USER MOD reduce.3.24.130724 H: found=0, std=0, add=1300, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1298 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 3 MET CE :methyl -175:sc= -0.461 (180deg=-0.454) USER MOD Set 1.2: A 168 MET CE :methyl -172:sc= -2.95 (180deg=-3.41) USER MOD Set 2.1: A 105 HIS : no HD1:sc= -2.47 K(o=-2.5,f=-5!) USER MOD Set 2.2: A 118 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 114 LYS NZ :NH3+ -170:sc= 1.29 (180deg=0) USER MOD Set 3.2: A 171 HIS : no HD1:sc= -1.15! K(o=0.14!,f=-4.5) USER MOD Set 4.1: A 90 GLN :FLIP amide:sc= -0.345 F(o=-7.5!,f=0.099) USER MOD Set 4.2: A 148 ASN : amide:sc= 0.444 K(o=0.099,f=-2.5!) USER MOD Set 5.1: A 10 SER OG : rot 131:sc= 0.706 USER MOD Set 5.2: A 62 GLN : amide:sc= 0.878 K(o=1.6,f=-8.4!) USER MOD Set 6.1: A 33 HIS : no HD1:sc= 0.0388 X(o=0.039,f=-0.24) USER MOD Set 6.2: A 46 TYR OH : rot 180:sc= 0 USER MOD Set 7.1: A 12 CYS SG : rot 19:sc= 0.179 USER MOD Set 7.2: A 16 MET CE :methyl -171:sc= -0.602 (180deg=-0.881) USER MOD Set 8.1: A 9 SER OG : rot 130:sc= 0.198 USER MOD Set 8.2: A 34 ASN : amide:sc= 0.516 K(o=0.71,f=-8.5!) USER MOD Single : A 1 MET CE :methyl -173:sc= -0.366 (180deg=-0.458) USER MOD Single : A 1 MET N :NH3+ -141:sc= 0.303 (180deg=0.003) USER MOD Single : A 2 ASN : amide:sc= 0.602 K(o=0.6,f=-0.043) USER MOD Single : A 7 TYR OH : rot 166:sc= 1.25 USER MOD Single : A 11 THR OG1 : rot 129:sc= 0.686 USER MOD Single : A 13 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot -110:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ -166:sc= 1.3 (180deg=1.11) USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -159:sc= 1.23 (180deg=0.884) USER MOD Single : A 43 MET CE :methyl 168:sc= -0.394 (180deg=-0.786) USER MOD Single : A 45 GLN : amide:sc= 0.457 X(o=0.46,f=-0.0028) USER MOD Single : A 55 THR OG1 : rot 90:sc= 0.287 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -165:sc= 2.18 (180deg=1.77) USER MOD Single : A 85 TYR OH : rot -179:sc= 0.242 USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 MET CE :methyl 167:sc= -0.213 (180deg=-0.384) USER MOD Single : A 107 LYS NZ :NH3+ -163:sc= 0.133 (180deg=0.0675) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ -179:sc= 1.63 (180deg=1.63) USER MOD Single : A 121 THR OG1 : rot -164:sc= 0.284 USER MOD Single : A 127 THR OG1 : rot -40:sc= 0.0182 USER MOD Single : A 128 SER OG : rot 172:sc= 0.62 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 GLN :FLIP amide:sc= 0 F(o=-0.58,f=0) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 SER OG : rot 142:sc= 0.743 USER MOD Single : A 158 GLN : amide:sc= 1.03 K(o=1,f=-0.22) USER MOD Single : A 159 SER OG : rot 76:sc= 0.00178 USER MOD Single : A 161 CYS SG : rot 77:sc= -1.47! USER MOD Single : A 163 GLN : amide:sc= 1.26 K(o=1.3,f=-0.5) USER MOD Single : A 166 ASN : amide:sc= 0.893 K(o=0.89,f=0) USER MOD Single : A 172 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.038 0.870 -0.238 1.00 0.00 N ATOM 2 CA MET A 1 2.084 0.879 -1.310 1.00 0.00 C ATOM 3 C MET A 1 2.253 2.264 -1.931 1.00 0.00 C ATOM 4 O MET A 1 1.269 2.965 -2.144 1.00 0.00 O ATOM 5 CB MET A 1 1.850 -0.177 -2.427 1.00 0.00 C ATOM 6 CG MET A 1 0.679 0.078 -3.396 1.00 0.00 C ATOM 7 SD MET A 1 -0.962 -0.314 -2.728 1.00 0.00 S ATOM 8 CE MET A 1 -1.852 -0.656 -4.269 1.00 0.00 C ATOM 0 H1 MET A 1 1.349 0.261 0.546 1.00 0.00 H new ATOM 0 H2 MET A 1 0.892 1.838 0.113 1.00 0.00 H new ATOM 0 H3 MET A 1 0.145 0.504 -0.627 1.00 0.00 H new ATOM 0 HA MET A 1 3.006 0.602 -0.799 1.00 0.00 H new ATOM 0 HB2 MET A 1 2.765 -0.257 -3.014 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.691 -1.145 -1.951 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.694 1.127 -3.693 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.838 -0.511 -4.299 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.912 -0.794 -4.054 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.727 0.182 -4.955 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.454 -1.562 -4.726 1.00 0.00 H new ATOM 20 N ASN A 2 3.482 2.629 -2.305 1.00 0.00 N ATOM 21 CA ASN A 2 3.734 3.815 -3.121 1.00 0.00 C ATOM 22 C ASN A 2 3.582 3.443 -4.597 1.00 0.00 C ATOM 23 O ASN A 2 4.003 2.364 -5.013 1.00 0.00 O ATOM 24 CB ASN A 2 5.088 4.469 -2.803 1.00 0.00 C ATOM 25 CG ASN A 2 6.330 3.569 -2.743 1.00 0.00 C ATOM 26 OD1 ASN A 2 7.223 3.809 -1.936 1.00 0.00 O ATOM 27 ND2 ASN A 2 6.436 2.524 -3.552 1.00 0.00 N ATOM 0 H ASN A 2 4.324 2.113 -2.052 1.00 0.00 H new ATOM 0 HA ASN A 2 2.995 4.578 -2.879 1.00 0.00 H new ATOM 0 HB2 ASN A 2 5.270 5.239 -3.553 1.00 0.00 H new ATOM 0 HB3 ASN A 2 4.996 4.975 -1.842 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.258 1.922 -3.503 1.00 0.00 H new ATOM 0 HD22 ASN A 2 5.696 2.322 -4.224 1.00 0.00 H new ATOM 34 N MET A 3 2.995 4.338 -5.378 1.00 0.00 N ATOM 35 CA MET A 3 2.617 4.169 -6.777 1.00 0.00 C ATOM 36 C MET A 3 3.277 5.270 -7.600 1.00 0.00 C ATOM 37 O MET A 3 3.425 6.397 -7.133 1.00 0.00 O ATOM 38 CB MET A 3 1.085 4.215 -6.918 1.00 0.00 C ATOM 39 CG MET A 3 0.391 3.308 -5.884 1.00 0.00 C ATOM 40 SD MET A 3 -1.316 2.812 -6.247 1.00 0.00 S ATOM 41 CE MET A 3 -2.128 4.412 -6.481 1.00 0.00 C ATOM 0 H MET A 3 2.753 5.265 -5.029 1.00 0.00 H new ATOM 0 HA MET A 3 2.956 3.200 -7.143 1.00 0.00 H new ATOM 0 HB2 MET A 3 0.739 5.241 -6.793 1.00 0.00 H new ATOM 0 HB3 MET A 3 0.802 3.903 -7.924 1.00 0.00 H new ATOM 0 HG2 MET A 3 0.990 2.405 -5.768 1.00 0.00 H new ATOM 0 HG3 MET A 3 0.399 3.821 -4.922 1.00 0.00 H new ATOM 0 HE1 MET A 3 -3.198 4.260 -6.622 1.00 0.00 H new ATOM 0 HE2 MET A 3 -1.963 5.036 -5.603 1.00 0.00 H new ATOM 0 HE3 MET A 3 -1.713 4.906 -7.360 1.00 0.00 H new ATOM 51 N GLY A 4 3.644 4.971 -8.839 1.00 0.00 N ATOM 52 CA GLY A 4 4.387 5.910 -9.673 1.00 0.00 C ATOM 53 C GLY A 4 3.528 6.433 -10.811 1.00 0.00 C ATOM 54 O GLY A 4 3.125 5.637 -11.654 1.00 0.00 O ATOM 0 H GLY A 4 3.438 4.081 -9.292 1.00 0.00 H new ATOM 0 HA2 GLY A 4 4.736 6.744 -9.064 1.00 0.00 H new ATOM 0 HA3 GLY A 4 5.272 5.419 -10.078 1.00 0.00 H new ATOM 58 N LEU A 5 3.236 7.738 -10.866 1.00 0.00 N ATOM 59 CA LEU A 5 2.557 8.352 -12.003 1.00 0.00 C ATOM 60 C LEU A 5 3.586 8.808 -13.047 1.00 0.00 C ATOM 61 O LEU A 5 4.165 9.884 -12.917 1.00 0.00 O ATOM 62 CB LEU A 5 1.690 9.517 -11.498 1.00 0.00 C ATOM 63 CG LEU A 5 0.624 10.064 -12.471 1.00 0.00 C ATOM 64 CD1 LEU A 5 0.789 9.754 -13.962 1.00 0.00 C ATOM 65 CD2 LEU A 5 -0.743 9.547 -12.040 1.00 0.00 C ATOM 0 H LEU A 5 3.466 8.395 -10.120 1.00 0.00 H new ATOM 0 HA LEU A 5 1.904 7.628 -12.491 1.00 0.00 H new ATOM 0 HB2 LEU A 5 1.185 9.195 -10.587 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.352 10.338 -11.222 1.00 0.00 H new ATOM 0 HG LEU A 5 0.743 11.145 -12.398 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -0.033 10.202 -14.520 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.735 10.164 -14.316 1.00 0.00 H new ATOM 0 HD13 LEU A 5 0.783 8.674 -14.112 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.506 9.926 -12.720 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.744 8.457 -12.065 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.958 9.887 -11.027 1.00 0.00 H new ATOM 77 N PHE A 6 3.772 8.024 -14.101 1.00 0.00 N ATOM 78 CA PHE A 6 4.634 8.328 -15.243 1.00 0.00 C ATOM 79 C PHE A 6 3.834 8.867 -16.419 1.00 0.00 C ATOM 80 O PHE A 6 2.715 8.437 -16.682 1.00 0.00 O ATOM 81 CB PHE A 6 5.385 7.072 -15.675 1.00 0.00 C ATOM 82 CG PHE A 6 6.349 6.580 -14.629 1.00 0.00 C ATOM 83 CD1 PHE A 6 5.906 5.772 -13.568 1.00 0.00 C ATOM 84 CD2 PHE A 6 7.685 6.991 -14.688 1.00 0.00 C ATOM 85 CE1 PHE A 6 6.798 5.412 -12.549 1.00 0.00 C ATOM 86 CE2 PHE A 6 8.579 6.603 -13.684 1.00 0.00 C ATOM 87 CZ PHE A 6 8.139 5.823 -12.599 1.00 0.00 C ATOM 0 H PHE A 6 3.308 7.120 -14.190 1.00 0.00 H new ATOM 0 HA PHE A 6 5.341 9.096 -14.930 1.00 0.00 H new ATOM 0 HB2 PHE A 6 4.666 6.284 -15.900 1.00 0.00 H new ATOM 0 HB3 PHE A 6 5.930 7.279 -16.596 1.00 0.00 H new ATOM 0 HD1 PHE A 6 4.882 5.430 -13.538 1.00 0.00 H new ATOM 0 HD2 PHE A 6 8.026 7.607 -15.507 1.00 0.00 H new ATOM 0 HE1 PHE A 6 6.451 4.814 -11.719 1.00 0.00 H new ATOM 0 HE2 PHE A 6 9.614 6.905 -13.742 1.00 0.00 H new ATOM 0 HZ PHE A 6 8.825 5.544 -11.813 1.00 0.00 H new ATOM 97 N TYR A 7 4.433 9.786 -17.162 1.00 0.00 N ATOM 98 CA TYR A 7 3.853 10.402 -18.349 1.00 0.00 C ATOM 99 C TYR A 7 4.952 11.130 -19.119 1.00 0.00 C ATOM 100 O TYR A 7 6.064 11.278 -18.610 1.00 0.00 O ATOM 101 CB TYR A 7 2.764 11.392 -17.920 1.00 0.00 C ATOM 102 CG TYR A 7 3.274 12.506 -17.032 1.00 0.00 C ATOM 103 CD1 TYR A 7 3.507 12.262 -15.667 1.00 0.00 C ATOM 104 CD2 TYR A 7 3.579 13.766 -17.575 1.00 0.00 C ATOM 105 CE1 TYR A 7 4.033 13.259 -14.839 1.00 0.00 C ATOM 106 CE2 TYR A 7 4.105 14.767 -16.747 1.00 0.00 C ATOM 107 CZ TYR A 7 4.335 14.526 -15.372 1.00 0.00 C ATOM 108 OH TYR A 7 4.847 15.486 -14.556 1.00 0.00 O ATOM 0 H TYR A 7 5.367 10.136 -16.949 1.00 0.00 H new ATOM 0 HA TYR A 7 3.410 9.640 -18.991 1.00 0.00 H new ATOM 0 HB2 TYR A 7 2.309 11.827 -18.810 1.00 0.00 H new ATOM 0 HB3 TYR A 7 1.979 10.850 -17.394 1.00 0.00 H new ATOM 0 HD1 TYR A 7 3.277 11.292 -15.252 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.409 13.962 -18.623 1.00 0.00 H new ATOM 0 HE1 TYR A 7 4.207 13.057 -13.792 1.00 0.00 H new ATOM 0 HE2 TYR A 7 4.338 15.736 -17.164 1.00 0.00 H new ATOM 0 HH TYR A 7 5.213 16.215 -15.099 1.00 0.00 H new ATOM 118 N GLY A 8 4.638 11.637 -20.308 1.00 0.00 N ATOM 119 CA GLY A 8 5.520 12.488 -21.093 1.00 0.00 C ATOM 120 C GLY A 8 4.631 13.474 -21.831 1.00 0.00 C ATOM 121 O GLY A 8 3.639 13.068 -22.437 1.00 0.00 O ATOM 0 H GLY A 8 3.741 11.462 -20.761 1.00 0.00 H new ATOM 0 HA2 GLY A 8 6.227 13.011 -20.449 1.00 0.00 H new ATOM 0 HA3 GLY A 8 6.106 11.895 -21.795 1.00 0.00 H new ATOM 125 N SER A 9 4.927 14.764 -21.712 1.00 0.00 N ATOM 126 CA SER A 9 4.103 15.867 -22.167 1.00 0.00 C ATOM 127 C SER A 9 4.955 16.812 -23.021 1.00 0.00 C ATOM 128 O SER A 9 6.046 17.206 -22.600 1.00 0.00 O ATOM 129 CB SER A 9 3.518 16.549 -20.918 1.00 0.00 C ATOM 130 OG SER A 9 4.533 16.751 -19.939 1.00 0.00 O ATOM 0 H SER A 9 5.792 15.079 -21.273 1.00 0.00 H new ATOM 0 HA SER A 9 3.278 15.535 -22.797 1.00 0.00 H new ATOM 0 HB2 SER A 9 3.074 17.506 -21.193 1.00 0.00 H new ATOM 0 HB3 SER A 9 2.719 15.935 -20.501 1.00 0.00 H new ATOM 0 HG SER A 9 4.511 17.682 -19.632 1.00 0.00 H new ATOM 136 N SER A 10 4.454 17.199 -24.200 1.00 0.00 N ATOM 137 CA SER A 10 5.135 18.192 -25.036 1.00 0.00 C ATOM 138 C SER A 10 4.746 19.602 -24.584 1.00 0.00 C ATOM 139 O SER A 10 5.579 20.512 -24.597 1.00 0.00 O ATOM 140 CB SER A 10 4.793 17.970 -26.509 1.00 0.00 C ATOM 141 OG SER A 10 4.809 16.583 -26.811 1.00 0.00 O ATOM 0 H SER A 10 3.584 16.841 -24.594 1.00 0.00 H new ATOM 0 HA SER A 10 6.213 18.079 -24.924 1.00 0.00 H new ATOM 0 HB2 SER A 10 3.810 18.386 -26.729 1.00 0.00 H new ATOM 0 HB3 SER A 10 5.510 18.496 -27.140 1.00 0.00 H new ATOM 0 HG SER A 10 3.989 16.343 -27.291 1.00 0.00 H new ATOM 147 N THR A 11 3.480 19.772 -24.175 1.00 0.00 N ATOM 148 CA THR A 11 2.923 21.052 -23.766 1.00 0.00 C ATOM 149 C THR A 11 2.840 21.051 -22.232 1.00 0.00 C ATOM 150 O THR A 11 3.745 21.544 -21.551 1.00 0.00 O ATOM 151 CB THR A 11 1.585 21.258 -24.511 1.00 0.00 C ATOM 152 OG1 THR A 11 0.721 20.197 -24.169 1.00 0.00 O ATOM 153 CG2 THR A 11 1.730 21.162 -26.031 1.00 0.00 C ATOM 0 H THR A 11 2.810 19.005 -24.121 1.00 0.00 H new ATOM 0 HA THR A 11 3.539 21.910 -24.036 1.00 0.00 H new ATOM 0 HB THR A 11 1.222 22.247 -24.231 1.00 0.00 H new ATOM 0 HG1 THR A 11 -0.143 20.559 -23.882 1.00 0.00 H new ATOM 0 HG21 THR A 11 0.758 21.315 -26.500 1.00 0.00 H new ATOM 0 HG22 THR A 11 2.425 21.926 -26.379 1.00 0.00 H new ATOM 0 HG23 THR A 11 2.111 20.176 -26.299 1.00 0.00 H new ATOM 161 N CYS A 12 1.777 20.430 -21.705 1.00 0.00 N ATOM 162 CA CYS A 12 1.424 20.265 -20.302 1.00 0.00 C ATOM 163 C CYS A 12 0.142 19.431 -20.121 1.00 0.00 C ATOM 164 O CYS A 12 -0.213 19.153 -18.981 1.00 0.00 O ATOM 165 CB CYS A 12 1.223 21.648 -19.643 1.00 0.00 C ATOM 166 SG CYS A 12 0.109 22.720 -20.608 1.00 0.00 S ATOM 0 H CYS A 12 1.083 19.993 -22.311 1.00 0.00 H new ATOM 0 HA CYS A 12 2.246 19.732 -19.823 1.00 0.00 H new ATOM 0 HB2 CYS A 12 0.816 21.514 -18.640 1.00 0.00 H new ATOM 0 HB3 CYS A 12 2.190 22.139 -19.532 1.00 0.00 H new ATOM 0 HG CYS A 12 -0.592 21.993 -21.426 1.00 0.00 H new ATOM 172 N TYR A 13 -0.593 19.015 -21.167 1.00 0.00 N ATOM 173 CA TYR A 13 -1.941 18.456 -20.961 1.00 0.00 C ATOM 174 C TYR A 13 -1.871 17.094 -20.274 1.00 0.00 C ATOM 175 O TYR A 13 -2.579 16.837 -19.301 1.00 0.00 O ATOM 176 CB TYR A 13 -2.762 18.400 -22.262 1.00 0.00 C ATOM 177 CG TYR A 13 -2.696 19.591 -23.212 1.00 0.00 C ATOM 178 CD1 TYR A 13 -2.437 20.902 -22.762 1.00 0.00 C ATOM 179 CD2 TYR A 13 -2.906 19.372 -24.587 1.00 0.00 C ATOM 180 CE1 TYR A 13 -2.342 21.968 -23.672 1.00 0.00 C ATOM 181 CE2 TYR A 13 -2.822 20.433 -25.507 1.00 0.00 C ATOM 182 CZ TYR A 13 -2.533 21.741 -25.053 1.00 0.00 C ATOM 183 OH TYR A 13 -2.440 22.784 -25.928 1.00 0.00 O ATOM 0 H TYR A 13 -0.287 19.053 -22.139 1.00 0.00 H new ATOM 0 HA TYR A 13 -2.472 19.138 -20.296 1.00 0.00 H new ATOM 0 HB2 TYR A 13 -2.447 17.516 -22.816 1.00 0.00 H new ATOM 0 HB3 TYR A 13 -3.807 18.250 -21.989 1.00 0.00 H new ATOM 0 HD1 TYR A 13 -2.310 21.089 -21.706 1.00 0.00 H new ATOM 0 HD2 TYR A 13 -3.134 18.377 -24.940 1.00 0.00 H new ATOM 0 HE1 TYR A 13 -2.122 22.963 -23.315 1.00 0.00 H new ATOM 0 HE2 TYR A 13 -2.978 20.249 -26.560 1.00 0.00 H new ATOM 0 HH TYR A 13 -2.596 22.461 -26.840 1.00 0.00 H new ATOM 193 N THR A 14 -0.934 16.257 -20.727 1.00 0.00 N ATOM 194 CA THR A 14 -0.716 14.928 -20.137 1.00 0.00 C ATOM 195 C THR A 14 -0.155 15.077 -18.714 1.00 0.00 C ATOM 196 O THR A 14 -0.470 14.278 -17.833 1.00 0.00 O ATOM 197 CB THR A 14 0.147 14.054 -21.070 1.00 0.00 C ATOM 198 OG1 THR A 14 -0.336 14.160 -22.393 1.00 0.00 O ATOM 199 CG2 THR A 14 0.067 12.565 -20.729 1.00 0.00 C ATOM 0 H THR A 14 -0.310 16.475 -21.504 1.00 0.00 H new ATOM 0 HA THR A 14 -1.663 14.398 -20.039 1.00 0.00 H new ATOM 0 HB THR A 14 1.171 14.410 -20.953 1.00 0.00 H new ATOM 0 HG1 THR A 14 -0.751 13.313 -22.659 1.00 0.00 H new ATOM 0 HG21 THR A 14 0.694 12.000 -21.418 1.00 0.00 H new ATOM 0 HG22 THR A 14 0.415 12.406 -19.708 1.00 0.00 H new ATOM 0 HG23 THR A 14 -0.965 12.227 -20.817 1.00 0.00 H new ATOM 207 N GLU A 15 0.610 16.148 -18.473 1.00 0.00 N ATOM 208 CA GLU A 15 1.148 16.483 -17.167 1.00 0.00 C ATOM 209 C GLU A 15 0.029 16.860 -16.208 1.00 0.00 C ATOM 210 O GLU A 15 -0.031 16.333 -15.104 1.00 0.00 O ATOM 211 CB GLU A 15 2.208 17.591 -17.312 1.00 0.00 C ATOM 212 CG GLU A 15 2.842 17.980 -15.969 1.00 0.00 C ATOM 213 CD GLU A 15 4.282 18.499 -16.134 1.00 0.00 C ATOM 214 OE1 GLU A 15 4.472 19.701 -16.437 1.00 0.00 O1- ATOM 215 OE2 GLU A 15 5.233 17.695 -15.944 1.00 0.00 O ATOM 0 H GLU A 15 0.872 16.813 -19.200 1.00 0.00 H new ATOM 0 HA GLU A 15 1.642 15.612 -16.737 1.00 0.00 H new ATOM 0 HB2 GLU A 15 2.989 17.255 -17.994 1.00 0.00 H new ATOM 0 HB3 GLU A 15 1.749 18.471 -17.762 1.00 0.00 H new ATOM 0 HG2 GLU A 15 2.234 18.748 -15.491 1.00 0.00 H new ATOM 0 HG3 GLU A 15 2.843 17.115 -15.306 1.00 0.00 H new ATOM 222 N MET A 16 -0.908 17.704 -16.632 1.00 0.00 N ATOM 223 CA MET A 16 -1.989 18.164 -15.765 1.00 0.00 C ATOM 224 C MET A 16 -2.888 17.005 -15.349 1.00 0.00 C ATOM 225 O MET A 16 -3.330 16.953 -14.200 1.00 0.00 O ATOM 226 CB MET A 16 -2.788 19.295 -16.431 1.00 0.00 C ATOM 227 CG MET A 16 -1.975 20.594 -16.515 1.00 0.00 C ATOM 228 SD MET A 16 -2.838 21.996 -17.284 1.00 0.00 S ATOM 229 CE MET A 16 -2.966 21.389 -18.986 1.00 0.00 C ATOM 0 H MET A 16 -0.940 18.085 -17.577 1.00 0.00 H new ATOM 0 HA MET A 16 -1.545 18.572 -14.857 1.00 0.00 H new ATOM 0 HB2 MET A 16 -3.087 18.988 -17.433 1.00 0.00 H new ATOM 0 HB3 MET A 16 -3.703 19.475 -15.867 1.00 0.00 H new ATOM 0 HG2 MET A 16 -1.674 20.881 -15.508 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.062 20.397 -17.077 1.00 0.00 H new ATOM 0 HE1 MET A 16 -3.327 22.190 -19.632 1.00 0.00 H new ATOM 0 HE2 MET A 16 -1.985 21.060 -19.330 1.00 0.00 H new ATOM 0 HE3 MET A 16 -3.663 20.552 -19.022 1.00 0.00 H new ATOM 239 N ALA A 17 -3.112 16.034 -16.236 1.00 0.00 N ATOM 240 CA ALA A 17 -3.813 14.816 -15.873 1.00 0.00 C ATOM 241 C ALA A 17 -3.047 14.041 -14.807 1.00 0.00 C ATOM 242 O ALA A 17 -3.655 13.623 -13.828 1.00 0.00 O ATOM 243 CB ALA A 17 -4.120 13.973 -17.112 1.00 0.00 C ATOM 0 H ALA A 17 -2.815 16.074 -17.211 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.773 15.085 -15.432 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.645 13.066 -16.814 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -4.745 14.546 -17.796 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -3.188 13.705 -17.610 1.00 0.00 H new ATOM 249 N ALA A 18 -1.725 13.915 -14.935 1.00 0.00 N ATOM 250 CA ALA A 18 -0.871 13.273 -13.942 1.00 0.00 C ATOM 251 C ALA A 18 -1.067 13.911 -12.570 1.00 0.00 C ATOM 252 O ALA A 18 -1.265 13.193 -11.587 1.00 0.00 O ATOM 253 CB ALA A 18 0.604 13.373 -14.383 1.00 0.00 C ATOM 0 H ALA A 18 -1.212 14.263 -15.745 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.147 12.221 -13.865 1.00 0.00 H new ATOM 0 HB1 ALA A 18 1.240 12.893 -13.639 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.731 12.875 -15.344 1.00 0.00 H new ATOM 0 HB3 ALA A 18 0.885 14.422 -14.477 1.00 0.00 H new ATOM 259 N GLU A 19 -1.070 15.246 -12.509 1.00 0.00 N ATOM 260 CA GLU A 19 -1.256 15.984 -11.259 1.00 0.00 C ATOM 261 C GLU A 19 -2.581 15.610 -10.628 1.00 0.00 C ATOM 262 O GLU A 19 -2.623 15.314 -9.433 1.00 0.00 O ATOM 263 CB GLU A 19 -1.222 17.515 -11.414 1.00 0.00 C ATOM 264 CG GLU A 19 -0.047 18.030 -12.226 1.00 0.00 C ATOM 265 CD GLU A 19 0.153 19.544 -12.030 1.00 0.00 C ATOM 266 OE1 GLU A 19 -0.498 20.349 -12.737 1.00 0.00 O ATOM 267 OE2 GLU A 19 0.966 19.939 -11.159 1.00 0.00 O1- ATOM 0 H GLU A 19 -0.943 15.844 -13.325 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.411 15.700 -10.632 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -2.148 17.842 -11.887 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -1.192 17.969 -10.424 1.00 0.00 H new ATOM 0 HG2 GLU A 19 0.860 17.501 -11.932 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -0.212 17.817 -13.282 1.00 0.00 H new ATOM 274 N LYS A 20 -3.633 15.605 -11.446 1.00 0.00 N ATOM 275 CA LYS A 20 -4.991 15.329 -11.040 1.00 0.00 C ATOM 276 C LYS A 20 -5.059 13.934 -10.483 1.00 0.00 C ATOM 277 O LYS A 20 -5.454 13.778 -9.339 1.00 0.00 O ATOM 278 CB LYS A 20 -5.947 15.529 -12.226 1.00 0.00 C ATOM 279 CG LYS A 20 -6.156 17.013 -12.558 1.00 0.00 C ATOM 280 CD LYS A 20 -6.864 17.082 -13.915 1.00 0.00 C ATOM 281 CE LYS A 20 -6.891 18.462 -14.566 1.00 0.00 C ATOM 282 NZ LYS A 20 -7.695 19.462 -13.809 1.00 0.00 N1+ ATOM 0 H LYS A 20 -3.549 15.801 -12.443 1.00 0.00 H new ATOM 0 HA LYS A 20 -5.303 16.023 -10.259 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.550 15.015 -13.101 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.909 15.071 -11.996 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -6.755 17.498 -11.787 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -5.201 17.536 -12.596 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.376 16.386 -14.597 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.890 16.738 -13.789 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -5.869 18.829 -14.664 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.295 18.371 -15.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -7.870 20.293 -14.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.603 19.038 -13.531 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.174 19.754 -12.958 1.00 0.00 H new ATOM 296 N ILE A 21 -4.624 12.929 -11.239 1.00 0.00 N ATOM 297 CA ILE A 21 -4.710 11.544 -10.795 1.00 0.00 C ATOM 298 C ILE A 21 -4.056 11.394 -9.427 1.00 0.00 C ATOM 299 O ILE A 21 -4.688 10.932 -8.481 1.00 0.00 O ATOM 300 CB ILE A 21 -4.039 10.629 -11.838 1.00 0.00 C ATOM 301 CG1 ILE A 21 -4.878 10.471 -13.112 1.00 0.00 C ATOM 302 CG2 ILE A 21 -3.809 9.235 -11.244 1.00 0.00 C ATOM 303 CD1 ILE A 21 -3.988 10.422 -14.357 1.00 0.00 C ATOM 0 H ILE A 21 -4.208 13.050 -12.163 1.00 0.00 H new ATOM 0 HA ILE A 21 -5.756 11.251 -10.700 1.00 0.00 H new ATOM 0 HB ILE A 21 -3.095 11.104 -12.103 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -5.471 9.559 -13.049 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.579 11.302 -13.195 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -3.334 8.596 -11.989 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -3.163 9.314 -10.369 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -4.765 8.802 -10.951 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -4.610 10.310 -15.245 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.414 11.346 -14.431 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -3.305 9.576 -14.283 1.00 0.00 H new ATOM 315 N ARG A 22 -2.784 11.783 -9.326 1.00 0.00 N ATOM 316 CA ARG A 22 -2.016 11.680 -8.093 1.00 0.00 C ATOM 317 C ARG A 22 -2.728 12.414 -6.961 1.00 0.00 C ATOM 318 O ARG A 22 -2.741 11.912 -5.848 1.00 0.00 O ATOM 319 CB ARG A 22 -0.592 12.196 -8.407 1.00 0.00 C ATOM 320 CG ARG A 22 0.322 12.459 -7.187 1.00 0.00 C ATOM 321 CD ARG A 22 0.914 13.873 -7.075 1.00 0.00 C ATOM 322 NE ARG A 22 -0.070 14.910 -7.427 1.00 0.00 N ATOM 323 CZ ARG A 22 -0.055 16.213 -7.102 1.00 0.00 C ATOM 324 NH1 ARG A 22 0.919 16.722 -6.358 1.00 0.00 N1+ ATOM 325 NH2 ARG A 22 -1.031 17.002 -7.541 1.00 0.00 N ATOM 0 H ARG A 22 -2.258 12.180 -10.105 1.00 0.00 H new ATOM 0 HA ARG A 22 -1.931 10.654 -7.736 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -0.099 11.471 -9.054 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -0.680 13.122 -8.975 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -0.248 12.254 -6.281 1.00 0.00 H new ATOM 0 HG3 ARG A 22 1.145 11.744 -7.215 1.00 0.00 H new ATOM 0 HD2 ARG A 22 1.268 14.039 -6.057 1.00 0.00 H new ATOM 0 HD3 ARG A 22 1.780 13.957 -7.731 1.00 0.00 H new ATOM 0 HE ARG A 22 -0.863 14.600 -7.988 1.00 0.00 H new ATOM 0 HH11 ARG A 22 1.672 16.121 -6.023 1.00 0.00 H new ATOM 0 HH12 ARG A 22 0.914 17.714 -6.121 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -1.779 16.616 -8.117 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -1.032 17.994 -7.302 1.00 0.00 H new ATOM 339 N ASP A 23 -3.329 13.556 -7.251 1.00 0.00 N ATOM 340 CA ASP A 23 -4.049 14.348 -6.255 1.00 0.00 C ATOM 341 C ASP A 23 -5.296 13.624 -5.748 1.00 0.00 C ATOM 342 O ASP A 23 -5.514 13.526 -4.539 1.00 0.00 O ATOM 343 CB ASP A 23 -4.440 15.727 -6.791 1.00 0.00 C ATOM 344 CG ASP A 23 -5.211 16.508 -5.715 1.00 0.00 C ATOM 345 OD1 ASP A 23 -4.567 17.002 -4.758 1.00 0.00 O1- ATOM 346 OD2 ASP A 23 -6.452 16.644 -5.828 1.00 0.00 O ATOM 0 H ASP A 23 -3.334 13.965 -8.185 1.00 0.00 H new ATOM 0 HA ASP A 23 -3.360 14.484 -5.422 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -3.547 16.279 -7.084 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.055 15.618 -7.684 1.00 0.00 H new ATOM 351 N ILE A 24 -6.088 13.082 -6.675 1.00 0.00 N ATOM 352 CA ILE A 24 -7.361 12.429 -6.389 1.00 0.00 C ATOM 353 C ILE A 24 -7.095 11.157 -5.580 1.00 0.00 C ATOM 354 O ILE A 24 -7.745 10.911 -4.561 1.00 0.00 O ATOM 355 CB ILE A 24 -8.134 12.166 -7.708 1.00 0.00 C ATOM 356 CG1 ILE A 24 -8.519 13.480 -8.438 1.00 0.00 C ATOM 357 CG2 ILE A 24 -9.428 11.372 -7.433 1.00 0.00 C ATOM 358 CD1 ILE A 24 -8.343 13.430 -9.955 1.00 0.00 C ATOM 0 H ILE A 24 -5.854 13.087 -7.668 1.00 0.00 H new ATOM 0 HA ILE A 24 -8.000 13.074 -5.785 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.461 11.593 -8.346 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -9.559 13.716 -8.212 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.913 14.294 -8.040 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.955 11.198 -8.371 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -9.177 10.415 -6.975 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.067 11.941 -6.758 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -8.634 14.388 -10.387 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.299 13.227 -10.194 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -8.970 12.640 -10.368 1.00 0.00 H new ATOM 370 N ILE A 25 -6.138 10.351 -6.041 1.00 0.00 N ATOM 371 CA ILE A 25 -5.807 9.064 -5.445 1.00 0.00 C ATOM 372 C ILE A 25 -5.116 9.263 -4.096 1.00 0.00 C ATOM 373 O ILE A 25 -5.525 8.675 -3.095 1.00 0.00 O ATOM 374 CB ILE A 25 -4.983 8.254 -6.461 1.00 0.00 C ATOM 375 CG1 ILE A 25 -5.876 7.970 -7.681 1.00 0.00 C ATOM 376 CG2 ILE A 25 -4.432 6.939 -5.891 1.00 0.00 C ATOM 377 CD1 ILE A 25 -5.163 7.195 -8.774 1.00 0.00 C ATOM 0 H ILE A 25 -5.564 10.581 -6.852 1.00 0.00 H new ATOM 0 HA ILE A 25 -6.706 8.488 -5.224 1.00 0.00 H new ATOM 0 HB ILE A 25 -4.111 8.847 -6.736 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -6.753 7.409 -7.359 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -6.235 8.915 -8.089 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -3.862 6.419 -6.661 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -3.783 7.154 -5.042 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -5.259 6.309 -5.565 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -5.847 7.027 -9.606 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -4.302 7.765 -9.122 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -4.828 6.235 -8.380 1.00 0.00 H new ATOM 389 N GLY A 26 -4.087 10.107 -4.076 1.00 0.00 N ATOM 390 CA GLY A 26 -3.431 10.564 -2.860 1.00 0.00 C ATOM 391 C GLY A 26 -1.954 10.832 -3.112 1.00 0.00 C ATOM 392 O GLY A 26 -1.193 9.884 -3.317 1.00 0.00 O ATOM 0 H GLY A 26 -3.679 10.499 -4.925 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.914 11.472 -2.500 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -3.541 9.813 -2.078 1.00 0.00 H new ATOM 396 N PRO A 27 -1.484 12.086 -3.013 1.00 0.00 N ATOM 397 CA PRO A 27 -0.075 12.438 -3.206 1.00 0.00 C ATOM 398 C PRO A 27 0.826 11.963 -2.048 1.00 0.00 C ATOM 399 O PRO A 27 2.029 12.221 -2.040 1.00 0.00 O ATOM 400 CB PRO A 27 -0.089 13.959 -3.393 1.00 0.00 C ATOM 401 CG PRO A 27 -1.262 14.403 -2.528 1.00 0.00 C ATOM 402 CD PRO A 27 -2.269 13.281 -2.726 1.00 0.00 C ATOM 0 HA PRO A 27 0.363 11.935 -4.068 1.00 0.00 H new ATOM 0 HB2 PRO A 27 0.847 14.414 -3.068 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -0.231 14.235 -4.438 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -0.976 14.510 -1.482 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.660 15.365 -2.849 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -2.880 13.142 -1.834 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.950 13.507 -3.546 1.00 0.00 H new ATOM 410 N GLU A 28 0.246 11.256 -1.070 1.00 0.00 N ATOM 411 CA GLU A 28 0.949 10.631 0.038 1.00 0.00 C ATOM 412 C GLU A 28 1.719 9.416 -0.480 1.00 0.00 C ATOM 413 O GLU A 28 2.791 9.080 0.023 1.00 0.00 O ATOM 414 CB GLU A 28 -0.029 10.159 1.136 1.00 0.00 C ATOM 415 CG GLU A 28 -1.349 10.934 1.224 1.00 0.00 C ATOM 416 CD GLU A 28 -2.139 10.572 2.495 1.00 0.00 C ATOM 417 OE1 GLU A 28 -2.965 9.629 2.451 1.00 0.00 O1- ATOM 418 OE2 GLU A 28 -1.951 11.239 3.542 1.00 0.00 O ATOM 0 H GLU A 28 -0.762 11.103 -1.035 1.00 0.00 H new ATOM 0 HA GLU A 28 1.625 11.370 0.468 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.257 9.107 0.967 1.00 0.00 H new ATOM 0 HB3 GLU A 28 0.476 10.225 2.100 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -1.144 12.004 1.216 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -1.956 10.719 0.345 1.00 0.00 H new ATOM 425 N LEU A 29 1.129 8.743 -1.476 1.00 0.00 N ATOM 426 CA LEU A 29 1.551 7.458 -1.984 1.00 0.00 C ATOM 427 C LEU A 29 1.738 7.489 -3.493 1.00 0.00 C ATOM 428 O LEU A 29 2.472 6.648 -3.988 1.00 0.00 O ATOM 429 CB LEU A 29 0.565 6.375 -1.512 1.00 0.00 C ATOM 430 CG LEU A 29 -0.886 6.523 -2.024 1.00 0.00 C ATOM 431 CD1 LEU A 29 -1.334 5.226 -2.702 1.00 0.00 C ATOM 432 CD2 LEU A 29 -1.859 6.885 -0.902 1.00 0.00 C ATOM 0 H LEU A 29 0.309 9.107 -1.962 1.00 0.00 H new ATOM 0 HA LEU A 29 2.532 7.208 -1.580 1.00 0.00 H new ATOM 0 HB2 LEU A 29 0.944 5.402 -1.825 1.00 0.00 H new ATOM 0 HB3 LEU A 29 0.548 6.374 -0.422 1.00 0.00 H new ATOM 0 HG LEU A 29 -0.897 7.341 -2.744 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -2.357 5.337 -3.060 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.676 5.010 -3.544 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -1.288 4.406 -1.985 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.866 6.978 -1.309 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -1.846 6.103 -0.143 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -1.560 7.832 -0.453 1.00 0.00 H new ATOM 444 N VAL A 30 1.138 8.421 -4.238 1.00 0.00 N ATOM 445 CA VAL A 30 1.437 8.575 -5.661 1.00 0.00 C ATOM 446 C VAL A 30 2.526 9.637 -5.829 1.00 0.00 C ATOM 447 O VAL A 30 2.471 10.669 -5.160 1.00 0.00 O ATOM 448 CB VAL A 30 0.161 8.881 -6.464 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.421 8.826 -7.986 1.00 0.00 C ATOM 450 CG2 VAL A 30 -0.986 7.926 -6.123 1.00 0.00 C ATOM 0 H VAL A 30 0.445 9.078 -3.879 1.00 0.00 H new ATOM 0 HA VAL A 30 1.820 7.639 -6.067 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.132 9.892 -6.181 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.502 9.047 -8.521 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.180 9.562 -8.252 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.769 7.830 -8.260 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.863 8.184 -6.716 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.686 6.902 -6.346 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.227 8.011 -5.063 1.00 0.00 H new ATOM 460 N THR A 31 3.452 9.433 -6.771 1.00 0.00 N ATOM 461 CA THR A 31 4.516 10.369 -7.094 1.00 0.00 C ATOM 462 C THR A 31 4.603 10.562 -8.610 1.00 0.00 C ATOM 463 O THR A 31 4.619 9.580 -9.344 1.00 0.00 O ATOM 464 CB THR A 31 5.833 9.860 -6.471 1.00 0.00 C ATOM 465 OG1 THR A 31 5.673 9.578 -5.085 1.00 0.00 O ATOM 466 CG2 THR A 31 6.983 10.858 -6.645 1.00 0.00 C ATOM 0 H THR A 31 3.477 8.588 -7.341 1.00 0.00 H new ATOM 0 HA THR A 31 4.309 11.352 -6.671 1.00 0.00 H new ATOM 0 HB THR A 31 6.085 8.944 -7.005 1.00 0.00 H new ATOM 0 HG1 THR A 31 6.522 9.256 -4.717 1.00 0.00 H new ATOM 0 HG21 THR A 31 7.887 10.454 -6.190 1.00 0.00 H new ATOM 0 HG22 THR A 31 7.157 11.031 -7.707 1.00 0.00 H new ATOM 0 HG23 THR A 31 6.724 11.800 -6.162 1.00 0.00 H new ATOM 474 N LEU A 32 4.616 11.815 -9.080 1.00 0.00 N ATOM 475 CA LEU A 32 4.791 12.158 -10.497 1.00 0.00 C ATOM 476 C LEU A 32 6.215 11.874 -10.971 1.00 0.00 C ATOM 477 O LEU A 32 7.168 12.105 -10.223 1.00 0.00 O ATOM 478 CB LEU A 32 4.499 13.649 -10.780 1.00 0.00 C ATOM 479 CG LEU A 32 3.132 14.193 -10.354 1.00 0.00 C ATOM 480 CD1 LEU A 32 2.877 15.552 -11.009 1.00 0.00 C ATOM 481 CD2 LEU A 32 2.005 13.225 -10.717 1.00 0.00 C ATOM 0 H LEU A 32 4.504 12.631 -8.478 1.00 0.00 H new ATOM 0 HA LEU A 32 4.078 11.535 -11.036 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.267 14.243 -10.284 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.609 13.816 -11.851 1.00 0.00 H new ATOM 0 HG LEU A 32 3.145 14.308 -9.270 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.902 15.928 -10.699 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.652 16.255 -10.702 1.00 0.00 H new ATOM 0 HD13 LEU A 32 2.895 15.442 -12.093 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.050 13.643 -10.400 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.993 13.069 -11.796 1.00 0.00 H new ATOM 0 HD23 LEU A 32 2.168 12.272 -10.214 1.00 0.00 H new ATOM 493 N HIS A 33 6.356 11.500 -12.246 1.00 0.00 N ATOM 494 CA HIS A 33 7.613 11.342 -12.943 1.00 0.00 C ATOM 495 C HIS A 33 7.397 11.774 -14.384 1.00 0.00 C ATOM 496 O HIS A 33 6.740 11.061 -15.154 1.00 0.00 O ATOM 497 CB HIS A 33 8.069 9.884 -12.908 1.00 0.00 C ATOM 498 CG HIS A 33 8.434 9.394 -11.534 1.00 0.00 C ATOM 499 ND1 HIS A 33 9.624 9.685 -10.864 1.00 0.00 N ATOM 500 CD2 HIS A 33 7.619 8.662 -10.716 1.00 0.00 C ATOM 501 CE1 HIS A 33 9.491 9.130 -9.648 1.00 0.00 C ATOM 502 NE2 HIS A 33 8.304 8.502 -9.533 1.00 0.00 N ATOM 0 H HIS A 33 5.552 11.292 -12.838 1.00 0.00 H new ATOM 0 HA HIS A 33 8.383 11.947 -12.464 1.00 0.00 H new ATOM 0 HB2 HIS A 33 7.274 9.255 -13.308 1.00 0.00 H new ATOM 0 HB3 HIS A 33 8.930 9.767 -13.566 1.00 0.00 H new ATOM 0 HD2 HIS A 33 6.635 8.285 -10.951 1.00 0.00 H new ATOM 0 HE1 HIS A 33 10.235 9.180 -8.867 1.00 0.00 H new ATOM 0 HE2 HIS A 33 7.971 7.996 -8.712 1.00 0.00 H new ATOM 510 N ASN A 34 7.926 12.933 -14.768 1.00 0.00 N ATOM 511 CA ASN A 34 7.889 13.350 -16.153 1.00 0.00 C ATOM 512 C ASN A 34 9.046 12.693 -16.890 1.00 0.00 C ATOM 513 O ASN A 34 10.208 13.040 -16.682 1.00 0.00 O ATOM 514 CB ASN A 34 7.937 14.862 -16.315 1.00 0.00 C ATOM 515 CG ASN A 34 7.488 15.189 -17.730 1.00 0.00 C ATOM 516 OD1 ASN A 34 7.848 14.531 -18.701 1.00 0.00 O ATOM 517 ND2 ASN A 34 6.674 16.203 -17.878 1.00 0.00 N ATOM 0 H ASN A 34 8.382 13.592 -14.137 1.00 0.00 H new ATOM 0 HA ASN A 34 6.938 13.032 -16.579 1.00 0.00 H new ATOM 0 HB2 ASN A 34 7.287 15.346 -15.586 1.00 0.00 H new ATOM 0 HB3 ASN A 34 8.946 15.234 -16.138 1.00 0.00 H new ATOM 0 HD21 ASN A 34 6.333 16.452 -18.807 1.00 0.00 H new ATOM 0 HD22 ASN A 34 6.380 16.744 -17.065 1.00 0.00 H new ATOM 524 N LEU A 35 8.717 11.793 -17.802 1.00 0.00 N ATOM 525 CA LEU A 35 9.671 11.006 -18.578 1.00 0.00 C ATOM 526 C LEU A 35 10.543 11.864 -19.504 1.00 0.00 C ATOM 527 O LEU A 35 11.525 11.358 -20.047 1.00 0.00 O ATOM 528 CB LEU A 35 8.936 9.912 -19.363 1.00 0.00 C ATOM 529 CG LEU A 35 8.390 8.804 -18.446 1.00 0.00 C ATOM 530 CD1 LEU A 35 7.384 7.963 -19.226 1.00 0.00 C ATOM 531 CD2 LEU A 35 9.514 7.915 -17.896 1.00 0.00 C ATOM 0 H LEU A 35 7.746 11.580 -18.033 1.00 0.00 H new ATOM 0 HA LEU A 35 10.355 10.539 -17.870 1.00 0.00 H new ATOM 0 HB2 LEU A 35 8.112 10.358 -19.920 1.00 0.00 H new ATOM 0 HB3 LEU A 35 9.615 9.474 -20.094 1.00 0.00 H new ATOM 0 HG LEU A 35 7.902 9.272 -17.591 1.00 0.00 H new ATOM 0 HD11 LEU A 35 6.992 7.175 -18.583 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.564 8.597 -19.564 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.876 7.515 -20.090 1.00 0.00 H new ATOM 0 HD21 LEU A 35 9.087 7.145 -17.253 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.043 7.444 -18.724 1.00 0.00 H new ATOM 0 HD23 LEU A 35 10.210 8.524 -17.320 1.00 0.00 H new ATOM 543 N LYS A 36 10.232 13.157 -19.679 1.00 0.00 N ATOM 544 CA LYS A 36 11.135 14.093 -20.348 1.00 0.00 C ATOM 545 C LYS A 36 12.481 14.205 -19.622 1.00 0.00 C ATOM 546 O LYS A 36 13.491 14.517 -20.254 1.00 0.00 O ATOM 547 CB LYS A 36 10.468 15.443 -20.611 1.00 0.00 C ATOM 548 CG LYS A 36 10.522 16.273 -19.344 1.00 0.00 C ATOM 549 CD LYS A 36 9.632 17.503 -19.414 1.00 0.00 C ATOM 550 CE LYS A 36 9.661 17.926 -17.957 1.00 0.00 C ATOM 551 NZ LYS A 36 8.990 19.228 -17.700 1.00 0.00 N1+ ATOM 0 H LYS A 36 9.357 13.575 -19.363 1.00 0.00 H new ATOM 0 HA LYS A 36 11.363 13.683 -21.332 1.00 0.00 H new ATOM 0 HB2 LYS A 36 10.976 15.962 -21.424 1.00 0.00 H new ATOM 0 HB3 LYS A 36 9.434 15.298 -20.923 1.00 0.00 H new ATOM 0 HG2 LYS A 36 10.219 15.657 -18.497 1.00 0.00 H new ATOM 0 HG3 LYS A 36 11.551 16.583 -19.161 1.00 0.00 H new ATOM 0 HD2 LYS A 36 10.030 18.269 -20.079 1.00 0.00 H new ATOM 0 HD3 LYS A 36 8.625 17.271 -19.762 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.182 17.155 -17.354 1.00 0.00 H new ATOM 0 HE3 LYS A 36 10.698 17.990 -17.627 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 9.048 19.454 -16.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.461 19.975 -18.249 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 7.992 19.166 -17.985 1.00 0.00 H new ATOM 565 N ASP A 37 12.488 13.981 -18.305 1.00 0.00 N ATOM 566 CA ASP A 37 13.643 14.171 -17.431 1.00 0.00 C ATOM 567 C ASP A 37 13.912 12.938 -16.565 1.00 0.00 C ATOM 568 O ASP A 37 15.074 12.619 -16.302 1.00 0.00 O ATOM 569 CB ASP A 37 13.404 15.391 -16.536 1.00 0.00 C ATOM 570 CG ASP A 37 14.598 15.620 -15.592 1.00 0.00 C ATOM 571 OD1 ASP A 37 15.674 16.047 -16.075 1.00 0.00 O1- ATOM 572 OD2 ASP A 37 14.453 15.418 -14.362 1.00 0.00 O ATOM 0 H ASP A 37 11.662 13.652 -17.804 1.00 0.00 H new ATOM 0 HA ASP A 37 14.520 14.329 -18.059 1.00 0.00 H new ATOM 0 HB2 ASP A 37 13.248 16.276 -17.154 1.00 0.00 H new ATOM 0 HB3 ASP A 37 12.495 15.246 -15.952 1.00 0.00 H new ATOM 577 N ASP A 38 12.865 12.222 -16.150 1.00 0.00 N ATOM 578 CA ASP A 38 12.963 11.037 -15.319 1.00 0.00 C ATOM 579 C ASP A 38 13.184 9.822 -16.210 1.00 0.00 C ATOM 580 O ASP A 38 12.575 9.697 -17.275 1.00 0.00 O ATOM 581 CB ASP A 38 11.729 10.833 -14.430 1.00 0.00 C ATOM 582 CG ASP A 38 11.675 11.846 -13.273 1.00 0.00 C ATOM 583 OD1 ASP A 38 12.578 11.808 -12.402 1.00 0.00 O1- ATOM 584 OD2 ASP A 38 10.737 12.679 -13.236 1.00 0.00 O ATOM 0 H ASP A 38 11.904 12.463 -16.393 1.00 0.00 H new ATOM 0 HA ASP A 38 13.809 11.170 -14.645 1.00 0.00 H new ATOM 0 HB2 ASP A 38 10.827 10.926 -15.035 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.738 9.821 -14.025 1.00 0.00 H new ATOM 589 N SER A 39 14.020 8.901 -15.744 1.00 0.00 N ATOM 590 CA SER A 39 14.243 7.618 -16.388 1.00 0.00 C ATOM 591 C SER A 39 13.152 6.670 -15.902 1.00 0.00 C ATOM 592 O SER A 39 12.846 6.688 -14.715 1.00 0.00 O ATOM 593 CB SER A 39 15.644 7.089 -16.036 1.00 0.00 C ATOM 594 OG SER A 39 16.636 8.080 -16.275 1.00 0.00 O ATOM 0 H SER A 39 14.569 9.030 -14.894 1.00 0.00 H new ATOM 0 HA SER A 39 14.197 7.708 -17.473 1.00 0.00 H new ATOM 0 HB2 SER A 39 15.671 6.787 -14.989 1.00 0.00 H new ATOM 0 HB3 SER A 39 15.861 6.201 -16.629 1.00 0.00 H new ATOM 0 HG SER A 39 17.518 7.722 -16.043 1.00 0.00 H new ATOM 600 N PRO A 40 12.601 5.771 -16.729 1.00 0.00 N ATOM 601 CA PRO A 40 11.580 4.840 -16.269 1.00 0.00 C ATOM 602 C PRO A 40 12.181 3.745 -15.376 1.00 0.00 C ATOM 603 O PRO A 40 11.425 2.991 -14.790 1.00 0.00 O ATOM 604 CB PRO A 40 10.951 4.318 -17.563 1.00 0.00 C ATOM 605 CG PRO A 40 12.154 4.247 -18.496 1.00 0.00 C ATOM 606 CD PRO A 40 12.889 5.543 -18.140 1.00 0.00 C ATOM 0 HA PRO A 40 10.827 5.299 -15.628 1.00 0.00 H new ATOM 0 HB2 PRO A 40 10.484 3.343 -17.425 1.00 0.00 H new ATOM 0 HB3 PRO A 40 10.180 4.990 -17.942 1.00 0.00 H new ATOM 0 HG2 PRO A 40 12.766 3.364 -18.311 1.00 0.00 H new ATOM 0 HG3 PRO A 40 11.859 4.217 -19.545 1.00 0.00 H new ATOM 0 HD2 PRO A 40 13.961 5.448 -18.313 1.00 0.00 H new ATOM 0 HD3 PRO A 40 12.540 6.374 -18.752 1.00 0.00 H new ATOM 614 N LYS A 41 13.506 3.646 -15.203 1.00 0.00 N ATOM 615 CA LYS A 41 14.154 2.613 -14.378 1.00 0.00 C ATOM 616 C LYS A 41 13.586 2.593 -12.963 1.00 0.00 C ATOM 617 O LYS A 41 13.340 1.540 -12.397 1.00 0.00 O ATOM 618 CB LYS A 41 15.670 2.874 -14.322 1.00 0.00 C ATOM 619 CG LYS A 41 16.421 2.611 -15.643 1.00 0.00 C ATOM 620 CD LYS A 41 16.877 1.150 -15.800 1.00 0.00 C ATOM 621 CE LYS A 41 17.785 1.023 -17.035 1.00 0.00 C ATOM 622 NZ LYS A 41 18.362 -0.340 -17.193 1.00 0.00 N1+ ATOM 0 H LYS A 41 14.168 4.289 -15.637 1.00 0.00 H new ATOM 0 HA LYS A 41 13.959 1.643 -14.835 1.00 0.00 H new ATOM 0 HB2 LYS A 41 15.835 3.910 -14.027 1.00 0.00 H new ATOM 0 HB3 LYS A 41 16.104 2.247 -13.543 1.00 0.00 H new ATOM 0 HG2 LYS A 41 15.774 2.875 -16.480 1.00 0.00 H new ATOM 0 HG3 LYS A 41 17.292 3.264 -15.695 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.413 0.828 -14.907 1.00 0.00 H new ATOM 0 HD3 LYS A 41 16.010 0.497 -15.904 1.00 0.00 H new ATOM 0 HE2 LYS A 41 17.213 1.275 -17.928 1.00 0.00 H new ATOM 0 HE3 LYS A 41 18.595 1.748 -16.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 19.210 -0.290 -17.793 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.620 -0.718 -16.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 17.660 -0.965 -17.638 1.00 0.00 H new ATOM 636 N LEU A 42 13.282 3.767 -12.410 1.00 0.00 N ATOM 637 CA LEU A 42 12.695 3.873 -11.076 1.00 0.00 C ATOM 638 C LEU A 42 11.291 3.280 -10.989 1.00 0.00 C ATOM 639 O LEU A 42 10.870 2.863 -9.914 1.00 0.00 O ATOM 640 CB LEU A 42 12.782 5.298 -10.512 1.00 0.00 C ATOM 641 CG LEU A 42 12.856 6.507 -11.449 1.00 0.00 C ATOM 642 CD1 LEU A 42 11.498 6.747 -12.082 1.00 0.00 C ATOM 643 CD2 LEU A 42 13.287 7.762 -10.689 1.00 0.00 C ATOM 0 H LEU A 42 13.434 4.664 -12.870 1.00 0.00 H new ATOM 0 HA LEU A 42 13.309 3.251 -10.425 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.913 5.442 -9.870 1.00 0.00 H new ATOM 0 HB3 LEU A 42 13.662 5.336 -9.870 1.00 0.00 H new ATOM 0 HG LEU A 42 13.595 6.295 -12.222 1.00 0.00 H new ATOM 0 HD11 LEU A 42 11.554 7.608 -12.748 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.201 5.866 -12.652 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.762 6.939 -11.302 1.00 0.00 H new ATOM 0 HD21 LEU A 42 13.332 8.606 -11.377 1.00 0.00 H new ATOM 0 HD22 LEU A 42 12.566 7.975 -9.900 1.00 0.00 H new ATOM 0 HD23 LEU A 42 14.271 7.601 -10.248 1.00 0.00 H new ATOM 655 N MET A 43 10.586 3.155 -12.110 1.00 0.00 N ATOM 656 CA MET A 43 9.321 2.421 -12.233 1.00 0.00 C ATOM 657 C MET A 43 9.474 0.935 -11.875 1.00 0.00 C ATOM 658 O MET A 43 8.478 0.265 -11.630 1.00 0.00 O ATOM 659 CB MET A 43 8.646 2.702 -13.600 1.00 0.00 C ATOM 660 CG MET A 43 8.692 1.582 -14.649 1.00 0.00 C ATOM 661 SD MET A 43 7.818 1.874 -16.227 1.00 0.00 S ATOM 662 CE MET A 43 7.620 3.679 -16.311 1.00 0.00 C ATOM 0 H MET A 43 10.886 3.575 -12.990 1.00 0.00 H new ATOM 0 HA MET A 43 8.624 2.800 -11.485 1.00 0.00 H new ATOM 0 HB2 MET A 43 7.601 2.950 -13.416 1.00 0.00 H new ATOM 0 HB3 MET A 43 9.112 3.588 -14.031 1.00 0.00 H new ATOM 0 HG2 MET A 43 9.738 1.376 -14.876 1.00 0.00 H new ATOM 0 HG3 MET A 43 8.280 0.680 -14.197 1.00 0.00 H new ATOM 0 HE1 MET A 43 7.300 3.964 -17.313 1.00 0.00 H new ATOM 0 HE2 MET A 43 6.870 3.997 -15.587 1.00 0.00 H new ATOM 0 HE3 MET A 43 8.571 4.160 -16.084 1.00 0.00 H new ATOM 672 N GLU A 44 10.696 0.403 -11.795 1.00 0.00 N ATOM 673 CA GLU A 44 10.943 -0.966 -11.354 1.00 0.00 C ATOM 674 C GLU A 44 10.721 -1.099 -9.842 1.00 0.00 C ATOM 675 O GLU A 44 10.369 -2.185 -9.383 1.00 0.00 O ATOM 676 CB GLU A 44 12.358 -1.413 -11.750 1.00 0.00 C ATOM 677 CG GLU A 44 12.551 -1.452 -13.271 1.00 0.00 C ATOM 678 CD GLU A 44 13.970 -1.919 -13.653 1.00 0.00 C ATOM 679 OE1 GLU A 44 14.952 -1.164 -13.467 1.00 0.00 O1- ATOM 680 OE2 GLU A 44 14.090 -3.054 -14.167 1.00 0.00 O ATOM 0 H GLU A 44 11.544 0.915 -12.036 1.00 0.00 H new ATOM 0 HA GLU A 44 10.231 -1.623 -11.853 1.00 0.00 H new ATOM 0 HB2 GLU A 44 13.088 -0.733 -11.311 1.00 0.00 H new ATOM 0 HB3 GLU A 44 12.554 -2.402 -11.336 1.00 0.00 H new ATOM 0 HG2 GLU A 44 11.815 -2.123 -13.714 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.370 -0.461 -13.687 1.00 0.00 H new ATOM 687 N GLN A 45 10.876 -0.014 -9.066 1.00 0.00 N ATOM 688 CA GLN A 45 10.788 -0.057 -7.604 1.00 0.00 C ATOM 689 C GLN A 45 9.326 -0.111 -7.168 1.00 0.00 C ATOM 690 O GLN A 45 8.934 -0.914 -6.323 1.00 0.00 O ATOM 691 CB GLN A 45 11.435 1.179 -6.949 1.00 0.00 C ATOM 692 CG GLN A 45 12.759 1.659 -7.556 1.00 0.00 C ATOM 693 CD GLN A 45 13.017 3.112 -7.162 1.00 0.00 C ATOM 694 OE1 GLN A 45 13.960 3.436 -6.443 1.00 0.00 O ATOM 695 NE2 GLN A 45 12.158 4.010 -7.630 1.00 0.00 N ATOM 0 H GLN A 45 11.066 0.916 -9.438 1.00 0.00 H new ATOM 0 HA GLN A 45 11.324 -0.950 -7.282 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.721 2.002 -6.993 1.00 0.00 H new ATOM 0 HB3 GLN A 45 11.603 0.958 -5.895 1.00 0.00 H new ATOM 0 HG2 GLN A 45 13.578 1.028 -7.209 1.00 0.00 H new ATOM 0 HG3 GLN A 45 12.725 1.568 -8.642 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.384 3.714 -8.225 1.00 0.00 H new ATOM 0 HE22 GLN A 45 12.272 4.996 -7.395 1.00 0.00 H new ATOM 704 N TYR A 46 8.536 0.804 -7.744 1.00 0.00 N ATOM 705 CA TYR A 46 7.173 1.091 -7.340 1.00 0.00 C ATOM 706 C TYR A 46 6.320 -0.142 -7.612 1.00 0.00 C ATOM 707 O TYR A 46 6.476 -0.818 -8.629 1.00 0.00 O ATOM 708 CB TYR A 46 6.646 2.332 -8.077 1.00 0.00 C ATOM 709 CG TYR A 46 7.348 3.634 -7.743 1.00 0.00 C ATOM 710 CD1 TYR A 46 7.024 4.357 -6.582 1.00 0.00 C ATOM 711 CD2 TYR A 46 8.321 4.141 -8.624 1.00 0.00 C ATOM 712 CE1 TYR A 46 7.711 5.546 -6.277 1.00 0.00 C ATOM 713 CE2 TYR A 46 9.015 5.324 -8.331 1.00 0.00 C ATOM 714 CZ TYR A 46 8.727 6.024 -7.134 1.00 0.00 C ATOM 715 OH TYR A 46 9.404 7.161 -6.801 1.00 0.00 O ATOM 0 H TYR A 46 8.847 1.378 -8.528 1.00 0.00 H new ATOM 0 HA TYR A 46 7.131 1.318 -6.275 1.00 0.00 H new ATOM 0 HB2 TYR A 46 6.729 2.159 -9.150 1.00 0.00 H new ATOM 0 HB3 TYR A 46 5.585 2.443 -7.853 1.00 0.00 H new ATOM 0 HD1 TYR A 46 6.247 3.999 -5.923 1.00 0.00 H new ATOM 0 HD2 TYR A 46 8.537 3.611 -9.540 1.00 0.00 H new ATOM 0 HE1 TYR A 46 7.460 6.097 -5.382 1.00 0.00 H new ATOM 0 HE2 TYR A 46 9.764 5.699 -9.013 1.00 0.00 H new ATOM 0 HH TYR A 46 10.071 7.358 -7.491 1.00 0.00 H new ATOM 725 N ASP A 47 5.413 -0.441 -6.693 1.00 0.00 N ATOM 726 CA ASP A 47 4.598 -1.661 -6.738 1.00 0.00 C ATOM 727 C ASP A 47 3.534 -1.564 -7.832 1.00 0.00 C ATOM 728 O ASP A 47 3.106 -2.565 -8.408 1.00 0.00 O ATOM 729 CB ASP A 47 3.918 -1.869 -5.378 1.00 0.00 C ATOM 730 CG ASP A 47 4.919 -2.227 -4.267 1.00 0.00 C ATOM 731 OD1 ASP A 47 5.416 -3.377 -4.233 1.00 0.00 O1- ATOM 732 OD2 ASP A 47 5.219 -1.340 -3.434 1.00 0.00 O ATOM 0 H ASP A 47 5.216 0.154 -5.889 1.00 0.00 H new ATOM 0 HA ASP A 47 5.248 -2.507 -6.962 1.00 0.00 H new ATOM 0 HB2 ASP A 47 3.382 -0.961 -5.101 1.00 0.00 H new ATOM 0 HB3 ASP A 47 3.176 -2.663 -5.464 1.00 0.00 H new ATOM 737 N VAL A 48 3.095 -0.337 -8.117 1.00 0.00 N ATOM 738 CA VAL A 48 1.954 -0.023 -8.962 1.00 0.00 C ATOM 739 C VAL A 48 2.333 1.220 -9.739 1.00 0.00 C ATOM 740 O VAL A 48 2.979 2.103 -9.176 1.00 0.00 O ATOM 741 CB VAL A 48 0.753 0.227 -8.046 1.00 0.00 C ATOM 742 CG1 VAL A 48 -0.415 0.829 -8.814 1.00 0.00 C ATOM 743 CG2 VAL A 48 0.326 -1.052 -7.326 1.00 0.00 C ATOM 0 H VAL A 48 3.549 0.498 -7.746 1.00 0.00 H new ATOM 0 HA VAL A 48 1.693 -0.823 -9.655 1.00 0.00 H new ATOM 0 HB VAL A 48 1.066 0.949 -7.292 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -1.251 0.994 -8.134 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -0.111 1.779 -9.253 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -0.721 0.145 -9.606 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -0.529 -0.840 -6.684 1.00 0.00 H new ATOM 0 HG22 VAL A 48 0.049 -1.808 -8.061 1.00 0.00 H new ATOM 0 HG23 VAL A 48 1.153 -1.421 -6.719 1.00 0.00 H new ATOM 753 N LEU A 49 1.917 1.336 -10.996 1.00 0.00 N ATOM 754 CA LEU A 49 2.252 2.462 -11.835 1.00 0.00 C ATOM 755 C LEU A 49 1.006 2.954 -12.543 1.00 0.00 C ATOM 756 O LEU A 49 0.084 2.181 -12.795 1.00 0.00 O ATOM 757 CB LEU A 49 3.327 2.098 -12.876 1.00 0.00 C ATOM 758 CG LEU A 49 4.464 1.157 -12.434 1.00 0.00 C ATOM 759 CD1 LEU A 49 5.276 0.698 -13.645 1.00 0.00 C ATOM 760 CD2 LEU A 49 5.424 1.845 -11.465 1.00 0.00 C ATOM 0 H LEU A 49 1.332 0.639 -11.458 1.00 0.00 H new ATOM 0 HA LEU A 49 2.657 3.247 -11.197 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.826 1.641 -13.729 1.00 0.00 H new ATOM 0 HB3 LEU A 49 3.778 3.025 -13.230 1.00 0.00 H new ATOM 0 HG LEU A 49 3.994 0.308 -11.938 1.00 0.00 H new ATOM 0 HD11 LEU A 49 6.075 0.034 -13.316 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.625 0.167 -14.339 1.00 0.00 H new ATOM 0 HD13 LEU A 49 5.707 1.566 -14.144 1.00 0.00 H new ATOM 0 HD21 LEU A 49 6.211 1.148 -11.177 1.00 0.00 H new ATOM 0 HD22 LEU A 49 5.868 2.715 -11.949 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.878 2.163 -10.577 1.00 0.00 H new ATOM 772 N ILE A 50 1.005 4.219 -12.933 1.00 0.00 N ATOM 773 CA ILE A 50 0.007 4.793 -13.821 1.00 0.00 C ATOM 774 C ILE A 50 0.824 5.430 -14.925 1.00 0.00 C ATOM 775 O ILE A 50 1.694 6.235 -14.613 1.00 0.00 O ATOM 776 CB ILE A 50 -0.878 5.782 -13.056 1.00 0.00 C ATOM 777 CG1 ILE A 50 -1.721 5.010 -12.018 1.00 0.00 C ATOM 778 CG2 ILE A 50 -1.796 6.581 -13.991 1.00 0.00 C ATOM 779 CD1 ILE A 50 -1.297 5.399 -10.611 1.00 0.00 C ATOM 0 H ILE A 50 1.713 4.889 -12.634 1.00 0.00 H new ATOM 0 HA ILE A 50 -0.694 4.067 -14.233 1.00 0.00 H new ATOM 0 HB ILE A 50 -0.228 6.499 -12.555 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -2.779 5.229 -12.161 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.595 3.937 -12.161 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.404 7.269 -13.403 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -1.191 7.146 -14.699 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -2.446 5.896 -14.535 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.897 4.850 -9.885 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -0.244 5.157 -10.468 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.446 6.469 -10.469 1.00 0.00 H new ATOM 791 N LEU A 51 0.606 5.035 -16.176 1.00 0.00 N ATOM 792 CA LEU A 51 1.365 5.528 -17.319 1.00 0.00 C ATOM 793 C LEU A 51 0.382 6.184 -18.272 1.00 0.00 C ATOM 794 O LEU A 51 -0.732 5.683 -18.422 1.00 0.00 O ATOM 795 CB LEU A 51 2.126 4.385 -18.018 1.00 0.00 C ATOM 796 CG LEU A 51 3.484 4.021 -17.397 1.00 0.00 C ATOM 797 CD1 LEU A 51 3.387 3.606 -15.932 1.00 0.00 C ATOM 798 CD2 LEU A 51 4.072 2.838 -18.161 1.00 0.00 C ATOM 0 H LEU A 51 -0.112 4.355 -16.427 1.00 0.00 H new ATOM 0 HA LEU A 51 2.114 6.248 -16.989 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.495 3.496 -18.016 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.285 4.661 -19.060 1.00 0.00 H new ATOM 0 HG LEU A 51 4.104 4.915 -17.458 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.381 3.363 -15.556 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.969 4.426 -15.348 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.742 2.732 -15.843 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.036 2.570 -17.730 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.394 1.987 -18.092 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.206 3.111 -19.208 1.00 0.00 H new ATOM 810 N GLY A 52 0.786 7.247 -18.963 1.00 0.00 N ATOM 811 CA GLY A 52 -0.094 7.836 -19.964 1.00 0.00 C ATOM 812 C GLY A 52 0.589 8.624 -21.056 1.00 0.00 C ATOM 813 O GLY A 52 1.634 9.229 -20.827 1.00 0.00 O ATOM 0 H GLY A 52 1.690 7.706 -18.853 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -0.674 7.037 -20.426 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -0.802 8.491 -19.457 1.00 0.00 H new ATOM 817 N ILE A 53 -0.010 8.579 -22.249 1.00 0.00 N ATOM 818 CA ILE A 53 0.532 9.063 -23.516 1.00 0.00 C ATOM 819 C ILE A 53 -0.547 9.865 -24.266 1.00 0.00 C ATOM 820 O ILE A 53 -1.682 9.399 -24.373 1.00 0.00 O ATOM 821 CB ILE A 53 1.046 7.914 -24.432 1.00 0.00 C ATOM 822 CG1 ILE A 53 0.058 6.762 -24.701 1.00 0.00 C ATOM 823 CG2 ILE A 53 2.377 7.291 -23.977 1.00 0.00 C ATOM 824 CD1 ILE A 53 -0.277 5.892 -23.490 1.00 0.00 C ATOM 0 H ILE A 53 -0.942 8.179 -22.360 1.00 0.00 H new ATOM 0 HA ILE A 53 1.387 9.695 -23.276 1.00 0.00 H new ATOM 0 HB ILE A 53 1.185 8.459 -25.366 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -0.868 7.184 -25.092 1.00 0.00 H new ATOM 0 HG13 ILE A 53 0.473 6.125 -25.482 1.00 0.00 H new ATOM 0 HG21 ILE A 53 2.664 6.499 -24.669 1.00 0.00 H new ATOM 0 HG22 ILE A 53 3.151 8.058 -23.962 1.00 0.00 H new ATOM 0 HG23 ILE A 53 2.260 6.874 -22.977 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -0.979 5.112 -23.785 1.00 0.00 H new ATOM 0 HD12 ILE A 53 0.635 5.434 -23.108 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -0.727 6.509 -22.712 1.00 0.00 H new ATOM 836 N PRO A 54 -0.225 11.042 -24.819 1.00 0.00 N ATOM 837 CA PRO A 54 -1.073 11.727 -25.786 1.00 0.00 C ATOM 838 C PRO A 54 -0.745 11.145 -27.176 1.00 0.00 C ATOM 839 O PRO A 54 0.424 10.875 -27.466 1.00 0.00 O ATOM 840 CB PRO A 54 -0.717 13.208 -25.636 1.00 0.00 C ATOM 841 CG PRO A 54 0.763 13.168 -25.244 1.00 0.00 C ATOM 842 CD PRO A 54 0.935 11.856 -24.487 1.00 0.00 C ATOM 0 HA PRO A 54 -2.146 11.601 -25.640 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -0.874 13.757 -26.564 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -1.324 13.694 -24.872 1.00 0.00 H new ATOM 0 HG2 PRO A 54 1.405 13.203 -26.124 1.00 0.00 H new ATOM 0 HG3 PRO A 54 1.029 14.021 -24.620 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.858 11.356 -24.779 1.00 0.00 H new ATOM 0 HD3 PRO A 54 0.994 12.031 -23.413 1.00 0.00 H new ATOM 850 N THR A 55 -1.744 10.938 -28.037 1.00 0.00 N ATOM 851 CA THR A 55 -1.488 10.433 -29.386 1.00 0.00 C ATOM 852 C THR A 55 -1.233 11.626 -30.309 1.00 0.00 C ATOM 853 O THR A 55 -2.172 12.323 -30.693 1.00 0.00 O ATOM 854 CB THR A 55 -2.649 9.557 -29.856 1.00 0.00 C ATOM 855 OG1 THR A 55 -2.833 8.469 -28.961 1.00 0.00 O ATOM 856 CG2 THR A 55 -2.312 8.952 -31.212 1.00 0.00 C ATOM 0 H THR A 55 -2.727 11.110 -27.827 1.00 0.00 H new ATOM 0 HA THR A 55 -0.603 9.797 -29.399 1.00 0.00 H new ATOM 0 HB THR A 55 -3.544 10.177 -29.905 1.00 0.00 H new ATOM 0 HG1 THR A 55 -3.461 8.729 -28.255 1.00 0.00 H new ATOM 0 HG21 THR A 55 -3.140 8.327 -31.547 1.00 0.00 H new ATOM 0 HG22 THR A 55 -2.144 9.750 -31.935 1.00 0.00 H new ATOM 0 HG23 THR A 55 -1.411 8.345 -31.126 1.00 0.00 H new ATOM 864 N TRP A 56 0.022 11.876 -30.670 1.00 0.00 N ATOM 865 CA TRP A 56 0.401 12.920 -31.600 1.00 0.00 C ATOM 866 C TRP A 56 0.367 12.399 -33.045 1.00 0.00 C ATOM 867 O TRP A 56 0.236 11.197 -33.274 1.00 0.00 O ATOM 868 CB TRP A 56 1.780 13.477 -31.213 1.00 0.00 C ATOM 869 CG TRP A 56 1.799 14.463 -30.081 1.00 0.00 C ATOM 870 CD1 TRP A 56 2.110 14.192 -28.792 1.00 0.00 C ATOM 871 CD2 TRP A 56 1.538 15.902 -30.125 1.00 0.00 C ATOM 872 NE1 TRP A 56 2.119 15.365 -28.056 1.00 0.00 N ATOM 873 CE2 TRP A 56 1.721 16.439 -28.819 1.00 0.00 C ATOM 874 CE3 TRP A 56 1.171 16.818 -31.137 1.00 0.00 C ATOM 875 CZ2 TRP A 56 1.529 17.796 -28.525 1.00 0.00 C ATOM 876 CZ3 TRP A 56 0.991 18.188 -30.856 1.00 0.00 C ATOM 877 CH2 TRP A 56 1.160 18.679 -29.549 1.00 0.00 C ATOM 0 H TRP A 56 0.816 11.344 -30.314 1.00 0.00 H new ATOM 0 HA TRP A 56 -0.318 13.737 -31.545 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.427 12.640 -30.950 1.00 0.00 H new ATOM 0 HB3 TRP A 56 2.216 13.954 -32.091 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.320 13.209 -28.397 1.00 0.00 H new ATOM 0 HE1 TRP A 56 2.387 15.425 -27.074 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.025 16.461 -32.146 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 1.664 18.159 -27.517 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 0.721 18.866 -31.652 1.00 0.00 H new ATOM 0 HH2 TRP A 56 1.007 19.727 -29.336 1.00 0.00 H new ATOM 888 N ASP A 57 0.478 13.333 -33.998 1.00 0.00 N ATOM 889 CA ASP A 57 0.726 13.159 -35.435 1.00 0.00 C ATOM 890 C ASP A 57 0.343 11.787 -36.014 1.00 0.00 C ATOM 891 O ASP A 57 1.202 11.018 -36.452 1.00 0.00 O ATOM 892 CB ASP A 57 2.175 13.548 -35.756 1.00 0.00 C ATOM 893 CG ASP A 57 2.451 13.551 -37.274 1.00 0.00 C ATOM 894 OD1 ASP A 57 1.586 14.015 -38.056 1.00 0.00 O ATOM 895 OD2 ASP A 57 3.573 13.168 -37.689 1.00 0.00 O1- ATOM 0 H ASP A 57 0.388 14.321 -33.761 1.00 0.00 H new ATOM 0 HA ASP A 57 0.041 13.836 -35.946 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.384 14.537 -35.348 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.854 12.851 -35.266 1.00 0.00 H new ATOM 900 N PHE A 58 -0.964 11.501 -36.026 1.00 0.00 N ATOM 901 CA PHE A 58 -1.537 10.282 -36.595 1.00 0.00 C ATOM 902 C PHE A 58 -0.920 9.014 -35.985 1.00 0.00 C ATOM 903 O PHE A 58 -0.190 8.266 -36.650 1.00 0.00 O ATOM 904 CB PHE A 58 -1.478 10.308 -38.132 1.00 0.00 C ATOM 905 CG PHE A 58 -2.218 11.470 -38.759 1.00 0.00 C ATOM 906 CD1 PHE A 58 -3.612 11.550 -38.611 1.00 0.00 C ATOM 907 CD2 PHE A 58 -1.532 12.466 -39.476 1.00 0.00 C ATOM 908 CE1 PHE A 58 -4.330 12.604 -39.208 1.00 0.00 C ATOM 909 CE2 PHE A 58 -2.245 13.532 -40.058 1.00 0.00 C ATOM 910 CZ PHE A 58 -3.646 13.596 -39.933 1.00 0.00 C ATOM 0 H PHE A 58 -1.666 12.127 -35.631 1.00 0.00 H new ATOM 0 HA PHE A 58 -2.592 10.250 -36.325 1.00 0.00 H new ATOM 0 HB2 PHE A 58 -0.434 10.345 -38.444 1.00 0.00 H new ATOM 0 HB3 PHE A 58 -1.893 9.377 -38.517 1.00 0.00 H new ATOM 0 HD1 PHE A 58 -4.136 10.800 -38.037 1.00 0.00 H new ATOM 0 HD2 PHE A 58 -0.458 12.414 -39.580 1.00 0.00 H new ATOM 0 HE1 PHE A 58 -5.404 12.650 -39.109 1.00 0.00 H new ATOM 0 HE2 PHE A 58 -1.716 14.302 -40.601 1.00 0.00 H new ATOM 0 HZ PHE A 58 -4.194 14.405 -40.393 1.00 0.00 H new ATOM 920 N GLY A 59 -1.252 8.736 -34.720 1.00 0.00 N ATOM 921 CA GLY A 59 -0.816 7.520 -34.054 1.00 0.00 C ATOM 922 C GLY A 59 0.665 7.470 -33.678 1.00 0.00 C ATOM 923 O GLY A 59 1.183 6.396 -33.361 1.00 0.00 O ATOM 0 H GLY A 59 -1.826 9.347 -34.139 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -1.408 7.391 -33.148 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -1.037 6.672 -34.702 1.00 0.00 H new ATOM 927 N GLU A 60 1.346 8.605 -33.684 1.00 0.00 N ATOM 928 CA GLU A 60 2.678 8.746 -33.149 1.00 0.00 C ATOM 929 C GLU A 60 2.613 8.863 -31.627 1.00 0.00 C ATOM 930 O GLU A 60 1.667 9.402 -31.039 1.00 0.00 O ATOM 931 CB GLU A 60 3.434 9.931 -33.775 1.00 0.00 C ATOM 932 CG GLU A 60 3.849 9.667 -35.230 1.00 0.00 C ATOM 933 CD GLU A 60 5.087 8.756 -35.337 1.00 0.00 C ATOM 934 OE1 GLU A 60 4.962 7.520 -35.157 1.00 0.00 O1- ATOM 935 OE2 GLU A 60 6.197 9.267 -35.627 1.00 0.00 O ATOM 0 H GLU A 60 0.973 9.471 -34.072 1.00 0.00 H new ATOM 0 HA GLU A 60 3.245 7.852 -33.410 1.00 0.00 H new ATOM 0 HB2 GLU A 60 2.804 10.820 -33.737 1.00 0.00 H new ATOM 0 HB3 GLU A 60 4.323 10.144 -33.181 1.00 0.00 H new ATOM 0 HG2 GLU A 60 3.017 9.207 -35.764 1.00 0.00 H new ATOM 0 HG3 GLU A 60 4.058 10.617 -35.722 1.00 0.00 H new ATOM 942 N ILE A 61 3.661 8.355 -30.987 1.00 0.00 N ATOM 943 CA ILE A 61 3.886 8.502 -29.564 1.00 0.00 C ATOM 944 C ILE A 61 4.478 9.902 -29.352 1.00 0.00 C ATOM 945 O ILE A 61 5.128 10.469 -30.237 1.00 0.00 O ATOM 946 CB ILE A 61 4.815 7.367 -29.079 1.00 0.00 C ATOM 947 CG1 ILE A 61 4.230 5.961 -29.334 1.00 0.00 C ATOM 948 CG2 ILE A 61 5.126 7.472 -27.579 1.00 0.00 C ATOM 949 CD1 ILE A 61 5.353 4.929 -29.459 1.00 0.00 C ATOM 0 H ILE A 61 4.390 7.819 -31.458 1.00 0.00 H new ATOM 0 HA ILE A 61 2.970 8.418 -28.980 1.00 0.00 H new ATOM 0 HB ILE A 61 5.727 7.493 -29.663 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.563 5.684 -28.518 1.00 0.00 H new ATOM 0 HG13 ILE A 61 3.632 5.969 -30.245 1.00 0.00 H new ATOM 0 HG21 ILE A 61 5.782 6.653 -27.285 1.00 0.00 H new ATOM 0 HG22 ILE A 61 5.619 8.423 -27.375 1.00 0.00 H new ATOM 0 HG23 ILE A 61 4.198 7.415 -27.010 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.923 3.944 -29.638 1.00 0.00 H new ATOM 0 HD12 ILE A 61 6.004 5.198 -30.291 1.00 0.00 H new ATOM 0 HD13 ILE A 61 5.933 4.909 -28.537 1.00 0.00 H new ATOM 961 N GLN A 62 4.253 10.458 -28.161 1.00 0.00 N ATOM 962 CA GLN A 62 4.872 11.687 -27.718 1.00 0.00 C ATOM 963 C GLN A 62 6.392 11.495 -27.686 1.00 0.00 C ATOM 964 O GLN A 62 6.904 10.445 -27.308 1.00 0.00 O ATOM 965 CB GLN A 62 4.254 12.059 -26.370 1.00 0.00 C ATOM 966 CG GLN A 62 4.550 13.485 -25.893 1.00 0.00 C ATOM 967 CD GLN A 62 5.910 13.620 -25.218 1.00 0.00 C ATOM 968 OE1 GLN A 62 6.426 12.656 -24.671 1.00 0.00 O ATOM 969 NE2 GLN A 62 6.529 14.783 -25.280 1.00 0.00 N ATOM 0 H GLN A 62 3.622 10.051 -27.471 1.00 0.00 H new ATOM 0 HA GLN A 62 4.690 12.520 -28.397 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.174 11.931 -26.435 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.614 11.358 -25.617 1.00 0.00 H new ATOM 0 HG2 GLN A 62 4.505 14.163 -26.745 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.772 13.797 -25.196 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.081 15.575 -25.741 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.455 14.890 -24.867 1.00 0.00 H new ATOM 978 N GLU A 63 7.114 12.540 -28.055 1.00 0.00 N ATOM 979 CA GLU A 63 8.544 12.446 -28.357 1.00 0.00 C ATOM 980 C GLU A 63 9.413 12.099 -27.140 1.00 0.00 C ATOM 981 O GLU A 63 10.466 11.475 -27.295 1.00 0.00 O ATOM 982 CB GLU A 63 9.026 13.721 -29.064 1.00 0.00 C ATOM 983 CG GLU A 63 8.989 14.981 -28.184 1.00 0.00 C ATOM 984 CD GLU A 63 9.493 16.214 -28.958 1.00 0.00 C ATOM 985 OE1 GLU A 63 10.721 16.484 -28.943 1.00 0.00 O ATOM 986 OE2 GLU A 63 8.669 16.928 -29.580 1.00 0.00 O1- ATOM 0 H GLU A 63 6.731 13.480 -28.155 1.00 0.00 H new ATOM 0 HA GLU A 63 8.666 11.602 -29.037 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.047 13.565 -29.414 1.00 0.00 H new ATOM 0 HB3 GLU A 63 8.409 13.889 -29.946 1.00 0.00 H new ATOM 0 HG2 GLU A 63 7.970 15.157 -27.838 1.00 0.00 H new ATOM 0 HG3 GLU A 63 9.605 14.827 -27.298 1.00 0.00 H new ATOM 993 N ASP A 64 8.983 12.458 -25.932 1.00 0.00 N ATOM 994 CA ASP A 64 9.702 12.130 -24.704 1.00 0.00 C ATOM 995 C ASP A 64 9.377 10.705 -24.259 1.00 0.00 C ATOM 996 O ASP A 64 10.193 10.063 -23.599 1.00 0.00 O ATOM 997 CB ASP A 64 9.413 13.132 -23.580 1.00 0.00 C ATOM 998 CG ASP A 64 9.913 14.535 -23.937 1.00 0.00 C ATOM 999 OD1 ASP A 64 11.148 14.750 -23.965 1.00 0.00 O ATOM 1000 OD2 ASP A 64 9.060 15.418 -24.202 1.00 0.00 O1- ATOM 0 H ASP A 64 8.124 12.986 -25.778 1.00 0.00 H new ATOM 0 HA ASP A 64 10.768 12.195 -24.923 1.00 0.00 H new ATOM 0 HB2 ASP A 64 8.341 13.165 -23.387 1.00 0.00 H new ATOM 0 HB3 ASP A 64 9.892 12.797 -22.660 1.00 0.00 H new ATOM 1005 N TRP A 65 8.221 10.172 -24.662 1.00 0.00 N ATOM 1006 CA TRP A 65 7.896 8.777 -24.477 1.00 0.00 C ATOM 1007 C TRP A 65 8.697 7.902 -25.429 1.00 0.00 C ATOM 1008 O TRP A 65 9.250 6.899 -24.986 1.00 0.00 O ATOM 1009 CB TRP A 65 6.396 8.545 -24.621 1.00 0.00 C ATOM 1010 CG TRP A 65 5.664 8.463 -23.331 1.00 0.00 C ATOM 1011 CD1 TRP A 65 4.782 9.367 -22.857 1.00 0.00 C ATOM 1012 CD2 TRP A 65 5.698 7.378 -22.361 1.00 0.00 C ATOM 1013 NE1 TRP A 65 4.200 8.864 -21.715 1.00 0.00 N ATOM 1014 CE2 TRP A 65 4.746 7.660 -21.344 1.00 0.00 C ATOM 1015 CE3 TRP A 65 6.438 6.187 -22.244 1.00 0.00 C ATOM 1016 CZ2 TRP A 65 4.529 6.801 -20.260 1.00 0.00 C ATOM 1017 CZ3 TRP A 65 6.255 5.333 -21.144 1.00 0.00 C ATOM 1018 CH2 TRP A 65 5.319 5.646 -20.153 1.00 0.00 C ATOM 0 H TRP A 65 7.488 10.708 -25.127 1.00 0.00 H new ATOM 0 HA TRP A 65 8.174 8.492 -23.462 1.00 0.00 H new ATOM 0 HB2 TRP A 65 5.971 9.353 -25.216 1.00 0.00 H new ATOM 0 HB3 TRP A 65 6.235 7.621 -25.176 1.00 0.00 H new ATOM 0 HD1 TRP A 65 4.567 10.328 -23.301 1.00 0.00 H new ATOM 0 HE1 TRP A 65 3.451 9.331 -21.204 1.00 0.00 H new ATOM 0 HE3 TRP A 65 7.155 5.927 -23.009 1.00 0.00 H new ATOM 0 HZ2 TRP A 65 3.771 7.022 -19.523 1.00 0.00 H new ATOM 0 HZ3 TRP A 65 6.841 4.429 -21.063 1.00 0.00 H new ATOM 0 HH2 TRP A 65 5.203 4.994 -19.300 1.00 0.00 H new ATOM 1029 N GLU A 66 8.820 8.286 -26.701 1.00 0.00 N ATOM 1030 CA GLU A 66 9.653 7.579 -27.678 1.00 0.00 C ATOM 1031 C GLU A 66 11.086 7.409 -27.157 1.00 0.00 C ATOM 1032 O GLU A 66 11.712 6.373 -27.388 1.00 0.00 O ATOM 1033 CB GLU A 66 9.712 8.333 -29.017 1.00 0.00 C ATOM 1034 CG GLU A 66 8.388 8.353 -29.781 1.00 0.00 C ATOM 1035 CD GLU A 66 8.588 8.911 -31.205 1.00 0.00 C ATOM 1036 OE1 GLU A 66 8.839 10.133 -31.362 1.00 0.00 O ATOM 1037 OE2 GLU A 66 8.510 8.124 -32.180 1.00 0.00 O1- ATOM 0 H GLU A 66 8.342 9.101 -27.085 1.00 0.00 H new ATOM 0 HA GLU A 66 9.195 6.602 -27.832 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.027 9.360 -28.830 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.475 7.875 -29.646 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.978 7.344 -29.835 1.00 0.00 H new ATOM 0 HG3 GLU A 66 7.662 8.964 -29.244 1.00 0.00 H new ATOM 1044 N ALA A 67 11.586 8.407 -26.419 1.00 0.00 N ATOM 1045 CA ALA A 67 12.932 8.404 -25.871 1.00 0.00 C ATOM 1046 C ALA A 67 13.126 7.290 -24.840 1.00 0.00 C ATOM 1047 O ALA A 67 14.235 6.767 -24.717 1.00 0.00 O ATOM 1048 CB ALA A 67 13.245 9.773 -25.255 1.00 0.00 C ATOM 0 H ALA A 67 11.054 9.246 -26.187 1.00 0.00 H new ATOM 0 HA ALA A 67 13.628 8.209 -26.687 1.00 0.00 H new ATOM 0 HB1 ALA A 67 14.255 9.765 -24.846 1.00 0.00 H new ATOM 0 HB2 ALA A 67 13.170 10.543 -26.023 1.00 0.00 H new ATOM 0 HB3 ALA A 67 12.532 9.985 -24.458 1.00 0.00 H new ATOM 1054 N VAL A 68 12.068 6.910 -24.113 1.00 0.00 N ATOM 1055 CA VAL A 68 12.139 5.882 -23.078 1.00 0.00 C ATOM 1056 C VAL A 68 11.496 4.564 -23.502 1.00 0.00 C ATOM 1057 O VAL A 68 11.716 3.563 -22.829 1.00 0.00 O ATOM 1058 CB VAL A 68 11.606 6.413 -21.736 1.00 0.00 C ATOM 1059 CG1 VAL A 68 12.306 7.709 -21.299 1.00 0.00 C ATOM 1060 CG2 VAL A 68 10.085 6.594 -21.688 1.00 0.00 C ATOM 0 H VAL A 68 11.137 7.311 -24.230 1.00 0.00 H new ATOM 0 HA VAL A 68 13.192 5.643 -22.931 1.00 0.00 H new ATOM 0 HB VAL A 68 11.850 5.624 -21.024 1.00 0.00 H new ATOM 0 HG11 VAL A 68 11.894 8.042 -20.347 1.00 0.00 H new ATOM 0 HG12 VAL A 68 13.375 7.526 -21.187 1.00 0.00 H new ATOM 0 HG13 VAL A 68 12.147 8.480 -22.053 1.00 0.00 H new ATOM 0 HG21 VAL A 68 9.794 6.971 -20.708 1.00 0.00 H new ATOM 0 HG22 VAL A 68 9.779 7.305 -22.456 1.00 0.00 H new ATOM 0 HG23 VAL A 68 9.599 5.635 -21.867 1.00 0.00 H new ATOM 1070 N TRP A 69 10.754 4.533 -24.614 1.00 0.00 N ATOM 1071 CA TRP A 69 10.047 3.361 -25.139 1.00 0.00 C ATOM 1072 C TRP A 69 10.984 2.164 -25.300 1.00 0.00 C ATOM 1073 O TRP A 69 10.566 1.015 -25.174 1.00 0.00 O ATOM 1074 CB TRP A 69 9.410 3.731 -26.488 1.00 0.00 C ATOM 1075 CG TRP A 69 8.104 3.056 -26.775 1.00 0.00 C ATOM 1076 CD1 TRP A 69 7.903 1.960 -27.543 1.00 0.00 C ATOM 1077 CD2 TRP A 69 6.775 3.494 -26.372 1.00 0.00 C ATOM 1078 NE1 TRP A 69 6.549 1.673 -27.586 1.00 0.00 N ATOM 1079 CE2 TRP A 69 5.814 2.641 -26.974 1.00 0.00 C ATOM 1080 CE3 TRP A 69 6.276 4.558 -25.598 1.00 0.00 C ATOM 1081 CZ2 TRP A 69 4.441 2.863 -26.912 1.00 0.00 C ATOM 1082 CZ3 TRP A 69 4.892 4.787 -25.501 1.00 0.00 C ATOM 1083 CH2 TRP A 69 3.981 3.976 -26.208 1.00 0.00 C ATOM 0 H TRP A 69 10.624 5.360 -25.197 1.00 0.00 H new ATOM 0 HA TRP A 69 9.273 3.069 -24.429 1.00 0.00 H new ATOM 0 HB2 TRP A 69 9.259 4.810 -26.518 1.00 0.00 H new ATOM 0 HB3 TRP A 69 10.112 3.485 -27.285 1.00 0.00 H new ATOM 0 HD1 TRP A 69 8.677 1.397 -28.044 1.00 0.00 H new ATOM 0 HE1 TRP A 69 6.152 0.840 -28.022 1.00 0.00 H new ATOM 0 HE3 TRP A 69 6.963 5.205 -25.073 1.00 0.00 H new ATOM 0 HZ2 TRP A 69 3.749 2.190 -27.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 69 4.524 5.590 -24.880 1.00 0.00 H new ATOM 0 HH2 TRP A 69 2.928 4.216 -26.205 1.00 0.00 H new ATOM 1094 N ASP A 70 12.260 2.451 -25.541 1.00 0.00 N ATOM 1095 CA ASP A 70 13.326 1.468 -25.693 1.00 0.00 C ATOM 1096 C ASP A 70 13.658 0.798 -24.362 1.00 0.00 C ATOM 1097 O ASP A 70 13.756 -0.425 -24.278 1.00 0.00 O ATOM 1098 CB ASP A 70 14.565 2.143 -26.283 1.00 0.00 C ATOM 1099 CG ASP A 70 15.740 1.151 -26.363 1.00 0.00 C ATOM 1100 OD1 ASP A 70 15.752 0.299 -27.283 1.00 0.00 O1- ATOM 1101 OD2 ASP A 70 16.667 1.239 -25.523 1.00 0.00 O ATOM 0 H ASP A 70 12.591 3.411 -25.639 1.00 0.00 H new ATOM 0 HA ASP A 70 12.984 0.688 -26.373 1.00 0.00 H new ATOM 0 HB2 ASP A 70 14.338 2.526 -27.278 1.00 0.00 H new ATOM 0 HB3 ASP A 70 14.846 2.999 -25.669 1.00 0.00 H new ATOM 1106 N GLN A 71 13.748 1.600 -23.297 1.00 0.00 N ATOM 1107 CA GLN A 71 14.035 1.137 -21.948 1.00 0.00 C ATOM 1108 C GLN A 71 12.890 0.344 -21.364 1.00 0.00 C ATOM 1109 O GLN A 71 13.161 -0.556 -20.587 1.00 0.00 O ATOM 1110 CB GLN A 71 14.374 2.316 -21.017 1.00 0.00 C ATOM 1111 CG GLN A 71 15.847 2.726 -21.121 1.00 0.00 C ATOM 1112 CD GLN A 71 16.085 4.057 -20.413 1.00 0.00 C ATOM 1113 OE1 GLN A 71 16.364 4.103 -19.219 1.00 0.00 O ATOM 1114 NE2 GLN A 71 15.917 5.165 -21.121 1.00 0.00 N ATOM 0 H GLN A 71 13.620 2.610 -23.356 1.00 0.00 H new ATOM 0 HA GLN A 71 14.901 0.479 -22.023 1.00 0.00 H new ATOM 0 HB2 GLN A 71 13.742 3.168 -21.267 1.00 0.00 H new ATOM 0 HB3 GLN A 71 14.146 2.041 -19.987 1.00 0.00 H new ATOM 0 HG2 GLN A 71 16.477 1.955 -20.678 1.00 0.00 H new ATOM 0 HG3 GLN A 71 16.134 2.809 -22.169 1.00 0.00 H new ATOM 0 HE21 GLN A 71 15.685 5.106 -22.113 1.00 0.00 H new ATOM 0 HE22 GLN A 71 16.019 6.076 -20.674 1.00 0.00 H new ATOM 1123 N LEU A 72 11.637 0.611 -21.736 1.00 0.00 N ATOM 1124 CA LEU A 72 10.482 -0.100 -21.164 1.00 0.00 C ATOM 1125 C LEU A 72 10.603 -1.612 -21.372 1.00 0.00 C ATOM 1126 O LEU A 72 10.132 -2.395 -20.553 1.00 0.00 O ATOM 1127 CB LEU A 72 9.165 0.373 -21.805 1.00 0.00 C ATOM 1128 CG LEU A 72 8.935 1.892 -21.856 1.00 0.00 C ATOM 1129 CD1 LEU A 72 7.583 2.197 -22.504 1.00 0.00 C ATOM 1130 CD2 LEU A 72 9.072 2.577 -20.494 1.00 0.00 C ATOM 0 H LEU A 72 11.391 1.315 -22.432 1.00 0.00 H new ATOM 0 HA LEU A 72 10.473 0.124 -20.097 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.123 -0.013 -22.824 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.338 -0.079 -21.258 1.00 0.00 H new ATOM 0 HG LEU A 72 9.730 2.313 -22.472 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.430 3.276 -22.535 1.00 0.00 H new ATOM 0 HD12 LEU A 72 7.568 1.799 -23.518 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.787 1.734 -21.920 1.00 0.00 H new ATOM 0 HD21 LEU A 72 8.897 3.647 -20.606 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.341 2.160 -19.802 1.00 0.00 H new ATOM 0 HD23 LEU A 72 10.076 2.413 -20.103 1.00 0.00 H new ATOM 1142 N ASP A 73 11.256 -2.015 -22.464 1.00 0.00 N ATOM 1143 CA ASP A 73 11.505 -3.418 -22.788 1.00 0.00 C ATOM 1144 C ASP A 73 12.528 -4.037 -21.840 1.00 0.00 C ATOM 1145 O ASP A 73 12.446 -5.229 -21.542 1.00 0.00 O ATOM 1146 CB ASP A 73 11.990 -3.554 -24.234 1.00 0.00 C ATOM 1147 CG ASP A 73 12.238 -5.029 -24.595 1.00 0.00 C ATOM 1148 OD1 ASP A 73 11.248 -5.791 -24.707 1.00 0.00 O1- ATOM 1149 OD2 ASP A 73 13.413 -5.420 -24.797 1.00 0.00 O ATOM 0 H ASP A 73 11.631 -1.366 -23.156 1.00 0.00 H new ATOM 0 HA ASP A 73 10.564 -3.955 -22.671 1.00 0.00 H new ATOM 0 HB2 ASP A 73 11.249 -3.130 -24.911 1.00 0.00 H new ATOM 0 HB3 ASP A 73 12.909 -2.983 -24.369 1.00 0.00 H new ATOM 1154 N ASP A 74 13.443 -3.229 -21.301 1.00 0.00 N ATOM 1155 CA ASP A 74 14.501 -3.700 -20.416 1.00 0.00 C ATOM 1156 C ASP A 74 13.994 -3.860 -18.980 1.00 0.00 C ATOM 1157 O ASP A 74 14.535 -4.662 -18.212 1.00 0.00 O ATOM 1158 CB ASP A 74 15.684 -2.726 -20.462 1.00 0.00 C ATOM 1159 CG ASP A 74 16.781 -3.104 -19.452 1.00 0.00 C ATOM 1160 OD1 ASP A 74 17.499 -4.107 -19.681 1.00 0.00 O1- ATOM 1161 OD2 ASP A 74 16.959 -2.360 -18.457 1.00 0.00 O ATOM 0 H ASP A 74 13.468 -2.223 -21.470 1.00 0.00 H new ATOM 0 HA ASP A 74 14.829 -4.681 -20.761 1.00 0.00 H new ATOM 0 HB2 ASP A 74 16.105 -2.714 -21.467 1.00 0.00 H new ATOM 0 HB3 ASP A 74 15.331 -1.716 -20.253 1.00 0.00 H new ATOM 1166 N LEU A 75 12.933 -3.129 -18.618 1.00 0.00 N ATOM 1167 CA LEU A 75 12.518 -2.999 -17.228 1.00 0.00 C ATOM 1168 C LEU A 75 11.843 -4.252 -16.713 1.00 0.00 C ATOM 1169 O LEU A 75 11.255 -5.048 -17.443 1.00 0.00 O ATOM 1170 CB LEU A 75 11.597 -1.793 -16.980 1.00 0.00 C ATOM 1171 CG LEU A 75 12.106 -0.505 -17.607 1.00 0.00 C ATOM 1172 CD1 LEU A 75 11.218 0.688 -17.300 1.00 0.00 C ATOM 1173 CD2 LEU A 75 13.570 -0.132 -17.366 1.00 0.00 C ATOM 0 H LEU A 75 12.347 -2.618 -19.278 1.00 0.00 H new ATOM 0 HA LEU A 75 13.444 -2.837 -16.676 1.00 0.00 H new ATOM 0 HB2 LEU A 75 10.606 -2.014 -17.377 1.00 0.00 H new ATOM 0 HB3 LEU A 75 11.485 -1.646 -15.906 1.00 0.00 H new ATOM 0 HG LEU A 75 12.055 -0.755 -18.667 1.00 0.00 H new ATOM 0 HD11 LEU A 75 11.630 1.579 -17.773 1.00 0.00 H new ATOM 0 HD12 LEU A 75 10.215 0.504 -17.685 1.00 0.00 H new ATOM 0 HD13 LEU A 75 11.171 0.838 -16.221 1.00 0.00 H new ATOM 0 HD21 LEU A 75 13.794 0.808 -17.871 1.00 0.00 H new ATOM 0 HD22 LEU A 75 13.746 -0.020 -16.296 1.00 0.00 H new ATOM 0 HD23 LEU A 75 14.215 -0.918 -17.759 1.00 0.00 H new ATOM 1185 N ASN A 76 11.860 -4.338 -15.399 1.00 0.00 N ATOM 1186 CA ASN A 76 11.194 -5.350 -14.597 1.00 0.00 C ATOM 1187 C ASN A 76 9.809 -4.841 -14.208 1.00 0.00 C ATOM 1188 O ASN A 76 9.707 -4.062 -13.260 1.00 0.00 O ATOM 1189 CB ASN A 76 12.049 -5.688 -13.362 1.00 0.00 C ATOM 1190 CG ASN A 76 11.328 -6.648 -12.418 1.00 0.00 C ATOM 1191 OD1 ASN A 76 11.320 -7.855 -12.634 1.00 0.00 O ATOM 1192 ND2 ASN A 76 10.686 -6.139 -11.375 1.00 0.00 N ATOM 0 H ASN A 76 12.369 -3.665 -14.826 1.00 0.00 H new ATOM 0 HA ASN A 76 11.074 -6.269 -15.170 1.00 0.00 H new ATOM 0 HB2 ASN A 76 12.991 -6.133 -13.683 1.00 0.00 H new ATOM 0 HB3 ASN A 76 12.295 -4.770 -12.828 1.00 0.00 H new ATOM 0 HD21 ASN A 76 10.177 -6.754 -10.740 1.00 0.00 H new ATOM 0 HD22 ASN A 76 10.701 -5.133 -11.208 1.00 0.00 H new ATOM 1199 N LEU A 77 8.747 -5.248 -14.925 1.00 0.00 N ATOM 1200 CA LEU A 77 7.360 -4.879 -14.601 1.00 0.00 C ATOM 1201 C LEU A 77 6.461 -6.067 -14.305 1.00 0.00 C ATOM 1202 O LEU A 77 5.248 -5.925 -14.189 1.00 0.00 O ATOM 1203 CB LEU A 77 6.702 -3.984 -15.677 1.00 0.00 C ATOM 1204 CG LEU A 77 7.555 -2.891 -16.326 1.00 0.00 C ATOM 1205 CD1 LEU A 77 6.761 -2.222 -17.453 1.00 0.00 C ATOM 1206 CD2 LEU A 77 7.993 -1.809 -15.342 1.00 0.00 C ATOM 0 H LEU A 77 8.828 -5.844 -15.748 1.00 0.00 H new ATOM 0 HA LEU A 77 7.455 -4.300 -13.682 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.332 -4.634 -16.470 1.00 0.00 H new ATOM 0 HB3 LEU A 77 5.833 -3.505 -15.226 1.00 0.00 H new ATOM 0 HG LEU A 77 8.452 -3.382 -16.705 1.00 0.00 H new ATOM 0 HD11 LEU A 77 7.369 -1.444 -17.914 1.00 0.00 H new ATOM 0 HD12 LEU A 77 6.495 -2.967 -18.203 1.00 0.00 H new ATOM 0 HD13 LEU A 77 5.853 -1.778 -17.045 1.00 0.00 H new ATOM 0 HD21 LEU A 77 8.594 -1.064 -15.864 1.00 0.00 H new ATOM 0 HD22 LEU A 77 7.113 -1.329 -14.913 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.585 -2.260 -14.545 1.00 0.00 H new ATOM 1218 N GLU A 78 7.056 -7.239 -14.196 1.00 0.00 N ATOM 1219 CA GLU A 78 6.307 -8.483 -14.101 1.00 0.00 C ATOM 1220 C GLU A 78 5.505 -8.479 -12.798 1.00 0.00 C ATOM 1221 O GLU A 78 6.063 -8.354 -11.703 1.00 0.00 O ATOM 1222 CB GLU A 78 7.225 -9.708 -14.214 1.00 0.00 C ATOM 1223 CG GLU A 78 7.710 -9.923 -15.652 1.00 0.00 C ATOM 1224 CD GLU A 78 8.637 -11.149 -15.754 1.00 0.00 C ATOM 1225 OE1 GLU A 78 8.127 -12.290 -15.873 1.00 0.00 O1- ATOM 1226 OE2 GLU A 78 9.882 -10.982 -15.734 1.00 0.00 O ATOM 0 H GLU A 78 8.069 -7.359 -14.171 1.00 0.00 H new ATOM 0 HA GLU A 78 5.614 -8.553 -14.940 1.00 0.00 H new ATOM 0 HB2 GLU A 78 8.084 -9.581 -13.555 1.00 0.00 H new ATOM 0 HB3 GLU A 78 6.691 -10.595 -13.874 1.00 0.00 H new ATOM 0 HG2 GLU A 78 6.852 -10.058 -16.311 1.00 0.00 H new ATOM 0 HG3 GLU A 78 8.240 -9.035 -15.996 1.00 0.00 H new ATOM 1233 N GLY A 79 4.184 -8.592 -12.933 1.00 0.00 N ATOM 1234 CA GLY A 79 3.228 -8.613 -11.834 1.00 0.00 C ATOM 1235 C GLY A 79 2.960 -7.247 -11.216 1.00 0.00 C ATOM 1236 O GLY A 79 2.333 -7.163 -10.159 1.00 0.00 O ATOM 0 H GLY A 79 3.737 -8.674 -13.846 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.286 -9.028 -12.194 1.00 0.00 H new ATOM 0 HA3 GLY A 79 3.597 -9.284 -11.059 1.00 0.00 H new ATOM 1240 N LYS A 80 3.402 -6.172 -11.873 1.00 0.00 N ATOM 1241 CA LYS A 80 3.055 -4.816 -11.480 1.00 0.00 C ATOM 1242 C LYS A 80 1.682 -4.497 -11.979 1.00 0.00 C ATOM 1243 O LYS A 80 1.298 -4.937 -13.060 1.00 0.00 O ATOM 1244 CB LYS A 80 4.021 -3.753 -12.028 1.00 0.00 C ATOM 1245 CG LYS A 80 5.340 -3.888 -11.304 1.00 0.00 C ATOM 1246 CD LYS A 80 6.218 -2.654 -11.536 1.00 0.00 C ATOM 1247 CE LYS A 80 7.650 -2.882 -11.043 1.00 0.00 C ATOM 1248 NZ LYS A 80 7.742 -3.124 -9.574 1.00 0.00 N1+ ATOM 0 H LYS A 80 4.010 -6.223 -12.691 1.00 0.00 H new ATOM 0 HA LYS A 80 3.113 -4.784 -10.392 1.00 0.00 H new ATOM 0 HB2 LYS A 80 4.162 -3.886 -13.101 1.00 0.00 H new ATOM 0 HB3 LYS A 80 3.609 -2.755 -11.882 1.00 0.00 H new ATOM 0 HG2 LYS A 80 5.162 -4.018 -10.236 1.00 0.00 H new ATOM 0 HG3 LYS A 80 5.861 -4.781 -11.651 1.00 0.00 H new ATOM 0 HD2 LYS A 80 6.232 -2.411 -12.599 1.00 0.00 H new ATOM 0 HD3 LYS A 80 5.786 -1.797 -11.019 1.00 0.00 H new ATOM 0 HE2 LYS A 80 8.076 -3.735 -11.571 1.00 0.00 H new ATOM 0 HE3 LYS A 80 8.257 -2.013 -11.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 8.730 -3.018 -9.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 7.146 -2.436 -9.071 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 7.414 -4.087 -9.360 1.00 0.00 H new ATOM 1262 N ILE A 81 0.983 -3.663 -11.230 1.00 0.00 N ATOM 1263 CA ILE A 81 -0.230 -3.072 -11.770 1.00 0.00 C ATOM 1264 C ILE A 81 0.180 -1.842 -12.558 1.00 0.00 C ATOM 1265 O ILE A 81 1.055 -1.090 -12.134 1.00 0.00 O ATOM 1266 CB ILE A 81 -1.280 -2.782 -10.701 1.00 0.00 C ATOM 1267 CG1 ILE A 81 -1.692 -4.076 -9.977 1.00 0.00 C ATOM 1268 CG2 ILE A 81 -2.521 -2.206 -11.400 1.00 0.00 C ATOM 1269 CD1 ILE A 81 -1.689 -3.911 -8.468 1.00 0.00 C ATOM 0 H ILE A 81 1.222 -3.386 -10.278 1.00 0.00 H new ATOM 0 HA ILE A 81 -0.728 -3.782 -12.430 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.868 -2.084 -9.972 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.687 -4.374 -10.307 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -1.010 -4.879 -10.255 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -3.289 -1.989 -10.658 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -2.251 -1.288 -11.922 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -2.904 -2.932 -12.117 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.986 -4.849 -7.999 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -0.688 -3.639 -8.134 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.391 -3.126 -8.186 1.00 0.00 H new ATOM 1281 N VAL A 82 -0.485 -1.630 -13.685 1.00 0.00 N ATOM 1282 CA VAL A 82 -0.303 -0.514 -14.569 1.00 0.00 C ATOM 1283 C VAL A 82 -1.691 -0.009 -14.948 1.00 0.00 C ATOM 1284 O VAL A 82 -2.468 -0.748 -15.544 1.00 0.00 O ATOM 1285 CB VAL A 82 0.511 -0.974 -15.793 1.00 0.00 C ATOM 1286 CG1 VAL A 82 0.667 0.155 -16.816 1.00 0.00 C ATOM 1287 CG2 VAL A 82 1.899 -1.482 -15.371 1.00 0.00 C ATOM 0 H VAL A 82 -1.203 -2.275 -14.015 1.00 0.00 H new ATOM 0 HA VAL A 82 0.252 0.300 -14.102 1.00 0.00 H new ATOM 0 HB VAL A 82 -0.041 -1.791 -16.258 1.00 0.00 H new ATOM 0 HG11 VAL A 82 1.246 -0.203 -17.667 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -0.317 0.476 -17.156 1.00 0.00 H new ATOM 0 HG13 VAL A 82 1.183 0.996 -16.354 1.00 0.00 H new ATOM 0 HG21 VAL A 82 2.454 -1.801 -16.254 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.443 -0.681 -14.870 1.00 0.00 H new ATOM 0 HG23 VAL A 82 1.786 -2.325 -14.689 1.00 0.00 H new ATOM 1297 N ALA A 83 -2.029 1.240 -14.641 1.00 0.00 N ATOM 1298 CA ALA A 83 -3.213 1.880 -15.164 1.00 0.00 C ATOM 1299 C ALA A 83 -2.810 2.760 -16.346 1.00 0.00 C ATOM 1300 O ALA A 83 -2.043 3.701 -16.145 1.00 0.00 O ATOM 1301 CB ALA A 83 -3.910 2.655 -14.046 1.00 0.00 C ATOM 0 H ALA A 83 -1.480 1.833 -14.018 1.00 0.00 H new ATOM 0 HA ALA A 83 -3.932 1.147 -15.530 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -4.804 3.138 -14.441 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -4.191 1.968 -13.248 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -3.233 3.412 -13.651 1.00 0.00 H new ATOM 1307 N LEU A 84 -3.285 2.475 -17.563 1.00 0.00 N ATOM 1308 CA LEU A 84 -3.041 3.351 -18.709 1.00 0.00 C ATOM 1309 C LEU A 84 -4.070 4.465 -18.811 1.00 0.00 C ATOM 1310 O LEU A 84 -5.264 4.230 -18.648 1.00 0.00 O ATOM 1311 CB LEU A 84 -3.027 2.580 -20.038 1.00 0.00 C ATOM 1312 CG LEU A 84 -1.857 1.616 -20.247 1.00 0.00 C ATOM 1313 CD1 LEU A 84 -1.930 1.026 -21.657 1.00 0.00 C ATOM 1314 CD2 LEU A 84 -0.510 2.331 -20.065 1.00 0.00 C ATOM 0 H LEU A 84 -3.839 1.646 -17.778 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.056 3.785 -18.534 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.955 2.014 -20.116 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.025 3.303 -20.854 1.00 0.00 H new ATOM 0 HG LEU A 84 -1.929 0.823 -19.503 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.097 0.339 -21.808 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -2.870 0.488 -21.778 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.874 1.830 -22.391 1.00 0.00 H new ATOM 0 HD21 LEU A 84 0.303 1.621 -20.219 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.427 3.141 -20.790 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -0.448 2.739 -19.056 1.00 0.00 H new ATOM 1326 N TYR A 85 -3.618 5.654 -19.199 1.00 0.00 N ATOM 1327 CA TYR A 85 -4.478 6.770 -19.576 1.00 0.00 C ATOM 1328 C TYR A 85 -3.909 7.442 -20.818 1.00 0.00 C ATOM 1329 O TYR A 85 -2.716 7.331 -21.081 1.00 0.00 O ATOM 1330 CB TYR A 85 -4.644 7.751 -18.410 1.00 0.00 C ATOM 1331 CG TYR A 85 -3.479 8.670 -18.116 1.00 0.00 C ATOM 1332 CD1 TYR A 85 -2.415 8.235 -17.311 1.00 0.00 C ATOM 1333 CD2 TYR A 85 -3.489 9.986 -18.617 1.00 0.00 C ATOM 1334 CE1 TYR A 85 -1.369 9.118 -16.988 1.00 0.00 C ATOM 1335 CE2 TYR A 85 -2.452 10.875 -18.291 1.00 0.00 C ATOM 1336 CZ TYR A 85 -1.405 10.457 -17.444 1.00 0.00 C ATOM 1337 OH TYR A 85 -0.442 11.337 -17.061 1.00 0.00 O ATOM 0 H TYR A 85 -2.624 5.872 -19.261 1.00 0.00 H new ATOM 0 HA TYR A 85 -5.476 6.401 -19.813 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -5.521 8.368 -18.608 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -4.857 7.175 -17.510 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -2.399 7.221 -16.939 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -4.297 10.313 -19.254 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -0.537 8.774 -16.391 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -2.456 11.879 -18.689 1.00 0.00 H new ATOM 0 HH TYR A 85 -0.627 12.216 -17.453 1.00 0.00 H new ATOM 1347 N GLY A 86 -4.717 8.125 -21.616 1.00 0.00 N ATOM 1348 CA GLY A 86 -4.177 8.862 -22.743 1.00 0.00 C ATOM 1349 C GLY A 86 -5.119 9.936 -23.229 1.00 0.00 C ATOM 1350 O GLY A 86 -6.262 10.031 -22.774 1.00 0.00 O ATOM 0 H GLY A 86 -5.729 8.183 -21.506 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -3.228 9.316 -22.456 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -3.966 8.171 -23.559 1.00 0.00 H new ATOM 1354 N LEU A 87 -4.611 10.749 -24.152 1.00 0.00 N ATOM 1355 CA LEU A 87 -5.295 11.920 -24.683 1.00 0.00 C ATOM 1356 C LEU A 87 -5.335 11.807 -26.208 1.00 0.00 C ATOM 1357 O LEU A 87 -4.457 11.169 -26.800 1.00 0.00 O ATOM 1358 CB LEU A 87 -4.561 13.221 -24.298 1.00 0.00 C ATOM 1359 CG LEU A 87 -3.963 13.372 -22.887 1.00 0.00 C ATOM 1360 CD1 LEU A 87 -3.391 14.782 -22.753 1.00 0.00 C ATOM 1361 CD2 LEU A 87 -4.965 13.203 -21.755 1.00 0.00 C ATOM 0 H LEU A 87 -3.687 10.606 -24.561 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.301 11.958 -24.264 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -3.749 13.360 -25.012 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.260 14.045 -24.445 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.218 12.582 -22.794 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.962 14.908 -21.759 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -2.616 14.933 -23.504 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.186 15.513 -22.900 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -4.457 13.325 -20.798 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.749 13.954 -21.848 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -5.407 12.208 -21.806 1.00 0.00 H new ATOM 1373 N GLY A 88 -6.296 12.467 -26.843 1.00 0.00 N ATOM 1374 CA GLY A 88 -6.406 12.555 -28.291 1.00 0.00 C ATOM 1375 C GLY A 88 -7.557 13.488 -28.674 1.00 0.00 C ATOM 1376 O GLY A 88 -7.944 14.346 -27.881 1.00 0.00 O ATOM 0 H GLY A 88 -7.037 12.967 -26.352 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -5.472 12.925 -28.713 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -6.575 11.564 -28.712 1.00 0.00 H new ATOM 1380 N ASP A 89 -8.118 13.315 -29.869 1.00 0.00 N ATOM 1381 CA ASP A 89 -9.369 13.912 -30.319 1.00 0.00 C ATOM 1382 C ASP A 89 -10.008 12.939 -31.304 1.00 0.00 C ATOM 1383 O ASP A 89 -9.324 12.321 -32.118 1.00 0.00 O ATOM 1384 CB ASP A 89 -9.195 15.272 -30.986 1.00 0.00 C ATOM 1385 CG ASP A 89 -10.451 15.586 -31.821 1.00 0.00 C ATOM 1386 OD1 ASP A 89 -11.594 15.545 -31.294 1.00 0.00 O ATOM 1387 OD2 ASP A 89 -10.298 15.765 -33.045 1.00 0.00 O ATOM 0 H ASP A 89 -7.690 12.726 -30.583 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.994 14.088 -29.444 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.042 16.044 -30.232 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.311 15.268 -31.623 1.00 0.00 H new ATOM 1392 N GLN A 90 -11.323 12.793 -31.231 1.00 0.00 N ATOM 1393 CA GLN A 90 -12.107 11.955 -32.092 1.00 0.00 C ATOM 1394 C GLN A 90 -12.630 12.668 -33.337 1.00 0.00 C ATOM 1395 O GLN A 90 -12.902 11.985 -34.326 1.00 0.00 O ATOM 1396 CB GLN A 90 -13.249 11.316 -31.286 1.00 0.00 C ATOM 1397 CG GLN A 90 -14.237 12.306 -30.639 1.00 0.00 C ATOM 1398 CD GLN A 90 -13.772 12.868 -29.293 1.00 0.00 C ATOM 1399 OE1 GLN A 90 -13.104 14.006 -29.249 1.00 0.00 O flip ATOM 1400 NE2 GLN A 90 -14.020 12.288 -28.244 1.00 0.00 N flip ATOM 0 H GLN A 90 -11.886 13.282 -30.535 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.446 11.176 -32.471 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -13.807 10.650 -31.944 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.815 10.697 -30.501 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -14.406 13.134 -31.327 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -15.196 11.806 -30.500 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -14.535 11.408 -28.257 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -13.712 12.685 -27.356 1.00 0.00 H new ATOM 1409 N LEU A 91 -12.789 13.996 -33.334 1.00 0.00 N ATOM 1410 CA LEU A 91 -13.508 14.653 -34.418 1.00 0.00 C ATOM 1411 C LEU A 91 -12.656 14.833 -35.671 1.00 0.00 C ATOM 1412 O LEU A 91 -13.176 14.775 -36.785 1.00 0.00 O ATOM 1413 CB LEU A 91 -14.076 15.999 -33.963 1.00 0.00 C ATOM 1414 CG LEU A 91 -15.097 15.914 -32.813 1.00 0.00 C ATOM 1415 CD1 LEU A 91 -15.751 17.288 -32.651 1.00 0.00 C ATOM 1416 CD2 LEU A 91 -16.222 14.890 -33.032 1.00 0.00 C ATOM 0 H LEU A 91 -12.437 14.621 -32.609 1.00 0.00 H new ATOM 0 HA LEU A 91 -14.332 13.991 -34.684 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -13.251 16.639 -33.651 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -14.550 16.484 -34.816 1.00 0.00 H new ATOM 0 HG LEU A 91 -14.540 15.592 -31.933 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -16.479 17.251 -31.841 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -14.987 18.030 -32.419 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -16.254 17.563 -33.578 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -16.894 14.898 -32.173 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -16.780 15.149 -33.932 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -15.791 13.895 -33.146 1.00 0.00 H new ATOM 1428 N GLY A 92 -11.355 15.047 -35.491 1.00 0.00 N ATOM 1429 CA GLY A 92 -10.401 15.266 -36.566 1.00 0.00 C ATOM 1430 C GLY A 92 -9.772 13.957 -37.021 1.00 0.00 C ATOM 1431 O GLY A 92 -9.257 13.867 -38.138 1.00 0.00 O ATOM 0 H GLY A 92 -10.927 15.073 -34.566 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -10.902 15.744 -37.408 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -9.621 15.949 -36.230 1.00 0.00 H new ATOM 1435 N TYR A 93 -9.830 12.946 -36.149 1.00 0.00 N ATOM 1436 CA TYR A 93 -9.122 11.696 -36.292 1.00 0.00 C ATOM 1437 C TYR A 93 -10.152 10.563 -36.278 1.00 0.00 C ATOM 1438 O TYR A 93 -10.586 10.090 -37.326 1.00 0.00 O ATOM 1439 CB TYR A 93 -8.009 11.604 -35.216 1.00 0.00 C ATOM 1440 CG TYR A 93 -7.086 12.811 -35.182 1.00 0.00 C ATOM 1441 CD1 TYR A 93 -7.409 13.916 -34.371 1.00 0.00 C ATOM 1442 CD2 TYR A 93 -5.953 12.866 -36.014 1.00 0.00 C ATOM 1443 CE1 TYR A 93 -6.646 15.092 -34.434 1.00 0.00 C ATOM 1444 CE2 TYR A 93 -5.183 14.042 -36.082 1.00 0.00 C ATOM 1445 CZ TYR A 93 -5.544 15.173 -35.313 1.00 0.00 C ATOM 1446 OH TYR A 93 -4.854 16.346 -35.417 1.00 0.00 O ATOM 0 H TYR A 93 -10.393 12.989 -35.300 1.00 0.00 H new ATOM 0 HA TYR A 93 -8.594 11.617 -37.242 1.00 0.00 H new ATOM 0 HB2 TYR A 93 -8.473 11.485 -34.237 1.00 0.00 H new ATOM 0 HB3 TYR A 93 -7.414 10.709 -35.398 1.00 0.00 H new ATOM 0 HD1 TYR A 93 -8.250 13.858 -33.696 1.00 0.00 H new ATOM 0 HD2 TYR A 93 -5.674 12.004 -36.602 1.00 0.00 H new ATOM 0 HE1 TYR A 93 -6.902 15.935 -33.810 1.00 0.00 H new ATOM 0 HE2 TYR A 93 -4.315 14.081 -36.723 1.00 0.00 H new ATOM 0 HH TYR A 93 -4.124 16.240 -36.062 1.00 0.00 H new ATOM 1456 N GLY A 94 -10.502 10.100 -35.075 1.00 0.00 N ATOM 1457 CA GLY A 94 -11.274 8.899 -34.744 1.00 0.00 C ATOM 1458 C GLY A 94 -10.359 7.702 -34.912 1.00 0.00 C ATOM 1459 O GLY A 94 -10.049 6.980 -33.973 1.00 0.00 O ATOM 0 H GLY A 94 -10.227 10.602 -34.231 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.648 8.954 -33.722 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.143 8.811 -35.396 1.00 0.00 H new ATOM 1463 N GLU A 95 -9.777 7.648 -36.095 1.00 0.00 N ATOM 1464 CA GLU A 95 -8.971 6.550 -36.619 1.00 0.00 C ATOM 1465 C GLU A 95 -7.694 6.372 -35.794 1.00 0.00 C ATOM 1466 O GLU A 95 -7.170 5.261 -35.692 1.00 0.00 O ATOM 1467 CB GLU A 95 -8.601 6.830 -38.088 1.00 0.00 C ATOM 1468 CG GLU A 95 -9.635 6.385 -39.125 1.00 0.00 C ATOM 1469 CD GLU A 95 -9.721 4.853 -39.244 1.00 0.00 C ATOM 1470 OE1 GLU A 95 -8.968 4.259 -40.055 1.00 0.00 O ATOM 1471 OE2 GLU A 95 -10.555 4.231 -38.545 1.00 0.00 O ATOM 0 H GLU A 95 -9.857 8.416 -36.761 1.00 0.00 H new ATOM 0 HA GLU A 95 -9.557 5.633 -36.557 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -8.433 7.901 -38.204 1.00 0.00 H new ATOM 0 HB3 GLU A 95 -7.656 6.334 -38.307 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -10.613 6.782 -38.853 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -9.378 6.809 -40.096 1.00 0.00 H new ATOM 1478 N TRP A 96 -7.218 7.468 -35.189 1.00 0.00 N ATOM 1479 CA TRP A 96 -6.012 7.516 -34.384 1.00 0.00 C ATOM 1480 C TRP A 96 -6.299 7.921 -32.932 1.00 0.00 C ATOM 1481 O TRP A 96 -5.362 8.164 -32.180 1.00 0.00 O ATOM 1482 CB TRP A 96 -4.956 8.384 -35.082 1.00 0.00 C ATOM 1483 CG TRP A 96 -4.647 7.992 -36.499 1.00 0.00 C ATOM 1484 CD1 TRP A 96 -3.719 7.090 -36.891 1.00 0.00 C ATOM 1485 CD2 TRP A 96 -5.294 8.442 -37.730 1.00 0.00 C ATOM 1486 NE1 TRP A 96 -3.754 6.955 -38.264 1.00 0.00 N ATOM 1487 CE2 TRP A 96 -4.725 7.745 -38.831 1.00 0.00 C ATOM 1488 CE3 TRP A 96 -6.318 9.362 -38.029 1.00 0.00 C ATOM 1489 CZ2 TRP A 96 -5.170 7.921 -40.147 1.00 0.00 C ATOM 1490 CZ3 TRP A 96 -6.746 9.589 -39.352 1.00 0.00 C ATOM 1491 CH2 TRP A 96 -6.181 8.859 -40.412 1.00 0.00 C ATOM 0 H TRP A 96 -7.686 8.372 -35.255 1.00 0.00 H new ATOM 0 HA TRP A 96 -5.596 6.512 -34.304 1.00 0.00 H new ATOM 0 HB2 TRP A 96 -5.295 9.420 -35.073 1.00 0.00 H new ATOM 0 HB3 TRP A 96 -4.034 8.346 -34.501 1.00 0.00 H new ATOM 0 HD1 TRP A 96 -3.052 6.556 -36.230 1.00 0.00 H new ATOM 0 HE1 TRP A 96 -3.134 6.343 -38.794 1.00 0.00 H new ATOM 0 HE3 TRP A 96 -6.787 9.907 -37.223 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 -4.740 7.341 -40.950 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 -7.510 10.326 -39.552 1.00 0.00 H new ATOM 0 HH2 TRP A 96 -6.522 9.019 -41.424 1.00 0.00 H new ATOM 1502 N PHE A 97 -7.564 8.050 -32.518 1.00 0.00 N ATOM 1503 CA PHE A 97 -7.974 8.211 -31.137 1.00 0.00 C ATOM 1504 C PHE A 97 -7.293 7.170 -30.272 1.00 0.00 C ATOM 1505 O PHE A 97 -7.447 5.978 -30.521 1.00 0.00 O ATOM 1506 CB PHE A 97 -9.511 8.123 -31.022 1.00 0.00 C ATOM 1507 CG PHE A 97 -10.122 8.897 -29.874 1.00 0.00 C ATOM 1508 CD1 PHE A 97 -9.720 10.223 -29.665 1.00 0.00 C ATOM 1509 CD2 PHE A 97 -11.130 8.343 -29.064 1.00 0.00 C ATOM 1510 CE1 PHE A 97 -10.316 10.992 -28.651 1.00 0.00 C ATOM 1511 CE2 PHE A 97 -11.751 9.125 -28.072 1.00 0.00 C ATOM 1512 CZ PHE A 97 -11.356 10.460 -27.876 1.00 0.00 C ATOM 0 H PHE A 97 -8.352 8.044 -33.166 1.00 0.00 H new ATOM 0 HA PHE A 97 -7.671 9.196 -30.783 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -9.949 8.482 -31.953 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -9.791 7.075 -30.921 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -8.949 10.656 -30.286 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -11.428 7.314 -29.204 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -9.971 11.999 -28.468 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -12.532 8.699 -27.460 1.00 0.00 H new ATOM 0 HZ PHE A 97 -11.850 11.071 -27.135 1.00 0.00 H new ATOM 1522 N LEU A 98 -6.549 7.639 -29.263 1.00 0.00 N ATOM 1523 CA LEU A 98 -5.870 6.817 -28.265 1.00 0.00 C ATOM 1524 C LEU A 98 -4.950 5.762 -28.883 1.00 0.00 C ATOM 1525 O LEU A 98 -4.674 4.735 -28.274 1.00 0.00 O ATOM 1526 CB LEU A 98 -6.879 6.236 -27.264 1.00 0.00 C ATOM 1527 CG LEU A 98 -7.500 7.209 -26.252 1.00 0.00 C ATOM 1528 CD1 LEU A 98 -6.486 8.120 -25.564 1.00 0.00 C ATOM 1529 CD2 LEU A 98 -8.621 8.073 -26.826 1.00 0.00 C ATOM 0 H LEU A 98 -6.401 8.638 -29.118 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.199 7.468 -27.704 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.688 5.774 -27.829 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -6.384 5.440 -26.708 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.926 6.536 -25.508 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.003 8.777 -24.865 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -5.760 7.513 -25.023 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -5.970 8.721 -26.313 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.007 8.732 -26.048 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -8.233 8.672 -27.650 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.424 7.432 -27.190 1.00 0.00 H new ATOM 1541 N ASP A 99 -4.434 6.004 -30.078 1.00 0.00 N ATOM 1542 CA ASP A 99 -3.673 4.989 -30.804 1.00 0.00 C ATOM 1543 C ASP A 99 -2.390 4.641 -30.048 1.00 0.00 C ATOM 1544 O ASP A 99 -2.064 3.465 -29.869 1.00 0.00 O ATOM 1545 CB ASP A 99 -3.408 5.419 -32.244 1.00 0.00 C ATOM 1546 CG ASP A 99 -2.755 4.273 -33.032 1.00 0.00 C ATOM 1547 OD1 ASP A 99 -3.506 3.456 -33.614 1.00 0.00 O1- ATOM 1548 OD2 ASP A 99 -1.506 4.219 -33.102 1.00 0.00 O ATOM 0 H ASP A 99 -4.526 6.893 -30.569 1.00 0.00 H new ATOM 0 HA ASP A 99 -4.271 4.079 -30.862 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.343 5.711 -32.721 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -2.758 6.294 -32.256 1.00 0.00 H new ATOM 1553 N ALA A 100 -1.743 5.654 -29.454 1.00 0.00 N ATOM 1554 CA ALA A 100 -0.583 5.465 -28.597 1.00 0.00 C ATOM 1555 C ALA A 100 -0.930 4.672 -27.331 1.00 0.00 C ATOM 1556 O ALA A 100 -0.101 3.901 -26.850 1.00 0.00 O ATOM 1557 CB ALA A 100 0.025 6.833 -28.253 1.00 0.00 C ATOM 0 H ALA A 100 -2.018 6.630 -29.561 1.00 0.00 H new ATOM 0 HA ALA A 100 0.155 4.873 -29.138 1.00 0.00 H new ATOM 0 HB1 ALA A 100 0.895 6.694 -27.611 1.00 0.00 H new ATOM 0 HB2 ALA A 100 0.329 7.337 -29.170 1.00 0.00 H new ATOM 0 HB3 ALA A 100 -0.716 7.440 -27.733 1.00 0.00 H new ATOM 1563 N LEU A 101 -2.149 4.827 -26.797 1.00 0.00 N ATOM 1564 CA LEU A 101 -2.638 4.073 -25.648 1.00 0.00 C ATOM 1565 C LEU A 101 -2.645 2.585 -25.955 1.00 0.00 C ATOM 1566 O LEU A 101 -2.164 1.791 -25.152 1.00 0.00 O ATOM 1567 CB LEU A 101 -4.063 4.540 -25.289 1.00 0.00 C ATOM 1568 CG LEU A 101 -4.515 4.168 -23.878 1.00 0.00 C ATOM 1569 CD1 LEU A 101 -3.730 4.965 -22.857 1.00 0.00 C ATOM 1570 CD2 LEU A 101 -6.012 4.476 -23.707 1.00 0.00 C ATOM 0 H LEU A 101 -2.830 5.493 -27.162 1.00 0.00 H new ATOM 0 HA LEU A 101 -1.974 4.251 -24.802 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -4.115 5.623 -25.400 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -4.763 4.112 -26.006 1.00 0.00 H new ATOM 0 HG LEU A 101 -4.340 3.103 -23.726 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -4.058 4.694 -21.853 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -2.668 4.746 -22.963 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -3.899 6.030 -23.019 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -6.326 4.208 -22.698 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.186 5.540 -23.870 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -6.587 3.899 -24.431 1.00 0.00 H new ATOM 1582 N GLY A 102 -3.153 2.224 -27.132 1.00 0.00 N ATOM 1583 CA GLY A 102 -3.155 0.844 -27.591 1.00 0.00 C ATOM 1584 C GLY A 102 -1.731 0.324 -27.736 1.00 0.00 C ATOM 1585 O GLY A 102 -1.455 -0.802 -27.323 1.00 0.00 O ATOM 0 H GLY A 102 -3.573 2.881 -27.790 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -3.705 0.221 -26.885 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -3.672 0.774 -28.548 1.00 0.00 H new ATOM 1589 N MET A 103 -0.806 1.155 -28.231 1.00 0.00 N ATOM 1590 CA MET A 103 0.578 0.728 -28.399 1.00 0.00 C ATOM 1591 C MET A 103 1.258 0.463 -27.064 1.00 0.00 C ATOM 1592 O MET A 103 1.910 -0.572 -26.921 1.00 0.00 O ATOM 1593 CB MET A 103 1.381 1.673 -29.306 1.00 0.00 C ATOM 1594 CG MET A 103 0.802 1.749 -30.728 1.00 0.00 C ATOM 1595 SD MET A 103 2.010 2.086 -32.038 1.00 0.00 S ATOM 1596 CE MET A 103 2.557 3.732 -31.526 1.00 0.00 C ATOM 0 H MET A 103 -0.993 2.116 -28.518 1.00 0.00 H new ATOM 0 HA MET A 103 0.551 -0.227 -28.923 1.00 0.00 H new ATOM 0 HB2 MET A 103 1.393 2.671 -28.867 1.00 0.00 H new ATOM 0 HB3 MET A 103 2.416 1.334 -29.355 1.00 0.00 H new ATOM 0 HG2 MET A 103 0.303 0.806 -30.950 1.00 0.00 H new ATOM 0 HG3 MET A 103 0.039 2.527 -30.751 1.00 0.00 H new ATOM 0 HE1 MET A 103 3.459 4.003 -32.075 1.00 0.00 H new ATOM 0 HE2 MET A 103 1.772 4.458 -31.737 1.00 0.00 H new ATOM 0 HE3 MET A 103 2.771 3.728 -30.457 1.00 0.00 H new ATOM 1606 N LEU A 104 1.061 1.314 -26.051 1.00 0.00 N ATOM 1607 CA LEU A 104 1.570 0.981 -24.729 1.00 0.00 C ATOM 1608 C LEU A 104 0.914 -0.267 -24.179 1.00 0.00 C ATOM 1609 O LEU A 104 1.560 -1.020 -23.463 1.00 0.00 O ATOM 1610 CB LEU A 104 1.378 2.084 -23.679 1.00 0.00 C ATOM 1611 CG LEU A 104 2.648 2.899 -23.383 1.00 0.00 C ATOM 1612 CD1 LEU A 104 2.487 3.655 -22.069 1.00 0.00 C ATOM 1613 CD2 LEU A 104 3.949 2.095 -23.346 1.00 0.00 C ATOM 0 H LEU A 104 0.570 2.206 -26.121 1.00 0.00 H new ATOM 0 HA LEU A 104 2.638 0.837 -24.892 1.00 0.00 H new ATOM 0 HB2 LEU A 104 0.595 2.762 -24.019 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.026 1.631 -22.752 1.00 0.00 H new ATOM 0 HG LEU A 104 2.747 3.581 -24.228 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.391 4.230 -21.867 1.00 0.00 H new ATOM 0 HD12 LEU A 104 1.635 4.331 -22.140 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.320 2.945 -21.259 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.783 2.763 -23.130 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.884 1.333 -22.569 1.00 0.00 H new ATOM 0 HD23 LEU A 104 4.108 1.616 -24.312 1.00 0.00 H new ATOM 1625 N HIS A 105 -0.359 -0.483 -24.467 1.00 0.00 N ATOM 1626 CA HIS A 105 -1.044 -1.616 -23.880 1.00 0.00 C ATOM 1627 C HIS A 105 -0.438 -2.919 -24.390 1.00 0.00 C ATOM 1628 O HIS A 105 -0.134 -3.811 -23.608 1.00 0.00 O ATOM 1629 CB HIS A 105 -2.546 -1.495 -24.121 1.00 0.00 C ATOM 1630 CG HIS A 105 -3.313 -2.248 -23.084 1.00 0.00 C ATOM 1631 ND1 HIS A 105 -3.591 -1.795 -21.800 1.00 0.00 N ATOM 1632 CD2 HIS A 105 -3.809 -3.498 -23.234 1.00 0.00 C ATOM 1633 CE1 HIS A 105 -4.275 -2.785 -21.215 1.00 0.00 C ATOM 1634 NE2 HIS A 105 -4.420 -3.828 -22.047 1.00 0.00 N ATOM 0 H HIS A 105 -0.925 0.096 -25.088 1.00 0.00 H new ATOM 0 HA HIS A 105 -0.907 -1.625 -22.799 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -2.838 -0.445 -24.104 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -2.792 -1.878 -25.111 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -3.739 -4.117 -24.116 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -4.660 -2.749 -20.206 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -4.896 -4.705 -21.837 1.00 0.00 H new ATOM 1642 N ASP A 106 -0.147 -2.986 -25.684 1.00 0.00 N ATOM 1643 CA ASP A 106 0.524 -4.113 -26.325 1.00 0.00 C ATOM 1644 C ASP A 106 1.950 -4.279 -25.806 1.00 0.00 C ATOM 1645 O ASP A 106 2.369 -5.392 -25.483 1.00 0.00 O ATOM 1646 CB ASP A 106 0.546 -3.911 -27.839 1.00 0.00 C ATOM 1647 CG ASP A 106 1.322 -5.051 -28.520 1.00 0.00 C ATOM 1648 OD1 ASP A 106 0.765 -6.165 -28.640 1.00 0.00 O1- ATOM 1649 OD2 ASP A 106 2.481 -4.827 -28.944 1.00 0.00 O ATOM 0 H ASP A 106 -0.378 -2.236 -26.336 1.00 0.00 H new ATOM 0 HA ASP A 106 -0.033 -5.019 -26.084 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -0.474 -3.877 -28.223 1.00 0.00 H new ATOM 0 HB3 ASP A 106 1.009 -2.954 -28.078 1.00 0.00 H new ATOM 1654 N LYS A 107 2.664 -3.158 -25.654 1.00 0.00 N ATOM 1655 CA LYS A 107 4.004 -3.099 -25.090 1.00 0.00 C ATOM 1656 C LYS A 107 3.970 -3.744 -23.719 1.00 0.00 C ATOM 1657 O LYS A 107 4.650 -4.732 -23.471 1.00 0.00 O ATOM 1658 CB LYS A 107 4.474 -1.634 -25.065 1.00 0.00 C ATOM 1659 CG LYS A 107 5.873 -1.457 -24.474 1.00 0.00 C ATOM 1660 CD LYS A 107 7.001 -1.953 -25.379 1.00 0.00 C ATOM 1661 CE LYS A 107 8.073 -0.869 -25.577 1.00 0.00 C ATOM 1662 NZ LYS A 107 9.123 -1.277 -26.562 1.00 0.00 N1+ ATOM 0 H LYS A 107 2.309 -2.243 -25.931 1.00 0.00 H new ATOM 0 HA LYS A 107 4.726 -3.649 -25.694 1.00 0.00 H new ATOM 0 HB2 LYS A 107 4.464 -1.239 -26.081 1.00 0.00 H new ATOM 0 HB3 LYS A 107 3.765 -1.042 -24.486 1.00 0.00 H new ATOM 0 HG2 LYS A 107 6.033 -0.401 -24.258 1.00 0.00 H new ATOM 0 HG3 LYS A 107 5.924 -1.988 -23.524 1.00 0.00 H new ATOM 0 HD2 LYS A 107 7.456 -2.843 -24.943 1.00 0.00 H new ATOM 0 HD3 LYS A 107 6.593 -2.245 -26.346 1.00 0.00 H new ATOM 0 HE2 LYS A 107 7.597 0.051 -25.918 1.00 0.00 H new ATOM 0 HE3 LYS A 107 8.544 -0.648 -24.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 9.957 -0.665 -26.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 9.395 -2.266 -26.390 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 8.748 -1.184 -27.528 1.00 0.00 H new ATOM 1676 N LEU A 108 3.175 -3.197 -22.813 1.00 0.00 N ATOM 1677 CA LEU A 108 3.233 -3.590 -21.416 1.00 0.00 C ATOM 1678 C LEU A 108 2.546 -4.932 -21.200 1.00 0.00 C ATOM 1679 O LEU A 108 2.919 -5.638 -20.268 1.00 0.00 O ATOM 1680 CB LEU A 108 2.742 -2.454 -20.508 1.00 0.00 C ATOM 1681 CG LEU A 108 3.468 -1.118 -20.775 1.00 0.00 C ATOM 1682 CD1 LEU A 108 2.922 -0.055 -19.824 1.00 0.00 C ATOM 1683 CD2 LEU A 108 4.999 -1.203 -20.695 1.00 0.00 C ATOM 0 H LEU A 108 2.481 -2.479 -23.021 1.00 0.00 H new ATOM 0 HA LEU A 108 4.270 -3.756 -21.124 1.00 0.00 H new ATOM 0 HB2 LEU A 108 1.671 -2.316 -20.654 1.00 0.00 H new ATOM 0 HB3 LEU A 108 2.887 -2.739 -19.466 1.00 0.00 H new ATOM 0 HG LEU A 108 3.261 -0.844 -21.809 1.00 0.00 H new ATOM 0 HD11 LEU A 108 3.430 0.892 -20.006 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.852 0.069 -19.992 1.00 0.00 H new ATOM 0 HD13 LEU A 108 3.094 -0.366 -18.794 1.00 0.00 H new ATOM 0 HD21 LEU A 108 5.429 -0.222 -20.895 1.00 0.00 H new ATOM 0 HD22 LEU A 108 5.294 -1.532 -19.698 1.00 0.00 H new ATOM 0 HD23 LEU A 108 5.363 -1.916 -21.435 1.00 0.00 H new ATOM 1695 N SER A 109 1.666 -5.373 -22.099 1.00 0.00 N ATOM 1696 CA SER A 109 1.149 -6.737 -22.067 1.00 0.00 C ATOM 1697 C SER A 109 2.295 -7.752 -22.232 1.00 0.00 C ATOM 1698 O SER A 109 2.237 -8.827 -21.633 1.00 0.00 O ATOM 1699 CB SER A 109 0.061 -6.893 -23.145 1.00 0.00 C ATOM 1700 OG SER A 109 -0.621 -8.133 -23.040 1.00 0.00 O ATOM 0 H SER A 109 1.297 -4.802 -22.859 1.00 0.00 H new ATOM 0 HA SER A 109 0.691 -6.941 -21.099 1.00 0.00 H new ATOM 0 HB2 SER A 109 -0.656 -6.077 -23.056 1.00 0.00 H new ATOM 0 HB3 SER A 109 0.515 -6.812 -24.132 1.00 0.00 H new ATOM 0 HG SER A 109 -1.304 -8.191 -23.741 1.00 0.00 H new ATOM 1706 N THR A 110 3.389 -7.412 -22.934 1.00 0.00 N ATOM 1707 CA THR A 110 4.513 -8.334 -23.107 1.00 0.00 C ATOM 1708 C THR A 110 5.341 -8.396 -21.808 1.00 0.00 C ATOM 1709 O THR A 110 6.037 -9.378 -21.550 1.00 0.00 O ATOM 1710 CB THR A 110 5.297 -7.932 -24.383 1.00 0.00 C ATOM 1711 OG1 THR A 110 5.568 -9.086 -25.165 1.00 0.00 O ATOM 1712 CG2 THR A 110 6.612 -7.186 -24.123 1.00 0.00 C ATOM 0 H THR A 110 3.514 -6.507 -23.388 1.00 0.00 H new ATOM 0 HA THR A 110 4.181 -9.359 -23.273 1.00 0.00 H new ATOM 0 HB THR A 110 4.649 -7.232 -24.911 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.062 -8.827 -25.971 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.089 -6.947 -25.074 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.406 -6.265 -23.578 1.00 0.00 H new ATOM 0 HG23 THR A 110 7.277 -7.816 -23.532 1.00 0.00 H new ATOM 1720 N LYS A 111 5.244 -7.361 -20.961 1.00 0.00 N ATOM 1721 CA LYS A 111 5.964 -7.219 -19.704 1.00 0.00 C ATOM 1722 C LYS A 111 5.254 -7.922 -18.539 1.00 0.00 C ATOM 1723 O LYS A 111 5.723 -7.824 -17.410 1.00 0.00 O ATOM 1724 CB LYS A 111 6.190 -5.720 -19.419 1.00 0.00 C ATOM 1725 CG LYS A 111 6.906 -4.945 -20.534 1.00 0.00 C ATOM 1726 CD LYS A 111 8.318 -5.475 -20.820 1.00 0.00 C ATOM 1727 CE LYS A 111 9.245 -5.521 -19.588 1.00 0.00 C ATOM 1728 NZ LYS A 111 10.496 -6.304 -19.830 1.00 0.00 N1+ ATOM 0 H LYS A 111 4.631 -6.568 -21.150 1.00 0.00 H new ATOM 0 HA LYS A 111 6.930 -7.715 -19.800 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.223 -5.251 -19.235 1.00 0.00 H new ATOM 0 HB3 LYS A 111 6.770 -5.624 -18.501 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.312 -4.999 -21.446 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.968 -3.893 -20.256 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.238 -6.479 -21.237 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.780 -4.849 -21.583 1.00 0.00 H new ATOM 0 HE2 LYS A 111 9.509 -4.503 -19.300 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.705 -5.959 -18.749 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 11.072 -6.315 -18.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.250 -7.279 -20.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 11.038 -5.863 -20.600 1.00 0.00 H new ATOM 1742 N GLY A 112 4.135 -8.602 -18.796 1.00 0.00 N ATOM 1743 CA GLY A 112 3.465 -9.444 -17.807 1.00 0.00 C ATOM 1744 C GLY A 112 2.844 -8.622 -16.677 1.00 0.00 C ATOM 1745 O GLY A 112 2.915 -9.028 -15.517 1.00 0.00 O ATOM 0 H GLY A 112 3.667 -8.583 -19.702 1.00 0.00 H new ATOM 0 HA2 GLY A 112 2.688 -10.030 -18.298 1.00 0.00 H new ATOM 0 HA3 GLY A 112 4.181 -10.151 -17.389 1.00 0.00 H new ATOM 1749 N VAL A 113 2.306 -7.440 -16.987 1.00 0.00 N ATOM 1750 CA VAL A 113 1.695 -6.548 -16.014 1.00 0.00 C ATOM 1751 C VAL A 113 0.216 -6.914 -15.819 1.00 0.00 C ATOM 1752 O VAL A 113 -0.366 -7.676 -16.598 1.00 0.00 O ATOM 1753 CB VAL A 113 1.943 -5.066 -16.376 1.00 0.00 C ATOM 1754 CG1 VAL A 113 3.376 -4.837 -16.876 1.00 0.00 C ATOM 1755 CG2 VAL A 113 0.949 -4.504 -17.398 1.00 0.00 C ATOM 0 H VAL A 113 2.285 -7.075 -17.939 1.00 0.00 H new ATOM 0 HA VAL A 113 2.173 -6.682 -15.044 1.00 0.00 H new ATOM 0 HB VAL A 113 1.790 -4.522 -15.444 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.512 -3.784 -17.121 1.00 0.00 H new ATOM 0 HG12 VAL A 113 4.083 -5.123 -16.097 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.552 -5.442 -17.766 1.00 0.00 H new ATOM 0 HG21 VAL A 113 1.187 -3.460 -17.601 1.00 0.00 H new ATOM 0 HG22 VAL A 113 1.014 -5.078 -18.322 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -0.063 -4.574 -16.998 1.00 0.00 H new ATOM 1765 N LYS A 114 -0.412 -6.335 -14.800 1.00 0.00 N ATOM 1766 CA LYS A 114 -1.822 -6.356 -14.528 1.00 0.00 C ATOM 1767 C LYS A 114 -2.314 -4.975 -14.934 1.00 0.00 C ATOM 1768 O LYS A 114 -1.657 -4.001 -14.576 1.00 0.00 O ATOM 1769 CB LYS A 114 -1.912 -6.676 -13.040 1.00 0.00 C ATOM 1770 CG LYS A 114 -3.279 -6.270 -12.530 1.00 0.00 C ATOM 1771 CD LYS A 114 -3.595 -6.939 -11.201 1.00 0.00 C ATOM 1772 CE LYS A 114 -3.687 -8.463 -11.403 1.00 0.00 C ATOM 1773 NZ LYS A 114 -4.638 -9.127 -10.467 1.00 0.00 N1+ ATOM 0 H LYS A 114 0.102 -5.802 -14.098 1.00 0.00 H new ATOM 0 HA LYS A 114 -2.435 -7.084 -15.059 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -1.749 -7.741 -12.873 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -1.133 -6.145 -12.493 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -3.319 -5.187 -12.413 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -4.038 -6.539 -13.264 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -2.821 -6.704 -10.470 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -4.535 -6.557 -10.804 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -3.995 -8.668 -12.428 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -2.697 -8.900 -11.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -4.530 -10.159 -10.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -4.436 -8.823 -9.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -5.612 -8.863 -10.717 1.00 0.00 H new ATOM 1787 N PHE A 115 -3.441 -4.851 -15.625 1.00 0.00 N ATOM 1788 CA PHE A 115 -3.987 -3.565 -16.003 1.00 0.00 C ATOM 1789 C PHE A 115 -5.217 -3.234 -15.162 1.00 0.00 C ATOM 1790 O PHE A 115 -5.968 -4.137 -14.792 1.00 0.00 O ATOM 1791 CB PHE A 115 -4.257 -3.509 -17.507 1.00 0.00 C ATOM 1792 CG PHE A 115 -3.006 -3.566 -18.366 1.00 0.00 C ATOM 1793 CD1 PHE A 115 -2.202 -2.417 -18.522 1.00 0.00 C ATOM 1794 CD2 PHE A 115 -2.701 -4.733 -19.093 1.00 0.00 C ATOM 1795 CE1 PHE A 115 -1.139 -2.420 -19.445 1.00 0.00 C ATOM 1796 CE2 PHE A 115 -1.638 -4.734 -20.015 1.00 0.00 C ATOM 1797 CZ PHE A 115 -0.877 -3.570 -20.208 1.00 0.00 C ATOM 0 H PHE A 115 -3.999 -5.646 -15.937 1.00 0.00 H new ATOM 0 HA PHE A 115 -3.249 -2.791 -15.794 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -4.909 -4.339 -17.779 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -4.798 -2.591 -17.734 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -2.402 -1.534 -17.933 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -3.284 -5.629 -18.942 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.526 -1.539 -19.566 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -1.408 -5.629 -20.574 1.00 0.00 H new ATOM 0 HZ PHE A 115 -0.088 -3.559 -20.945 1.00 0.00 H new ATOM 1807 N VAL A 116 -5.427 -1.946 -14.869 1.00 0.00 N ATOM 1808 CA VAL A 116 -6.656 -1.441 -14.269 1.00 0.00 C ATOM 1809 C VAL A 116 -7.152 -0.250 -15.090 1.00 0.00 C ATOM 1810 O VAL A 116 -6.468 0.181 -16.024 1.00 0.00 O ATOM 1811 CB VAL A 116 -6.468 -1.106 -12.774 1.00 0.00 C ATOM 1812 CG1 VAL A 116 -5.973 -2.321 -11.984 1.00 0.00 C ATOM 1813 CG2 VAL A 116 -5.563 0.102 -12.515 1.00 0.00 C ATOM 0 H VAL A 116 -4.735 -1.218 -15.047 1.00 0.00 H new ATOM 0 HA VAL A 116 -7.421 -2.217 -14.293 1.00 0.00 H new ATOM 0 HB VAL A 116 -7.460 -0.828 -12.419 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -5.852 -2.049 -10.936 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -6.699 -3.130 -12.067 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -5.015 -2.651 -12.386 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -5.482 0.272 -11.441 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -4.573 -0.090 -12.928 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -5.990 0.985 -12.991 1.00 0.00 H new ATOM 1823 N GLY A 117 -8.293 0.333 -14.724 1.00 0.00 N ATOM 1824 CA GLY A 117 -8.749 1.551 -15.339 1.00 0.00 C ATOM 1825 C GLY A 117 -9.336 1.356 -16.731 1.00 0.00 C ATOM 1826 O GLY A 117 -9.112 2.205 -17.592 1.00 0.00 O ATOM 0 H GLY A 117 -8.912 -0.031 -14.000 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -9.502 2.010 -14.699 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -7.915 2.250 -15.402 1.00 0.00 H new ATOM 1830 N TYR A 118 -10.090 0.287 -16.980 1.00 0.00 N ATOM 1831 CA TYR A 118 -10.840 0.163 -18.226 1.00 0.00 C ATOM 1832 C TYR A 118 -12.121 0.998 -18.125 1.00 0.00 C ATOM 1833 O TYR A 118 -12.635 1.227 -17.031 1.00 0.00 O ATOM 1834 CB TYR A 118 -11.126 -1.316 -18.542 1.00 0.00 C ATOM 1835 CG TYR A 118 -9.928 -2.216 -18.833 1.00 0.00 C ATOM 1836 CD1 TYR A 118 -8.682 -1.690 -19.234 1.00 0.00 C ATOM 1837 CD2 TYR A 118 -10.085 -3.615 -18.748 1.00 0.00 C ATOM 1838 CE1 TYR A 118 -7.620 -2.546 -19.567 1.00 0.00 C ATOM 1839 CE2 TYR A 118 -9.026 -4.479 -19.086 1.00 0.00 C ATOM 1840 CZ TYR A 118 -7.787 -3.945 -19.505 1.00 0.00 C ATOM 1841 OH TYR A 118 -6.753 -4.761 -19.859 1.00 0.00 O ATOM 0 H TYR A 118 -10.197 -0.500 -16.340 1.00 0.00 H new ATOM 0 HA TYR A 118 -10.249 0.548 -19.057 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -11.670 -1.742 -17.699 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -11.793 -1.354 -19.403 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -8.544 -0.620 -19.285 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -11.028 -4.028 -18.420 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -6.671 -2.131 -19.872 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -9.161 -5.549 -19.025 1.00 0.00 H new ATOM 0 HH TYR A 118 -7.026 -5.697 -19.761 1.00 0.00 H new ATOM 1851 N TRP A 119 -12.640 1.439 -19.267 1.00 0.00 N ATOM 1852 CA TRP A 119 -13.944 2.100 -19.395 1.00 0.00 C ATOM 1853 C TRP A 119 -14.713 1.442 -20.530 1.00 0.00 C ATOM 1854 O TRP A 119 -14.065 1.043 -21.494 1.00 0.00 O ATOM 1855 CB TRP A 119 -13.801 3.568 -19.769 1.00 0.00 C ATOM 1856 CG TRP A 119 -13.470 4.525 -18.684 1.00 0.00 C ATOM 1857 CD1 TRP A 119 -12.650 5.566 -18.889 1.00 0.00 C ATOM 1858 CD2 TRP A 119 -13.984 4.664 -17.317 1.00 0.00 C ATOM 1859 NE1 TRP A 119 -12.602 6.333 -17.752 1.00 0.00 N ATOM 1860 CE2 TRP A 119 -13.421 5.849 -16.761 1.00 0.00 C ATOM 1861 CE3 TRP A 119 -14.886 3.956 -16.493 1.00 0.00 C ATOM 1862 CZ2 TRP A 119 -13.731 6.311 -15.474 1.00 0.00 C ATOM 1863 CZ3 TRP A 119 -15.189 4.393 -15.189 1.00 0.00 C ATOM 1864 CH2 TRP A 119 -14.615 5.567 -14.677 1.00 0.00 C ATOM 0 H TRP A 119 -12.154 1.346 -20.159 1.00 0.00 H new ATOM 0 HA TRP A 119 -14.451 2.013 -18.434 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -13.028 3.646 -20.533 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -14.736 3.890 -20.228 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -12.113 5.769 -19.804 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -12.024 7.168 -17.654 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -15.354 3.059 -16.871 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -13.296 7.226 -15.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -15.869 3.819 -14.577 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -14.852 5.896 -13.676 1.00 0.00 H new ATOM 1875 N PRO A 120 -16.052 1.389 -20.508 1.00 0.00 N ATOM 1876 CA PRO A 120 -16.812 0.975 -21.672 1.00 0.00 C ATOM 1877 C PRO A 120 -16.737 2.056 -22.767 1.00 0.00 C ATOM 1878 O PRO A 120 -16.809 3.255 -22.493 1.00 0.00 O ATOM 1879 CB PRO A 120 -18.226 0.717 -21.156 1.00 0.00 C ATOM 1880 CG PRO A 120 -18.357 1.705 -19.995 1.00 0.00 C ATOM 1881 CD PRO A 120 -16.941 1.779 -19.423 1.00 0.00 C ATOM 0 HA PRO A 120 -16.423 0.074 -22.145 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -18.976 0.898 -21.926 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -18.352 -0.314 -20.825 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -18.703 2.681 -20.336 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -19.072 1.356 -19.250 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -16.713 2.786 -19.074 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -16.830 1.112 -18.568 1.00 0.00 H new ATOM 1889 N THR A 121 -16.617 1.622 -24.021 1.00 0.00 N ATOM 1890 CA THR A 121 -16.559 2.445 -25.219 1.00 0.00 C ATOM 1891 C THR A 121 -17.925 3.021 -25.635 1.00 0.00 C ATOM 1892 O THR A 121 -18.003 3.794 -26.594 1.00 0.00 O ATOM 1893 CB THR A 121 -15.912 1.628 -26.355 1.00 0.00 C ATOM 1894 OG1 THR A 121 -16.711 0.498 -26.652 1.00 0.00 O ATOM 1895 CG2 THR A 121 -14.505 1.122 -26.018 1.00 0.00 C ATOM 0 H THR A 121 -16.554 0.627 -24.236 1.00 0.00 H new ATOM 0 HA THR A 121 -15.945 3.318 -24.997 1.00 0.00 H new ATOM 0 HB THR A 121 -15.837 2.308 -27.204 1.00 0.00 H new ATOM 0 HG1 THR A 121 -16.190 -0.140 -27.183 1.00 0.00 H new ATOM 0 HG21 THR A 121 -14.110 0.555 -26.861 1.00 0.00 H new ATOM 0 HG22 THR A 121 -13.852 1.971 -25.814 1.00 0.00 H new ATOM 0 HG23 THR A 121 -14.550 0.479 -25.139 1.00 0.00 H new ATOM 1946 N GLU A 125 -17.528 7.844 -30.257 1.00 0.00 N ATOM 1947 CA GLU A 125 -17.243 7.688 -31.660 1.00 0.00 C ATOM 1948 C GLU A 125 -15.713 7.681 -31.764 1.00 0.00 C ATOM 1949 O GLU A 125 -15.062 8.558 -31.192 1.00 0.00 O ATOM 1950 CB GLU A 125 -17.948 8.820 -32.426 1.00 0.00 C ATOM 1951 CG GLU A 125 -17.524 10.247 -32.037 1.00 0.00 C ATOM 1952 CD GLU A 125 -18.407 11.302 -32.729 1.00 0.00 C ATOM 1953 OE1 GLU A 125 -18.202 11.573 -33.937 1.00 0.00 O ATOM 1954 OE2 GLU A 125 -19.303 11.878 -32.065 1.00 0.00 O ATOM 0 HA GLU A 125 -17.617 6.767 -32.108 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.765 8.683 -33.492 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -19.023 8.724 -32.273 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.591 10.366 -30.956 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -16.481 10.406 -32.311 1.00 0.00 H new ATOM 1961 N PHE A 126 -15.123 6.658 -32.389 1.00 0.00 N ATOM 1962 CA PHE A 126 -13.669 6.498 -32.448 1.00 0.00 C ATOM 1963 C PHE A 126 -13.321 5.526 -33.574 1.00 0.00 C ATOM 1964 O PHE A 126 -12.659 5.911 -34.526 1.00 0.00 O ATOM 1965 CB PHE A 126 -13.088 6.042 -31.089 1.00 0.00 C ATOM 1966 CG PHE A 126 -13.538 4.687 -30.559 1.00 0.00 C ATOM 1967 CD1 PHE A 126 -14.851 4.506 -30.089 1.00 0.00 C ATOM 1968 CD2 PHE A 126 -12.662 3.585 -30.597 1.00 0.00 C ATOM 1969 CE1 PHE A 126 -15.295 3.235 -29.689 1.00 0.00 C ATOM 1970 CE2 PHE A 126 -13.103 2.315 -30.191 1.00 0.00 C ATOM 1971 CZ PHE A 126 -14.422 2.134 -29.744 1.00 0.00 C ATOM 0 H PHE A 126 -15.639 5.920 -32.867 1.00 0.00 H new ATOM 0 HA PHE A 126 -13.211 7.464 -32.662 1.00 0.00 H new ATOM 0 HB2 PHE A 126 -12.001 6.028 -31.174 1.00 0.00 H new ATOM 0 HB3 PHE A 126 -13.339 6.797 -30.344 1.00 0.00 H new ATOM 0 HD1 PHE A 126 -15.523 5.350 -30.035 1.00 0.00 H new ATOM 0 HD2 PHE A 126 -11.646 3.717 -30.940 1.00 0.00 H new ATOM 0 HE1 PHE A 126 -16.308 3.103 -29.339 1.00 0.00 H new ATOM 0 HE2 PHE A 126 -12.425 1.475 -30.223 1.00 0.00 H new ATOM 0 HZ PHE A 126 -14.764 1.154 -29.444 1.00 0.00 H new ATOM 1981 N THR A 127 -13.815 4.289 -33.478 1.00 0.00 N ATOM 1982 CA THR A 127 -13.632 3.166 -34.398 1.00 0.00 C ATOM 1983 C THR A 127 -12.151 2.784 -34.647 1.00 0.00 C ATOM 1984 O THR A 127 -11.855 1.919 -35.480 1.00 0.00 O ATOM 1985 CB THR A 127 -14.551 3.349 -35.627 1.00 0.00 C ATOM 1986 OG1 THR A 127 -14.824 2.115 -36.278 1.00 0.00 O ATOM 1987 CG2 THR A 127 -14.062 4.397 -36.630 1.00 0.00 C ATOM 0 H THR A 127 -14.403 4.026 -32.687 1.00 0.00 H new ATOM 0 HA THR A 127 -13.972 2.244 -33.926 1.00 0.00 H new ATOM 0 HB THR A 127 -15.483 3.738 -35.217 1.00 0.00 H new ATOM 0 HG1 THR A 127 -14.009 1.572 -36.305 1.00 0.00 H new ATOM 0 HG21 THR A 127 -14.765 4.461 -37.461 1.00 0.00 H new ATOM 0 HG22 THR A 127 -13.992 5.367 -36.138 1.00 0.00 H new ATOM 0 HG23 THR A 127 -13.080 4.110 -37.007 1.00 0.00 H new ATOM 1995 N SER A 128 -11.211 3.352 -33.886 1.00 0.00 N ATOM 1996 CA SER A 128 -9.823 2.906 -33.878 1.00 0.00 C ATOM 1997 C SER A 128 -9.755 1.487 -33.272 1.00 0.00 C ATOM 1998 O SER A 128 -10.395 1.232 -32.249 1.00 0.00 O ATOM 1999 CB SER A 128 -8.924 3.920 -33.149 1.00 0.00 C ATOM 2000 OG SER A 128 -9.458 4.322 -31.900 1.00 0.00 O ATOM 0 H SER A 128 -11.396 4.135 -33.259 1.00 0.00 H new ATOM 0 HA SER A 128 -9.440 2.851 -34.897 1.00 0.00 H new ATOM 0 HB2 SER A 128 -7.938 3.481 -32.994 1.00 0.00 H new ATOM 0 HB3 SER A 128 -8.786 4.798 -33.781 1.00 0.00 H new ATOM 0 HG SER A 128 -8.795 4.860 -31.419 1.00 0.00 H new ATOM 2006 N PRO A 129 -8.990 0.543 -33.858 1.00 0.00 N ATOM 2007 CA PRO A 129 -8.977 -0.851 -33.405 1.00 0.00 C ATOM 2008 C PRO A 129 -7.989 -1.118 -32.256 1.00 0.00 C ATOM 2009 O PRO A 129 -8.031 -2.181 -31.634 1.00 0.00 O ATOM 2010 CB PRO A 129 -8.615 -1.654 -34.659 1.00 0.00 C ATOM 2011 CG PRO A 129 -7.699 -0.707 -35.433 1.00 0.00 C ATOM 2012 CD PRO A 129 -8.309 0.665 -35.143 1.00 0.00 C ATOM 0 HA PRO A 129 -9.942 -1.132 -32.983 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -8.109 -2.586 -34.407 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -9.501 -1.918 -35.237 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -6.667 -0.772 -35.089 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -7.694 -0.930 -36.500 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -7.537 1.434 -35.103 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -9.008 0.955 -35.928 1.00 0.00 H new ATOM 2020 N LYS A 130 -7.066 -0.184 -31.982 1.00 0.00 N ATOM 2021 CA LYS A 130 -5.953 -0.383 -31.057 1.00 0.00 C ATOM 2022 C LYS A 130 -6.324 -0.206 -29.578 1.00 0.00 C ATOM 2023 O LYS A 130 -5.932 -1.055 -28.781 1.00 0.00 O ATOM 2024 CB LYS A 130 -4.739 0.483 -31.452 1.00 0.00 C ATOM 2025 CG LYS A 130 -4.069 0.062 -32.767 1.00 0.00 C ATOM 2026 CD LYS A 130 -3.393 -1.318 -32.709 1.00 0.00 C ATOM 2027 CE LYS A 130 -2.423 -1.448 -33.893 1.00 0.00 C ATOM 2028 NZ LYS A 130 -1.813 -2.803 -33.993 1.00 0.00 N1+ ATOM 0 H LYS A 130 -7.077 0.743 -32.406 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.673 -1.432 -31.153 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -5.059 1.521 -31.536 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -4.001 0.441 -30.651 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -4.818 0.056 -33.559 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -3.324 0.809 -33.039 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.856 -1.435 -31.768 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -4.144 -2.107 -32.748 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -2.954 -1.224 -34.818 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -1.632 -0.705 -33.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -1.168 -2.834 -34.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.282 -3.010 -33.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -2.563 -3.513 -34.118 1.00 0.00 H new ATOM 2042 N PRO A 131 -7.023 0.864 -29.142 1.00 0.00 N ATOM 2043 CA PRO A 131 -7.170 1.166 -27.717 1.00 0.00 C ATOM 2044 C PRO A 131 -8.330 0.415 -27.065 1.00 0.00 C ATOM 2045 O PRO A 131 -8.996 0.966 -26.195 1.00 0.00 O ATOM 2046 CB PRO A 131 -7.340 2.686 -27.658 1.00 0.00 C ATOM 2047 CG PRO A 131 -8.152 2.965 -28.919 1.00 0.00 C ATOM 2048 CD PRO A 131 -7.562 1.980 -29.924 1.00 0.00 C ATOM 0 HA PRO A 131 -6.304 0.834 -27.145 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -7.865 3.003 -26.757 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -6.381 3.204 -27.667 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -9.217 2.793 -28.761 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -8.042 3.997 -29.251 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -8.325 1.633 -30.621 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -6.779 2.453 -30.517 1.00 0.00 H new ATOM 2056 N VAL A 132 -8.586 -0.827 -27.446 1.00 0.00 N ATOM 2057 CA VAL A 132 -9.792 -1.553 -27.097 1.00 0.00 C ATOM 2058 C VAL A 132 -9.431 -2.993 -26.716 1.00 0.00 C ATOM 2059 O VAL A 132 -8.485 -3.550 -27.279 1.00 0.00 O ATOM 2060 CB VAL A 132 -10.834 -1.483 -28.240 1.00 0.00 C ATOM 2061 CG1 VAL A 132 -12.172 -0.975 -27.691 1.00 0.00 C ATOM 2062 CG2 VAL A 132 -10.464 -0.596 -29.450 1.00 0.00 C ATOM 0 H VAL A 132 -7.942 -1.370 -28.022 1.00 0.00 H new ATOM 0 HA VAL A 132 -10.260 -1.086 -26.230 1.00 0.00 H new ATOM 0 HB VAL A 132 -10.881 -2.506 -28.613 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.902 -0.927 -28.499 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -12.530 -1.655 -26.918 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -12.037 0.019 -27.265 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -11.270 -0.627 -30.184 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -10.316 0.431 -29.116 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -9.545 -0.966 -29.905 1.00 0.00 H new ATOM 2072 N ILE A 133 -10.175 -3.594 -25.780 1.00 0.00 N ATOM 2073 CA ILE A 133 -10.058 -4.978 -25.357 1.00 0.00 C ATOM 2074 C ILE A 133 -11.403 -5.663 -25.500 1.00 0.00 C ATOM 2075 O ILE A 133 -12.380 -5.060 -25.950 1.00 0.00 O ATOM 2076 CB ILE A 133 -9.462 -5.153 -23.940 1.00 0.00 C ATOM 2077 CG1 ILE A 133 -10.364 -4.633 -22.805 1.00 0.00 C ATOM 2078 CG2 ILE A 133 -8.071 -4.537 -23.950 1.00 0.00 C ATOM 2079 CD1 ILE A 133 -10.162 -3.150 -22.530 1.00 0.00 C ATOM 0 H ILE A 133 -10.909 -3.096 -25.277 1.00 0.00 H new ATOM 0 HA ILE A 133 -9.335 -5.460 -26.015 1.00 0.00 H new ATOM 0 HB ILE A 133 -9.392 -6.216 -23.710 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -11.407 -4.812 -23.064 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -10.160 -5.198 -21.896 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -7.619 -4.643 -22.964 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -7.453 -5.047 -24.689 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -8.143 -3.480 -24.205 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -10.822 -2.837 -21.721 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -9.126 -2.971 -22.242 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -10.393 -2.579 -23.429 1.00 0.00 H new ATOM 2091 N ALA A 134 -11.464 -6.895 -25.005 1.00 0.00 N ATOM 2092 CA ALA A 134 -12.632 -7.738 -25.025 1.00 0.00 C ATOM 2093 C ALA A 134 -13.039 -7.928 -26.491 1.00 0.00 C ATOM 2094 O ALA A 134 -12.245 -8.441 -27.281 1.00 0.00 O ATOM 2095 CB ALA A 134 -13.667 -7.169 -24.039 1.00 0.00 C ATOM 0 H ALA A 134 -10.662 -7.343 -24.562 1.00 0.00 H new ATOM 0 HA ALA A 134 -12.477 -8.752 -24.657 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -14.558 -7.797 -24.043 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -13.241 -7.150 -23.036 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -13.936 -6.156 -24.338 1.00 0.00 H new ATOM 2101 N ASP A 135 -14.231 -7.462 -26.862 1.00 0.00 N ATOM 2102 CA ASP A 135 -14.740 -7.481 -28.227 1.00 0.00 C ATOM 2103 C ASP A 135 -14.696 -6.090 -28.877 1.00 0.00 C ATOM 2104 O ASP A 135 -15.247 -5.876 -29.957 1.00 0.00 O ATOM 2105 CB ASP A 135 -16.152 -8.057 -28.214 1.00 0.00 C ATOM 2106 CG ASP A 135 -16.684 -8.387 -29.622 1.00 0.00 C ATOM 2107 OD1 ASP A 135 -16.008 -9.133 -30.372 1.00 0.00 O ATOM 2108 OD2 ASP A 135 -17.813 -7.954 -29.959 1.00 0.00 O ATOM 0 H ASP A 135 -14.887 -7.049 -26.199 1.00 0.00 H new ATOM 0 HA ASP A 135 -14.098 -8.115 -28.839 1.00 0.00 H new ATOM 0 HB2 ASP A 135 -16.163 -8.962 -27.607 1.00 0.00 H new ATOM 0 HB3 ASP A 135 -16.824 -7.344 -27.736 1.00 0.00 H new ATOM 2113 N GLY A 136 -14.078 -5.118 -28.197 1.00 0.00 N ATOM 2114 CA GLY A 136 -14.068 -3.714 -28.587 1.00 0.00 C ATOM 2115 C GLY A 136 -15.088 -2.878 -27.815 1.00 0.00 C ATOM 2116 O GLY A 136 -15.470 -1.799 -28.265 1.00 0.00 O ATOM 0 H GLY A 136 -13.558 -5.297 -27.338 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -13.071 -3.304 -28.425 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -14.275 -3.637 -29.654 1.00 0.00 H new ATOM 2120 N GLN A 137 -15.537 -3.376 -26.656 1.00 0.00 N ATOM 2121 CA GLN A 137 -16.620 -2.801 -25.866 1.00 0.00 C ATOM 2122 C GLN A 137 -16.073 -1.986 -24.701 1.00 0.00 C ATOM 2123 O GLN A 137 -16.804 -1.215 -24.088 1.00 0.00 O ATOM 2124 CB GLN A 137 -17.560 -3.900 -25.343 1.00 0.00 C ATOM 2125 CG GLN A 137 -17.664 -5.103 -26.277 1.00 0.00 C ATOM 2126 CD GLN A 137 -18.584 -6.182 -25.710 1.00 0.00 C ATOM 2127 OE1 GLN A 137 -19.734 -6.339 -26.116 1.00 0.00 O ATOM 2128 NE2 GLN A 137 -18.078 -6.938 -24.744 1.00 0.00 N ATOM 0 H GLN A 137 -15.141 -4.216 -26.234 1.00 0.00 H new ATOM 0 HA GLN A 137 -17.187 -2.137 -26.518 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -17.207 -4.236 -24.368 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -18.554 -3.478 -25.194 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -18.039 -4.778 -27.248 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -16.671 -5.522 -26.443 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -17.121 -6.786 -24.426 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -18.646 -7.671 -24.319 1.00 0.00 H new ATOM 2137 N LEU A 138 -14.797 -2.197 -24.359 1.00 0.00 N ATOM 2138 CA LEU A 138 -14.090 -1.410 -23.342 1.00 0.00 C ATOM 2139 C LEU A 138 -12.720 -0.978 -23.848 1.00 0.00 C ATOM 2140 O LEU A 138 -12.082 -1.717 -24.595 1.00 0.00 O ATOM 2141 CB LEU A 138 -14.006 -2.065 -21.942 1.00 0.00 C ATOM 2142 CG LEU A 138 -14.076 -3.601 -21.834 1.00 0.00 C ATOM 2143 CD1 LEU A 138 -13.422 -4.092 -20.539 1.00 0.00 C ATOM 2144 CD2 LEU A 138 -15.534 -4.070 -21.808 1.00 0.00 C ATOM 0 H LEU A 138 -14.221 -2.924 -24.783 1.00 0.00 H new ATOM 0 HA LEU A 138 -14.708 -0.526 -23.184 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -13.070 -1.744 -21.484 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -14.814 -1.655 -21.337 1.00 0.00 H new ATOM 0 HG LEU A 138 -13.552 -4.005 -22.700 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -13.486 -5.179 -20.489 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -12.375 -3.789 -20.522 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -13.939 -3.658 -19.683 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -15.565 -5.157 -21.732 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -16.042 -3.631 -20.949 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -16.034 -3.756 -22.725 1.00 0.00 H new ATOM 2156 N PHE A 139 -12.286 0.218 -23.447 1.00 0.00 N ATOM 2157 CA PHE A 139 -11.000 0.789 -23.772 1.00 0.00 C ATOM 2158 C PHE A 139 -9.931 0.200 -22.868 1.00 0.00 C ATOM 2159 O PHE A 139 -10.196 -0.137 -21.714 1.00 0.00 O ATOM 2160 CB PHE A 139 -10.994 2.309 -23.569 1.00 0.00 C ATOM 2161 CG PHE A 139 -11.944 3.090 -24.443 1.00 0.00 C ATOM 2162 CD1 PHE A 139 -11.789 3.076 -25.843 1.00 0.00 C ATOM 2163 CD2 PHE A 139 -12.978 3.840 -23.856 1.00 0.00 C ATOM 2164 CE1 PHE A 139 -12.642 3.852 -26.645 1.00 0.00 C ATOM 2165 CE2 PHE A 139 -13.846 4.587 -24.664 1.00 0.00 C ATOM 2166 CZ PHE A 139 -13.663 4.620 -26.058 1.00 0.00 C ATOM 0 H PHE A 139 -12.853 0.832 -22.863 1.00 0.00 H new ATOM 0 HA PHE A 139 -10.799 0.560 -24.819 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -11.233 2.519 -22.526 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -9.983 2.676 -23.744 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -11.018 2.472 -26.298 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -13.103 3.841 -22.783 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -12.513 3.859 -27.717 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -14.658 5.139 -24.215 1.00 0.00 H new ATOM 0 HZ PHE A 139 -14.304 5.233 -26.675 1.00 0.00 H new ATOM 2176 N VAL A 140 -8.695 0.207 -23.357 1.00 0.00 N ATOM 2177 CA VAL A 140 -7.510 -0.212 -22.625 1.00 0.00 C ATOM 2178 C VAL A 140 -7.187 0.709 -21.433 1.00 0.00 C ATOM 2179 O VAL A 140 -6.322 0.365 -20.628 1.00 0.00 O ATOM 2180 CB VAL A 140 -6.313 -0.280 -23.596 1.00 0.00 C ATOM 2181 CG1 VAL A 140 -6.431 -1.393 -24.644 1.00 0.00 C ATOM 2182 CG2 VAL A 140 -6.050 1.064 -24.273 1.00 0.00 C ATOM 0 H VAL A 140 -8.486 0.516 -24.307 1.00 0.00 H new ATOM 0 HA VAL A 140 -7.710 -1.198 -22.205 1.00 0.00 H new ATOM 0 HB VAL A 140 -5.456 -0.529 -22.970 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -5.553 -1.379 -25.290 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -6.497 -2.359 -24.143 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -7.327 -1.234 -25.245 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -5.199 0.971 -24.948 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -6.931 1.365 -24.839 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -5.832 1.816 -23.515 1.00 0.00 H new ATOM 2192 N GLY A 141 -7.811 1.889 -21.320 1.00 0.00 N ATOM 2193 CA GLY A 141 -7.425 2.860 -20.304 1.00 0.00 C ATOM 2194 C GLY A 141 -8.375 4.045 -20.264 1.00 0.00 C ATOM 2195 O GLY A 141 -9.350 4.081 -21.020 1.00 0.00 O ATOM 0 H GLY A 141 -8.581 2.187 -21.919 1.00 0.00 H new ATOM 0 HA2 GLY A 141 -7.407 2.376 -19.327 1.00 0.00 H new ATOM 0 HA3 GLY A 141 -6.413 3.212 -20.504 1.00 0.00 H new ATOM 2199 N LEU A 142 -8.072 5.037 -19.420 1.00 0.00 N ATOM 2200 CA LEU A 142 -8.779 6.317 -19.406 1.00 0.00 C ATOM 2201 C LEU A 142 -8.552 6.992 -20.746 1.00 0.00 C ATOM 2202 O LEU A 142 -7.409 7.167 -21.164 1.00 0.00 O ATOM 2203 CB LEU A 142 -8.290 7.191 -18.241 1.00 0.00 C ATOM 2204 CG LEU A 142 -8.722 8.667 -18.183 1.00 0.00 C ATOM 2205 CD1 LEU A 142 -10.244 8.824 -18.128 1.00 0.00 C ATOM 2206 CD2 LEU A 142 -8.142 9.331 -16.936 1.00 0.00 C ATOM 0 H LEU A 142 -7.327 4.972 -18.726 1.00 0.00 H new ATOM 0 HA LEU A 142 -9.847 6.162 -19.255 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -8.615 6.717 -17.315 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -7.200 7.167 -18.247 1.00 0.00 H new ATOM 0 HG LEU A 142 -8.350 9.138 -19.093 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -10.499 9.883 -18.088 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -10.688 8.377 -19.017 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -10.629 8.324 -17.239 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -8.452 10.375 -16.902 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -8.505 8.816 -16.047 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -7.054 9.277 -16.968 1.00 0.00 H new ATOM 2218 N ALA A 143 -9.648 7.375 -21.389 1.00 0.00 N ATOM 2219 CA ALA A 143 -9.632 8.010 -22.697 1.00 0.00 C ATOM 2220 C ALA A 143 -10.098 9.449 -22.523 1.00 0.00 C ATOM 2221 O ALA A 143 -11.201 9.658 -22.015 1.00 0.00 O ATOM 2222 CB ALA A 143 -10.527 7.208 -23.656 1.00 0.00 C ATOM 0 H ALA A 143 -10.586 7.250 -21.009 1.00 0.00 H new ATOM 0 HA ALA A 143 -8.632 8.025 -23.131 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -10.520 7.678 -24.639 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -10.150 6.189 -23.739 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -11.546 7.188 -23.271 1.00 0.00 H new ATOM 2228 N LEU A 144 -9.263 10.421 -22.901 1.00 0.00 N ATOM 2229 CA LEU A 144 -9.541 11.845 -22.744 1.00 0.00 C ATOM 2230 C LEU A 144 -9.461 12.532 -24.102 1.00 0.00 C ATOM 2231 O LEU A 144 -8.762 12.068 -25.008 1.00 0.00 O ATOM 2232 CB LEU A 144 -8.544 12.492 -21.763 1.00 0.00 C ATOM 2233 CG LEU A 144 -8.558 11.917 -20.334 1.00 0.00 C ATOM 2234 CD1 LEU A 144 -7.651 12.714 -19.394 1.00 0.00 C ATOM 2235 CD2 LEU A 144 -9.974 11.875 -19.745 1.00 0.00 C ATOM 0 H LEU A 144 -8.358 10.233 -23.333 1.00 0.00 H new ATOM 0 HA LEU A 144 -10.545 11.964 -22.336 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -7.538 12.385 -22.170 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -8.754 13.560 -21.709 1.00 0.00 H new ATOM 0 HG LEU A 144 -8.180 10.898 -20.417 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -7.688 12.277 -18.396 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -6.627 12.685 -19.765 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -7.991 13.749 -19.350 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -9.937 11.463 -18.737 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -10.383 12.885 -19.709 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -10.610 11.248 -20.370 1.00 0.00 H new ATOM 2247 N ASP A 145 -10.150 13.663 -24.225 1.00 0.00 N ATOM 2248 CA ASP A 145 -10.102 14.518 -25.399 1.00 0.00 C ATOM 2249 C ASP A 145 -10.031 15.954 -24.935 1.00 0.00 C ATOM 2250 O ASP A 145 -10.923 16.436 -24.243 1.00 0.00 O ATOM 2251 CB ASP A 145 -11.280 14.275 -26.337 1.00 0.00 C ATOM 2252 CG ASP A 145 -11.716 15.543 -27.070 1.00 0.00 C ATOM 2253 OD1 ASP A 145 -10.897 16.236 -27.696 1.00 0.00 O ATOM 2254 OD2 ASP A 145 -12.937 15.799 -27.110 1.00 0.00 O ATOM 0 H ASP A 145 -10.769 14.015 -23.494 1.00 0.00 H new ATOM 0 HA ASP A 145 -9.214 14.280 -25.985 1.00 0.00 H new ATOM 0 HB2 ASP A 145 -11.008 13.513 -27.067 1.00 0.00 H new ATOM 0 HB3 ASP A 145 -12.121 13.883 -25.765 1.00 0.00 H new ATOM 2259 N GLU A 146 -8.962 16.620 -25.346 1.00 0.00 N ATOM 2260 CA GLU A 146 -8.620 17.957 -24.899 1.00 0.00 C ATOM 2261 C GLU A 146 -9.030 19.017 -25.928 1.00 0.00 C ATOM 2262 O GLU A 146 -8.751 20.201 -25.726 1.00 0.00 O ATOM 2263 CB GLU A 146 -7.114 18.035 -24.582 1.00 0.00 C ATOM 2264 CG GLU A 146 -6.666 17.147 -23.412 1.00 0.00 C ATOM 2265 CD GLU A 146 -7.344 17.486 -22.063 1.00 0.00 C ATOM 2266 OE1 GLU A 146 -7.690 18.668 -21.812 1.00 0.00 O1- ATOM 2267 OE2 GLU A 146 -7.486 16.567 -21.221 1.00 0.00 O ATOM 0 H GLU A 146 -8.295 16.235 -26.015 1.00 0.00 H new ATOM 0 HA GLU A 146 -9.179 18.169 -23.987 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.552 17.753 -25.472 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -6.855 19.070 -24.357 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.875 16.106 -23.660 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -5.586 17.236 -23.296 1.00 0.00 H new ATOM 2274 N THR A 147 -9.689 18.627 -27.024 1.00 0.00 N ATOM 2275 CA THR A 147 -10.094 19.533 -28.078 1.00 0.00 C ATOM 2276 C THR A 147 -11.594 19.828 -27.986 1.00 0.00 C ATOM 2277 O THR A 147 -11.993 20.957 -28.290 1.00 0.00 O ATOM 2278 CB THR A 147 -9.571 19.028 -29.446 1.00 0.00 C ATOM 2279 OG1 THR A 147 -8.937 20.076 -30.165 1.00 0.00 O ATOM 2280 CG2 THR A 147 -10.639 18.418 -30.350 1.00 0.00 C ATOM 0 H THR A 147 -9.955 17.657 -27.196 1.00 0.00 H new ATOM 0 HA THR A 147 -9.628 20.511 -27.956 1.00 0.00 H new ATOM 0 HB THR A 147 -8.867 18.237 -29.189 1.00 0.00 H new ATOM 0 HG1 THR A 147 -8.613 19.734 -31.024 1.00 0.00 H new ATOM 0 HG21 THR A 147 -10.182 18.093 -31.285 1.00 0.00 H new ATOM 0 HG22 THR A 147 -11.093 17.562 -29.851 1.00 0.00 H new ATOM 0 HG23 THR A 147 -11.406 19.163 -30.561 1.00 0.00 H new ATOM 2288 N ASN A 148 -12.420 18.886 -27.500 1.00 0.00 N ATOM 2289 CA ASN A 148 -13.862 19.118 -27.347 1.00 0.00 C ATOM 2290 C ASN A 148 -14.289 18.898 -25.909 1.00 0.00 C ATOM 2291 O ASN A 148 -15.013 19.712 -25.342 1.00 0.00 O ATOM 2292 CB ASN A 148 -14.721 18.236 -28.273 1.00 0.00 C ATOM 2293 CG ASN A 148 -14.058 17.958 -29.609 1.00 0.00 C ATOM 2294 OD1 ASN A 148 -14.051 18.797 -30.504 1.00 0.00 O ATOM 2295 ND2 ASN A 148 -13.440 16.800 -29.724 1.00 0.00 N ATOM 0 H ASN A 148 -12.112 17.959 -27.207 1.00 0.00 H new ATOM 0 HA ASN A 148 -14.031 20.156 -27.635 1.00 0.00 H new ATOM 0 HB2 ASN A 148 -14.930 17.290 -27.773 1.00 0.00 H new ATOM 0 HB3 ASN A 148 -15.680 18.725 -28.444 1.00 0.00 H new ATOM 0 HD21 ASN A 148 -12.933 16.575 -30.580 1.00 0.00 H new ATOM 0 HD22 ASN A 148 -13.469 16.128 -28.957 1.00 0.00 H new ATOM 2302 N GLN A 149 -13.835 17.793 -25.320 1.00 0.00 N ATOM 2303 CA GLN A 149 -14.270 17.322 -24.023 1.00 0.00 C ATOM 2304 C GLN A 149 -13.275 17.700 -22.935 1.00 0.00 C ATOM 2305 O GLN A 149 -13.237 17.044 -21.904 1.00 0.00 O ATOM 2306 CB GLN A 149 -14.499 15.813 -24.091 1.00 0.00 C ATOM 2307 CG GLN A 149 -15.649 15.414 -25.034 1.00 0.00 C ATOM 2308 CD GLN A 149 -15.931 13.922 -24.893 1.00 0.00 C ATOM 2309 OE1 GLN A 149 -14.878 13.131 -24.965 1.00 0.00 O flip ATOM 2310 NE2 GLN A 149 -17.054 13.480 -24.674 1.00 0.00 N flip ATOM 0 H GLN A 149 -13.135 17.189 -25.751 1.00 0.00 H new ATOM 0 HA GLN A 149 -15.210 17.806 -23.759 1.00 0.00 H new ATOM 0 HB2 GLN A 149 -13.581 15.328 -24.423 1.00 0.00 H new ATOM 0 HB3 GLN A 149 -14.713 15.439 -23.090 1.00 0.00 H new ATOM 0 HG2 GLN A 149 -16.544 15.988 -24.795 1.00 0.00 H new ATOM 0 HG3 GLN A 149 -15.385 15.649 -26.065 1.00 0.00 H new ATOM 0 HE21 GLN A 149 -17.851 14.115 -24.623 1.00 0.00 H new ATOM 0 HE22 GLN A 149 -17.191 12.478 -24.542 1.00 0.00 H new ATOM 2319 N TYR A 150 -12.474 18.742 -23.136 1.00 0.00 N ATOM 2320 CA TYR A 150 -11.454 19.175 -22.172 1.00 0.00 C ATOM 2321 C TYR A 150 -12.049 19.399 -20.771 1.00 0.00 C ATOM 2322 O TYR A 150 -11.376 19.192 -19.761 1.00 0.00 O ATOM 2323 CB TYR A 150 -10.773 20.459 -22.676 1.00 0.00 C ATOM 2324 CG TYR A 150 -11.717 21.541 -23.178 1.00 0.00 C ATOM 2325 CD1 TYR A 150 -12.432 22.339 -22.265 1.00 0.00 C ATOM 2326 CD2 TYR A 150 -11.908 21.729 -24.561 1.00 0.00 C ATOM 2327 CE1 TYR A 150 -13.361 23.291 -22.721 1.00 0.00 C ATOM 2328 CE2 TYR A 150 -12.823 22.691 -25.029 1.00 0.00 C ATOM 2329 CZ TYR A 150 -13.561 23.473 -24.110 1.00 0.00 C ATOM 2330 OH TYR A 150 -14.450 24.396 -24.579 1.00 0.00 O ATOM 0 H TYR A 150 -12.511 19.318 -23.977 1.00 0.00 H new ATOM 0 HA TYR A 150 -10.713 18.380 -22.087 1.00 0.00 H new ATOM 0 HB2 TYR A 150 -10.170 20.872 -21.867 1.00 0.00 H new ATOM 0 HB3 TYR A 150 -10.088 20.195 -23.482 1.00 0.00 H new ATOM 0 HD1 TYR A 150 -12.266 22.219 -21.205 1.00 0.00 H new ATOM 0 HD2 TYR A 150 -11.349 21.132 -25.266 1.00 0.00 H new ATOM 0 HE1 TYR A 150 -13.921 23.883 -22.012 1.00 0.00 H new ATOM 0 HE2 TYR A 150 -12.962 22.832 -26.091 1.00 0.00 H new ATOM 0 HH TYR A 150 -14.452 24.380 -25.559 1.00 0.00 H new ATOM 2340 N ASP A 151 -13.333 19.775 -20.702 1.00 0.00 N ATOM 2341 CA ASP A 151 -14.030 20.082 -19.448 1.00 0.00 C ATOM 2342 C ASP A 151 -14.431 18.799 -18.707 1.00 0.00 C ATOM 2343 O ASP A 151 -14.605 18.783 -17.489 1.00 0.00 O ATOM 2344 CB ASP A 151 -15.274 20.914 -19.774 1.00 0.00 C ATOM 2345 CG ASP A 151 -16.043 21.306 -18.500 1.00 0.00 C ATOM 2346 OD1 ASP A 151 -15.512 22.115 -17.702 1.00 0.00 O ATOM 2347 OD2 ASP A 151 -17.195 20.847 -18.318 1.00 0.00 O ATOM 0 H ASP A 151 -13.924 19.876 -21.527 1.00 0.00 H new ATOM 0 HA ASP A 151 -13.362 20.643 -18.795 1.00 0.00 H new ATOM 0 HB2 ASP A 151 -14.979 21.814 -20.313 1.00 0.00 H new ATOM 0 HB3 ASP A 151 -15.929 20.346 -20.435 1.00 0.00 H new ATOM 2352 N LEU A 152 -14.542 17.696 -19.451 1.00 0.00 N ATOM 2353 CA LEU A 152 -15.016 16.384 -19.000 1.00 0.00 C ATOM 2354 C LEU A 152 -13.862 15.477 -18.751 1.00 0.00 C ATOM 2355 O LEU A 152 -13.896 14.593 -17.911 1.00 0.00 O ATOM 2356 CB LEU A 152 -15.796 15.681 -20.114 1.00 0.00 C ATOM 2357 CG LEU A 152 -16.842 16.563 -20.768 1.00 0.00 C ATOM 2358 CD1 LEU A 152 -17.589 15.685 -21.765 1.00 0.00 C ATOM 2359 CD2 LEU A 152 -17.690 17.174 -19.652 1.00 0.00 C ATOM 0 H LEU A 152 -14.290 17.694 -20.439 1.00 0.00 H new ATOM 0 HA LEU A 152 -15.620 16.562 -18.110 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -15.096 15.336 -20.875 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -16.283 14.796 -19.704 1.00 0.00 H new ATOM 0 HG LEU A 152 -16.447 17.407 -21.333 1.00 0.00 H new ATOM 0 HD11 LEU A 152 -18.357 16.275 -22.265 1.00 0.00 H new ATOM 0 HD12 LEU A 152 -16.889 15.298 -22.505 1.00 0.00 H new ATOM 0 HD13 LEU A 152 -18.056 14.853 -21.238 1.00 0.00 H new ATOM 0 HD21 LEU A 152 -18.455 17.817 -20.087 1.00 0.00 H new ATOM 0 HD22 LEU A 152 -18.167 16.378 -19.080 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -17.053 17.764 -18.992 1.00 0.00 H new ATOM 2371 N SER A 153 -12.832 15.718 -19.528 1.00 0.00 N ATOM 2372 CA SER A 153 -11.549 15.115 -19.313 1.00 0.00 C ATOM 2373 C SER A 153 -11.083 15.431 -17.894 1.00 0.00 C ATOM 2374 O SER A 153 -10.411 14.599 -17.298 1.00 0.00 O ATOM 2375 CB SER A 153 -10.579 15.503 -20.430 1.00 0.00 C ATOM 2376 OG SER A 153 -11.082 14.997 -21.664 1.00 0.00 O ATOM 0 H SER A 153 -12.867 16.344 -20.332 1.00 0.00 H new ATOM 0 HA SER A 153 -11.604 14.028 -19.374 1.00 0.00 H new ATOM 0 HB2 SER A 153 -10.474 16.587 -20.480 1.00 0.00 H new ATOM 0 HB3 SER A 153 -9.588 15.095 -20.229 1.00 0.00 H new ATOM 0 HG SER A 153 -10.917 15.649 -22.377 1.00 0.00 H new ATOM 2382 N ASP A 154 -11.539 16.537 -17.290 1.00 0.00 N ATOM 2383 CA ASP A 154 -11.349 16.754 -15.871 1.00 0.00 C ATOM 2384 C ASP A 154 -12.223 15.796 -15.078 1.00 0.00 C ATOM 2385 O ASP A 154 -11.704 15.015 -14.281 1.00 0.00 O ATOM 2386 CB ASP A 154 -11.605 18.202 -15.456 1.00 0.00 C ATOM 2387 CG ASP A 154 -11.384 18.337 -13.944 1.00 0.00 C ATOM 2388 OD1 ASP A 154 -10.201 18.342 -13.528 1.00 0.00 O ATOM 2389 OD2 ASP A 154 -12.375 18.431 -13.183 1.00 0.00 O ATOM 0 H ASP A 154 -12.039 17.286 -17.770 1.00 0.00 H new ATOM 0 HA ASP A 154 -10.301 16.553 -15.647 1.00 0.00 H new ATOM 0 HB2 ASP A 154 -10.935 18.872 -15.995 1.00 0.00 H new ATOM 0 HB3 ASP A 154 -12.623 18.493 -15.715 1.00 0.00 H new ATOM 2394 N GLU A 155 -13.533 15.782 -15.334 1.00 0.00 N ATOM 2395 CA GLU A 155 -14.475 15.041 -14.495 1.00 0.00 C ATOM 2396 C GLU A 155 -14.191 13.527 -14.516 1.00 0.00 C ATOM 2397 O GLU A 155 -14.357 12.817 -13.525 1.00 0.00 O ATOM 2398 CB GLU A 155 -15.921 15.398 -14.888 1.00 0.00 C ATOM 2399 CG GLU A 155 -16.597 14.538 -15.971 1.00 0.00 C ATOM 2400 CD GLU A 155 -18.125 14.735 -15.964 1.00 0.00 C ATOM 2401 OE1 GLU A 155 -18.607 15.860 -16.243 1.00 0.00 O ATOM 2402 OE2 GLU A 155 -18.863 13.759 -15.681 1.00 0.00 O ATOM 0 H GLU A 155 -13.965 16.275 -16.115 1.00 0.00 H new ATOM 0 HA GLU A 155 -14.339 15.343 -13.456 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -16.535 15.350 -13.989 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -15.931 16.434 -15.226 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -16.198 14.802 -16.950 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -16.362 13.487 -15.804 1.00 0.00 H new ATOM 2409 N ARG A 156 -13.708 13.043 -15.658 1.00 0.00 N ATOM 2410 CA ARG A 156 -13.544 11.632 -15.974 1.00 0.00 C ATOM 2411 C ARG A 156 -12.232 11.132 -15.409 1.00 0.00 C ATOM 2412 O ARG A 156 -12.134 9.946 -15.108 1.00 0.00 O ATOM 2413 CB ARG A 156 -13.677 11.474 -17.495 1.00 0.00 C ATOM 2414 CG ARG A 156 -13.778 10.009 -17.934 1.00 0.00 C ATOM 2415 CD ARG A 156 -13.906 9.936 -19.460 1.00 0.00 C ATOM 2416 NE ARG A 156 -15.272 10.279 -19.914 1.00 0.00 N ATOM 2417 CZ ARG A 156 -16.341 9.468 -19.972 1.00 0.00 C ATOM 2418 NH1 ARG A 156 -16.260 8.195 -19.589 1.00 0.00 N ATOM 2419 NH2 ARG A 156 -17.497 9.939 -20.425 1.00 0.00 N ATOM 0 H ARG A 156 -13.408 13.652 -16.419 1.00 0.00 H new ATOM 0 HA ARG A 156 -14.314 11.014 -15.512 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -14.562 12.012 -17.836 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -12.817 11.935 -17.980 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -12.896 9.459 -17.606 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -14.641 9.537 -17.464 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -13.189 10.617 -19.918 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -13.652 8.931 -19.798 1.00 0.00 H new ATOM 0 HE ARG A 156 -15.419 11.242 -20.218 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -15.376 7.821 -19.245 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -17.082 7.594 -19.640 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -17.569 10.911 -20.726 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -18.313 9.329 -20.472 1.00 0.00 H new ATOM 2433 N ILE A 157 -11.257 12.016 -15.190 1.00 0.00 N ATOM 2434 CA ILE A 157 -10.068 11.643 -14.453 1.00 0.00 C ATOM 2435 C ILE A 157 -10.506 11.216 -13.054 1.00 0.00 C ATOM 2436 O ILE A 157 -10.165 10.122 -12.624 1.00 0.00 O ATOM 2437 CB ILE A 157 -9.023 12.785 -14.451 1.00 0.00 C ATOM 2438 CG1 ILE A 157 -8.288 12.946 -15.792 1.00 0.00 C ATOM 2439 CG2 ILE A 157 -7.995 12.486 -13.357 1.00 0.00 C ATOM 2440 CD1 ILE A 157 -7.624 14.325 -15.938 1.00 0.00 C ATOM 0 H ILE A 157 -11.274 12.984 -15.512 1.00 0.00 H new ATOM 0 HA ILE A 157 -9.561 10.805 -14.931 1.00 0.00 H new ATOM 0 HB ILE A 157 -9.557 13.718 -14.272 1.00 0.00 H new ATOM 0 HG12 ILE A 157 -7.528 12.169 -15.882 1.00 0.00 H new ATOM 0 HG13 ILE A 157 -8.994 12.798 -16.609 1.00 0.00 H new ATOM 0 HG21 ILE A 157 -7.246 13.278 -13.335 1.00 0.00 H new ATOM 0 HG22 ILE A 157 -8.497 12.434 -12.391 1.00 0.00 H new ATOM 0 HG23 ILE A 157 -7.509 11.533 -13.565 1.00 0.00 H new ATOM 0 HD11 ILE A 157 -7.119 14.386 -16.902 1.00 0.00 H new ATOM 0 HD12 ILE A 157 -8.385 15.103 -15.877 1.00 0.00 H new ATOM 0 HD13 ILE A 157 -6.897 14.465 -15.138 1.00 0.00 H new ATOM 2452 N GLN A 158 -11.270 12.051 -12.353 1.00 0.00 N ATOM 2453 CA GLN A 158 -11.686 11.810 -10.970 1.00 0.00 C ATOM 2454 C GLN A 158 -12.382 10.457 -10.847 1.00 0.00 C ATOM 2455 O GLN A 158 -12.060 9.669 -9.959 1.00 0.00 O ATOM 2456 CB GLN A 158 -12.606 12.926 -10.416 1.00 0.00 C ATOM 2457 CG GLN A 158 -12.554 14.336 -11.027 1.00 0.00 C ATOM 2458 CD GLN A 158 -11.281 15.136 -10.765 1.00 0.00 C ATOM 2459 OE1 GLN A 158 -10.948 15.442 -9.625 1.00 0.00 O ATOM 2460 NE2 GLN A 158 -10.568 15.513 -11.814 1.00 0.00 N ATOM 0 H GLN A 158 -11.624 12.928 -12.734 1.00 0.00 H new ATOM 0 HA GLN A 158 -10.777 11.811 -10.369 1.00 0.00 H new ATOM 0 HB2 GLN A 158 -13.633 12.572 -10.502 1.00 0.00 H new ATOM 0 HB3 GLN A 158 -12.391 13.025 -9.352 1.00 0.00 H new ATOM 0 HG2 GLN A 158 -12.688 14.248 -12.105 1.00 0.00 H new ATOM 0 HG3 GLN A 158 -13.402 14.906 -10.647 1.00 0.00 H new ATOM 0 HE21 GLN A 158 -10.863 15.247 -12.753 1.00 0.00 H new ATOM 0 HE22 GLN A 158 -9.723 16.069 -11.683 1.00 0.00 H new ATOM 2469 N SER A 159 -13.281 10.163 -11.779 1.00 0.00 N ATOM 2470 CA SER A 159 -14.028 8.907 -11.738 1.00 0.00 C ATOM 2471 C SER A 159 -13.120 7.728 -12.080 1.00 0.00 C ATOM 2472 O SER A 159 -13.260 6.647 -11.510 1.00 0.00 O ATOM 2473 CB SER A 159 -15.222 8.961 -12.684 1.00 0.00 C ATOM 2474 OG SER A 159 -16.010 10.114 -12.422 1.00 0.00 O ATOM 0 H SER A 159 -13.511 10.769 -12.566 1.00 0.00 H new ATOM 0 HA SER A 159 -14.402 8.765 -10.724 1.00 0.00 H new ATOM 0 HB2 SER A 159 -14.875 8.977 -13.717 1.00 0.00 H new ATOM 0 HB3 SER A 159 -15.829 8.063 -12.565 1.00 0.00 H new ATOM 0 HG SER A 159 -15.559 10.907 -12.781 1.00 0.00 H new ATOM 2480 N TRP A 160 -12.137 7.926 -12.967 1.00 0.00 N ATOM 2481 CA TRP A 160 -11.190 6.876 -13.298 1.00 0.00 C ATOM 2482 C TRP A 160 -10.349 6.543 -12.082 1.00 0.00 C ATOM 2483 O TRP A 160 -10.174 5.383 -11.720 1.00 0.00 O ATOM 2484 CB TRP A 160 -10.306 7.368 -14.433 1.00 0.00 C ATOM 2485 CG TRP A 160 -9.416 6.307 -14.958 1.00 0.00 C ATOM 2486 CD1 TRP A 160 -9.842 5.242 -15.669 1.00 0.00 C ATOM 2487 CD2 TRP A 160 -7.960 6.219 -14.906 1.00 0.00 C ATOM 2488 NE1 TRP A 160 -8.750 4.496 -16.043 1.00 0.00 N ATOM 2489 CE2 TRP A 160 -7.571 5.043 -15.602 1.00 0.00 C ATOM 2490 CE3 TRP A 160 -6.930 7.054 -14.430 1.00 0.00 C ATOM 2491 CZ2 TRP A 160 -6.236 4.693 -15.800 1.00 0.00 C ATOM 2492 CZ3 TRP A 160 -5.575 6.733 -14.656 1.00 0.00 C ATOM 2493 CH2 TRP A 160 -5.232 5.556 -15.342 1.00 0.00 C ATOM 0 H TRP A 160 -11.984 8.804 -13.463 1.00 0.00 H new ATOM 0 HA TRP A 160 -11.718 5.974 -13.608 1.00 0.00 H new ATOM 0 HB2 TRP A 160 -10.933 7.745 -15.241 1.00 0.00 H new ATOM 0 HB3 TRP A 160 -9.702 8.205 -14.082 1.00 0.00 H new ATOM 0 HD1 TRP A 160 -10.871 5.014 -15.905 1.00 0.00 H new ATOM 0 HE1 TRP A 160 -8.809 3.635 -16.586 1.00 0.00 H new ATOM 0 HE3 TRP A 160 -7.181 7.952 -13.885 1.00 0.00 H new ATOM 0 HZ2 TRP A 160 -5.980 3.770 -16.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 160 -4.799 7.394 -14.300 1.00 0.00 H new ATOM 0 HH2 TRP A 160 -4.193 5.316 -15.516 1.00 0.00 H new ATOM 2504 N CYS A 161 -9.896 7.587 -11.403 1.00 0.00 N ATOM 2505 CA CYS A 161 -9.098 7.471 -10.209 1.00 0.00 C ATOM 2506 C CYS A 161 -9.865 6.707 -9.144 1.00 0.00 C ATOM 2507 O CYS A 161 -9.265 5.905 -8.436 1.00 0.00 O ATOM 2508 CB CYS A 161 -8.738 8.870 -9.722 1.00 0.00 C ATOM 2509 SG CYS A 161 -7.628 9.619 -10.937 1.00 0.00 S ATOM 0 H CYS A 161 -10.081 8.552 -11.678 1.00 0.00 H new ATOM 0 HA CYS A 161 -8.182 6.920 -10.423 1.00 0.00 H new ATOM 0 HB2 CYS A 161 -9.637 9.475 -9.604 1.00 0.00 H new ATOM 0 HB3 CYS A 161 -8.256 8.821 -8.746 1.00 0.00 H new ATOM 0 HG CYS A 161 -8.315 10.013 -11.968 1.00 0.00 H new ATOM 2515 N GLU A 162 -11.181 6.906 -9.074 1.00 0.00 N ATOM 2516 CA GLU A 162 -12.007 6.313 -8.052 1.00 0.00 C ATOM 2517 C GLU A 162 -12.100 4.797 -8.248 1.00 0.00 C ATOM 2518 O GLU A 162 -12.132 4.054 -7.263 1.00 0.00 O ATOM 2519 CB GLU A 162 -13.341 7.070 -8.085 1.00 0.00 C ATOM 2520 CG GLU A 162 -14.516 6.353 -7.434 1.00 0.00 C ATOM 2521 CD GLU A 162 -14.327 6.036 -5.934 1.00 0.00 C ATOM 2522 OE1 GLU A 162 -13.582 6.757 -5.229 1.00 0.00 O ATOM 2523 OE2 GLU A 162 -14.965 5.072 -5.445 1.00 0.00 O ATOM 0 H GLU A 162 -11.696 7.489 -9.734 1.00 0.00 H new ATOM 0 HA GLU A 162 -11.590 6.412 -7.050 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -13.206 8.032 -7.591 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -13.595 7.278 -9.124 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -15.409 6.966 -7.552 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -14.697 5.420 -7.969 1.00 0.00 H new ATOM 2530 N GLN A 163 -12.063 4.316 -9.496 1.00 0.00 N ATOM 2531 CA GLN A 163 -11.982 2.884 -9.739 1.00 0.00 C ATOM 2532 C GLN A 163 -10.562 2.360 -9.558 1.00 0.00 C ATOM 2533 O GLN A 163 -10.391 1.370 -8.854 1.00 0.00 O ATOM 2534 CB GLN A 163 -12.627 2.451 -11.059 1.00 0.00 C ATOM 2535 CG GLN A 163 -12.072 3.100 -12.330 1.00 0.00 C ATOM 2536 CD GLN A 163 -12.614 2.434 -13.599 1.00 0.00 C ATOM 2537 OE1 GLN A 163 -13.556 1.644 -13.579 1.00 0.00 O ATOM 2538 NE2 GLN A 163 -12.012 2.730 -14.738 1.00 0.00 N ATOM 0 H GLN A 163 -12.088 4.893 -10.337 1.00 0.00 H new ATOM 0 HA GLN A 163 -12.589 2.406 -8.970 1.00 0.00 H new ATOM 0 HB2 GLN A 163 -12.522 1.370 -11.153 1.00 0.00 H new ATOM 0 HB3 GLN A 163 -13.695 2.664 -11.004 1.00 0.00 H new ATOM 0 HG2 GLN A 163 -12.330 4.159 -12.338 1.00 0.00 H new ATOM 0 HG3 GLN A 163 -10.984 3.037 -12.324 1.00 0.00 H new ATOM 0 HE21 GLN A 163 -11.231 3.386 -14.747 1.00 0.00 H new ATOM 0 HE22 GLN A 163 -12.328 2.302 -15.608 1.00 0.00 H new ATOM 2547 N ILE A 164 -9.524 3.004 -10.103 1.00 0.00 N ATOM 2548 CA ILE A 164 -8.202 2.392 -10.080 1.00 0.00 C ATOM 2549 C ILE A 164 -7.715 2.265 -8.639 1.00 0.00 C ATOM 2550 O ILE A 164 -7.150 1.235 -8.282 1.00 0.00 O ATOM 2551 CB ILE A 164 -7.196 3.102 -11.008 1.00 0.00 C ATOM 2552 CG1 ILE A 164 -6.587 4.429 -10.512 1.00 0.00 C ATOM 2553 CG2 ILE A 164 -7.738 3.186 -12.438 1.00 0.00 C ATOM 2554 CD1 ILE A 164 -5.630 5.079 -11.530 1.00 0.00 C ATOM 0 H ILE A 164 -9.574 3.919 -10.551 1.00 0.00 H new ATOM 0 HA ILE A 164 -8.283 1.386 -10.492 1.00 0.00 H new ATOM 0 HB ILE A 164 -6.322 2.451 -10.993 1.00 0.00 H new ATOM 0 HG12 ILE A 164 -7.392 5.127 -10.284 1.00 0.00 H new ATOM 0 HG13 ILE A 164 -6.048 4.248 -9.582 1.00 0.00 H new ATOM 0 HG21 ILE A 164 -7.011 3.691 -13.074 1.00 0.00 H new ATOM 0 HG22 ILE A 164 -7.917 2.181 -12.819 1.00 0.00 H new ATOM 0 HG23 ILE A 164 -8.673 3.747 -12.440 1.00 0.00 H new ATOM 0 HD11 ILE A 164 -5.237 6.009 -11.118 1.00 0.00 H new ATOM 0 HD12 ILE A 164 -4.805 4.398 -11.740 1.00 0.00 H new ATOM 0 HD13 ILE A 164 -6.170 5.291 -12.453 1.00 0.00 H new ATOM 2566 N LEU A 165 -7.994 3.252 -7.783 1.00 0.00 N ATOM 2567 CA LEU A 165 -7.585 3.223 -6.377 1.00 0.00 C ATOM 2568 C LEU A 165 -8.279 2.104 -5.596 1.00 0.00 C ATOM 2569 O LEU A 165 -7.860 1.795 -4.484 1.00 0.00 O ATOM 2570 CB LEU A 165 -7.764 4.609 -5.724 1.00 0.00 C ATOM 2571 CG LEU A 165 -9.206 5.085 -5.412 1.00 0.00 C ATOM 2572 CD1 LEU A 165 -9.793 4.513 -4.113 1.00 0.00 C ATOM 2573 CD2 LEU A 165 -9.220 6.613 -5.267 1.00 0.00 C ATOM 0 H LEU A 165 -8.509 4.092 -8.045 1.00 0.00 H new ATOM 0 HA LEU A 165 -6.521 2.988 -6.344 1.00 0.00 H new ATOM 0 HB2 LEU A 165 -7.201 4.614 -4.790 1.00 0.00 H new ATOM 0 HB3 LEU A 165 -7.302 5.349 -6.378 1.00 0.00 H new ATOM 0 HG LEU A 165 -9.813 4.729 -6.244 1.00 0.00 H new ATOM 0 HD11 LEU A 165 -10.803 4.896 -3.971 1.00 0.00 H new ATOM 0 HD12 LEU A 165 -9.823 3.425 -4.175 1.00 0.00 H new ATOM 0 HD13 LEU A 165 -9.170 4.811 -3.270 1.00 0.00 H new ATOM 0 HD21 LEU A 165 -10.234 6.948 -5.048 1.00 0.00 H new ATOM 0 HD22 LEU A 165 -8.556 6.907 -4.454 1.00 0.00 H new ATOM 0 HD23 LEU A 165 -8.880 7.070 -6.196 1.00 0.00 H new ATOM 2585 N ASN A 166 -9.310 1.486 -6.177 1.00 0.00 N ATOM 2586 CA ASN A 166 -9.955 0.298 -5.650 1.00 0.00 C ATOM 2587 C ASN A 166 -9.336 -0.912 -6.324 1.00 0.00 C ATOM 2588 O ASN A 166 -8.914 -1.826 -5.635 1.00 0.00 O ATOM 2589 CB ASN A 166 -11.474 0.354 -5.866 1.00 0.00 C ATOM 2590 CG ASN A 166 -12.177 1.122 -4.751 1.00 0.00 C ATOM 2591 OD1 ASN A 166 -12.391 0.587 -3.666 1.00 0.00 O ATOM 2592 ND2 ASN A 166 -12.539 2.379 -4.969 1.00 0.00 N ATOM 0 H ASN A 166 -9.724 1.813 -7.050 1.00 0.00 H new ATOM 0 HA ASN A 166 -9.800 0.232 -4.573 1.00 0.00 H new ATOM 0 HB2 ASN A 166 -11.688 0.828 -6.824 1.00 0.00 H new ATOM 0 HB3 ASN A 166 -11.872 -0.660 -5.916 1.00 0.00 H new ATOM 0 HD21 ASN A 166 -13.000 2.912 -4.232 1.00 0.00 H new ATOM 0 HD22 ASN A 166 -12.356 2.813 -5.874 1.00 0.00 H new ATOM 2599 N GLU A 167 -9.174 -0.901 -7.646 1.00 0.00 N ATOM 2600 CA GLU A 167 -8.736 -2.069 -8.409 1.00 0.00 C ATOM 2601 C GLU A 167 -7.341 -2.516 -7.959 1.00 0.00 C ATOM 2602 O GLU A 167 -7.046 -3.707 -7.888 1.00 0.00 O ATOM 2603 CB GLU A 167 -8.732 -1.743 -9.914 1.00 0.00 C ATOM 2604 CG GLU A 167 -10.115 -1.567 -10.551 1.00 0.00 C ATOM 2605 CD GLU A 167 -10.000 -1.131 -12.027 1.00 0.00 C ATOM 2606 OE1 GLU A 167 -9.867 0.084 -12.299 1.00 0.00 O1- ATOM 2607 OE2 GLU A 167 -9.997 -2.009 -12.922 1.00 0.00 O ATOM 0 H GLU A 167 -9.344 -0.076 -8.222 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.433 -2.886 -8.225 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.160 -0.828 -10.069 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.207 -2.540 -10.440 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.669 -2.504 -10.488 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -10.683 -0.823 -9.993 1.00 0.00 H new ATOM 2614 N MET A 168 -6.486 -1.546 -7.623 1.00 0.00 N ATOM 2615 CA MET A 168 -5.098 -1.774 -7.235 1.00 0.00 C ATOM 2616 C MET A 168 -5.004 -2.170 -5.769 1.00 0.00 C ATOM 2617 O MET A 168 -4.209 -3.032 -5.410 1.00 0.00 O ATOM 2618 CB MET A 168 -4.271 -0.509 -7.555 1.00 0.00 C ATOM 2619 CG MET A 168 -4.379 -0.242 -9.055 1.00 0.00 C ATOM 2620 SD MET A 168 -3.426 1.099 -9.803 1.00 0.00 S ATOM 2621 CE MET A 168 -4.198 2.488 -8.970 1.00 0.00 C ATOM 0 H MET A 168 -6.749 -0.560 -7.614 1.00 0.00 H new ATOM 0 HA MET A 168 -4.686 -2.606 -7.806 1.00 0.00 H new ATOM 0 HB2 MET A 168 -4.644 0.344 -6.988 1.00 0.00 H new ATOM 0 HB3 MET A 168 -3.229 -0.652 -7.267 1.00 0.00 H new ATOM 0 HG2 MET A 168 -4.103 -1.163 -9.569 1.00 0.00 H new ATOM 0 HG3 MET A 168 -5.430 -0.056 -9.277 1.00 0.00 H new ATOM 0 HE1 MET A 168 -3.839 3.420 -9.407 1.00 0.00 H new ATOM 0 HE2 MET A 168 -5.280 2.426 -9.086 1.00 0.00 H new ATOM 0 HE3 MET A 168 -3.945 2.463 -7.910 1.00 0.00 H new ATOM 2631 N ALA A 169 -5.841 -1.569 -4.929 1.00 0.00 N ATOM 2632 CA ALA A 169 -5.850 -1.783 -3.492 1.00 0.00 C ATOM 2633 C ALA A 169 -6.435 -3.151 -3.167 1.00 0.00 C ATOM 2634 O ALA A 169 -5.879 -3.899 -2.373 1.00 0.00 O ATOM 2635 CB ALA A 169 -6.672 -0.685 -2.810 1.00 0.00 C ATOM 0 H ALA A 169 -6.548 -0.903 -5.240 1.00 0.00 H new ATOM 0 HA ALA A 169 -4.825 -1.745 -3.122 1.00 0.00 H new ATOM 0 HB1 ALA A 169 -6.676 -0.850 -1.733 1.00 0.00 H new ATOM 0 HB2 ALA A 169 -6.231 0.288 -3.027 1.00 0.00 H new ATOM 0 HB3 ALA A 169 -7.695 -0.711 -3.185 1.00 0.00 H new ATOM 2641 N GLU A 170 -7.547 -3.480 -3.815 1.00 0.00 N ATOM 2642 CA GLU A 170 -8.299 -4.704 -3.596 1.00 0.00 C ATOM 2643 C GLU A 170 -7.496 -5.912 -4.095 1.00 0.00 C ATOM 2644 O GLU A 170 -7.601 -6.996 -3.518 1.00 0.00 O ATOM 2645 CB GLU A 170 -9.655 -4.581 -4.303 1.00 0.00 C ATOM 2646 CG GLU A 170 -10.566 -3.493 -3.692 1.00 0.00 C ATOM 2647 CD GLU A 170 -11.228 -3.967 -2.386 1.00 0.00 C ATOM 2648 OE1 GLU A 170 -12.326 -4.576 -2.443 1.00 0.00 O ATOM 2649 OE2 GLU A 170 -10.673 -3.725 -1.287 1.00 0.00 O ATOM 0 H GLU A 170 -7.961 -2.881 -4.529 1.00 0.00 H new ATOM 0 HA GLU A 170 -8.477 -4.857 -2.532 1.00 0.00 H new ATOM 0 HB2 GLU A 170 -9.489 -4.356 -5.357 1.00 0.00 H new ATOM 0 HB3 GLU A 170 -10.168 -5.542 -4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 170 -9.979 -2.595 -3.497 1.00 0.00 H new ATOM 0 HG3 GLU A 170 -11.337 -3.219 -4.412 1.00 0.00 H new ATOM 2656 N HIS A 171 -6.653 -5.727 -5.123 1.00 0.00 N ATOM 2657 CA HIS A 171 -5.680 -6.722 -5.539 1.00 0.00 C ATOM 2658 C HIS A 171 -4.658 -6.949 -4.420 1.00 0.00 C ATOM 2659 O HIS A 171 -4.412 -8.091 -4.021 1.00 0.00 O ATOM 2660 CB HIS A 171 -4.963 -6.245 -6.808 1.00 0.00 C ATOM 2661 CG HIS A 171 -3.744 -7.088 -7.114 1.00 0.00 C ATOM 2662 ND1 HIS A 171 -3.747 -8.318 -7.777 1.00 0.00 N ATOM 2663 CD2 HIS A 171 -2.483 -6.835 -6.661 1.00 0.00 C ATOM 2664 CE1 HIS A 171 -2.477 -8.771 -7.702 1.00 0.00 C ATOM 2665 NE2 HIS A 171 -1.698 -7.893 -7.050 1.00 0.00 N ATOM 0 H HIS A 171 -6.635 -4.876 -5.685 1.00 0.00 H new ATOM 0 HA HIS A 171 -6.194 -7.660 -5.748 1.00 0.00 H new ATOM 0 HB2 HIS A 171 -5.652 -6.283 -7.651 1.00 0.00 H new ATOM 0 HB3 HIS A 171 -4.664 -5.204 -6.687 1.00 0.00 H new ATOM 0 HD2 HIS A 171 -2.162 -5.968 -6.103 1.00 0.00 H new ATOM 0 HE1 HIS A 171 -2.135 -9.710 -8.110 1.00 0.00 H new ATOM 0 HE2 HIS A 171 -0.698 -7.994 -6.874 1.00 0.00 H new ATOM 2673 N TYR A 172 -4.048 -5.858 -3.942 1.00 0.00 N ATOM 2674 CA TYR A 172 -2.915 -5.912 -3.030 1.00 0.00 C ATOM 2675 C TYR A 172 -3.312 -6.226 -1.585 1.00 0.00 C ATOM 2676 O TYR A 172 -2.432 -6.483 -0.756 1.00 0.00 O ATOM 2677 CB TYR A 172 -2.084 -4.621 -3.174 1.00 0.00 C ATOM 2678 CG TYR A 172 -0.739 -4.818 -3.841 1.00 0.00 C ATOM 2679 CD1 TYR A 172 0.229 -5.667 -3.272 1.00 0.00 C ATOM 2680 CD2 TYR A 172 -0.461 -4.141 -5.042 1.00 0.00 C ATOM 2681 CE1 TYR A 172 1.463 -5.866 -3.917 1.00 0.00 C ATOM 2682 CE2 TYR A 172 0.781 -4.310 -5.676 1.00 0.00 C ATOM 2683 CZ TYR A 172 1.743 -5.192 -5.130 1.00 0.00 C ATOM 2684 OH TYR A 172 2.932 -5.377 -5.774 1.00 0.00 O ATOM 0 H TYR A 172 -4.334 -4.909 -4.183 1.00 0.00 H new ATOM 0 HA TYR A 172 -2.286 -6.756 -3.312 1.00 0.00 H new ATOM 0 HB2 TYR A 172 -2.659 -3.895 -3.749 1.00 0.00 H new ATOM 0 HB3 TYR A 172 -1.927 -4.192 -2.185 1.00 0.00 H new ATOM 0 HD1 TYR A 172 0.023 -6.167 -2.337 1.00 0.00 H new ATOM 0 HD2 TYR A 172 -1.204 -3.490 -5.478 1.00 0.00 H new ATOM 0 HE1 TYR A 172 2.196 -6.532 -3.487 1.00 0.00 H new ATOM 0 HE2 TYR A 172 1.002 -3.766 -6.582 1.00 0.00 H new ATOM 0 HH TYR A 172 2.949 -4.835 -6.591 1.00 0.00 H new ATOM 2694 N ALA A 173 -4.610 -6.224 -1.280 1.00 0.00 N ATOM 2695 CA ALA A 173 -5.114 -6.541 0.038 1.00 0.00 C ATOM 2696 C ALA A 173 -4.902 -8.025 0.356 1.00 0.00 C ATOM 2697 O ALA A 173 -4.459 -8.332 1.487 1.00 0.00 O ATOM 2698 CB ALA A 173 -6.590 -6.150 0.157 1.00 0.00 C ATOM 2699 OXT ALA A 173 -5.205 -8.887 -0.504 1.00 0.00 O1- ATOM 0 H ALA A 173 -5.341 -5.999 -1.955 1.00 0.00 H new ATOM 0 HA ALA A 173 -4.555 -5.962 0.772 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -6.952 -6.396 1.155 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -6.698 -5.079 -0.015 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.172 -6.697 -0.585 1.00 0.00 H new