USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 994 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 119 SER OG : rot -103:sc= 2.12 USER MOD Set 1.2: A 121 TYR OH : rot -71:sc= 0.784 USER MOD Set 2.1: A 5 THR OG1 : rot 146:sc= -3.21 USER MOD Set 2.2: A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 107 SER OG : rot 180:sc= 0.0901 USER MOD Set 3.2: A 113 THR OG1 : rot 120:sc= 0.442 USER MOD Set 4.1: A 104 LYS NZ :NH3+ 156:sc= -0.0153 (180deg=-0.401) USER MOD Set 4.2: A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.1: A 73 HIS : no HE2:sc= -1.41! C(o=-0.24!,f=-7.9!) USER MOD Set 5.2: A 85 SER OG : rot -115:sc= 1.17 USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.047 K(o=-0.047,f=-1.8!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot -55:sc= -2.1! USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN :FLIP amide:sc=-0.00516 F(o=-0.55,f=-0.0052) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 62:sc= -3.23! USER MOD Single : A 55 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.565) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 HIS : no HD1:sc= -6.82! C(o=-6.8!,f=-6.9!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -0.312 X(o=-0.31,f=-0.005) USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 81 THR OG1 : rot 54:sc= 0.773 USER MOD Single : A 82 TYR OH : rot 50:sc= -4.25! USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot -53:sc= 0.0501 USER MOD Single : A 93 SER OG : rot 33:sc= 0.00181 USER MOD Single : A 95 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 TYR OH : rot -15:sc= -1.85! USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 HIS : no HD1:sc= -1.76 K(o=-1.8,f=-3.7!) USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 HIS : no HE2:sc= 0.647 K(o=0.65,f=-2!) USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.0763 K(o=-0.076,f=-0.62) USER MOD Single : A 146 LYS NZ :NH3+ 158:sc= -0.0391 (180deg=-0.372) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 8 N VAL A 3 -7.554 -1.511 18.450 1.00 0.00 N ATOM 9 CA VAL A 3 -6.201 -1.745 17.874 1.00 0.00 C ATOM 10 C VAL A 3 -5.797 -0.546 17.014 1.00 0.00 C ATOM 11 O VAL A 3 -6.598 0.007 16.286 1.00 0.00 O ATOM 12 CB VAL A 3 -6.224 -3.008 17.009 1.00 0.00 C ATOM 13 CG1 VAL A 3 -7.084 -2.763 15.768 1.00 0.00 C ATOM 14 CG2 VAL A 3 -4.797 -3.356 16.578 1.00 0.00 C ATOM 0 HA VAL A 3 -5.481 -1.872 18.682 1.00 0.00 H new ATOM 0 HB VAL A 3 -6.643 -3.834 17.584 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -7.100 -3.663 15.153 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -8.100 -2.514 16.073 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -6.665 -1.937 15.193 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -4.812 -4.255 15.962 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.379 -2.530 16.004 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -4.183 -3.531 17.461 1.00 0.00 H new ATOM 24 N TYR A 4 -4.560 -0.138 17.091 1.00 0.00 N ATOM 25 CA TYR A 4 -4.106 1.025 16.279 1.00 0.00 C ATOM 26 C TYR A 4 -3.155 0.541 15.183 1.00 0.00 C ATOM 27 O TYR A 4 -2.400 -0.393 15.370 1.00 0.00 O ATOM 28 CB TYR A 4 -3.379 2.025 17.181 1.00 0.00 C ATOM 29 CG TYR A 4 -3.020 3.256 16.383 1.00 0.00 C ATOM 30 CD1 TYR A 4 -3.977 4.255 16.169 1.00 0.00 C ATOM 31 CD2 TYR A 4 -1.731 3.398 15.858 1.00 0.00 C ATOM 32 CE1 TYR A 4 -3.645 5.396 15.430 1.00 0.00 C ATOM 33 CE2 TYR A 4 -1.398 4.538 15.118 1.00 0.00 C ATOM 34 CZ TYR A 4 -2.355 5.537 14.904 1.00 0.00 C ATOM 35 OH TYR A 4 -2.027 6.662 14.175 1.00 0.00 O ATOM 0 H TYR A 4 -3.844 -0.561 17.682 1.00 0.00 H new ATOM 0 HA TYR A 4 -4.970 1.509 15.823 1.00 0.00 H new ATOM 0 HB2 TYR A 4 -4.013 2.298 18.024 1.00 0.00 H new ATOM 0 HB3 TYR A 4 -2.478 1.571 17.593 1.00 0.00 H new ATOM 0 HD1 TYR A 4 -4.972 4.145 16.574 1.00 0.00 H new ATOM 0 HD2 TYR A 4 -0.993 2.627 16.024 1.00 0.00 H new ATOM 0 HE1 TYR A 4 -4.383 6.167 15.266 1.00 0.00 H new ATOM 0 HE2 TYR A 4 -0.403 4.647 14.712 1.00 0.00 H new ATOM 0 HH TYR A 4 -1.093 6.602 13.884 1.00 0.00 H new ATOM 45 N THR A 5 -3.183 1.169 14.038 1.00 0.00 N ATOM 46 CA THR A 5 -2.280 0.744 12.932 1.00 0.00 C ATOM 47 C THR A 5 -0.997 1.576 12.973 1.00 0.00 C ATOM 48 O THR A 5 -1.017 2.750 13.288 1.00 0.00 O ATOM 49 CB THR A 5 -2.983 0.957 11.589 1.00 0.00 C ATOM 50 OG1 THR A 5 -4.213 0.245 11.582 1.00 0.00 O ATOM 51 CG2 THR A 5 -2.090 0.448 10.457 1.00 0.00 C ATOM 0 H THR A 5 -3.792 1.958 13.822 1.00 0.00 H new ATOM 0 HA THR A 5 -2.033 -0.311 13.050 1.00 0.00 H new ATOM 0 HB THR A 5 -3.177 2.020 11.445 1.00 0.00 H new ATOM 0 HG1 THR A 5 -4.877 0.745 11.063 1.00 0.00 H new ATOM 0 HG21 THR A 5 -2.592 0.600 9.501 1.00 0.00 H new ATOM 0 HG22 THR A 5 -1.147 0.995 10.463 1.00 0.00 H new ATOM 0 HG23 THR A 5 -1.894 -0.615 10.598 1.00 0.00 H new ATOM 59 N TYR A 6 0.121 0.980 12.659 1.00 0.00 N ATOM 60 CA TYR A 6 1.402 1.739 12.683 1.00 0.00 C ATOM 61 C TYR A 6 2.125 1.572 11.345 1.00 0.00 C ATOM 62 O TYR A 6 2.125 0.507 10.758 1.00 0.00 O ATOM 63 CB TYR A 6 2.289 1.208 13.812 1.00 0.00 C ATOM 64 CG TYR A 6 3.568 2.009 13.866 1.00 0.00 C ATOM 65 CD1 TYR A 6 3.611 3.216 14.573 1.00 0.00 C ATOM 66 CD2 TYR A 6 4.713 1.542 13.208 1.00 0.00 C ATOM 67 CE1 TYR A 6 4.798 3.956 14.623 1.00 0.00 C ATOM 68 CE2 TYR A 6 5.900 2.283 13.258 1.00 0.00 C ATOM 69 CZ TYR A 6 5.941 3.491 13.966 1.00 0.00 C ATOM 70 OH TYR A 6 7.112 4.221 14.015 1.00 0.00 O ATOM 0 H TYR A 6 0.202 0.000 12.387 1.00 0.00 H new ATOM 0 HA TYR A 6 1.192 2.795 12.850 1.00 0.00 H new ATOM 0 HB2 TYR A 6 1.764 1.277 14.765 1.00 0.00 H new ATOM 0 HB3 TYR A 6 2.514 0.154 13.647 1.00 0.00 H new ATOM 0 HD1 TYR A 6 2.728 3.576 15.080 1.00 0.00 H new ATOM 0 HD2 TYR A 6 4.680 0.611 12.662 1.00 0.00 H new ATOM 0 HE1 TYR A 6 4.831 4.887 15.170 1.00 0.00 H new ATOM 0 HE2 TYR A 6 6.783 1.923 12.751 1.00 0.00 H new ATOM 0 HH TYR A 6 7.809 3.756 13.507 1.00 0.00 H new ATOM 80 N GLU A 7 2.744 2.613 10.859 1.00 0.00 N ATOM 81 CA GLU A 7 3.470 2.514 9.562 1.00 0.00 C ATOM 82 C GLU A 7 4.973 2.654 9.811 1.00 0.00 C ATOM 83 O GLU A 7 5.414 3.536 10.522 1.00 0.00 O ATOM 84 CB GLU A 7 3.000 3.630 8.626 1.00 0.00 C ATOM 85 CG GLU A 7 3.785 3.563 7.316 1.00 0.00 C ATOM 86 CD GLU A 7 3.313 4.678 6.380 1.00 0.00 C ATOM 87 OE1 GLU A 7 2.554 5.520 6.831 1.00 0.00 O ATOM 88 OE2 GLU A 7 3.716 4.670 5.229 1.00 0.00 O ATOM 0 H GLU A 7 2.778 3.529 11.305 1.00 0.00 H new ATOM 0 HA GLU A 7 3.265 1.547 9.102 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.933 3.528 8.428 1.00 0.00 H new ATOM 0 HB3 GLU A 7 3.145 4.601 9.100 1.00 0.00 H new ATOM 0 HG2 GLU A 7 4.852 3.667 7.513 1.00 0.00 H new ATOM 0 HG3 GLU A 7 3.641 2.592 6.843 1.00 0.00 H new ATOM 95 N ASN A 8 5.764 1.791 9.235 1.00 0.00 N ATOM 96 CA ASN A 8 7.236 1.876 9.445 1.00 0.00 C ATOM 97 C ASN A 8 7.934 2.135 8.107 1.00 0.00 C ATOM 98 O ASN A 8 7.636 1.510 7.110 1.00 0.00 O ATOM 99 CB ASN A 8 7.741 0.558 10.036 1.00 0.00 C ATOM 100 CG ASN A 8 9.166 0.748 10.563 1.00 0.00 C ATOM 101 OD1 ASN A 8 9.555 1.845 10.912 1.00 0.00 O ATOM 102 ND2 ASN A 8 9.963 -0.282 10.638 1.00 0.00 N ATOM 0 H ASN A 8 5.455 1.031 8.629 1.00 0.00 H new ATOM 0 HA ASN A 8 7.457 2.694 10.131 1.00 0.00 H new ATOM 0 HB2 ASN A 8 7.084 0.233 10.843 1.00 0.00 H new ATOM 0 HB3 ASN A 8 7.724 -0.224 9.277 1.00 0.00 H new ATOM 0 HD21 ASN A 8 10.913 -0.167 10.990 1.00 0.00 H new ATOM 0 HD22 ASN A 8 9.636 -1.203 10.345 1.00 0.00 H new ATOM 109 N GLU A 9 8.863 3.051 8.081 1.00 0.00 N ATOM 110 CA GLU A 9 9.583 3.349 6.811 1.00 0.00 C ATOM 111 C GLU A 9 10.972 2.708 6.855 1.00 0.00 C ATOM 112 O GLU A 9 11.838 3.131 7.595 1.00 0.00 O ATOM 113 CB GLU A 9 9.724 4.864 6.646 1.00 0.00 C ATOM 114 CG GLU A 9 8.342 5.515 6.724 1.00 0.00 C ATOM 115 CD GLU A 9 8.467 7.013 6.434 1.00 0.00 C ATOM 116 OE1 GLU A 9 9.583 7.506 6.438 1.00 0.00 O ATOM 117 OE2 GLU A 9 7.445 7.640 6.211 1.00 0.00 O ATOM 0 H GLU A 9 9.155 3.606 8.885 1.00 0.00 H new ATOM 0 HA GLU A 9 9.021 2.945 5.969 1.00 0.00 H new ATOM 0 HB2 GLU A 9 10.372 5.267 7.424 1.00 0.00 H new ATOM 0 HB3 GLU A 9 10.193 5.095 5.690 1.00 0.00 H new ATOM 0 HG2 GLU A 9 7.668 5.049 6.005 1.00 0.00 H new ATOM 0 HG3 GLU A 9 7.910 5.360 7.713 1.00 0.00 H new ATOM 124 N PHE A 10 11.191 1.689 6.070 1.00 0.00 N ATOM 125 CA PHE A 10 12.524 1.021 6.072 1.00 0.00 C ATOM 126 C PHE A 10 13.169 1.154 4.691 1.00 0.00 C ATOM 127 O PHE A 10 12.553 0.886 3.678 1.00 0.00 O ATOM 128 CB PHE A 10 12.347 -0.460 6.411 1.00 0.00 C ATOM 129 CG PHE A 10 13.693 -1.145 6.401 1.00 0.00 C ATOM 130 CD1 PHE A 10 14.483 -1.151 7.557 1.00 0.00 C ATOM 131 CD2 PHE A 10 14.148 -1.777 5.238 1.00 0.00 C ATOM 132 CE1 PHE A 10 15.731 -1.787 7.548 1.00 0.00 C ATOM 133 CE2 PHE A 10 15.395 -2.414 5.230 1.00 0.00 C ATOM 134 CZ PHE A 10 16.186 -2.419 6.385 1.00 0.00 C ATOM 0 H PHE A 10 10.506 1.290 5.428 1.00 0.00 H new ATOM 0 HA PHE A 10 13.165 1.493 6.816 1.00 0.00 H new ATOM 0 HB2 PHE A 10 11.881 -0.566 7.390 1.00 0.00 H new ATOM 0 HB3 PHE A 10 11.682 -0.932 5.688 1.00 0.00 H new ATOM 0 HD1 PHE A 10 14.130 -0.666 8.455 1.00 0.00 H new ATOM 0 HD2 PHE A 10 13.538 -1.773 4.347 1.00 0.00 H new ATOM 0 HE1 PHE A 10 16.342 -1.790 8.438 1.00 0.00 H new ATOM 0 HE2 PHE A 10 15.747 -2.901 4.333 1.00 0.00 H new ATOM 0 HZ PHE A 10 17.148 -2.911 6.379 1.00 0.00 H new ATOM 144 N THR A 11 14.407 1.564 4.641 1.00 0.00 N ATOM 145 CA THR A 11 15.093 1.711 3.327 1.00 0.00 C ATOM 146 C THR A 11 15.819 0.408 2.989 1.00 0.00 C ATOM 147 O THR A 11 16.157 -0.367 3.862 1.00 0.00 O ATOM 148 CB THR A 11 16.104 2.859 3.405 1.00 0.00 C ATOM 149 OG1 THR A 11 17.230 2.444 4.165 1.00 0.00 O ATOM 150 CG2 THR A 11 15.451 4.070 4.073 1.00 0.00 C ATOM 0 H THR A 11 14.973 1.804 5.455 1.00 0.00 H new ATOM 0 HA THR A 11 14.359 1.930 2.552 1.00 0.00 H new ATOM 0 HB THR A 11 16.425 3.132 2.400 1.00 0.00 H new ATOM 0 HG1 THR A 11 17.879 3.177 4.215 1.00 0.00 H new ATOM 0 HG21 THR A 11 16.171 4.887 4.128 1.00 0.00 H new ATOM 0 HG22 THR A 11 14.587 4.386 3.488 1.00 0.00 H new ATOM 0 HG23 THR A 11 15.129 3.801 5.079 1.00 0.00 H new ATOM 158 N SER A 12 16.060 0.154 1.731 1.00 0.00 N ATOM 159 CA SER A 12 16.760 -1.106 1.350 1.00 0.00 C ATOM 160 C SER A 12 17.495 -0.909 0.021 1.00 0.00 C ATOM 161 O SER A 12 17.344 0.098 -0.642 1.00 0.00 O ATOM 162 CB SER A 12 15.735 -2.232 1.201 1.00 0.00 C ATOM 163 OG SER A 12 14.965 -2.022 0.026 1.00 0.00 O ATOM 0 H SER A 12 15.803 0.762 0.953 1.00 0.00 H new ATOM 0 HA SER A 12 17.481 -1.366 2.125 1.00 0.00 H new ATOM 0 HB2 SER A 12 16.243 -3.195 1.148 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.084 -2.263 2.074 1.00 0.00 H new ATOM 0 HG SER A 12 14.560 -1.130 0.055 1.00 0.00 H new ATOM 169 N ASP A 13 18.289 -1.868 -0.370 1.00 0.00 N ATOM 170 CA ASP A 13 19.036 -1.748 -1.653 1.00 0.00 C ATOM 171 C ASP A 13 18.108 -2.101 -2.817 1.00 0.00 C ATOM 172 O ASP A 13 16.930 -2.339 -2.636 1.00 0.00 O ATOM 173 CB ASP A 13 20.228 -2.708 -1.641 1.00 0.00 C ATOM 174 CG ASP A 13 21.477 -1.978 -2.139 1.00 0.00 C ATOM 175 OD1 ASP A 13 21.348 -0.838 -2.551 1.00 0.00 O ATOM 176 OD2 ASP A 13 22.541 -2.573 -2.099 1.00 0.00 O ATOM 0 H ASP A 13 18.453 -2.732 0.146 1.00 0.00 H new ATOM 0 HA ASP A 13 19.395 -0.726 -1.771 1.00 0.00 H new ATOM 0 HB2 ASP A 13 20.393 -3.087 -0.632 1.00 0.00 H new ATOM 0 HB3 ASP A 13 20.021 -3.570 -2.275 1.00 0.00 H new ATOM 181 N ILE A 14 18.629 -2.136 -4.015 1.00 0.00 N ATOM 182 CA ILE A 14 17.774 -2.471 -5.189 1.00 0.00 C ATOM 183 C ILE A 14 16.673 -1.419 -5.327 1.00 0.00 C ATOM 184 O ILE A 14 16.132 -0.945 -4.348 1.00 0.00 O ATOM 185 CB ILE A 14 17.141 -3.851 -4.987 1.00 0.00 C ATOM 186 CG1 ILE A 14 18.124 -4.768 -4.253 1.00 0.00 C ATOM 187 CG2 ILE A 14 16.800 -4.458 -6.349 1.00 0.00 C ATOM 188 CD1 ILE A 14 19.448 -4.819 -5.019 1.00 0.00 C ATOM 0 H ILE A 14 19.608 -1.947 -4.230 1.00 0.00 H new ATOM 0 HA ILE A 14 18.384 -2.484 -6.092 1.00 0.00 H new ATOM 0 HB ILE A 14 16.232 -3.748 -4.394 1.00 0.00 H new ATOM 0 HG12 ILE A 14 18.292 -4.402 -3.240 1.00 0.00 H new ATOM 0 HG13 ILE A 14 17.705 -5.770 -4.164 1.00 0.00 H new ATOM 0 HG21 ILE A 14 16.349 -5.440 -6.207 1.00 0.00 H new ATOM 0 HG22 ILE A 14 16.097 -3.809 -6.871 1.00 0.00 H new ATOM 0 HG23 ILE A 14 17.710 -4.558 -6.941 1.00 0.00 H new ATOM 0 HD11 ILE A 14 20.146 -5.472 -4.495 1.00 0.00 H new ATOM 0 HD12 ILE A 14 19.273 -5.206 -6.023 1.00 0.00 H new ATOM 0 HD13 ILE A 14 19.869 -3.816 -5.085 1.00 0.00 H new ATOM 200 N PRO A 15 16.339 -1.044 -6.571 1.00 0.00 N ATOM 201 CA PRO A 15 15.304 -0.042 -6.840 1.00 0.00 C ATOM 202 C PRO A 15 13.899 -0.569 -6.526 1.00 0.00 C ATOM 203 O PRO A 15 13.608 -1.737 -6.689 1.00 0.00 O ATOM 204 CB PRO A 15 15.447 0.233 -8.336 1.00 0.00 C ATOM 205 CG PRO A 15 16.064 -1.003 -8.892 1.00 0.00 C ATOM 206 CD PRO A 15 16.944 -1.568 -7.809 1.00 0.00 C ATOM 0 HA PRO A 15 15.426 0.847 -6.221 1.00 0.00 H new ATOM 0 HB2 PRO A 15 14.479 0.433 -8.796 1.00 0.00 H new ATOM 0 HB3 PRO A 15 16.074 1.105 -8.520 1.00 0.00 H new ATOM 0 HG2 PRO A 15 15.298 -1.722 -9.183 1.00 0.00 H new ATOM 0 HG3 PRO A 15 16.646 -0.778 -9.786 1.00 0.00 H new ATOM 0 HD2 PRO A 15 16.950 -2.658 -7.824 1.00 0.00 H new ATOM 0 HD3 PRO A 15 17.978 -1.242 -7.920 1.00 0.00 H new ATOM 214 N ALA A 16 13.034 0.295 -6.071 1.00 0.00 N ATOM 215 CA ALA A 16 11.642 -0.119 -5.730 1.00 0.00 C ATOM 216 C ALA A 16 11.107 -1.158 -6.728 1.00 0.00 C ATOM 217 O ALA A 16 10.604 -2.192 -6.336 1.00 0.00 O ATOM 218 CB ALA A 16 10.734 1.110 -5.752 1.00 0.00 C ATOM 0 H ALA A 16 13.235 1.283 -5.919 1.00 0.00 H new ATOM 0 HA ALA A 16 11.652 -0.570 -4.738 1.00 0.00 H new ATOM 0 HB1 ALA A 16 9.715 0.814 -5.504 1.00 0.00 H new ATOM 0 HB2 ALA A 16 11.089 1.838 -5.022 1.00 0.00 H new ATOM 0 HB3 ALA A 16 10.750 1.556 -6.746 1.00 0.00 H new ATOM 224 N PRO A 17 11.190 -0.873 -8.042 1.00 0.00 N ATOM 225 CA PRO A 17 10.681 -1.788 -9.078 1.00 0.00 C ATOM 226 C PRO A 17 11.427 -3.127 -9.118 1.00 0.00 C ATOM 227 O PRO A 17 10.820 -4.179 -9.122 1.00 0.00 O ATOM 228 CB PRO A 17 10.903 -1.011 -10.379 1.00 0.00 C ATOM 229 CG PRO A 17 12.005 -0.064 -10.058 1.00 0.00 C ATOM 230 CD PRO A 17 11.781 0.343 -8.630 1.00 0.00 C ATOM 0 HA PRO A 17 9.641 -2.060 -8.895 1.00 0.00 H new ATOM 0 HB2 PRO A 17 11.176 -1.676 -11.198 1.00 0.00 H new ATOM 0 HB3 PRO A 17 10.001 -0.482 -10.685 1.00 0.00 H new ATOM 0 HG2 PRO A 17 12.979 -0.538 -10.183 1.00 0.00 H new ATOM 0 HG3 PRO A 17 11.984 0.801 -10.721 1.00 0.00 H new ATOM 0 HD2 PRO A 17 12.712 0.621 -8.136 1.00 0.00 H new ATOM 0 HD3 PRO A 17 11.111 1.199 -8.552 1.00 0.00 H new ATOM 238 N LYS A 18 12.731 -3.107 -9.156 1.00 0.00 N ATOM 239 CA LYS A 18 13.483 -4.395 -9.204 1.00 0.00 C ATOM 240 C LYS A 18 13.186 -5.213 -7.944 1.00 0.00 C ATOM 241 O LYS A 18 13.062 -6.420 -7.994 1.00 0.00 O ATOM 242 CB LYS A 18 14.984 -4.115 -9.285 1.00 0.00 C ATOM 243 CG LYS A 18 15.315 -3.509 -10.651 1.00 0.00 C ATOM 244 CD LYS A 18 16.829 -3.315 -10.769 1.00 0.00 C ATOM 245 CE LYS A 18 17.143 -2.513 -12.034 1.00 0.00 C ATOM 246 NZ LYS A 18 18.490 -1.890 -11.903 1.00 0.00 N ATOM 0 H LYS A 18 13.305 -2.264 -9.156 1.00 0.00 H new ATOM 0 HA LYS A 18 13.172 -4.957 -10.084 1.00 0.00 H new ATOM 0 HB2 LYS A 18 15.281 -3.431 -8.490 1.00 0.00 H new ATOM 0 HB3 LYS A 18 15.546 -5.038 -9.138 1.00 0.00 H new ATOM 0 HG2 LYS A 18 14.958 -4.163 -11.447 1.00 0.00 H new ATOM 0 HG3 LYS A 18 14.805 -2.553 -10.770 1.00 0.00 H new ATOM 0 HD2 LYS A 18 17.209 -2.793 -9.891 1.00 0.00 H new ATOM 0 HD3 LYS A 18 17.329 -4.283 -10.806 1.00 0.00 H new ATOM 0 HE2 LYS A 18 17.115 -3.165 -12.907 1.00 0.00 H new ATOM 0 HE3 LYS A 18 16.387 -1.743 -12.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 18.705 -1.344 -12.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 18.501 -1.256 -11.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 19.206 -2.634 -11.777 1.00 0.00 H new ATOM 260 N LEU A 19 13.073 -4.569 -6.816 1.00 0.00 N ATOM 261 CA LEU A 19 12.786 -5.316 -5.559 1.00 0.00 C ATOM 262 C LEU A 19 11.288 -5.619 -5.469 1.00 0.00 C ATOM 263 O LEU A 19 10.873 -6.561 -4.822 1.00 0.00 O ATOM 264 CB LEU A 19 13.209 -4.472 -4.355 1.00 0.00 C ATOM 265 CG LEU A 19 12.953 -5.257 -3.068 1.00 0.00 C ATOM 266 CD1 LEU A 19 13.929 -6.434 -2.988 1.00 0.00 C ATOM 267 CD2 LEU A 19 13.159 -4.340 -1.861 1.00 0.00 C ATOM 0 H LEU A 19 13.167 -3.559 -6.710 1.00 0.00 H new ATOM 0 HA LEU A 19 13.344 -6.252 -5.561 1.00 0.00 H new ATOM 0 HB2 LEU A 19 14.265 -4.213 -4.432 1.00 0.00 H new ATOM 0 HB3 LEU A 19 12.651 -3.536 -4.340 1.00 0.00 H new ATOM 0 HG LEU A 19 11.929 -5.632 -3.068 1.00 0.00 H new ATOM 0 HD11 LEU A 19 13.748 -6.995 -2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 19 13.782 -7.087 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 19 14.952 -6.059 -2.988 1.00 0.00 H new ATOM 0 HD21 LEU A 19 12.976 -4.900 -0.944 1.00 0.00 H new ATOM 0 HD22 LEU A 19 14.182 -3.965 -1.860 1.00 0.00 H new ATOM 0 HD23 LEU A 19 12.465 -3.501 -1.919 1.00 0.00 H new ATOM 279 N PHE A 20 10.474 -4.823 -6.107 1.00 0.00 N ATOM 280 CA PHE A 20 9.002 -5.059 -6.052 1.00 0.00 C ATOM 281 C PHE A 20 8.656 -6.363 -6.775 1.00 0.00 C ATOM 282 O PHE A 20 7.715 -7.047 -6.422 1.00 0.00 O ATOM 283 CB PHE A 20 8.278 -3.895 -6.732 1.00 0.00 C ATOM 284 CG PHE A 20 6.787 -4.132 -6.684 1.00 0.00 C ATOM 285 CD1 PHE A 20 6.157 -4.831 -7.719 1.00 0.00 C ATOM 286 CD2 PHE A 20 6.037 -3.651 -5.604 1.00 0.00 C ATOM 287 CE1 PHE A 20 4.774 -5.050 -7.676 1.00 0.00 C ATOM 288 CE2 PHE A 20 4.655 -3.869 -5.561 1.00 0.00 C ATOM 289 CZ PHE A 20 4.024 -4.569 -6.597 1.00 0.00 C ATOM 0 H PHE A 20 10.764 -4.019 -6.664 1.00 0.00 H new ATOM 0 HA PHE A 20 8.688 -5.132 -5.011 1.00 0.00 H new ATOM 0 HB2 PHE A 20 8.524 -2.958 -6.232 1.00 0.00 H new ATOM 0 HB3 PHE A 20 8.609 -3.801 -7.766 1.00 0.00 H new ATOM 0 HD1 PHE A 20 6.737 -5.202 -8.551 1.00 0.00 H new ATOM 0 HD2 PHE A 20 6.524 -3.112 -4.805 1.00 0.00 H new ATOM 0 HE1 PHE A 20 4.287 -5.590 -8.475 1.00 0.00 H new ATOM 0 HE2 PHE A 20 4.075 -3.497 -4.729 1.00 0.00 H new ATOM 0 HZ PHE A 20 2.958 -4.738 -6.563 1.00 0.00 H new ATOM 299 N LYS A 21 9.402 -6.710 -7.787 1.00 0.00 N ATOM 300 CA LYS A 21 9.107 -7.966 -8.533 1.00 0.00 C ATOM 301 C LYS A 21 9.486 -9.176 -7.676 1.00 0.00 C ATOM 302 O LYS A 21 8.726 -10.115 -7.542 1.00 0.00 O ATOM 303 CB LYS A 21 9.914 -7.984 -9.834 1.00 0.00 C ATOM 304 CG LYS A 21 9.428 -6.853 -10.742 1.00 0.00 C ATOM 305 CD LYS A 21 10.153 -6.929 -12.088 1.00 0.00 C ATOM 306 CE LYS A 21 9.748 -5.732 -12.952 1.00 0.00 C ATOM 307 NZ LYS A 21 10.824 -5.449 -13.945 1.00 0.00 N ATOM 0 H LYS A 21 10.203 -6.179 -8.130 1.00 0.00 H new ATOM 0 HA LYS A 21 8.043 -8.010 -8.764 1.00 0.00 H new ATOM 0 HB2 LYS A 21 10.976 -7.863 -9.619 1.00 0.00 H new ATOM 0 HB3 LYS A 21 9.797 -8.945 -10.335 1.00 0.00 H new ATOM 0 HG2 LYS A 21 8.351 -6.931 -10.892 1.00 0.00 H new ATOM 0 HG3 LYS A 21 9.615 -5.888 -10.270 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.232 -6.931 -11.933 1.00 0.00 H new ATOM 0 HD3 LYS A 21 9.902 -7.860 -12.597 1.00 0.00 H new ATOM 0 HE2 LYS A 21 8.810 -5.942 -13.466 1.00 0.00 H new ATOM 0 HE3 LYS A 21 9.579 -4.857 -12.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 10.549 -4.636 -14.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.710 -5.231 -13.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 10.965 -6.282 -14.551 1.00 0.00 H new ATOM 321 N ALA A 22 10.655 -9.164 -7.097 1.00 0.00 N ATOM 322 CA ALA A 22 11.080 -10.316 -6.251 1.00 0.00 C ATOM 323 C ALA A 22 10.345 -10.263 -4.910 1.00 0.00 C ATOM 324 O ALA A 22 10.083 -11.278 -4.295 1.00 0.00 O ATOM 325 CB ALA A 22 12.588 -10.241 -6.010 1.00 0.00 C ATOM 0 H ALA A 22 11.334 -8.407 -7.173 1.00 0.00 H new ATOM 0 HA ALA A 22 10.839 -11.249 -6.760 1.00 0.00 H new ATOM 0 HB1 ALA A 22 12.900 -11.083 -5.392 1.00 0.00 H new ATOM 0 HB2 ALA A 22 13.111 -10.279 -6.965 1.00 0.00 H new ATOM 0 HB3 ALA A 22 12.829 -9.308 -5.501 1.00 0.00 H new ATOM 331 N PHE A 23 10.009 -9.089 -4.451 1.00 0.00 N ATOM 332 CA PHE A 23 9.292 -8.974 -3.150 1.00 0.00 C ATOM 333 C PHE A 23 7.809 -9.291 -3.357 1.00 0.00 C ATOM 334 O PHE A 23 7.084 -9.560 -2.420 1.00 0.00 O ATOM 335 CB PHE A 23 9.440 -7.550 -2.610 1.00 0.00 C ATOM 336 CG PHE A 23 8.795 -7.457 -1.247 1.00 0.00 C ATOM 337 CD1 PHE A 23 7.431 -7.161 -1.136 1.00 0.00 C ATOM 338 CD2 PHE A 23 9.561 -7.664 -0.093 1.00 0.00 C ATOM 339 CE1 PHE A 23 6.834 -7.072 0.127 1.00 0.00 C ATOM 340 CE2 PHE A 23 8.963 -7.575 1.170 1.00 0.00 C ATOM 341 CZ PHE A 23 7.600 -7.280 1.280 1.00 0.00 C ATOM 0 H PHE A 23 10.200 -8.204 -4.921 1.00 0.00 H new ATOM 0 HA PHE A 23 9.718 -9.678 -2.436 1.00 0.00 H new ATOM 0 HB2 PHE A 23 10.495 -7.283 -2.544 1.00 0.00 H new ATOM 0 HB3 PHE A 23 8.974 -6.840 -3.294 1.00 0.00 H new ATOM 0 HD1 PHE A 23 6.839 -7.001 -2.025 1.00 0.00 H new ATOM 0 HD2 PHE A 23 10.613 -7.892 -0.177 1.00 0.00 H new ATOM 0 HE1 PHE A 23 5.782 -6.843 0.212 1.00 0.00 H new ATOM 0 HE2 PHE A 23 9.554 -7.734 2.060 1.00 0.00 H new ATOM 0 HZ PHE A 23 7.139 -7.213 2.254 1.00 0.00 H new ATOM 351 N VAL A 24 7.355 -9.263 -4.580 1.00 0.00 N ATOM 352 CA VAL A 24 5.921 -9.563 -4.849 1.00 0.00 C ATOM 353 C VAL A 24 5.818 -10.860 -5.656 1.00 0.00 C ATOM 354 O VAL A 24 5.232 -11.829 -5.217 1.00 0.00 O ATOM 355 CB VAL A 24 5.302 -8.414 -5.646 1.00 0.00 C ATOM 356 CG1 VAL A 24 3.832 -8.726 -5.933 1.00 0.00 C ATOM 357 CG2 VAL A 24 5.401 -7.122 -4.834 1.00 0.00 C ATOM 0 H VAL A 24 7.915 -9.045 -5.404 1.00 0.00 H new ATOM 0 HA VAL A 24 5.387 -9.678 -3.905 1.00 0.00 H new ATOM 0 HB VAL A 24 5.837 -8.294 -6.588 1.00 0.00 H new ATOM 0 HG11 VAL A 24 3.390 -7.907 -6.501 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.762 -9.648 -6.511 1.00 0.00 H new ATOM 0 HG13 VAL A 24 3.295 -8.846 -4.992 1.00 0.00 H new ATOM 0 HG21 VAL A 24 4.960 -6.302 -5.400 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.865 -7.242 -3.892 1.00 0.00 H new ATOM 0 HG23 VAL A 24 6.448 -6.900 -4.629 1.00 0.00 H new ATOM 367 N LEU A 25 6.387 -10.886 -6.830 1.00 0.00 N ATOM 368 CA LEU A 25 6.322 -12.123 -7.657 1.00 0.00 C ATOM 369 C LEU A 25 6.967 -13.277 -6.888 1.00 0.00 C ATOM 370 O LEU A 25 6.443 -14.373 -6.837 1.00 0.00 O ATOM 371 CB LEU A 25 7.077 -11.901 -8.969 1.00 0.00 C ATOM 372 CG LEU A 25 6.521 -10.664 -9.680 1.00 0.00 C ATOM 373 CD1 LEU A 25 7.141 -10.560 -11.075 1.00 0.00 C ATOM 374 CD2 LEU A 25 5.001 -10.784 -9.805 1.00 0.00 C ATOM 0 H LEU A 25 6.893 -10.106 -7.251 1.00 0.00 H new ATOM 0 HA LEU A 25 5.281 -12.363 -7.875 1.00 0.00 H new ATOM 0 HB2 LEU A 25 8.141 -11.771 -8.770 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.977 -12.777 -9.610 1.00 0.00 H new ATOM 0 HG LEU A 25 6.767 -9.772 -9.103 1.00 0.00 H new ATOM 0 HD11 LEU A 25 6.747 -9.680 -11.584 1.00 0.00 H new ATOM 0 HD12 LEU A 25 8.224 -10.473 -10.986 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.894 -11.452 -11.650 1.00 0.00 H new ATOM 0 HD21 LEU A 25 4.607 -9.903 -10.311 1.00 0.00 H new ATOM 0 HD22 LEU A 25 4.753 -11.675 -10.381 1.00 0.00 H new ATOM 0 HD23 LEU A 25 4.559 -10.860 -8.811 1.00 0.00 H new ATOM 386 N ASP A 26 8.100 -13.038 -6.284 1.00 0.00 N ATOM 387 CA ASP A 26 8.779 -14.118 -5.514 1.00 0.00 C ATOM 388 C ASP A 26 8.509 -13.922 -4.021 1.00 0.00 C ATOM 389 O ASP A 26 9.267 -14.361 -3.181 1.00 0.00 O ATOM 390 CB ASP A 26 10.287 -14.059 -5.768 1.00 0.00 C ATOM 391 CG ASP A 26 10.565 -14.287 -7.256 1.00 0.00 C ATOM 392 OD1 ASP A 26 9.657 -14.716 -7.948 1.00 0.00 O ATOM 393 OD2 ASP A 26 11.680 -14.028 -7.676 1.00 0.00 O ATOM 0 H ASP A 26 8.584 -12.140 -6.291 1.00 0.00 H new ATOM 0 HA ASP A 26 8.395 -15.087 -5.833 1.00 0.00 H new ATOM 0 HB2 ASP A 26 10.681 -13.091 -5.458 1.00 0.00 H new ATOM 0 HB3 ASP A 26 10.797 -14.816 -5.172 1.00 0.00 H new ATOM 398 N ALA A 27 7.436 -13.259 -3.684 1.00 0.00 N ATOM 399 CA ALA A 27 7.122 -13.032 -2.245 1.00 0.00 C ATOM 400 C ALA A 27 6.735 -14.359 -1.588 1.00 0.00 C ATOM 401 O ALA A 27 7.067 -14.617 -0.448 1.00 0.00 O ATOM 402 CB ALA A 27 5.959 -12.047 -2.128 1.00 0.00 C ATOM 0 H ALA A 27 6.764 -12.865 -4.343 1.00 0.00 H new ATOM 0 HA ALA A 27 7.999 -12.623 -1.743 1.00 0.00 H new ATOM 0 HB1 ALA A 27 5.728 -11.880 -1.076 1.00 0.00 H new ATOM 0 HB2 ALA A 27 6.235 -11.101 -2.594 1.00 0.00 H new ATOM 0 HB3 ALA A 27 5.083 -12.457 -2.631 1.00 0.00 H new ATOM 408 N ASP A 28 6.031 -15.201 -2.295 1.00 0.00 N ATOM 409 CA ASP A 28 5.623 -16.507 -1.705 1.00 0.00 C ATOM 410 C ASP A 28 6.850 -17.408 -1.553 1.00 0.00 C ATOM 411 O ASP A 28 6.941 -18.198 -0.635 1.00 0.00 O ATOM 412 CB ASP A 28 4.602 -17.185 -2.622 1.00 0.00 C ATOM 413 CG ASP A 28 4.059 -18.441 -1.939 1.00 0.00 C ATOM 414 OD1 ASP A 28 4.326 -18.614 -0.761 1.00 0.00 O ATOM 415 OD2 ASP A 28 3.384 -19.209 -2.605 1.00 0.00 O ATOM 0 H ASP A 28 5.722 -15.041 -3.254 1.00 0.00 H new ATOM 0 HA ASP A 28 5.176 -16.337 -0.726 1.00 0.00 H new ATOM 0 HB2 ASP A 28 3.786 -16.498 -2.846 1.00 0.00 H new ATOM 0 HB3 ASP A 28 5.068 -17.447 -3.572 1.00 0.00 H new ATOM 420 N ASN A 29 7.795 -17.298 -2.445 1.00 0.00 N ATOM 421 CA ASN A 29 9.014 -18.149 -2.347 1.00 0.00 C ATOM 422 C ASN A 29 10.110 -17.387 -1.598 1.00 0.00 C ATOM 423 O ASN A 29 10.939 -17.971 -0.928 1.00 0.00 O ATOM 424 CB ASN A 29 9.508 -18.499 -3.752 1.00 0.00 C ATOM 425 CG ASN A 29 8.478 -19.392 -4.446 1.00 0.00 C ATOM 426 OD1 ASN A 29 7.940 -20.382 -3.786 1.00 0.00 O flip ATOM 427 ND2 ASN A 29 8.158 -19.187 -5.600 1.00 0.00 N flip ATOM 0 H ASN A 29 7.776 -16.656 -3.237 1.00 0.00 H new ATOM 0 HA ASN A 29 8.773 -19.065 -1.808 1.00 0.00 H new ATOM 0 HB2 ASN A 29 9.665 -17.589 -4.331 1.00 0.00 H new ATOM 0 HB3 ASN A 29 10.469 -19.010 -3.695 1.00 0.00 H new ATOM 0 HD21 ASN A 29 8.578 -18.414 -6.116 1.00 0.00 H new ATOM 0 HD22 ASN A 29 7.469 -19.788 -6.053 1.00 0.00 H new ATOM 434 N LEU A 30 10.122 -16.088 -1.708 1.00 0.00 N ATOM 435 CA LEU A 30 11.163 -15.289 -1.003 1.00 0.00 C ATOM 436 C LEU A 30 10.994 -15.448 0.509 1.00 0.00 C ATOM 437 O LEU A 30 11.952 -15.625 1.234 1.00 0.00 O ATOM 438 CB LEU A 30 11.015 -13.813 -1.383 1.00 0.00 C ATOM 439 CG LEU A 30 12.062 -12.985 -0.634 1.00 0.00 C ATOM 440 CD1 LEU A 30 13.449 -13.585 -0.868 1.00 0.00 C ATOM 441 CD2 LEU A 30 12.034 -11.544 -1.147 1.00 0.00 C ATOM 0 H LEU A 30 9.455 -15.544 -2.256 1.00 0.00 H new ATOM 0 HA LEU A 30 12.152 -15.642 -1.295 1.00 0.00 H new ATOM 0 HB2 LEU A 30 11.140 -13.689 -2.459 1.00 0.00 H new ATOM 0 HB3 LEU A 30 10.013 -13.462 -1.136 1.00 0.00 H new ATOM 0 HG LEU A 30 11.839 -12.994 0.433 1.00 0.00 H new ATOM 0 HD11 LEU A 30 14.195 -12.996 -0.335 1.00 0.00 H new ATOM 0 HD12 LEU A 30 13.468 -14.611 -0.502 1.00 0.00 H new ATOM 0 HD13 LEU A 30 13.674 -13.576 -1.934 1.00 0.00 H new ATOM 0 HD21 LEU A 30 12.779 -10.954 -0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 30 12.257 -11.533 -2.214 1.00 0.00 H new ATOM 0 HD23 LEU A 30 11.045 -11.117 -0.979 1.00 0.00 H new ATOM 453 N ILE A 31 9.783 -15.388 0.991 1.00 0.00 N ATOM 454 CA ILE A 31 9.557 -15.537 2.456 1.00 0.00 C ATOM 455 C ILE A 31 10.286 -16.790 2.958 1.00 0.00 C ATOM 456 O ILE A 31 11.149 -16.712 3.810 1.00 0.00 O ATOM 457 CB ILE A 31 8.051 -15.651 2.729 1.00 0.00 C ATOM 458 CG1 ILE A 31 7.421 -14.256 2.687 1.00 0.00 C ATOM 459 CG2 ILE A 31 7.811 -16.270 4.108 1.00 0.00 C ATOM 460 CD1 ILE A 31 6.099 -14.317 1.919 1.00 0.00 C ATOM 0 H ILE A 31 8.941 -15.242 0.434 1.00 0.00 H new ATOM 0 HA ILE A 31 9.947 -14.666 2.983 1.00 0.00 H new ATOM 0 HB ILE A 31 7.599 -16.287 1.968 1.00 0.00 H new ATOM 0 HG12 ILE A 31 7.249 -13.892 3.700 1.00 0.00 H new ATOM 0 HG13 ILE A 31 8.101 -13.552 2.207 1.00 0.00 H new ATOM 0 HG21 ILE A 31 6.739 -16.346 4.291 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.257 -17.264 4.143 1.00 0.00 H new ATOM 0 HG23 ILE A 31 8.266 -15.641 4.873 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.650 -13.324 1.889 1.00 0.00 H new ATOM 0 HD12 ILE A 31 6.285 -14.663 0.902 1.00 0.00 H new ATOM 0 HD13 ILE A 31 5.420 -15.008 2.419 1.00 0.00 H new ATOM 472 N PRO A 32 9.934 -17.966 2.416 1.00 0.00 N ATOM 473 CA PRO A 32 10.562 -19.237 2.807 1.00 0.00 C ATOM 474 C PRO A 32 12.020 -19.318 2.345 1.00 0.00 C ATOM 475 O PRO A 32 12.784 -20.140 2.811 1.00 0.00 O ATOM 476 CB PRO A 32 9.726 -20.288 2.076 1.00 0.00 C ATOM 477 CG PRO A 32 9.151 -19.560 0.909 1.00 0.00 C ATOM 478 CD PRO A 32 8.902 -18.156 1.381 1.00 0.00 C ATOM 0 HA PRO A 32 10.585 -19.365 3.889 1.00 0.00 H new ATOM 0 HB2 PRO A 32 10.339 -21.131 1.756 1.00 0.00 H new ATOM 0 HB3 PRO A 32 8.943 -20.690 2.719 1.00 0.00 H new ATOM 0 HG2 PRO A 32 9.839 -19.572 0.064 1.00 0.00 H new ATOM 0 HG3 PRO A 32 8.226 -20.029 0.573 1.00 0.00 H new ATOM 0 HD2 PRO A 32 9.005 -17.434 0.571 1.00 0.00 H new ATOM 0 HD3 PRO A 32 7.897 -18.039 1.787 1.00 0.00 H new ATOM 486 N LYS A 33 12.409 -18.473 1.431 1.00 0.00 N ATOM 487 CA LYS A 33 13.815 -18.503 0.938 1.00 0.00 C ATOM 488 C LYS A 33 14.756 -18.030 2.048 1.00 0.00 C ATOM 489 O LYS A 33 15.826 -18.571 2.239 1.00 0.00 O ATOM 490 CB LYS A 33 13.951 -17.577 -0.271 1.00 0.00 C ATOM 491 CG LYS A 33 15.371 -17.678 -0.834 1.00 0.00 C ATOM 492 CD LYS A 33 15.492 -18.947 -1.679 1.00 0.00 C ATOM 493 CE LYS A 33 16.860 -18.974 -2.365 1.00 0.00 C ATOM 494 NZ LYS A 33 17.661 -20.112 -1.831 1.00 0.00 N ATOM 0 H LYS A 33 11.814 -17.763 1.004 1.00 0.00 H new ATOM 0 HA LYS A 33 14.076 -19.521 0.649 1.00 0.00 H new ATOM 0 HB2 LYS A 33 13.225 -17.851 -1.036 1.00 0.00 H new ATOM 0 HB3 LYS A 33 13.736 -16.549 0.019 1.00 0.00 H new ATOM 0 HG2 LYS A 33 15.597 -16.801 -1.440 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.096 -17.699 -0.021 1.00 0.00 H new ATOM 0 HD2 LYS A 33 15.371 -19.829 -1.050 1.00 0.00 H new ATOM 0 HD3 LYS A 33 14.698 -18.977 -2.425 1.00 0.00 H new ATOM 0 HE2 LYS A 33 16.736 -19.077 -3.443 1.00 0.00 H new ATOM 0 HE3 LYS A 33 17.384 -18.034 -2.192 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 18.591 -20.131 -2.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 17.790 -19.995 -0.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 17.162 -21.005 -2.018 1.00 0.00 H new ATOM 508 N ILE A 34 14.366 -17.023 2.781 1.00 0.00 N ATOM 509 CA ILE A 34 15.239 -16.517 3.875 1.00 0.00 C ATOM 510 C ILE A 34 15.339 -17.572 4.980 1.00 0.00 C ATOM 511 O ILE A 34 16.357 -17.711 5.628 1.00 0.00 O ATOM 512 CB ILE A 34 14.644 -15.230 4.449 1.00 0.00 C ATOM 513 CG1 ILE A 34 14.451 -14.211 3.324 1.00 0.00 C ATOM 514 CG2 ILE A 34 15.593 -14.654 5.501 1.00 0.00 C ATOM 515 CD1 ILE A 34 13.813 -12.941 3.890 1.00 0.00 C ATOM 0 H ILE A 34 13.480 -16.530 2.669 1.00 0.00 H new ATOM 0 HA ILE A 34 16.234 -16.312 3.479 1.00 0.00 H new ATOM 0 HB ILE A 34 13.681 -15.449 4.910 1.00 0.00 H new ATOM 0 HG12 ILE A 34 15.411 -13.975 2.864 1.00 0.00 H new ATOM 0 HG13 ILE A 34 13.818 -14.632 2.543 1.00 0.00 H new ATOM 0 HG21 ILE A 34 15.169 -13.737 5.910 1.00 0.00 H new ATOM 0 HG22 ILE A 34 15.731 -15.379 6.303 1.00 0.00 H new ATOM 0 HG23 ILE A 34 16.556 -14.435 5.041 1.00 0.00 H new ATOM 0 HD11 ILE A 34 13.675 -12.215 3.089 1.00 0.00 H new ATOM 0 HD12 ILE A 34 12.846 -13.184 4.329 1.00 0.00 H new ATOM 0 HD13 ILE A 34 14.463 -12.518 4.656 1.00 0.00 H new ATOM 527 N ALA A 35 14.291 -18.318 5.198 1.00 0.00 N ATOM 528 CA ALA A 35 14.329 -19.363 6.260 1.00 0.00 C ATOM 529 C ALA A 35 13.496 -20.568 5.820 1.00 0.00 C ATOM 530 O ALA A 35 12.431 -20.824 6.346 1.00 0.00 O ATOM 531 CB ALA A 35 13.753 -18.793 7.557 1.00 0.00 C ATOM 0 H ALA A 35 13.411 -18.249 4.687 1.00 0.00 H new ATOM 0 HA ALA A 35 15.360 -19.675 6.426 1.00 0.00 H new ATOM 0 HB1 ALA A 35 13.781 -19.557 8.334 1.00 0.00 H new ATOM 0 HB2 ALA A 35 14.346 -17.934 7.872 1.00 0.00 H new ATOM 0 HB3 ALA A 35 12.722 -18.481 7.391 1.00 0.00 H new ATOM 537 N PRO A 36 13.998 -21.325 4.833 1.00 0.00 N ATOM 538 CA PRO A 36 13.306 -22.511 4.316 1.00 0.00 C ATOM 539 C PRO A 36 13.304 -23.650 5.339 1.00 0.00 C ATOM 540 O PRO A 36 12.391 -24.450 5.392 1.00 0.00 O ATOM 541 CB PRO A 36 14.135 -22.906 3.094 1.00 0.00 C ATOM 542 CG PRO A 36 15.493 -22.352 3.367 1.00 0.00 C ATOM 543 CD PRO A 36 15.278 -21.084 4.146 1.00 0.00 C ATOM 0 HA PRO A 36 12.259 -22.310 4.087 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.166 -23.988 2.969 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.714 -22.491 2.178 1.00 0.00 H new ATOM 0 HG2 PRO A 36 16.096 -23.061 3.935 1.00 0.00 H new ATOM 0 HG3 PRO A 36 16.026 -22.153 2.438 1.00 0.00 H new ATOM 0 HD2 PRO A 36 16.087 -20.904 4.854 1.00 0.00 H new ATOM 0 HD3 PRO A 36 15.227 -20.213 3.492 1.00 0.00 H new ATOM 551 N GLN A 37 14.320 -23.726 6.154 1.00 0.00 N ATOM 552 CA GLN A 37 14.378 -24.807 7.177 1.00 0.00 C ATOM 553 C GLN A 37 13.292 -24.565 8.227 1.00 0.00 C ATOM 554 O GLN A 37 12.852 -25.474 8.901 1.00 0.00 O ATOM 555 CB GLN A 37 15.754 -24.802 7.847 1.00 0.00 C ATOM 556 CG GLN A 37 15.867 -23.591 8.776 1.00 0.00 C ATOM 557 CD GLN A 37 17.285 -23.518 9.347 1.00 0.00 C ATOM 558 OE1 GLN A 37 18.245 -23.781 8.651 1.00 0.00 O ATOM 559 NE2 GLN A 37 17.458 -23.169 10.592 1.00 0.00 N ATOM 0 H GLN A 37 15.113 -23.085 6.155 1.00 0.00 H new ATOM 0 HA GLN A 37 14.214 -25.774 6.701 1.00 0.00 H new ATOM 0 HB2 GLN A 37 15.898 -25.722 8.413 1.00 0.00 H new ATOM 0 HB3 GLN A 37 16.538 -24.768 7.091 1.00 0.00 H new ATOM 0 HG2 GLN A 37 15.636 -22.677 8.229 1.00 0.00 H new ATOM 0 HG3 GLN A 37 15.141 -23.671 9.585 1.00 0.00 H new ATOM 0 HE21 GLN A 37 16.652 -22.948 11.176 1.00 0.00 H new ATOM 0 HE22 GLN A 37 18.399 -23.117 10.981 1.00 0.00 H new ATOM 568 N ALA A 38 12.859 -23.342 8.368 1.00 0.00 N ATOM 569 CA ALA A 38 11.800 -23.037 9.370 1.00 0.00 C ATOM 570 C ALA A 38 10.426 -23.221 8.726 1.00 0.00 C ATOM 571 O ALA A 38 9.444 -23.472 9.396 1.00 0.00 O ATOM 572 CB ALA A 38 11.951 -21.590 9.846 1.00 0.00 C ATOM 0 H ALA A 38 13.193 -22.541 7.832 1.00 0.00 H new ATOM 0 HA ALA A 38 11.897 -23.711 10.221 1.00 0.00 H new ATOM 0 HB1 ALA A 38 11.176 -21.366 10.579 1.00 0.00 H new ATOM 0 HB2 ALA A 38 12.932 -21.458 10.302 1.00 0.00 H new ATOM 0 HB3 ALA A 38 11.852 -20.915 8.996 1.00 0.00 H new ATOM 578 N VAL A 39 10.350 -23.100 7.429 1.00 0.00 N ATOM 579 CA VAL A 39 9.041 -23.270 6.739 1.00 0.00 C ATOM 580 C VAL A 39 9.091 -24.520 5.858 1.00 0.00 C ATOM 581 O VAL A 39 10.040 -24.743 5.132 1.00 0.00 O ATOM 582 CB VAL A 39 8.760 -22.042 5.870 1.00 0.00 C ATOM 583 CG1 VAL A 39 7.270 -21.992 5.524 1.00 0.00 C ATOM 584 CG2 VAL A 39 9.148 -20.776 6.636 1.00 0.00 C ATOM 0 H VAL A 39 11.139 -22.891 6.817 1.00 0.00 H new ATOM 0 HA VAL A 39 8.249 -23.378 7.480 1.00 0.00 H new ATOM 0 HB VAL A 39 9.344 -22.105 4.952 1.00 0.00 H new ATOM 0 HG11 VAL A 39 7.069 -21.117 4.905 1.00 0.00 H new ATOM 0 HG12 VAL A 39 6.993 -22.894 4.978 1.00 0.00 H new ATOM 0 HG13 VAL A 39 6.685 -21.929 6.442 1.00 0.00 H new ATOM 0 HG21 VAL A 39 8.948 -19.901 6.018 1.00 0.00 H new ATOM 0 HG22 VAL A 39 8.564 -20.713 7.554 1.00 0.00 H new ATOM 0 HG23 VAL A 39 10.209 -20.811 6.883 1.00 0.00 H new ATOM 594 N LYS A 40 8.076 -25.340 5.917 1.00 0.00 N ATOM 595 CA LYS A 40 8.068 -26.576 5.084 1.00 0.00 C ATOM 596 C LYS A 40 7.851 -26.204 3.616 1.00 0.00 C ATOM 597 O LYS A 40 8.587 -26.622 2.745 1.00 0.00 O ATOM 598 CB LYS A 40 6.937 -27.495 5.551 1.00 0.00 C ATOM 599 CG LYS A 40 7.080 -28.861 4.878 1.00 0.00 C ATOM 600 CD LYS A 40 6.074 -29.840 5.489 1.00 0.00 C ATOM 601 CE LYS A 40 4.657 -29.439 5.074 1.00 0.00 C ATOM 602 NZ LYS A 40 3.957 -30.621 4.494 1.00 0.00 N ATOM 0 H LYS A 40 7.253 -25.207 6.505 1.00 0.00 H new ATOM 0 HA LYS A 40 9.023 -27.091 5.188 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.969 -27.606 6.635 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.971 -27.055 5.304 1.00 0.00 H new ATOM 0 HG2 LYS A 40 6.909 -28.769 3.805 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.095 -29.238 5.008 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.289 -30.855 5.155 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.161 -29.837 6.576 1.00 0.00 H new ATOM 0 HE2 LYS A 40 4.106 -29.064 5.936 1.00 0.00 H new ATOM 0 HE3 LYS A 40 4.695 -28.631 4.344 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 2.994 -30.350 4.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 4.480 -30.960 3.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 3.909 -31.379 5.204 1.00 0.00 H new ATOM 616 N CYS A 41 6.845 -25.421 3.335 1.00 0.00 N ATOM 617 CA CYS A 41 6.582 -25.023 1.923 1.00 0.00 C ATOM 618 C CYS A 41 5.322 -24.157 1.866 1.00 0.00 C ATOM 619 O CYS A 41 4.295 -24.503 2.415 1.00 0.00 O ATOM 620 CB CYS A 41 6.381 -26.276 1.069 1.00 0.00 C ATOM 621 SG CYS A 41 7.418 -26.171 -0.410 1.00 0.00 S ATOM 0 H CYS A 41 6.194 -25.040 4.022 1.00 0.00 H new ATOM 0 HA CYS A 41 7.430 -24.456 1.540 1.00 0.00 H new ATOM 0 HB2 CYS A 41 6.638 -27.166 1.644 1.00 0.00 H new ATOM 0 HB3 CYS A 41 5.333 -26.371 0.785 1.00 0.00 H new ATOM 0 HG CYS A 41 7.249 -27.237 -1.135 1.00 0.00 H new ATOM 627 N ALA A 42 5.391 -23.035 1.204 1.00 0.00 N ATOM 628 CA ALA A 42 4.197 -22.149 1.113 1.00 0.00 C ATOM 629 C ALA A 42 3.427 -22.462 -0.173 1.00 0.00 C ATOM 630 O ALA A 42 3.974 -22.427 -1.258 1.00 0.00 O ATOM 631 CB ALA A 42 4.645 -20.687 1.097 1.00 0.00 C ATOM 0 H ALA A 42 6.223 -22.694 0.722 1.00 0.00 H new ATOM 0 HA ALA A 42 3.551 -22.320 1.974 1.00 0.00 H new ATOM 0 HB1 ALA A 42 3.771 -20.039 1.030 1.00 0.00 H new ATOM 0 HB2 ALA A 42 5.193 -20.464 2.013 1.00 0.00 H new ATOM 0 HB3 ALA A 42 5.291 -20.514 0.236 1.00 0.00 H new ATOM 637 N GLU A 43 2.164 -22.768 -0.059 1.00 0.00 N ATOM 638 CA GLU A 43 1.362 -23.081 -1.275 1.00 0.00 C ATOM 639 C GLU A 43 0.185 -22.110 -1.374 1.00 0.00 C ATOM 640 O GLU A 43 -0.365 -21.681 -0.379 1.00 0.00 O ATOM 641 CB GLU A 43 0.834 -24.515 -1.182 1.00 0.00 C ATOM 642 CG GLU A 43 2.008 -25.481 -1.015 1.00 0.00 C ATOM 643 CD GLU A 43 1.481 -26.914 -0.924 1.00 0.00 C ATOM 644 OE1 GLU A 43 0.281 -27.074 -0.778 1.00 0.00 O ATOM 645 OE2 GLU A 43 2.286 -27.827 -1.002 1.00 0.00 O ATOM 0 H GLU A 43 1.653 -22.815 0.823 1.00 0.00 H new ATOM 0 HA GLU A 43 1.990 -22.981 -2.160 1.00 0.00 H new ATOM 0 HB2 GLU A 43 0.150 -24.608 -0.338 1.00 0.00 H new ATOM 0 HB3 GLU A 43 0.269 -24.765 -2.080 1.00 0.00 H new ATOM 0 HG2 GLU A 43 2.693 -25.387 -1.858 1.00 0.00 H new ATOM 0 HG3 GLU A 43 2.572 -25.232 -0.116 1.00 0.00 H new ATOM 652 N ILE A 44 -0.207 -21.760 -2.569 1.00 0.00 N ATOM 653 CA ILE A 44 -1.348 -20.816 -2.733 1.00 0.00 C ATOM 654 C ILE A 44 -2.591 -21.589 -3.179 1.00 0.00 C ATOM 655 O ILE A 44 -2.614 -22.189 -4.235 1.00 0.00 O ATOM 656 CB ILE A 44 -0.993 -19.767 -3.788 1.00 0.00 C ATOM 657 CG1 ILE A 44 0.337 -19.105 -3.423 1.00 0.00 C ATOM 658 CG2 ILE A 44 -2.093 -18.705 -3.842 1.00 0.00 C ATOM 659 CD1 ILE A 44 0.768 -18.169 -4.555 1.00 0.00 C ATOM 0 H ILE A 44 0.214 -22.087 -3.439 1.00 0.00 H new ATOM 0 HA ILE A 44 -1.550 -20.322 -1.783 1.00 0.00 H new ATOM 0 HB ILE A 44 -0.904 -20.248 -4.762 1.00 0.00 H new ATOM 0 HG12 ILE A 44 0.234 -18.545 -2.493 1.00 0.00 H new ATOM 0 HG13 ILE A 44 1.100 -19.865 -3.255 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -1.840 -17.957 -4.594 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.041 -19.176 -4.103 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -2.183 -18.224 -2.868 1.00 0.00 H new ATOM 0 HD11 ILE A 44 1.716 -17.697 -4.296 1.00 0.00 H new ATOM 0 HD12 ILE A 44 0.887 -18.741 -5.475 1.00 0.00 H new ATOM 0 HD13 ILE A 44 0.008 -17.401 -4.702 1.00 0.00 H new ATOM 671 N LEU A 45 -3.624 -21.579 -2.383 1.00 0.00 N ATOM 672 CA LEU A 45 -4.863 -22.313 -2.763 1.00 0.00 C ATOM 673 C LEU A 45 -5.450 -21.695 -4.035 1.00 0.00 C ATOM 674 O LEU A 45 -5.846 -22.391 -4.949 1.00 0.00 O ATOM 675 CB LEU A 45 -5.886 -22.212 -1.630 1.00 0.00 C ATOM 676 CG LEU A 45 -5.426 -23.067 -0.447 1.00 0.00 C ATOM 677 CD1 LEU A 45 -4.308 -22.340 0.303 1.00 0.00 C ATOM 678 CD2 LEU A 45 -6.604 -23.304 0.499 1.00 0.00 C ATOM 0 H LEU A 45 -3.664 -21.095 -1.486 1.00 0.00 H new ATOM 0 HA LEU A 45 -4.623 -23.361 -2.943 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -5.999 -21.173 -1.319 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.863 -22.549 -1.977 1.00 0.00 H new ATOM 0 HG LEU A 45 -5.055 -24.025 -0.813 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -3.980 -22.948 1.146 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -3.468 -22.170 -0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.678 -21.382 0.669 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.277 -23.913 1.342 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -6.975 -22.347 0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.401 -23.822 -0.035 1.00 0.00 H new ATOM 690 N GLU A 46 -5.507 -20.393 -4.100 1.00 0.00 N ATOM 691 CA GLU A 46 -6.067 -19.731 -5.311 1.00 0.00 C ATOM 692 C GLU A 46 -5.565 -18.287 -5.380 1.00 0.00 C ATOM 693 O GLU A 46 -5.217 -17.692 -4.380 1.00 0.00 O ATOM 694 CB GLU A 46 -7.595 -19.736 -5.236 1.00 0.00 C ATOM 695 CG GLU A 46 -8.103 -21.179 -5.249 1.00 0.00 C ATOM 696 CD GLU A 46 -9.624 -21.183 -5.411 1.00 0.00 C ATOM 697 OE1 GLU A 46 -10.210 -20.116 -5.335 1.00 0.00 O ATOM 698 OE2 GLU A 46 -10.176 -22.253 -5.609 1.00 0.00 O ATOM 0 H GLU A 46 -5.190 -19.759 -3.366 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.746 -20.271 -6.201 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -7.927 -19.231 -4.329 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -8.013 -19.185 -6.079 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -7.638 -21.732 -6.065 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -7.824 -21.682 -4.323 1.00 0.00 H new ATOM 705 N GLY A 47 -5.525 -17.719 -6.555 1.00 0.00 N ATOM 706 CA GLY A 47 -5.047 -16.314 -6.687 1.00 0.00 C ATOM 707 C GLY A 47 -3.640 -16.309 -7.291 1.00 0.00 C ATOM 708 O GLY A 47 -3.321 -15.498 -8.137 1.00 0.00 O ATOM 0 H GLY A 47 -5.803 -18.167 -7.428 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -5.728 -15.745 -7.320 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -5.037 -15.829 -5.711 1.00 0.00 H new ATOM 712 N ASP A 48 -2.797 -17.208 -6.862 1.00 0.00 N ATOM 713 CA ASP A 48 -1.413 -17.256 -7.410 1.00 0.00 C ATOM 714 C ASP A 48 -0.694 -15.941 -7.098 1.00 0.00 C ATOM 715 O ASP A 48 0.099 -15.456 -7.880 1.00 0.00 O ATOM 716 CB ASP A 48 -1.470 -17.458 -8.926 1.00 0.00 C ATOM 717 CG ASP A 48 -2.015 -18.854 -9.234 1.00 0.00 C ATOM 718 OD1 ASP A 48 -2.135 -19.640 -8.308 1.00 0.00 O ATOM 719 OD2 ASP A 48 -2.304 -19.113 -10.390 1.00 0.00 O ATOM 0 H ASP A 48 -3.008 -17.912 -6.155 1.00 0.00 H new ATOM 0 HA ASP A 48 -0.871 -18.084 -6.953 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.106 -16.699 -9.381 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.476 -17.341 -9.357 1.00 0.00 H new ATOM 724 N GLY A 49 -0.966 -15.361 -5.962 1.00 0.00 N ATOM 725 CA GLY A 49 -0.298 -14.079 -5.601 1.00 0.00 C ATOM 726 C GLY A 49 -1.107 -12.908 -6.162 1.00 0.00 C ATOM 727 O GLY A 49 -0.561 -11.895 -6.554 1.00 0.00 O ATOM 0 H GLY A 49 -1.622 -15.719 -5.268 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -0.215 -13.992 -4.518 1.00 0.00 H new ATOM 0 HA3 GLY A 49 0.716 -14.059 -6.001 1.00 0.00 H new ATOM 731 N GLY A 50 -2.405 -13.037 -6.204 1.00 0.00 N ATOM 732 CA GLY A 50 -3.246 -11.931 -6.740 1.00 0.00 C ATOM 733 C GLY A 50 -4.229 -11.469 -5.662 1.00 0.00 C ATOM 734 O GLY A 50 -4.057 -11.749 -4.493 1.00 0.00 O ATOM 0 H GLY A 50 -2.919 -13.860 -5.890 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -2.615 -11.099 -7.053 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -3.790 -12.268 -7.623 1.00 0.00 H new ATOM 738 N PRO A 51 -5.281 -10.746 -6.072 1.00 0.00 N ATOM 739 CA PRO A 51 -6.303 -10.238 -5.148 1.00 0.00 C ATOM 740 C PRO A 51 -7.172 -11.365 -4.585 1.00 0.00 C ATOM 741 O PRO A 51 -7.680 -12.195 -5.314 1.00 0.00 O ATOM 742 CB PRO A 51 -7.149 -9.312 -6.022 1.00 0.00 C ATOM 743 CG PRO A 51 -6.959 -9.830 -7.409 1.00 0.00 C ATOM 744 CD PRO A 51 -5.557 -10.368 -7.469 1.00 0.00 C ATOM 0 HA PRO A 51 -5.861 -9.743 -4.283 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -8.198 -9.339 -5.729 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -6.821 -8.276 -5.937 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -7.685 -10.611 -7.636 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -7.103 -9.038 -8.143 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -5.483 -11.224 -8.140 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -4.853 -9.618 -7.830 1.00 0.00 H new ATOM 752 N GLY A 52 -7.349 -11.401 -3.292 1.00 0.00 N ATOM 753 CA GLY A 52 -8.185 -12.474 -2.684 1.00 0.00 C ATOM 754 C GLY A 52 -7.464 -13.817 -2.810 1.00 0.00 C ATOM 755 O GLY A 52 -8.085 -14.858 -2.909 1.00 0.00 O ATOM 0 H GLY A 52 -6.951 -10.734 -2.631 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.377 -12.249 -1.635 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.153 -12.521 -3.182 1.00 0.00 H new ATOM 759 N THR A 53 -6.160 -13.806 -2.807 1.00 0.00 N ATOM 760 CA THR A 53 -5.403 -15.083 -2.926 1.00 0.00 C ATOM 761 C THR A 53 -5.236 -15.707 -1.539 1.00 0.00 C ATOM 762 O THR A 53 -5.052 -15.016 -0.556 1.00 0.00 O ATOM 763 CB THR A 53 -4.023 -14.806 -3.527 1.00 0.00 C ATOM 764 OG1 THR A 53 -4.177 -14.159 -4.783 1.00 0.00 O ATOM 765 CG2 THR A 53 -3.274 -16.126 -3.718 1.00 0.00 C ATOM 0 H THR A 53 -5.586 -12.967 -2.727 1.00 0.00 H new ATOM 0 HA THR A 53 -5.950 -15.769 -3.572 1.00 0.00 H new ATOM 0 HB THR A 53 -3.455 -14.163 -2.855 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.627 -13.298 -4.654 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.291 -15.928 -4.146 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.157 -16.621 -2.754 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.839 -16.771 -4.390 1.00 0.00 H new ATOM 773 N ILE A 54 -5.300 -17.007 -1.450 1.00 0.00 N ATOM 774 CA ILE A 54 -5.144 -17.671 -0.125 1.00 0.00 C ATOM 775 C ILE A 54 -3.822 -18.437 -0.093 1.00 0.00 C ATOM 776 O ILE A 54 -3.498 -19.173 -1.004 1.00 0.00 O ATOM 777 CB ILE A 54 -6.303 -18.644 0.099 1.00 0.00 C ATOM 778 CG1 ILE A 54 -7.629 -17.932 -0.176 1.00 0.00 C ATOM 779 CG2 ILE A 54 -6.281 -19.138 1.546 1.00 0.00 C ATOM 780 CD1 ILE A 54 -7.667 -16.609 0.592 1.00 0.00 C ATOM 0 H ILE A 54 -5.453 -17.638 -2.237 1.00 0.00 H new ATOM 0 HA ILE A 54 -5.147 -16.917 0.662 1.00 0.00 H new ATOM 0 HB ILE A 54 -6.200 -19.493 -0.577 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -7.740 -17.748 -1.245 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -8.463 -18.565 0.127 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -7.107 -19.831 1.706 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -5.337 -19.646 1.743 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -6.384 -18.289 2.222 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -8.612 -16.102 0.396 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -7.575 -16.806 1.660 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -6.841 -15.976 0.267 1.00 0.00 H new ATOM 792 N LYS A 55 -3.055 -18.271 0.949 1.00 0.00 N ATOM 793 CA LYS A 55 -1.754 -18.991 1.037 1.00 0.00 C ATOM 794 C LYS A 55 -1.721 -19.833 2.315 1.00 0.00 C ATOM 795 O LYS A 55 -2.273 -19.460 3.330 1.00 0.00 O ATOM 796 CB LYS A 55 -0.612 -17.974 1.070 1.00 0.00 C ATOM 797 CG LYS A 55 -0.679 -17.091 -0.177 1.00 0.00 C ATOM 798 CD LYS A 55 0.535 -16.160 -0.207 1.00 0.00 C ATOM 799 CE LYS A 55 0.449 -15.252 -1.435 1.00 0.00 C ATOM 800 NZ LYS A 55 1.800 -14.706 -1.746 1.00 0.00 N ATOM 0 H LYS A 55 -3.273 -17.668 1.743 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.640 -19.642 0.170 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.684 -17.360 1.968 1.00 0.00 H new ATOM 0 HB3 LYS A 55 0.347 -18.490 1.112 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.698 -17.710 -1.074 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -1.599 -16.507 -0.173 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.569 -15.559 0.702 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.455 -16.744 -0.237 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.066 -15.812 -2.288 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -0.250 -14.437 -1.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.745 -13.671 -1.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.460 -14.957 -0.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 2.139 -15.108 -2.643 1.00 0.00 H new ATOM 814 N LYS A 56 -1.073 -20.964 2.272 1.00 0.00 N ATOM 815 CA LYS A 56 -1.000 -21.826 3.485 1.00 0.00 C ATOM 816 C LYS A 56 0.462 -22.172 3.771 1.00 0.00 C ATOM 817 O LYS A 56 1.142 -22.761 2.954 1.00 0.00 O ATOM 818 CB LYS A 56 -1.794 -23.113 3.248 1.00 0.00 C ATOM 819 CG LYS A 56 -1.833 -23.932 4.540 1.00 0.00 C ATOM 820 CD LYS A 56 -2.582 -25.244 4.292 1.00 0.00 C ATOM 821 CE LYS A 56 -2.748 -25.993 5.616 1.00 0.00 C ATOM 822 NZ LYS A 56 -3.967 -26.850 5.554 1.00 0.00 N ATOM 0 H LYS A 56 -0.591 -21.328 1.450 1.00 0.00 H new ATOM 0 HA LYS A 56 -1.423 -21.294 4.337 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -2.807 -22.874 2.925 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.334 -23.695 2.449 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -0.819 -24.139 4.882 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -2.326 -23.363 5.329 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -3.558 -25.041 3.852 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.033 -25.860 3.580 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -1.869 -26.607 5.811 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -2.831 -25.284 6.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -4.080 -27.359 6.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -4.802 -26.254 5.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -3.870 -27.536 4.778 1.00 0.00 H new ATOM 836 N ILE A 57 0.954 -21.809 4.924 1.00 0.00 N ATOM 837 CA ILE A 57 2.374 -22.116 5.257 1.00 0.00 C ATOM 838 C ILE A 57 2.426 -23.049 6.468 1.00 0.00 C ATOM 839 O ILE A 57 1.841 -22.778 7.498 1.00 0.00 O ATOM 840 CB ILE A 57 3.113 -20.816 5.582 1.00 0.00 C ATOM 841 CG1 ILE A 57 2.878 -19.802 4.462 1.00 0.00 C ATOM 842 CG2 ILE A 57 4.612 -21.099 5.707 1.00 0.00 C ATOM 843 CD1 ILE A 57 2.967 -18.385 5.031 1.00 0.00 C ATOM 0 H ILE A 57 0.435 -21.314 5.649 1.00 0.00 H new ATOM 0 HA ILE A 57 2.850 -22.602 4.405 1.00 0.00 H new ATOM 0 HB ILE A 57 2.739 -20.411 6.523 1.00 0.00 H new ATOM 0 HG12 ILE A 57 3.619 -19.936 3.674 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.899 -19.963 4.010 1.00 0.00 H new ATOM 0 HG21 ILE A 57 5.139 -20.173 5.938 1.00 0.00 H new ATOM 0 HG22 ILE A 57 4.780 -21.822 6.505 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.986 -21.504 4.766 1.00 0.00 H new ATOM 0 HD11 ILE A 57 2.800 -17.661 4.233 1.00 0.00 H new ATOM 0 HD12 ILE A 57 2.209 -18.255 5.804 1.00 0.00 H new ATOM 0 HD13 ILE A 57 3.956 -18.227 5.462 1.00 0.00 H new ATOM 855 N THR A 58 3.124 -24.146 6.355 1.00 0.00 N ATOM 856 CA THR A 58 3.216 -25.097 7.498 1.00 0.00 C ATOM 857 C THR A 58 4.623 -25.040 8.094 1.00 0.00 C ATOM 858 O THR A 58 5.609 -25.171 7.395 1.00 0.00 O ATOM 859 CB THR A 58 2.927 -26.516 7.006 1.00 0.00 C ATOM 860 OG1 THR A 58 1.624 -26.563 6.441 1.00 0.00 O ATOM 861 CG2 THR A 58 3.011 -27.494 8.180 1.00 0.00 C ATOM 0 H THR A 58 3.636 -24.425 5.518 1.00 0.00 H new ATOM 0 HA THR A 58 2.487 -24.822 8.260 1.00 0.00 H new ATOM 0 HB THR A 58 3.662 -26.795 6.251 1.00 0.00 H new ATOM 0 HG1 THR A 58 1.438 -27.471 6.124 1.00 0.00 H new ATOM 0 HG21 THR A 58 2.805 -28.504 7.827 1.00 0.00 H new ATOM 0 HG22 THR A 58 4.011 -27.458 8.613 1.00 0.00 H new ATOM 0 HG23 THR A 58 2.277 -27.217 8.937 1.00 0.00 H new ATOM 869 N PHE A 59 4.727 -24.847 9.380 1.00 0.00 N ATOM 870 CA PHE A 59 6.072 -24.783 10.018 1.00 0.00 C ATOM 871 C PHE A 59 6.319 -26.061 10.821 1.00 0.00 C ATOM 872 O PHE A 59 5.429 -26.587 11.460 1.00 0.00 O ATOM 873 CB PHE A 59 6.136 -23.573 10.952 1.00 0.00 C ATOM 874 CG PHE A 59 5.825 -22.318 10.172 1.00 0.00 C ATOM 875 CD1 PHE A 59 6.842 -21.664 9.466 1.00 0.00 C ATOM 876 CD2 PHE A 59 4.522 -21.809 10.154 1.00 0.00 C ATOM 877 CE1 PHE A 59 6.554 -20.500 8.743 1.00 0.00 C ATOM 878 CE2 PHE A 59 4.234 -20.645 9.431 1.00 0.00 C ATOM 879 CZ PHE A 59 5.250 -19.991 8.725 1.00 0.00 C ATOM 0 H PHE A 59 3.939 -24.731 10.017 1.00 0.00 H new ATOM 0 HA PHE A 59 6.835 -24.687 9.246 1.00 0.00 H new ATOM 0 HB2 PHE A 59 5.424 -23.692 11.769 1.00 0.00 H new ATOM 0 HB3 PHE A 59 7.126 -23.499 11.401 1.00 0.00 H new ATOM 0 HD1 PHE A 59 7.848 -22.057 9.479 1.00 0.00 H new ATOM 0 HD2 PHE A 59 3.738 -22.314 10.698 1.00 0.00 H new ATOM 0 HE1 PHE A 59 7.338 -19.995 8.199 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.228 -20.252 9.418 1.00 0.00 H new ATOM 0 HZ PHE A 59 5.028 -19.094 8.166 1.00 0.00 H new ATOM 974 N TYR A 67 0.668 -24.058 11.277 1.00 0.00 N ATOM 975 CA TYR A 67 0.669 -23.455 9.915 1.00 0.00 C ATOM 976 C TYR A 67 -0.193 -22.192 9.916 1.00 0.00 C ATOM 977 O TYR A 67 -1.205 -22.119 10.586 1.00 0.00 O ATOM 978 CB TYR A 67 0.100 -24.461 8.912 1.00 0.00 C ATOM 979 CG TYR A 67 -1.380 -24.633 9.159 1.00 0.00 C ATOM 980 CD1 TYR A 67 -1.829 -25.578 10.089 1.00 0.00 C ATOM 981 CD2 TYR A 67 -2.303 -23.848 8.459 1.00 0.00 C ATOM 982 CE1 TYR A 67 -3.201 -25.739 10.318 1.00 0.00 C ATOM 983 CE2 TYR A 67 -3.675 -24.009 8.687 1.00 0.00 C ATOM 984 CZ TYR A 67 -4.123 -24.954 9.617 1.00 0.00 C ATOM 985 OH TYR A 67 -5.476 -25.112 9.843 1.00 0.00 O ATOM 0 HA TYR A 67 1.690 -23.197 9.632 1.00 0.00 H new ATOM 0 HB2 TYR A 67 0.272 -24.113 7.894 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.610 -25.419 9.012 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.117 -26.183 10.630 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.957 -23.118 7.743 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.547 -26.469 11.035 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -4.387 -23.404 8.145 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.977 -24.489 9.276 1.00 0.00 H new ATOM 995 N VAL A 68 0.198 -21.196 9.171 1.00 0.00 N ATOM 996 CA VAL A 68 -0.599 -19.938 9.129 1.00 0.00 C ATOM 997 C VAL A 68 -1.022 -19.654 7.686 1.00 0.00 C ATOM 998 O VAL A 68 -0.324 -19.982 6.747 1.00 0.00 O ATOM 999 CB VAL A 68 0.253 -18.780 9.655 1.00 0.00 C ATOM 1000 CG1 VAL A 68 0.960 -19.216 10.939 1.00 0.00 C ATOM 1001 CG2 VAL A 68 1.298 -18.389 8.607 1.00 0.00 C ATOM 0 H VAL A 68 1.036 -21.199 8.589 1.00 0.00 H new ATOM 0 HA VAL A 68 -1.487 -20.044 9.752 1.00 0.00 H new ATOM 0 HB VAL A 68 -0.388 -17.923 9.861 1.00 0.00 H new ATOM 0 HG11 VAL A 68 1.568 -18.394 11.317 1.00 0.00 H new ATOM 0 HG12 VAL A 68 0.217 -19.492 11.688 1.00 0.00 H new ATOM 0 HG13 VAL A 68 1.599 -20.073 10.729 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.902 -17.564 8.986 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.941 -19.244 8.398 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.796 -18.080 7.690 1.00 0.00 H new ATOM 1011 N LYS A 69 -2.164 -19.051 7.501 1.00 0.00 N ATOM 1012 CA LYS A 69 -2.628 -18.752 6.118 1.00 0.00 C ATOM 1013 C LYS A 69 -2.526 -17.249 5.853 1.00 0.00 C ATOM 1014 O LYS A 69 -2.808 -16.437 6.713 1.00 0.00 O ATOM 1015 CB LYS A 69 -4.082 -19.199 5.960 1.00 0.00 C ATOM 1016 CG LYS A 69 -4.169 -20.718 6.127 1.00 0.00 C ATOM 1017 CD LYS A 69 -5.590 -21.185 5.808 1.00 0.00 C ATOM 1018 CE LYS A 69 -5.706 -22.687 6.077 1.00 0.00 C ATOM 1019 NZ LYS A 69 -6.555 -23.315 5.026 1.00 0.00 N ATOM 0 H LYS A 69 -2.794 -18.753 8.246 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.002 -19.288 5.405 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -4.709 -18.704 6.702 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -4.459 -18.908 4.980 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -3.456 -21.209 5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.903 -20.998 7.146 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -6.309 -20.639 6.418 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -5.829 -20.972 4.766 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.716 -23.144 6.082 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -6.141 -22.859 7.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -6.634 -24.336 5.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -7.502 -22.886 5.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -6.122 -23.162 4.093 1.00 0.00 H new ATOM 1033 N HIS A 70 -2.130 -16.873 4.669 1.00 0.00 N ATOM 1034 CA HIS A 70 -2.015 -15.424 4.345 1.00 0.00 C ATOM 1035 C HIS A 70 -2.945 -15.096 3.176 1.00 0.00 C ATOM 1036 O HIS A 70 -2.978 -15.797 2.183 1.00 0.00 O ATOM 1037 CB HIS A 70 -0.572 -15.098 3.953 1.00 0.00 C ATOM 1038 CG HIS A 70 0.308 -15.156 5.172 1.00 0.00 C ATOM 1039 ND1 HIS A 70 0.931 -16.325 5.578 1.00 0.00 N ATOM 1040 CD2 HIS A 70 0.688 -14.195 6.075 1.00 0.00 C ATOM 1041 CE1 HIS A 70 1.646 -16.040 6.682 1.00 0.00 C ATOM 1042 NE2 HIS A 70 1.533 -14.755 7.028 1.00 0.00 N ATOM 0 H HIS A 70 -1.881 -17.508 3.911 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.295 -14.832 5.216 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -0.219 -15.806 3.204 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -0.522 -14.107 3.503 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.378 -13.161 6.050 1.00 0.00 H new ATOM 0 HE1 HIS A 70 2.239 -16.763 7.223 1.00 0.00 H new ATOM 0 HE2 HIS A 70 1.972 -14.285 7.820 1.00 0.00 H new ATOM 1050 N LYS A 71 -3.703 -14.040 3.281 1.00 0.00 N ATOM 1051 CA LYS A 71 -4.628 -13.678 2.171 1.00 0.00 C ATOM 1052 C LYS A 71 -4.216 -12.330 1.576 1.00 0.00 C ATOM 1053 O LYS A 71 -3.849 -11.413 2.284 1.00 0.00 O ATOM 1054 CB LYS A 71 -6.057 -13.581 2.706 1.00 0.00 C ATOM 1055 CG LYS A 71 -7.019 -13.346 1.540 1.00 0.00 C ATOM 1056 CD LYS A 71 -8.430 -13.104 2.081 1.00 0.00 C ATOM 1057 CE LYS A 71 -9.424 -13.074 0.919 1.00 0.00 C ATOM 1058 NZ LYS A 71 -10.248 -11.837 1.003 1.00 0.00 N ATOM 0 H LYS A 71 -3.722 -13.413 4.086 1.00 0.00 H new ATOM 0 HA LYS A 71 -4.579 -14.445 1.398 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -6.323 -14.497 3.233 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -6.134 -12.766 3.426 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -6.692 -12.488 0.952 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -7.017 -14.209 0.874 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -8.701 -13.891 2.785 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -8.465 -12.162 2.628 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -8.890 -13.105 -0.031 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -10.066 -13.954 0.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -10.924 -11.816 0.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -10.768 -11.826 1.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -9.629 -11.003 0.951 1.00 0.00 H new ATOM 1072 N ILE A 72 -4.275 -12.204 0.278 1.00 0.00 N ATOM 1073 CA ILE A 72 -3.889 -10.916 -0.365 1.00 0.00 C ATOM 1074 C ILE A 72 -5.148 -10.099 -0.663 1.00 0.00 C ATOM 1075 O ILE A 72 -6.137 -10.618 -1.140 1.00 0.00 O ATOM 1076 CB ILE A 72 -3.145 -11.200 -1.672 1.00 0.00 C ATOM 1077 CG1 ILE A 72 -1.949 -12.112 -1.393 1.00 0.00 C ATOM 1078 CG2 ILE A 72 -2.654 -9.883 -2.274 1.00 0.00 C ATOM 1079 CD1 ILE A 72 -1.279 -12.492 -2.715 1.00 0.00 C ATOM 0 H ILE A 72 -4.574 -12.937 -0.365 1.00 0.00 H new ATOM 0 HA ILE A 72 -3.240 -10.354 0.307 1.00 0.00 H new ATOM 0 HB ILE A 72 -3.819 -11.692 -2.374 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.235 -11.605 -0.744 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.277 -13.009 -0.868 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.124 -10.084 -3.205 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.507 -9.234 -2.475 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -1.981 -9.391 -1.572 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -0.427 -13.142 -2.517 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -1.995 -13.015 -3.349 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -0.937 -11.590 -3.222 1.00 0.00 H new ATOM 1091 N HIS A 73 -5.119 -8.825 -0.385 1.00 0.00 N ATOM 1092 CA HIS A 73 -6.314 -7.977 -0.653 1.00 0.00 C ATOM 1093 C HIS A 73 -6.227 -7.407 -2.070 1.00 0.00 C ATOM 1094 O HIS A 73 -7.175 -7.455 -2.829 1.00 0.00 O ATOM 1095 CB HIS A 73 -6.362 -6.830 0.358 1.00 0.00 C ATOM 1096 CG HIS A 73 -6.689 -7.377 1.721 1.00 0.00 C ATOM 1097 ND1 HIS A 73 -7.894 -8.002 1.997 1.00 0.00 N ATOM 1098 CD2 HIS A 73 -5.977 -7.399 2.894 1.00 0.00 C ATOM 1099 CE1 HIS A 73 -7.873 -8.371 3.291 1.00 0.00 C ATOM 1100 NE2 HIS A 73 -6.727 -8.027 3.884 1.00 0.00 N ATOM 0 H HIS A 73 -4.320 -8.335 0.016 1.00 0.00 H new ATOM 0 HA HIS A 73 -7.217 -8.580 -0.560 1.00 0.00 H new ATOM 0 HB2 HIS A 73 -5.403 -6.312 0.383 1.00 0.00 H new ATOM 0 HB3 HIS A 73 -7.112 -6.098 0.058 1.00 0.00 H new ATOM 0 HD1 HIS A 73 -8.658 -8.155 1.339 1.00 0.00 H new ATOM 0 HD2 HIS A 73 -4.986 -6.991 3.028 1.00 0.00 H new ATOM 0 HE1 HIS A 73 -8.683 -8.883 3.789 1.00 0.00 H new ATOM 1108 N SER A 74 -5.097 -6.866 -2.433 1.00 0.00 N ATOM 1109 CA SER A 74 -4.949 -6.294 -3.800 1.00 0.00 C ATOM 1110 C SER A 74 -3.480 -5.948 -4.053 1.00 0.00 C ATOM 1111 O SER A 74 -2.706 -5.777 -3.131 1.00 0.00 O ATOM 1112 CB SER A 74 -5.797 -5.025 -3.917 1.00 0.00 C ATOM 1113 OG SER A 74 -5.704 -4.513 -5.238 1.00 0.00 O ATOM 0 H SER A 74 -4.269 -6.795 -1.841 1.00 0.00 H new ATOM 0 HA SER A 74 -5.283 -7.025 -4.536 1.00 0.00 H new ATOM 0 HB2 SER A 74 -6.836 -5.246 -3.674 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.454 -4.278 -3.201 1.00 0.00 H new ATOM 0 HG SER A 74 -6.248 -3.702 -5.313 1.00 0.00 H new ATOM 1119 N ILE A 75 -3.088 -5.846 -5.293 1.00 0.00 N ATOM 1120 CA ILE A 75 -1.669 -5.512 -5.601 1.00 0.00 C ATOM 1121 C ILE A 75 -1.620 -4.394 -6.643 1.00 0.00 C ATOM 1122 O ILE A 75 -2.449 -4.321 -7.528 1.00 0.00 O ATOM 1123 CB ILE A 75 -0.961 -6.753 -6.149 1.00 0.00 C ATOM 1124 CG1 ILE A 75 -1.518 -7.088 -7.535 1.00 0.00 C ATOM 1125 CG2 ILE A 75 -1.195 -7.934 -5.206 1.00 0.00 C ATOM 1126 CD1 ILE A 75 -0.758 -8.283 -8.115 1.00 0.00 C ATOM 0 H ILE A 75 -3.689 -5.980 -6.106 1.00 0.00 H new ATOM 0 HA ILE A 75 -1.169 -5.180 -4.691 1.00 0.00 H new ATOM 0 HB ILE A 75 0.108 -6.556 -6.225 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -2.581 -7.318 -7.465 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.421 -6.226 -8.196 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -0.690 -8.817 -5.597 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -0.798 -7.696 -4.219 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.264 -8.131 -5.128 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.154 -8.522 -9.102 1.00 0.00 H new ATOM 0 HD12 ILE A 75 0.300 -8.035 -8.199 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -0.878 -9.144 -7.458 1.00 0.00 H new ATOM 1138 N ASP A 76 -0.654 -3.523 -6.547 1.00 0.00 N ATOM 1139 CA ASP A 76 -0.550 -2.411 -7.533 1.00 0.00 C ATOM 1140 C ASP A 76 0.838 -2.427 -8.175 1.00 0.00 C ATOM 1141 O ASP A 76 1.771 -1.835 -7.672 1.00 0.00 O ATOM 1142 CB ASP A 76 -0.768 -1.075 -6.819 1.00 0.00 C ATOM 1143 CG ASP A 76 -2.221 -0.975 -6.355 1.00 0.00 C ATOM 1144 OD1 ASP A 76 -3.015 -1.804 -6.771 1.00 0.00 O ATOM 1145 OD2 ASP A 76 -2.518 -0.070 -5.591 1.00 0.00 O ATOM 0 H ASP A 76 0.069 -3.533 -5.827 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.308 -2.538 -8.306 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -0.096 -0.993 -5.965 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.532 -0.249 -7.490 1.00 0.00 H new ATOM 1150 N LYS A 77 0.982 -3.100 -9.284 1.00 0.00 N ATOM 1151 CA LYS A 77 2.311 -3.151 -9.956 1.00 0.00 C ATOM 1152 C LYS A 77 2.688 -1.751 -10.441 1.00 0.00 C ATOM 1153 O LYS A 77 3.832 -1.347 -10.373 1.00 0.00 O ATOM 1154 CB LYS A 77 2.243 -4.107 -11.148 1.00 0.00 C ATOM 1155 CG LYS A 77 2.013 -5.533 -10.645 1.00 0.00 C ATOM 1156 CD LYS A 77 2.087 -6.508 -11.822 1.00 0.00 C ATOM 1157 CE LYS A 77 1.698 -7.911 -11.349 1.00 0.00 C ATOM 1158 NZ LYS A 77 2.116 -8.913 -12.370 1.00 0.00 N ATOM 0 H LYS A 77 0.238 -3.616 -9.753 1.00 0.00 H new ATOM 0 HA LYS A 77 3.064 -3.505 -9.252 1.00 0.00 H new ATOM 0 HB2 LYS A 77 1.436 -3.812 -11.819 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.169 -4.057 -11.721 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.763 -5.792 -9.897 1.00 0.00 H new ATOM 0 HG3 LYS A 77 1.040 -5.606 -10.159 1.00 0.00 H new ATOM 0 HD2 LYS A 77 1.419 -6.183 -12.619 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.095 -6.519 -12.236 1.00 0.00 H new ATOM 0 HE2 LYS A 77 2.174 -8.129 -10.393 1.00 0.00 H new ATOM 0 HE3 LYS A 77 0.621 -7.967 -11.189 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.852 -9.866 -12.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 1.642 -8.708 -13.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.147 -8.865 -12.502 1.00 0.00 H new ATOM 1172 N VAL A 78 1.735 -1.005 -10.930 1.00 0.00 N ATOM 1173 CA VAL A 78 2.041 0.370 -11.417 1.00 0.00 C ATOM 1174 C VAL A 78 2.405 1.259 -10.227 1.00 0.00 C ATOM 1175 O VAL A 78 3.335 2.039 -10.284 1.00 0.00 O ATOM 1176 CB VAL A 78 0.812 0.945 -12.126 1.00 0.00 C ATOM 1177 CG1 VAL A 78 1.058 2.419 -12.453 1.00 0.00 C ATOM 1178 CG2 VAL A 78 0.561 0.169 -13.421 1.00 0.00 C ATOM 0 H VAL A 78 0.759 -1.288 -11.013 1.00 0.00 H new ATOM 0 HA VAL A 78 2.878 0.333 -12.114 1.00 0.00 H new ATOM 0 HB VAL A 78 -0.059 0.857 -11.476 1.00 0.00 H new ATOM 0 HG11 VAL A 78 0.184 2.830 -12.958 1.00 0.00 H new ATOM 0 HG12 VAL A 78 1.238 2.971 -11.531 1.00 0.00 H new ATOM 0 HG13 VAL A 78 1.928 2.507 -13.104 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -0.314 0.578 -13.926 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.431 0.257 -14.072 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.387 -0.882 -13.188 1.00 0.00 H new ATOM 1188 N ASN A 79 1.681 1.145 -9.147 1.00 0.00 N ATOM 1189 CA ASN A 79 1.987 1.982 -7.953 1.00 0.00 C ATOM 1190 C ASN A 79 3.041 1.280 -7.095 1.00 0.00 C ATOM 1191 O ASN A 79 3.342 1.701 -5.996 1.00 0.00 O ATOM 1192 CB ASN A 79 0.713 2.183 -7.131 1.00 0.00 C ATOM 1193 CG ASN A 79 -0.370 2.808 -8.012 1.00 0.00 C ATOM 1194 OD1 ASN A 79 -0.165 3.851 -8.599 1.00 0.00 O ATOM 1195 ND2 ASN A 79 -1.524 2.210 -8.129 1.00 0.00 N ATOM 0 H ASN A 79 0.891 0.509 -9.040 1.00 0.00 H new ATOM 0 HA ASN A 79 2.368 2.951 -8.277 1.00 0.00 H new ATOM 0 HB2 ASN A 79 0.368 1.228 -6.736 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.917 2.827 -6.276 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -2.253 2.619 -8.713 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.697 1.334 -7.636 1.00 0.00 H new ATOM 1202 N HIS A 80 3.608 0.213 -7.589 1.00 0.00 N ATOM 1203 CA HIS A 80 4.643 -0.515 -6.802 1.00 0.00 C ATOM 1204 C HIS A 80 4.163 -0.687 -5.361 1.00 0.00 C ATOM 1205 O HIS A 80 4.919 -0.530 -4.422 1.00 0.00 O ATOM 1206 CB HIS A 80 5.947 0.286 -6.815 1.00 0.00 C ATOM 1207 CG HIS A 80 6.334 0.586 -8.236 1.00 0.00 C ATOM 1208 ND1 HIS A 80 5.991 1.774 -8.862 1.00 0.00 N ATOM 1209 CD2 HIS A 80 7.035 -0.139 -9.168 1.00 0.00 C ATOM 1210 CE1 HIS A 80 6.481 1.729 -10.114 1.00 0.00 C ATOM 1211 NE2 HIS A 80 7.127 0.585 -10.353 1.00 0.00 N ATOM 0 H HIS A 80 3.399 -0.186 -8.504 1.00 0.00 H new ATOM 0 HA HIS A 80 4.814 -1.496 -7.245 1.00 0.00 H new ATOM 0 HB2 HIS A 80 5.822 1.214 -6.257 1.00 0.00 H new ATOM 0 HB3 HIS A 80 6.739 -0.279 -6.322 1.00 0.00 H new ATOM 0 HD2 HIS A 80 7.452 -1.122 -9.006 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.366 2.522 -10.838 1.00 0.00 H new ATOM 0 HE2 HIS A 80 7.588 0.303 -11.218 1.00 0.00 H new ATOM 1219 N THR A 81 2.913 -1.011 -5.175 1.00 0.00 N ATOM 1220 CA THR A 81 2.389 -1.195 -3.793 1.00 0.00 C ATOM 1221 C THR A 81 1.825 -2.610 -3.644 1.00 0.00 C ATOM 1222 O THR A 81 1.192 -3.133 -4.539 1.00 0.00 O ATOM 1223 CB THR A 81 1.280 -0.174 -3.526 1.00 0.00 C ATOM 1224 OG1 THR A 81 1.782 1.136 -3.752 1.00 0.00 O ATOM 1225 CG2 THR A 81 0.806 -0.300 -2.077 1.00 0.00 C ATOM 0 H THR A 81 2.232 -1.156 -5.920 1.00 0.00 H new ATOM 0 HA THR A 81 3.198 -1.049 -3.077 1.00 0.00 H new ATOM 0 HB THR A 81 0.441 -0.363 -4.196 1.00 0.00 H new ATOM 0 HG1 THR A 81 2.167 1.188 -4.652 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.016 0.427 -1.888 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.422 -1.306 -1.906 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.642 -0.112 -1.403 1.00 0.00 H new ATOM 1233 N TYR A 82 2.049 -3.233 -2.520 1.00 0.00 N ATOM 1234 CA TYR A 82 1.525 -4.612 -2.314 1.00 0.00 C ATOM 1235 C TYR A 82 0.801 -4.686 -0.968 1.00 0.00 C ATOM 1236 O TYR A 82 1.366 -4.394 0.068 1.00 0.00 O ATOM 1237 CB TYR A 82 2.688 -5.605 -2.325 1.00 0.00 C ATOM 1238 CG TYR A 82 2.149 -7.015 -2.262 1.00 0.00 C ATOM 1239 CD1 TYR A 82 1.738 -7.659 -3.435 1.00 0.00 C ATOM 1240 CD2 TYR A 82 2.060 -7.677 -1.032 1.00 0.00 C ATOM 1241 CE1 TYR A 82 1.239 -8.965 -3.378 1.00 0.00 C ATOM 1242 CE2 TYR A 82 1.560 -8.983 -0.974 1.00 0.00 C ATOM 1243 CZ TYR A 82 1.150 -9.627 -2.147 1.00 0.00 C ATOM 1244 OH TYR A 82 0.657 -10.915 -2.091 1.00 0.00 O ATOM 0 H TYR A 82 2.573 -2.846 -1.735 1.00 0.00 H new ATOM 0 HA TYR A 82 0.828 -4.861 -3.114 1.00 0.00 H new ATOM 0 HB2 TYR A 82 3.284 -5.473 -3.228 1.00 0.00 H new ATOM 0 HB3 TYR A 82 3.347 -5.418 -1.477 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.806 -7.148 -4.384 1.00 0.00 H new ATOM 0 HD2 TYR A 82 2.377 -7.180 -0.127 1.00 0.00 H new ATOM 0 HE1 TYR A 82 0.923 -9.462 -4.283 1.00 0.00 H new ATOM 0 HE2 TYR A 82 1.491 -9.493 -0.025 1.00 0.00 H new ATOM 0 HH TYR A 82 1.115 -11.470 -2.756 1.00 0.00 H new ATOM 1254 N SER A 83 -0.446 -5.072 -0.974 1.00 0.00 N ATOM 1255 CA SER A 83 -1.204 -5.162 0.306 1.00 0.00 C ATOM 1256 C SER A 83 -1.623 -6.613 0.552 1.00 0.00 C ATOM 1257 O SER A 83 -2.117 -7.285 -0.332 1.00 0.00 O ATOM 1258 CB SER A 83 -2.451 -4.279 0.222 1.00 0.00 C ATOM 1259 OG SER A 83 -3.094 -4.247 1.488 1.00 0.00 O ATOM 0 H SER A 83 -0.972 -5.329 -1.809 1.00 0.00 H new ATOM 0 HA SER A 83 -0.572 -4.823 1.127 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.175 -3.270 -0.083 1.00 0.00 H new ATOM 0 HB3 SER A 83 -3.133 -4.666 -0.535 1.00 0.00 H new ATOM 0 HG SER A 83 -3.892 -3.680 1.435 1.00 0.00 H new ATOM 1265 N TYR A 84 -1.433 -7.100 1.747 1.00 0.00 N ATOM 1266 CA TYR A 84 -1.822 -8.505 2.052 1.00 0.00 C ATOM 1267 C TYR A 84 -2.185 -8.621 3.533 1.00 0.00 C ATOM 1268 O TYR A 84 -1.835 -7.779 4.335 1.00 0.00 O ATOM 1269 CB TYR A 84 -0.653 -9.439 1.736 1.00 0.00 C ATOM 1270 CG TYR A 84 0.449 -9.229 2.746 1.00 0.00 C ATOM 1271 CD1 TYR A 84 0.412 -9.901 3.975 1.00 0.00 C ATOM 1272 CD2 TYR A 84 1.509 -8.363 2.454 1.00 0.00 C ATOM 1273 CE1 TYR A 84 1.433 -9.705 4.911 1.00 0.00 C ATOM 1274 CE2 TYR A 84 2.532 -8.168 3.391 1.00 0.00 C ATOM 1275 CZ TYR A 84 2.494 -8.838 4.618 1.00 0.00 C ATOM 1276 OH TYR A 84 3.502 -8.647 5.541 1.00 0.00 O ATOM 0 H TYR A 84 -1.024 -6.584 2.527 1.00 0.00 H new ATOM 0 HA TYR A 84 -2.682 -8.785 1.444 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -0.987 -10.476 1.757 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -0.280 -9.245 0.730 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -0.405 -10.571 4.200 1.00 0.00 H new ATOM 0 HD2 TYR A 84 1.538 -7.845 1.507 1.00 0.00 H new ATOM 0 HE1 TYR A 84 1.403 -10.222 5.859 1.00 0.00 H new ATOM 0 HE2 TYR A 84 3.350 -7.500 3.166 1.00 0.00 H new ATOM 0 HH TYR A 84 3.112 -8.388 6.402 1.00 0.00 H new ATOM 1286 N SER A 85 -2.885 -9.658 3.904 1.00 0.00 N ATOM 1287 CA SER A 85 -3.269 -9.823 5.333 1.00 0.00 C ATOM 1288 C SER A 85 -3.118 -11.292 5.736 1.00 0.00 C ATOM 1289 O SER A 85 -3.121 -12.177 4.905 1.00 0.00 O ATOM 1290 CB SER A 85 -4.724 -9.390 5.523 1.00 0.00 C ATOM 1291 OG SER A 85 -5.580 -10.292 4.838 1.00 0.00 O ATOM 0 H SER A 85 -3.207 -10.397 3.279 1.00 0.00 H new ATOM 0 HA SER A 85 -2.621 -9.207 5.956 1.00 0.00 H new ATOM 0 HB2 SER A 85 -4.973 -9.370 6.584 1.00 0.00 H new ATOM 0 HB3 SER A 85 -4.866 -8.378 5.143 1.00 0.00 H new ATOM 0 HG SER A 85 -6.040 -9.820 4.113 1.00 0.00 H new ATOM 1297 N LEU A 86 -2.986 -11.556 7.007 1.00 0.00 N ATOM 1298 CA LEU A 86 -2.837 -12.966 7.463 1.00 0.00 C ATOM 1299 C LEU A 86 -4.189 -13.490 7.948 1.00 0.00 C ATOM 1300 O LEU A 86 -4.822 -12.906 8.805 1.00 0.00 O ATOM 1301 CB LEU A 86 -1.826 -13.025 8.610 1.00 0.00 C ATOM 1302 CG LEU A 86 -1.436 -14.481 8.871 1.00 0.00 C ATOM 1303 CD1 LEU A 86 -0.194 -14.524 9.762 1.00 0.00 C ATOM 1304 CD2 LEU A 86 -2.591 -15.203 9.570 1.00 0.00 C ATOM 0 H LEU A 86 -2.975 -10.856 7.749 1.00 0.00 H new ATOM 0 HA LEU A 86 -2.485 -13.581 6.635 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -0.941 -12.440 8.360 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -2.255 -12.585 9.510 1.00 0.00 H new ATOM 0 HG LEU A 86 -1.221 -14.974 7.923 1.00 0.00 H new ATOM 0 HD11 LEU A 86 0.084 -15.561 9.948 1.00 0.00 H new ATOM 0 HD12 LEU A 86 0.629 -14.011 9.264 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -0.409 -14.030 10.710 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -2.312 -16.240 9.756 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -2.808 -14.710 10.518 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -3.476 -15.173 8.935 1.00 0.00 H new ATOM 1316 N ILE A 87 -4.639 -14.588 7.405 1.00 0.00 N ATOM 1317 CA ILE A 87 -5.952 -15.148 7.834 1.00 0.00 C ATOM 1318 C ILE A 87 -5.810 -15.779 9.220 1.00 0.00 C ATOM 1319 O ILE A 87 -6.343 -15.286 10.195 1.00 0.00 O ATOM 1320 CB ILE A 87 -6.402 -16.212 6.831 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -6.502 -15.588 5.438 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.771 -16.754 7.246 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -7.331 -14.305 5.514 1.00 0.00 C ATOM 0 H ILE A 87 -4.154 -15.121 6.683 1.00 0.00 H new ATOM 0 HA ILE A 87 -6.693 -14.350 7.875 1.00 0.00 H new ATOM 0 HB ILE A 87 -5.678 -17.026 6.813 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -5.506 -15.368 5.054 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -6.963 -16.291 4.745 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -8.094 -17.512 6.533 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.701 -17.197 8.240 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.495 -15.940 7.262 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -7.403 -13.859 4.522 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.331 -14.539 5.880 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -6.851 -13.601 6.194 1.00 0.00 H new ATOM 1335 N GLU A 88 -5.098 -16.868 9.317 1.00 0.00 N ATOM 1336 CA GLU A 88 -4.926 -17.530 10.641 1.00 0.00 C ATOM 1337 C GLU A 88 -3.494 -18.050 10.774 1.00 0.00 C ATOM 1338 O GLU A 88 -2.881 -18.462 9.809 1.00 0.00 O ATOM 1339 CB GLU A 88 -5.908 -18.698 10.756 1.00 0.00 C ATOM 1340 CG GLU A 88 -7.339 -18.176 10.619 1.00 0.00 C ATOM 1341 CD GLU A 88 -8.324 -19.330 10.815 1.00 0.00 C ATOM 1342 OE1 GLU A 88 -7.876 -20.461 10.883 1.00 0.00 O ATOM 1343 OE2 GLU A 88 -9.512 -19.061 10.894 1.00 0.00 O ATOM 0 H GLU A 88 -4.628 -17.328 8.537 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.122 -16.809 11.435 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -5.703 -19.437 9.981 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -5.783 -19.199 11.716 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -7.525 -17.396 11.357 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -7.481 -17.726 9.637 1.00 0.00 H new ATOM 1350 N GLY A 89 -2.956 -18.034 11.962 1.00 0.00 N ATOM 1351 CA GLY A 89 -1.564 -18.528 12.159 1.00 0.00 C ATOM 1352 C GLY A 89 -1.401 -19.029 13.597 1.00 0.00 C ATOM 1353 O GLY A 89 -2.170 -18.686 14.473 1.00 0.00 O ATOM 0 H GLY A 89 -3.421 -17.700 12.806 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -1.349 -19.332 11.455 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -0.851 -17.729 11.958 1.00 0.00 H new ATOM 1357 N ASP A 90 -0.409 -19.837 13.847 1.00 0.00 N ATOM 1358 CA ASP A 90 -0.200 -20.359 15.227 1.00 0.00 C ATOM 1359 C ASP A 90 0.044 -19.189 16.184 1.00 0.00 C ATOM 1360 O ASP A 90 -0.302 -19.245 17.347 1.00 0.00 O ATOM 1361 CB ASP A 90 1.013 -21.290 15.241 1.00 0.00 C ATOM 1362 CG ASP A 90 0.779 -22.446 14.266 1.00 0.00 C ATOM 1363 OD1 ASP A 90 -0.356 -22.879 14.153 1.00 0.00 O ATOM 1364 OD2 ASP A 90 1.739 -22.880 13.651 1.00 0.00 O ATOM 0 H ASP A 90 0.267 -20.159 13.155 1.00 0.00 H new ATOM 0 HA ASP A 90 -1.085 -20.910 15.545 1.00 0.00 H new ATOM 0 HB2 ASP A 90 1.911 -20.739 14.960 1.00 0.00 H new ATOM 0 HB3 ASP A 90 1.177 -21.676 16.247 1.00 0.00 H new ATOM 1369 N ALA A 91 0.635 -18.131 15.703 1.00 0.00 N ATOM 1370 CA ALA A 91 0.899 -16.960 16.586 1.00 0.00 C ATOM 1371 C ALA A 91 -0.397 -16.170 16.782 1.00 0.00 C ATOM 1372 O ALA A 91 -0.593 -15.517 17.788 1.00 0.00 O ATOM 1373 CB ALA A 91 1.953 -16.059 15.938 1.00 0.00 C ATOM 0 H ALA A 91 0.947 -18.026 14.737 1.00 0.00 H new ATOM 0 HA ALA A 91 1.264 -17.307 17.553 1.00 0.00 H new ATOM 0 HB1 ALA A 91 2.146 -15.202 16.584 1.00 0.00 H new ATOM 0 HB2 ALA A 91 2.876 -16.622 15.796 1.00 0.00 H new ATOM 0 HB3 ALA A 91 1.589 -15.710 14.972 1.00 0.00 H new ATOM 1379 N LEU A 92 -1.285 -16.227 15.827 1.00 0.00 N ATOM 1380 CA LEU A 92 -2.569 -15.482 15.958 1.00 0.00 C ATOM 1381 C LEU A 92 -3.503 -16.242 16.901 1.00 0.00 C ATOM 1382 O LEU A 92 -4.198 -15.656 17.708 1.00 0.00 O ATOM 1383 CB LEU A 92 -3.225 -15.354 14.581 1.00 0.00 C ATOM 1384 CG LEU A 92 -2.330 -14.513 13.667 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.241 -15.402 13.061 1.00 0.00 C ATOM 1386 CD2 LEU A 92 -3.175 -13.905 12.546 1.00 0.00 C ATOM 0 H LEU A 92 -1.177 -16.757 14.962 1.00 0.00 H new ATOM 0 HA LEU A 92 -2.376 -14.488 16.362 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.381 -16.342 14.147 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.206 -14.889 14.675 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.866 -13.715 14.246 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.603 -14.804 12.410 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.639 -15.836 13.860 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.704 -16.200 12.481 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.539 -13.306 11.895 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -3.639 -14.703 11.966 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.951 -13.272 12.977 1.00 0.00 H new ATOM 1398 N SER A 93 -3.526 -17.543 16.808 1.00 0.00 N ATOM 1399 CA SER A 93 -4.415 -18.337 17.701 1.00 0.00 C ATOM 1400 C SER A 93 -5.869 -17.915 17.479 1.00 0.00 C ATOM 1401 O SER A 93 -6.147 -16.932 16.823 1.00 0.00 O ATOM 1402 CB SER A 93 -4.027 -18.086 19.159 1.00 0.00 C ATOM 1403 OG SER A 93 -2.806 -18.751 19.446 1.00 0.00 O ATOM 0 H SER A 93 -2.968 -18.090 16.153 1.00 0.00 H new ATOM 0 HA SER A 93 -4.306 -19.397 17.474 1.00 0.00 H new ATOM 0 HB2 SER A 93 -3.922 -17.016 19.339 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.814 -18.445 19.823 1.00 0.00 H new ATOM 0 HG SER A 93 -2.241 -18.758 18.645 1.00 0.00 H new ATOM 1409 N GLU A 94 -6.799 -18.651 18.024 1.00 0.00 N ATOM 1410 CA GLU A 94 -8.233 -18.292 17.846 1.00 0.00 C ATOM 1411 C GLU A 94 -8.562 -17.064 18.697 1.00 0.00 C ATOM 1412 O GLU A 94 -9.633 -16.498 18.601 1.00 0.00 O ATOM 1413 CB GLU A 94 -9.108 -19.468 18.283 1.00 0.00 C ATOM 1414 CG GLU A 94 -8.846 -20.664 17.365 1.00 0.00 C ATOM 1415 CD GLU A 94 -9.776 -21.816 17.749 1.00 0.00 C ATOM 1416 OE1 GLU A 94 -10.455 -21.694 18.756 1.00 0.00 O ATOM 1417 OE2 GLU A 94 -9.794 -22.802 17.030 1.00 0.00 O ATOM 0 H GLU A 94 -6.627 -19.485 18.585 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.425 -18.066 16.797 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.889 -19.734 19.317 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -10.161 -19.188 18.242 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -9.011 -20.381 16.325 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -7.806 -20.979 17.449 1.00 0.00 H new ATOM 1424 N ASN A 95 -7.649 -16.645 19.529 1.00 0.00 N ATOM 1425 CA ASN A 95 -7.908 -15.454 20.386 1.00 0.00 C ATOM 1426 C ASN A 95 -7.596 -14.181 19.596 1.00 0.00 C ATOM 1427 O ASN A 95 -8.163 -13.134 19.838 1.00 0.00 O ATOM 1428 CB ASN A 95 -7.019 -15.516 21.628 1.00 0.00 C ATOM 1429 CG ASN A 95 -7.242 -16.848 22.347 1.00 0.00 C ATOM 1430 OD1 ASN A 95 -8.339 -17.371 22.356 1.00 0.00 O ATOM 1431 ND2 ASN A 95 -6.240 -17.422 22.954 1.00 0.00 N ATOM 0 H ASN A 95 -6.733 -17.077 19.653 1.00 0.00 H new ATOM 0 HA ASN A 95 -8.955 -15.445 20.690 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -5.971 -15.414 21.344 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.250 -14.686 22.296 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -6.377 -18.310 23.436 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -5.320 -16.983 22.946 1.00 0.00 H new ATOM 1438 N ILE A 96 -6.698 -14.262 18.652 1.00 0.00 N ATOM 1439 CA ILE A 96 -6.352 -13.055 17.847 1.00 0.00 C ATOM 1440 C ILE A 96 -7.089 -13.109 16.507 1.00 0.00 C ATOM 1441 O ILE A 96 -7.308 -14.167 15.951 1.00 0.00 O ATOM 1442 CB ILE A 96 -4.842 -13.018 17.601 1.00 0.00 C ATOM 1443 CG1 ILE A 96 -4.102 -13.301 18.911 1.00 0.00 C ATOM 1444 CG2 ILE A 96 -4.445 -11.636 17.079 1.00 0.00 C ATOM 1445 CD1 ILE A 96 -2.592 -13.289 18.658 1.00 0.00 C ATOM 0 H ILE A 96 -6.189 -15.110 18.403 1.00 0.00 H new ATOM 0 HA ILE A 96 -6.651 -12.158 18.390 1.00 0.00 H new ATOM 0 HB ILE A 96 -4.576 -13.776 16.864 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.362 -12.551 19.657 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -4.407 -14.268 19.311 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.370 -11.609 16.903 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -4.970 -11.435 16.145 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.712 -10.878 17.816 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -2.065 -13.490 19.591 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -2.340 -14.056 17.926 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.295 -12.312 18.277 1.00 0.00 H new ATOM 1457 N GLU A 97 -7.474 -11.977 15.986 1.00 0.00 N ATOM 1458 CA GLU A 97 -8.200 -11.961 14.683 1.00 0.00 C ATOM 1459 C GLU A 97 -7.194 -11.841 13.536 1.00 0.00 C ATOM 1460 O GLU A 97 -6.000 -11.775 13.749 1.00 0.00 O ATOM 1461 CB GLU A 97 -9.158 -10.770 14.649 1.00 0.00 C ATOM 1462 CG GLU A 97 -10.320 -11.020 15.613 1.00 0.00 C ATOM 1463 CD GLU A 97 -11.303 -9.850 15.543 1.00 0.00 C ATOM 1464 OE1 GLU A 97 -11.014 -8.901 14.833 1.00 0.00 O ATOM 1465 OE2 GLU A 97 -12.328 -9.922 16.202 1.00 0.00 O ATOM 0 H GLU A 97 -7.317 -11.061 16.406 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.765 -12.886 14.572 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -8.631 -9.858 14.928 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -9.536 -10.623 13.637 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.827 -11.950 15.355 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -9.945 -11.133 16.630 1.00 0.00 H new ATOM 1472 N LYS A 98 -7.669 -11.815 12.319 1.00 0.00 N ATOM 1473 CA LYS A 98 -6.738 -11.701 11.159 1.00 0.00 C ATOM 1474 C LYS A 98 -5.894 -10.433 11.302 1.00 0.00 C ATOM 1475 O LYS A 98 -6.225 -9.538 12.055 1.00 0.00 O ATOM 1476 CB LYS A 98 -7.547 -11.630 9.861 1.00 0.00 C ATOM 1477 CG LYS A 98 -8.390 -12.899 9.714 1.00 0.00 C ATOM 1478 CD LYS A 98 -9.118 -12.875 8.367 1.00 0.00 C ATOM 1479 CE LYS A 98 -10.096 -14.051 8.295 1.00 0.00 C ATOM 1480 NZ LYS A 98 -11.357 -13.608 7.637 1.00 0.00 N ATOM 0 H LYS A 98 -8.659 -11.868 12.079 1.00 0.00 H new ATOM 0 HA LYS A 98 -6.083 -12.572 11.134 1.00 0.00 H new ATOM 0 HB2 LYS A 98 -8.192 -10.751 9.870 1.00 0.00 H new ATOM 0 HB3 LYS A 98 -6.877 -11.525 9.008 1.00 0.00 H new ATOM 0 HG2 LYS A 98 -7.753 -13.781 9.780 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -9.112 -12.966 10.528 1.00 0.00 H new ATOM 0 HD2 LYS A 98 -9.655 -11.934 8.248 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -8.398 -12.936 7.551 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -9.651 -14.874 7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -10.308 -14.424 9.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -12.022 -14.406 7.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -11.783 -12.836 8.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 -11.147 -13.272 6.675 1.00 0.00 H new ATOM 1494 N ILE A 99 -4.805 -10.350 10.589 1.00 0.00 N ATOM 1495 CA ILE A 99 -3.940 -9.140 10.687 1.00 0.00 C ATOM 1496 C ILE A 99 -3.862 -8.450 9.324 1.00 0.00 C ATOM 1497 O ILE A 99 -3.788 -9.093 8.295 1.00 0.00 O ATOM 1498 CB ILE A 99 -2.535 -9.553 11.131 1.00 0.00 C ATOM 1499 CG1 ILE A 99 -2.621 -10.309 12.459 1.00 0.00 C ATOM 1500 CG2 ILE A 99 -1.669 -8.305 11.311 1.00 0.00 C ATOM 1501 CD1 ILE A 99 -1.355 -11.146 12.651 1.00 0.00 C ATOM 0 H ILE A 99 -4.476 -11.067 9.943 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.365 -8.450 11.416 1.00 0.00 H new ATOM 0 HB ILE A 99 -2.090 -10.198 10.373 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -2.733 -9.605 13.284 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.500 -10.953 12.467 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -0.668 -8.599 11.627 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -1.607 -7.766 10.366 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -2.114 -7.660 12.068 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -1.415 -11.685 13.597 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -1.263 -11.859 11.832 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -0.484 -10.491 12.661 1.00 0.00 H new ATOM 1513 N ASP A 100 -3.875 -7.145 9.307 1.00 0.00 N ATOM 1514 CA ASP A 100 -3.801 -6.416 8.010 1.00 0.00 C ATOM 1515 C ASP A 100 -2.358 -5.982 7.751 1.00 0.00 C ATOM 1516 O ASP A 100 -1.773 -5.243 8.518 1.00 0.00 O ATOM 1517 CB ASP A 100 -4.704 -5.181 8.063 1.00 0.00 C ATOM 1518 CG ASP A 100 -4.741 -4.516 6.686 1.00 0.00 C ATOM 1519 OD1 ASP A 100 -4.195 -5.089 5.758 1.00 0.00 O ATOM 1520 OD2 ASP A 100 -5.315 -3.444 6.583 1.00 0.00 O ATOM 0 H ASP A 100 -3.934 -6.553 10.135 1.00 0.00 H new ATOM 0 HA ASP A 100 -4.133 -7.073 7.206 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -5.711 -5.466 8.368 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.333 -4.478 8.808 1.00 0.00 H new ATOM 1525 N TYR A 101 -1.779 -6.437 6.674 1.00 0.00 N ATOM 1526 CA TYR A 101 -0.373 -6.054 6.365 1.00 0.00 C ATOM 1527 C TYR A 101 -0.346 -5.192 5.101 1.00 0.00 C ATOM 1528 O TYR A 101 -1.118 -5.393 4.185 1.00 0.00 O ATOM 1529 CB TYR A 101 0.460 -7.316 6.140 1.00 0.00 C ATOM 1530 CG TYR A 101 0.576 -8.081 7.437 1.00 0.00 C ATOM 1531 CD1 TYR A 101 1.530 -7.703 8.389 1.00 0.00 C ATOM 1532 CD2 TYR A 101 -0.271 -9.168 7.689 1.00 0.00 C ATOM 1533 CE1 TYR A 101 1.637 -8.410 9.592 1.00 0.00 C ATOM 1534 CE2 TYR A 101 -0.164 -9.875 8.892 1.00 0.00 C ATOM 1535 CZ TYR A 101 0.790 -9.496 9.844 1.00 0.00 C ATOM 1536 OH TYR A 101 0.896 -10.193 11.031 1.00 0.00 O ATOM 0 H TYR A 101 -2.219 -7.058 5.995 1.00 0.00 H new ATOM 0 HA TYR A 101 0.042 -5.488 7.199 1.00 0.00 H new ATOM 0 HB2 TYR A 101 -0.005 -7.941 5.377 1.00 0.00 H new ATOM 0 HB3 TYR A 101 1.451 -7.050 5.773 1.00 0.00 H new ATOM 0 HD1 TYR A 101 2.184 -6.865 8.195 1.00 0.00 H new ATOM 0 HD2 TYR A 101 -1.007 -9.461 6.955 1.00 0.00 H new ATOM 0 HE1 TYR A 101 2.373 -8.118 10.326 1.00 0.00 H new ATOM 0 HE2 TYR A 101 -0.817 -10.713 9.086 1.00 0.00 H new ATOM 0 HH TYR A 101 1.743 -9.967 11.468 1.00 0.00 H new ATOM 1546 N GLU A 102 0.538 -4.235 5.043 1.00 0.00 N ATOM 1547 CA GLU A 102 0.614 -3.363 3.838 1.00 0.00 C ATOM 1548 C GLU A 102 2.082 -3.116 3.484 1.00 0.00 C ATOM 1549 O GLU A 102 2.893 -2.818 4.337 1.00 0.00 O ATOM 1550 CB GLU A 102 -0.073 -2.028 4.130 1.00 0.00 C ATOM 1551 CG GLU A 102 -1.535 -2.279 4.507 1.00 0.00 C ATOM 1552 CD GLU A 102 -2.261 -0.940 4.652 1.00 0.00 C ATOM 1553 OE1 GLU A 102 -1.588 0.077 4.672 1.00 0.00 O ATOM 1554 OE2 GLU A 102 -3.478 -0.955 4.740 1.00 0.00 O ATOM 0 H GLU A 102 1.211 -4.019 5.778 1.00 0.00 H new ATOM 0 HA GLU A 102 0.114 -3.851 3.001 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.440 -1.513 4.942 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.018 -1.379 3.256 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.020 -2.887 3.743 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.590 -2.838 5.441 1.00 0.00 H new ATOM 1561 N THR A 103 2.429 -3.237 2.232 1.00 0.00 N ATOM 1562 CA THR A 103 3.845 -3.009 1.830 1.00 0.00 C ATOM 1563 C THR A 103 3.897 -1.981 0.698 1.00 0.00 C ATOM 1564 O THR A 103 3.160 -2.065 -0.264 1.00 0.00 O ATOM 1565 CB THR A 103 4.459 -4.327 1.351 1.00 0.00 C ATOM 1566 OG1 THR A 103 4.253 -5.329 2.338 1.00 0.00 O ATOM 1567 CG2 THR A 103 5.958 -4.139 1.117 1.00 0.00 C ATOM 0 H THR A 103 1.795 -3.483 1.472 1.00 0.00 H new ATOM 0 HA THR A 103 4.408 -2.635 2.685 1.00 0.00 H new ATOM 0 HB THR A 103 3.984 -4.632 0.418 1.00 0.00 H new ATOM 0 HG1 THR A 103 4.644 -6.174 2.033 1.00 0.00 H new ATOM 0 HG21 THR A 103 6.394 -5.078 0.776 1.00 0.00 H new ATOM 0 HG22 THR A 103 6.115 -3.370 0.360 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.436 -3.834 2.048 1.00 0.00 H new ATOM 1575 N LYS A 104 4.764 -1.013 0.807 1.00 0.00 N ATOM 1576 CA LYS A 104 4.865 0.021 -0.262 1.00 0.00 C ATOM 1577 C LYS A 104 6.331 0.183 -0.672 1.00 0.00 C ATOM 1578 O LYS A 104 7.208 0.294 0.161 1.00 0.00 O ATOM 1579 CB LYS A 104 4.333 1.354 0.266 1.00 0.00 C ATOM 1580 CG LYS A 104 4.290 2.372 -0.875 1.00 0.00 C ATOM 1581 CD LYS A 104 3.727 3.695 -0.354 1.00 0.00 C ATOM 1582 CE LYS A 104 3.575 4.677 -1.518 1.00 0.00 C ATOM 1583 NZ LYS A 104 3.937 6.048 -1.061 1.00 0.00 N ATOM 0 H LYS A 104 5.407 -0.893 1.590 1.00 0.00 H new ATOM 0 HA LYS A 104 4.276 -0.288 -1.126 1.00 0.00 H new ATOM 0 HB2 LYS A 104 3.336 1.220 0.686 1.00 0.00 H new ATOM 0 HB3 LYS A 104 4.971 1.720 1.071 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.291 2.524 -1.279 1.00 0.00 H new ATOM 0 HG3 LYS A 104 3.671 1.996 -1.689 1.00 0.00 H new ATOM 0 HD2 LYS A 104 2.762 3.529 0.124 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.391 4.112 0.404 1.00 0.00 H new ATOM 0 HE2 LYS A 104 4.216 4.377 -2.347 1.00 0.00 H new ATOM 0 HE3 LYS A 104 2.550 4.664 -1.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 4.229 6.621 -1.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 3.114 6.491 -0.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 4.721 5.991 -0.380 1.00 0.00 H new ATOM 1597 N LEU A 105 6.602 0.196 -1.948 1.00 0.00 N ATOM 1598 CA LEU A 105 8.011 0.349 -2.407 1.00 0.00 C ATOM 1599 C LEU A 105 8.214 1.754 -2.977 1.00 0.00 C ATOM 1600 O LEU A 105 7.632 2.119 -3.980 1.00 0.00 O ATOM 1601 CB LEU A 105 8.309 -0.687 -3.491 1.00 0.00 C ATOM 1602 CG LEU A 105 8.240 -2.091 -2.887 1.00 0.00 C ATOM 1603 CD1 LEU A 105 9.105 -2.147 -1.627 1.00 0.00 C ATOM 1604 CD2 LEU A 105 6.790 -2.420 -2.525 1.00 0.00 C ATOM 0 H LEU A 105 5.910 0.107 -2.692 1.00 0.00 H new ATOM 0 HA LEU A 105 8.685 0.198 -1.564 1.00 0.00 H new ATOM 0 HB2 LEU A 105 7.590 -0.594 -4.305 1.00 0.00 H new ATOM 0 HB3 LEU A 105 9.297 -0.510 -3.916 1.00 0.00 H new ATOM 0 HG LEU A 105 8.607 -2.817 -3.612 1.00 0.00 H new ATOM 0 HD11 LEU A 105 9.056 -3.147 -1.196 1.00 0.00 H new ATOM 0 HD12 LEU A 105 10.138 -1.913 -1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 105 8.738 -1.421 -0.901 1.00 0.00 H new ATOM 0 HD21 LEU A 105 6.740 -3.420 -2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 105 6.422 -1.694 -1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 105 6.173 -2.380 -3.423 1.00 0.00 H new ATOM 1616 N VAL A 106 9.038 2.545 -2.346 1.00 0.00 N ATOM 1617 CA VAL A 106 9.283 3.925 -2.851 1.00 0.00 C ATOM 1618 C VAL A 106 10.790 4.180 -2.903 1.00 0.00 C ATOM 1619 O VAL A 106 11.538 3.699 -2.075 1.00 0.00 O ATOM 1620 CB VAL A 106 8.623 4.935 -1.911 1.00 0.00 C ATOM 1621 CG1 VAL A 106 8.718 6.337 -2.518 1.00 0.00 C ATOM 1622 CG2 VAL A 106 7.152 4.562 -1.715 1.00 0.00 C ATOM 0 H VAL A 106 9.553 2.295 -1.502 1.00 0.00 H new ATOM 0 HA VAL A 106 8.860 4.033 -3.850 1.00 0.00 H new ATOM 0 HB VAL A 106 9.133 4.922 -0.948 1.00 0.00 H new ATOM 0 HG11 VAL A 106 8.247 7.056 -1.848 1.00 0.00 H new ATOM 0 HG12 VAL A 106 9.766 6.603 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 106 8.208 6.352 -3.481 1.00 0.00 H new ATOM 0 HG21 VAL A 106 6.680 5.281 -1.045 1.00 0.00 H new ATOM 0 HG22 VAL A 106 6.642 4.575 -2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 106 7.084 3.564 -1.282 1.00 0.00 H new ATOM 1632 N SER A 107 11.244 4.929 -3.869 1.00 0.00 N ATOM 1633 CA SER A 107 12.705 5.206 -3.972 1.00 0.00 C ATOM 1634 C SER A 107 12.964 6.695 -3.739 1.00 0.00 C ATOM 1635 O SER A 107 12.115 7.530 -3.982 1.00 0.00 O ATOM 1636 CB SER A 107 13.200 4.816 -5.365 1.00 0.00 C ATOM 1637 OG SER A 107 13.524 3.434 -5.383 1.00 0.00 O ATOM 0 H SER A 107 10.668 5.361 -4.591 1.00 0.00 H new ATOM 0 HA SER A 107 13.237 4.624 -3.219 1.00 0.00 H new ATOM 0 HB2 SER A 107 12.432 5.030 -6.108 1.00 0.00 H new ATOM 0 HB3 SER A 107 14.075 5.409 -5.631 1.00 0.00 H new ATOM 0 HG SER A 107 13.840 3.184 -6.276 1.00 0.00 H new ATOM 1643 N ALA A 108 14.134 7.036 -3.273 1.00 0.00 N ATOM 1644 CA ALA A 108 14.451 8.471 -3.030 1.00 0.00 C ATOM 1645 C ALA A 108 15.526 8.927 -4.018 1.00 0.00 C ATOM 1646 O ALA A 108 16.148 8.126 -4.686 1.00 0.00 O ATOM 1647 CB ALA A 108 14.962 8.646 -1.597 1.00 0.00 C ATOM 0 H ALA A 108 14.884 6.382 -3.050 1.00 0.00 H new ATOM 0 HA ALA A 108 13.552 9.072 -3.168 1.00 0.00 H new ATOM 0 HB1 ALA A 108 15.194 9.696 -1.419 1.00 0.00 H new ATOM 0 HB2 ALA A 108 14.195 8.320 -0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 108 15.861 8.047 -1.456 1.00 0.00 H new ATOM 1653 N PRO A 109 15.745 10.247 -4.110 1.00 0.00 N ATOM 1654 CA PRO A 109 16.745 10.822 -5.018 1.00 0.00 C ATOM 1655 C PRO A 109 18.174 10.518 -4.557 1.00 0.00 C ATOM 1656 O PRO A 109 19.133 10.792 -5.251 1.00 0.00 O ATOM 1657 CB PRO A 109 16.479 12.324 -4.938 1.00 0.00 C ATOM 1658 CG PRO A 109 15.837 12.523 -3.607 1.00 0.00 C ATOM 1659 CD PRO A 109 15.036 11.280 -3.336 1.00 0.00 C ATOM 0 HA PRO A 109 16.665 10.414 -6.026 1.00 0.00 H new ATOM 0 HB2 PRO A 109 17.404 12.895 -5.021 1.00 0.00 H new ATOM 0 HB3 PRO A 109 15.826 12.654 -5.746 1.00 0.00 H new ATOM 0 HG2 PRO A 109 16.588 12.679 -2.832 1.00 0.00 H new ATOM 0 HG3 PRO A 109 15.197 13.405 -3.612 1.00 0.00 H new ATOM 0 HD2 PRO A 109 15.012 11.041 -2.273 1.00 0.00 H new ATOM 0 HD3 PRO A 109 14.002 11.388 -3.662 1.00 0.00 H new ATOM 1667 N HIS A 110 18.323 9.956 -3.389 1.00 0.00 N ATOM 1668 CA HIS A 110 19.687 9.635 -2.883 1.00 0.00 C ATOM 1669 C HIS A 110 20.211 8.381 -3.587 1.00 0.00 C ATOM 1670 O HIS A 110 21.385 8.071 -3.529 1.00 0.00 O ATOM 1671 CB HIS A 110 19.626 9.386 -1.375 1.00 0.00 C ATOM 1672 CG HIS A 110 20.995 9.018 -0.873 1.00 0.00 C ATOM 1673 ND1 HIS A 110 21.507 7.735 -0.991 1.00 0.00 N ATOM 1674 CD2 HIS A 110 21.971 9.754 -0.248 1.00 0.00 C ATOM 1675 CE1 HIS A 110 22.739 7.738 -0.450 1.00 0.00 C ATOM 1676 NE2 HIS A 110 23.071 8.944 0.019 1.00 0.00 N ATOM 0 H HIS A 110 17.558 9.705 -2.763 1.00 0.00 H new ATOM 0 HA HIS A 110 20.356 10.471 -3.086 1.00 0.00 H new ATOM 0 HB2 HIS A 110 19.266 10.278 -0.862 1.00 0.00 H new ATOM 0 HB3 HIS A 110 18.919 8.586 -1.156 1.00 0.00 H new ATOM 0 HD2 HIS A 110 21.897 10.803 -0.001 1.00 0.00 H new ATOM 0 HE1 HIS A 110 23.381 6.871 -0.401 1.00 0.00 H new ATOM 0 HE2 HIS A 110 23.943 9.213 0.475 1.00 0.00 H new ATOM 1684 N GLY A 111 19.351 7.659 -4.251 1.00 0.00 N ATOM 1685 CA GLY A 111 19.802 6.427 -4.958 1.00 0.00 C ATOM 1686 C GLY A 111 19.341 5.193 -4.180 1.00 0.00 C ATOM 1687 O GLY A 111 19.330 4.091 -4.694 1.00 0.00 O ATOM 0 H GLY A 111 18.356 7.868 -4.335 1.00 0.00 H new ATOM 0 HA2 GLY A 111 19.395 6.406 -5.969 1.00 0.00 H new ATOM 0 HA3 GLY A 111 20.888 6.426 -5.052 1.00 0.00 H new ATOM 1691 N GLY A 112 18.961 5.366 -2.943 1.00 0.00 N ATOM 1692 CA GLY A 112 18.502 4.201 -2.134 1.00 0.00 C ATOM 1693 C GLY A 112 16.998 3.998 -2.336 1.00 0.00 C ATOM 1694 O GLY A 112 16.330 4.806 -2.950 1.00 0.00 O ATOM 0 H GLY A 112 18.949 6.263 -2.458 1.00 0.00 H new ATOM 0 HA2 GLY A 112 19.044 3.303 -2.431 1.00 0.00 H new ATOM 0 HA3 GLY A 112 18.718 4.370 -1.079 1.00 0.00 H new ATOM 1698 N THR A 113 16.462 2.925 -1.823 1.00 0.00 N ATOM 1699 CA THR A 113 15.003 2.672 -1.985 1.00 0.00 C ATOM 1700 C THR A 113 14.328 2.689 -0.613 1.00 0.00 C ATOM 1701 O THR A 113 14.710 1.968 0.287 1.00 0.00 O ATOM 1702 CB THR A 113 14.791 1.305 -2.639 1.00 0.00 C ATOM 1703 OG1 THR A 113 15.417 1.290 -3.914 1.00 0.00 O ATOM 1704 CG2 THR A 113 13.294 1.040 -2.798 1.00 0.00 C ATOM 0 H THR A 113 16.971 2.213 -1.299 1.00 0.00 H new ATOM 0 HA THR A 113 14.568 3.448 -2.615 1.00 0.00 H new ATOM 0 HB THR A 113 15.229 0.529 -2.011 1.00 0.00 H new ATOM 0 HG1 THR A 113 16.097 0.584 -3.936 1.00 0.00 H new ATOM 0 HG21 THR A 113 13.144 0.066 -3.264 1.00 0.00 H new ATOM 0 HG22 THR A 113 12.817 1.051 -1.818 1.00 0.00 H new ATOM 0 HG23 THR A 113 12.852 1.814 -3.425 1.00 0.00 H new ATOM 1712 N ILE A 114 13.324 3.506 -0.445 1.00 0.00 N ATOM 1713 CA ILE A 114 12.624 3.566 0.870 1.00 0.00 C ATOM 1714 C ILE A 114 11.381 2.675 0.821 1.00 0.00 C ATOM 1715 O ILE A 114 10.560 2.787 -0.067 1.00 0.00 O ATOM 1716 CB ILE A 114 12.208 5.009 1.161 1.00 0.00 C ATOM 1717 CG1 ILE A 114 13.429 5.925 1.053 1.00 0.00 C ATOM 1718 CG2 ILE A 114 11.629 5.097 2.574 1.00 0.00 C ATOM 1719 CD1 ILE A 114 12.983 7.385 1.144 1.00 0.00 C ATOM 0 H ILE A 114 12.958 4.134 -1.161 1.00 0.00 H new ATOM 0 HA ILE A 114 13.293 3.217 1.657 1.00 0.00 H new ATOM 0 HB ILE A 114 11.454 5.322 0.438 1.00 0.00 H new ATOM 0 HG12 ILE A 114 14.137 5.700 1.851 1.00 0.00 H new ATOM 0 HG13 ILE A 114 13.946 5.750 0.109 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.332 6.125 2.782 1.00 0.00 H new ATOM 0 HG22 ILE A 114 10.759 4.445 2.652 1.00 0.00 H new ATOM 0 HG23 ILE A 114 12.383 4.784 3.296 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.853 8.037 1.067 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.291 7.606 0.331 1.00 0.00 H new ATOM 0 HD13 ILE A 114 12.486 7.555 2.099 1.00 0.00 H new ATOM 1731 N ILE A 115 11.237 1.785 1.766 1.00 0.00 N ATOM 1732 CA ILE A 115 10.047 0.887 1.766 1.00 0.00 C ATOM 1733 C ILE A 115 9.159 1.205 2.970 1.00 0.00 C ATOM 1734 O ILE A 115 9.608 1.218 4.100 1.00 0.00 O ATOM 1735 CB ILE A 115 10.507 -0.570 1.846 1.00 0.00 C ATOM 1736 CG1 ILE A 115 11.477 -0.866 0.701 1.00 0.00 C ATOM 1737 CG2 ILE A 115 9.291 -1.493 1.734 1.00 0.00 C ATOM 1738 CD1 ILE A 115 12.236 -2.161 0.997 1.00 0.00 C ATOM 0 H ILE A 115 11.890 1.641 2.536 1.00 0.00 H new ATOM 0 HA ILE A 115 9.480 1.042 0.848 1.00 0.00 H new ATOM 0 HB ILE A 115 11.009 -0.740 2.798 1.00 0.00 H new ATOM 0 HG12 ILE A 115 10.931 -0.959 -0.238 1.00 0.00 H new ATOM 0 HG13 ILE A 115 12.178 -0.040 0.582 1.00 0.00 H new ATOM 0 HG21 ILE A 115 9.616 -2.532 1.791 1.00 0.00 H new ATOM 0 HG22 ILE A 115 8.599 -1.284 2.550 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.790 -1.321 0.781 1.00 0.00 H new ATOM 0 HD11 ILE A 115 12.927 -2.372 0.181 1.00 0.00 H new ATOM 0 HD12 ILE A 115 12.794 -2.051 1.927 1.00 0.00 H new ATOM 0 HD13 ILE A 115 11.528 -2.984 1.094 1.00 0.00 H new ATOM 1750 N LYS A 116 7.899 1.454 2.740 1.00 0.00 N ATOM 1751 CA LYS A 116 6.979 1.761 3.870 1.00 0.00 C ATOM 1752 C LYS A 116 6.121 0.528 4.162 1.00 0.00 C ATOM 1753 O LYS A 116 5.528 -0.049 3.273 1.00 0.00 O ATOM 1754 CB LYS A 116 6.075 2.935 3.490 1.00 0.00 C ATOM 1755 CG LYS A 116 6.923 4.196 3.305 1.00 0.00 C ATOM 1756 CD LYS A 116 6.008 5.386 3.007 1.00 0.00 C ATOM 1757 CE LYS A 116 6.851 6.653 2.851 1.00 0.00 C ATOM 1758 NZ LYS A 116 6.736 7.160 1.454 1.00 0.00 N ATOM 0 H LYS A 116 7.467 1.458 1.816 1.00 0.00 H new ATOM 0 HA LYS A 116 7.558 2.026 4.755 1.00 0.00 H new ATOM 0 HB2 LYS A 116 5.535 2.709 2.570 1.00 0.00 H new ATOM 0 HB3 LYS A 116 5.327 3.098 4.266 1.00 0.00 H new ATOM 0 HG2 LYS A 116 7.508 4.389 4.204 1.00 0.00 H new ATOM 0 HG3 LYS A 116 7.631 4.055 2.489 1.00 0.00 H new ATOM 0 HD2 LYS A 116 5.439 5.201 2.096 1.00 0.00 H new ATOM 0 HD3 LYS A 116 5.286 5.514 3.814 1.00 0.00 H new ATOM 0 HE2 LYS A 116 6.515 7.415 3.554 1.00 0.00 H new ATOM 0 HE3 LYS A 116 7.894 6.440 3.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 7.309 8.021 1.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 7.077 6.434 0.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 5.741 7.379 1.245 1.00 0.00 H new ATOM 1772 N THR A 117 6.058 0.111 5.397 1.00 0.00 N ATOM 1773 CA THR A 117 5.244 -1.092 5.729 1.00 0.00 C ATOM 1774 C THR A 117 4.302 -0.784 6.894 1.00 0.00 C ATOM 1775 O THR A 117 4.724 -0.364 7.953 1.00 0.00 O ATOM 1776 CB THR A 117 6.176 -2.241 6.120 1.00 0.00 C ATOM 1777 OG1 THR A 117 7.080 -2.500 5.054 1.00 0.00 O ATOM 1778 CG2 THR A 117 5.350 -3.495 6.409 1.00 0.00 C ATOM 0 H THR A 117 6.532 0.549 6.187 1.00 0.00 H new ATOM 0 HA THR A 117 4.653 -1.375 4.858 1.00 0.00 H new ATOM 0 HB THR A 117 6.737 -1.966 7.013 1.00 0.00 H new ATOM 0 HG1 THR A 117 7.679 -3.235 5.304 1.00 0.00 H new ATOM 0 HG21 THR A 117 6.015 -4.313 6.687 1.00 0.00 H new ATOM 0 HG22 THR A 117 4.659 -3.295 7.228 1.00 0.00 H new ATOM 0 HG23 THR A 117 4.787 -3.773 5.518 1.00 0.00 H new ATOM 1786 N THR A 118 3.028 -0.998 6.707 1.00 0.00 N ATOM 1787 CA THR A 118 2.055 -0.728 7.802 1.00 0.00 C ATOM 1788 C THR A 118 1.572 -2.061 8.378 1.00 0.00 C ATOM 1789 O THR A 118 1.392 -3.026 7.664 1.00 0.00 O ATOM 1790 CB THR A 118 0.862 0.053 7.247 1.00 0.00 C ATOM 1791 OG1 THR A 118 1.333 1.174 6.512 1.00 0.00 O ATOM 1792 CG2 THR A 118 -0.020 0.531 8.402 1.00 0.00 C ATOM 0 H THR A 118 2.619 -1.349 5.841 1.00 0.00 H new ATOM 0 HA THR A 118 2.535 -0.140 8.585 1.00 0.00 H new ATOM 0 HB THR A 118 0.278 -0.593 6.591 1.00 0.00 H new ATOM 0 HG1 THR A 118 0.570 1.675 6.154 1.00 0.00 H new ATOM 0 HG21 THR A 118 -0.869 1.087 8.005 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.381 -0.330 8.965 1.00 0.00 H new ATOM 0 HG23 THR A 118 0.561 1.177 9.060 1.00 0.00 H new ATOM 1800 N SER A 119 1.365 -2.126 9.665 1.00 0.00 N ATOM 1801 CA SER A 119 0.901 -3.404 10.276 1.00 0.00 C ATOM 1802 C SER A 119 -0.326 -3.147 11.153 1.00 0.00 C ATOM 1803 O SER A 119 -0.426 -2.135 11.820 1.00 0.00 O ATOM 1804 CB SER A 119 2.024 -3.993 11.132 1.00 0.00 C ATOM 1805 OG SER A 119 1.651 -5.290 11.575 1.00 0.00 O ATOM 0 H SER A 119 1.496 -1.353 10.317 1.00 0.00 H new ATOM 0 HA SER A 119 0.635 -4.105 9.485 1.00 0.00 H new ATOM 0 HB2 SER A 119 2.947 -4.046 10.554 1.00 0.00 H new ATOM 0 HB3 SER A 119 2.220 -3.347 11.988 1.00 0.00 H new ATOM 0 HG SER A 119 1.377 -5.248 12.515 1.00 0.00 H new ATOM 1811 N LYS A 120 -1.259 -4.060 11.159 1.00 0.00 N ATOM 1812 CA LYS A 120 -2.480 -3.879 11.994 1.00 0.00 C ATOM 1813 C LYS A 120 -2.990 -5.252 12.439 1.00 0.00 C ATOM 1814 O LYS A 120 -3.324 -6.092 11.628 1.00 0.00 O ATOM 1815 CB LYS A 120 -3.560 -3.172 11.173 1.00 0.00 C ATOM 1816 CG LYS A 120 -4.580 -2.528 12.115 1.00 0.00 C ATOM 1817 CD LYS A 120 -5.787 -2.047 11.307 1.00 0.00 C ATOM 1818 CE LYS A 120 -6.873 -1.549 12.261 1.00 0.00 C ATOM 1819 NZ LYS A 120 -7.568 -0.377 11.657 1.00 0.00 N ATOM 0 H LYS A 120 -1.228 -4.925 10.620 1.00 0.00 H new ATOM 0 HA LYS A 120 -2.241 -3.275 12.869 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -3.108 -2.412 10.536 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -4.057 -3.885 10.515 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -4.898 -3.247 12.871 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -4.125 -1.690 12.643 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -5.489 -1.247 10.629 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -6.173 -2.859 10.691 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -7.589 -2.346 12.461 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -6.431 -1.270 13.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -8.307 -0.039 12.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -6.881 0.385 11.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -8.003 -0.658 10.755 1.00 0.00 H new ATOM 1833 N TYR A 121 -3.051 -5.488 13.722 1.00 0.00 N ATOM 1834 CA TYR A 121 -3.537 -6.810 14.211 1.00 0.00 C ATOM 1835 C TYR A 121 -4.928 -6.647 14.827 1.00 0.00 C ATOM 1836 O TYR A 121 -5.170 -5.753 15.614 1.00 0.00 O ATOM 1837 CB TYR A 121 -2.573 -7.350 15.271 1.00 0.00 C ATOM 1838 CG TYR A 121 -1.153 -7.256 14.762 1.00 0.00 C ATOM 1839 CD1 TYR A 121 -0.453 -6.047 14.858 1.00 0.00 C ATOM 1840 CD2 TYR A 121 -0.537 -8.379 14.197 1.00 0.00 C ATOM 1841 CE1 TYR A 121 0.863 -5.962 14.389 1.00 0.00 C ATOM 1842 CE2 TYR A 121 0.779 -8.293 13.727 1.00 0.00 C ATOM 1843 CZ TYR A 121 1.478 -7.085 13.823 1.00 0.00 C ATOM 1844 OH TYR A 121 2.776 -7.001 13.360 1.00 0.00 O ATOM 0 H TYR A 121 -2.786 -4.825 14.450 1.00 0.00 H new ATOM 0 HA TYR A 121 -3.588 -7.508 13.375 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.677 -6.781 16.195 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -2.818 -8.386 15.505 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -0.928 -5.181 15.294 1.00 0.00 H new ATOM 0 HD2 TYR A 121 -1.077 -9.312 14.124 1.00 0.00 H new ATOM 0 HE1 TYR A 121 1.404 -5.030 14.464 1.00 0.00 H new ATOM 0 HE2 TYR A 121 1.254 -9.159 13.290 1.00 0.00 H new ATOM 0 HH TYR A 121 2.797 -6.465 12.540 1.00 0.00 H new ATOM 1854 N HIS A 122 -5.844 -7.507 14.477 1.00 0.00 N ATOM 1855 CA HIS A 122 -7.218 -7.405 15.045 1.00 0.00 C ATOM 1856 C HIS A 122 -7.343 -8.355 16.239 1.00 0.00 C ATOM 1857 O HIS A 122 -6.788 -9.435 16.244 1.00 0.00 O ATOM 1858 CB HIS A 122 -8.240 -7.786 13.972 1.00 0.00 C ATOM 1859 CG HIS A 122 -8.203 -6.773 12.862 1.00 0.00 C ATOM 1860 ND1 HIS A 122 -7.432 -6.953 11.723 1.00 0.00 N ATOM 1861 CD2 HIS A 122 -8.831 -5.564 12.701 1.00 0.00 C ATOM 1862 CE1 HIS A 122 -7.617 -5.877 10.934 1.00 0.00 C ATOM 1863 NE2 HIS A 122 -8.461 -5.000 11.484 1.00 0.00 N ATOM 0 H HIS A 122 -5.701 -8.276 13.822 1.00 0.00 H new ATOM 0 HA HIS A 122 -7.406 -6.383 15.375 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -8.019 -8.779 13.580 1.00 0.00 H new ATOM 0 HB3 HIS A 122 -9.239 -7.830 14.406 1.00 0.00 H new ATOM 0 HD1 HIS A 122 -6.834 -7.754 11.520 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -9.510 -5.117 13.412 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -7.141 -5.740 9.974 1.00 0.00 H new ATOM 1871 N THR A 123 -8.064 -7.960 17.253 1.00 0.00 N ATOM 1872 CA THR A 123 -8.218 -8.842 18.445 1.00 0.00 C ATOM 1873 C THR A 123 -9.650 -9.374 18.513 1.00 0.00 C ATOM 1874 O THR A 123 -10.579 -8.750 18.042 1.00 0.00 O ATOM 1875 CB THR A 123 -7.917 -8.043 19.715 1.00 0.00 C ATOM 1876 OG1 THR A 123 -8.674 -6.842 19.705 1.00 0.00 O ATOM 1877 CG2 THR A 123 -6.426 -7.708 19.769 1.00 0.00 C ATOM 0 H THR A 123 -8.552 -7.066 17.308 1.00 0.00 H new ATOM 0 HA THR A 123 -7.523 -9.678 18.363 1.00 0.00 H new ATOM 0 HB THR A 123 -8.185 -8.636 20.590 1.00 0.00 H new ATOM 0 HG1 THR A 123 -8.484 -6.329 20.518 1.00 0.00 H new ATOM 0 HG21 THR A 123 -6.213 -7.139 20.674 1.00 0.00 H new ATOM 0 HG22 THR A 123 -5.846 -8.631 19.776 1.00 0.00 H new ATOM 0 HG23 THR A 123 -6.154 -7.115 18.896 1.00 0.00 H new ATOM 2169 N ALA A 142 11.591 -6.292 9.995 1.00 0.00 N ATOM 2170 CA ALA A 142 12.663 -5.371 9.523 1.00 0.00 C ATOM 2171 C ALA A 142 13.957 -6.163 9.316 1.00 0.00 C ATOM 2172 O ALA A 142 14.766 -5.836 8.471 1.00 0.00 O ATOM 2173 CB ALA A 142 12.895 -4.279 10.568 1.00 0.00 C ATOM 0 HA ALA A 142 12.361 -4.912 8.581 1.00 0.00 H new ATOM 0 HB1 ALA A 142 13.679 -3.605 10.222 1.00 0.00 H new ATOM 0 HB2 ALA A 142 11.973 -3.717 10.717 1.00 0.00 H new ATOM 0 HB3 ALA A 142 13.198 -4.736 11.510 1.00 0.00 H new ATOM 2179 N HIS A 143 14.156 -7.202 10.079 1.00 0.00 N ATOM 2180 CA HIS A 143 15.396 -8.012 9.923 1.00 0.00 C ATOM 2181 C HIS A 143 15.292 -8.855 8.651 1.00 0.00 C ATOM 2182 O HIS A 143 16.277 -9.136 7.997 1.00 0.00 O ATOM 2183 CB HIS A 143 15.560 -8.933 11.133 1.00 0.00 C ATOM 2184 CG HIS A 143 16.802 -9.764 10.967 1.00 0.00 C ATOM 2185 ND1 HIS A 143 16.784 -11.006 10.353 1.00 0.00 N ATOM 2186 CD2 HIS A 143 18.109 -9.543 11.328 1.00 0.00 C ATOM 2187 CE1 HIS A 143 18.043 -11.482 10.362 1.00 0.00 C ATOM 2188 NE2 HIS A 143 18.890 -10.629 10.944 1.00 0.00 N ATOM 0 H HIS A 143 13.514 -7.525 10.803 1.00 0.00 H new ATOM 0 HA HIS A 143 16.259 -7.349 9.853 1.00 0.00 H new ATOM 0 HB2 HIS A 143 15.625 -8.342 12.047 1.00 0.00 H new ATOM 0 HB3 HIS A 143 14.688 -9.579 11.232 1.00 0.00 H new ATOM 0 HD2 HIS A 143 18.475 -8.661 11.833 1.00 0.00 H new ATOM 0 HE1 HIS A 143 18.333 -12.437 9.949 1.00 0.00 H new ATOM 0 HE2 HIS A 143 19.894 -10.748 11.078 1.00 0.00 H new ATOM 2196 N LEU A 144 14.104 -9.259 8.294 1.00 0.00 N ATOM 2197 CA LEU A 144 13.934 -10.081 7.064 1.00 0.00 C ATOM 2198 C LEU A 144 14.262 -9.230 5.836 1.00 0.00 C ATOM 2199 O LEU A 144 14.939 -9.668 4.928 1.00 0.00 O ATOM 2200 CB LEU A 144 12.487 -10.570 6.974 1.00 0.00 C ATOM 2201 CG LEU A 144 12.158 -11.423 8.200 1.00 0.00 C ATOM 2202 CD1 LEU A 144 10.751 -12.007 8.054 1.00 0.00 C ATOM 2203 CD2 LEU A 144 13.173 -12.562 8.319 1.00 0.00 C ATOM 0 H LEU A 144 13.243 -9.055 8.802 1.00 0.00 H new ATOM 0 HA LEU A 144 14.605 -10.939 7.103 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.808 -9.719 6.917 1.00 0.00 H new ATOM 0 HB3 LEU A 144 12.345 -11.153 6.064 1.00 0.00 H new ATOM 0 HG LEU A 144 12.203 -10.802 9.095 1.00 0.00 H new ATOM 0 HD11 LEU A 144 10.517 -12.615 8.928 1.00 0.00 H new ATOM 0 HD12 LEU A 144 10.027 -11.196 7.972 1.00 0.00 H new ATOM 0 HD13 LEU A 144 10.705 -12.627 7.158 1.00 0.00 H new ATOM 0 HD21 LEU A 144 12.938 -13.169 9.193 1.00 0.00 H new ATOM 0 HD22 LEU A 144 13.130 -13.182 7.424 1.00 0.00 H new ATOM 0 HD23 LEU A 144 14.175 -12.147 8.425 1.00 0.00 H new ATOM 2215 N PHE A 145 13.789 -8.013 5.803 1.00 0.00 N ATOM 2216 CA PHE A 145 14.076 -7.135 4.634 1.00 0.00 C ATOM 2217 C PHE A 145 15.587 -7.057 4.416 1.00 0.00 C ATOM 2218 O PHE A 145 16.065 -7.063 3.300 1.00 0.00 O ATOM 2219 CB PHE A 145 13.526 -5.733 4.902 1.00 0.00 C ATOM 2220 CG PHE A 145 12.018 -5.762 4.832 1.00 0.00 C ATOM 2221 CD1 PHE A 145 11.374 -5.703 3.590 1.00 0.00 C ATOM 2222 CD2 PHE A 145 11.263 -5.849 6.008 1.00 0.00 C ATOM 2223 CE1 PHE A 145 9.977 -5.729 3.524 1.00 0.00 C ATOM 2224 CE2 PHE A 145 9.865 -5.876 5.942 1.00 0.00 C ATOM 2225 CZ PHE A 145 9.222 -5.816 4.700 1.00 0.00 C ATOM 0 H PHE A 145 13.217 -7.590 6.534 1.00 0.00 H new ATOM 0 HA PHE A 145 13.601 -7.547 3.744 1.00 0.00 H new ATOM 0 HB2 PHE A 145 13.849 -5.386 5.884 1.00 0.00 H new ATOM 0 HB3 PHE A 145 13.921 -5.029 4.169 1.00 0.00 H new ATOM 0 HD1 PHE A 145 11.956 -5.637 2.683 1.00 0.00 H new ATOM 0 HD2 PHE A 145 11.759 -5.895 6.966 1.00 0.00 H new ATOM 0 HE1 PHE A 145 9.481 -5.682 2.566 1.00 0.00 H new ATOM 0 HE2 PHE A 145 9.283 -5.943 6.849 1.00 0.00 H new ATOM 0 HZ PHE A 145 8.143 -5.837 4.649 1.00 0.00 H new ATOM 2235 N LYS A 146 16.344 -6.985 5.477 1.00 0.00 N ATOM 2236 CA LYS A 146 17.825 -6.910 5.332 1.00 0.00 C ATOM 2237 C LYS A 146 18.324 -8.138 4.571 1.00 0.00 C ATOM 2238 O LYS A 146 19.179 -8.045 3.715 1.00 0.00 O ATOM 2239 CB LYS A 146 18.470 -6.871 6.719 1.00 0.00 C ATOM 2240 CG LYS A 146 18.186 -5.517 7.373 1.00 0.00 C ATOM 2241 CD LYS A 146 18.977 -5.406 8.678 1.00 0.00 C ATOM 2242 CE LYS A 146 18.544 -4.148 9.431 1.00 0.00 C ATOM 2243 NZ LYS A 146 17.165 -4.339 9.965 1.00 0.00 N ATOM 0 H LYS A 146 16.001 -6.975 6.437 1.00 0.00 H new ATOM 0 HA LYS A 146 18.093 -6.008 4.781 1.00 0.00 H new ATOM 0 HB2 LYS A 146 18.076 -7.676 7.338 1.00 0.00 H new ATOM 0 HB3 LYS A 146 19.545 -7.029 6.637 1.00 0.00 H new ATOM 0 HG2 LYS A 146 18.464 -4.709 6.697 1.00 0.00 H new ATOM 0 HG3 LYS A 146 17.119 -5.413 7.572 1.00 0.00 H new ATOM 0 HD2 LYS A 146 18.807 -6.288 9.295 1.00 0.00 H new ATOM 0 HD3 LYS A 146 20.045 -5.366 8.466 1.00 0.00 H new ATOM 0 HE2 LYS A 146 19.237 -3.943 10.247 1.00 0.00 H new ATOM 0 HE3 LYS A 146 18.572 -3.285 8.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 17.007 -3.687 10.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 16.472 -4.144 9.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 17.053 -5.319 10.294 1.00 0.00 H new ATOM 2257 N LEU A 147 17.792 -9.291 4.876 1.00 0.00 N ATOM 2258 CA LEU A 147 18.233 -10.525 4.169 1.00 0.00 C ATOM 2259 C LEU A 147 17.798 -10.452 2.705 1.00 0.00 C ATOM 2260 O LEU A 147 18.520 -10.850 1.811 1.00 0.00 O ATOM 2261 CB LEU A 147 17.594 -11.747 4.831 1.00 0.00 C ATOM 2262 CG LEU A 147 18.262 -11.999 6.185 1.00 0.00 C ATOM 2263 CD1 LEU A 147 17.652 -13.245 6.829 1.00 0.00 C ATOM 2264 CD2 LEU A 147 19.763 -12.213 5.980 1.00 0.00 C ATOM 0 H LEU A 147 17.071 -9.430 5.584 1.00 0.00 H new ATOM 0 HA LEU A 147 19.318 -10.609 4.223 1.00 0.00 H new ATOM 0 HB2 LEU A 147 16.525 -11.584 4.965 1.00 0.00 H new ATOM 0 HB3 LEU A 147 17.705 -12.621 4.190 1.00 0.00 H new ATOM 0 HG LEU A 147 18.103 -11.139 6.836 1.00 0.00 H new ATOM 0 HD11 LEU A 147 18.127 -13.426 7.793 1.00 0.00 H new ATOM 0 HD12 LEU A 147 16.582 -13.093 6.974 1.00 0.00 H new ATOM 0 HD13 LEU A 147 17.811 -14.106 6.179 1.00 0.00 H new ATOM 0 HD21 LEU A 147 20.240 -12.393 6.944 1.00 0.00 H new ATOM 0 HD22 LEU A 147 19.922 -13.074 5.330 1.00 0.00 H new ATOM 0 HD23 LEU A 147 20.198 -11.326 5.520 1.00 0.00 H new ATOM 2276 N ILE A 148 16.623 -9.946 2.451 1.00 0.00 N ATOM 2277 CA ILE A 148 16.141 -9.847 1.046 1.00 0.00 C ATOM 2278 C ILE A 148 17.174 -9.095 0.205 1.00 0.00 C ATOM 2279 O ILE A 148 17.522 -9.506 -0.883 1.00 0.00 O ATOM 2280 CB ILE A 148 14.813 -9.086 1.015 1.00 0.00 C ATOM 2281 CG1 ILE A 148 13.762 -9.860 1.812 1.00 0.00 C ATOM 2282 CG2 ILE A 148 14.347 -8.937 -0.434 1.00 0.00 C ATOM 2283 CD1 ILE A 148 12.436 -9.098 1.779 1.00 0.00 C ATOM 0 H ILE A 148 15.975 -9.596 3.157 1.00 0.00 H new ATOM 0 HA ILE A 148 15.998 -10.848 0.640 1.00 0.00 H new ATOM 0 HB ILE A 148 14.949 -8.099 1.457 1.00 0.00 H new ATOM 0 HG12 ILE A 148 13.632 -10.857 1.391 1.00 0.00 H new ATOM 0 HG13 ILE A 148 14.094 -9.990 2.842 1.00 0.00 H new ATOM 0 HG21 ILE A 148 13.401 -8.395 -0.458 1.00 0.00 H new ATOM 0 HG22 ILE A 148 15.096 -8.385 -1.002 1.00 0.00 H new ATOM 0 HG23 ILE A 148 14.211 -9.924 -0.876 1.00 0.00 H new ATOM 0 HD11 ILE A 148 11.686 -9.648 2.347 1.00 0.00 H new ATOM 0 HD12 ILE A 148 12.573 -8.111 2.220 1.00 0.00 H new ATOM 0 HD13 ILE A 148 12.103 -8.991 0.747 1.00 0.00 H new ATOM 2295 N GLU A 149 17.665 -7.993 0.702 1.00 0.00 N ATOM 2296 CA GLU A 149 18.674 -7.213 -0.067 1.00 0.00 C ATOM 2297 C GLU A 149 19.986 -7.999 -0.131 1.00 0.00 C ATOM 2298 O GLU A 149 20.650 -8.033 -1.148 1.00 0.00 O ATOM 2299 CB GLU A 149 18.916 -5.871 0.627 1.00 0.00 C ATOM 2300 CG GLU A 149 17.572 -5.215 0.951 1.00 0.00 C ATOM 2301 CD GLU A 149 16.769 -5.033 -0.337 1.00 0.00 C ATOM 2302 OE1 GLU A 149 17.348 -5.183 -1.401 1.00 0.00 O ATOM 2303 OE2 GLU A 149 15.586 -4.746 -0.240 1.00 0.00 O ATOM 0 H GLU A 149 17.411 -7.599 1.608 1.00 0.00 H new ATOM 0 HA GLU A 149 18.306 -7.039 -1.078 1.00 0.00 H new ATOM 0 HB2 GLU A 149 19.490 -6.021 1.542 1.00 0.00 H new ATOM 0 HB3 GLU A 149 19.506 -5.218 -0.016 1.00 0.00 H new ATOM 0 HG2 GLU A 149 17.014 -5.832 1.655 1.00 0.00 H new ATOM 0 HG3 GLU A 149 17.733 -4.250 1.431 1.00 0.00 H new ATOM 2310 N GLY A 150 20.365 -8.629 0.947 1.00 0.00 N ATOM 2311 CA GLY A 150 21.634 -9.411 0.943 1.00 0.00 C ATOM 2312 C GLY A 150 21.615 -10.408 -0.216 1.00 0.00 C ATOM 2313 O GLY A 150 22.503 -10.427 -1.046 1.00 0.00 O ATOM 0 H GLY A 150 19.852 -8.636 1.829 1.00 0.00 H new ATOM 0 HA2 GLY A 150 22.487 -8.740 0.845 1.00 0.00 H new ATOM 0 HA3 GLY A 150 21.751 -9.939 1.889 1.00 0.00 H new ATOM 2317 N TYR A 151 20.610 -11.235 -0.282 1.00 0.00 N ATOM 2318 CA TYR A 151 20.533 -12.229 -1.390 1.00 0.00 C ATOM 2319 C TYR A 151 20.625 -11.504 -2.734 1.00 0.00 C ATOM 2320 O TYR A 151 21.478 -11.793 -3.549 1.00 0.00 O ATOM 2321 CB TYR A 151 19.203 -12.983 -1.308 1.00 0.00 C ATOM 2322 CG TYR A 151 19.167 -13.804 -0.041 1.00 0.00 C ATOM 2323 CD1 TYR A 151 20.075 -14.855 0.138 1.00 0.00 C ATOM 2324 CD2 TYR A 151 18.227 -13.514 0.955 1.00 0.00 C ATOM 2325 CE1 TYR A 151 20.042 -15.617 1.312 1.00 0.00 C ATOM 2326 CE2 TYR A 151 18.194 -14.276 2.129 1.00 0.00 C ATOM 2327 CZ TYR A 151 19.102 -15.327 2.308 1.00 0.00 C ATOM 2328 OH TYR A 151 19.069 -16.077 3.466 1.00 0.00 O ATOM 0 H TYR A 151 19.838 -11.266 0.383 1.00 0.00 H new ATOM 0 HA TYR A 151 21.358 -12.936 -1.301 1.00 0.00 H new ATOM 0 HB2 TYR A 151 18.372 -12.278 -1.321 1.00 0.00 H new ATOM 0 HB3 TYR A 151 19.086 -13.630 -2.177 1.00 0.00 H new ATOM 0 HD1 TYR A 151 20.801 -15.078 -0.630 1.00 0.00 H new ATOM 0 HD2 TYR A 151 17.527 -12.703 0.818 1.00 0.00 H new ATOM 0 HE1 TYR A 151 20.742 -16.428 1.449 1.00 0.00 H new ATOM 0 HE2 TYR A 151 17.468 -14.053 2.897 1.00 0.00 H new ATOM 0 HH TYR A 151 18.358 -15.743 4.052 1.00 0.00 H new ATOM 2338 N LEU A 152 19.753 -10.563 -2.971 1.00 0.00 N ATOM 2339 CA LEU A 152 19.790 -9.819 -4.262 1.00 0.00 C ATOM 2340 C LEU A 152 21.151 -9.141 -4.424 1.00 0.00 C ATOM 2341 O LEU A 152 21.721 -9.118 -5.496 1.00 0.00 O ATOM 2342 CB LEU A 152 18.688 -8.757 -4.271 1.00 0.00 C ATOM 2343 CG LEU A 152 17.335 -9.423 -4.013 1.00 0.00 C ATOM 2344 CD1 LEU A 152 16.218 -8.393 -4.191 1.00 0.00 C ATOM 2345 CD2 LEU A 152 17.134 -10.570 -5.004 1.00 0.00 C ATOM 0 H LEU A 152 19.016 -10.277 -2.326 1.00 0.00 H new ATOM 0 HA LEU A 152 19.632 -10.516 -5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 152 18.887 -8.005 -3.507 1.00 0.00 H new ATOM 0 HB3 LEU A 152 18.674 -8.240 -5.231 1.00 0.00 H new ATOM 0 HG LEU A 152 17.310 -9.814 -2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 152 15.254 -8.867 -4.007 1.00 0.00 H new ATOM 0 HD12 LEU A 152 16.361 -7.575 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU A 152 16.242 -8.002 -5.208 1.00 0.00 H new ATOM 0 HD21 LEU A 152 16.170 -11.045 -4.820 1.00 0.00 H new ATOM 0 HD22 LEU A 152 17.159 -10.180 -6.022 1.00 0.00 H new ATOM 0 HD23 LEU A 152 17.930 -11.304 -4.877 1.00 0.00 H new