USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 751 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.285 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= 0.322 K(o=0.32,f=-5.2!) USER MOD Single : A 9 GLN : amide:sc= -0.0812 X(o=-0.081,f=-0.063) USER MOD Single : A 10 ASN : amide:sc=-0.00313 X(o=-0.0031,f=-0.26) USER MOD Single : A 11 GLN : amide:sc=-0.00991 X(o=-0.0099,f=-0.056) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 13 GLN : amide:sc= -0.298 K(o=-0.3,f=-2.5!) USER MOD Single : A 14 HIS : no HD1:sc= -0.654 K(o=-0.65,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.574 K(o=-0.57,f=-3.5!) USER MOD Single : A 19 GLN : amide:sc= -0.196 K(o=-0.2,f=-1.4!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= -2.17! K(o=-2.2!,f=-0.66) USER MOD Single : A 29 GLN : amide:sc= -0.323 K(o=-0.32,f=-2.5!) USER MOD Single : A 30 MET CE :methyl -174:sc= 0 (180deg=-0.0538) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 35 ASN : amide:sc= -4.65! C(o=-4.7!,f=-6.5!) USER MOD Single : A 42 LYS NZ :NH3+ 174:sc= 0.144 (180deg=0.11) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 GLN : amide:sc= -1.58 K(o=-1.6,f=-2.2!) USER MOD Single : A 50 THR OG1 : rot -81:sc= 0.629! USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 ASN : amide:sc= -0.121 K(o=-0.12,f=-1.9) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 57 CYS SG : rot 111:sc= -0.0567 USER MOD Single : A 62 HIS : no HD1:sc= -0.771 K(o=-0.77,f=-0.16) USER MOD Single : A 64 CYS SG : rot -60:sc= -6.21! USER MOD Single : A 65 ASN : amide:sc= -2.58! C(o=-2.6!,f=-3.8!) USER MOD Single : A 69 ASN : amide:sc= -0.178 X(o=-0.18,f=-0.22) USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= -0.477 K(o=-0.48,f=-3!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= -1.41! C(o=-1.4!,f=-1.1!) USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 60:sc= 0.0796 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.604 -0.054 -24.849 1.00 0.00 N ATOM 2 CA GLY A 1 -3.831 -0.472 -25.505 1.00 0.00 C ATOM 3 C GLY A 1 -4.070 0.332 -26.784 1.00 0.00 C ATOM 4 O GLY A 1 -4.728 1.371 -26.755 1.00 0.00 O ATOM 0 H1 GLY A 1 -2.465 -0.614 -23.984 1.00 0.00 H new ATOM 0 H2 GLY A 1 -1.799 -0.202 -25.491 1.00 0.00 H new ATOM 0 H3 GLY A 1 -2.669 0.954 -24.602 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.776 -1.534 -25.744 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -4.674 -0.341 -24.826 1.00 0.00 H new ATOM 8 N SER A 2 -3.522 -0.178 -27.877 1.00 0.00 N ATOM 9 CA SER A 2 -3.668 0.480 -29.165 1.00 0.00 C ATOM 10 C SER A 2 -5.142 0.797 -29.427 1.00 0.00 C ATOM 11 O SER A 2 -5.492 1.939 -29.722 1.00 0.00 O ATOM 12 CB SER A 2 -3.103 -0.386 -30.293 1.00 0.00 C ATOM 13 OG SER A 2 -3.902 -1.541 -30.531 1.00 0.00 O ATOM 0 H SER A 2 -2.976 -1.039 -27.898 1.00 0.00 H new ATOM 0 HA SER A 2 -3.102 1.411 -29.139 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.039 0.205 -31.207 1.00 0.00 H new ATOM 0 HB3 SER A 2 -2.088 -0.693 -30.041 1.00 0.00 H new ATOM 0 HG SER A 2 -3.509 -2.066 -31.259 1.00 0.00 H new ATOM 19 N SER A 3 -5.966 -0.234 -29.309 1.00 0.00 N ATOM 20 CA SER A 3 -7.394 -0.079 -29.529 1.00 0.00 C ATOM 21 C SER A 3 -8.174 -0.828 -28.447 1.00 0.00 C ATOM 22 O SER A 3 -8.950 -0.225 -27.706 1.00 0.00 O ATOM 23 CB SER A 3 -7.795 -0.583 -30.917 1.00 0.00 C ATOM 24 OG SER A 3 -7.484 0.361 -31.938 1.00 0.00 O ATOM 0 H SER A 3 -5.672 -1.180 -29.064 1.00 0.00 H new ATOM 0 HA SER A 3 -7.636 0.982 -29.474 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.282 -1.523 -31.124 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.864 -0.793 -30.931 1.00 0.00 H new ATOM 0 HG SER A 3 -7.754 0.002 -32.809 1.00 0.00 H new ATOM 30 N GLY A 4 -7.942 -2.131 -28.389 1.00 0.00 N ATOM 31 CA GLY A 4 -8.614 -2.969 -27.410 1.00 0.00 C ATOM 32 C GLY A 4 -9.733 -3.783 -28.061 1.00 0.00 C ATOM 33 O GLY A 4 -9.665 -5.011 -28.109 1.00 0.00 O ATOM 0 H GLY A 4 -7.298 -2.627 -29.004 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -7.893 -3.642 -26.946 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -9.027 -2.347 -26.616 1.00 0.00 H new ATOM 37 N SER A 5 -10.738 -3.068 -28.545 1.00 0.00 N ATOM 38 CA SER A 5 -11.870 -3.709 -29.191 1.00 0.00 C ATOM 39 C SER A 5 -12.574 -4.644 -28.206 1.00 0.00 C ATOM 40 O SER A 5 -12.203 -5.810 -28.078 1.00 0.00 O ATOM 41 CB SER A 5 -11.429 -4.483 -30.435 1.00 0.00 C ATOM 42 OG SER A 5 -11.110 -3.615 -31.519 1.00 0.00 O ATOM 0 H SER A 5 -10.792 -2.050 -28.503 1.00 0.00 H new ATOM 0 HA SER A 5 -12.567 -2.933 -29.507 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.560 -5.094 -30.192 1.00 0.00 H new ATOM 0 HB3 SER A 5 -12.224 -5.165 -30.738 1.00 0.00 H new ATOM 0 HG SER A 5 -10.832 -4.147 -32.293 1.00 0.00 H new ATOM 48 N SER A 6 -13.577 -4.098 -27.535 1.00 0.00 N ATOM 49 CA SER A 6 -14.336 -4.869 -26.565 1.00 0.00 C ATOM 50 C SER A 6 -13.449 -5.226 -25.371 1.00 0.00 C ATOM 51 O SER A 6 -12.227 -5.110 -25.444 1.00 0.00 O ATOM 52 CB SER A 6 -14.910 -6.139 -27.198 1.00 0.00 C ATOM 53 OG SER A 6 -16.236 -6.406 -26.751 1.00 0.00 O ATOM 0 H SER A 6 -13.882 -3.131 -27.644 1.00 0.00 H new ATOM 0 HA SER A 6 -15.170 -4.258 -26.220 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.907 -6.036 -28.283 1.00 0.00 H new ATOM 0 HB3 SER A 6 -14.268 -6.986 -26.956 1.00 0.00 H new ATOM 0 HG SER A 6 -16.567 -7.223 -27.179 1.00 0.00 H new ATOM 59 N GLY A 7 -14.099 -5.653 -24.298 1.00 0.00 N ATOM 60 CA GLY A 7 -13.385 -6.028 -23.090 1.00 0.00 C ATOM 61 C GLY A 7 -14.358 -6.328 -21.948 1.00 0.00 C ATOM 62 O GLY A 7 -15.435 -6.878 -22.174 1.00 0.00 O ATOM 0 H GLY A 7 -15.113 -5.747 -24.241 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -12.767 -6.905 -23.286 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.712 -5.223 -22.797 1.00 0.00 H new ATOM 66 N ASN A 8 -13.944 -5.955 -20.746 1.00 0.00 N ATOM 67 CA ASN A 8 -14.766 -6.178 -19.569 1.00 0.00 C ATOM 68 C ASN A 8 -15.646 -4.950 -19.326 1.00 0.00 C ATOM 69 O ASN A 8 -15.260 -3.830 -19.660 1.00 0.00 O ATOM 70 CB ASN A 8 -13.901 -6.392 -18.326 1.00 0.00 C ATOM 71 CG ASN A 8 -13.033 -5.164 -18.043 1.00 0.00 C ATOM 72 OD1 ASN A 8 -12.524 -4.512 -18.939 1.00 0.00 O ATOM 73 ND2 ASN A 8 -12.894 -4.887 -16.750 1.00 0.00 N ATOM 0 H ASN A 8 -13.050 -5.500 -20.562 1.00 0.00 H new ATOM 0 HA ASN A 8 -15.372 -7.067 -19.745 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.539 -6.597 -17.466 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -13.265 -7.266 -18.467 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -12.333 -4.087 -16.457 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -13.348 -5.475 -16.051 1.00 0.00 H new ATOM 80 N GLN A 9 -16.811 -5.201 -18.748 1.00 0.00 N ATOM 81 CA GLN A 9 -17.749 -4.129 -18.457 1.00 0.00 C ATOM 82 C GLN A 9 -18.253 -3.498 -19.756 1.00 0.00 C ATOM 83 O GLN A 9 -17.469 -3.223 -20.663 1.00 0.00 O ATOM 84 CB GLN A 9 -17.113 -3.077 -17.547 1.00 0.00 C ATOM 85 CG GLN A 9 -17.915 -2.912 -16.255 1.00 0.00 C ATOM 86 CD GLN A 9 -17.796 -4.157 -15.373 1.00 0.00 C ATOM 87 OE1 GLN A 9 -16.728 -4.519 -14.908 1.00 0.00 O ATOM 88 NE2 GLN A 9 -18.948 -4.789 -15.171 1.00 0.00 N ATOM 0 H GLN A 9 -17.127 -6.131 -18.473 1.00 0.00 H new ATOM 0 HA GLN A 9 -18.602 -4.552 -17.927 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -16.090 -3.368 -17.309 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -17.060 -2.122 -18.071 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -17.556 -2.039 -15.709 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -18.963 -2.730 -16.494 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -19.806 -4.431 -15.591 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -18.974 -5.631 -14.596 1.00 0.00 H new ATOM 97 N ASN A 10 -19.560 -3.287 -19.806 1.00 0.00 N ATOM 98 CA ASN A 10 -20.179 -2.694 -20.979 1.00 0.00 C ATOM 99 C ASN A 10 -21.572 -2.179 -20.610 1.00 0.00 C ATOM 100 O ASN A 10 -22.070 -2.452 -19.519 1.00 0.00 O ATOM 101 CB ASN A 10 -20.336 -3.724 -22.099 1.00 0.00 C ATOM 102 CG ASN A 10 -21.392 -4.770 -21.737 1.00 0.00 C ATOM 103 OD1 ASN A 10 -22.553 -4.669 -22.099 1.00 0.00 O ATOM 104 ND2 ASN A 10 -20.927 -5.778 -21.006 1.00 0.00 N ATOM 0 H ASN A 10 -20.208 -3.516 -19.052 1.00 0.00 H new ATOM 0 HA ASN A 10 -19.539 -1.882 -21.324 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -20.619 -3.221 -23.024 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -19.380 -4.215 -22.283 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -21.554 -6.528 -20.714 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -19.943 -5.802 -20.737 1.00 0.00 H new ATOM 111 N GLN A 11 -22.162 -1.445 -21.542 1.00 0.00 N ATOM 112 CA GLN A 11 -23.488 -0.890 -21.329 1.00 0.00 C ATOM 113 C GLN A 11 -23.424 0.270 -20.333 1.00 0.00 C ATOM 114 O GLN A 11 -23.818 1.391 -20.654 1.00 0.00 O ATOM 115 CB GLN A 11 -24.463 -1.968 -20.852 1.00 0.00 C ATOM 116 CG GLN A 11 -25.913 -1.513 -21.030 1.00 0.00 C ATOM 117 CD GLN A 11 -26.884 -2.521 -20.413 1.00 0.00 C ATOM 118 OE1 GLN A 11 -26.763 -2.916 -19.265 1.00 0.00 O ATOM 119 NE2 GLN A 11 -27.852 -2.914 -21.237 1.00 0.00 N ATOM 0 H GLN A 11 -21.746 -1.222 -22.446 1.00 0.00 H new ATOM 0 HA GLN A 11 -23.857 -0.507 -22.280 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -24.296 -2.888 -21.412 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -24.275 -2.195 -19.802 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -26.051 -0.537 -20.564 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -26.133 -1.394 -22.091 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -27.895 -2.544 -22.186 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -28.551 -3.586 -20.919 1.00 0.00 H new ATOM 128 N THR A 12 -22.924 -0.038 -19.145 1.00 0.00 N ATOM 129 CA THR A 12 -22.803 0.965 -18.101 1.00 0.00 C ATOM 130 C THR A 12 -21.724 1.987 -18.465 1.00 0.00 C ATOM 131 O THR A 12 -22.011 3.173 -18.612 1.00 0.00 O ATOM 132 CB THR A 12 -22.536 0.242 -16.780 1.00 0.00 C ATOM 133 OG1 THR A 12 -23.750 -0.453 -16.512 1.00 0.00 O ATOM 134 CG2 THR A 12 -22.392 1.208 -15.602 1.00 0.00 C ATOM 0 H THR A 12 -22.598 -0.968 -18.883 1.00 0.00 H new ATOM 0 HA THR A 12 -23.724 1.538 -17.994 1.00 0.00 H new ATOM 0 HB THR A 12 -21.630 -0.357 -16.872 1.00 0.00 H new ATOM 0 HG1 THR A 12 -23.663 -0.951 -15.672 1.00 0.00 H new ATOM 0 HG21 THR A 12 -22.204 0.643 -14.689 1.00 0.00 H new ATOM 0 HG22 THR A 12 -21.559 1.886 -15.787 1.00 0.00 H new ATOM 0 HG23 THR A 12 -23.311 1.784 -15.489 1.00 0.00 H new ATOM 142 N GLN A 13 -20.504 1.488 -18.599 1.00 0.00 N ATOM 143 CA GLN A 13 -19.379 2.342 -18.942 1.00 0.00 C ATOM 144 C GLN A 13 -18.695 1.833 -20.213 1.00 0.00 C ATOM 145 O GLN A 13 -18.985 0.733 -20.680 1.00 0.00 O ATOM 146 CB GLN A 13 -18.385 2.432 -17.783 1.00 0.00 C ATOM 147 CG GLN A 13 -18.149 3.888 -17.375 1.00 0.00 C ATOM 148 CD GLN A 13 -18.786 4.186 -16.016 1.00 0.00 C ATOM 149 OE1 GLN A 13 -19.085 3.300 -15.233 1.00 0.00 O ATOM 150 NE2 GLN A 13 -18.975 5.482 -15.780 1.00 0.00 N ATOM 0 H GLN A 13 -20.270 0.503 -18.476 1.00 0.00 H new ATOM 0 HA GLN A 13 -19.756 3.347 -19.133 1.00 0.00 H new ATOM 0 HB2 GLN A 13 -18.763 1.868 -16.930 1.00 0.00 H new ATOM 0 HB3 GLN A 13 -17.439 1.974 -18.074 1.00 0.00 H new ATOM 0 HG2 GLN A 13 -17.078 4.088 -17.331 1.00 0.00 H new ATOM 0 HG3 GLN A 13 -18.567 4.554 -18.130 1.00 0.00 H new ATOM 0 HE21 GLN A 13 -18.702 6.173 -16.479 1.00 0.00 H new ATOM 0 HE22 GLN A 13 -19.393 5.785 -14.900 1.00 0.00 H new ATOM 159 N HIS A 14 -17.800 2.659 -20.735 1.00 0.00 N ATOM 160 CA HIS A 14 -17.073 2.307 -21.943 1.00 0.00 C ATOM 161 C HIS A 14 -15.625 1.961 -21.587 1.00 0.00 C ATOM 162 O HIS A 14 -15.101 0.939 -22.028 1.00 0.00 O ATOM 163 CB HIS A 14 -17.177 3.422 -22.985 1.00 0.00 C ATOM 164 CG HIS A 14 -18.565 3.603 -23.553 1.00 0.00 C ATOM 165 ND1 HIS A 14 -18.796 4.134 -24.810 1.00 0.00 N ATOM 166 CD2 HIS A 14 -19.789 3.318 -23.024 1.00 0.00 C ATOM 167 CE1 HIS A 14 -20.105 4.164 -25.017 1.00 0.00 C ATOM 168 NE2 HIS A 14 -20.718 3.658 -23.909 1.00 0.00 N ATOM 0 H HIS A 14 -17.562 3.570 -20.344 1.00 0.00 H new ATOM 0 HA HIS A 14 -17.521 1.423 -22.397 1.00 0.00 H new ATOM 0 HB2 HIS A 14 -16.855 4.360 -22.532 1.00 0.00 H new ATOM 0 HB3 HIS A 14 -16.486 3.209 -23.801 1.00 0.00 H new ATOM 0 HD2 HIS A 14 -19.972 2.888 -22.050 1.00 0.00 H new ATOM 0 HE1 HIS A 14 -20.599 4.526 -25.907 1.00 0.00 H new ATOM 0 HE2 HIS A 14 -21.725 3.557 -23.781 1.00 0.00 H new ATOM 176 N LYS A 15 -15.021 2.832 -20.793 1.00 0.00 N ATOM 177 CA LYS A 15 -13.644 2.632 -20.374 1.00 0.00 C ATOM 178 C LYS A 15 -13.236 3.760 -19.424 1.00 0.00 C ATOM 179 O LYS A 15 -12.628 3.511 -18.384 1.00 0.00 O ATOM 180 CB LYS A 15 -12.728 2.492 -21.591 1.00 0.00 C ATOM 181 CG LYS A 15 -13.137 3.463 -22.700 1.00 0.00 C ATOM 182 CD LYS A 15 -11.927 4.243 -23.220 1.00 0.00 C ATOM 183 CE LYS A 15 -12.306 5.099 -24.430 1.00 0.00 C ATOM 184 NZ LYS A 15 -12.864 6.398 -23.992 1.00 0.00 N ATOM 0 H LYS A 15 -15.459 3.678 -20.429 1.00 0.00 H new ATOM 0 HA LYS A 15 -13.546 1.698 -19.822 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -11.696 2.683 -21.298 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -12.768 1.469 -21.965 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -13.598 2.911 -23.519 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -13.887 4.158 -22.322 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -11.533 4.880 -22.428 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -11.133 3.549 -23.495 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -11.428 5.266 -25.054 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -13.037 4.570 -25.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -13.116 6.966 -24.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -13.714 6.234 -23.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -12.155 6.908 -23.427 1.00 0.00 H new ATOM 198 N GLN A 16 -13.587 4.976 -19.815 1.00 0.00 N ATOM 199 CA GLN A 16 -13.265 6.143 -19.011 1.00 0.00 C ATOM 200 C GLN A 16 -13.577 5.875 -17.537 1.00 0.00 C ATOM 201 O GLN A 16 -14.738 5.893 -17.131 1.00 0.00 O ATOM 202 CB GLN A 16 -14.014 7.379 -19.514 1.00 0.00 C ATOM 203 CG GLN A 16 -13.044 8.407 -20.100 1.00 0.00 C ATOM 204 CD GLN A 16 -12.176 9.029 -19.004 1.00 0.00 C ATOM 205 OE1 GLN A 16 -11.389 8.366 -18.349 1.00 0.00 O ATOM 206 NE2 GLN A 16 -12.364 10.336 -18.842 1.00 0.00 N ATOM 0 H GLN A 16 -14.091 5.179 -20.678 1.00 0.00 H new ATOM 0 HA GLN A 16 -12.197 6.342 -19.106 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -14.740 7.085 -20.272 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -14.574 7.828 -18.694 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -12.408 7.929 -20.845 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -13.604 9.189 -20.613 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -13.039 10.830 -19.425 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -11.833 10.844 -18.135 1.00 0.00 H new ATOM 215 N ARG A 17 -12.520 5.632 -16.776 1.00 0.00 N ATOM 216 CA ARG A 17 -12.666 5.360 -15.356 1.00 0.00 C ATOM 217 C ARG A 17 -11.639 6.161 -14.554 1.00 0.00 C ATOM 218 O ARG A 17 -10.603 6.557 -15.086 1.00 0.00 O ATOM 219 CB ARG A 17 -12.486 3.870 -15.059 1.00 0.00 C ATOM 220 CG ARG A 17 -13.818 3.223 -14.676 1.00 0.00 C ATOM 221 CD ARG A 17 -13.617 1.769 -14.244 1.00 0.00 C ATOM 222 NE ARG A 17 -14.923 1.076 -14.174 1.00 0.00 N ATOM 223 CZ ARG A 17 -15.106 -0.127 -13.612 1.00 0.00 C ATOM 224 NH1 ARG A 17 -14.068 -0.777 -13.068 1.00 0.00 N ATOM 225 NH2 ARG A 17 -16.326 -0.679 -13.594 1.00 0.00 N ATOM 0 H ARG A 17 -11.558 5.618 -17.116 1.00 0.00 H new ATOM 0 HA ARG A 17 -13.673 5.658 -15.063 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -12.072 3.368 -15.934 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -11.769 3.741 -14.249 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -14.280 3.786 -13.865 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -14.503 3.263 -15.523 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -12.963 1.258 -14.950 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -13.125 1.735 -13.272 1.00 0.00 H new ATOM 0 HE ARG A 17 -15.734 1.543 -14.579 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -13.139 -0.356 -13.082 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -14.207 -1.692 -12.640 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -17.116 -0.184 -14.008 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -16.465 -1.594 -13.166 1.00 0.00 H new ATOM 239 N PRO A 18 -11.971 6.382 -13.254 1.00 0.00 N ATOM 240 CA PRO A 18 -11.089 7.128 -12.373 1.00 0.00 C ATOM 241 C PRO A 18 -9.883 6.282 -11.958 1.00 0.00 C ATOM 242 O PRO A 18 -8.786 6.458 -12.485 1.00 0.00 O ATOM 243 CB PRO A 18 -11.961 7.536 -11.196 1.00 0.00 C ATOM 244 CG PRO A 18 -13.169 6.615 -11.234 1.00 0.00 C ATOM 245 CD PRO A 18 -13.189 5.928 -12.590 1.00 0.00 C ATOM 0 HA PRO A 18 -10.657 8.005 -12.855 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -11.420 7.433 -10.255 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -12.263 8.580 -11.277 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -13.112 5.878 -10.433 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -14.087 7.183 -11.080 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -13.201 4.843 -12.484 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -14.077 6.203 -13.160 1.00 0.00 H new ATOM 253 N GLN A 19 -10.128 5.382 -11.017 1.00 0.00 N ATOM 254 CA GLN A 19 -9.076 4.508 -10.526 1.00 0.00 C ATOM 255 C GLN A 19 -8.031 5.317 -9.756 1.00 0.00 C ATOM 256 O GLN A 19 -7.743 6.460 -10.107 1.00 0.00 O ATOM 257 CB GLN A 19 -8.430 3.729 -11.673 1.00 0.00 C ATOM 258 CG GLN A 19 -8.035 2.320 -11.225 1.00 0.00 C ATOM 259 CD GLN A 19 -6.535 2.086 -11.411 1.00 0.00 C ATOM 260 OE1 GLN A 19 -5.731 3.004 -11.398 1.00 0.00 O ATOM 261 NE2 GLN A 19 -6.204 0.809 -11.583 1.00 0.00 N ATOM 0 H GLN A 19 -11.039 5.239 -10.582 1.00 0.00 H new ATOM 0 HA GLN A 19 -9.521 3.783 -9.844 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -9.124 3.667 -12.511 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -7.548 4.262 -12.028 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -8.301 2.180 -10.177 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.596 1.582 -11.798 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -6.928 0.090 -11.583 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -5.227 0.549 -11.715 1.00 0.00 H new ATOM 270 N ALA A 20 -7.491 4.692 -8.719 1.00 0.00 N ATOM 271 CA ALA A 20 -6.484 5.339 -7.896 1.00 0.00 C ATOM 272 C ALA A 20 -7.174 6.219 -6.851 1.00 0.00 C ATOM 273 O ALA A 20 -6.886 6.115 -5.660 1.00 0.00 O ATOM 274 CB ALA A 20 -5.529 6.134 -8.789 1.00 0.00 C ATOM 0 H ALA A 20 -7.733 3.744 -8.430 1.00 0.00 H new ATOM 0 HA ALA A 20 -5.890 4.597 -7.362 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -4.773 6.620 -8.172 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -5.043 5.459 -9.494 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.089 6.890 -9.339 1.00 0.00 H new ATOM 280 N THR A 21 -8.071 7.065 -7.336 1.00 0.00 N ATOM 281 CA THR A 21 -8.804 7.961 -6.458 1.00 0.00 C ATOM 282 C THR A 21 -9.700 7.164 -5.508 1.00 0.00 C ATOM 283 O THR A 21 -9.222 6.603 -4.524 1.00 0.00 O ATOM 284 CB THR A 21 -9.575 8.952 -7.332 1.00 0.00 C ATOM 285 OG1 THR A 21 -8.559 9.751 -7.932 1.00 0.00 O ATOM 286 CG2 THR A 21 -10.393 9.947 -6.507 1.00 0.00 C ATOM 0 H THR A 21 -8.307 7.149 -8.325 1.00 0.00 H new ATOM 0 HA THR A 21 -8.128 8.527 -5.817 1.00 0.00 H new ATOM 0 HB THR A 21 -10.238 8.405 -8.002 1.00 0.00 H new ATOM 0 HG1 THR A 21 -8.972 10.420 -8.517 1.00 0.00 H new ATOM 0 HG21 THR A 21 -10.920 10.627 -7.176 1.00 0.00 H new ATOM 0 HG22 THR A 21 -11.116 9.406 -5.896 1.00 0.00 H new ATOM 0 HG23 THR A 21 -9.727 10.518 -5.860 1.00 0.00 H new ATOM 294 N ALA A 22 -10.983 7.140 -5.837 1.00 0.00 N ATOM 295 CA ALA A 22 -11.950 6.420 -5.026 1.00 0.00 C ATOM 296 C ALA A 22 -11.664 4.919 -5.110 1.00 0.00 C ATOM 297 O ALA A 22 -11.589 4.240 -4.087 1.00 0.00 O ATOM 298 CB ALA A 22 -13.366 6.771 -5.487 1.00 0.00 C ATOM 0 H ALA A 22 -11.375 7.608 -6.654 1.00 0.00 H new ATOM 0 HA ALA A 22 -11.866 6.713 -3.979 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.091 6.231 -4.878 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -13.529 7.843 -5.379 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -13.488 6.489 -6.533 1.00 0.00 H new ATOM 304 N GLU A 23 -11.512 4.446 -6.338 1.00 0.00 N ATOM 305 CA GLU A 23 -11.236 3.039 -6.569 1.00 0.00 C ATOM 306 C GLU A 23 -10.262 2.509 -5.514 1.00 0.00 C ATOM 307 O GLU A 23 -10.581 1.570 -4.786 1.00 0.00 O ATOM 308 CB GLU A 23 -10.693 2.811 -7.981 1.00 0.00 C ATOM 309 CG GLU A 23 -10.969 1.381 -8.451 1.00 0.00 C ATOM 310 CD GLU A 23 -12.298 1.299 -9.204 1.00 0.00 C ATOM 311 OE1 GLU A 23 -12.364 1.887 -10.305 1.00 0.00 O ATOM 312 OE2 GLU A 23 -13.219 0.651 -8.662 1.00 0.00 O ATOM 0 H GLU A 23 -11.575 5.013 -7.184 1.00 0.00 H new ATOM 0 HA GLU A 23 -12.171 2.486 -6.482 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -11.153 3.519 -8.670 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -9.620 3.002 -7.997 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -10.159 1.044 -9.098 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -10.991 0.710 -7.592 1.00 0.00 H new ATOM 319 N GLN A 24 -9.095 3.133 -5.466 1.00 0.00 N ATOM 320 CA GLN A 24 -8.073 2.736 -4.513 1.00 0.00 C ATOM 321 C GLN A 24 -8.643 2.732 -3.093 1.00 0.00 C ATOM 322 O GLN A 24 -8.527 1.740 -2.376 1.00 0.00 O ATOM 323 CB GLN A 24 -6.849 3.649 -4.609 1.00 0.00 C ATOM 324 CG GLN A 24 -5.604 2.957 -4.051 1.00 0.00 C ATOM 325 CD GLN A 24 -4.771 3.925 -3.208 1.00 0.00 C ATOM 326 OE1 GLN A 24 -3.688 4.343 -3.584 1.00 0.00 O ATOM 327 NE2 GLN A 24 -5.334 4.258 -2.050 1.00 0.00 N ATOM 0 H GLN A 24 -8.834 3.911 -6.072 1.00 0.00 H new ATOM 0 HA GLN A 24 -7.751 1.724 -4.757 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -6.679 3.928 -5.649 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -7.035 4.571 -4.058 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -5.900 2.102 -3.443 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -4.999 2.571 -4.872 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -6.243 3.872 -1.795 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -4.857 4.899 -1.417 1.00 0.00 H new ATOM 336 N ILE A 25 -9.248 3.854 -2.730 1.00 0.00 N ATOM 337 CA ILE A 25 -9.837 3.993 -1.409 1.00 0.00 C ATOM 338 C ILE A 25 -10.621 2.724 -1.069 1.00 0.00 C ATOM 339 O ILE A 25 -10.406 2.118 -0.021 1.00 0.00 O ATOM 340 CB ILE A 25 -10.671 5.272 -1.326 1.00 0.00 C ATOM 341 CG1 ILE A 25 -9.787 6.514 -1.461 1.00 0.00 C ATOM 342 CG2 ILE A 25 -11.507 5.300 -0.045 1.00 0.00 C ATOM 343 CD1 ILE A 25 -10.635 7.778 -1.607 1.00 0.00 C ATOM 0 H ILE A 25 -9.343 4.675 -3.328 1.00 0.00 H new ATOM 0 HA ILE A 25 -9.058 4.099 -0.654 1.00 0.00 H new ATOM 0 HB ILE A 25 -11.367 5.280 -2.165 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -9.143 6.603 -0.586 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -9.134 6.408 -2.328 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -12.090 6.220 -0.011 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -12.180 4.443 -0.031 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -10.847 5.257 0.821 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -9.982 8.646 -1.701 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -11.260 7.696 -2.496 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -11.269 7.895 -0.728 1.00 0.00 H new ATOM 355 N ARG A 26 -11.516 2.359 -1.977 1.00 0.00 N ATOM 356 CA ARG A 26 -12.333 1.173 -1.786 1.00 0.00 C ATOM 357 C ARG A 26 -11.458 -0.082 -1.793 1.00 0.00 C ATOM 358 O ARG A 26 -11.643 -0.976 -0.969 1.00 0.00 O ATOM 359 CB ARG A 26 -13.393 1.053 -2.883 1.00 0.00 C ATOM 360 CG ARG A 26 -14.567 1.998 -2.617 1.00 0.00 C ATOM 361 CD ARG A 26 -15.876 1.220 -2.474 1.00 0.00 C ATOM 362 NE ARG A 26 -16.852 2.009 -1.689 1.00 0.00 N ATOM 363 CZ ARG A 26 -17.883 1.477 -1.019 1.00 0.00 C ATOM 364 NH1 ARG A 26 -18.080 0.151 -1.035 1.00 0.00 N ATOM 365 NH2 ARG A 26 -18.717 2.270 -0.333 1.00 0.00 N ATOM 0 H ARG A 26 -11.692 2.864 -2.846 1.00 0.00 H new ATOM 0 HA ARG A 26 -12.832 1.266 -0.822 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -12.948 1.284 -3.851 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -13.753 0.026 -2.935 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -14.379 2.570 -1.709 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -14.653 2.715 -3.433 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -16.285 0.997 -3.459 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -15.689 0.265 -1.983 1.00 0.00 H new ATOM 0 HE ARG A 26 -16.732 3.021 -1.656 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -17.445 -0.453 -1.557 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -18.865 -0.254 -0.525 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -18.567 3.279 -0.321 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -19.502 1.865 0.177 1.00 0.00 H new ATOM 379 N LEU A 27 -10.524 -0.108 -2.732 1.00 0.00 N ATOM 380 CA LEU A 27 -9.620 -1.239 -2.857 1.00 0.00 C ATOM 381 C LEU A 27 -8.888 -1.450 -1.531 1.00 0.00 C ATOM 382 O LEU A 27 -8.859 -2.560 -1.003 1.00 0.00 O ATOM 383 CB LEU A 27 -8.685 -1.047 -4.053 1.00 0.00 C ATOM 384 CG LEU A 27 -9.319 -1.214 -5.435 1.00 0.00 C ATOM 385 CD1 LEU A 27 -8.251 -1.454 -6.504 1.00 0.00 C ATOM 386 CD2 LEU A 27 -10.376 -2.321 -5.423 1.00 0.00 C ATOM 0 H LEU A 27 -10.373 0.636 -3.414 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.178 -2.153 -3.062 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.251 -0.049 -3.993 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.863 -1.758 -3.964 1.00 0.00 H new ATOM 0 HG LEU A 27 -9.828 -0.285 -5.691 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.729 -1.569 -7.477 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -7.569 -0.605 -6.534 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -7.693 -2.359 -6.264 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -10.811 -2.419 -6.417 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -9.912 -3.264 -5.135 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -11.159 -2.069 -4.708 1.00 0.00 H new ATOM 398 N ALA A 28 -8.313 -0.366 -1.030 1.00 0.00 N ATOM 399 CA ALA A 28 -7.583 -0.418 0.225 1.00 0.00 C ATOM 400 C ALA A 28 -8.546 -0.785 1.356 1.00 0.00 C ATOM 401 O ALA A 28 -8.180 -1.519 2.273 1.00 0.00 O ATOM 402 CB ALA A 28 -6.885 0.923 0.466 1.00 0.00 C ATOM 0 H ALA A 28 -8.338 0.553 -1.471 1.00 0.00 H new ATOM 0 HA ALA A 28 -6.810 -1.186 0.188 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -6.337 0.884 1.408 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -6.190 1.123 -0.350 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -7.630 1.718 0.512 1.00 0.00 H new ATOM 408 N GLN A 29 -9.757 -0.258 1.253 1.00 0.00 N ATOM 409 CA GLN A 29 -10.775 -0.522 2.256 1.00 0.00 C ATOM 410 C GLN A 29 -11.215 -1.986 2.194 1.00 0.00 C ATOM 411 O GLN A 29 -11.546 -2.582 3.217 1.00 0.00 O ATOM 412 CB GLN A 29 -11.970 0.417 2.084 1.00 0.00 C ATOM 413 CG GLN A 29 -13.196 -0.112 2.831 1.00 0.00 C ATOM 414 CD GLN A 29 -13.953 1.025 3.518 1.00 0.00 C ATOM 415 OE1 GLN A 29 -13.590 2.187 3.435 1.00 0.00 O ATOM 416 NE2 GLN A 29 -15.024 0.628 4.201 1.00 0.00 N ATOM 0 H GLN A 29 -10.056 0.350 0.491 1.00 0.00 H new ATOM 0 HA GLN A 29 -10.345 -0.334 3.240 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -11.714 1.409 2.456 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -12.203 0.524 1.025 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -13.858 -0.625 2.133 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -12.885 -0.847 3.573 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -15.273 -0.361 4.230 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -15.596 1.313 4.695 1.00 0.00 H new ATOM 425 N MET A 30 -11.204 -2.523 0.983 1.00 0.00 N ATOM 426 CA MET A 30 -11.598 -3.906 0.774 1.00 0.00 C ATOM 427 C MET A 30 -10.431 -4.856 1.050 1.00 0.00 C ATOM 428 O MET A 30 -10.609 -5.896 1.683 1.00 0.00 O ATOM 429 CB MET A 30 -12.074 -4.089 -0.669 1.00 0.00 C ATOM 430 CG MET A 30 -13.547 -3.700 -0.813 1.00 0.00 C ATOM 431 SD MET A 30 -14.373 -4.834 -1.917 1.00 0.00 S ATOM 432 CE MET A 30 -13.601 -4.380 -3.461 1.00 0.00 C ATOM 0 H MET A 30 -10.928 -2.025 0.136 1.00 0.00 H new ATOM 0 HA MET A 30 -12.406 -4.142 1.466 1.00 0.00 H new ATOM 0 HB2 MET A 30 -11.466 -3.479 -1.337 1.00 0.00 H new ATOM 0 HB3 MET A 30 -11.937 -5.127 -0.972 1.00 0.00 H new ATOM 0 HG2 MET A 30 -14.032 -3.712 0.163 1.00 0.00 H new ATOM 0 HG3 MET A 30 -13.627 -2.683 -1.196 1.00 0.00 H new ATOM 0 HE1 MET A 30 -14.079 -4.919 -4.279 1.00 0.00 H new ATOM 0 HE2 MET A 30 -13.710 -3.307 -3.621 1.00 0.00 H new ATOM 0 HE3 MET A 30 -12.542 -4.636 -3.427 1.00 0.00 H new ATOM 442 N ILE A 31 -9.262 -4.465 0.563 1.00 0.00 N ATOM 443 CA ILE A 31 -8.067 -5.269 0.750 1.00 0.00 C ATOM 444 C ILE A 31 -7.912 -5.608 2.234 1.00 0.00 C ATOM 445 O ILE A 31 -7.744 -6.773 2.593 1.00 0.00 O ATOM 446 CB ILE A 31 -6.848 -4.564 0.150 1.00 0.00 C ATOM 447 CG1 ILE A 31 -6.802 -4.745 -1.368 1.00 0.00 C ATOM 448 CG2 ILE A 31 -5.557 -5.033 0.824 1.00 0.00 C ATOM 449 CD1 ILE A 31 -6.352 -3.457 -2.060 1.00 0.00 C ATOM 0 H ILE A 31 -9.118 -3.602 0.039 1.00 0.00 H new ATOM 0 HA ILE A 31 -8.156 -6.214 0.214 1.00 0.00 H new ATOM 0 HB ILE A 31 -6.942 -3.495 0.343 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -6.119 -5.556 -1.621 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -7.788 -5.033 -1.734 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -4.706 -4.517 0.379 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.601 -4.809 1.890 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -5.443 -6.108 0.684 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -6.328 -3.613 -3.139 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -7.051 -2.654 -1.825 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -5.356 -3.185 -1.710 1.00 0.00 H new ATOM 461 N SER A 32 -7.975 -4.571 3.055 1.00 0.00 N ATOM 462 CA SER A 32 -7.844 -4.745 4.492 1.00 0.00 C ATOM 463 C SER A 32 -8.709 -5.917 4.958 1.00 0.00 C ATOM 464 O SER A 32 -8.226 -6.815 5.645 1.00 0.00 O ATOM 465 CB SER A 32 -8.235 -3.468 5.239 1.00 0.00 C ATOM 466 OG SER A 32 -8.021 -3.584 6.643 1.00 0.00 O ATOM 0 H SER A 32 -8.115 -3.607 2.753 1.00 0.00 H new ATOM 0 HA SER A 32 -6.799 -4.960 4.717 1.00 0.00 H new ATOM 0 HB2 SER A 32 -7.656 -2.630 4.852 1.00 0.00 H new ATOM 0 HB3 SER A 32 -9.285 -3.244 5.050 1.00 0.00 H new ATOM 0 HG SER A 32 -8.281 -2.748 7.084 1.00 0.00 H new ATOM 472 N ASP A 33 -9.974 -5.872 4.565 1.00 0.00 N ATOM 473 CA ASP A 33 -10.911 -6.919 4.933 1.00 0.00 C ATOM 474 C ASP A 33 -10.361 -8.273 4.478 1.00 0.00 C ATOM 475 O ASP A 33 -10.433 -9.255 5.215 1.00 0.00 O ATOM 476 CB ASP A 33 -12.267 -6.709 4.257 1.00 0.00 C ATOM 477 CG ASP A 33 -13.373 -6.186 5.175 1.00 0.00 C ATOM 478 OD1 ASP A 33 -13.325 -4.978 5.492 1.00 0.00 O ATOM 479 OD2 ASP A 33 -14.242 -7.007 5.541 1.00 0.00 O ATOM 0 H ASP A 33 -10.372 -5.126 3.995 1.00 0.00 H new ATOM 0 HA ASP A 33 -11.040 -6.890 6.015 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -12.140 -6.009 3.431 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -12.591 -7.656 3.825 1.00 0.00 H new ATOM 484 N HIS A 34 -9.823 -8.280 3.267 1.00 0.00 N ATOM 485 CA HIS A 34 -9.261 -9.497 2.706 1.00 0.00 C ATOM 486 C HIS A 34 -7.738 -9.375 2.639 1.00 0.00 C ATOM 487 O HIS A 34 -7.190 -8.937 1.629 1.00 0.00 O ATOM 488 CB HIS A 34 -9.891 -9.809 1.347 1.00 0.00 C ATOM 489 CG HIS A 34 -11.363 -10.140 1.413 1.00 0.00 C ATOM 490 ND1 HIS A 34 -11.833 -11.407 1.710 1.00 0.00 N ATOM 491 CD2 HIS A 34 -12.462 -9.357 1.219 1.00 0.00 C ATOM 492 CE1 HIS A 34 -13.158 -11.377 1.692 1.00 0.00 C ATOM 493 NE2 HIS A 34 -13.545 -10.105 1.387 1.00 0.00 N ATOM 0 H HIS A 34 -9.764 -7.463 2.659 1.00 0.00 H new ATOM 0 HA HIS A 34 -9.495 -10.342 3.353 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -9.751 -8.952 0.688 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -9.360 -10.648 0.896 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -12.453 -8.306 0.971 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -13.815 -12.212 1.885 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -14.509 -9.782 1.302 1.00 0.00 H new ATOM 501 N ASN A 35 -7.096 -9.770 3.729 1.00 0.00 N ATOM 502 CA ASN A 35 -5.647 -9.711 3.807 1.00 0.00 C ATOM 503 C ASN A 35 -5.166 -10.598 4.958 1.00 0.00 C ATOM 504 O ASN A 35 -4.552 -11.639 4.729 1.00 0.00 O ATOM 505 CB ASN A 35 -5.168 -8.284 4.079 1.00 0.00 C ATOM 506 CG ASN A 35 -3.660 -8.251 4.335 1.00 0.00 C ATOM 507 OD1 ASN A 35 -2.993 -9.270 4.402 1.00 0.00 O ATOM 508 ND2 ASN A 35 -3.161 -7.026 4.474 1.00 0.00 N ATOM 0 H ASN A 35 -7.554 -10.132 4.566 1.00 0.00 H new ATOM 0 HA ASN A 35 -5.244 -10.052 2.853 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -5.410 -7.647 3.228 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -5.696 -7.878 4.942 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -2.164 -6.898 4.648 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -3.775 -6.214 4.407 1.00 0.00 H new ATOM 515 N ASP A 36 -5.463 -10.153 6.170 1.00 0.00 N ATOM 516 CA ASP A 36 -5.068 -10.893 7.356 1.00 0.00 C ATOM 517 C ASP A 36 -5.296 -10.023 8.594 1.00 0.00 C ATOM 518 O ASP A 36 -5.709 -8.870 8.479 1.00 0.00 O ATOM 519 CB ASP A 36 -3.585 -11.265 7.306 1.00 0.00 C ATOM 520 CG ASP A 36 -3.298 -12.757 7.127 1.00 0.00 C ATOM 521 OD1 ASP A 36 -4.193 -13.554 7.482 1.00 0.00 O ATOM 522 OD2 ASP A 36 -2.189 -13.067 6.640 1.00 0.00 O ATOM 0 H ASP A 36 -5.973 -9.289 6.356 1.00 0.00 H new ATOM 0 HA ASP A 36 -5.666 -11.803 7.400 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -3.117 -10.720 6.487 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -3.110 -10.927 8.227 1.00 0.00 H new ATOM 527 N ALA A 37 -5.016 -10.609 9.749 1.00 0.00 N ATOM 528 CA ALA A 37 -5.185 -9.901 11.007 1.00 0.00 C ATOM 529 C ALA A 37 -3.960 -9.020 11.260 1.00 0.00 C ATOM 530 O ALA A 37 -4.082 -7.921 11.798 1.00 0.00 O ATOM 531 CB ALA A 37 -5.421 -10.910 12.133 1.00 0.00 C ATOM 0 H ALA A 37 -4.673 -11.565 9.840 1.00 0.00 H new ATOM 0 HA ALA A 37 -6.057 -9.248 10.966 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -5.548 -10.379 13.077 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -6.319 -11.490 11.920 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -4.565 -11.580 12.206 1.00 0.00 H new ATOM 537 N ASP A 38 -2.807 -9.537 10.861 1.00 0.00 N ATOM 538 CA ASP A 38 -1.561 -8.811 11.038 1.00 0.00 C ATOM 539 C ASP A 38 -1.732 -7.379 10.526 1.00 0.00 C ATOM 540 O ASP A 38 -1.587 -6.423 11.285 1.00 0.00 O ATOM 541 CB ASP A 38 -0.426 -9.464 10.247 1.00 0.00 C ATOM 542 CG ASP A 38 -0.172 -10.936 10.576 1.00 0.00 C ATOM 543 OD1 ASP A 38 0.449 -11.183 11.632 1.00 0.00 O ATOM 544 OD2 ASP A 38 -0.605 -11.782 9.764 1.00 0.00 O ATOM 0 H ASP A 38 -2.710 -10.450 10.416 1.00 0.00 H new ATOM 0 HA ASP A 38 -1.313 -8.821 12.099 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -0.648 -9.378 9.183 1.00 0.00 H new ATOM 0 HB3 ASP A 38 0.491 -8.904 10.427 1.00 0.00 H new ATOM 549 N PHE A 39 -2.038 -7.278 9.241 1.00 0.00 N ATOM 550 CA PHE A 39 -2.231 -5.979 8.618 1.00 0.00 C ATOM 551 C PHE A 39 -3.239 -5.138 9.403 1.00 0.00 C ATOM 552 O PHE A 39 -3.039 -3.940 9.594 1.00 0.00 O ATOM 553 CB PHE A 39 -2.782 -6.234 7.213 1.00 0.00 C ATOM 554 CG PHE A 39 -3.099 -4.960 6.429 1.00 0.00 C ATOM 555 CD1 PHE A 39 -2.105 -4.085 6.120 1.00 0.00 C ATOM 556 CD2 PHE A 39 -4.377 -4.701 6.040 1.00 0.00 C ATOM 557 CE1 PHE A 39 -2.400 -2.902 5.392 1.00 0.00 C ATOM 558 CE2 PHE A 39 -4.672 -3.519 5.311 1.00 0.00 C ATOM 559 CZ PHE A 39 -3.677 -2.644 5.003 1.00 0.00 C ATOM 0 H PHE A 39 -2.157 -8.074 8.614 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.287 -5.435 8.593 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.057 -6.823 6.651 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -3.688 -6.834 7.293 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -1.090 -4.290 6.428 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -5.167 -5.395 6.286 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -1.610 -2.207 5.147 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -5.686 -3.315 5.001 1.00 0.00 H new ATOM 0 HZ PHE A 39 -3.901 -1.744 4.449 1.00 0.00 H new ATOM 569 N GLU A 40 -4.302 -5.800 9.838 1.00 0.00 N ATOM 570 CA GLU A 40 -5.342 -5.128 10.599 1.00 0.00 C ATOM 571 C GLU A 40 -4.743 -4.449 11.832 1.00 0.00 C ATOM 572 O GLU A 40 -4.894 -3.242 12.015 1.00 0.00 O ATOM 573 CB GLU A 40 -6.450 -6.107 10.995 1.00 0.00 C ATOM 574 CG GLU A 40 -7.511 -6.207 9.898 1.00 0.00 C ATOM 575 CD GLU A 40 -8.759 -6.932 10.406 1.00 0.00 C ATOM 576 OE1 GLU A 40 -9.546 -6.274 11.121 1.00 0.00 O ATOM 577 OE2 GLU A 40 -8.898 -8.127 10.068 1.00 0.00 O ATOM 0 H GLU A 40 -4.465 -6.794 9.678 1.00 0.00 H new ATOM 0 HA GLU A 40 -5.789 -4.360 9.968 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -6.021 -7.091 11.182 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -6.914 -5.780 11.926 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -7.781 -5.208 9.556 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -7.102 -6.739 9.039 1.00 0.00 H new ATOM 584 N GLU A 41 -4.077 -5.254 12.647 1.00 0.00 N ATOM 585 CA GLU A 41 -3.455 -4.746 13.857 1.00 0.00 C ATOM 586 C GLU A 41 -2.553 -3.554 13.531 1.00 0.00 C ATOM 587 O GLU A 41 -2.525 -2.572 14.270 1.00 0.00 O ATOM 588 CB GLU A 41 -2.671 -5.847 14.575 1.00 0.00 C ATOM 589 CG GLU A 41 -3.395 -6.297 15.845 1.00 0.00 C ATOM 590 CD GLU A 41 -2.817 -5.604 17.081 1.00 0.00 C ATOM 591 OE1 GLU A 41 -3.328 -4.513 17.411 1.00 0.00 O ATOM 592 OE2 GLU A 41 -1.876 -6.183 17.667 1.00 0.00 O ATOM 0 H GLU A 41 -3.955 -6.255 12.493 1.00 0.00 H new ATOM 0 HA GLU A 41 -4.242 -4.407 14.531 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -2.538 -6.698 13.907 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.676 -5.483 14.829 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -4.458 -6.071 15.761 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -3.306 -7.378 15.955 1.00 0.00 H new ATOM 599 N LYS A 42 -1.838 -3.681 12.423 1.00 0.00 N ATOM 600 CA LYS A 42 -0.937 -2.626 11.989 1.00 0.00 C ATOM 601 C LYS A 42 -1.737 -1.345 11.747 1.00 0.00 C ATOM 602 O LYS A 42 -1.424 -0.298 12.311 1.00 0.00 O ATOM 603 CB LYS A 42 -0.124 -3.082 10.776 1.00 0.00 C ATOM 604 CG LYS A 42 0.976 -4.062 11.189 1.00 0.00 C ATOM 605 CD LYS A 42 2.038 -4.189 10.095 1.00 0.00 C ATOM 606 CE LYS A 42 3.148 -5.154 10.517 1.00 0.00 C ATOM 607 NZ LYS A 42 4.477 -4.543 10.294 1.00 0.00 N ATOM 0 H LYS A 42 -1.864 -4.498 11.813 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.207 -2.404 12.768 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -0.784 -3.556 10.049 1.00 0.00 H new ATOM 0 HB3 LYS A 42 0.321 -2.216 10.286 1.00 0.00 H new ATOM 0 HG2 LYS A 42 1.441 -3.723 12.114 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.539 -5.040 11.392 1.00 0.00 H new ATOM 0 HD2 LYS A 42 1.575 -4.542 9.173 1.00 0.00 H new ATOM 0 HD3 LYS A 42 2.465 -3.209 9.882 1.00 0.00 H new ATOM 0 HE2 LYS A 42 3.032 -5.413 11.569 1.00 0.00 H new ATOM 0 HE3 LYS A 42 3.067 -6.081 9.950 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 5.215 -5.167 10.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 4.632 -4.411 9.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 4.520 -3.621 10.773 1.00 0.00 H new ATOM 621 N VAL A 43 -2.755 -1.471 10.908 1.00 0.00 N ATOM 622 CA VAL A 43 -3.603 -0.336 10.584 1.00 0.00 C ATOM 623 C VAL A 43 -3.946 0.421 11.868 1.00 0.00 C ATOM 624 O VAL A 43 -3.717 1.626 11.963 1.00 0.00 O ATOM 625 CB VAL A 43 -4.841 -0.809 9.819 1.00 0.00 C ATOM 626 CG1 VAL A 43 -5.893 0.299 9.741 1.00 0.00 C ATOM 627 CG2 VAL A 43 -4.465 -1.309 8.423 1.00 0.00 C ATOM 0 H VAL A 43 -3.012 -2.342 10.443 1.00 0.00 H new ATOM 0 HA VAL A 43 -3.078 0.358 9.928 1.00 0.00 H new ATOM 0 HB VAL A 43 -5.275 -1.645 10.367 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -6.763 -0.063 9.192 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -6.194 0.587 10.748 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.473 1.164 9.227 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -5.363 -1.639 7.901 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.995 -0.501 7.862 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -3.769 -2.143 8.511 1.00 0.00 H new ATOM 637 N LYS A 44 -4.490 -0.317 12.825 1.00 0.00 N ATOM 638 CA LYS A 44 -4.868 0.270 14.099 1.00 0.00 C ATOM 639 C LYS A 44 -3.659 0.989 14.703 1.00 0.00 C ATOM 640 O LYS A 44 -3.771 2.128 15.153 1.00 0.00 O ATOM 641 CB LYS A 44 -5.474 -0.792 15.019 1.00 0.00 C ATOM 642 CG LYS A 44 -6.977 -0.936 14.774 1.00 0.00 C ATOM 643 CD LYS A 44 -7.615 -1.865 15.809 1.00 0.00 C ATOM 644 CE LYS A 44 -9.093 -2.105 15.494 1.00 0.00 C ATOM 645 NZ LYS A 44 -9.898 -2.082 16.736 1.00 0.00 N ATOM 0 H LYS A 44 -4.678 -1.316 12.743 1.00 0.00 H new ATOM 0 HA LYS A 44 -5.647 1.019 13.957 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -4.981 -1.749 14.850 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -5.296 -0.521 16.060 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -7.452 0.044 14.818 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -7.150 -1.329 13.772 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -7.084 -2.817 15.825 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -7.518 -1.429 16.803 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -9.453 -1.340 14.806 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -9.213 -3.066 14.994 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -10.898 -2.246 16.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -9.565 -2.828 17.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -9.797 -1.156 17.198 1.00 0.00 H new ATOM 659 N GLN A 45 -2.531 0.293 14.693 1.00 0.00 N ATOM 660 CA GLN A 45 -1.304 0.851 15.234 1.00 0.00 C ATOM 661 C GLN A 45 -1.027 2.223 14.616 1.00 0.00 C ATOM 662 O GLN A 45 -0.579 3.139 15.304 1.00 0.00 O ATOM 663 CB GLN A 45 -0.125 -0.099 15.011 1.00 0.00 C ATOM 664 CG GLN A 45 0.271 -0.797 16.313 1.00 0.00 C ATOM 665 CD GLN A 45 1.242 0.065 17.124 1.00 0.00 C ATOM 666 OE1 GLN A 45 2.451 -0.018 16.984 1.00 0.00 O ATOM 667 NE2 GLN A 45 0.646 0.894 17.976 1.00 0.00 N ATOM 0 H GLN A 45 -2.442 -0.652 14.319 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.428 0.977 16.310 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -0.391 -0.844 14.261 1.00 0.00 H new ATOM 0 HB3 GLN A 45 0.726 0.458 14.619 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -0.621 -1.002 16.905 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.733 -1.758 16.089 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -0.372 0.912 18.042 1.00 0.00 H new ATOM 0 HE22 GLN A 45 1.207 1.512 18.563 1.00 0.00 H new ATOM 676 N LEU A 46 -1.305 2.322 13.324 1.00 0.00 N ATOM 677 CA LEU A 46 -1.091 3.567 12.606 1.00 0.00 C ATOM 678 C LEU A 46 -2.022 4.642 13.170 1.00 0.00 C ATOM 679 O LEU A 46 -1.598 5.772 13.408 1.00 0.00 O ATOM 680 CB LEU A 46 -1.245 3.349 11.099 1.00 0.00 C ATOM 681 CG LEU A 46 0.024 2.944 10.347 1.00 0.00 C ATOM 682 CD1 LEU A 46 -0.268 2.713 8.863 1.00 0.00 C ATOM 683 CD2 LEU A 46 1.139 3.970 10.559 1.00 0.00 C ATOM 0 H LEU A 46 -1.676 1.560 12.756 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.070 3.920 12.751 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -2.000 2.579 10.939 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -1.628 4.268 10.656 1.00 0.00 H new ATOM 0 HG LEU A 46 0.376 1.997 10.757 1.00 0.00 H new ATOM 0 HD11 LEU A 46 0.651 2.426 8.352 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -1.006 1.918 8.757 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -0.658 3.630 8.422 1.00 0.00 H new ATOM 0 HD21 LEU A 46 2.029 3.658 10.014 1.00 0.00 H new ATOM 0 HD22 LEU A 46 0.812 4.943 10.193 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.371 4.041 11.622 1.00 0.00 H new ATOM 695 N ILE A 47 -3.273 4.253 13.367 1.00 0.00 N ATOM 696 CA ILE A 47 -4.267 5.170 13.899 1.00 0.00 C ATOM 697 C ILE A 47 -3.883 5.558 15.328 1.00 0.00 C ATOM 698 O ILE A 47 -4.005 6.719 15.714 1.00 0.00 O ATOM 699 CB ILE A 47 -5.668 4.568 13.780 1.00 0.00 C ATOM 700 CG1 ILE A 47 -6.216 4.732 12.360 1.00 0.00 C ATOM 701 CG2 ILE A 47 -6.611 5.161 14.829 1.00 0.00 C ATOM 702 CD1 ILE A 47 -7.455 3.859 12.147 1.00 0.00 C ATOM 0 H ILE A 47 -3.621 3.315 13.168 1.00 0.00 H new ATOM 0 HA ILE A 47 -4.290 6.090 13.314 1.00 0.00 H new ATOM 0 HB ILE A 47 -5.598 3.498 13.978 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -6.468 5.777 12.182 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -5.447 4.462 11.636 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.600 4.716 14.722 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -6.224 4.951 15.826 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -6.681 6.239 14.687 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -7.825 3.994 11.131 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -7.194 2.812 12.302 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -8.230 4.148 12.856 1.00 0.00 H new ATOM 714 N ASP A 48 -3.428 4.563 16.075 1.00 0.00 N ATOM 715 CA ASP A 48 -3.026 4.785 17.454 1.00 0.00 C ATOM 716 C ASP A 48 -1.726 5.592 17.478 1.00 0.00 C ATOM 717 O ASP A 48 -1.528 6.431 18.355 1.00 0.00 O ATOM 718 CB ASP A 48 -2.774 3.460 18.175 1.00 0.00 C ATOM 719 CG ASP A 48 -3.814 3.092 19.235 1.00 0.00 C ATOM 720 OD1 ASP A 48 -4.865 3.768 19.257 1.00 0.00 O ATOM 721 OD2 ASP A 48 -3.535 2.142 19.998 1.00 0.00 O ATOM 0 H ASP A 48 -3.329 3.601 15.752 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.830 5.321 17.957 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -2.735 2.662 17.434 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.793 3.503 18.649 1.00 0.00 H new ATOM 726 N ILE A 49 -0.874 5.309 16.503 1.00 0.00 N ATOM 727 CA ILE A 49 0.402 5.997 16.402 1.00 0.00 C ATOM 728 C ILE A 49 0.173 7.409 15.858 1.00 0.00 C ATOM 729 O ILE A 49 0.326 8.390 16.585 1.00 0.00 O ATOM 730 CB ILE A 49 1.391 5.173 15.575 1.00 0.00 C ATOM 731 CG1 ILE A 49 1.777 3.885 16.305 1.00 0.00 C ATOM 732 CG2 ILE A 49 2.617 6.007 15.196 1.00 0.00 C ATOM 733 CD1 ILE A 49 2.257 2.818 15.319 1.00 0.00 C ATOM 0 H ILE A 49 -1.042 4.613 15.777 1.00 0.00 H new ATOM 0 HA ILE A 49 0.856 6.103 17.387 1.00 0.00 H new ATOM 0 HB ILE A 49 0.900 4.882 14.646 1.00 0.00 H new ATOM 0 HG12 ILE A 49 2.563 4.095 17.030 1.00 0.00 H new ATOM 0 HG13 ILE A 49 0.920 3.509 16.864 1.00 0.00 H new ATOM 0 HG21 ILE A 49 3.304 5.398 14.609 1.00 0.00 H new ATOM 0 HG22 ILE A 49 2.303 6.869 14.608 1.00 0.00 H new ATOM 0 HG23 ILE A 49 3.119 6.349 16.101 1.00 0.00 H new ATOM 0 HD11 ILE A 49 2.525 1.913 15.864 1.00 0.00 H new ATOM 0 HD12 ILE A 49 1.460 2.592 14.611 1.00 0.00 H new ATOM 0 HD13 ILE A 49 3.129 3.188 14.779 1.00 0.00 H new ATOM 745 N THR A 50 -0.191 7.467 14.586 1.00 0.00 N ATOM 746 CA THR A 50 -0.442 8.743 13.937 1.00 0.00 C ATOM 747 C THR A 50 -1.842 9.252 14.287 1.00 0.00 C ATOM 748 O THR A 50 -1.987 10.190 15.070 1.00 0.00 O ATOM 749 CB THR A 50 -0.221 8.560 12.434 1.00 0.00 C ATOM 750 OG1 THR A 50 -1.289 7.710 12.026 1.00 0.00 O ATOM 751 CG2 THR A 50 1.040 7.752 12.122 1.00 0.00 C ATOM 0 H THR A 50 -0.318 6.651 13.987 1.00 0.00 H new ATOM 0 HA THR A 50 0.247 9.510 14.291 1.00 0.00 H new ATOM 0 HB THR A 50 -0.153 9.537 11.956 1.00 0.00 H new ATOM 0 HG1 THR A 50 -1.062 6.779 12.230 1.00 0.00 H new ATOM 0 HG21 THR A 50 1.150 7.652 11.042 1.00 0.00 H new ATOM 0 HG22 THR A 50 1.911 8.265 12.529 1.00 0.00 H new ATOM 0 HG23 THR A 50 0.959 6.763 12.572 1.00 0.00 H new ATOM 759 N GLY A 51 -2.837 8.611 13.691 1.00 0.00 N ATOM 760 CA GLY A 51 -4.219 8.988 13.930 1.00 0.00 C ATOM 761 C GLY A 51 -4.842 9.612 12.679 1.00 0.00 C ATOM 762 O GLY A 51 -5.764 10.420 12.777 1.00 0.00 O ATOM 0 H GLY A 51 -2.713 7.833 13.043 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -4.793 8.110 14.227 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -4.269 9.696 14.757 1.00 0.00 H new ATOM 766 N LYS A 52 -4.313 9.213 11.532 1.00 0.00 N ATOM 767 CA LYS A 52 -4.805 9.722 10.263 1.00 0.00 C ATOM 768 C LYS A 52 -6.023 8.905 9.828 1.00 0.00 C ATOM 769 O LYS A 52 -6.386 7.929 10.483 1.00 0.00 O ATOM 770 CB LYS A 52 -3.682 9.751 9.225 1.00 0.00 C ATOM 771 CG LYS A 52 -2.444 10.462 9.776 1.00 0.00 C ATOM 772 CD LYS A 52 -2.576 11.980 9.637 1.00 0.00 C ATOM 773 CE LYS A 52 -1.212 12.629 9.396 1.00 0.00 C ATOM 774 NZ LYS A 52 -1.364 13.888 8.633 1.00 0.00 N ATOM 0 H LYS A 52 -3.548 8.543 11.455 1.00 0.00 H new ATOM 0 HA LYS A 52 -5.135 10.755 10.370 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -3.422 8.732 8.936 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -4.027 10.259 8.325 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -2.307 10.200 10.825 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.557 10.120 9.243 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -3.246 12.216 8.810 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -3.025 12.394 10.540 1.00 0.00 H new ATOM 0 HE2 LYS A 52 -0.726 12.832 10.350 1.00 0.00 H new ATOM 0 HE3 LYS A 52 -0.567 11.941 8.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 -0.429 14.315 8.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -1.808 13.686 7.715 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 -1.962 14.549 9.169 1.00 0.00 H new ATOM 788 N ASN A 53 -6.621 9.334 8.727 1.00 0.00 N ATOM 789 CA ASN A 53 -7.791 8.654 8.197 1.00 0.00 C ATOM 790 C ASN A 53 -7.470 7.170 8.005 1.00 0.00 C ATOM 791 O ASN A 53 -6.569 6.819 7.245 1.00 0.00 O ATOM 792 CB ASN A 53 -8.194 9.230 6.838 1.00 0.00 C ATOM 793 CG ASN A 53 -8.552 10.713 6.954 1.00 0.00 C ATOM 794 OD1 ASN A 53 -8.492 11.311 8.016 1.00 0.00 O ATOM 795 ND2 ASN A 53 -8.926 11.271 5.807 1.00 0.00 N ATOM 0 H ASN A 53 -6.318 10.144 8.187 1.00 0.00 H new ATOM 0 HA ASN A 53 -8.609 8.791 8.904 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -7.376 9.104 6.129 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.046 8.677 6.443 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -9.185 12.257 5.780 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -8.954 10.713 4.954 1.00 0.00 H new ATOM 802 N GLN A 54 -8.225 6.339 8.709 1.00 0.00 N ATOM 803 CA GLN A 54 -8.032 4.901 8.626 1.00 0.00 C ATOM 804 C GLN A 54 -7.716 4.490 7.187 1.00 0.00 C ATOM 805 O GLN A 54 -6.652 3.937 6.915 1.00 0.00 O ATOM 806 CB GLN A 54 -9.258 4.153 9.153 1.00 0.00 C ATOM 807 CG GLN A 54 -8.970 2.656 9.288 1.00 0.00 C ATOM 808 CD GLN A 54 -10.244 1.881 9.629 1.00 0.00 C ATOM 809 OE1 GLN A 54 -11.112 2.347 10.349 1.00 0.00 O ATOM 810 NE2 GLN A 54 -10.309 0.675 9.072 1.00 0.00 N ATOM 0 H GLN A 54 -8.971 6.634 9.339 1.00 0.00 H new ATOM 0 HA GLN A 54 -7.184 4.631 9.255 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -9.548 4.560 10.122 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -10.100 4.306 8.478 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -8.548 2.278 8.357 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -8.223 2.494 10.065 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -9.547 0.345 8.479 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -11.121 0.080 9.238 1.00 0.00 H new ATOM 819 N ASP A 55 -8.660 4.777 6.302 1.00 0.00 N ATOM 820 CA ASP A 55 -8.495 4.444 4.897 1.00 0.00 C ATOM 821 C ASP A 55 -7.083 4.824 4.450 1.00 0.00 C ATOM 822 O ASP A 55 -6.374 4.009 3.861 1.00 0.00 O ATOM 823 CB ASP A 55 -9.490 5.215 4.028 1.00 0.00 C ATOM 824 CG ASP A 55 -10.948 4.773 4.165 1.00 0.00 C ATOM 825 OD1 ASP A 55 -11.487 4.931 5.282 1.00 0.00 O ATOM 826 OD2 ASP A 55 -11.491 4.286 3.150 1.00 0.00 O ATOM 0 H ASP A 55 -9.542 5.236 6.531 1.00 0.00 H new ATOM 0 HA ASP A 55 -8.669 3.374 4.781 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -9.422 6.274 4.277 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -9.192 5.114 2.984 1.00 0.00 H new ATOM 831 N GLU A 56 -6.715 6.062 4.746 1.00 0.00 N ATOM 832 CA GLU A 56 -5.400 6.559 4.382 1.00 0.00 C ATOM 833 C GLU A 56 -4.310 5.701 5.027 1.00 0.00 C ATOM 834 O GLU A 56 -3.345 5.318 4.367 1.00 0.00 O ATOM 835 CB GLU A 56 -5.242 8.030 4.773 1.00 0.00 C ATOM 836 CG GLU A 56 -6.102 8.929 3.883 1.00 0.00 C ATOM 837 CD GLU A 56 -5.300 9.446 2.687 1.00 0.00 C ATOM 838 OE1 GLU A 56 -4.479 8.657 2.171 1.00 0.00 O ATOM 839 OE2 GLU A 56 -5.526 10.618 2.316 1.00 0.00 O ATOM 0 H GLU A 56 -7.305 6.736 5.234 1.00 0.00 H new ATOM 0 HA GLU A 56 -5.295 6.491 3.299 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -5.527 8.165 5.816 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.195 8.322 4.688 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.971 8.373 3.530 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.477 9.771 4.465 1.00 0.00 H new ATOM 846 N CYS A 57 -4.500 5.424 6.308 1.00 0.00 N ATOM 847 CA CYS A 57 -3.546 4.617 7.050 1.00 0.00 C ATOM 848 C CYS A 57 -3.371 3.285 6.318 1.00 0.00 C ATOM 849 O CYS A 57 -2.249 2.877 6.022 1.00 0.00 O ATOM 850 CB CYS A 57 -3.981 4.418 8.503 1.00 0.00 C ATOM 851 SG CYS A 57 -3.924 6.013 9.398 1.00 0.00 S ATOM 0 H CYS A 57 -5.301 5.744 6.852 1.00 0.00 H new ATOM 0 HA CYS A 57 -2.587 5.134 7.095 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -4.991 4.009 8.536 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -3.328 3.694 8.991 1.00 0.00 H new ATOM 0 HG CYS A 57 -5.135 6.403 9.668 1.00 0.00 H new ATOM 857 N VAL A 58 -4.498 2.644 6.047 1.00 0.00 N ATOM 858 CA VAL A 58 -4.485 1.366 5.355 1.00 0.00 C ATOM 859 C VAL A 58 -3.793 1.531 4.000 1.00 0.00 C ATOM 860 O VAL A 58 -3.110 0.622 3.533 1.00 0.00 O ATOM 861 CB VAL A 58 -5.909 0.819 5.237 1.00 0.00 C ATOM 862 CG1 VAL A 58 -5.938 -0.455 4.390 1.00 0.00 C ATOM 863 CG2 VAL A 58 -6.518 0.574 6.618 1.00 0.00 C ATOM 0 H VAL A 58 -5.427 2.986 6.294 1.00 0.00 H new ATOM 0 HA VAL A 58 -3.916 0.630 5.923 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.516 1.570 4.732 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.962 -0.823 4.322 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.564 -0.236 3.390 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.309 -1.215 4.854 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -7.530 0.185 6.506 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -5.910 -0.150 7.161 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -6.549 1.511 7.174 1.00 0.00 H new ATOM 873 N ILE A 59 -3.995 2.699 3.408 1.00 0.00 N ATOM 874 CA ILE A 59 -3.400 2.996 2.116 1.00 0.00 C ATOM 875 C ILE A 59 -1.879 3.068 2.265 1.00 0.00 C ATOM 876 O ILE A 59 -1.151 2.324 1.609 1.00 0.00 O ATOM 877 CB ILE A 59 -4.020 4.260 1.518 1.00 0.00 C ATOM 878 CG1 ILE A 59 -5.461 4.005 1.071 1.00 0.00 C ATOM 879 CG2 ILE A 59 -3.156 4.810 0.381 1.00 0.00 C ATOM 880 CD1 ILE A 59 -6.238 5.318 0.951 1.00 0.00 C ATOM 0 H ILE A 59 -4.562 3.451 3.799 1.00 0.00 H new ATOM 0 HA ILE A 59 -3.614 2.198 1.405 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.054 5.024 2.295 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -5.462 3.489 0.111 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.957 3.349 1.786 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -3.620 5.708 -0.026 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -2.165 5.054 0.763 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -3.067 4.059 -0.404 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -7.259 5.109 0.632 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.256 5.820 1.918 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -5.753 5.962 0.217 1.00 0.00 H new ATOM 892 N ALA A 60 -1.443 3.971 3.131 1.00 0.00 N ATOM 893 CA ALA A 60 -0.022 4.151 3.374 1.00 0.00 C ATOM 894 C ALA A 60 0.598 2.807 3.765 1.00 0.00 C ATOM 895 O ALA A 60 1.622 2.408 3.213 1.00 0.00 O ATOM 896 CB ALA A 60 0.181 5.221 4.448 1.00 0.00 C ATOM 0 H ALA A 60 -2.049 4.586 3.673 1.00 0.00 H new ATOM 0 HA ALA A 60 0.481 4.496 2.471 1.00 0.00 H new ATOM 0 HB1 ALA A 60 1.247 5.356 4.630 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -0.251 6.163 4.110 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -0.308 4.908 5.370 1.00 0.00 H new ATOM 902 N LEU A 61 -0.050 2.147 4.713 1.00 0.00 N ATOM 903 CA LEU A 61 0.425 0.857 5.184 1.00 0.00 C ATOM 904 C LEU A 61 0.725 -0.041 3.982 1.00 0.00 C ATOM 905 O LEU A 61 1.864 -0.459 3.784 1.00 0.00 O ATOM 906 CB LEU A 61 -0.571 0.248 6.173 1.00 0.00 C ATOM 907 CG LEU A 61 -0.048 -0.911 7.025 1.00 0.00 C ATOM 908 CD1 LEU A 61 1.399 -0.664 7.455 1.00 0.00 C ATOM 909 CD2 LEU A 61 -0.966 -1.170 8.221 1.00 0.00 C ATOM 0 H LEU A 61 -0.900 2.481 5.168 1.00 0.00 H new ATOM 0 HA LEU A 61 1.357 0.973 5.737 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.917 1.037 6.841 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -1.440 -0.101 5.615 1.00 0.00 H new ATOM 0 HG LEU A 61 -0.053 -1.814 6.415 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.747 -1.502 8.059 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.030 -0.567 6.571 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.453 0.253 8.041 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -0.572 -1.998 8.810 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.016 -0.275 8.842 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.965 -1.421 7.865 1.00 0.00 H new ATOM 921 N HIS A 62 -0.318 -0.311 3.211 1.00 0.00 N ATOM 922 CA HIS A 62 -0.181 -1.152 2.034 1.00 0.00 C ATOM 923 C HIS A 62 0.821 -0.520 1.066 1.00 0.00 C ATOM 924 O HIS A 62 1.795 -1.158 0.670 1.00 0.00 O ATOM 925 CB HIS A 62 -1.544 -1.412 1.390 1.00 0.00 C ATOM 926 CG HIS A 62 -1.465 -1.960 -0.015 1.00 0.00 C ATOM 927 ND1 HIS A 62 -1.786 -3.270 -0.328 1.00 0.00 N ATOM 928 CD2 HIS A 62 -1.100 -1.363 -1.186 1.00 0.00 C ATOM 929 CE1 HIS A 62 -1.616 -3.442 -1.631 1.00 0.00 C ATOM 930 NE2 HIS A 62 -1.191 -2.259 -2.161 1.00 0.00 N ATOM 0 H HIS A 62 -1.262 0.038 3.378 1.00 0.00 H new ATOM 0 HA HIS A 62 0.211 -2.127 2.323 1.00 0.00 H new ATOM 0 HB2 HIS A 62 -2.100 -2.113 2.012 1.00 0.00 H new ATOM 0 HB3 HIS A 62 -2.111 -0.481 1.375 1.00 0.00 H new ATOM 0 HD2 HIS A 62 -0.789 -0.335 -1.300 1.00 0.00 H new ATOM 0 HE1 HIS A 62 -1.784 -4.358 -2.178 1.00 0.00 H new ATOM 0 HE2 HIS A 62 -0.978 -2.091 -3.144 1.00 0.00 H new ATOM 938 N ASP A 63 0.547 0.728 0.712 1.00 0.00 N ATOM 939 CA ASP A 63 1.413 1.453 -0.202 1.00 0.00 C ATOM 940 C ASP A 63 2.874 1.151 0.137 1.00 0.00 C ATOM 941 O ASP A 63 3.649 0.762 -0.735 1.00 0.00 O ATOM 942 CB ASP A 63 1.201 2.964 -0.078 1.00 0.00 C ATOM 943 CG ASP A 63 1.730 3.789 -1.253 1.00 0.00 C ATOM 944 OD1 ASP A 63 1.575 3.311 -2.398 1.00 0.00 O ATOM 945 OD2 ASP A 63 2.278 4.879 -0.980 1.00 0.00 O ATOM 0 H ASP A 63 -0.262 1.255 1.042 1.00 0.00 H new ATOM 0 HA ASP A 63 1.173 1.136 -1.217 1.00 0.00 H new ATOM 0 HB2 ASP A 63 0.134 3.158 0.032 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.684 3.310 0.836 1.00 0.00 H new ATOM 950 N CYS A 64 3.205 1.342 1.405 1.00 0.00 N ATOM 951 CA CYS A 64 4.559 1.094 1.870 1.00 0.00 C ATOM 952 C CYS A 64 4.848 -0.402 1.734 1.00 0.00 C ATOM 953 O CYS A 64 5.650 -0.809 0.895 1.00 0.00 O ATOM 954 CB CYS A 64 4.764 1.587 3.304 1.00 0.00 C ATOM 955 SG CYS A 64 5.815 3.085 3.307 1.00 0.00 S ATOM 0 H CYS A 64 2.559 1.666 2.125 1.00 0.00 H new ATOM 0 HA CYS A 64 5.265 1.656 1.258 1.00 0.00 H new ATOM 0 HB2 CYS A 64 3.800 1.808 3.762 1.00 0.00 H new ATOM 0 HB3 CYS A 64 5.230 0.805 3.903 1.00 0.00 H new ATOM 0 HG CYS A 64 6.972 2.805 2.784 1.00 0.00 H new ATOM 961 N ASN A 65 4.179 -1.180 2.573 1.00 0.00 N ATOM 962 CA ASN A 65 4.354 -2.622 2.557 1.00 0.00 C ATOM 963 C ASN A 65 3.986 -3.191 3.928 1.00 0.00 C ATOM 964 O ASN A 65 4.855 -3.649 4.668 1.00 0.00 O ATOM 965 CB ASN A 65 5.808 -2.998 2.263 1.00 0.00 C ATOM 966 CG ASN A 65 5.989 -3.381 0.793 1.00 0.00 C ATOM 967 OD1 ASN A 65 5.246 -2.964 -0.080 1.00 0.00 O ATOM 968 ND2 ASN A 65 7.016 -4.195 0.570 1.00 0.00 N ATOM 0 H ASN A 65 3.515 -0.839 3.268 1.00 0.00 H new ATOM 0 HA ASN A 65 3.712 -3.031 1.777 1.00 0.00 H new ATOM 0 HB2 ASN A 65 6.461 -2.160 2.507 1.00 0.00 H new ATOM 0 HB3 ASN A 65 6.108 -3.831 2.899 1.00 0.00 H new ATOM 0 HD21 ASN A 65 7.222 -4.508 -0.379 1.00 0.00 H new ATOM 0 HD22 ASN A 65 7.598 -4.506 1.348 1.00 0.00 H new ATOM 975 N GLY A 66 2.696 -3.144 4.226 1.00 0.00 N ATOM 976 CA GLY A 66 2.202 -3.649 5.496 1.00 0.00 C ATOM 977 C GLY A 66 3.184 -3.341 6.628 1.00 0.00 C ATOM 978 O GLY A 66 3.284 -4.099 7.592 1.00 0.00 O ATOM 0 H GLY A 66 1.978 -2.764 3.610 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.234 -3.201 5.718 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.046 -4.726 5.428 1.00 0.00 H new ATOM 982 N ASP A 67 3.885 -2.227 6.474 1.00 0.00 N ATOM 983 CA ASP A 67 4.856 -1.809 7.471 1.00 0.00 C ATOM 984 C ASP A 67 4.352 -0.543 8.167 1.00 0.00 C ATOM 985 O ASP A 67 4.297 0.524 7.558 1.00 0.00 O ATOM 986 CB ASP A 67 6.205 -1.489 6.825 1.00 0.00 C ATOM 987 CG ASP A 67 7.337 -2.455 7.181 1.00 0.00 C ATOM 988 OD1 ASP A 67 7.977 -2.219 8.229 1.00 0.00 O ATOM 989 OD2 ASP A 67 7.538 -3.407 6.396 1.00 0.00 O ATOM 0 H ASP A 67 3.800 -1.601 5.673 1.00 0.00 H new ATOM 0 HA ASP A 67 4.982 -2.625 8.183 1.00 0.00 H new ATOM 0 HB2 ASP A 67 6.080 -1.482 5.742 1.00 0.00 H new ATOM 0 HB3 ASP A 67 6.501 -0.482 7.118 1.00 0.00 H new ATOM 994 N VAL A 68 3.998 -0.704 9.434 1.00 0.00 N ATOM 995 CA VAL A 68 3.502 0.413 10.219 1.00 0.00 C ATOM 996 C VAL A 68 4.567 1.509 10.269 1.00 0.00 C ATOM 997 O VAL A 68 4.248 2.694 10.188 1.00 0.00 O ATOM 998 CB VAL A 68 3.077 -0.072 11.607 1.00 0.00 C ATOM 999 CG1 VAL A 68 3.126 1.069 12.625 1.00 0.00 C ATOM 1000 CG2 VAL A 68 1.686 -0.708 11.564 1.00 0.00 C ATOM 0 H VAL A 68 4.045 -1.591 9.936 1.00 0.00 H new ATOM 0 HA VAL A 68 2.615 0.843 9.753 1.00 0.00 H new ATOM 0 HB VAL A 68 3.785 -0.837 11.926 1.00 0.00 H new ATOM 0 HG11 VAL A 68 2.819 0.698 13.603 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.142 1.458 12.687 1.00 0.00 H new ATOM 0 HG13 VAL A 68 2.451 1.866 12.312 1.00 0.00 H new ATOM 0 HG21 VAL A 68 1.408 -1.044 12.563 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.961 0.026 11.214 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.696 -1.560 10.885 1.00 0.00 H new ATOM 1010 N ASN A 69 5.812 1.075 10.403 1.00 0.00 N ATOM 1011 CA ASN A 69 6.926 2.006 10.465 1.00 0.00 C ATOM 1012 C ASN A 69 7.049 2.737 9.127 1.00 0.00 C ATOM 1013 O ASN A 69 6.918 3.959 9.069 1.00 0.00 O ATOM 1014 CB ASN A 69 8.243 1.271 10.725 1.00 0.00 C ATOM 1015 CG ASN A 69 8.046 0.129 11.723 1.00 0.00 C ATOM 1016 OD1 ASN A 69 7.754 0.333 12.890 1.00 0.00 O ATOM 1017 ND2 ASN A 69 8.221 -1.082 11.201 1.00 0.00 N ATOM 0 H ASN A 69 6.074 0.091 10.470 1.00 0.00 H new ATOM 0 HA ASN A 69 6.736 2.706 11.279 1.00 0.00 H new ATOM 0 HB2 ASN A 69 8.634 0.876 9.787 1.00 0.00 H new ATOM 0 HB3 ASN A 69 8.984 1.971 11.110 1.00 0.00 H new ATOM 0 HD21 ASN A 69 8.111 -1.910 11.786 1.00 0.00 H new ATOM 0 HD22 ASN A 69 8.465 -1.182 10.216 1.00 0.00 H new ATOM 1024 N ARG A 70 7.300 1.959 8.084 1.00 0.00 N ATOM 1025 CA ARG A 70 7.442 2.518 6.750 1.00 0.00 C ATOM 1026 C ARG A 70 6.281 3.467 6.446 1.00 0.00 C ATOM 1027 O ARG A 70 6.482 4.531 5.863 1.00 0.00 O ATOM 1028 CB ARG A 70 7.479 1.414 5.692 1.00 0.00 C ATOM 1029 CG ARG A 70 8.600 0.414 5.981 1.00 0.00 C ATOM 1030 CD ARG A 70 9.782 0.626 5.032 1.00 0.00 C ATOM 1031 NE ARG A 70 10.822 -0.397 5.283 1.00 0.00 N ATOM 1032 CZ ARG A 70 12.064 -0.343 4.784 1.00 0.00 C ATOM 1033 NH1 ARG A 70 12.429 0.684 4.005 1.00 0.00 N ATOM 1034 NH2 ARG A 70 12.942 -1.316 5.065 1.00 0.00 N ATOM 0 H ARG A 70 7.409 0.946 8.136 1.00 0.00 H new ATOM 0 HA ARG A 70 8.383 3.068 6.719 1.00 0.00 H new ATOM 0 HB2 ARG A 70 6.521 0.895 5.670 1.00 0.00 H new ATOM 0 HB3 ARG A 70 7.626 1.855 4.706 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.933 0.524 7.013 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.222 -0.603 5.875 1.00 0.00 H new ATOM 0 HD2 ARG A 70 9.444 0.566 3.998 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.199 1.623 5.174 1.00 0.00 H new ATOM 0 HE ARG A 70 10.578 -1.193 5.873 1.00 0.00 H new ATOM 0 HH11 ARG A 70 11.761 1.425 3.792 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.375 0.725 3.625 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.664 -2.098 5.659 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.888 -1.275 4.685 1.00 0.00 H new ATOM 1048 N ALA A 71 5.093 3.048 6.856 1.00 0.00 N ATOM 1049 CA ALA A 71 3.900 3.848 6.635 1.00 0.00 C ATOM 1050 C ALA A 71 4.075 5.213 7.305 1.00 0.00 C ATOM 1051 O ALA A 71 3.869 6.249 6.674 1.00 0.00 O ATOM 1052 CB ALA A 71 2.675 3.095 7.157 1.00 0.00 C ATOM 0 H ALA A 71 4.931 2.165 7.340 1.00 0.00 H new ATOM 0 HA ALA A 71 3.746 4.021 5.570 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.781 3.696 6.991 1.00 0.00 H new ATOM 0 HB2 ALA A 71 2.578 2.147 6.629 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.792 2.906 8.224 1.00 0.00 H new ATOM 1058 N ILE A 72 4.453 5.169 8.574 1.00 0.00 N ATOM 1059 CA ILE A 72 4.658 6.389 9.336 1.00 0.00 C ATOM 1060 C ILE A 72 5.594 7.318 8.562 1.00 0.00 C ATOM 1061 O ILE A 72 5.411 8.534 8.566 1.00 0.00 O ATOM 1062 CB ILE A 72 5.145 6.062 10.749 1.00 0.00 C ATOM 1063 CG1 ILE A 72 4.016 5.474 11.597 1.00 0.00 C ATOM 1064 CG2 ILE A 72 5.778 7.289 11.408 1.00 0.00 C ATOM 1065 CD1 ILE A 72 4.551 4.424 12.572 1.00 0.00 C ATOM 0 H ILE A 72 4.623 4.308 9.094 1.00 0.00 H new ATOM 0 HA ILE A 72 3.715 6.921 9.464 1.00 0.00 H new ATOM 0 HB ILE A 72 5.921 5.300 10.675 1.00 0.00 H new ATOM 0 HG12 ILE A 72 3.520 6.271 12.151 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.266 5.023 10.947 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.116 7.030 12.411 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.629 7.623 10.814 1.00 0.00 H new ATOM 0 HG23 ILE A 72 5.041 8.090 11.469 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.727 4.022 13.162 1.00 0.00 H new ATOM 0 HD12 ILE A 72 5.025 3.617 12.013 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.283 4.884 13.236 1.00 0.00 H new ATOM 1077 N ASN A 73 6.578 6.710 7.915 1.00 0.00 N ATOM 1078 CA ASN A 73 7.544 7.467 7.138 1.00 0.00 C ATOM 1079 C ASN A 73 6.822 8.181 5.992 1.00 0.00 C ATOM 1080 O ASN A 73 7.302 9.196 5.489 1.00 0.00 O ATOM 1081 CB ASN A 73 8.604 6.547 6.529 1.00 0.00 C ATOM 1082 CG ASN A 73 9.980 6.817 7.140 1.00 0.00 C ATOM 1083 OD1 ASN A 73 10.712 7.698 6.721 1.00 0.00 O ATOM 1084 ND2 ASN A 73 10.290 6.011 8.152 1.00 0.00 N ATOM 0 H ASN A 73 6.727 5.701 7.913 1.00 0.00 H new ATOM 0 HA ASN A 73 8.027 8.182 7.804 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.326 5.506 6.695 1.00 0.00 H new ATOM 0 HB3 ASN A 73 8.645 6.698 5.450 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.187 6.111 8.627 1.00 0.00 H new ATOM 0 HD22 ASN A 73 9.631 5.293 8.453 1.00 0.00 H new ATOM 1091 N VAL A 74 5.683 7.622 5.613 1.00 0.00 N ATOM 1092 CA VAL A 74 4.891 8.192 4.537 1.00 0.00 C ATOM 1093 C VAL A 74 3.811 9.100 5.129 1.00 0.00 C ATOM 1094 O VAL A 74 3.668 10.250 4.717 1.00 0.00 O ATOM 1095 CB VAL A 74 4.318 7.076 3.660 1.00 0.00 C ATOM 1096 CG1 VAL A 74 3.516 7.653 2.492 1.00 0.00 C ATOM 1097 CG2 VAL A 74 5.428 6.149 3.159 1.00 0.00 C ATOM 0 H VAL A 74 5.289 6.780 6.032 1.00 0.00 H new ATOM 0 HA VAL A 74 5.515 8.808 3.890 1.00 0.00 H new ATOM 0 HB VAL A 74 3.638 6.484 4.272 1.00 0.00 H new ATOM 0 HG11 VAL A 74 3.120 6.839 1.885 1.00 0.00 H new ATOM 0 HG12 VAL A 74 2.691 8.252 2.878 1.00 0.00 H new ATOM 0 HG13 VAL A 74 4.164 8.280 1.880 1.00 0.00 H new ATOM 0 HG21 VAL A 74 4.995 5.365 2.538 1.00 0.00 H new ATOM 0 HG22 VAL A 74 6.144 6.723 2.571 1.00 0.00 H new ATOM 0 HG23 VAL A 74 5.937 5.698 4.011 1.00 0.00 H new ATOM 1107 N LEU A 75 3.079 8.549 6.086 1.00 0.00 N ATOM 1108 CA LEU A 75 2.017 9.295 6.739 1.00 0.00 C ATOM 1109 C LEU A 75 2.552 10.662 7.173 1.00 0.00 C ATOM 1110 O LEU A 75 1.943 11.691 6.883 1.00 0.00 O ATOM 1111 CB LEU A 75 1.415 8.479 7.885 1.00 0.00 C ATOM 1112 CG LEU A 75 0.293 7.512 7.502 1.00 0.00 C ATOM 1113 CD1 LEU A 75 0.214 6.345 8.489 1.00 0.00 C ATOM 1114 CD2 LEU A 75 -1.043 8.246 7.375 1.00 0.00 C ATOM 0 H LEU A 75 3.200 7.595 6.425 1.00 0.00 H new ATOM 0 HA LEU A 75 1.198 9.478 6.044 1.00 0.00 H new ATOM 0 HB2 LEU A 75 2.214 7.908 8.357 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.031 9.171 8.635 1.00 0.00 H new ATOM 0 HG LEU A 75 0.524 7.091 6.523 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.592 5.673 8.194 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.159 5.802 8.487 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.018 6.728 9.490 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.824 7.536 7.102 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -1.294 8.713 8.328 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.965 9.013 6.605 1.00 0.00 H new ATOM 1126 N LEU A 76 3.684 10.628 7.860 1.00 0.00 N ATOM 1127 CA LEU A 76 4.307 11.851 8.337 1.00 0.00 C ATOM 1128 C LEU A 76 4.653 12.741 7.141 1.00 0.00 C ATOM 1129 O LEU A 76 4.106 13.833 6.997 1.00 0.00 O ATOM 1130 CB LEU A 76 5.506 11.529 9.230 1.00 0.00 C ATOM 1131 CG LEU A 76 5.178 11.048 10.645 1.00 0.00 C ATOM 1132 CD1 LEU A 76 6.410 10.436 11.316 1.00 0.00 C ATOM 1133 CD2 LEU A 76 4.572 12.176 11.481 1.00 0.00 C ATOM 0 H LEU A 76 4.186 9.773 8.098 1.00 0.00 H new ATOM 0 HA LEU A 76 3.614 12.412 8.964 1.00 0.00 H new ATOM 0 HB2 LEU A 76 6.106 10.764 8.737 1.00 0.00 H new ATOM 0 HB3 LEU A 76 6.127 12.421 9.306 1.00 0.00 H new ATOM 0 HG LEU A 76 4.427 10.262 10.572 1.00 0.00 H new ATOM 0 HD11 LEU A 76 6.149 10.102 12.320 1.00 0.00 H new ATOM 0 HD12 LEU A 76 6.759 9.585 10.730 1.00 0.00 H new ATOM 0 HD13 LEU A 76 7.201 11.184 11.376 1.00 0.00 H new ATOM 0 HD21 LEU A 76 4.348 11.807 12.482 1.00 0.00 H new ATOM 0 HD22 LEU A 76 5.282 13.001 11.548 1.00 0.00 H new ATOM 0 HD23 LEU A 76 3.654 12.525 11.009 1.00 0.00 H new ATOM 1145 N GLU A 77 5.558 12.241 6.314 1.00 0.00 N ATOM 1146 CA GLU A 77 5.984 12.977 5.135 1.00 0.00 C ATOM 1147 C GLU A 77 6.158 14.459 5.470 1.00 0.00 C ATOM 1148 O GLU A 77 5.755 15.326 4.696 1.00 0.00 O ATOM 1149 CB GLU A 77 4.994 12.788 3.984 1.00 0.00 C ATOM 1150 CG GLU A 77 3.578 13.182 4.408 1.00 0.00 C ATOM 1151 CD GLU A 77 2.616 13.134 3.219 1.00 0.00 C ATOM 1152 OE1 GLU A 77 2.912 13.826 2.221 1.00 0.00 O ATOM 1153 OE2 GLU A 77 1.606 12.407 3.335 1.00 0.00 O ATOM 0 H GLU A 77 6.009 11.334 6.436 1.00 0.00 H new ATOM 0 HA GLU A 77 6.947 12.582 4.811 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.303 13.392 3.131 1.00 0.00 H new ATOM 0 HB3 GLU A 77 5.004 11.748 3.658 1.00 0.00 H new ATOM 0 HG2 GLU A 77 3.228 12.509 5.191 1.00 0.00 H new ATOM 0 HG3 GLU A 77 3.588 14.186 4.832 1.00 0.00 H new ATOM 1160 N GLY A 78 6.760 14.706 6.624 1.00 0.00 N ATOM 1161 CA GLY A 78 6.993 16.068 7.071 1.00 0.00 C ATOM 1162 C GLY A 78 6.209 16.368 8.350 1.00 0.00 C ATOM 1163 O GLY A 78 6.430 15.735 9.381 1.00 0.00 O ATOM 0 H GLY A 78 7.094 13.985 7.263 1.00 0.00 H new ATOM 0 HA2 GLY A 78 8.058 16.219 7.249 1.00 0.00 H new ATOM 0 HA3 GLY A 78 6.699 16.767 6.288 1.00 0.00 H new ATOM 1167 N ASN A 79 5.309 17.334 8.242 1.00 0.00 N ATOM 1168 CA ASN A 79 4.490 17.725 9.377 1.00 0.00 C ATOM 1169 C ASN A 79 3.015 17.688 8.973 1.00 0.00 C ATOM 1170 O ASN A 79 2.677 17.943 7.818 1.00 0.00 O ATOM 1171 CB ASN A 79 4.821 19.149 9.830 1.00 0.00 C ATOM 1172 CG ASN A 79 5.542 19.141 11.179 1.00 0.00 C ATOM 1173 OD1 ASN A 79 5.539 18.163 11.908 1.00 0.00 O ATOM 1174 ND2 ASN A 79 6.159 20.283 11.469 1.00 0.00 N ATOM 0 H ASN A 79 5.129 17.858 7.386 1.00 0.00 H new ATOM 0 HA ASN A 79 4.691 17.031 10.193 1.00 0.00 H new ATOM 0 HB2 ASN A 79 5.447 19.636 9.082 1.00 0.00 H new ATOM 0 HB3 ASN A 79 3.904 19.732 9.907 1.00 0.00 H new ATOM 0 HD21 ASN A 79 6.669 20.378 12.347 1.00 0.00 H new ATOM 0 HD22 ASN A 79 6.122 21.064 10.813 1.00 0.00 H new ATOM 1181 N PRO A 80 2.153 17.360 9.973 1.00 0.00 N ATOM 1182 CA PRO A 80 0.722 17.287 9.734 1.00 0.00 C ATOM 1183 C PRO A 80 0.113 18.686 9.620 1.00 0.00 C ATOM 1184 O PRO A 80 -0.494 19.022 8.604 1.00 0.00 O ATOM 1185 CB PRO A 80 0.168 16.491 10.904 1.00 0.00 C ATOM 1186 CG PRO A 80 1.232 16.547 11.988 1.00 0.00 C ATOM 1187 CD PRO A 80 2.518 17.052 11.353 1.00 0.00 C ATOM 0 HA PRO A 80 0.477 16.802 8.789 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -0.771 16.917 11.256 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -0.039 15.461 10.613 1.00 0.00 H new ATOM 0 HG2 PRO A 80 0.920 17.209 12.796 1.00 0.00 H new ATOM 0 HG3 PRO A 80 1.384 15.560 12.425 1.00 0.00 H new ATOM 0 HD2 PRO A 80 2.895 17.935 11.870 1.00 0.00 H new ATOM 0 HD3 PRO A 80 3.304 16.298 11.396 1.00 0.00 H new ATOM 1195 N ASP A 81 0.295 19.463 10.677 1.00 0.00 N ATOM 1196 CA ASP A 81 -0.230 20.818 10.709 1.00 0.00 C ATOM 1197 C ASP A 81 0.740 21.718 11.478 1.00 0.00 C ATOM 1198 O ASP A 81 0.350 22.770 11.982 1.00 0.00 O ATOM 1199 CB ASP A 81 -1.584 20.868 11.419 1.00 0.00 C ATOM 1200 CG ASP A 81 -2.549 21.935 10.898 1.00 0.00 C ATOM 1201 OD1 ASP A 81 -2.181 22.593 9.901 1.00 0.00 O ATOM 1202 OD2 ASP A 81 -3.631 22.068 11.508 1.00 0.00 O ATOM 0 H ASP A 81 0.799 19.181 11.518 1.00 0.00 H new ATOM 0 HA ASP A 81 -0.350 21.157 9.680 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -2.061 19.892 11.328 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -1.414 21.041 12.482 1.00 0.00 H new ATOM 1207 N THR A 82 1.986 21.271 11.544 1.00 0.00 N ATOM 1208 CA THR A 82 3.014 22.023 12.242 1.00 0.00 C ATOM 1209 C THR A 82 2.685 22.119 13.733 1.00 0.00 C ATOM 1210 O THR A 82 2.160 23.132 14.193 1.00 0.00 O ATOM 1211 CB THR A 82 3.149 23.386 11.561 1.00 0.00 C ATOM 1212 OG1 THR A 82 3.733 23.085 10.296 1.00 0.00 O ATOM 1213 CG2 THR A 82 4.184 24.283 12.244 1.00 0.00 C ATOM 0 H THR A 82 2.306 20.398 11.125 1.00 0.00 H new ATOM 0 HA THR A 82 3.979 21.519 12.186 1.00 0.00 H new ATOM 0 HB THR A 82 2.181 23.887 11.557 1.00 0.00 H new ATOM 0 HG1 THR A 82 3.855 23.913 9.786 1.00 0.00 H new ATOM 0 HG21 THR A 82 4.240 25.238 11.721 1.00 0.00 H new ATOM 0 HG22 THR A 82 3.891 24.454 13.280 1.00 0.00 H new ATOM 0 HG23 THR A 82 5.160 23.798 12.218 1.00 0.00 H new ATOM 1221 N HIS A 83 3.006 21.051 14.448 1.00 0.00 N ATOM 1222 CA HIS A 83 2.751 21.002 15.878 1.00 0.00 C ATOM 1223 C HIS A 83 3.612 22.047 16.589 1.00 0.00 C ATOM 1224 O HIS A 83 4.824 21.877 16.714 1.00 0.00 O ATOM 1225 CB HIS A 83 2.966 19.588 16.420 1.00 0.00 C ATOM 1226 CG HIS A 83 4.379 19.314 16.879 1.00 0.00 C ATOM 1227 ND1 HIS A 83 4.700 19.051 18.199 1.00 0.00 N ATOM 1228 CD2 HIS A 83 5.549 19.265 16.180 1.00 0.00 C ATOM 1229 CE1 HIS A 83 6.008 18.855 18.280 1.00 0.00 C ATOM 1230 NE2 HIS A 83 6.532 18.988 17.027 1.00 0.00 N ATOM 0 H HIS A 83 3.441 20.212 14.064 1.00 0.00 H new ATOM 0 HA HIS A 83 1.707 21.248 16.073 1.00 0.00 H new ATOM 0 HB2 HIS A 83 2.285 19.423 17.255 1.00 0.00 H new ATOM 0 HB3 HIS A 83 2.701 18.869 15.645 1.00 0.00 H new ATOM 0 HD2 HIS A 83 5.657 19.425 15.117 1.00 0.00 H new ATOM 0 HE1 HIS A 83 6.562 18.630 19.179 1.00 0.00 H new ATOM 0 HE2 HIS A 83 7.517 18.890 16.782 1.00 0.00 H new ATOM 1238 N SER A 84 2.953 23.106 17.035 1.00 0.00 N ATOM 1239 CA SER A 84 3.643 24.179 17.731 1.00 0.00 C ATOM 1240 C SER A 84 4.992 24.452 17.063 1.00 0.00 C ATOM 1241 O SER A 84 6.033 24.023 17.560 1.00 0.00 O ATOM 1242 CB SER A 84 3.841 23.839 19.209 1.00 0.00 C ATOM 1243 OG SER A 84 2.613 23.860 19.931 1.00 0.00 O ATOM 0 H SER A 84 1.948 23.244 16.928 1.00 0.00 H new ATOM 0 HA SER A 84 3.027 25.077 17.673 1.00 0.00 H new ATOM 0 HB2 SER A 84 4.296 22.852 19.296 1.00 0.00 H new ATOM 0 HB3 SER A 84 4.536 24.551 19.655 1.00 0.00 H new ATOM 0 HG SER A 84 2.782 23.636 20.870 1.00 0.00 H new ATOM 1249 N TRP A 85 4.931 25.165 15.948 1.00 0.00 N ATOM 1250 CA TRP A 85 6.136 25.500 15.208 1.00 0.00 C ATOM 1251 C TRP A 85 6.788 24.195 14.749 1.00 0.00 C ATOM 1252 O TRP A 85 6.530 23.135 15.318 1.00 0.00 O ATOM 1253 CB TRP A 85 7.071 26.373 16.048 1.00 0.00 C ATOM 1254 CG TRP A 85 7.218 27.805 15.530 1.00 0.00 C ATOM 1255 CD1 TRP A 85 6.553 28.898 15.926 1.00 0.00 C ATOM 1256 CD2 TRP A 85 8.120 28.257 14.497 1.00 0.00 C ATOM 1257 NE1 TRP A 85 6.957 30.017 15.227 1.00 0.00 N ATOM 1258 CE2 TRP A 85 7.940 29.615 14.331 1.00 0.00 C ATOM 1259 CE3 TRP A 85 9.055 27.542 13.729 1.00 0.00 C ATOM 1260 CZ2 TRP A 85 8.661 30.376 13.402 1.00 0.00 C ATOM 1261 CZ3 TRP A 85 9.768 28.316 12.805 1.00 0.00 C ATOM 1262 CH2 TRP A 85 9.599 29.684 12.626 1.00 0.00 C ATOM 0 H TRP A 85 4.067 25.520 15.539 1.00 0.00 H new ATOM 0 HA TRP A 85 5.894 26.096 14.328 1.00 0.00 H new ATOM 0 HB2 TRP A 85 6.699 26.404 17.072 1.00 0.00 H new ATOM 0 HB3 TRP A 85 8.056 25.906 16.080 1.00 0.00 H new ATOM 0 HD1 TRP A 85 5.796 28.903 16.696 1.00 0.00 H new ATOM 0 HE1 TRP A 85 6.600 30.965 15.346 1.00 0.00 H new ATOM 0 HE3 TRP A 85 9.211 26.479 13.842 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 8.502 31.438 13.290 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 10.500 27.815 12.189 1.00 0.00 H new ATOM 0 HH2 TRP A 85 10.189 30.211 11.891 1.00 0.00 H new ATOM 1273 N GLU A 86 7.620 24.314 13.725 1.00 0.00 N ATOM 1274 CA GLU A 86 8.311 23.156 13.183 1.00 0.00 C ATOM 1275 C GLU A 86 9.618 22.915 13.942 1.00 0.00 C ATOM 1276 O GLU A 86 10.429 23.827 14.093 1.00 0.00 O ATOM 1277 CB GLU A 86 8.570 23.323 11.685 1.00 0.00 C ATOM 1278 CG GLU A 86 9.885 24.062 11.434 1.00 0.00 C ATOM 1279 CD GLU A 86 9.908 24.684 10.037 1.00 0.00 C ATOM 1280 OE1 GLU A 86 9.719 23.915 9.070 1.00 0.00 O ATOM 1281 OE2 GLU A 86 10.113 25.915 9.966 1.00 0.00 O ATOM 0 H GLU A 86 7.831 25.195 13.256 1.00 0.00 H new ATOM 0 HA GLU A 86 7.672 22.283 13.312 1.00 0.00 H new ATOM 0 HB2 GLU A 86 8.602 22.344 11.207 1.00 0.00 H new ATOM 0 HB3 GLU A 86 7.747 23.873 11.229 1.00 0.00 H new ATOM 0 HG2 GLU A 86 10.017 24.841 12.185 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.721 23.371 11.542 1.00 0.00 H new ATOM 1288 N MET A 87 9.781 21.682 14.398 1.00 0.00 N ATOM 1289 CA MET A 87 10.975 21.310 15.137 1.00 0.00 C ATOM 1290 C MET A 87 11.281 19.820 14.970 1.00 0.00 C ATOM 1291 O MET A 87 10.378 18.987 15.028 1.00 0.00 O ATOM 1292 CB MET A 87 10.778 21.628 16.621 1.00 0.00 C ATOM 1293 CG MET A 87 11.691 22.774 17.062 1.00 0.00 C ATOM 1294 SD MET A 87 13.272 22.130 17.583 1.00 0.00 S ATOM 1295 CE MET A 87 14.233 23.634 17.588 1.00 0.00 C ATOM 0 H MET A 87 9.106 20.928 14.270 1.00 0.00 H new ATOM 0 HA MET A 87 11.816 21.881 14.743 1.00 0.00 H new ATOM 0 HB2 MET A 87 9.737 21.896 16.804 1.00 0.00 H new ATOM 0 HB3 MET A 87 10.988 20.740 17.218 1.00 0.00 H new ATOM 0 HG2 MET A 87 11.828 23.477 16.240 1.00 0.00 H new ATOM 0 HG3 MET A 87 11.227 23.326 17.879 1.00 0.00 H new ATOM 0 HE1 MET A 87 15.255 23.411 17.893 1.00 0.00 H new ATOM 0 HE2 MET A 87 14.239 24.065 16.587 1.00 0.00 H new ATOM 0 HE3 MET A 87 13.792 24.345 18.287 1.00 0.00 H new ATOM 1305 N VAL A 88 12.558 19.530 14.767 1.00 0.00 N ATOM 1306 CA VAL A 88 12.994 18.155 14.591 1.00 0.00 C ATOM 1307 C VAL A 88 13.382 17.570 15.951 1.00 0.00 C ATOM 1308 O VAL A 88 13.979 18.257 16.778 1.00 0.00 O ATOM 1309 CB VAL A 88 14.129 18.093 13.568 1.00 0.00 C ATOM 1310 CG1 VAL A 88 15.253 19.064 13.935 1.00 0.00 C ATOM 1311 CG2 VAL A 88 14.663 16.665 13.426 1.00 0.00 C ATOM 0 H VAL A 88 13.304 20.224 14.721 1.00 0.00 H new ATOM 0 HA VAL A 88 12.183 17.545 14.194 1.00 0.00 H new ATOM 0 HB VAL A 88 13.725 18.398 12.602 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.047 18.999 13.191 1.00 0.00 H new ATOM 0 HG12 VAL A 88 14.861 20.081 13.960 1.00 0.00 H new ATOM 0 HG13 VAL A 88 15.652 18.804 14.915 1.00 0.00 H new ATOM 0 HG21 VAL A 88 15.469 16.649 12.693 1.00 0.00 H new ATOM 0 HG22 VAL A 88 15.041 16.321 14.388 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.859 16.007 13.096 1.00 0.00 H new ATOM 1321 N GLY A 89 13.027 16.307 16.139 1.00 0.00 N ATOM 1322 CA GLY A 89 13.331 15.622 17.384 1.00 0.00 C ATOM 1323 C GLY A 89 14.819 15.277 17.471 1.00 0.00 C ATOM 1324 O GLY A 89 15.586 15.588 16.561 1.00 0.00 O ATOM 0 H GLY A 89 12.532 15.741 15.450 1.00 0.00 H new ATOM 0 HA2 GLY A 89 13.050 16.252 18.228 1.00 0.00 H new ATOM 0 HA3 GLY A 89 12.738 14.710 17.456 1.00 0.00 H new ATOM 1328 N LYS A 90 15.182 14.639 18.574 1.00 0.00 N ATOM 1329 CA LYS A 90 16.565 14.248 18.791 1.00 0.00 C ATOM 1330 C LYS A 90 16.601 12.923 19.555 1.00 0.00 C ATOM 1331 O LYS A 90 17.073 11.914 19.033 1.00 0.00 O ATOM 1332 CB LYS A 90 17.338 15.375 19.478 1.00 0.00 C ATOM 1333 CG LYS A 90 18.737 15.526 18.876 1.00 0.00 C ATOM 1334 CD LYS A 90 19.721 14.549 19.523 1.00 0.00 C ATOM 1335 CE LYS A 90 20.788 14.102 18.522 1.00 0.00 C ATOM 1336 NZ LYS A 90 21.978 14.977 18.607 1.00 0.00 N ATOM 0 H LYS A 90 14.543 14.383 19.327 1.00 0.00 H new ATOM 0 HA LYS A 90 17.069 14.081 17.839 1.00 0.00 H new ATOM 0 HB2 LYS A 90 16.791 16.312 19.375 1.00 0.00 H new ATOM 0 HB3 LYS A 90 17.418 15.168 20.545 1.00 0.00 H new ATOM 0 HG2 LYS A 90 18.696 15.348 17.801 1.00 0.00 H new ATOM 0 HG3 LYS A 90 19.089 16.548 19.016 1.00 0.00 H new ATOM 0 HD2 LYS A 90 20.198 15.023 20.381 1.00 0.00 H new ATOM 0 HD3 LYS A 90 19.182 13.679 19.898 1.00 0.00 H new ATOM 0 HE2 LYS A 90 21.074 13.069 18.723 1.00 0.00 H new ATOM 0 HE3 LYS A 90 20.381 14.129 17.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 22.692 14.659 17.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 21.704 15.957 18.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 22.375 14.930 19.567 1.00 0.00 H new ATOM 1350 N LYS A 91 16.097 12.968 20.780 1.00 0.00 N ATOM 1351 CA LYS A 91 16.066 11.784 21.621 1.00 0.00 C ATOM 1352 C LYS A 91 14.945 10.856 21.147 1.00 0.00 C ATOM 1353 O LYS A 91 13.948 10.675 21.844 1.00 0.00 O ATOM 1354 CB LYS A 91 15.957 12.176 23.095 1.00 0.00 C ATOM 1355 CG LYS A 91 16.686 11.169 23.986 1.00 0.00 C ATOM 1356 CD LYS A 91 16.118 11.182 25.407 1.00 0.00 C ATOM 1357 CE LYS A 91 17.069 10.487 26.384 1.00 0.00 C ATOM 1358 NZ LYS A 91 16.556 9.146 26.742 1.00 0.00 N ATOM 0 H LYS A 91 15.707 13.807 21.210 1.00 0.00 H new ATOM 0 HA LYS A 91 17.000 11.229 21.531 1.00 0.00 H new ATOM 0 HB2 LYS A 91 16.379 13.170 23.243 1.00 0.00 H new ATOM 0 HB3 LYS A 91 14.907 12.229 23.384 1.00 0.00 H new ATOM 0 HG2 LYS A 91 16.593 10.169 23.562 1.00 0.00 H new ATOM 0 HG3 LYS A 91 17.750 11.406 24.014 1.00 0.00 H new ATOM 0 HD2 LYS A 91 15.951 12.211 25.726 1.00 0.00 H new ATOM 0 HD3 LYS A 91 15.149 10.683 25.420 1.00 0.00 H new ATOM 0 HE2 LYS A 91 18.058 10.396 25.935 1.00 0.00 H new ATOM 0 HE3 LYS A 91 17.181 11.092 27.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 17.213 8.689 27.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 15.622 9.240 27.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 16.472 8.566 25.883 1.00 0.00 H new ATOM 1372 N LYS A 92 15.147 10.294 19.964 1.00 0.00 N ATOM 1373 CA LYS A 92 14.165 9.389 19.389 1.00 0.00 C ATOM 1374 C LYS A 92 14.875 8.137 18.870 1.00 0.00 C ATOM 1375 O LYS A 92 15.787 8.231 18.050 1.00 0.00 O ATOM 1376 CB LYS A 92 13.332 10.109 18.327 1.00 0.00 C ATOM 1377 CG LYS A 92 14.166 10.396 17.077 1.00 0.00 C ATOM 1378 CD LYS A 92 13.999 9.285 16.038 1.00 0.00 C ATOM 1379 CE LYS A 92 14.976 9.470 14.876 1.00 0.00 C ATOM 1380 NZ LYS A 92 15.490 8.160 14.417 1.00 0.00 N ATOM 0 H LYS A 92 15.975 10.447 19.388 1.00 0.00 H new ATOM 0 HA LYS A 92 13.456 9.061 20.149 1.00 0.00 H new ATOM 0 HB2 LYS A 92 12.469 9.498 18.061 1.00 0.00 H new ATOM 0 HB3 LYS A 92 12.947 11.044 18.734 1.00 0.00 H new ATOM 0 HG2 LYS A 92 13.864 11.350 16.646 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.217 10.488 17.350 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.166 8.315 16.507 1.00 0.00 H new ATOM 0 HD3 LYS A 92 12.976 9.285 15.661 1.00 0.00 H new ATOM 0 HE2 LYS A 92 14.478 9.981 14.052 1.00 0.00 H new ATOM 0 HE3 LYS A 92 15.806 10.104 15.188 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 16.152 8.304 13.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 15.983 7.687 15.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.696 7.568 14.100 1.00 0.00 H new ATOM 1394 N GLY A 93 14.430 6.994 19.369 1.00 0.00 N ATOM 1395 CA GLY A 93 15.011 5.724 18.966 1.00 0.00 C ATOM 1396 C GLY A 93 15.065 4.748 20.142 1.00 0.00 C ATOM 1397 O GLY A 93 14.729 5.108 21.269 1.00 0.00 O ATOM 0 H GLY A 93 13.673 6.920 20.049 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.423 5.292 18.157 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.016 5.887 18.578 1.00 0.00 H new ATOM 1401 N VAL A 94 15.490 3.530 19.840 1.00 0.00 N ATOM 1402 CA VAL A 94 15.592 2.498 20.858 1.00 0.00 C ATOM 1403 C VAL A 94 16.771 2.814 21.781 1.00 0.00 C ATOM 1404 O VAL A 94 17.752 3.422 21.355 1.00 0.00 O ATOM 1405 CB VAL A 94 15.701 1.122 20.200 1.00 0.00 C ATOM 1406 CG1 VAL A 94 17.022 0.980 19.440 1.00 0.00 C ATOM 1407 CG2 VAL A 94 15.540 0.005 21.233 1.00 0.00 C ATOM 0 H VAL A 94 15.768 3.234 18.904 1.00 0.00 H new ATOM 0 HA VAL A 94 14.692 2.478 21.473 1.00 0.00 H new ATOM 0 HB VAL A 94 14.888 1.031 19.479 1.00 0.00 H new ATOM 0 HG11 VAL A 94 17.074 -0.008 18.982 1.00 0.00 H new ATOM 0 HG12 VAL A 94 17.079 1.743 18.664 1.00 0.00 H new ATOM 0 HG13 VAL A 94 17.855 1.103 20.132 1.00 0.00 H new ATOM 0 HG21 VAL A 94 15.622 -0.963 20.738 1.00 0.00 H new ATOM 0 HG22 VAL A 94 16.320 0.093 21.989 1.00 0.00 H new ATOM 0 HG23 VAL A 94 14.563 0.088 21.709 1.00 0.00 H new ATOM 1417 N SER A 95 16.636 2.388 23.028 1.00 0.00 N ATOM 1418 CA SER A 95 17.677 2.618 24.015 1.00 0.00 C ATOM 1419 C SER A 95 18.784 1.573 23.861 1.00 0.00 C ATOM 1420 O SER A 95 19.942 1.919 23.633 1.00 0.00 O ATOM 1421 CB SER A 95 17.108 2.583 25.435 1.00 0.00 C ATOM 1422 OG SER A 95 18.115 2.802 26.419 1.00 0.00 O ATOM 0 H SER A 95 15.821 1.884 23.378 1.00 0.00 H new ATOM 0 HA SER A 95 18.096 3.610 23.845 1.00 0.00 H new ATOM 0 HB2 SER A 95 16.333 3.343 25.534 1.00 0.00 H new ATOM 0 HB3 SER A 95 16.632 1.618 25.611 1.00 0.00 H new ATOM 0 HG SER A 95 17.712 2.774 27.312 1.00 0.00 H new ATOM 1428 N GLY A 96 18.388 0.315 23.992 1.00 0.00 N ATOM 1429 CA GLY A 96 19.332 -0.783 23.871 1.00 0.00 C ATOM 1430 C GLY A 96 18.936 -1.949 24.778 1.00 0.00 C ATOM 1431 O GLY A 96 17.775 -2.073 25.166 1.00 0.00 O ATOM 0 H GLY A 96 17.426 0.032 24.181 1.00 0.00 H new ATOM 0 HA2 GLY A 96 19.372 -1.121 22.835 1.00 0.00 H new ATOM 0 HA3 GLY A 96 20.332 -0.438 24.132 1.00 0.00 H new ATOM 1435 N GLN A 97 19.923 -2.776 25.091 1.00 0.00 N ATOM 1436 CA GLN A 97 19.693 -3.928 25.945 1.00 0.00 C ATOM 1437 C GLN A 97 20.995 -4.703 26.154 1.00 0.00 C ATOM 1438 O GLN A 97 21.899 -4.641 25.323 1.00 0.00 O ATOM 1439 CB GLN A 97 18.604 -4.833 25.364 1.00 0.00 C ATOM 1440 CG GLN A 97 17.805 -5.513 26.478 1.00 0.00 C ATOM 1441 CD GLN A 97 16.425 -5.945 25.977 1.00 0.00 C ATOM 1442 OE1 GLN A 97 16.271 -6.490 24.896 1.00 0.00 O ATOM 1443 NE2 GLN A 97 15.434 -5.673 26.820 1.00 0.00 N ATOM 0 H GLN A 97 20.885 -2.670 24.768 1.00 0.00 H new ATOM 0 HA GLN A 97 19.345 -3.572 26.915 1.00 0.00 H new ATOM 0 HB2 GLN A 97 17.933 -4.245 24.737 1.00 0.00 H new ATOM 0 HB3 GLN A 97 19.058 -5.589 24.723 1.00 0.00 H new ATOM 0 HG2 GLN A 97 18.352 -6.382 26.844 1.00 0.00 H new ATOM 0 HG3 GLN A 97 17.693 -4.829 27.320 1.00 0.00 H new ATOM 0 HE21 GLN A 97 15.632 -5.215 27.709 1.00 0.00 H new ATOM 0 HE22 GLN A 97 14.475 -5.923 26.578 1.00 0.00 H new ATOM 1452 N LYS A 98 21.050 -5.416 27.270 1.00 0.00 N ATOM 1453 CA LYS A 98 22.227 -6.202 27.599 1.00 0.00 C ATOM 1454 C LYS A 98 23.409 -5.263 27.847 1.00 0.00 C ATOM 1455 O LYS A 98 23.579 -4.273 27.138 1.00 0.00 O ATOM 1456 CB LYS A 98 22.491 -7.250 26.516 1.00 0.00 C ATOM 1457 CG LYS A 98 23.033 -8.544 27.126 1.00 0.00 C ATOM 1458 CD LYS A 98 23.764 -9.381 26.074 1.00 0.00 C ATOM 1459 CE LYS A 98 25.140 -9.819 26.581 1.00 0.00 C ATOM 1460 NZ LYS A 98 26.202 -8.970 25.996 1.00 0.00 N ATOM 0 H LYS A 98 20.298 -5.466 27.958 1.00 0.00 H new ATOM 0 HA LYS A 98 22.066 -6.762 28.520 1.00 0.00 H new ATOM 0 HB2 LYS A 98 21.569 -7.458 25.974 1.00 0.00 H new ATOM 0 HB3 LYS A 98 23.205 -6.858 25.792 1.00 0.00 H new ATOM 0 HG2 LYS A 98 23.713 -8.308 27.945 1.00 0.00 H new ATOM 0 HG3 LYS A 98 22.212 -9.122 27.550 1.00 0.00 H new ATOM 0 HD2 LYS A 98 23.168 -10.259 25.824 1.00 0.00 H new ATOM 0 HD3 LYS A 98 23.878 -8.802 25.158 1.00 0.00 H new ATOM 0 HE2 LYS A 98 25.171 -9.753 27.669 1.00 0.00 H new ATOM 0 HE3 LYS A 98 25.315 -10.863 26.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 27.129 -9.280 26.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 26.182 -9.054 24.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 26.042 -7.979 26.267 1.00 0.00 H new ATOM 1474 N SER A 99 24.195 -5.608 28.856 1.00 0.00 N ATOM 1475 CA SER A 99 25.357 -4.809 29.207 1.00 0.00 C ATOM 1476 C SER A 99 26.135 -5.484 30.338 1.00 0.00 C ATOM 1477 O SER A 99 25.552 -6.183 31.166 1.00 0.00 O ATOM 1478 CB SER A 99 24.947 -3.392 29.616 1.00 0.00 C ATOM 1479 OG SER A 99 25.363 -2.419 28.662 1.00 0.00 O ATOM 0 H SER A 99 24.050 -6.430 29.442 1.00 0.00 H new ATOM 0 HA SER A 99 25.998 -4.734 28.329 1.00 0.00 H new ATOM 0 HB2 SER A 99 23.864 -3.347 29.731 1.00 0.00 H new ATOM 0 HB3 SER A 99 25.381 -3.155 30.588 1.00 0.00 H new ATOM 0 HG SER A 99 24.961 -2.622 27.791 1.00 0.00 H new ATOM 1485 N GLY A 100 27.439 -5.251 30.338 1.00 0.00 N ATOM 1486 CA GLY A 100 28.303 -5.828 31.354 1.00 0.00 C ATOM 1487 C GLY A 100 29.563 -4.982 31.547 1.00 0.00 C ATOM 1488 O GLY A 100 30.654 -5.388 31.148 1.00 0.00 O ATOM 0 H GLY A 100 27.919 -4.670 29.650 1.00 0.00 H new ATOM 0 HA2 GLY A 100 27.762 -5.902 32.297 1.00 0.00 H new ATOM 0 HA3 GLY A 100 28.582 -6.842 31.066 1.00 0.00 H new ATOM 1492 N PRO A 101 29.366 -3.792 32.174 1.00 0.00 N ATOM 1493 CA PRO A 101 30.473 -2.886 32.425 1.00 0.00 C ATOM 1494 C PRO A 101 31.344 -3.390 33.579 1.00 0.00 C ATOM 1495 O PRO A 101 32.554 -3.547 33.425 1.00 0.00 O ATOM 1496 CB PRO A 101 29.825 -1.542 32.714 1.00 0.00 C ATOM 1497 CG PRO A 101 28.379 -1.845 33.071 1.00 0.00 C ATOM 1498 CD PRO A 101 28.088 -3.280 32.660 1.00 0.00 C ATOM 0 HA PRO A 101 31.154 -2.811 31.577 1.00 0.00 H new ATOM 0 HB2 PRO A 101 30.331 -1.033 33.534 1.00 0.00 H new ATOM 0 HB3 PRO A 101 29.884 -0.885 31.846 1.00 0.00 H new ATOM 0 HG2 PRO A 101 28.214 -1.713 34.140 1.00 0.00 H new ATOM 0 HG3 PRO A 101 27.707 -1.157 32.558 1.00 0.00 H new ATOM 0 HD2 PRO A 101 27.721 -3.867 33.502 1.00 0.00 H new ATOM 0 HD3 PRO A 101 27.323 -3.323 31.884 1.00 0.00 H new ATOM 1506 N SER A 102 30.693 -3.628 34.708 1.00 0.00 N ATOM 1507 CA SER A 102 31.392 -4.111 35.887 1.00 0.00 C ATOM 1508 C SER A 102 32.428 -5.163 35.487 1.00 0.00 C ATOM 1509 O SER A 102 32.127 -6.074 34.718 1.00 0.00 O ATOM 1510 CB SER A 102 30.413 -4.692 36.909 1.00 0.00 C ATOM 1511 OG SER A 102 30.946 -4.671 38.230 1.00 0.00 O ATOM 0 H SER A 102 29.689 -3.495 34.831 1.00 0.00 H new ATOM 0 HA SER A 102 31.901 -3.267 36.352 1.00 0.00 H new ATOM 0 HB2 SER A 102 29.483 -4.124 36.884 1.00 0.00 H new ATOM 0 HB3 SER A 102 30.167 -5.718 36.633 1.00 0.00 H new ATOM 0 HG SER A 102 30.291 -5.048 38.853 1.00 0.00 H new ATOM 1517 N SER A 103 33.628 -5.002 36.026 1.00 0.00 N ATOM 1518 CA SER A 103 34.710 -5.927 35.735 1.00 0.00 C ATOM 1519 C SER A 103 35.335 -6.427 37.038 1.00 0.00 C ATOM 1520 O SER A 103 36.006 -5.672 37.740 1.00 0.00 O ATOM 1521 CB SER A 103 35.774 -5.269 34.854 1.00 0.00 C ATOM 1522 OG SER A 103 36.745 -6.208 34.400 1.00 0.00 O ATOM 0 H SER A 103 33.875 -4.244 36.663 1.00 0.00 H new ATOM 0 HA SER A 103 34.298 -6.775 35.188 1.00 0.00 H new ATOM 0 HB2 SER A 103 35.294 -4.799 33.995 1.00 0.00 H new ATOM 0 HB3 SER A 103 36.270 -4.477 35.415 1.00 0.00 H new ATOM 0 HG SER A 103 37.406 -5.750 33.840 1.00 0.00 H new ATOM 1528 N GLY A 104 35.093 -7.698 37.323 1.00 0.00 N ATOM 1529 CA GLY A 104 35.624 -8.309 38.530 1.00 0.00 C ATOM 1530 C GLY A 104 37.122 -8.586 38.391 1.00 0.00 C ATOM 1531 O GLY A 104 37.569 -9.716 38.584 1.00 0.00 O ATOM 0 H GLY A 104 34.536 -8.322 36.739 1.00 0.00 H new ATOM 0 HA2 GLY A 104 35.450 -7.651 39.382 1.00 0.00 H new ATOM 0 HA3 GLY A 104 35.096 -9.240 38.733 1.00 0.00 H new TER 1535 GLY A 104