.00 C ATOM 1514 OE1 GLU B 111 22.933 -6.502 0.991 1.00 15.00 O ATOM 1515 OE2 GLU B 111 22.757 -5.455 2.907 1.00 15.00 O1- ATOM 0 H GLU B 111 18.350 -3.331 0.980 1.00 15.00 H new ATOM 0 HA GLU B 111 18.347 -6.107 0.522 1.00 15.00 H new ATOM 0 HB2 GLU B 111 20.371 -4.703 0.620 1.00 15.00 H new ATOM 0 HB3 GLU B 111 20.068 -4.339 2.308 1.00 15.00 H new ATOM 0 HG2 GLU B 111 20.450 -6.651 2.946 1.00 15.00 H new ATOM 0 HG3 GLU B 111 20.536 -7.153 1.269 1.00 15.00 H new ATOM 1522 N LEU B 112 17.781 -5.185 3.652 1.00 15.00 N ATOM 1523 CA LEU B 112 17.232 -5.636 4.926 1.00 15.00 C ATOM 1524 C LEU B 112 15.768 -6.036 4.781 1.00 15.00 C ATOM 1525 O LEU B 112 15.344 -7.068 5.307 1.00 15.00 O ATOM 1526 CB LEU B 112 17.370 -4.539 5.985 1.00 15.00 C ATOM 1527 CG LEU B 112 18.806 -4.125 6.317 1.00 15.00 C ATOM 1528 CD1 LEU B 112 18.815 -2.975 7.313 1.00 15.00 C ATOM 1529 CD2 LEU B 112 19.595 -5.307 6.862 1.00 15.00 C ATOM 0 H LEU B 112 18.088 -4.212 3.646 1.00 15.00 H new ATOM 0 HA LEU B 112 17.798 -6.512 5.243 1.00 15.00 H new ATOM 0 HB2 LEU B 112 16.825 -3.658 5.645 1.00 15.00 H new ATOM 0 HB3 LEU B 112 16.887 -4.879 6.901 1.00 15.00 H new ATOM 0 HG LEU B 112 19.284 -3.789 5.397 1.00 15.00 H new ATOM 0 HD11 LEU B 112 19.845 -2.695 7.536 1.00 15.00 H new ATOM 0 HD12 LEU B 112 18.291 -2.120 6.886 1.00 15.00 H new ATOM 0 HD13 LEU B 112 18.316 -3.285 8.231 1.00 15.00 H new ATOM 0 HD21 LEU B 112 20.613 -4.991 7.091 1.00 15.00 H new ATOM 0 HD22 LEU B 112 19.117 -5.676 7.769 1.00 15.00 H new ATOM 0 HD23 LEU B 112 19.621 -6.102 6.116 1.00 15.00 H new ATOM 1541 N GLN B 113 15.007 -5.226 4.051 1.00 15.00 N ATOM 1542 CA GLN B 113 13.590 -5.491 3.839 1.00 15.00 C ATOM 1543 C GLN B 113 13.384 -6.796 3.076 1.00 15.00 C ATOM 1544 O GLN B 113 12.556 -7.622 3.464 1.00 15.00 O ATOM 1545 CB GLN B 113 12.938 -4.333 3.081 1.00 15.00 C ATOM 1546 CG GLN B 113 11.422 -4.434 2.992 1.00 15.00 C ATOM 1547 CD GLN B 113 10.763 -4.535 4.356 1.00 15.00 C ATOM 1548 OE1 GLN B 113 10.449 -3.526 4.984 1.00 15.00 O ATOM 1549 NE2 GLN B 113 10.544 -5.755 4.823 1.00 15.00 N ATOM 0 H GLN B 113 15.350 -4.380 3.596 1.00 15.00 H new ATOM 0 HA GLN B 113 13.117 -5.587 4.816 1.00 15.00 H new ATOM 0 HB2 GLN B 113 13.202 -3.396 3.571 1.00 15.00 H new ATOM 0 HB3 GLN B 113 13.350 -4.293 2.073 1.00 15.00 H new ATOM 0 HG2 GLN B 113 11.033 -3.560 2.469 1.00 15.00 H new ATOM 0 HG3 GLN B 113 11.154 -5.307 2.397 1.00 15.00 H new ATOM 0 HE21 GLN B 113 10.819 -6.569 4.273 1.00 15.00 H new ATOM 0 HE22 GLN B 113 10.101 -5.881 5.733 1.00 15.00 H new ATOM 1558 N ARG B 114 14.149 -6.984 2.004 1.00 15.00 N ATOM 1559 CA ARG B 114 14.043 -8.190 1.192 1.00 15.00 C ATOM 1560 C ARG B 114 14.490 -9.417 1.979 1.00 15.00 C ATOM 1561 O ARG B 114 13.828 -10.452 1.947 1.00 15.00 O ATOM 1562 CB ARG B 114 14.880 -8.062 -0.080 1.00 15.00 C ATOM 1563 CG ARG B 114 14.847 -9.304 -0.952 1.00 15.00 C ATOM 1564 CD ARG B 114 15.673 -9.125 -2.212 1.00 15.00 C ATOM 1565 NE ARG B 114 15.096 -8.127 -3.112 1.00 15.00 N ATOM 1566 CZ ARG B 114 15.098 -8.235 -4.442 1.00 15.00 C ATOM 1567 NH1 ARG B 114 15.639 -9.299 -5.026 1.00 15.00 N1+ ATOM 1568 NH2 ARG B 114 14.548 -7.285 -5.187 1.00 15.00 N ATOM 0 H ARG B 114 14.848 -6.316 1.679 1.00 15.00 H new ATOM 0 HA ARG B 114 12.996 -8.312 0.916 1.00 15.00 H new ATOM 0 HB2 ARG B 114 14.520 -7.211 -0.659 1.00 15.00 H new ATOM 0 HB3 ARG B 114 15.913 -7.847 0.194 1.00 15.00 H new ATOM 0 HG2 ARG B 114 15.225 -10.156 -0.387 1.00 15.00 H new ATOM 0 HG3 ARG B 114 13.816 -9.532 -1.222 1.00 15.00 H new ATOM 0 HD2 ARG B 114 16.686 -8.826 -1.941 1.00 15.00 H new ATOM 0 HD3 ARG B 114 15.751 -10.080 -2.732 1.00 15.00 H new ATOM 0 HE ARG B 114 14.667 -7.299 -2.699 1.00 15.00 H new ATOM 0 HH11 ARG B 114 16.055 -10.037 -4.457 1.00 15.00 H new ATOM 0 HH12 ARG B 114 15.639 -9.378 -6.043 1.00 15.00 H new ATOM 0 HH21 ARG B 114 14.123 -6.471 -4.743 1.00 15.00 H new ATOM 0 HH22 ARG B 114 14.550 -7.369 -6.204 1.00 15.00 H new ATOM 1582 N LEU B 115 15.608 -9.285 2.688 1.00 15.00 N ATOM 1583 CA LEU B 115 16.154 -10.379 3.484 1.00 15.00 C ATOM 1584 C LEU B 115 15.118 -10.893 4.478 1.00 15.00 C ATOM 1585 O LEU B 115 14.842 -12.097 4.537 1.00 15.00 O ATOM 1586 CB LEU B 115 17.408 -9.918 4.231 1.00 15.00 C ATOM 1587 CG LEU B 115 18.224 -11.034 4.887 1.00 15.00 C ATOM 1588 CD1 LEU B 115 19.003 -11.816 3.838 1.00 15.00 C ATOM 1589 CD2 LEU B 115 19.164 -10.454 5.932 1.00 15.00 C ATOM 0 H LEU B 115 16.156 -8.426 2.727 1.00 15.00 H new ATOM 0 HA LEU B 115 16.421 -11.191 2.808 1.00 15.00 H new ATOM 0 HB2 LEU B 115 18.051 -9.382 3.533 1.00 15.00 H new ATOM 0 HB3 LEU B 115 17.111 -9.206 5.001 1.00 15.00 H new ATOM 0 HG LEU B 115 17.538 -11.721 5.382 1.00 15.00 H new ATOM 0 HD11 LEU B 115 19.577 -12.605 4.324 1.00 15.00 H new ATOM 0 HD12 LEU B 115 18.308 -12.259 3.125 1.00 15.00 H new ATOM 0 HD13 LEU B 115 19.682 -11.144 3.313 1.00 15.00 H new ATOM 0 HD21 LEU B 115 19.739 -11.258 6.391 1.00 15.00 H new ATOM 0 HD22 LEU B 115 19.845 -9.747 5.457 1.00 15.00 H new ATOM 0 HD23 LEU B 115 18.584 -9.940 6.698 1.00 15.00 H new ATOM 1601 N LYS B 116 14.535 -9.971 5.238 1.00 15.00 N ATOM 1602 CA LYS B 116 13.527 -10.316 6.230 1.00 15.00 C ATOM 1603 C LYS B 116 12.270 -10.869 5.563 1.00 15.00 C ATOM 1604 O LYS B 116 11.688 -11.845 6.036 1.00 15.00 O ATOM 1605 CB LYS B 116 13.184 -9.094 7.087 1.00 15.00 C ATOM 1606 CG LYS B 116 12.077 -9.347 8.099 1.00 15.00 C ATOM 1607 CD LYS B 116 12.072 -8.301 9.204 1.00 15.00 C ATOM 1608 CE LYS B 116 10.872 -8.470 10.124 1.00 15.00 C ATOM 1609 NZ LYS B 116 11.025 -7.701 11.388 1.00 15.00 N1+ ATOM 0 H LYS B 116 14.746 -8.975 5.184 1.00 15.00 H new ATOM 0 HA LYS B 116 13.937 -11.093 6.875 1.00 15.00 H new ATOM 0 HB2 LYS B 116 14.080 -8.769 7.616 1.00 15.00 H new ATOM 0 HB3 LYS B 116 12.886 -8.275 6.433 1.00 15.00 H new ATOM 0 HG2 LYS B 116 11.113 -9.344 7.591 1.00 15.00 H new ATOM 0 HG3 LYS B 116 12.204 -10.337 8.536 1.00 15.00 H new ATOM 0 HD2 LYS B 116 12.991 -8.379 9.785 1.00 15.00 H new ATOM 0 HD3 LYS B 116 12.057 -7.304 8.763 1.00 15.00 H new ATOM 0 HE2 LYS B 116 9.970 -8.142 9.607 1.00 15.00 H new ATOM 0 HE3 LYS B 116 10.740 -9.527 10.356 1.00 15.00 H new ATOM 0 HZ1 LYS B 116 10.108 -7.647 11.875 1.00 15.00 H new ATOM 0 HZ2 LYS B 116 11.716 -8.177 12.003 1.00 15.00 H new ATOM 0 HZ3 LYS B 116 11.359 -6.740 11.172 1.00 15.00 H new ATOM 1623 N ASN B 117 11.868 -10.254 4.456 1.00 15.00 N ATOM 1624 CA ASN B 117 10.682 -10.694 3.729 1.00 15.00 C ATOM 1625 C ASN B 117 10.855 -12.122 3.224 1.00 15.00 C ATOM 1626 O ASN B 117 9.963 -12.950 3.385 1.00 15.00 O ATOM 1627 CB ASN B 117 10.383 -9.745 2.557 1.00 15.00 C ATOM 1628 CG ASN B 117 9.482 -10.374 1.504 1.00 15.00 C ATOM 1629 OD1 ASN B 117 8.258 -10.384 1.638 1.00 15.00 O ATOM 1630 ND2 ASN B 117 10.084 -10.883 0.438 1.00 15.00 N ATOM 0 H ASN B 117 12.344 -9.452 4.043 1.00 15.00 H new ATOM 0 HA ASN B 117 9.837 -10.673 4.417 1.00 15.00 H new ATOM 0 HB2 ASN B 117 9.910 -8.840 2.939 1.00 15.00 H new ATOM 0 HB3 ASN B 117 11.321 -9.442 2.092 1.00 15.00 H new ATOM 0 HD21 ASN B 117 9.530 -11.302 -0.309 1.00 15.00 H new ATOM 0 HD22 ASN B 117 11.101 -10.855 0.365 1.00 15.00 H new ATOM 1637 N GLU B 118 12.016 -12.407 2.642 1.00 15.00 N ATOM 1638 CA GLU B 118 12.308 -13.733 2.108 1.00 15.00 C ATOM 1639 C GLU B 118 12.214 -14.805 3.191 1.00 15.00 C ATOM 1640 O GLU B 118 11.745 -15.918 2.943 1.00 15.00 O ATOM 1641 CB GLU B 118 13.699 -13.748 1.475 1.00 15.00 C ATOM 1642 CG GLU B 118 14.033 -15.050 0.765 1.00 15.00 C ATOM 1643 CD GLU B 118 15.413 -15.037 0.147 1.00 15.00 C ATOM 1644 OE1 GLU B 118 16.405 -15.103 0.900 1.00 15.00 O ATOM 1645 OE2 GLU B 118 15.510 -14.967 -1.097 1.00 15.00 O1- ATOM 0 H GLU B 118 12.773 -11.733 2.528 1.00 15.00 H new ATOM 0 HA GLU B 118 11.561 -13.960 1.347 1.00 15.00 H new ATOM 0 HB2 GLU B 118 13.773 -12.926 0.762 1.00 15.00 H new ATOM 0 HB3 GLU B 118 14.443 -13.566 2.250 1.00 15.00 H new ATOM 0 HG2 GLU B 118 13.964 -15.875 1.475 1.00 15.00 H new ATOM 0 HG3 GLU B 118 13.292 -15.236 -0.013 1.00 15.00 H new ATOM 1652 N ALA B 119 12.663 -14.469 4.391 1.00 15.00 N ATOM 1653 CA ALA B 119 12.620 -15.401 5.506 1.00 15.00 C ATOM 1654 C ALA B 119 11.202 -15.520 6.050 1.00 15.00 C ATOM 1655 O ALA B 119 10.734 -16.613 6.364 1.00 15.00 O ATOM 1656 CB ALA B 119 13.575 -14.959 6.606 1.00 15.00 C ATOM 0 H ALA B 119 13.061 -13.558 4.617 1.00 15.00 H new ATOM 0 HA ALA B 119 12.935 -16.381 5.147 1.00 15.00 H new ATOM 0 HB1 ALA B 119 13.530 -15.668 7.433 1.00 15.00 H new ATOM 0 HB2 ALA B 119 14.591 -14.923 6.213 1.00 15.00 H new ATOM 0 HB3 ALA B 119 13.288 -13.969 6.961 1.00 15.00 H new ATOM 1662 N ALA B 120 10.516 -14.384 6.138 1.00 15.00 N ATOM 1663 CA ALA B 120 9.154 -14.345 6.652 1.00 15.00 C ATOM 1664 C ALA B 120 8.168 -15.012 5.698 1.00 15.00 C ATOM 1665 O ALA B 120 7.124 -15.493 6.129 1.00 15.00 O ATOM 1666 CB ALA B 120 8.739 -12.910 6.925 1.00 15.00 C ATOM 0 H ALA B 120 10.885 -13.475 5.858 1.00 15.00 H new ATOM 0 HA ALA B 120 9.136 -14.907 7.586 1.00 15.00 H new ATOM 0 HB1 ALA B 120 7.719 -12.893 7.309 1.00 15.00 H new ATOM 0 HB2 ALA B 120 9.411 -12.471 7.662 1.00 15.00 H new ATOM 0 HB3 ALA B 120 8.788 -12.335 6.000 1.00 15.00 H new ATOM 1672 N GLU B 121 8.511 -15.056 4.412 1.00 15.00 N ATOM 1673 CA GLU B 121 7.649 -15.667 3.398 1.00 15.00 C ATOM 1674 C GLU B 121 7.313 -17.123 3.729 1.00 15.00 C ATOM 1675 O GLU B 121 6.367 -17.684 3.174 1.00 15.00 O ATOM 1676 CB GLU B 121 8.290 -15.573 2.008 1.00 15.00 C ATOM 1677 CG GLU B 121 7.997 -14.255 1.300 1.00 15.00 C ATOM 1678 CD GLU B 121 8.449 -14.233 -0.149 1.00 15.00 C ATOM 1679 OE1 GLU B 121 8.691 -13.125 -0.683 1.00 15.00 O ATOM 1680 OE2 GLU B 121 8.534 -15.310 -0.772 1.00 15.00 O1- ATOM 0 H GLU B 121 9.383 -14.675 4.045 1.00 15.00 H new ATOM 0 HA GLU B 121 6.715 -15.106 3.395 1.00 15.00 H new ATOM 0 HB2 GLU B 121 9.369 -15.695 2.103 1.00 15.00 H new ATOM 0 HB3 GLU B 121 7.929 -16.397 1.392 1.00 15.00 H new ATOM 0 HG2 GLU B 121 6.925 -14.060 1.341 1.00 15.00 H new ATOM 0 HG3 GLU B 121 8.489 -13.445 1.838 1.00 15.00 H new ATOM 1687 N GLU B 122 8.089 -17.727 4.624 1.00 15.00 N ATOM 1688 CA GLU B 122 7.856 -19.104 5.039 1.00 15.00 C ATOM 1689 C GLU B 122 6.468 -19.242 5.684 1.00 15.00 C ATOM 1690 O GLU B 122 5.585 -19.909 5.141 1.00 15.00 O ATOM 1691 CB GLU B 122 8.944 -19.546 6.019 1.00 15.00 C ATOM 1692 CG GLU B 122 8.738 -20.947 6.572 1.00 15.00 C ATOM 1693 CD GLU B 122 9.548 -21.203 7.824 1.00 15.00 C ATOM 1694 OE1 GLU B 122 9.340 -20.488 8.830 1.00 15.00 O ATOM 1695 OE2 GLU B 122 10.385 -22.124 7.815 1.00 15.00 O1- ATOM 0 H GLU B 122 8.887 -17.281 5.077 1.00 15.00 H new ATOM 0 HA GLU B 122 7.892 -19.746 4.159 1.00 15.00 H new ATOM 0 HB2 GLU B 122 9.911 -19.502 5.518 1.00 15.00 H new ATOM 0 HB3 GLU B 122 8.982 -18.840 6.848 1.00 15.00 H new ATOM 0 HG2 GLU B 122 7.681 -21.095 6.791 1.00 15.00 H new ATOM 0 HG3 GLU B 122 9.011 -21.678 5.811 1.00 15.00 H new ATOM 1702 N ALA B 123 6.278 -18.599 6.834 1.00 15.00 N ATOM 1703 CA ALA B 123 4.999 -18.661 7.541 1.00 15.00 C ATOM 1704 C ALA B 123 4.674 -17.342 8.242 1.00 15.00 C ATOM 1705 O ALA B 123 3.520 -17.076 8.577 1.00 15.00 O ATOM 1706 CB ALA B 123 5.008 -19.807 8.541 1.00 15.00 C ATOM 0 H ALA B 123 6.989 -18.031 7.295 1.00 15.00 H new ATOM 0 HA ALA B 123 4.218 -18.838 6.801 1.00 15.00 H new ATOM 0 HB1 ALA B 123 4.051 -19.843 9.061 1.00 15.00 H new ATOM 0 HB2 ALA B 123 5.171 -20.748 8.015 1.00 15.00 H new ATOM 0 HB3 ALA B 123 5.809 -19.652 9.264 1.00 15.00 H new ATOM 1712 N GLU B 124 5.687 -16.510 8.446 1.00 15.00 N ATOM 1713 CA GLU B 124 5.509 -15.219 9.105 1.00 15.00 C ATOM 1714 C GLU B 124 5.051 -14.154 8.113 1.00 15.00 C ATOM 1715 O GLU B 124 5.051 -12.969 8.429 1.00 15.00 O ATOM 1716 CB GLU B 124 6.819 -14.773 9.761 1.00 15.00 C ATOM 1717 CG GLU B 124 7.005 -15.286 11.176 1.00 15.00 C ATOM 1718 CD GLU B 124 6.305 -14.427 12.208 1.00 15.00 C ATOM 1719 OE1 GLU B 124 5.194 -14.794 12.632 1.00 15.00 O ATOM 1720 OE2 GLU B 124 6.871 -13.387 12.610 1.00 15.00 O1- ATOM 0 H GLU B 124 6.647 -16.706 8.163 1.00 15.00 H new ATOM 0 HA GLU B 124 4.741 -15.338 9.869 1.00 15.00 H new ATOM 0 HB2 GLU B 124 7.654 -15.113 9.149 1.00 15.00 H new ATOM 0 HB3 GLU B 124 6.855 -13.684 9.772 1.00 15.00 H new ATOM 0 HG2 GLU B 124 6.625 -16.306 11.241 1.00 15.00 H new ATOM 0 HG3 GLU B 124 8.070 -15.327 11.406 1.00 15.00 H new ATOM 1727 N LEU B 125 4.655 -14.588 6.919 1.00 15.00 N ATOM 1728 CA LEU B 125 4.211 -13.678 5.869 1.00 15.00 C ATOM 1729 C LEU B 125 3.004 -12.865 6.321 1.00 15.00 C ATOM 1730 O LEU B 125 2.843 -11.705 5.937 1.00 15.00 O ATOM 1731 CB LEU B 125 3.886 -14.461 4.595 1.00 15.00 C ATOM 1732 CG LEU B 125 3.630 -13.610 3.348 1.00 15.00 C ATOM 1733 CD1 LEU B 125 4.801 -12.674 3.082 1.00 15.00 C ATOM 1734 CD2 LEU B 125 3.380 -14.504 2.141 1.00 15.00 C ATOM 0 H LEU B 125 4.633 -15.573 6.654 1.00 15.00 H new ATOM 0 HA LEU B 125 5.022 -12.981 5.656 1.00 15.00 H new ATOM 0 HB2 LEU B 125 4.712 -15.141 4.386 1.00 15.00 H new ATOM 0 HB3 LEU B 125 3.006 -15.076 4.781 1.00 15.00 H new ATOM 0 HG LEU B 125 2.742 -13.003 3.524 1.00 15.00 H new ATOM 0 HD11 LEU B 125 4.597 -12.080 2.191 1.00 15.00 H new ATOM 0 HD12 LEU B 125 4.939 -12.012 3.937 1.00 15.00 H new ATOM 0 HD13 LEU B 125 5.707 -13.260 2.927 1.00 15.00 H new ATOM 0 HD21 LEU B 125 3.199 -13.886 1.262 1.00 15.00 H new ATOM 0 HD22 LEU B 125 4.252 -15.135 1.968 1.00 15.00 H new ATOM 0 HD23 LEU B 125 2.509 -15.132 2.328 1.00 15.00 H new ATOM 1746 N GLU B 126 2.168 -13.473 7.152 1.00 15.00 N ATOM 1747 CA GLU B 126 0.986 -12.800 7.668 1.00 15.00 C ATOM 1748 C GLU B 126 1.386 -11.629 8.561 1.00 15.00 C ATOM 1749 O GLU B 126 0.786 -10.556 8.507 1.00 15.00 O ATOM 1750 CB GLU B 126 0.104 -13.787 8.435 1.00 15.00 C ATOM 1751 CG GLU B 126 -0.735 -14.669 7.527 1.00 15.00 C ATOM 1752 CD GLU B 126 -1.713 -13.872 6.688 1.00 15.00 C ATOM 1753 OE1 GLU B 126 -2.832 -13.606 7.168 1.00 15.00 O ATOM 1754 OE2 GLU B 126 -1.367 -13.509 5.547 1.00 15.00 O1- ATOM 0 H GLU B 126 2.287 -14.431 7.482 1.00 15.00 H new ATOM 0 HA GLU B 126 0.414 -12.409 6.827 1.00 15.00 H new ATOM 0 HB2 GLU B 126 0.735 -14.417 9.061 1.00 15.00 H new ATOM 0 HB3 GLU B 126 -0.555 -13.232 9.103 1.00 15.00 H new ATOM 0 HG2 GLU B 126 -0.078 -15.239 6.870 1.00 15.00 H new ATOM 0 HG3 GLU B 126 -1.284 -15.390 8.132 1.00 15.00 H new ATOM 1761 N ARG B 127 2.416 -11.831 9.364 1.00 15.00 N ATOM 1762 CA ARG B 127 2.895 -10.787 10.254 1.00 15.00 C ATOM 1763 C ARG B 127 3.810 -9.825 9.503 1.00 15.00 C ATOM 1764 O ARG B 127 3.904 -8.649 9.844 1.00 15.00 O ATOM 1765 CB ARG B 127 3.634 -11.398 11.441 1.00 15.00 C ATOM 1766 CG ARG B 127 3.421 -10.634 12.736 1.00 15.00 C ATOM 1767 CD ARG B 127 4.443 -11.023 13.787 1.00 15.00 C ATOM 1768 NE ARG B 127 5.812 -10.885 13.286 1.00 15.00 N ATOM 1769 CZ ARG B 127 6.459 -9.721 13.205 1.00 15.00 C ATOM 1770 NH1 ARG B 127 5.865 -8.596 13.602 1.00 15.00 N1+ ATOM 1771 NH2 ARG B 127 7.692 -9.674 12.723 1.00 15.00 N ATOM 0 H ARG B 127 2.936 -12.707 9.418 1.00 15.00 H new ATOM 0 HA ARG B 127 2.035 -10.231 10.627 1.00 15.00 H new ATOM 0 HB2 ARG B 127 3.303 -12.428 11.576 1.00 15.00 H new ATOM 0 HB3 ARG B 127 4.700 -11.432 11.218 1.00 15.00 H new ATOM 0 HG2 ARG B 127 3.486 -9.563 12.543 1.00 15.00 H new ATOM 0 HG3 ARG B 127 2.417 -10.829 13.114 1.00 15.00 H new ATOM 0 HD2 ARG B 127 4.314 -10.397 14.670 1.00 15.00 H new ATOM 0 HD3 ARG B 127 4.271 -12.053 14.098 1.00 15.00 H new ATOM 0 HE ARG B 127 6.299 -11.728 12.981 1.00 15.00 H new ATOM 0 HH11 ARG B 127 4.914 -8.624 13.969 1.00 15.00 H new ATOM 0 HH12 ARG B 127 6.362 -7.707 13.539 1.00 15.00 H new ATOM 0 HH21 ARG B 127 8.151 -10.530 12.412 1.00 15.00 H new ATOM 0 HH22 ARG B 127 8.182 -8.782 12.663 1.00 15.00 H new ATOM 1785 N LEU B 128 4.475 -10.340 8.474 1.00 15.00 N ATOM 1786 CA LEU B 128 5.391 -9.549 7.653 1.00 15.00 C ATOM 1787 C LEU B 128 4.665 -8.369 7.020 1.00 15.00 C ATOM 1788 O LEU B 128 5.122 -7.226 7.115 1.00 15.00 O ATOM 1789 CB LEU B 128 6.006 -10.444 6.558 1.00 15.00 C ATOM 1790 CG LEU B 128 7.036 -9.794 5.608 1.00 15.00 C ATOM 1791 CD1 LEU B 128 6.358 -9.176 4.389 1.00 15.00 C ATOM 1792 CD2 LEU B 128 7.884 -8.754 6.330 1.00 15.00 C ATOM 0 H LEU B 128 4.396 -11.315 8.184 1.00 15.00 H new ATOM 0 HA LEU B 128 6.185 -9.158 8.289 1.00 15.00 H new ATOM 0 HB2 LEU B 128 6.486 -11.293 7.046 1.00 15.00 H new ATOM 0 HB3 LEU B 128 5.193 -10.843 5.952 1.00 15.00 H new ATOM 0 HG LEU B 128 7.697 -10.589 5.263 1.00 15.00 H new ATOM 0 HD11 LEU B 128 7.112 -8.728 3.742 1.00 15.00 H new ATOM 0 HD12 LEU B 128 5.822 -9.950 3.840 1.00 15.00 H new ATOM 0 HD13 LEU B 128 5.655 -8.409 4.714 1.00 15.00 H new ATOM 0 HD21 LEU B 128 8.597 -8.317 5.631 1.00 15.00 H new ATOM 0 HD22 LEU B 128 7.239 -7.970 6.727 1.00 15.00 H new ATOM 0 HD23 LEU B 128 8.423 -9.229 7.149 1.00 15.00 H new ATOM 1804 N LYS B 129 3.534 -8.649 6.384 1.00 15.00 N ATOM 1805 CA LYS B 129 2.759 -7.612 5.721 1.00 15.00 C ATOM 1806 C LYS B 129 2.264 -6.569 6.728 1.00 15.00 C ATOM 1807 O LYS B 129 2.181 -5.382 6.409 1.00 15.00 O ATOM 1808 CB LYS B 129 1.596 -8.231 4.924 1.00 15.00 C ATOM 1809 CG LYS B 129 0.347 -8.522 5.739 1.00 15.00 C ATOM 1810 CD LYS B 129 -0.143 -9.952 5.553 1.00 15.00 C ATOM 1811 CE LYS B 129 -0.292 -10.324 4.088 1.00 15.00 C ATOM 1812 NZ LYS B 129 -1.277 -11.423 3.898 1.00 15.00 N1+ ATOM 0 H LYS B 129 3.135 -9.585 6.314 1.00 15.00 H new ATOM 0 HA LYS B 129 3.408 -7.096 5.013 1.00 15.00 H new ATOM 0 HB2 LYS B 129 1.332 -7.556 4.110 1.00 15.00 H new ATOM 0 HB3 LYS B 129 1.940 -9.160 4.469 1.00 15.00 H new ATOM 0 HG2 LYS B 129 0.555 -8.346 6.794 1.00 15.00 H new ATOM 0 HG3 LYS B 129 -0.443 -7.829 5.450 1.00 15.00 H new ATOM 0 HD2 LYS B 129 0.556 -10.638 6.031 1.00 15.00 H new ATOM 0 HD3 LYS B 129 -1.102 -10.073 6.056 1.00 15.00 H new ATOM 0 HE2 LYS B 129 -0.609 -9.449 3.520 1.00 15.00 H new ATOM 0 HE3 LYS B 129 0.676 -10.629 3.690 1.00 15.00 H new ATOM 0 HZ1 LYS B 129 -0.968 -12.034 3.115 1.00 15.00 H new ATOM 0 HZ2 LYS B 129 -1.343 -11.985 4.771 1.00 15.00 H new ATOM 0 HZ3 LYS B 129 -2.209 -11.019 3.675 1.00 15.00 H new ATOM 1826 N SER B 130 1.959 -7.006 7.948 1.00 15.00 N ATOM 1827 CA SER B 130 1.497 -6.091 8.982 1.00 15.00 C ATOM 1828 C SER B 130 2.669 -5.303 9.565 1.00 15.00 C ATOM 1829 O SER B 130 2.533 -4.128 9.910 1.00 15.00 O ATOM 1830 CB SER B 130 0.752 -6.861 10.073 1.00 15.00 C ATOM 1831 OG SER B 130 -0.369 -7.530 9.519 1.00 15.00 O ATOM 0 H SER B 130 2.024 -7.981 8.241 1.00 15.00 H new ATOM 0 HA SER B 130 0.805 -5.377 8.536 1.00 15.00 H new ATOM 0 HB2 SER B 130 1.421 -7.583 10.541 1.00 15.00 H new ATOM 0 HB3 SER B 130 0.426 -6.175 10.855 1.00 15.00 H new ATOM 0 HG SER B 130 -0.617 -7.106 8.671 1.00 15.00 H new ATOM 1837 N GLU B 131 3.825 -5.951 9.651 1.00 15.00 N ATOM 1838 CA GLU B 131 5.028 -5.311 10.171 1.00 15.00 C ATOM 1839 C GLU B 131 5.429 -4.169 9.248 1.00 15.00 C ATOM 1840 O GLU B 131 5.700 -3.055 9.695 1.00 15.00 O ATOM 1841 CB GLU B 131 6.173 -6.327 10.278 1.00 15.00 C ATOM 1842 CG GLU B 131 7.428 -5.778 10.945 1.00 15.00 C ATOM 1843 CD GLU B 131 7.673 -6.367 12.319 1.00 15.00 C ATOM 1844 OE1 GLU B 131 6.883 -6.083 13.242 1.00 15.00 O ATOM 1845 OE2 GLU B 131 8.651 -7.129 12.482 1.00 15.00 O1- ATOM 0 H GLU B 131 3.955 -6.922 9.367 1.00 15.00 H new ATOM 0 HA GLU B 131 4.822 -4.920 11.167 1.00 15.00 H new ATOM 0 HB2 GLU B 131 5.825 -7.194 10.840 1.00 15.00 H new ATOM 0 HB3 GLU B 131 6.429 -6.677 9.278 1.00 15.00 H new ATOM 0 HG2 GLU B 131 8.290 -5.982 10.309 1.00 15.00 H new ATOM 0 HG3 GLU B 131 7.344 -4.695 11.030 1.00 15.00 H new ATOM 1852 N ARG B 132 5.433 -4.458 7.952 1.00 15.00 N ATOM 1853 CA ARG B 132 5.790 -3.469 6.946 1.00 15.00 C ATOM 1854 C ARG B 132 4.781 -2.323 6.946 1.00 15.00 C ATOM 1855 O ARG B 132 5.137 -1.178 6.692 1.00 15.00 O ATOM 1856 CB ARG B 132 5.854 -4.132 5.566 1.00 15.00 C ATOM 1857 CG ARG B 132 6.390 -3.229 4.465 1.00 15.00 C ATOM 1858 CD ARG B 132 5.265 -2.615 3.651 1.00 15.00 C ATOM 1859 NE ARG B 132 5.767 -1.778 2.569 1.00 15.00 N ATOM 1860 CZ ARG B 132 4.991 -1.027 1.789 1.00 15.00 C ATOM 1861 NH1 ARG B 132 3.678 -1.007 1.980 1.00 15.00 N1+ ATOM 1862 NH2 ARG B 132 5.529 -0.301 0.818 1.00 15.00 N ATOM 0 H ARG B 132 5.192 -5.374 7.573 1.00 15.00 H new ATOM 0 HA ARG B 132 6.771 -3.058 7.184 1.00 15.00 H new ATOM 0 HB2 ARG B 132 6.483 -5.020 5.631 1.00 15.00 H new ATOM 0 HB3 ARG B 132 4.855 -4.469 5.290 1.00 15.00 H new ATOM 0 HG2 ARG B 132 6.996 -2.437 4.905 1.00 15.00 H new ATOM 0 HG3 ARG B 132 7.044 -3.803 3.809 1.00 15.00 H new ATOM 0 HD2 ARG B 132 4.643 -3.408 3.237 1.00 15.00 H new ATOM 0 HD3 ARG B 132 4.628 -2.019 4.305 1.00 15.00 H new ATOM 0 HE ARG B 132 6.773 -1.766 2.399 1.00 15.00 H new ATOM 0 HH11 ARG B 132 3.262 -1.567 2.724 1.00 15.00 H new ATOM 0 HH12 ARG B 132 3.084 -0.432 1.382 1.00 15.00 H new ATOM 0 HH21 ARG B 132 6.538 -0.317 0.668 1.00 15.00 H new ATOM 0 HH22 ARG B 132 4.934 0.274 0.221 1.00 15.00 H new ATOM 1876 N HIS B 133 3.528 -2.648 7.249 1.00 15.00 N ATOM 1877 CA HIS B 133 2.454 -1.660 7.292 1.00 15.00 C ATOM 1878 C HIS B 133 2.763 -0.570 8.319 1.00 15.00 C ATOM 1879 O HIS B 133 2.582 0.621 8.059 1.00 15.00 O ATOM 1880 CB HIS B 133 1.126 -2.346 7.645 1.00 15.00 C ATOM 1881 CG HIS B 133 -0.056 -1.862 6.858 1.00 15.00 C ATOM 1882 ND1 HIS B 133 0.039 -0.799 5.993 1.00 15.00 N ATOM 1883 CD2 HIS B 133 -1.325 -2.336 6.838 1.00 15.00 C ATOM 1884 CE1 HIS B 133 -1.167 -0.650 5.468 1.00 15.00 C ATOM 1885 NE2 HIS B 133 -2.022 -1.558 5.952 1.00 15.00 N ATOM 0 H HIS B 133 3.229 -3.598 7.471 1.00 15.00 H new ATOM 0 HA HIS B 133 2.372 -1.197 6.309 1.00 15.00 H new ATOM 0 HB2 HIS B 133 1.234 -3.419 7.490 1.00 15.00 H new ATOM 0 HB3 HIS B 133 0.926 -2.196 8.706 1.00 15.00 H new ATOM 0 HD2 HIS B 133 -1.712 -3.166 7.410 1.00 15.00 H new ATOM 0 HE1 HIS B 133 -1.427 0.107 4.743 1.00 15.00 H new ATOM 0 HE2 HIS B 133 -3.008 -1.653 5.707 1.00 15.00 H new ATOM 1893 N ASP B 134 3.251 -0.983 9.483 1.00 15.00 N ATOM 1894 CA ASP B 134 3.583 -0.042 10.547 1.00 15.00 C ATOM 1895 C ASP B 134 4.961 0.573 10.332 1.00 15.00 C ATOM 1896 O ASP B 134 5.235 1.690 10.773 1.00 15.00 O ATOM 1897 CB ASP B 134 3.526 -0.727 11.913 1.00 15.00 C ATOM 1898 CG ASP B 134 3.553 0.275 13.050 1.00 15.00 C ATOM 1899 OD1 ASP B 134 4.492 0.224 13.875 1.00 15.00 O ATOM 1900 OD2 ASP B 134 2.636 1.121 13.121 1.00 15.00 O1- ATOM 0 H ASP B 134 3.425 -1.961 9.714 1.00 15.00 H new ATOM 0 HA ASP B 134 2.842 0.757 10.521 1.00 15.00 H new ATOM 0 HB2 ASP B 134 2.619 -1.328 11.980 1.00 15.00 H new ATOM 0 HB3 ASP B 134 4.369 -1.411 12.012 1.00 15.00 H new ATOM 1905 N HIS B 135 5.823 -0.158 9.650 1.00 15.00 N ATOM 1906 CA HIS B 135 7.174 0.318 9.378 1.00 15.00 C ATOM 1907 C HIS B 135 7.176 1.388 8.296 1.00 15.00 C ATOM 1908 O HIS B 135 7.862 2.399 8.417 1.00 15.00 O ATOM 1909 CB HIS B 135 8.085 -0.839 8.963 1.00 15.00 C ATOM 1910 CG HIS B 135 8.684 -1.577 10.121 1.00 15.00 C ATOM 1911 ND1 HIS B 135 9.908 -2.196 10.020 1.00 15.00 N ATOM 1912 CD2 HIS B 135 8.199 -1.755 11.374 1.00 15.00 C ATOM 1913 CE1 HIS B 135 10.135 -2.738 11.205 1.00 15.00 C ATOM 1914 NE2 HIS B 135 9.127 -2.501 12.051 1.00 15.00 N ATOM 0 H HIS B 135 5.616 -1.083 9.273 1.00 15.00 H new ATOM 0 HA HIS B 135 7.556 0.758 10.299 1.00 15.00 H new ATOM 0 HB2 HIS B 135 7.514 -1.539 8.353 1.00 15.00 H new ATOM 0 HB3 HIS B 135 8.888 -0.451 8.336 1.00 15.00 H new ATOM 0 HD2 HIS B 135 7.263 -1.381 11.763 1.00 15.00 H new ATOM 0 HE1 HIS B 135 11.022 -3.300 11.457 1.00 15.00 H new ATOM 0 HE2 HIS B 135 9.061 -2.817 13.019 1.00 15.00 H new ATOM 1922 N ASP B 136 6.386 1.174 7.254 1.00 15.00 N ATOM 1923 CA ASP B 136 6.312 2.109 6.135 1.00 15.00 C ATOM 1924 C ASP B 136 5.750 3.464 6.554 1.00 15.00 C ATOM 1925 O ASP B 136 6.189 4.500 6.058 1.00 15.00 O ATOM 1926 CB ASP B 136 5.473 1.522 5.005 1.00 15.00 C ATOM 1927 CG ASP B 136 6.165 1.641 3.664 1.00 15.00 C ATOM 1928 OD1 ASP B 136 7.287 1.115 3.523 1.00 15.00 O ATOM 1929 OD2 ASP B 136 5.586 2.247 2.742 1.00 15.00 O1- ATOM 0 H ASP B 136 5.783 0.357 7.158 1.00 15.00 H new ATOM 0 HA ASP B 136 7.331 2.270 5.783 1.00 15.00 H new ATOM 0 HB2 ASP B 136 5.266 0.472 5.214 1.00 15.00 H new ATOM 0 HB3 ASP B 136 4.512 2.034 4.964 1.00 15.00 H new ATOM 1934 N LYS B 137 4.789 3.467 7.477 1.00 15.00 N ATOM 1935 CA LYS B 137 4.196 4.721 7.940 1.00 15.00 C ATOM 1936 C LYS B 137 5.236 5.564 8.682 1.00 15.00 C ATOM 1937 O LYS B 137 5.156 6.791 8.711 1.00 15.00 O ATOM 1938 CB LYS B 137 2.972 4.462 8.833 1.00 15.00 C ATOM 1939 CG LYS B 137 3.311 3.968 10.234 1.00 15.00 C ATOM 1940 CD LYS B 137 2.062 3.751 11.076 1.00 15.00 C ATOM 1941 CE LYS B 137 1.143 2.711 10.456 1.00 15.00 C ATOM 1942 NZ LYS B 137 0.539 1.821 11.485 1.00 15.00 N1+ ATOM 0 H LYS B 137 4.409 2.628 7.914 1.00 15.00 H new ATOM 0 HA LYS B 137 3.859 5.276 7.065 1.00 15.00 H new ATOM 0 HB2 LYS B 137 2.395 5.383 8.915 1.00 15.00 H new ATOM 0 HB3 LYS B 137 2.331 3.727 8.346 1.00 15.00 H new ATOM 0 HG2 LYS B 137 3.869 3.034 10.165 1.00 15.00 H new ATOM 0 HG3 LYS B 137 3.960 4.692 10.727 1.00 15.00 H new ATOM 0 HD2 LYS B 137 2.349 3.433 12.078 1.00 15.00 H new ATOM 0 HD3 LYS B 137 1.526 4.694 11.182 1.00 15.00 H new ATOM 0 HE2 LYS B 137 0.351 3.212 9.899 1.00 15.00 H new ATOM 0 HE3 LYS B 137 1.705 2.110 9.741 1.00 15.00 H new ATOM 0 HZ1 LYS B 137 0.315 0.899 11.059 1.00 15.00 H new ATOM 0 HZ2 LYS B 137 1.212 1.687 12.266 1.00 15.00 H new ATOM 0 HZ3 LYS B 137 -0.333 2.254 11.850 1.00 15.00 H new ATOM 1956 N LYS B 138 6.210 4.886 9.282 1.00 15.00 N ATOM 1957 CA LYS B 138 7.284 5.554 10.002 1.00 15.00 C ATOM 1958 C LYS B 138 8.385 5.926 9.015 1.00 15.00 C ATOM 1959 O LYS B 138 8.982 7.005 9.090 1.00 15.00 O ATOM 1960 CB LYS B 138 7.836 4.638 11.100 1.00 15.00 C ATOM 1961 CG LYS B 138 8.631 5.371 12.167 1.00 15.00 C ATOM 1962 CD LYS B 138 7.747 6.308 12.975 1.00 15.00 C ATOM 1963 CE LYS B 138 8.465 6.832 14.208 1.00 15.00 C ATOM 1964 NZ LYS B 138 8.771 5.747 15.176 1.00 15.00 N1+ ATOM 0 H LYS B 138 6.275 3.868 9.282 1.00 15.00 H new ATOM 0 HA LYS B 138 6.901 6.458 10.476 1.00 15.00 H new ATOM 0 HB2 LYS B 138 7.006 4.114 11.574 1.00 15.00 H new ATOM 0 HB3 LYS B 138 8.472 3.880 10.642 1.00 15.00 H new ATOM 0 HG2 LYS B 138 9.101 4.648 12.833 1.00 15.00 H new ATOM 0 HG3 LYS B 138 9.433 5.940 11.698 1.00 15.00 H new ATOM 0 HD2 LYS B 138 7.438 7.146 12.350 1.00 15.00 H new ATOM 0 HD3 LYS B 138 6.840 5.783 13.277 1.00 15.00 H new ATOM 0 HE2 LYS B 138 9.391 7.322 13.908 1.00 15.00 H new ATOM 0 HE3 LYS B 138 7.848 7.588 14.694 1.00 15.00 H new ATOM 0 HZ1 LYS B 138 8.375 5.990 16.106 1.00 15.00 H new ATOM 0 HZ2 LYS B 138 8.351 4.856 14.843 1.00 15.00 H new ATOM 0 HZ3 LYS B 138 9.802 5.635 15.257 1.00 15.00 H new ATOM 1978 N GLU B 139 8.618 5.014 8.075 1.00 15.00 N ATOM 1979 CA GLU B 139 9.618 5.185 7.030 1.00 15.00 C ATOM 1980 C GLU B 139 9.356 6.455 6.234 1.00 15.00 C ATOM 1981 O GLU B 139 10.288 7.108 5.777 1.00 15.00 O ATOM 1982 CB GLU B 139 9.601 3.971 6.099 1.00 15.00 C ATOM 1983 CG GLU B 139 10.910 3.198 6.065 1.00 15.00 C ATOM 1984 CD GLU B 139 11.849 3.700 4.990 1.00 15.00 C ATOM 1985 OE1 GLU B 139 11.624 3.384 3.800 1.00 15.00 O ATOM 1986 OE2 GLU B 139 12.819 4.410 5.331 1.00 15.00 O1- ATOM 0 H GLU B 139 8.113 4.129 8.018 1.00 15.00 H new ATOM 0 HA GLU B 139 10.599 5.271 7.497 1.00 15.00 H new ATOM 0 HB2 GLU B 139 8.802 3.298 6.411 1.00 15.00 H new ATOM 0 HB3 GLU B 139 9.361 4.304 5.089 1.00 15.00 H new ATOM 0 HG2 GLU B 139 11.399 3.275 7.036 1.00 15.00 H new ATOM 0 HG3 GLU B 139 10.701 2.142 5.896 1.00 15.00 H new ATOM 1993 N ALA B 140 8.082 6.799 6.078 1.00 15.00 N ATOM 1994 CA ALA B 140 7.687 7.996 5.347 1.00 15.00 C ATOM 1995 C ALA B 140 8.382 9.240 5.897 1.00 15.00 C ATOM 1996 O ALA B 140 8.986 10.004 5.144 1.00 15.00 O ATOM 1997 CB ALA B 140 6.179 8.166 5.401 1.00 15.00 C ATOM 0 H ALA B 140 7.300 6.260 6.452 1.00 15.00 H new ATOM 0 HA ALA B 140 7.996 7.875 4.309 1.00 15.00 H new ATOM 0 HB1 ALA B 140 5.894 9.063 4.852 1.00 15.00 H new ATOM 0 HB2 ALA B 140 5.699 7.297 4.951 1.00 15.00 H new ATOM 0 HB3 ALA B 140 5.860 8.260 6.439 1.00 15.00 H new ATOM 2003 N GLU B 141 8.312 9.422 7.215 1.00 15.00 N ATOM 2004 CA GLU B 141 8.933 10.573 7.860 1.00 15.00 C ATOM 2005 C GLU B 141 10.448 10.432 7.866 1.00 15.00 C ATOM 2006 O GLU B 141 11.169 11.401 7.633 1.00 15.00 O ATOM 2007 CB GLU B 141 8.426 10.738 9.293 1.00 15.00 C ATOM 2008 CG GLU B 141 7.303 11.753 9.428 1.00 15.00 C ATOM 2009 CD GLU B 141 5.995 11.262 8.848 1.00 15.00 C ATOM 2010 OE1 GLU B 141 5.700 11.583 7.676 1.00 15.00 O ATOM 2011 OE2 GLU B 141 5.249 10.562 9.566 1.00 15.00 O1- ATOM 0 H GLU B 141 7.832 8.788 7.854 1.00 15.00 H new ATOM 0 HA GLU B 141 8.660 11.460 7.288 1.00 15.00 H new ATOM 0 HB2 GLU B 141 8.078 9.772 9.660 1.00 15.00 H new ATOM 0 HB3 GLU B 141 9.257 11.041 9.931 1.00 15.00 H new ATOM 0 HG2 GLU B 141 7.161 11.992 10.482 1.00 15.00 H new ATOM 0 HG3 GLU B 141 7.593 12.677 8.928 1.00 15.00 H new ATOM 2018 N ARG B 142 10.926 9.221 8.131 1.00 15.00 N ATOM 2019 CA ARG B 142 12.358 8.954 8.160 1.00 15.00 C ATOM 2020 C ARG B 142 12.986 9.278 6.808 1.00 15.00 C ATOM 2021 O ARG B 142 14.013 9.953 6.732 1.00 15.00 O ATOM 2022 CB ARG B 142 12.619 7.490 8.528 1.00 15.00 C ATOM 2023 CG ARG B 142 14.061 7.210 8.911 1.00 15.00 C ATOM 2024 CD ARG B 142 14.275 5.740 9.237 1.00 15.00 C ATOM 2025 NE ARG B 142 14.125 4.886 8.057 1.00 15.00 N ATOM 2026 CZ ARG B 142 14.884 3.821 7.798 1.00 15.00 C ATOM 2027 NH1 ARG B 142 15.850 3.459 8.631 1.00 15.00 N1+ ATOM 2028 NH2 ARG B 142 14.661 3.114 6.703 1.00 15.00 N ATOM 0 H ARG B 142 10.342 8.409 8.329 1.00 15.00 H new ATOM 0 HA ARG B 142 12.814 9.591 8.918 1.00 15.00 H new ATOM 0 HB2 ARG B 142 11.970 7.211 9.358 1.00 15.00 H new ATOM 0 HB3 ARG B 142 12.346 6.857 7.684 1.00 15.00 H new ATOM 0 HG2 ARG B 142 14.719 7.502 8.093 1.00 15.00 H new ATOM 0 HG3 ARG B 142 14.335 7.819 9.773 1.00 15.00 H new ATOM 0 HD2 ARG B 142 15.271 5.604 9.658 1.00 15.00 H new ATOM 0 HD3 ARG B 142 13.561 5.431 10.001 1.00 15.00 H new ATOM 0 HE ARG B 142 13.391 5.122 7.389 1.00 15.00 H new ATOM 0 HH11 ARG B 142 16.019 3.997 9.481 1.00 15.00 H new ATOM 0 HH12 ARG B 142 16.424 2.642 8.422 1.00 15.00 H new ATOM 0 HH21 ARG B 142 13.913 3.385 6.064 1.00 15.00 H new ATOM 0 HH22 ARG B 142 15.237 2.298 6.497 1.00 15.00 H new ATOM 2042 N LYS B 143 12.342 8.816 5.740 1.00 15.00 N ATOM 2043 CA LYS B 143 12.822 9.051 4.385 1.00 15.00 C ATOM 2044 C LYS B 143 12.757 10.529 4.032 1.00 15.00 C ATOM 2045 O LYS B 143 13.570 11.017 3.254 1.00 15.00 O ATOM 2046 CB LYS B 143 12.006 8.241 3.375 1.00 15.00 C ATOM 2047 CG LYS B 143 12.507 6.818 3.183 1.00 15.00 C ATOM 2048 CD LYS B 143 13.823 6.788 2.421 1.00 15.00 C ATOM 2049 CE LYS B 143 14.429 5.393 2.404 1.00 15.00 C ATOM 2050 NZ LYS B 143 14.871 4.961 3.757 1.00 15.00 N1+ ATOM 0 H LYS B 143 11.480 8.273 5.790 1.00 15.00 H new ATOM 0 HA LYS B 143 13.862 8.728 4.341 1.00 15.00 H new ATOM 0 HB2 LYS B 143 10.967 8.210 3.703 1.00 15.00 H new ATOM 0 HB3 LYS B 143 12.021 8.755 2.414 1.00 15.00 H new ATOM 0 HG2 LYS B 143 12.638 6.343 4.155 1.00 15.00 H new ATOM 0 HG3 LYS B 143 11.759 6.238 2.643 1.00 15.00 H new ATOM 0 HD2 LYS B 143 13.659 7.127 1.398 1.00 15.00 H new ATOM 0 HD3 LYS B 143 14.525 7.485 2.879 1.00 15.00 H new ATOM 0 HE2 LYS B 143 13.696 4.684 2.018 1.00 15.00 H new ATOM 0 HE3 LYS B 143 15.279 5.375 1.722 1.00 15.00 H new ATOM 0 HZ1 LYS B 143 15.497 4.135 3.670 1.00 15.00 H new ATOM 0 HZ2 LYS B 143 15.385 5.738 4.219 1.00 15.00 H new ATOM 0 HZ3 LYS B 143 14.040 4.708 4.329 1.00 15.00 H new ATOM 2064 N ALA B 144 11.794 11.236 4.611 1.00 15.00 N ATOM 2065 CA ALA B 144 11.630 12.660 4.349 1.00 15.00 C ATOM 2066 C ALA B 144 12.895 13.432 4.708 1.00 15.00 C ATOM 2067 O ALA B 144 13.275 14.370 4.010 1.00 15.00 O ATOM 2068 CB ALA B 144 10.437 13.215 5.113 1.00 15.00 C ATOM 0 H ALA B 144 11.115 10.846 5.265 1.00 15.00 H new ATOM 0 HA ALA B 144 11.446 12.784 3.282 1.00 15.00 H new ATOM 0 HB1 ALA B 144 10.333 14.279 4.903 1.00 15.00 H new ATOM 0 HB2 ALA B 144 9.531 12.694 4.802 1.00 15.00 H new ATOM 0 HB3 ALA B 144 10.590 13.070 6.182 1.00 15.00 H new ATOM 2074 N LEU B 145 13.535 13.043 5.801 1.00 15.00 N ATOM 2075 CA LEU B 145 14.761 13.702 6.236 1.00 15.00 C ATOM 2076 C LEU B 145 15.997 13.020 5.640 1.00 15.00 C ATOM 2077 O LEU B 145 16.919 13.685 5.165 1.00 15.00 O ATOM 2078 CB LEU B 145 14.859 13.714 7.765 1.00 15.00 C ATOM 2079 CG LEU B 145 13.975 14.744 8.482 1.00 15.00 C ATOM 2080 CD1 LEU B 145 13.996 16.083 7.756 1.00 15.00 C ATOM 2081 CD2 LEU B 145 12.550 14.233 8.612 1.00 15.00 C ATOM 0 H LEU B 145 13.229 12.278 6.402 1.00 15.00 H new ATOM 0 HA LEU B 145 14.726 14.730 5.877 1.00 15.00 H new ATOM 0 HB2 LEU B 145 14.601 12.722 8.135 1.00 15.00 H new ATOM 0 HB3 LEU B 145 15.897 13.898 8.042 1.00 15.00 H new ATOM 0 HG LEU B 145 14.381 14.894 9.482 1.00 15.00 H new ATOM 0 HD11 LEU B 145 13.362 16.794 8.285 1.00 15.00 H new ATOM 0 HD12 LEU B 145 15.017 16.463 7.723 1.00 15.00 H new ATOM 0 HD13 LEU B 145 13.624 15.952 6.740 1.00 15.00 H new ATOM 0 HD21 LEU B 145 11.941 14.979 9.123 1.00 15.00 H new ATOM 0 HD22 LEU B 145 12.138 14.046 7.620 1.00 15.00 H new ATOM 0 HD23 LEU B 145 12.547 13.307 9.186 1.00 15.00 H new ATOM 2093 N GLU B 146 15.999 11.690 5.659 1.00 15.00 N ATOM 2094 CA GLU B 146 17.122 10.902 5.150 1.00 15.00 C ATOM 2095 C GLU B 146 17.379 11.144 3.661 1.00 15.00 C ATOM 2096 O GLU B 146 18.488 11.514 3.272 1.00 15.00 O ATOM 2097 CB GLU B 146 16.858 9.413 5.399 1.00 15.00 C ATOM 2098 CG GLU B 146 17.999 8.503 4.979 1.00 15.00 C ATOM 2099 CD GLU B 146 17.701 7.037 5.223 1.00 15.00 C ATOM 2100 OE1 GLU B 146 16.879 6.461 4.482 1.00 15.00 O ATOM 2101 OE2 GLU B 146 18.297 6.451 6.152 1.00 15.00 O1- ATOM 0 H GLU B 146 15.229 11.130 6.024 1.00 15.00 H new ATOM 0 HA GLU B 146 18.016 11.220 5.686 1.00 15.00 H new ATOM 0 HB2 GLU B 146 16.659 9.263 6.460 1.00 15.00 H new ATOM 0 HB3 GLU B 146 15.957 9.120 4.861 1.00 15.00 H new ATOM 0 HG2 GLU B 146 18.208 8.655 3.920 1.00 15.00 H new ATOM 0 HG3 GLU B 146 18.900 8.782 5.525 1.00 15.00 H new ATOM 2108 N ASP B 147 16.347 10.952 2.845 1.00 15.00 N ATOM 2109 CA ASP B 147 16.454 11.115 1.391 1.00 15.00 C ATOM 2110 C ASP B 147 16.701 12.572 1.006 1.00 15.00 C ATOM 2111 O ASP B 147 17.212 12.864 -0.077 1.00 15.00 O ATOM 2112 CB ASP B 147 15.179 10.595 0.708 1.00 15.00 C ATOM 2113 CG ASP B 147 15.167 10.833 -0.790 1.00 15.00 C ATOM 2114 OD1 ASP B 147 15.774 10.033 -1.532 1.00 15.00 O ATOM 2115 OD2 ASP B 147 14.549 11.825 -1.236 1.00 15.00 O1- ATOM 0 H ASP B 147 15.417 10.681 3.166 1.00 15.00 H new ATOM 0 HA ASP B 147 17.310 10.532 1.051 1.00 15.00 H new ATOM 0 HB2 ASP B 147 15.081 9.527 0.901 1.00 15.00 H new ATOM 0 HB3 ASP B 147 14.311 11.081 1.154 1.00 15.00 H new ATOM 2120 N LYS B 148 16.341 13.481 1.897 1.00 15.00 N ATOM 2121 CA LYS B 148 16.520 14.907 1.651 1.00 15.00 C ATOM 2122 C LYS B 148 17.963 15.328 1.908 1.00 15.00 C ATOM 2123 O LYS B 148 18.503 16.190 1.214 1.00 15.00 O ATOM 2124 CB LYS B 148 15.579 15.714 2.540 1.00 15.00 C ATOM 2125 CG LYS B 148 15.335 17.130 2.052 1.00 15.00 C ATOM 2126 CD LYS B 148 14.378 17.866 2.971 1.00 15.00 C ATOM 2127 CE LYS B 148 14.090 19.272 2.474 1.00 15.00 C ATOM 2128 NZ LYS B 148 13.142 19.990 3.364 1.00 15.00 N1+ ATOM 0 H LYS B 148 15.922 13.259 2.800 1.00 15.00 H new ATOM 0 HA LYS B 148 16.285 15.104 0.605 1.00 15.00 H new ATOM 0 HB2 LYS B 148 14.624 15.194 2.607 1.00 15.00 H new ATOM 0 HB3 LYS B 148 15.992 15.754 3.548 1.00 15.00 H new ATOM 0 HG2 LYS B 148 16.281 17.668 2.000 1.00 15.00 H new ATOM 0 HG3 LYS B 148 14.927 17.105 1.042 1.00 15.00 H new ATOM 0 HD2 LYS B 148 13.444 17.308 3.046 1.00 15.00 H new ATOM 0 HD3 LYS B 148 14.802 17.914 3.974 1.00 15.00 H new ATOM 0 HE2 LYS B 148 15.023 19.832 2.409 1.00 15.00 H new ATOM 0 HE3 LYS B 148 13.677 19.224 1.467 1.00 15.00 H new ATOM 0 HZ1 LYS B 148 12.971 20.946 2.991 1.00 15.00 H new ATOM 0 HZ2 LYS B 148 12.243 19.469 3.406 1.00 15.00 H new ATOM 0 HZ3 LYS B 148 13.547 20.059 4.319 1.00 15.00 H new ATOM 2142 N LEU B 149 18.575 14.731 2.917 1.00 15.00 N ATOM 2143 CA LEU B 149 19.954 15.045 3.259 1.00 15.00 C ATOM 2144 C LEU B 149 20.920 14.290 2.354 1.00 15.00 C ATOM 2145 O LEU B 149 21.846 14.874 1.784 1.00 15.00 O ATOM 2146 CB LEU B 149 20.226 14.703 4.724 1.00 15.00 C ATOM 2147 CG LEU B 149 21.622 15.074 5.230 1.00 15.00 C ATOM 2148 CD1 LEU B 149 21.827 16.583 5.202 1.00 15.00 C ATOM 2149 CD2 LEU B 149 21.843 14.529 6.634 1.00 15.00 C ATOM 0 H LEU B 149 18.140 14.027 3.514 1.00 15.00 H new ATOM 0 HA LEU B 149 20.109 16.114 3.111 1.00 15.00 H new ATOM 0 HB2 LEU B 149 19.486 15.210 5.343 1.00 15.00 H new ATOM 0 HB3 LEU B 149 20.079 13.632 4.864 1.00 15.00 H new ATOM 0 HG LEU B 149 22.356 14.621 4.564 1.00 15.00 H new ATOM 0 HD11 LEU B 149 22.826 16.821 5.566 1.00 15.00 H new ATOM 0 HD12 LEU B 149 21.717 16.946 4.180 1.00 15.00 H new ATOM 0 HD13 LEU B 149 21.085 17.063 5.840 1.00 15.00 H new ATOM 0 HD21 LEU B 149 22.841 14.802 6.978 1.00 15.00 H new ATOM 0 HD22 LEU B 149 21.098 14.951 7.309 1.00 15.00 H new ATOM 0 HD23 LEU B 149 21.748 13.443 6.622 1.00 15.00 H new ATOM 2161 N ALA B 150 20.700 12.990 2.221 1.00 15.00 N ATOM 2162 CA ALA B 150 21.546 12.161 1.382 1.00 15.00 C ATOM 2163 C ALA B 150 21.056 12.206 -0.058 1.00 15.00 C ATOM 2164 O ALA B 150 19.959 11.741 -0.366 1.00 15.00 O ATOM 2165 CB ALA B 150 21.569 10.730 1.901 1.00 15.00 C ATOM 0 H ALA B 150 19.942 12.489 2.684 1.00 15.00 H new ATOM 0 HA ALA B 150 22.564 12.549 1.413 1.00 15.00 H new ATOM 0 HB1 ALA B 150 22.208 10.121 1.261 1.00 15.00 H new ATOM 0 HB2 ALA B 150 21.959 10.718 2.919 1.00 15.00 H new ATOM 0 HB3 ALA B 150 20.557 10.325 1.895 1.00 15.00 H new ATOM 2171 N ASP B 151 21.866 12.777 -0.931 1.00 15.00 N ATOM 2172 CA ASP B 151 21.518 12.893 -2.342 1.00 15.00 C ATOM 2173 C ASP B 151 22.008 11.677 -3.114 1.00 15.00 C ATOM 2174 O ASP B 151 21.653 11.481 -4.276 1.00 15.00 O ATOM 2175 CB ASP B 151 22.084 14.191 -2.952 1.00 15.00 C ATOM 2176 CG ASP B 151 23.575 14.391 -2.718 1.00 15.00 C ATOM 2177 OD1 ASP B 151 24.104 13.907 -1.695 1.00 15.00 O ATOM 2178 OD2 ASP B 151 24.224 15.066 -3.547 1.00 15.00 O1- ATOM 0 H ASP B 151 22.775 13.171 -0.689 1.00 15.00 H new ATOM 0 HA ASP B 151 20.432 12.936 -2.418 1.00 15.00 H new ATOM 0 HB2 ASP B 151 21.893 14.188 -4.025 1.00 15.00 H new ATOM 0 HB3 ASP B 151 21.545 15.041 -2.534 1.00 15.00 H new ATOM 2183 N TYR B 152 22.813 10.855 -2.453 1.00 15.00 N ATOM 2184 CA TYR B 152 23.348 9.643 -3.055 1.00 15.00 C ATOM 2185 C TYR B 152 23.376 8.524 -2.029 1.00 15.00 C ATOM 2186 O TYR B 152 22.921 7.408 -2.345 1.00 15.00 O ATOM 2187 CB TYR B 152 24.757 9.874 -3.617 1.00 15.00 C ATOM 2188 CG TYR B 152 24.765 10.609 -4.939 1.00 15.00 C ATOM 2189 CD1 TYR B 152 25.104 11.954 -5.005 1.00 15.00 C ATOM 2190 CD2 TYR B 152 24.427 9.960 -6.122 1.00 15.00 C ATOM 2191 CE1 TYR B 152 25.105 12.632 -6.210 1.00 15.00 C ATOM 2192 CE2 TYR B 152 24.427 10.630 -7.329 1.00 15.00 C ATOM 2193 CZ TYR B 152 24.765 11.965 -7.368 1.00 15.00 C ATOM 2194 OH TYR B 152 24.769 12.637 -8.569 1.00 15.00 O ATOM 2195 OXT TYR B 152 23.838 8.776 -0.896 1.00 15.00 O1- ATOM 0 H TYR B 152 23.111 11.009 -1.490 1.00 15.00 H new ATOM 0 HA TYR B 152 22.697 9.361 -3.882 1.00 15.00 H new ATOM 0 HB2 TYR B 152 25.341 10.441 -2.892 1.00 15.00 H new ATOM 0 HB3 TYR B 152 25.252 8.911 -3.742 1.00 15.00 H new ATOM 0 HD1 TYR B 152 25.371 12.479 -4.100 1.00 15.00 H new ATOM 0 HD2 TYR B 152 24.160 8.914 -6.096 1.00 15.00 H new ATOM 0 HE1 TYR B 152 25.371 13.678 -6.244 1.00 15.00 H new ATOM 0 HE2 TYR B 152 24.163 10.110 -8.238 1.00 15.00 H new ATOM 0 HH TYR B 152 24.507 12.024 -9.288 1.00 15.00 H new