USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 921 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 124 SER OG : rot 63:sc= 0.983 USER MOD Set 1.2: A 127 SER OG : rot 110:sc= 0.77 USER MOD Set 2.1: A 78 ASN : amide:sc= -0.755 K(o=-0.82,f=0.12) USER MOD Set 2.2: A 80 GLN : amide:sc= -0.0702 K(o=-0.82,f=-1.3) USER MOD Set 3.1: A 27 GLN : amide:sc= -0.245 X(o=-3.4,f=-3) USER MOD Set 3.2: A 61 HIS : no HD1:sc= -3.12! K(o=-3.4!,f=-2.2) USER MOD Single : A 1 GLY N :NH3+ -121:sc= 0.0797 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 61:sc= 0.251 USER MOD Single : A 6 SER OG : rot 5:sc= 0.919 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc=-0.000601 USER MOD Single : A 17 TYR OH : rot 180:sc= 0.00331 USER MOD Single : A 18 ASN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 24 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.456) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.0229 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= -0.0927 X(o=-0.093,f=0) USER MOD Single : A 42 THR OG1 : rot 120:sc= -1.15 USER MOD Single : A 46 SER OG : rot 27:sc= 0.583! USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 20:sc= 0.857 USER MOD Single : A 57 SER OG : rot 114:sc= 0.47 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 ASN : amide:sc= -6.11! K(o=-6.1!,f=-3.3) USER MOD Single : A 64 HIS : no HD1:sc= -1.15 X(o=-1.2,f=-1.5) USER MOD Single : A 66 GLN : amide:sc= -1.02 K(o=-1,f=-2.8!) USER MOD Single : A 68 ASN : amide:sc= -0.609 K(o=-0.61,f=-1.1) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -6! C(o=-6!,f=-5.7!) USER MOD Single : A 85 HIS : no HD1:sc= -2.29 K(o=-2.3,f=-2.8!) USER MOD Single : A 93 ASN : amide:sc= 0.279 X(o=0.28,f=-0.0055) USER MOD Single : A 96 GLN : amide:sc= 1.22 K(o=1.2,f=0) USER MOD Single : A 99 HIS : no HD1:sc= -2.34! C(o=-2.3!,f=-3!) USER MOD Single : A 101 THR OG1 : rot 81:sc= -0.075 USER MOD Single : A 106 LYS NZ :NH3+ -166:sc= 0.986 (180deg=0.848) USER MOD Single : A 107 THR OG1 : rot 180:sc=-0.00176 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= -0.0102 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot -49:sc= 0.809 USER MOD Single : A 128 SER OG : rot 180:sc= -0.0355 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -22.684 20.011 -25.745 1.00 0.00 N ATOM 2 CA GLY A 1 -21.925 18.785 -25.912 1.00 0.00 C ATOM 3 C GLY A 1 -22.416 17.671 -25.009 1.00 0.00 C ATOM 4 O GLY A 1 -23.406 17.833 -24.295 1.00 0.00 O ATOM 0 H1 GLY A 1 -23.114 20.280 -26.653 1.00 0.00 H new ATOM 0 H2 GLY A 1 -23.432 19.862 -25.038 1.00 0.00 H new ATOM 0 H3 GLY A 1 -22.050 20.771 -25.424 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.988 18.461 -26.951 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.873 18.981 -25.703 1.00 0.00 H new ATOM 8 N SER A 2 -21.724 16.537 -25.041 1.00 0.00 N ATOM 9 CA SER A 2 -22.099 15.389 -24.223 1.00 0.00 C ATOM 10 C SER A 2 -20.886 14.827 -23.488 1.00 0.00 C ATOM 11 O SER A 2 -19.761 15.290 -23.679 1.00 0.00 O ATOM 12 CB SER A 2 -22.732 14.302 -25.093 1.00 0.00 C ATOM 13 OG SER A 2 -21.846 13.889 -26.119 1.00 0.00 O ATOM 0 H SER A 2 -20.901 16.388 -25.624 1.00 0.00 H new ATOM 0 HA SER A 2 -22.827 15.722 -23.484 1.00 0.00 H new ATOM 0 HB2 SER A 2 -23.000 13.446 -24.473 1.00 0.00 H new ATOM 0 HB3 SER A 2 -23.655 14.677 -25.535 1.00 0.00 H new ATOM 0 HG SER A 2 -22.274 13.193 -26.660 1.00 0.00 H new ATOM 19 N SER A 3 -21.123 13.826 -22.647 1.00 0.00 N ATOM 20 CA SER A 3 -20.052 13.202 -21.879 1.00 0.00 C ATOM 21 C SER A 3 -19.733 11.812 -22.423 1.00 0.00 C ATOM 22 O SER A 3 -20.602 11.130 -22.964 1.00 0.00 O ATOM 23 CB SER A 3 -20.442 13.108 -20.403 1.00 0.00 C ATOM 24 OG SER A 3 -20.379 14.377 -19.777 1.00 0.00 O ATOM 0 H SER A 3 -22.048 13.429 -22.480 1.00 0.00 H new ATOM 0 HA SER A 3 -19.161 13.823 -21.972 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.451 12.706 -20.315 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.776 12.413 -19.891 1.00 0.00 H new ATOM 0 HG SER A 3 -20.634 14.290 -18.835 1.00 0.00 H new ATOM 30 N GLY A 4 -18.478 11.400 -22.274 1.00 0.00 N ATOM 31 CA GLY A 4 -18.064 10.094 -22.754 1.00 0.00 C ATOM 32 C GLY A 4 -17.089 9.413 -21.815 1.00 0.00 C ATOM 33 O GLY A 4 -17.276 9.427 -20.598 1.00 0.00 O ATOM 0 H GLY A 4 -17.741 11.947 -21.830 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -18.943 9.462 -22.881 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.603 10.201 -23.736 1.00 0.00 H new ATOM 37 N SER A 5 -16.046 8.814 -22.380 1.00 0.00 N ATOM 38 CA SER A 5 -15.040 8.119 -21.585 1.00 0.00 C ATOM 39 C SER A 5 -15.674 7.456 -20.366 1.00 0.00 C ATOM 40 O SER A 5 -15.169 7.573 -19.249 1.00 0.00 O ATOM 41 CB SER A 5 -13.948 9.094 -21.140 1.00 0.00 C ATOM 42 OG SER A 5 -14.450 10.025 -20.196 1.00 0.00 O ATOM 0 H SER A 5 -15.875 8.796 -23.385 1.00 0.00 H new ATOM 0 HA SER A 5 -14.593 7.344 -22.207 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.117 8.540 -20.703 1.00 0.00 H new ATOM 0 HB3 SER A 5 -13.555 9.626 -22.007 1.00 0.00 H new ATOM 0 HG SER A 5 -14.767 9.547 -19.402 1.00 0.00 H new ATOM 48 N SER A 6 -16.784 6.760 -20.589 1.00 0.00 N ATOM 49 CA SER A 6 -17.490 6.081 -19.509 1.00 0.00 C ATOM 50 C SER A 6 -17.718 4.611 -19.848 1.00 0.00 C ATOM 51 O SER A 6 -18.440 4.284 -20.789 1.00 0.00 O ATOM 52 CB SER A 6 -18.831 6.767 -19.238 1.00 0.00 C ATOM 53 OG SER A 6 -19.795 6.406 -20.212 1.00 0.00 O ATOM 0 H SER A 6 -17.214 6.652 -21.508 1.00 0.00 H new ATOM 0 HA SER A 6 -16.872 6.138 -18.613 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.190 6.491 -18.247 1.00 0.00 H new ATOM 0 HB3 SER A 6 -18.696 7.849 -19.239 1.00 0.00 H new ATOM 0 HG SER A 6 -19.418 5.726 -20.809 1.00 0.00 H new ATOM 59 N GLY A 7 -17.094 3.728 -19.074 1.00 0.00 N ATOM 60 CA GLY A 7 -17.240 2.303 -19.308 1.00 0.00 C ATOM 61 C GLY A 7 -16.186 1.759 -20.251 1.00 0.00 C ATOM 62 O GLY A 7 -15.549 2.515 -20.984 1.00 0.00 O ATOM 0 H GLY A 7 -16.490 3.974 -18.289 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -17.180 1.774 -18.357 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -18.229 2.105 -19.721 1.00 0.00 H new ATOM 66 N GLY A 8 -16.000 0.443 -20.233 1.00 0.00 N ATOM 67 CA GLY A 8 -15.013 -0.179 -21.096 1.00 0.00 C ATOM 68 C GLY A 8 -14.526 -1.509 -20.557 1.00 0.00 C ATOM 69 O GLY A 8 -14.596 -1.762 -19.354 1.00 0.00 O ATOM 0 H GLY A 8 -16.515 -0.204 -19.636 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -15.443 -0.328 -22.086 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -14.164 0.494 -21.215 1.00 0.00 H new ATOM 73 N SER A 9 -14.033 -2.363 -21.448 1.00 0.00 N ATOM 74 CA SER A 9 -13.538 -3.677 -21.055 1.00 0.00 C ATOM 75 C SER A 9 -12.872 -3.619 -19.684 1.00 0.00 C ATOM 76 O SER A 9 -12.076 -2.722 -19.406 1.00 0.00 O ATOM 77 CB SER A 9 -12.547 -4.204 -22.095 1.00 0.00 C ATOM 78 OG SER A 9 -13.204 -4.527 -23.308 1.00 0.00 O ATOM 0 H SER A 9 -13.966 -2.169 -22.447 1.00 0.00 H new ATOM 0 HA SER A 9 -14.389 -4.356 -20.997 1.00 0.00 H new ATOM 0 HB2 SER A 9 -11.779 -3.454 -22.283 1.00 0.00 H new ATOM 0 HB3 SER A 9 -12.041 -5.088 -21.705 1.00 0.00 H new ATOM 0 HG SER A 9 -12.549 -4.860 -23.956 1.00 0.00 H new ATOM 84 N ASP A 10 -13.203 -4.583 -18.832 1.00 0.00 N ATOM 85 CA ASP A 10 -12.637 -4.644 -17.489 1.00 0.00 C ATOM 86 C ASP A 10 -11.272 -5.325 -17.505 1.00 0.00 C ATOM 87 O ASP A 10 -10.972 -6.158 -16.650 1.00 0.00 O ATOM 88 CB ASP A 10 -13.582 -5.391 -16.547 1.00 0.00 C ATOM 89 CG ASP A 10 -13.869 -6.804 -17.016 1.00 0.00 C ATOM 90 OD1 ASP A 10 -13.852 -7.037 -18.243 1.00 0.00 O ATOM 91 OD2 ASP A 10 -14.110 -7.677 -16.156 1.00 0.00 O ATOM 0 H ASP A 10 -13.860 -5.333 -19.047 1.00 0.00 H new ATOM 0 HA ASP A 10 -12.510 -3.623 -17.129 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -13.144 -5.424 -15.549 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -14.519 -4.841 -16.466 1.00 0.00 H new ATOM 96 N SER A 11 -10.448 -4.965 -18.485 1.00 0.00 N ATOM 97 CA SER A 11 -9.117 -5.545 -18.616 1.00 0.00 C ATOM 98 C SER A 11 -8.131 -4.858 -17.675 1.00 0.00 C ATOM 99 O SER A 11 -7.559 -5.491 -16.788 1.00 0.00 O ATOM 100 CB SER A 11 -8.627 -5.429 -20.060 1.00 0.00 C ATOM 101 OG SER A 11 -7.736 -6.483 -20.383 1.00 0.00 O ATOM 0 H SER A 11 -10.679 -4.275 -19.199 1.00 0.00 H new ATOM 0 HA SER A 11 -9.178 -6.599 -18.345 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.479 -5.448 -20.739 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.128 -4.470 -20.202 1.00 0.00 H new ATOM 0 HG SER A 11 -7.439 -6.387 -21.312 1.00 0.00 H new ATOM 107 N SER A 12 -7.936 -3.559 -17.878 1.00 0.00 N ATOM 108 CA SER A 12 -7.017 -2.786 -17.051 1.00 0.00 C ATOM 109 C SER A 12 -7.780 -1.911 -16.061 1.00 0.00 C ATOM 110 O SER A 12 -7.893 -0.699 -16.243 1.00 0.00 O ATOM 111 CB SER A 12 -6.118 -1.914 -17.930 1.00 0.00 C ATOM 112 OG SER A 12 -5.501 -2.683 -18.948 1.00 0.00 O ATOM 0 H SER A 12 -8.402 -3.020 -18.608 1.00 0.00 H new ATOM 0 HA SER A 12 -6.398 -3.485 -16.489 1.00 0.00 H new ATOM 0 HB2 SER A 12 -6.708 -1.115 -18.380 1.00 0.00 H new ATOM 0 HB3 SER A 12 -5.354 -1.438 -17.315 1.00 0.00 H new ATOM 0 HG SER A 12 -4.933 -2.103 -19.497 1.00 0.00 H new ATOM 118 N LEU A 13 -8.304 -2.536 -15.012 1.00 0.00 N ATOM 119 CA LEU A 13 -9.057 -1.817 -13.990 1.00 0.00 C ATOM 120 C LEU A 13 -8.202 -0.729 -13.348 1.00 0.00 C ATOM 121 O LEU A 13 -8.692 0.358 -13.038 1.00 0.00 O ATOM 122 CB LEU A 13 -9.557 -2.787 -12.919 1.00 0.00 C ATOM 123 CG LEU A 13 -10.746 -3.665 -13.311 1.00 0.00 C ATOM 124 CD1 LEU A 13 -11.943 -2.805 -13.686 1.00 0.00 C ATOM 125 CD2 LEU A 13 -10.371 -4.591 -14.459 1.00 0.00 C ATOM 0 H LEU A 13 -8.221 -3.539 -14.847 1.00 0.00 H new ATOM 0 HA LEU A 13 -9.913 -1.344 -14.471 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -8.730 -3.437 -12.631 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -9.832 -2.211 -12.035 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.019 -4.278 -12.452 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -12.780 -3.447 -13.962 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.226 -2.185 -12.835 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -11.682 -2.166 -14.530 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.230 -5.208 -14.724 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.071 -3.997 -15.322 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -9.544 -5.232 -14.154 1.00 0.00 H new ATOM 137 N PHE A 14 -6.922 -1.027 -13.153 1.00 0.00 N ATOM 138 CA PHE A 14 -5.999 -0.074 -12.549 1.00 0.00 C ATOM 139 C PHE A 14 -5.147 0.609 -13.615 1.00 0.00 C ATOM 140 O PHE A 14 -5.177 0.228 -14.785 1.00 0.00 O ATOM 141 CB PHE A 14 -5.096 -0.779 -11.534 1.00 0.00 C ATOM 142 CG PHE A 14 -5.811 -1.813 -10.712 1.00 0.00 C ATOM 143 CD1 PHE A 14 -6.061 -3.075 -11.227 1.00 0.00 C ATOM 144 CD2 PHE A 14 -6.233 -1.523 -9.425 1.00 0.00 C ATOM 145 CE1 PHE A 14 -6.720 -4.028 -10.473 1.00 0.00 C ATOM 146 CE2 PHE A 14 -6.892 -2.472 -8.666 1.00 0.00 C ATOM 147 CZ PHE A 14 -7.135 -3.726 -9.191 1.00 0.00 C ATOM 0 H PHE A 14 -6.500 -1.921 -13.405 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.587 0.687 -12.036 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -4.270 -1.255 -12.063 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.661 -0.034 -10.868 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.737 -3.317 -12.229 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -6.045 -0.544 -9.010 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -6.910 -5.008 -10.886 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -7.216 -2.233 -7.664 1.00 0.00 H new ATOM 0 HZ PHE A 14 -7.649 -4.469 -8.600 1.00 0.00 H new ATOM 157 N GLU A 15 -4.390 1.620 -13.201 1.00 0.00 N ATOM 158 CA GLU A 15 -3.532 2.358 -14.121 1.00 0.00 C ATOM 159 C GLU A 15 -2.115 2.473 -13.568 1.00 0.00 C ATOM 160 O GLU A 15 -1.914 2.869 -12.420 1.00 0.00 O ATOM 161 CB GLU A 15 -4.105 3.752 -14.382 1.00 0.00 C ATOM 162 CG GLU A 15 -4.342 4.559 -13.117 1.00 0.00 C ATOM 163 CD GLU A 15 -4.220 6.053 -13.347 1.00 0.00 C ATOM 164 OE1 GLU A 15 -5.177 6.650 -13.885 1.00 0.00 O ATOM 165 OE2 GLU A 15 -3.170 6.626 -12.989 1.00 0.00 O ATOM 0 H GLU A 15 -4.353 1.947 -12.235 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.493 1.808 -15.062 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.422 4.301 -15.030 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -5.047 3.653 -14.922 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.335 4.335 -12.728 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.625 4.253 -12.355 1.00 0.00 H new ATOM 172 N THR A 16 -1.133 2.125 -14.395 1.00 0.00 N ATOM 173 CA THR A 16 0.265 2.187 -13.989 1.00 0.00 C ATOM 174 C THR A 16 0.901 3.509 -14.408 1.00 0.00 C ATOM 175 O THR A 16 0.579 4.056 -15.463 1.00 0.00 O ATOM 176 CB THR A 16 1.078 1.026 -14.593 1.00 0.00 C ATOM 177 OG1 THR A 16 0.545 -0.227 -14.150 1.00 0.00 O ATOM 178 CG2 THR A 16 2.543 1.128 -14.197 1.00 0.00 C ATOM 0 H THR A 16 -1.281 1.797 -15.350 1.00 0.00 H new ATOM 0 HA THR A 16 0.282 2.106 -12.902 1.00 0.00 H new ATOM 0 HB THR A 16 1.007 1.087 -15.679 1.00 0.00 H new ATOM 0 HG1 THR A 16 1.066 -0.960 -14.539 1.00 0.00 H new ATOM 0 HG21 THR A 16 3.097 0.298 -14.635 1.00 0.00 H new ATOM 0 HG22 THR A 16 2.953 2.070 -14.561 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.630 1.089 -13.111 1.00 0.00 H new ATOM 186 N TYR A 17 1.804 4.015 -13.576 1.00 0.00 N ATOM 187 CA TYR A 17 2.483 5.274 -13.860 1.00 0.00 C ATOM 188 C TYR A 17 3.897 5.270 -13.288 1.00 0.00 C ATOM 189 O TYR A 17 4.158 4.662 -12.250 1.00 0.00 O ATOM 190 CB TYR A 17 1.690 6.447 -13.282 1.00 0.00 C ATOM 191 CG TYR A 17 1.452 6.342 -11.792 1.00 0.00 C ATOM 192 CD1 TYR A 17 0.395 5.594 -11.289 1.00 0.00 C ATOM 193 CD2 TYR A 17 2.284 6.991 -10.888 1.00 0.00 C ATOM 194 CE1 TYR A 17 0.173 5.496 -9.929 1.00 0.00 C ATOM 195 CE2 TYR A 17 2.071 6.897 -9.527 1.00 0.00 C ATOM 196 CZ TYR A 17 1.014 6.148 -9.052 1.00 0.00 C ATOM 197 OH TYR A 17 0.797 6.053 -7.696 1.00 0.00 O ATOM 0 H TYR A 17 2.083 3.573 -12.700 1.00 0.00 H new ATOM 0 HA TYR A 17 2.548 5.387 -14.942 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.224 7.374 -13.492 1.00 0.00 H new ATOM 0 HB3 TYR A 17 0.728 6.511 -13.791 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -0.264 5.080 -11.973 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.112 7.579 -11.256 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.655 4.912 -9.555 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.728 7.407 -8.838 1.00 0.00 H new ATOM 0 HH TYR A 17 1.479 6.570 -7.219 1.00 0.00 H new ATOM 207 N ASN A 18 4.807 5.955 -13.973 1.00 0.00 N ATOM 208 CA ASN A 18 6.196 6.032 -13.534 1.00 0.00 C ATOM 209 C ASN A 18 6.458 7.335 -12.784 1.00 0.00 C ATOM 210 O ASN A 18 5.982 8.399 -13.180 1.00 0.00 O ATOM 211 CB ASN A 18 7.139 5.923 -14.734 1.00 0.00 C ATOM 212 CG ASN A 18 7.475 4.484 -15.076 1.00 0.00 C ATOM 213 OD1 ASN A 18 8.610 4.042 -14.899 1.00 0.00 O ATOM 214 ND2 ASN A 18 6.487 3.747 -15.569 1.00 0.00 N ATOM 0 H ASN A 18 4.608 6.465 -14.834 1.00 0.00 H new ATOM 0 HA ASN A 18 6.383 5.199 -12.856 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.679 6.401 -15.599 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.059 6.467 -14.520 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.653 2.772 -15.818 1.00 0.00 H new ATOM 0 HD22 ASN A 18 5.562 4.156 -15.699 1.00 0.00 H new ATOM 221 N VAL A 19 7.220 7.243 -11.698 1.00 0.00 N ATOM 222 CA VAL A 19 7.547 8.414 -10.894 1.00 0.00 C ATOM 223 C VAL A 19 9.056 8.584 -10.760 1.00 0.00 C ATOM 224 O VAL A 19 9.732 7.756 -10.150 1.00 0.00 O ATOM 225 CB VAL A 19 6.925 8.321 -9.487 1.00 0.00 C ATOM 226 CG1 VAL A 19 6.832 9.699 -8.852 1.00 0.00 C ATOM 227 CG2 VAL A 19 5.556 7.661 -9.554 1.00 0.00 C ATOM 0 H VAL A 19 7.622 6.370 -11.356 1.00 0.00 H new ATOM 0 HA VAL A 19 7.131 9.279 -11.411 1.00 0.00 H new ATOM 0 HB VAL A 19 7.571 7.704 -8.862 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.390 9.613 -7.859 1.00 0.00 H new ATOM 0 HG12 VAL A 19 7.830 10.130 -8.769 1.00 0.00 H new ATOM 0 HG13 VAL A 19 6.209 10.344 -9.472 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.131 7.603 -8.552 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.899 8.250 -10.194 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.656 6.656 -9.964 1.00 0.00 H new ATOM 237 N GLU A 20 9.578 9.664 -11.333 1.00 0.00 N ATOM 238 CA GLU A 20 11.008 9.943 -11.277 1.00 0.00 C ATOM 239 C GLU A 20 11.356 10.757 -10.034 1.00 0.00 C ATOM 240 O GLU A 20 11.214 11.981 -10.020 1.00 0.00 O ATOM 241 CB GLU A 20 11.454 10.694 -12.534 1.00 0.00 C ATOM 242 CG GLU A 20 12.937 11.021 -12.554 1.00 0.00 C ATOM 243 CD GLU A 20 13.245 12.291 -13.323 1.00 0.00 C ATOM 244 OE1 GLU A 20 12.480 12.621 -14.254 1.00 0.00 O ATOM 245 OE2 GLU A 20 14.250 12.955 -12.993 1.00 0.00 O ATOM 0 H GLU A 20 9.032 10.360 -11.841 1.00 0.00 H new ATOM 0 HA GLU A 20 11.536 8.991 -11.225 1.00 0.00 H new ATOM 0 HB2 GLU A 20 11.211 10.094 -13.411 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.885 11.620 -12.614 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.296 11.125 -11.530 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.482 10.189 -13.000 1.00 0.00 H new ATOM 252 N LEU A 21 11.812 10.070 -8.993 1.00 0.00 N ATOM 253 CA LEU A 21 12.180 10.728 -7.744 1.00 0.00 C ATOM 254 C LEU A 21 13.619 11.232 -7.797 1.00 0.00 C ATOM 255 O LEU A 21 14.475 10.629 -8.446 1.00 0.00 O ATOM 256 CB LEU A 21 12.008 9.766 -6.567 1.00 0.00 C ATOM 257 CG LEU A 21 10.619 9.148 -6.404 1.00 0.00 C ATOM 258 CD1 LEU A 21 10.631 8.090 -5.311 1.00 0.00 C ATOM 259 CD2 LEU A 21 9.588 10.224 -6.097 1.00 0.00 C ATOM 0 H LEU A 21 11.936 9.058 -8.989 1.00 0.00 H new ATOM 0 HA LEU A 21 11.519 11.584 -7.605 1.00 0.00 H new ATOM 0 HB2 LEU A 21 12.733 8.959 -6.674 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.257 10.298 -5.649 1.00 0.00 H new ATOM 0 HG LEU A 21 10.344 8.668 -7.343 1.00 0.00 H new ATOM 0 HD11 LEU A 21 9.634 7.661 -5.209 1.00 0.00 H new ATOM 0 HD12 LEU A 21 11.339 7.304 -5.573 1.00 0.00 H new ATOM 0 HD13 LEU A 21 10.928 8.546 -4.367 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.606 9.765 -5.984 1.00 0.00 H new ATOM 0 HD22 LEU A 21 9.859 10.734 -5.172 1.00 0.00 H new ATOM 0 HD23 LEU A 21 9.560 10.945 -6.914 1.00 0.00 H new ATOM 271 N VAL A 22 13.879 12.339 -7.110 1.00 0.00 N ATOM 272 CA VAL A 22 15.215 12.922 -7.076 1.00 0.00 C ATOM 273 C VAL A 22 15.836 12.792 -5.690 1.00 0.00 C ATOM 274 O VAL A 22 15.186 13.058 -4.679 1.00 0.00 O ATOM 275 CB VAL A 22 15.189 14.409 -7.477 1.00 0.00 C ATOM 276 CG1 VAL A 22 14.455 15.232 -6.430 1.00 0.00 C ATOM 277 CG2 VAL A 22 16.604 14.930 -7.681 1.00 0.00 C ATOM 0 H VAL A 22 13.182 12.851 -6.569 1.00 0.00 H new ATOM 0 HA VAL A 22 15.820 12.370 -7.795 1.00 0.00 H new ATOM 0 HB VAL A 22 14.652 14.504 -8.421 1.00 0.00 H new ATOM 0 HG11 VAL A 22 14.447 16.280 -6.731 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.430 14.873 -6.338 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.961 15.134 -5.470 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.567 15.982 -7.964 1.00 0.00 H new ATOM 0 HG22 VAL A 22 17.168 14.823 -6.755 1.00 0.00 H new ATOM 0 HG23 VAL A 22 17.092 14.359 -8.471 1.00 0.00 H new ATOM 287 N ARG A 23 17.100 12.381 -5.650 1.00 0.00 N ATOM 288 CA ARG A 23 17.810 12.214 -4.388 1.00 0.00 C ATOM 289 C ARG A 23 18.807 13.348 -4.171 1.00 0.00 C ATOM 290 O ARG A 23 19.867 13.386 -4.798 1.00 0.00 O ATOM 291 CB ARG A 23 18.537 10.869 -4.360 1.00 0.00 C ATOM 292 CG ARG A 23 17.609 9.672 -4.493 1.00 0.00 C ATOM 293 CD ARG A 23 18.161 8.456 -3.766 1.00 0.00 C ATOM 294 NE ARG A 23 19.432 8.012 -4.330 1.00 0.00 N ATOM 295 CZ ARG A 23 20.335 7.315 -3.649 1.00 0.00 C ATOM 296 NH1 ARG A 23 20.107 6.985 -2.386 1.00 0.00 N ATOM 297 NH2 ARG A 23 21.469 6.947 -4.232 1.00 0.00 N ATOM 0 H ARG A 23 17.653 12.158 -6.478 1.00 0.00 H new ATOM 0 HA ARG A 23 17.076 12.239 -3.582 1.00 0.00 H new ATOM 0 HB2 ARG A 23 19.267 10.843 -5.169 1.00 0.00 H new ATOM 0 HB3 ARG A 23 19.093 10.785 -3.426 1.00 0.00 H new ATOM 0 HG2 ARG A 23 16.628 9.924 -4.090 1.00 0.00 H new ATOM 0 HG3 ARG A 23 17.469 9.434 -5.547 1.00 0.00 H new ATOM 0 HD2 ARG A 23 18.296 8.695 -2.711 1.00 0.00 H new ATOM 0 HD3 ARG A 23 17.437 7.643 -3.819 1.00 0.00 H new ATOM 0 HE ARG A 23 19.638 8.250 -5.300 1.00 0.00 H new ATOM 0 HH11 ARG A 23 19.237 7.266 -1.935 1.00 0.00 H new ATOM 0 HH12 ARG A 23 20.802 6.450 -1.865 1.00 0.00 H new ATOM 0 HH21 ARG A 23 21.648 7.199 -5.204 1.00 0.00 H new ATOM 0 HH22 ARG A 23 22.162 6.412 -3.708 1.00 0.00 H new ATOM 311 N LYS A 24 18.462 14.272 -3.281 1.00 0.00 N ATOM 312 CA LYS A 24 19.326 15.407 -2.981 1.00 0.00 C ATOM 313 C LYS A 24 20.746 14.943 -2.670 1.00 0.00 C ATOM 314 O LYS A 24 21.019 13.744 -2.615 1.00 0.00 O ATOM 315 CB LYS A 24 18.768 16.201 -1.797 1.00 0.00 C ATOM 316 CG LYS A 24 17.802 17.300 -2.204 1.00 0.00 C ATOM 317 CD LYS A 24 18.536 18.574 -2.586 1.00 0.00 C ATOM 318 CE LYS A 24 18.708 19.499 -1.391 1.00 0.00 C ATOM 319 NZ LYS A 24 20.004 19.271 -0.694 1.00 0.00 N ATOM 0 H LYS A 24 17.589 14.257 -2.754 1.00 0.00 H new ATOM 0 HA LYS A 24 19.356 16.050 -3.861 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.261 15.516 -1.118 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.597 16.643 -1.244 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.197 16.961 -3.045 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.117 17.506 -1.382 1.00 0.00 H new ATOM 0 HD2 LYS A 24 19.514 18.322 -2.996 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.985 19.091 -3.371 1.00 0.00 H new ATOM 0 HE2 LYS A 24 18.652 20.536 -1.723 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.887 19.344 -0.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 20.251 20.113 -0.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 19.918 18.449 -0.062 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 20.749 19.091 -1.397 1.00 0.00 H new ATOM 333 N ASP A 25 21.645 15.900 -2.467 1.00 0.00 N ATOM 334 CA ASP A 25 23.036 15.589 -2.159 1.00 0.00 C ATOM 335 C ASP A 25 23.155 14.926 -0.791 1.00 0.00 C ATOM 336 O ASP A 25 23.438 15.587 0.208 1.00 0.00 O ATOM 337 CB ASP A 25 23.886 16.860 -2.200 1.00 0.00 C ATOM 338 CG ASP A 25 23.938 17.477 -3.584 1.00 0.00 C ATOM 339 OD1 ASP A 25 24.196 16.736 -4.555 1.00 0.00 O ATOM 340 OD2 ASP A 25 23.720 18.702 -3.695 1.00 0.00 O ATOM 0 H ASP A 25 21.435 16.897 -2.510 1.00 0.00 H new ATOM 0 HA ASP A 25 23.402 14.892 -2.913 1.00 0.00 H new ATOM 0 HB2 ASP A 25 23.481 17.587 -1.496 1.00 0.00 H new ATOM 0 HB3 ASP A 25 24.899 16.627 -1.871 1.00 0.00 H new ATOM 345 N GLY A 26 22.935 13.615 -0.752 1.00 0.00 N ATOM 346 CA GLY A 26 23.021 12.885 0.499 1.00 0.00 C ATOM 347 C GLY A 26 21.658 12.575 1.084 1.00 0.00 C ATOM 348 O GLY A 26 21.459 12.673 2.295 1.00 0.00 O ATOM 0 H GLY A 26 22.699 13.046 -1.565 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.563 11.954 0.336 1.00 0.00 H new ATOM 0 HA3 GLY A 26 23.597 13.468 1.217 1.00 0.00 H new ATOM 352 N GLN A 27 20.717 12.202 0.223 1.00 0.00 N ATOM 353 CA GLN A 27 19.364 11.880 0.662 1.00 0.00 C ATOM 354 C GLN A 27 18.999 10.445 0.294 1.00 0.00 C ATOM 355 O GLN A 27 19.616 9.844 -0.586 1.00 0.00 O ATOM 356 CB GLN A 27 18.358 12.850 0.041 1.00 0.00 C ATOM 357 CG GLN A 27 16.927 12.619 0.498 1.00 0.00 C ATOM 358 CD GLN A 27 16.024 13.803 0.212 1.00 0.00 C ATOM 359 OE1 GLN A 27 15.534 14.460 1.130 1.00 0.00 O ATOM 360 NE2 GLN A 27 15.800 14.081 -1.067 1.00 0.00 N ATOM 0 H GLN A 27 20.866 12.115 -0.782 1.00 0.00 H new ATOM 0 HA GLN A 27 19.329 11.978 1.747 1.00 0.00 H new ATOM 0 HB2 GLN A 27 18.649 13.871 0.289 1.00 0.00 H new ATOM 0 HB3 GLN A 27 18.403 12.761 -1.044 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.529 11.735 0.000 1.00 0.00 H new ATOM 0 HG3 GLN A 27 16.920 12.412 1.568 1.00 0.00 H new ATOM 0 HE21 GLN A 27 16.227 13.509 -1.796 1.00 0.00 H new ATOM 0 HE22 GLN A 27 15.201 14.866 -1.321 1.00 0.00 H new ATOM 369 N SER A 28 17.994 9.903 0.972 1.00 0.00 N ATOM 370 CA SER A 28 17.549 8.537 0.719 1.00 0.00 C ATOM 371 C SER A 28 16.163 8.526 0.081 1.00 0.00 C ATOM 372 O SER A 28 15.557 9.577 -0.133 1.00 0.00 O ATOM 373 CB SER A 28 17.530 7.735 2.021 1.00 0.00 C ATOM 374 OG SER A 28 16.468 8.153 2.862 1.00 0.00 O ATOM 0 H SER A 28 17.472 10.388 1.701 1.00 0.00 H new ATOM 0 HA SER A 28 18.252 8.075 0.026 1.00 0.00 H new ATOM 0 HB2 SER A 28 17.424 6.674 1.797 1.00 0.00 H new ATOM 0 HB3 SER A 28 18.480 7.858 2.541 1.00 0.00 H new ATOM 0 HG SER A 28 16.476 7.624 3.687 1.00 0.00 H new ATOM 380 N LEU A 29 15.668 7.332 -0.222 1.00 0.00 N ATOM 381 CA LEU A 29 14.353 7.182 -0.836 1.00 0.00 C ATOM 382 C LEU A 29 13.248 7.567 0.142 1.00 0.00 C ATOM 383 O LEU A 29 12.388 8.390 -0.170 1.00 0.00 O ATOM 384 CB LEU A 29 14.151 5.741 -1.310 1.00 0.00 C ATOM 385 CG LEU A 29 13.245 5.556 -2.528 1.00 0.00 C ATOM 386 CD1 LEU A 29 13.818 6.283 -3.735 1.00 0.00 C ATOM 387 CD2 LEU A 29 13.058 4.077 -2.834 1.00 0.00 C ATOM 0 H LEU A 29 16.157 6.453 -0.053 1.00 0.00 H new ATOM 0 HA LEU A 29 14.302 7.851 -1.695 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.128 5.315 -1.541 1.00 0.00 H new ATOM 0 HB3 LEU A 29 13.738 5.162 -0.484 1.00 0.00 H new ATOM 0 HG LEU A 29 12.270 5.986 -2.300 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.160 6.140 -4.592 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.900 7.347 -3.514 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.806 5.883 -3.965 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.411 3.964 -3.704 1.00 0.00 H new ATOM 0 HD22 LEU A 29 14.027 3.623 -3.042 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.602 3.583 -1.976 1.00 0.00 H new ATOM 399 N GLY A 30 13.279 6.968 1.329 1.00 0.00 N ATOM 400 CA GLY A 30 12.277 7.263 2.335 1.00 0.00 C ATOM 401 C GLY A 30 10.936 6.630 2.021 1.00 0.00 C ATOM 402 O GLY A 30 9.893 7.270 2.158 1.00 0.00 O ATOM 0 H GLY A 30 13.981 6.284 1.611 1.00 0.00 H new ATOM 0 HA2 GLY A 30 12.625 6.908 3.305 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.155 8.343 2.416 1.00 0.00 H new ATOM 406 N ILE A 31 10.963 5.371 1.597 1.00 0.00 N ATOM 407 CA ILE A 31 9.740 4.652 1.262 1.00 0.00 C ATOM 408 C ILE A 31 9.712 3.277 1.921 1.00 0.00 C ATOM 409 O ILE A 31 10.578 2.439 1.668 1.00 0.00 O ATOM 410 CB ILE A 31 9.586 4.482 -0.261 1.00 0.00 C ATOM 411 CG1 ILE A 31 9.511 5.850 -0.943 1.00 0.00 C ATOM 412 CG2 ILE A 31 8.348 3.657 -0.580 1.00 0.00 C ATOM 413 CD1 ILE A 31 9.613 5.779 -2.451 1.00 0.00 C ATOM 0 H ILE A 31 11.818 4.828 1.477 1.00 0.00 H new ATOM 0 HA ILE A 31 8.910 5.250 1.639 1.00 0.00 H new ATOM 0 HB ILE A 31 10.459 3.953 -0.643 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.571 6.331 -0.673 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.313 6.482 -0.562 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.253 3.546 -1.660 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.438 2.673 -0.121 1.00 0.00 H new ATOM 0 HG23 ILE A 31 7.464 4.161 -0.188 1.00 0.00 H new ATOM 0 HD11 ILE A 31 9.552 6.784 -2.868 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.565 5.327 -2.730 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.795 5.174 -2.843 1.00 0.00 H new ATOM 425 N ARG A 32 8.711 3.051 2.765 1.00 0.00 N ATOM 426 CA ARG A 32 8.570 1.777 3.460 1.00 0.00 C ATOM 427 C ARG A 32 7.724 0.804 2.644 1.00 0.00 C ATOM 428 O ARG A 32 6.683 1.176 2.101 1.00 0.00 O ATOM 429 CB ARG A 32 7.938 1.990 4.836 1.00 0.00 C ATOM 430 CG ARG A 32 8.759 2.884 5.752 1.00 0.00 C ATOM 431 CD ARG A 32 10.027 2.188 6.220 1.00 0.00 C ATOM 432 NE ARG A 32 10.615 2.847 7.384 1.00 0.00 N ATOM 433 CZ ARG A 32 11.783 2.501 7.912 1.00 0.00 C ATOM 434 NH1 ARG A 32 12.486 1.508 7.383 1.00 0.00 N ATOM 435 NH2 ARG A 32 12.252 3.148 8.971 1.00 0.00 N ATOM 0 H ARG A 32 7.985 3.734 2.984 1.00 0.00 H new ATOM 0 HA ARG A 32 9.564 1.349 3.587 1.00 0.00 H new ATOM 0 HB2 ARG A 32 6.948 2.427 4.708 1.00 0.00 H new ATOM 0 HB3 ARG A 32 7.799 1.022 5.317 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.020 3.803 5.227 1.00 0.00 H new ATOM 0 HG3 ARG A 32 8.159 3.170 6.616 1.00 0.00 H new ATOM 0 HD2 ARG A 32 9.801 1.150 6.466 1.00 0.00 H new ATOM 0 HD3 ARG A 32 10.753 2.172 5.407 1.00 0.00 H new ATOM 0 HE ARG A 32 10.100 3.615 7.815 1.00 0.00 H new ATOM 0 HH11 ARG A 32 12.129 1.008 6.568 1.00 0.00 H new ATOM 0 HH12 ARG A 32 13.383 1.244 7.791 1.00 0.00 H new ATOM 0 HH21 ARG A 32 11.715 3.912 9.381 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.149 2.881 9.376 1.00 0.00 H new ATOM 449 N ILE A 33 8.178 -0.442 2.563 1.00 0.00 N ATOM 450 CA ILE A 33 7.462 -1.468 1.815 1.00 0.00 C ATOM 451 C ILE A 33 6.936 -2.558 2.742 1.00 0.00 C ATOM 452 O ILE A 33 7.415 -2.718 3.865 1.00 0.00 O ATOM 453 CB ILE A 33 8.359 -2.111 0.741 1.00 0.00 C ATOM 454 CG1 ILE A 33 9.598 -2.734 1.388 1.00 0.00 C ATOM 455 CG2 ILE A 33 8.761 -1.079 -0.301 1.00 0.00 C ATOM 456 CD1 ILE A 33 10.143 -3.923 0.628 1.00 0.00 C ATOM 0 H ILE A 33 9.038 -0.765 3.006 1.00 0.00 H new ATOM 0 HA ILE A 33 6.622 -0.974 1.327 1.00 0.00 H new ATOM 0 HB ILE A 33 7.796 -2.900 0.243 1.00 0.00 H new ATOM 0 HG12 ILE A 33 10.377 -1.976 1.467 1.00 0.00 H new ATOM 0 HG13 ILE A 33 9.351 -3.044 2.403 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.395 -1.549 -1.053 1.00 0.00 H new ATOM 0 HG22 ILE A 33 7.867 -0.677 -0.779 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.309 -0.270 0.181 1.00 0.00 H new ATOM 0 HD11 ILE A 33 11.020 -4.314 1.144 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.380 -4.699 0.571 1.00 0.00 H new ATOM 0 HD13 ILE A 33 10.422 -3.614 -0.379 1.00 0.00 H new ATOM 468 N VAL A 34 5.948 -3.309 2.264 1.00 0.00 N ATOM 469 CA VAL A 34 5.359 -4.387 3.049 1.00 0.00 C ATOM 470 C VAL A 34 5.210 -5.655 2.215 1.00 0.00 C ATOM 471 O VAL A 34 4.878 -5.597 1.032 1.00 0.00 O ATOM 472 CB VAL A 34 3.979 -3.987 3.605 1.00 0.00 C ATOM 473 CG1 VAL A 34 2.920 -4.069 2.517 1.00 0.00 C ATOM 474 CG2 VAL A 34 3.608 -4.865 4.790 1.00 0.00 C ATOM 0 H VAL A 34 5.539 -3.190 1.337 1.00 0.00 H new ATOM 0 HA VAL A 34 6.036 -4.580 3.881 1.00 0.00 H new ATOM 0 HB VAL A 34 4.031 -2.954 3.950 1.00 0.00 H new ATOM 0 HG11 VAL A 34 1.952 -3.783 2.929 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.182 -3.393 1.703 1.00 0.00 H new ATOM 0 HG13 VAL A 34 2.866 -5.090 2.138 1.00 0.00 H new ATOM 0 HG21 VAL A 34 2.630 -4.569 5.170 1.00 0.00 H new ATOM 0 HG22 VAL A 34 3.574 -5.908 4.474 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.354 -4.749 5.576 1.00 0.00 H new ATOM 484 N GLY A 35 5.457 -6.801 2.842 1.00 0.00 N ATOM 485 CA GLY A 35 5.345 -8.068 2.143 1.00 0.00 C ATOM 486 C GLY A 35 4.081 -8.821 2.508 1.00 0.00 C ATOM 487 O GLY A 35 3.950 -9.324 3.624 1.00 0.00 O ATOM 0 H GLY A 35 5.733 -6.875 3.821 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.360 -7.889 1.068 1.00 0.00 H new ATOM 0 HA3 GLY A 35 6.212 -8.686 2.376 1.00 0.00 H new ATOM 491 N TYR A 36 3.148 -8.898 1.566 1.00 0.00 N ATOM 492 CA TYR A 36 1.886 -9.592 1.795 1.00 0.00 C ATOM 493 C TYR A 36 1.913 -10.989 1.182 1.00 0.00 C ATOM 494 O TYR A 36 2.550 -11.216 0.154 1.00 0.00 O ATOM 495 CB TYR A 36 0.724 -8.788 1.208 1.00 0.00 C ATOM 496 CG TYR A 36 0.045 -7.885 2.212 1.00 0.00 C ATOM 497 CD1 TYR A 36 0.482 -6.580 2.409 1.00 0.00 C ATOM 498 CD2 TYR A 36 -1.032 -8.335 2.965 1.00 0.00 C ATOM 499 CE1 TYR A 36 -0.135 -5.751 3.326 1.00 0.00 C ATOM 500 CE2 TYR A 36 -1.656 -7.512 3.883 1.00 0.00 C ATOM 501 CZ TYR A 36 -1.204 -6.221 4.060 1.00 0.00 C ATOM 502 OH TYR A 36 -1.822 -5.399 4.974 1.00 0.00 O ATOM 0 H TYR A 36 3.242 -8.488 0.637 1.00 0.00 H new ATOM 0 HA TYR A 36 1.745 -9.690 2.871 1.00 0.00 H new ATOM 0 HB2 TYR A 36 1.093 -8.183 0.380 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -0.013 -9.478 0.796 1.00 0.00 H new ATOM 0 HD1 TYR A 36 1.318 -6.208 1.835 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -1.388 -9.346 2.831 1.00 0.00 H new ATOM 0 HE1 TYR A 36 0.218 -4.740 3.467 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -2.493 -7.878 4.459 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.557 -5.883 5.405 1.00 0.00 H new ATOM 512 N VAL A 37 1.216 -11.922 1.822 1.00 0.00 N ATOM 513 CA VAL A 37 1.158 -13.297 1.341 1.00 0.00 C ATOM 514 C VAL A 37 -0.276 -13.708 1.022 1.00 0.00 C ATOM 515 O VAL A 37 -0.512 -14.573 0.180 1.00 0.00 O ATOM 516 CB VAL A 37 1.743 -14.279 2.373 1.00 0.00 C ATOM 517 CG1 VAL A 37 1.611 -15.712 1.883 1.00 0.00 C ATOM 518 CG2 VAL A 37 3.197 -13.939 2.666 1.00 0.00 C ATOM 0 H VAL A 37 0.684 -11.751 2.675 1.00 0.00 H new ATOM 0 HA VAL A 37 1.757 -13.338 0.431 1.00 0.00 H new ATOM 0 HB VAL A 37 1.177 -14.185 3.300 1.00 0.00 H new ATOM 0 HG11 VAL A 37 2.030 -16.391 2.626 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.558 -15.948 1.729 1.00 0.00 H new ATOM 0 HG13 VAL A 37 2.150 -15.826 0.943 1.00 0.00 H new ATOM 0 HG21 VAL A 37 3.595 -14.643 3.397 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.778 -14.004 1.746 1.00 0.00 H new ATOM 0 HG23 VAL A 37 3.261 -12.927 3.065 1.00 0.00 H new ATOM 528 N GLY A 38 -1.230 -13.079 1.701 1.00 0.00 N ATOM 529 CA GLY A 38 -2.629 -13.392 1.476 1.00 0.00 C ATOM 530 C GLY A 38 -2.961 -14.835 1.803 1.00 0.00 C ATOM 531 O GLY A 38 -3.138 -15.659 0.904 1.00 0.00 O ATOM 0 H GLY A 38 -1.059 -12.359 2.403 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.248 -12.733 2.085 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -2.880 -13.192 0.434 1.00 0.00 H new ATOM 535 N THR A 39 -3.044 -15.144 3.093 1.00 0.00 N ATOM 536 CA THR A 39 -3.353 -16.497 3.536 1.00 0.00 C ATOM 537 C THR A 39 -4.710 -16.952 3.011 1.00 0.00 C ATOM 538 O THR A 39 -5.418 -16.190 2.353 1.00 0.00 O ATOM 539 CB THR A 39 -3.350 -16.600 5.073 1.00 0.00 C ATOM 540 OG1 THR A 39 -3.347 -17.975 5.473 1.00 0.00 O ATOM 541 CG2 THR A 39 -4.562 -15.897 5.665 1.00 0.00 C ATOM 0 H THR A 39 -2.901 -14.475 3.849 1.00 0.00 H new ATOM 0 HA THR A 39 -2.575 -17.146 3.134 1.00 0.00 H new ATOM 0 HB THR A 39 -2.449 -16.112 5.445 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.343 -18.031 6.451 1.00 0.00 H new ATOM 0 HG21 THR A 39 -4.538 -15.983 6.751 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.545 -14.844 5.384 1.00 0.00 H new ATOM 0 HG23 THR A 39 -5.473 -16.359 5.284 1.00 0.00 H new ATOM 549 N SER A 40 -5.067 -18.198 3.306 1.00 0.00 N ATOM 550 CA SER A 40 -6.338 -18.754 2.860 1.00 0.00 C ATOM 551 C SER A 40 -7.451 -18.429 3.852 1.00 0.00 C ATOM 552 O SER A 40 -7.194 -18.164 5.027 1.00 0.00 O ATOM 553 CB SER A 40 -6.223 -20.270 2.685 1.00 0.00 C ATOM 554 OG SER A 40 -7.150 -20.745 1.725 1.00 0.00 O ATOM 0 H SER A 40 -4.494 -18.841 3.852 1.00 0.00 H new ATOM 0 HA SER A 40 -6.587 -18.302 1.900 1.00 0.00 H new ATOM 0 HB2 SER A 40 -5.210 -20.527 2.375 1.00 0.00 H new ATOM 0 HB3 SER A 40 -6.399 -20.764 3.641 1.00 0.00 H new ATOM 0 HG SER A 40 -7.055 -21.716 1.631 1.00 0.00 H new ATOM 560 N HIS A 41 -8.690 -18.451 3.370 1.00 0.00 N ATOM 561 CA HIS A 41 -9.844 -18.159 4.213 1.00 0.00 C ATOM 562 C HIS A 41 -9.777 -16.733 4.750 1.00 0.00 C ATOM 563 O HIS A 41 -10.189 -16.463 5.879 1.00 0.00 O ATOM 564 CB HIS A 41 -9.918 -19.151 5.374 1.00 0.00 C ATOM 565 CG HIS A 41 -11.308 -19.376 5.882 1.00 0.00 C ATOM 566 ND1 HIS A 41 -12.080 -20.456 5.511 1.00 0.00 N ATOM 567 CD2 HIS A 41 -12.065 -18.652 6.740 1.00 0.00 C ATOM 568 CE1 HIS A 41 -13.252 -20.386 6.117 1.00 0.00 C ATOM 569 NE2 HIS A 41 -13.268 -19.301 6.869 1.00 0.00 N ATOM 0 H HIS A 41 -8.920 -18.668 2.400 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.742 -18.257 3.604 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -9.498 -20.105 5.053 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.296 -18.788 6.192 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -11.776 -17.735 7.231 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -14.060 -21.096 6.015 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -14.047 -18.995 7.451 1.00 0.00 H new ATOM 578 N THR A 42 -9.253 -15.822 3.935 1.00 0.00 N ATOM 579 CA THR A 42 -9.130 -14.424 4.329 1.00 0.00 C ATOM 580 C THR A 42 -9.223 -13.502 3.119 1.00 0.00 C ATOM 581 O THR A 42 -8.933 -13.907 1.994 1.00 0.00 O ATOM 582 CB THR A 42 -7.800 -14.162 5.061 1.00 0.00 C ATOM 583 OG1 THR A 42 -6.706 -14.654 4.279 1.00 0.00 O ATOM 584 CG2 THR A 42 -7.794 -14.828 6.428 1.00 0.00 C ATOM 0 H THR A 42 -8.907 -16.028 2.998 1.00 0.00 H new ATOM 0 HA THR A 42 -9.957 -14.212 5.007 1.00 0.00 H new ATOM 0 HB THR A 42 -7.692 -13.086 5.199 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.101 -13.914 4.061 1.00 0.00 H new ATOM 0 HG21 THR A 42 -6.845 -14.629 6.926 1.00 0.00 H new ATOM 0 HG22 THR A 42 -8.610 -14.429 7.031 1.00 0.00 H new ATOM 0 HG23 THR A 42 -7.923 -15.904 6.309 1.00 0.00 H new ATOM 592 N GLY A 43 -9.628 -12.258 3.358 1.00 0.00 N ATOM 593 CA GLY A 43 -9.750 -11.297 2.278 1.00 0.00 C ATOM 594 C GLY A 43 -8.549 -10.378 2.181 1.00 0.00 C ATOM 595 O GLY A 43 -8.689 -9.193 1.878 1.00 0.00 O ATOM 0 H GLY A 43 -9.874 -11.899 4.281 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -9.874 -11.829 1.335 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -10.649 -10.700 2.427 1.00 0.00 H new ATOM 599 N GLU A 44 -7.365 -10.924 2.440 1.00 0.00 N ATOM 600 CA GLU A 44 -6.135 -10.142 2.383 1.00 0.00 C ATOM 601 C GLU A 44 -5.616 -10.049 0.951 1.00 0.00 C ATOM 602 O GLU A 44 -6.205 -10.612 0.028 1.00 0.00 O ATOM 603 CB GLU A 44 -5.067 -10.765 3.284 1.00 0.00 C ATOM 604 CG GLU A 44 -5.470 -10.834 4.747 1.00 0.00 C ATOM 605 CD GLU A 44 -5.490 -9.472 5.413 1.00 0.00 C ATOM 606 OE1 GLU A 44 -4.459 -8.769 5.358 1.00 0.00 O ATOM 607 OE2 GLU A 44 -6.537 -9.108 5.988 1.00 0.00 O ATOM 0 H GLU A 44 -7.231 -11.904 2.691 1.00 0.00 H new ATOM 0 HA GLU A 44 -6.357 -9.135 2.737 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -4.846 -11.772 2.929 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.147 -10.187 3.196 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -6.458 -11.287 4.827 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -4.777 -11.485 5.280 1.00 0.00 H new ATOM 614 N ALA A 45 -4.511 -9.333 0.774 1.00 0.00 N ATOM 615 CA ALA A 45 -3.911 -9.167 -0.545 1.00 0.00 C ATOM 616 C ALA A 45 -2.549 -9.849 -0.619 1.00 0.00 C ATOM 617 O ALA A 45 -2.126 -10.514 0.326 1.00 0.00 O ATOM 618 CB ALA A 45 -3.782 -7.689 -0.883 1.00 0.00 C ATOM 0 H ALA A 45 -4.013 -8.858 1.527 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.565 -9.641 -1.277 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.333 -7.579 -1.870 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.770 -7.228 -0.881 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -3.151 -7.200 -0.141 1.00 0.00 H new ATOM 624 N SER A 46 -1.869 -9.680 -1.748 1.00 0.00 N ATOM 625 CA SER A 46 -0.556 -10.284 -1.946 1.00 0.00 C ATOM 626 C SER A 46 0.309 -9.415 -2.854 1.00 0.00 C ATOM 627 O SER A 46 -0.063 -9.118 -3.988 1.00 0.00 O ATOM 628 CB SER A 46 -0.701 -11.683 -2.548 1.00 0.00 C ATOM 629 OG SER A 46 -1.106 -11.616 -3.904 1.00 0.00 O ATOM 0 H SER A 46 -2.205 -9.131 -2.539 1.00 0.00 H new ATOM 0 HA SER A 46 -0.068 -10.363 -0.974 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.248 -12.214 -2.475 1.00 0.00 H new ATOM 0 HB3 SER A 46 -1.431 -12.255 -1.975 1.00 0.00 H new ATOM 0 HG SER A 46 -0.813 -10.765 -4.291 1.00 0.00 H new ATOM 635 N GLY A 47 1.469 -9.010 -2.345 1.00 0.00 N ATOM 636 CA GLY A 47 2.371 -8.179 -3.121 1.00 0.00 C ATOM 637 C GLY A 47 3.041 -7.109 -2.282 1.00 0.00 C ATOM 638 O GLY A 47 2.820 -7.030 -1.073 1.00 0.00 O ATOM 0 H GLY A 47 1.800 -9.243 -1.409 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.134 -8.807 -3.580 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.817 -7.706 -3.932 1.00 0.00 H new ATOM 642 N ILE A 48 3.862 -6.285 -2.923 1.00 0.00 N ATOM 643 CA ILE A 48 4.567 -5.215 -2.228 1.00 0.00 C ATOM 644 C ILE A 48 3.745 -3.930 -2.220 1.00 0.00 C ATOM 645 O ILE A 48 3.366 -3.417 -3.273 1.00 0.00 O ATOM 646 CB ILE A 48 5.937 -4.931 -2.872 1.00 0.00 C ATOM 647 CG1 ILE A 48 6.813 -6.185 -2.832 1.00 0.00 C ATOM 648 CG2 ILE A 48 6.625 -3.775 -2.163 1.00 0.00 C ATOM 649 CD1 ILE A 48 6.949 -6.784 -1.450 1.00 0.00 C ATOM 0 H ILE A 48 4.056 -6.338 -3.923 1.00 0.00 H new ATOM 0 HA ILE A 48 4.720 -5.552 -1.203 1.00 0.00 H new ATOM 0 HB ILE A 48 5.782 -4.652 -3.914 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.393 -6.933 -3.504 1.00 0.00 H new ATOM 0 HG13 ILE A 48 7.805 -5.938 -3.211 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.592 -3.586 -2.629 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.005 -2.882 -2.238 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.772 -4.028 -1.113 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.583 -7.669 -1.498 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.398 -6.052 -0.779 1.00 0.00 H new ATOM 0 HD13 ILE A 48 5.964 -7.063 -1.076 1.00 0.00 H new ATOM 661 N TYR A 49 3.476 -3.414 -1.026 1.00 0.00 N ATOM 662 CA TYR A 49 2.699 -2.189 -0.880 1.00 0.00 C ATOM 663 C TYR A 49 3.441 -1.173 -0.017 1.00 0.00 C ATOM 664 O TYR A 49 4.220 -1.539 0.862 1.00 0.00 O ATOM 665 CB TYR A 49 1.333 -2.497 -0.264 1.00 0.00 C ATOM 666 CG TYR A 49 0.469 -3.392 -1.124 1.00 0.00 C ATOM 667 CD1 TYR A 49 0.648 -4.770 -1.124 1.00 0.00 C ATOM 668 CD2 TYR A 49 -0.525 -2.861 -1.936 1.00 0.00 C ATOM 669 CE1 TYR A 49 -0.138 -5.592 -1.908 1.00 0.00 C ATOM 670 CE2 TYR A 49 -1.317 -3.675 -2.722 1.00 0.00 C ATOM 671 CZ TYR A 49 -1.120 -5.040 -2.704 1.00 0.00 C ATOM 672 OH TYR A 49 -1.905 -5.855 -3.487 1.00 0.00 O ATOM 0 H TYR A 49 3.785 -3.825 -0.145 1.00 0.00 H new ATOM 0 HA TYR A 49 2.555 -1.760 -1.872 1.00 0.00 H new ATOM 0 HB2 TYR A 49 1.480 -2.971 0.706 1.00 0.00 H new ATOM 0 HB3 TYR A 49 0.805 -1.560 -0.084 1.00 0.00 H new ATOM 0 HD1 TYR A 49 1.415 -5.206 -0.500 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.681 -1.793 -1.953 1.00 0.00 H new ATOM 0 HE1 TYR A 49 0.016 -6.661 -1.898 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.086 -3.245 -3.347 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.548 -5.309 -3.985 1.00 0.00 H new ATOM 682 N VAL A 50 3.192 0.107 -0.276 1.00 0.00 N ATOM 683 CA VAL A 50 3.834 1.178 0.477 1.00 0.00 C ATOM 684 C VAL A 50 3.271 1.270 1.891 1.00 0.00 C ATOM 685 O VAL A 50 2.239 1.899 2.120 1.00 0.00 O ATOM 686 CB VAL A 50 3.659 2.539 -0.223 1.00 0.00 C ATOM 687 CG1 VAL A 50 4.252 3.655 0.623 1.00 0.00 C ATOM 688 CG2 VAL A 50 4.293 2.512 -1.606 1.00 0.00 C ATOM 0 H VAL A 50 2.550 0.427 -1.001 1.00 0.00 H new ATOM 0 HA VAL A 50 4.896 0.937 0.527 1.00 0.00 H new ATOM 0 HB VAL A 50 2.593 2.733 -0.341 1.00 0.00 H new ATOM 0 HG11 VAL A 50 4.119 4.609 0.112 1.00 0.00 H new ATOM 0 HG12 VAL A 50 3.747 3.687 1.589 1.00 0.00 H new ATOM 0 HG13 VAL A 50 5.315 3.470 0.775 1.00 0.00 H new ATOM 0 HG21 VAL A 50 4.160 3.481 -2.086 1.00 0.00 H new ATOM 0 HG22 VAL A 50 5.357 2.295 -1.514 1.00 0.00 H new ATOM 0 HG23 VAL A 50 3.816 1.740 -2.210 1.00 0.00 H new ATOM 698 N LYS A 51 3.958 0.637 2.836 1.00 0.00 N ATOM 699 CA LYS A 51 3.529 0.648 4.230 1.00 0.00 C ATOM 700 C LYS A 51 3.441 2.075 4.761 1.00 0.00 C ATOM 701 O LYS A 51 2.466 2.444 5.417 1.00 0.00 O ATOM 702 CB LYS A 51 4.497 -0.169 5.089 1.00 0.00 C ATOM 703 CG LYS A 51 4.109 -0.225 6.556 1.00 0.00 C ATOM 704 CD LYS A 51 2.918 -1.142 6.783 1.00 0.00 C ATOM 705 CE LYS A 51 2.843 -1.611 8.228 1.00 0.00 C ATOM 706 NZ LYS A 51 1.440 -1.867 8.657 1.00 0.00 N ATOM 0 H LYS A 51 4.814 0.110 2.662 1.00 0.00 H new ATOM 0 HA LYS A 51 2.538 0.198 4.283 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.549 -1.185 4.697 1.00 0.00 H new ATOM 0 HB3 LYS A 51 5.496 0.258 5.002 1.00 0.00 H new ATOM 0 HG2 LYS A 51 4.957 -0.576 7.144 1.00 0.00 H new ATOM 0 HG3 LYS A 51 3.869 0.778 6.909 1.00 0.00 H new ATOM 0 HD2 LYS A 51 1.999 -0.618 6.521 1.00 0.00 H new ATOM 0 HD3 LYS A 51 2.991 -2.006 6.122 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.430 -2.522 8.345 1.00 0.00 H new ATOM 0 HE3 LYS A 51 3.290 -0.858 8.878 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 1.432 -2.185 9.647 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 0.885 -0.992 8.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.021 -2.604 8.054 1.00 0.00 H new ATOM 720 N SER A 52 4.463 2.873 4.473 1.00 0.00 N ATOM 721 CA SER A 52 4.502 4.259 4.924 1.00 0.00 C ATOM 722 C SER A 52 5.468 5.080 4.075 1.00 0.00 C ATOM 723 O SER A 52 6.104 4.559 3.159 1.00 0.00 O ATOM 724 CB SER A 52 4.914 4.328 6.396 1.00 0.00 C ATOM 725 OG SER A 52 3.809 4.082 7.247 1.00 0.00 O ATOM 0 H SER A 52 5.276 2.584 3.929 1.00 0.00 H new ATOM 0 HA SER A 52 3.502 4.679 4.814 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.698 3.596 6.592 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.333 5.310 6.614 1.00 0.00 H new ATOM 0 HG SER A 52 3.106 3.620 6.745 1.00 0.00 H new ATOM 731 N VAL A 53 5.571 6.369 4.386 1.00 0.00 N ATOM 732 CA VAL A 53 6.459 7.263 3.653 1.00 0.00 C ATOM 733 C VAL A 53 7.216 8.185 4.602 1.00 0.00 C ATOM 734 O VAL A 53 6.631 9.081 5.212 1.00 0.00 O ATOM 735 CB VAL A 53 5.680 8.119 2.637 1.00 0.00 C ATOM 736 CG1 VAL A 53 6.626 9.026 1.866 1.00 0.00 C ATOM 737 CG2 VAL A 53 4.889 7.231 1.688 1.00 0.00 C ATOM 0 H VAL A 53 5.050 6.817 5.140 1.00 0.00 H new ATOM 0 HA VAL A 53 7.170 6.634 3.118 1.00 0.00 H new ATOM 0 HB VAL A 53 4.976 8.748 3.182 1.00 0.00 H new ATOM 0 HG11 VAL A 53 6.057 9.623 1.153 1.00 0.00 H new ATOM 0 HG12 VAL A 53 7.144 9.687 2.561 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.356 8.419 1.330 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.345 7.852 0.977 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.573 6.576 1.148 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.182 6.628 2.258 1.00 0.00 H new ATOM 747 N ILE A 54 8.520 7.959 4.723 1.00 0.00 N ATOM 748 CA ILE A 54 9.358 8.770 5.597 1.00 0.00 C ATOM 749 C ILE A 54 9.331 10.236 5.178 1.00 0.00 C ATOM 750 O ILE A 54 9.562 10.581 4.019 1.00 0.00 O ATOM 751 CB ILE A 54 10.816 8.275 5.598 1.00 0.00 C ATOM 752 CG1 ILE A 54 10.930 6.957 6.367 1.00 0.00 C ATOM 753 CG2 ILE A 54 11.733 9.328 6.202 1.00 0.00 C ATOM 754 CD1 ILE A 54 10.568 5.743 5.542 1.00 0.00 C ATOM 0 H ILE A 54 9.019 7.221 4.227 1.00 0.00 H new ATOM 0 HA ILE A 54 8.950 8.674 6.603 1.00 0.00 H new ATOM 0 HB ILE A 54 11.125 8.100 4.567 1.00 0.00 H new ATOM 0 HG12 ILE A 54 11.951 6.846 6.733 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.281 6.999 7.242 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.760 8.963 6.196 1.00 0.00 H new ATOM 0 HG22 ILE A 54 11.670 10.245 5.616 1.00 0.00 H new ATOM 0 HG23 ILE A 54 11.427 9.532 7.228 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.672 4.845 6.151 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.538 5.831 5.198 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.234 5.676 4.681 1.00 0.00 H new ATOM 766 N PRO A 55 9.044 11.122 6.144 1.00 0.00 N ATOM 767 CA PRO A 55 8.983 12.566 5.900 1.00 0.00 C ATOM 768 C PRO A 55 10.357 13.166 5.622 1.00 0.00 C ATOM 769 O PRO A 55 11.368 12.691 6.137 1.00 0.00 O ATOM 770 CB PRO A 55 8.411 13.122 7.207 1.00 0.00 C ATOM 771 CG PRO A 55 8.782 12.116 8.241 1.00 0.00 C ATOM 772 CD PRO A 55 8.759 10.782 7.548 1.00 0.00 C ATOM 0 HA PRO A 55 8.386 12.806 5.021 1.00 0.00 H new ATOM 0 HB2 PRO A 55 8.831 14.101 7.438 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.330 13.246 7.145 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.770 12.325 8.652 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.079 12.135 9.074 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.508 10.104 7.957 1.00 0.00 H new ATOM 0 HD3 PRO A 55 7.792 10.291 7.654 1.00 0.00 H new ATOM 780 N GLY A 56 10.385 14.215 4.805 1.00 0.00 N ATOM 781 CA GLY A 56 11.641 14.863 4.474 1.00 0.00 C ATOM 782 C GLY A 56 12.511 14.013 3.570 1.00 0.00 C ATOM 783 O GLY A 56 13.738 14.107 3.609 1.00 0.00 O ATOM 0 H GLY A 56 9.561 14.627 4.367 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.437 15.816 3.986 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.185 15.085 5.392 1.00 0.00 H new ATOM 787 N SER A 57 11.876 13.178 2.753 1.00 0.00 N ATOM 788 CA SER A 57 12.600 12.303 1.839 1.00 0.00 C ATOM 789 C SER A 57 12.176 12.554 0.396 1.00 0.00 C ATOM 790 O SER A 57 11.257 13.330 0.133 1.00 0.00 O ATOM 791 CB SER A 57 12.361 10.837 2.205 1.00 0.00 C ATOM 792 OG SER A 57 11.182 10.344 1.592 1.00 0.00 O ATOM 0 H SER A 57 10.861 13.089 2.706 1.00 0.00 H new ATOM 0 HA SER A 57 13.663 12.524 1.931 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.215 10.237 1.892 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.281 10.738 3.287 1.00 0.00 H new ATOM 0 HG SER A 57 11.417 9.650 0.942 1.00 0.00 H new ATOM 798 N ALA A 58 12.852 11.892 -0.537 1.00 0.00 N ATOM 799 CA ALA A 58 12.545 12.041 -1.954 1.00 0.00 C ATOM 800 C ALA A 58 11.063 11.803 -2.223 1.00 0.00 C ATOM 801 O ALA A 58 10.380 12.657 -2.788 1.00 0.00 O ATOM 802 CB ALA A 58 13.393 11.087 -2.782 1.00 0.00 C ATOM 0 H ALA A 58 13.616 11.247 -0.337 1.00 0.00 H new ATOM 0 HA ALA A 58 12.781 13.065 -2.245 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.153 11.210 -3.838 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.449 11.306 -2.622 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.186 10.060 -2.480 1.00 0.00 H new ATOM 808 N ALA A 59 10.572 10.638 -1.814 1.00 0.00 N ATOM 809 CA ALA A 59 9.170 10.289 -2.009 1.00 0.00 C ATOM 810 C ALA A 59 8.252 11.382 -1.474 1.00 0.00 C ATOM 811 O ALA A 59 7.411 11.912 -2.201 1.00 0.00 O ATOM 812 CB ALA A 59 8.859 8.960 -1.337 1.00 0.00 C ATOM 0 H ALA A 59 11.124 9.920 -1.346 1.00 0.00 H new ATOM 0 HA ALA A 59 8.991 10.193 -3.080 1.00 0.00 H new ATOM 0 HB1 ALA A 59 7.809 8.712 -1.490 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.484 8.179 -1.770 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.061 9.036 -0.269 1.00 0.00 H new ATOM 818 N TYR A 60 8.418 11.715 -0.199 1.00 0.00 N ATOM 819 CA TYR A 60 7.602 12.744 0.435 1.00 0.00 C ATOM 820 C TYR A 60 7.657 14.048 -0.356 1.00 0.00 C ATOM 821 O TYR A 60 6.624 14.629 -0.690 1.00 0.00 O ATOM 822 CB TYR A 60 8.072 12.985 1.870 1.00 0.00 C ATOM 823 CG TYR A 60 7.242 14.007 2.615 1.00 0.00 C ATOM 824 CD1 TYR A 60 6.049 13.647 3.229 1.00 0.00 C ATOM 825 CD2 TYR A 60 7.653 15.331 2.707 1.00 0.00 C ATOM 826 CE1 TYR A 60 5.287 14.577 3.910 1.00 0.00 C ATOM 827 CE2 TYR A 60 6.899 16.267 3.387 1.00 0.00 C ATOM 828 CZ TYR A 60 5.717 15.886 3.987 1.00 0.00 C ATOM 829 OH TYR A 60 4.962 16.815 4.665 1.00 0.00 O ATOM 0 H TYR A 60 9.110 11.287 0.416 1.00 0.00 H new ATOM 0 HA TYR A 60 6.570 12.394 0.452 1.00 0.00 H new ATOM 0 HB2 TYR A 60 8.047 12.041 2.415 1.00 0.00 H new ATOM 0 HB3 TYR A 60 9.111 13.315 1.853 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.711 12.623 3.173 1.00 0.00 H new ATOM 0 HD2 TYR A 60 8.578 15.633 2.239 1.00 0.00 H new ATOM 0 HE1 TYR A 60 4.360 14.281 4.379 1.00 0.00 H new ATOM 0 HE2 TYR A 60 7.233 17.292 3.449 1.00 0.00 H new ATOM 0 HH TYR A 60 5.405 17.688 4.626 1.00 0.00 H new ATOM 839 N HIS A 61 8.871 14.501 -0.653 1.00 0.00 N ATOM 840 CA HIS A 61 9.063 15.735 -1.406 1.00 0.00 C ATOM 841 C HIS A 61 8.314 15.683 -2.735 1.00 0.00 C ATOM 842 O HIS A 61 7.509 16.562 -3.039 1.00 0.00 O ATOM 843 CB HIS A 61 10.552 15.978 -1.656 1.00 0.00 C ATOM 844 CG HIS A 61 11.340 16.204 -0.403 1.00 0.00 C ATOM 845 ND1 HIS A 61 10.964 17.105 0.571 1.00 0.00 N ATOM 846 CD2 HIS A 61 12.489 15.638 0.034 1.00 0.00 C ATOM 847 CE1 HIS A 61 11.849 17.085 1.552 1.00 0.00 C ATOM 848 NE2 HIS A 61 12.785 16.202 1.251 1.00 0.00 N ATOM 0 H HIS A 61 9.736 14.032 -0.384 1.00 0.00 H new ATOM 0 HA HIS A 61 8.662 16.558 -0.815 1.00 0.00 H new ATOM 0 HB2 HIS A 61 10.967 15.122 -2.187 1.00 0.00 H new ATOM 0 HB3 HIS A 61 10.666 16.844 -2.308 1.00 0.00 H new ATOM 0 HD2 HIS A 61 13.066 14.883 -0.479 1.00 0.00 H new ATOM 0 HE1 HIS A 61 11.813 17.688 2.447 1.00 0.00 H new ATOM 0 HE2 HIS A 61 13.595 15.976 1.828 1.00 0.00 H new ATOM 857 N ASN A 62 8.587 14.647 -3.522 1.00 0.00 N ATOM 858 CA ASN A 62 7.939 14.481 -4.818 1.00 0.00 C ATOM 859 C ASN A 62 6.425 14.619 -4.692 1.00 0.00 C ATOM 860 O ASN A 62 5.803 15.417 -5.392 1.00 0.00 O ATOM 861 CB ASN A 62 8.291 13.118 -5.416 1.00 0.00 C ATOM 862 CG ASN A 62 8.311 13.139 -6.933 1.00 0.00 C ATOM 863 OD1 ASN A 62 8.818 14.079 -7.545 1.00 0.00 O ATOM 864 ND2 ASN A 62 7.756 12.100 -7.546 1.00 0.00 N ATOM 0 H ASN A 62 9.252 13.911 -3.285 1.00 0.00 H new ATOM 0 HA ASN A 62 8.302 15.266 -5.481 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.267 12.804 -5.047 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.568 12.377 -5.075 1.00 0.00 H new ATOM 0 HD21 ASN A 62 7.738 12.059 -8.565 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.347 11.343 -6.998 1.00 0.00 H new ATOM 871 N GLY A 63 5.838 13.835 -3.793 1.00 0.00 N ATOM 872 CA GLY A 63 4.402 13.885 -3.590 1.00 0.00 C ATOM 873 C GLY A 63 3.644 13.052 -4.604 1.00 0.00 C ATOM 874 O GLY A 63 2.505 13.367 -4.952 1.00 0.00 O ATOM 0 H GLY A 63 6.331 13.166 -3.202 1.00 0.00 H new ATOM 0 HA2 GLY A 63 4.168 13.531 -2.586 1.00 0.00 H new ATOM 0 HA3 GLY A 63 4.065 14.920 -3.650 1.00 0.00 H new ATOM 878 N HIS A 64 4.277 11.986 -5.083 1.00 0.00 N ATOM 879 CA HIS A 64 3.655 11.105 -6.065 1.00 0.00 C ATOM 880 C HIS A 64 3.443 9.709 -5.486 1.00 0.00 C ATOM 881 O HIS A 64 2.410 9.081 -5.719 1.00 0.00 O ATOM 882 CB HIS A 64 4.518 11.021 -7.325 1.00 0.00 C ATOM 883 CG HIS A 64 4.466 12.257 -8.169 1.00 0.00 C ATOM 884 ND1 HIS A 64 4.603 12.238 -9.541 1.00 0.00 N ATOM 885 CD2 HIS A 64 4.290 13.555 -7.828 1.00 0.00 C ATOM 886 CE1 HIS A 64 4.515 13.471 -10.007 1.00 0.00 C ATOM 887 NE2 HIS A 64 4.325 14.290 -8.988 1.00 0.00 N ATOM 0 H HIS A 64 5.220 11.711 -4.807 1.00 0.00 H new ATOM 0 HA HIS A 64 2.683 11.522 -6.326 1.00 0.00 H new ATOM 0 HB2 HIS A 64 5.552 10.832 -7.036 1.00 0.00 H new ATOM 0 HB3 HIS A 64 4.193 10.169 -7.922 1.00 0.00 H new ATOM 0 HD2 HIS A 64 4.148 13.941 -6.829 1.00 0.00 H new ATOM 0 HE1 HIS A 64 4.586 13.760 -11.045 1.00 0.00 H new ATOM 0 HE2 HIS A 64 4.221 15.303 -9.052 1.00 0.00 H new ATOM 896 N ILE A 65 4.428 9.230 -4.733 1.00 0.00 N ATOM 897 CA ILE A 65 4.348 7.910 -4.121 1.00 0.00 C ATOM 898 C ILE A 65 3.891 8.003 -2.670 1.00 0.00 C ATOM 899 O ILE A 65 4.520 8.676 -1.853 1.00 0.00 O ATOM 900 CB ILE A 65 5.704 7.182 -4.175 1.00 0.00 C ATOM 901 CG1 ILE A 65 6.165 7.023 -5.625 1.00 0.00 C ATOM 902 CG2 ILE A 65 5.604 5.826 -3.493 1.00 0.00 C ATOM 903 CD1 ILE A 65 7.669 7.010 -5.783 1.00 0.00 C ATOM 0 H ILE A 65 5.290 9.737 -4.532 1.00 0.00 H new ATOM 0 HA ILE A 65 3.616 7.341 -4.694 1.00 0.00 H new ATOM 0 HB ILE A 65 6.443 7.781 -3.643 1.00 0.00 H new ATOM 0 HG12 ILE A 65 5.758 6.096 -6.028 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.752 7.837 -6.220 1.00 0.00 H new ATOM 0 HG21 ILE A 65 6.570 5.323 -3.539 1.00 0.00 H new ATOM 0 HG22 ILE A 65 5.316 5.963 -2.451 1.00 0.00 H new ATOM 0 HG23 ILE A 65 4.854 5.218 -4.000 1.00 0.00 H new ATOM 0 HD11 ILE A 65 7.923 6.894 -6.837 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.082 7.948 -5.411 1.00 0.00 H new ATOM 0 HD13 ILE A 65 8.087 6.179 -5.215 1.00 0.00 H new ATOM 915 N GLN A 66 2.793 7.323 -2.356 1.00 0.00 N ATOM 916 CA GLN A 66 2.253 7.328 -1.002 1.00 0.00 C ATOM 917 C GLN A 66 1.665 5.967 -0.644 1.00 0.00 C ATOM 918 O GLN A 66 1.501 5.104 -1.507 1.00 0.00 O ATOM 919 CB GLN A 66 1.182 8.412 -0.861 1.00 0.00 C ATOM 920 CG GLN A 66 1.614 9.766 -1.400 1.00 0.00 C ATOM 921 CD GLN A 66 1.270 9.948 -2.865 1.00 0.00 C ATOM 922 OE1 GLN A 66 0.748 9.038 -3.510 1.00 0.00 O ATOM 923 NE2 GLN A 66 1.561 11.129 -3.400 1.00 0.00 N ATOM 0 H GLN A 66 2.260 6.762 -3.021 1.00 0.00 H new ATOM 0 HA GLN A 66 3.071 7.542 -0.314 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.281 8.092 -1.385 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.918 8.516 0.191 1.00 0.00 H new ATOM 0 HG2 GLN A 66 1.136 10.554 -0.818 1.00 0.00 H new ATOM 0 HG3 GLN A 66 2.690 9.879 -1.267 1.00 0.00 H new ATOM 0 HE21 GLN A 66 1.993 11.855 -2.829 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.352 11.310 -4.382 1.00 0.00 H new ATOM 932 N VAL A 67 1.350 5.780 0.634 1.00 0.00 N ATOM 933 CA VAL A 67 0.780 4.524 1.105 1.00 0.00 C ATOM 934 C VAL A 67 -0.404 4.100 0.243 1.00 0.00 C ATOM 935 O VAL A 67 -0.875 4.862 -0.600 1.00 0.00 O ATOM 936 CB VAL A 67 0.320 4.632 2.571 1.00 0.00 C ATOM 937 CG1 VAL A 67 1.509 4.884 3.486 1.00 0.00 C ATOM 938 CG2 VAL A 67 -0.722 5.729 2.723 1.00 0.00 C ATOM 0 H VAL A 67 1.480 6.483 1.362 1.00 0.00 H new ATOM 0 HA VAL A 67 1.566 3.773 1.032 1.00 0.00 H new ATOM 0 HB VAL A 67 -0.137 3.686 2.861 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.165 4.957 4.518 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.217 4.060 3.397 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.998 5.815 3.199 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.036 5.791 3.765 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -0.294 6.683 2.416 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.585 5.500 2.097 1.00 0.00 H new ATOM 948 N ASN A 68 -0.880 2.879 0.461 1.00 0.00 N ATOM 949 CA ASN A 68 -2.010 2.352 -0.297 1.00 0.00 C ATOM 950 C ASN A 68 -1.674 2.262 -1.782 1.00 0.00 C ATOM 951 O ASN A 68 -2.497 2.589 -2.637 1.00 0.00 O ATOM 952 CB ASN A 68 -3.242 3.236 -0.095 1.00 0.00 C ATOM 953 CG ASN A 68 -3.416 3.664 1.350 1.00 0.00 C ATOM 954 OD1 ASN A 68 -3.008 2.957 2.272 1.00 0.00 O ATOM 955 ND2 ASN A 68 -4.023 4.828 1.553 1.00 0.00 N ATOM 0 H ASN A 68 -0.501 2.235 1.156 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.226 1.349 0.070 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.158 4.121 -0.726 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -4.131 2.696 -0.421 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.167 5.169 2.503 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.345 5.381 0.758 1.00 0.00 H new ATOM 962 N ASP A 69 -0.459 1.815 -2.082 1.00 0.00 N ATOM 963 CA ASP A 69 -0.014 1.679 -3.464 1.00 0.00 C ATOM 964 C ASP A 69 0.676 0.336 -3.684 1.00 0.00 C ATOM 965 O ASP A 69 1.314 -0.201 -2.778 1.00 0.00 O ATOM 966 CB ASP A 69 0.936 2.820 -3.831 1.00 0.00 C ATOM 967 CG ASP A 69 0.201 4.046 -4.335 1.00 0.00 C ATOM 968 OD1 ASP A 69 -0.403 3.969 -5.425 1.00 0.00 O ATOM 969 OD2 ASP A 69 0.229 5.084 -3.640 1.00 0.00 O ATOM 0 H ASP A 69 0.235 1.541 -1.387 1.00 0.00 H new ATOM 0 HA ASP A 69 -0.892 1.726 -4.108 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.530 3.090 -2.958 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.632 2.477 -4.596 1.00 0.00 H new ATOM 974 N LYS A 70 0.543 -0.201 -4.891 1.00 0.00 N ATOM 975 CA LYS A 70 1.153 -1.481 -5.231 1.00 0.00 C ATOM 976 C LYS A 70 2.311 -1.290 -6.204 1.00 0.00 C ATOM 977 O LYS A 70 2.107 -0.929 -7.364 1.00 0.00 O ATOM 978 CB LYS A 70 0.110 -2.421 -5.841 1.00 0.00 C ATOM 979 CG LYS A 70 0.413 -3.892 -5.620 1.00 0.00 C ATOM 980 CD LYS A 70 -0.224 -4.761 -6.692 1.00 0.00 C ATOM 981 CE LYS A 70 0.603 -4.768 -7.968 1.00 0.00 C ATOM 982 NZ LYS A 70 -0.232 -5.046 -9.169 1.00 0.00 N ATOM 0 H LYS A 70 0.018 0.230 -5.651 1.00 0.00 H new ATOM 0 HA LYS A 70 1.541 -1.925 -4.314 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.867 -2.192 -5.415 1.00 0.00 H new ATOM 0 HB3 LYS A 70 0.043 -2.230 -6.912 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.492 -4.046 -5.620 1.00 0.00 H new ATOM 0 HG3 LYS A 70 0.047 -4.196 -4.639 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.330 -5.780 -6.320 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -1.227 -4.395 -6.910 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.098 -3.804 -8.085 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.387 -5.521 -7.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.369 -5.042 -10.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.684 -5.977 -9.069 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -0.964 -4.313 -9.260 1.00 0.00 H new ATOM 996 N ILE A 71 3.526 -1.536 -5.726 1.00 0.00 N ATOM 997 CA ILE A 71 4.717 -1.394 -6.555 1.00 0.00 C ATOM 998 C ILE A 71 4.945 -2.637 -7.408 1.00 0.00 C ATOM 999 O ILE A 71 5.097 -3.742 -6.887 1.00 0.00 O ATOM 1000 CB ILE A 71 5.971 -1.135 -5.700 1.00 0.00 C ATOM 1001 CG1 ILE A 71 5.775 0.111 -4.833 1.00 0.00 C ATOM 1002 CG2 ILE A 71 7.196 -0.981 -6.589 1.00 0.00 C ATOM 1003 CD1 ILE A 71 5.171 -0.185 -3.479 1.00 0.00 C ATOM 0 H ILE A 71 3.712 -1.835 -4.769 1.00 0.00 H new ATOM 0 HA ILE A 71 4.547 -0.536 -7.206 1.00 0.00 H new ATOM 0 HB ILE A 71 6.128 -1.991 -5.043 1.00 0.00 H new ATOM 0 HG12 ILE A 71 6.738 0.602 -4.693 1.00 0.00 H new ATOM 0 HG13 ILE A 71 5.133 0.815 -5.362 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.074 -0.798 -5.970 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.343 -1.893 -7.167 1.00 0.00 H new ATOM 0 HG23 ILE A 71 7.050 -0.141 -7.268 1.00 0.00 H new ATOM 0 HD11 ILE A 71 5.061 0.744 -2.919 1.00 0.00 H new ATOM 0 HD12 ILE A 71 4.193 -0.648 -3.610 1.00 0.00 H new ATOM 0 HD13 ILE A 71 5.823 -0.864 -2.930 1.00 0.00 H new ATOM 1015 N VAL A 72 4.968 -2.449 -8.724 1.00 0.00 N ATOM 1016 CA VAL A 72 5.181 -3.555 -9.650 1.00 0.00 C ATOM 1017 C VAL A 72 6.609 -3.560 -10.182 1.00 0.00 C ATOM 1018 O VAL A 72 7.116 -4.592 -10.620 1.00 0.00 O ATOM 1019 CB VAL A 72 4.203 -3.488 -10.838 1.00 0.00 C ATOM 1020 CG1 VAL A 72 2.804 -3.896 -10.403 1.00 0.00 C ATOM 1021 CG2 VAL A 72 4.196 -2.092 -11.444 1.00 0.00 C ATOM 0 H VAL A 72 4.842 -1.542 -9.172 1.00 0.00 H new ATOM 0 HA VAL A 72 5.002 -4.474 -9.092 1.00 0.00 H new ATOM 0 HB VAL A 72 4.538 -4.190 -11.602 1.00 0.00 H new ATOM 0 HG11 VAL A 72 2.128 -3.842 -11.256 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.825 -4.916 -10.020 1.00 0.00 H new ATOM 0 HG13 VAL A 72 2.455 -3.222 -9.620 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.500 -2.063 -12.282 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.886 -1.369 -10.689 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.197 -1.843 -11.795 1.00 0.00 H new ATOM 1031 N ALA A 73 7.254 -2.399 -10.140 1.00 0.00 N ATOM 1032 CA ALA A 73 8.626 -2.269 -10.615 1.00 0.00 C ATOM 1033 C ALA A 73 9.291 -1.023 -10.039 1.00 0.00 C ATOM 1034 O ALA A 73 8.647 0.011 -9.861 1.00 0.00 O ATOM 1035 CB ALA A 73 8.657 -2.232 -12.135 1.00 0.00 C ATOM 0 H ALA A 73 6.848 -1.535 -9.782 1.00 0.00 H new ATOM 0 HA ALA A 73 9.187 -3.139 -10.273 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.688 -2.135 -12.476 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.230 -3.154 -12.530 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.076 -1.381 -12.490 1.00 0.00 H new ATOM 1041 N VAL A 74 10.584 -1.128 -9.749 1.00 0.00 N ATOM 1042 CA VAL A 74 11.337 -0.010 -9.194 1.00 0.00 C ATOM 1043 C VAL A 74 12.422 0.455 -10.159 1.00 0.00 C ATOM 1044 O VAL A 74 13.357 -0.287 -10.461 1.00 0.00 O ATOM 1045 CB VAL A 74 11.986 -0.383 -7.849 1.00 0.00 C ATOM 1046 CG1 VAL A 74 12.817 0.775 -7.317 1.00 0.00 C ATOM 1047 CG2 VAL A 74 10.924 -0.794 -6.841 1.00 0.00 C ATOM 0 H VAL A 74 11.132 -1.977 -9.889 1.00 0.00 H new ATOM 0 HA VAL A 74 10.627 0.801 -9.033 1.00 0.00 H new ATOM 0 HB VAL A 74 12.650 -1.232 -8.010 1.00 0.00 H new ATOM 0 HG11 VAL A 74 13.268 0.492 -6.366 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.602 1.018 -8.033 1.00 0.00 H new ATOM 0 HG13 VAL A 74 12.177 1.645 -7.171 1.00 0.00 H new ATOM 0 HG21 VAL A 74 11.401 -1.054 -5.896 1.00 0.00 H new ATOM 0 HG22 VAL A 74 10.233 0.034 -6.683 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.376 -1.656 -7.221 1.00 0.00 H new ATOM 1057 N ASP A 75 12.293 1.687 -10.638 1.00 0.00 N ATOM 1058 CA ASP A 75 13.264 2.252 -11.567 1.00 0.00 C ATOM 1059 C ASP A 75 13.507 1.308 -12.740 1.00 0.00 C ATOM 1060 O ASP A 75 14.615 1.231 -13.269 1.00 0.00 O ATOM 1061 CB ASP A 75 14.582 2.542 -10.847 1.00 0.00 C ATOM 1062 CG ASP A 75 15.330 1.276 -10.477 1.00 0.00 C ATOM 1063 OD1 ASP A 75 15.958 0.675 -11.373 1.00 0.00 O ATOM 1064 OD2 ASP A 75 15.286 0.886 -9.291 1.00 0.00 O ATOM 0 H ASP A 75 11.525 2.314 -10.398 1.00 0.00 H new ATOM 0 HA ASP A 75 12.858 3.186 -11.955 1.00 0.00 H new ATOM 0 HB2 ASP A 75 15.213 3.160 -11.486 1.00 0.00 H new ATOM 0 HB3 ASP A 75 14.380 3.118 -9.944 1.00 0.00 H new ATOM 1069 N GLY A 76 12.463 0.589 -13.141 1.00 0.00 N ATOM 1070 CA GLY A 76 12.584 -0.342 -14.248 1.00 0.00 C ATOM 1071 C GLY A 76 12.721 -1.779 -13.784 1.00 0.00 C ATOM 1072 O GLY A 76 12.424 -2.711 -14.531 1.00 0.00 O ATOM 0 H GLY A 76 11.536 0.635 -12.719 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.708 -0.253 -14.891 1.00 0.00 H new ATOM 0 HA3 GLY A 76 13.451 -0.074 -14.851 1.00 0.00 H new ATOM 1076 N VAL A 77 13.174 -1.960 -12.547 1.00 0.00 N ATOM 1077 CA VAL A 77 13.350 -3.293 -11.985 1.00 0.00 C ATOM 1078 C VAL A 77 12.005 -3.965 -11.731 1.00 0.00 C ATOM 1079 O VAL A 77 11.263 -3.570 -10.833 1.00 0.00 O ATOM 1080 CB VAL A 77 14.145 -3.246 -10.667 1.00 0.00 C ATOM 1081 CG1 VAL A 77 14.249 -4.635 -10.056 1.00 0.00 C ATOM 1082 CG2 VAL A 77 15.526 -2.651 -10.899 1.00 0.00 C ATOM 0 H VAL A 77 13.426 -1.200 -11.915 1.00 0.00 H new ATOM 0 HA VAL A 77 13.910 -3.874 -12.718 1.00 0.00 H new ATOM 0 HB VAL A 77 13.612 -2.606 -9.964 1.00 0.00 H new ATOM 0 HG11 VAL A 77 14.814 -4.582 -9.125 1.00 0.00 H new ATOM 0 HG12 VAL A 77 13.249 -5.019 -9.852 1.00 0.00 H new ATOM 0 HG13 VAL A 77 14.758 -5.301 -10.752 1.00 0.00 H new ATOM 0 HG21 VAL A 77 16.074 -2.625 -9.957 1.00 0.00 H new ATOM 0 HG22 VAL A 77 16.070 -3.263 -11.619 1.00 0.00 H new ATOM 0 HG23 VAL A 77 15.425 -1.638 -11.288 1.00 0.00 H new ATOM 1092 N ASN A 78 11.698 -4.982 -12.529 1.00 0.00 N ATOM 1093 CA ASN A 78 10.441 -5.710 -12.391 1.00 0.00 C ATOM 1094 C ASN A 78 10.422 -6.521 -11.099 1.00 0.00 C ATOM 1095 O ASN A 78 10.778 -7.700 -11.090 1.00 0.00 O ATOM 1096 CB ASN A 78 10.229 -6.635 -13.591 1.00 0.00 C ATOM 1097 CG ASN A 78 8.793 -7.111 -13.707 1.00 0.00 C ATOM 1098 OD1 ASN A 78 8.507 -8.298 -13.556 1.00 0.00 O ATOM 1099 ND2 ASN A 78 7.883 -6.183 -13.977 1.00 0.00 N ATOM 0 H ASN A 78 12.302 -5.321 -13.278 1.00 0.00 H new ATOM 0 HA ASN A 78 9.630 -4.983 -12.354 1.00 0.00 H new ATOM 0 HB2 ASN A 78 10.510 -6.111 -14.504 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.889 -7.498 -13.502 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.901 -6.443 -14.067 1.00 0.00 H new ATOM 0 HD22 ASN A 78 8.166 -5.210 -14.094 1.00 0.00 H new ATOM 1106 N ILE A 79 10.003 -5.883 -10.012 1.00 0.00 N ATOM 1107 CA ILE A 79 9.936 -6.546 -8.715 1.00 0.00 C ATOM 1108 C ILE A 79 8.604 -7.267 -8.536 1.00 0.00 C ATOM 1109 O ILE A 79 8.244 -7.656 -7.425 1.00 0.00 O ATOM 1110 CB ILE A 79 10.125 -5.545 -7.560 1.00 0.00 C ATOM 1111 CG1 ILE A 79 8.969 -4.542 -7.532 1.00 0.00 C ATOM 1112 CG2 ILE A 79 11.457 -4.823 -7.698 1.00 0.00 C ATOM 1113 CD1 ILE A 79 8.651 -4.026 -6.146 1.00 0.00 C ATOM 0 H ILE A 79 9.705 -4.908 -10.003 1.00 0.00 H new ATOM 0 HA ILE A 79 10.747 -7.274 -8.690 1.00 0.00 H new ATOM 0 HB ILE A 79 10.128 -6.094 -6.619 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.214 -3.699 -8.178 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.079 -5.014 -7.948 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.576 -4.119 -6.875 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.269 -5.550 -7.674 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.481 -4.282 -8.644 1.00 0.00 H new ATOM 0 HD11 ILE A 79 7.822 -3.320 -6.202 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.374 -4.860 -5.502 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.527 -3.525 -5.734 1.00 0.00 H new ATOM 1125 N GLN A 80 7.879 -7.442 -9.636 1.00 0.00 N ATOM 1126 CA GLN A 80 6.587 -8.118 -9.599 1.00 0.00 C ATOM 1127 C GLN A 80 6.608 -9.279 -8.610 1.00 0.00 C ATOM 1128 O GLN A 80 5.864 -9.287 -7.631 1.00 0.00 O ATOM 1129 CB GLN A 80 6.214 -8.626 -10.993 1.00 0.00 C ATOM 1130 CG GLN A 80 5.638 -7.549 -11.898 1.00 0.00 C ATOM 1131 CD GLN A 80 5.088 -8.110 -13.195 1.00 0.00 C ATOM 1132 OE1 GLN A 80 5.527 -9.159 -13.667 1.00 0.00 O ATOM 1133 NE2 GLN A 80 4.120 -7.413 -13.778 1.00 0.00 N ATOM 0 H GLN A 80 8.164 -7.126 -10.563 1.00 0.00 H new ATOM 0 HA GLN A 80 5.838 -7.398 -9.270 1.00 0.00 H new ATOM 0 HB2 GLN A 80 7.100 -9.050 -11.465 1.00 0.00 H new ATOM 0 HB3 GLN A 80 5.488 -9.433 -10.894 1.00 0.00 H new ATOM 0 HG2 GLN A 80 4.844 -7.021 -11.369 1.00 0.00 H new ATOM 0 HG3 GLN A 80 6.413 -6.816 -12.123 1.00 0.00 H new ATOM 0 HE21 GLN A 80 3.786 -6.549 -13.352 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.710 -7.742 -14.652 1.00 0.00 H new ATOM 1142 N GLY A 81 7.467 -10.260 -8.875 1.00 0.00 N ATOM 1143 CA GLY A 81 7.568 -11.413 -8.000 1.00 0.00 C ATOM 1144 C GLY A 81 8.839 -11.404 -7.174 1.00 0.00 C ATOM 1145 O GLY A 81 9.547 -12.408 -7.100 1.00 0.00 O ATOM 0 H GLY A 81 8.094 -10.276 -9.679 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.706 -11.436 -7.334 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.534 -12.323 -8.598 1.00 0.00 H new ATOM 1149 N PHE A 82 9.131 -10.266 -6.552 1.00 0.00 N ATOM 1150 CA PHE A 82 10.327 -10.130 -5.729 1.00 0.00 C ATOM 1151 C PHE A 82 9.982 -10.231 -4.247 1.00 0.00 C ATOM 1152 O PHE A 82 8.813 -10.191 -3.866 1.00 0.00 O ATOM 1153 CB PHE A 82 11.018 -8.794 -6.014 1.00 0.00 C ATOM 1154 CG PHE A 82 11.942 -8.837 -7.197 1.00 0.00 C ATOM 1155 CD1 PHE A 82 11.587 -9.524 -8.346 1.00 0.00 C ATOM 1156 CD2 PHE A 82 13.167 -8.191 -7.159 1.00 0.00 C ATOM 1157 CE1 PHE A 82 12.435 -9.566 -9.437 1.00 0.00 C ATOM 1158 CE2 PHE A 82 14.019 -8.228 -8.247 1.00 0.00 C ATOM 1159 CZ PHE A 82 13.653 -8.917 -9.386 1.00 0.00 C ATOM 0 H PHE A 82 8.556 -9.425 -6.602 1.00 0.00 H new ATOM 0 HA PHE A 82 11.006 -10.944 -5.982 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.259 -8.030 -6.184 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.583 -8.491 -5.133 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.636 -10.033 -8.390 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.460 -7.653 -6.270 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.146 -10.105 -10.327 1.00 0.00 H new ATOM 0 HE2 PHE A 82 14.970 -7.718 -8.206 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.318 -8.948 -10.236 1.00 0.00 H new ATOM 1169 N ALA A 83 11.010 -10.364 -3.414 1.00 0.00 N ATOM 1170 CA ALA A 83 10.816 -10.470 -1.973 1.00 0.00 C ATOM 1171 C ALA A 83 11.211 -9.176 -1.270 1.00 0.00 C ATOM 1172 O ALA A 83 12.051 -8.423 -1.761 1.00 0.00 O ATOM 1173 CB ALA A 83 11.615 -11.640 -1.418 1.00 0.00 C ATOM 0 H ALA A 83 11.985 -10.401 -3.713 1.00 0.00 H new ATOM 0 HA ALA A 83 9.757 -10.646 -1.785 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.461 -11.708 -0.341 1.00 0.00 H new ATOM 0 HB2 ALA A 83 11.283 -12.564 -1.891 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.674 -11.487 -1.624 1.00 0.00 H new ATOM 1179 N ASN A 84 10.600 -8.925 -0.117 1.00 0.00 N ATOM 1180 CA ASN A 84 10.888 -7.720 0.654 1.00 0.00 C ATOM 1181 C ASN A 84 12.374 -7.380 0.597 1.00 0.00 C ATOM 1182 O ASN A 84 12.753 -6.265 0.236 1.00 0.00 O ATOM 1183 CB ASN A 84 10.450 -7.904 2.109 1.00 0.00 C ATOM 1184 CG ASN A 84 8.943 -7.994 2.253 1.00 0.00 C ATOM 1185 OD1 ASN A 84 8.381 -9.086 2.337 1.00 0.00 O ATOM 1186 ND2 ASN A 84 8.282 -6.843 2.281 1.00 0.00 N ATOM 0 H ASN A 84 9.903 -9.539 0.304 1.00 0.00 H new ATOM 0 HA ASN A 84 10.328 -6.895 0.215 1.00 0.00 H new ATOM 0 HB2 ASN A 84 10.905 -8.809 2.511 1.00 0.00 H new ATOM 0 HB3 ASN A 84 10.820 -7.070 2.705 1.00 0.00 H new ATOM 0 HD21 ASN A 84 7.266 -6.840 2.375 1.00 0.00 H new ATOM 0 HD22 ASN A 84 8.790 -5.961 2.208 1.00 0.00 H new ATOM 1193 N HIS A 85 13.211 -8.348 0.956 1.00 0.00 N ATOM 1194 CA HIS A 85 14.656 -8.151 0.945 1.00 0.00 C ATOM 1195 C HIS A 85 15.157 -7.883 -0.471 1.00 0.00 C ATOM 1196 O HIS A 85 15.990 -7.003 -0.689 1.00 0.00 O ATOM 1197 CB HIS A 85 15.363 -9.377 1.524 1.00 0.00 C ATOM 1198 CG HIS A 85 14.814 -10.678 1.024 1.00 0.00 C ATOM 1199 ND1 HIS A 85 13.916 -11.440 1.740 1.00 0.00 N ATOM 1200 CD2 HIS A 85 15.039 -11.349 -0.130 1.00 0.00 C ATOM 1201 CE1 HIS A 85 13.614 -12.525 1.050 1.00 0.00 C ATOM 1202 NE2 HIS A 85 14.281 -12.493 -0.089 1.00 0.00 N ATOM 0 H HIS A 85 12.914 -9.276 1.258 1.00 0.00 H new ATOM 0 HA HIS A 85 14.884 -7.283 1.563 1.00 0.00 H new ATOM 0 HB2 HIS A 85 16.424 -9.323 1.281 1.00 0.00 H new ATOM 0 HB3 HIS A 85 15.283 -9.352 2.611 1.00 0.00 H new ATOM 0 HD2 HIS A 85 15.693 -11.042 -0.933 1.00 0.00 H new ATOM 0 HE1 HIS A 85 12.937 -13.305 1.364 1.00 0.00 H new ATOM 0 HE2 HIS A 85 14.240 -13.203 -0.820 1.00 0.00 H new ATOM 1211 N ASP A 86 14.644 -8.646 -1.430 1.00 0.00 N ATOM 1212 CA ASP A 86 15.039 -8.490 -2.825 1.00 0.00 C ATOM 1213 C ASP A 86 14.705 -7.090 -3.331 1.00 0.00 C ATOM 1214 O ASP A 86 15.396 -6.550 -4.194 1.00 0.00 O ATOM 1215 CB ASP A 86 14.344 -9.540 -3.694 1.00 0.00 C ATOM 1216 CG ASP A 86 15.125 -9.855 -4.955 1.00 0.00 C ATOM 1217 OD1 ASP A 86 15.897 -8.985 -5.407 1.00 0.00 O ATOM 1218 OD2 ASP A 86 14.962 -10.973 -5.490 1.00 0.00 O ATOM 0 H ASP A 86 13.954 -9.379 -1.267 1.00 0.00 H new ATOM 0 HA ASP A 86 16.118 -8.632 -2.890 1.00 0.00 H new ATOM 0 HB2 ASP A 86 14.208 -10.454 -3.116 1.00 0.00 H new ATOM 0 HB3 ASP A 86 13.350 -9.184 -3.965 1.00 0.00 H new ATOM 1223 N VAL A 87 13.639 -6.509 -2.788 1.00 0.00 N ATOM 1224 CA VAL A 87 13.213 -5.172 -3.185 1.00 0.00 C ATOM 1225 C VAL A 87 14.068 -4.102 -2.516 1.00 0.00 C ATOM 1226 O VAL A 87 14.359 -3.063 -3.110 1.00 0.00 O ATOM 1227 CB VAL A 87 11.734 -4.927 -2.831 1.00 0.00 C ATOM 1228 CG1 VAL A 87 11.313 -3.524 -3.240 1.00 0.00 C ATOM 1229 CG2 VAL A 87 10.848 -5.972 -3.493 1.00 0.00 C ATOM 0 H VAL A 87 13.055 -6.943 -2.073 1.00 0.00 H new ATOM 0 HA VAL A 87 13.336 -5.108 -4.266 1.00 0.00 H new ATOM 0 HB VAL A 87 11.617 -5.016 -1.751 1.00 0.00 H new ATOM 0 HG11 VAL A 87 10.265 -3.369 -2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.928 -2.792 -2.716 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.444 -3.404 -4.315 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.806 -5.784 -3.232 1.00 0.00 H new ATOM 0 HG22 VAL A 87 10.967 -5.917 -4.575 1.00 0.00 H new ATOM 0 HG23 VAL A 87 11.135 -6.965 -3.146 1.00 0.00 H new ATOM 1239 N VAL A 88 14.469 -4.362 -1.276 1.00 0.00 N ATOM 1240 CA VAL A 88 15.293 -3.422 -0.525 1.00 0.00 C ATOM 1241 C VAL A 88 16.599 -3.132 -1.256 1.00 0.00 C ATOM 1242 O VAL A 88 16.945 -1.975 -1.493 1.00 0.00 O ATOM 1243 CB VAL A 88 15.613 -3.956 0.884 1.00 0.00 C ATOM 1244 CG1 VAL A 88 16.533 -2.996 1.623 1.00 0.00 C ATOM 1245 CG2 VAL A 88 14.331 -4.189 1.668 1.00 0.00 C ATOM 0 H VAL A 88 14.237 -5.216 -0.770 1.00 0.00 H new ATOM 0 HA VAL A 88 14.718 -2.500 -0.433 1.00 0.00 H new ATOM 0 HB VAL A 88 16.129 -4.911 0.784 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.748 -3.390 2.616 1.00 0.00 H new ATOM 0 HG12 VAL A 88 17.464 -2.884 1.068 1.00 0.00 H new ATOM 0 HG13 VAL A 88 16.047 -2.025 1.715 1.00 0.00 H new ATOM 0 HG21 VAL A 88 14.575 -4.566 2.661 1.00 0.00 H new ATOM 0 HG22 VAL A 88 13.785 -3.250 1.761 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.712 -4.918 1.145 1.00 0.00 H new ATOM 1255 N GLU A 89 17.321 -4.191 -1.610 1.00 0.00 N ATOM 1256 CA GLU A 89 18.590 -4.048 -2.314 1.00 0.00 C ATOM 1257 C GLU A 89 18.413 -3.245 -3.599 1.00 0.00 C ATOM 1258 O GLU A 89 19.267 -2.436 -3.961 1.00 0.00 O ATOM 1259 CB GLU A 89 19.177 -5.424 -2.636 1.00 0.00 C ATOM 1260 CG GLU A 89 18.330 -6.235 -3.603 1.00 0.00 C ATOM 1261 CD GLU A 89 18.940 -7.587 -3.920 1.00 0.00 C ATOM 1262 OE1 GLU A 89 18.666 -8.551 -3.174 1.00 0.00 O ATOM 1263 OE2 GLU A 89 19.691 -7.681 -4.913 1.00 0.00 O ATOM 0 H GLU A 89 17.049 -5.156 -1.421 1.00 0.00 H new ATOM 0 HA GLU A 89 19.279 -3.510 -1.663 1.00 0.00 H new ATOM 0 HB2 GLU A 89 20.173 -5.295 -3.059 1.00 0.00 H new ATOM 0 HB3 GLU A 89 19.294 -5.986 -1.709 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.337 -6.379 -3.177 1.00 0.00 H new ATOM 0 HG3 GLU A 89 18.202 -5.673 -4.528 1.00 0.00 H new ATOM 1270 N VAL A 90 17.297 -3.474 -4.284 1.00 0.00 N ATOM 1271 CA VAL A 90 17.007 -2.772 -5.529 1.00 0.00 C ATOM 1272 C VAL A 90 16.976 -1.263 -5.314 1.00 0.00 C ATOM 1273 O VAL A 90 17.562 -0.503 -6.087 1.00 0.00 O ATOM 1274 CB VAL A 90 15.660 -3.222 -6.125 1.00 0.00 C ATOM 1275 CG1 VAL A 90 15.304 -2.377 -7.339 1.00 0.00 C ATOM 1276 CG2 VAL A 90 15.705 -4.699 -6.489 1.00 0.00 C ATOM 0 H VAL A 90 16.579 -4.140 -3.998 1.00 0.00 H new ATOM 0 HA VAL A 90 17.806 -3.020 -6.227 1.00 0.00 H new ATOM 0 HB VAL A 90 14.884 -3.080 -5.372 1.00 0.00 H new ATOM 0 HG11 VAL A 90 14.349 -2.710 -7.747 1.00 0.00 H new ATOM 0 HG12 VAL A 90 15.228 -1.330 -7.044 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.079 -2.485 -8.097 1.00 0.00 H new ATOM 0 HG21 VAL A 90 14.745 -5.000 -6.909 1.00 0.00 H new ATOM 0 HG22 VAL A 90 16.492 -4.869 -7.224 1.00 0.00 H new ATOM 0 HG23 VAL A 90 15.911 -5.288 -5.595 1.00 0.00 H new ATOM 1286 N LEU A 91 16.291 -0.835 -4.260 1.00 0.00 N ATOM 1287 CA LEU A 91 16.184 0.585 -3.942 1.00 0.00 C ATOM 1288 C LEU A 91 17.562 1.198 -3.718 1.00 0.00 C ATOM 1289 O LEU A 91 17.876 2.258 -4.259 1.00 0.00 O ATOM 1290 CB LEU A 91 15.315 0.785 -2.698 1.00 0.00 C ATOM 1291 CG LEU A 91 13.915 0.174 -2.752 1.00 0.00 C ATOM 1292 CD1 LEU A 91 13.296 0.136 -1.364 1.00 0.00 C ATOM 1293 CD2 LEU A 91 13.029 0.954 -3.712 1.00 0.00 C ATOM 0 H LEU A 91 15.801 -1.451 -3.611 1.00 0.00 H new ATOM 0 HA LEU A 91 15.717 1.088 -4.789 1.00 0.00 H new ATOM 0 HB2 LEU A 91 15.840 0.364 -1.841 1.00 0.00 H new ATOM 0 HB3 LEU A 91 15.216 1.855 -2.517 1.00 0.00 H new ATOM 0 HG LEU A 91 14.000 -0.849 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU A 91 12.300 -0.302 -1.422 1.00 0.00 H new ATOM 0 HD12 LEU A 91 13.920 -0.467 -0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 91 13.224 1.150 -0.970 1.00 0.00 H new ATOM 0 HD21 LEU A 91 12.036 0.505 -3.738 1.00 0.00 H new ATOM 0 HD22 LEU A 91 12.951 1.988 -3.376 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.464 0.929 -4.711 1.00 0.00 H new ATOM 1305 N ARG A 92 18.381 0.523 -2.918 1.00 0.00 N ATOM 1306 CA ARG A 92 19.727 1.001 -2.624 1.00 0.00 C ATOM 1307 C ARG A 92 20.566 1.082 -3.896 1.00 0.00 C ATOM 1308 O ARG A 92 21.323 2.031 -4.092 1.00 0.00 O ATOM 1309 CB ARG A 92 20.407 0.080 -1.609 1.00 0.00 C ATOM 1310 CG ARG A 92 19.643 -0.056 -0.302 1.00 0.00 C ATOM 1311 CD ARG A 92 20.382 -0.946 0.685 1.00 0.00 C ATOM 1312 NE ARG A 92 20.106 -0.574 2.070 1.00 0.00 N ATOM 1313 CZ ARG A 92 20.765 0.379 2.721 1.00 0.00 C ATOM 1314 NH1 ARG A 92 21.733 1.053 2.114 1.00 0.00 N ATOM 1315 NH2 ARG A 92 20.456 0.660 3.980 1.00 0.00 N ATOM 0 H ARG A 92 18.136 -0.356 -2.462 1.00 0.00 H new ATOM 0 HA ARG A 92 19.646 2.002 -2.200 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.530 -0.908 -2.053 1.00 0.00 H new ATOM 0 HB3 ARG A 92 21.406 0.461 -1.398 1.00 0.00 H new ATOM 0 HG2 ARG A 92 19.493 0.930 0.137 1.00 0.00 H new ATOM 0 HG3 ARG A 92 18.655 -0.471 -0.499 1.00 0.00 H new ATOM 0 HD2 ARG A 92 20.092 -1.984 0.524 1.00 0.00 H new ATOM 0 HD3 ARG A 92 21.454 -0.881 0.499 1.00 0.00 H new ATOM 0 HE ARG A 92 19.367 -1.073 2.565 1.00 0.00 H new ATOM 0 HH11 ARG A 92 21.973 0.840 1.146 1.00 0.00 H new ATOM 0 HH12 ARG A 92 22.237 1.784 2.616 1.00 0.00 H new ATOM 0 HH21 ARG A 92 19.712 0.144 4.450 1.00 0.00 H new ATOM 0 HH22 ARG A 92 20.963 1.392 4.478 1.00 0.00 H new ATOM 1329 N ASN A 93 20.425 0.079 -4.756 1.00 0.00 N ATOM 1330 CA ASN A 93 21.170 0.036 -6.009 1.00 0.00 C ATOM 1331 C ASN A 93 20.775 1.196 -6.917 1.00 0.00 C ATOM 1332 O ASN A 93 21.618 1.779 -7.598 1.00 0.00 O ATOM 1333 CB ASN A 93 20.927 -1.294 -6.726 1.00 0.00 C ATOM 1334 CG ASN A 93 21.864 -2.387 -6.250 1.00 0.00 C ATOM 1335 OD1 ASN A 93 23.075 -2.317 -6.459 1.00 0.00 O ATOM 1336 ND2 ASN A 93 21.306 -3.406 -5.607 1.00 0.00 N ATOM 0 H ASN A 93 19.802 -0.715 -4.608 1.00 0.00 H new ATOM 0 HA ASN A 93 22.231 0.126 -5.775 1.00 0.00 H new ATOM 0 HB2 ASN A 93 19.896 -1.608 -6.564 1.00 0.00 H new ATOM 0 HB3 ASN A 93 21.053 -1.153 -7.800 1.00 0.00 H new ATOM 0 HD21 ASN A 93 21.886 -4.172 -5.264 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.297 -3.423 -5.456 1.00 0.00 H new ATOM 1343 N ALA A 94 19.488 1.526 -6.921 1.00 0.00 N ATOM 1344 CA ALA A 94 18.981 2.617 -7.743 1.00 0.00 C ATOM 1345 C ALA A 94 19.752 3.906 -7.479 1.00 0.00 C ATOM 1346 O ALA A 94 20.173 4.170 -6.353 1.00 0.00 O ATOM 1347 CB ALA A 94 17.496 2.826 -7.486 1.00 0.00 C ATOM 0 H ALA A 94 18.777 1.053 -6.364 1.00 0.00 H new ATOM 0 HA ALA A 94 19.122 2.347 -8.790 1.00 0.00 H new ATOM 0 HB1 ALA A 94 17.131 3.644 -8.107 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.952 1.914 -7.731 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.339 3.070 -6.435 1.00 0.00 H new ATOM 1353 N GLY A 95 19.934 4.707 -8.525 1.00 0.00 N ATOM 1354 CA GLY A 95 20.655 5.958 -8.385 1.00 0.00 C ATOM 1355 C GLY A 95 19.730 7.138 -8.161 1.00 0.00 C ATOM 1356 O GLY A 95 18.597 6.969 -7.709 1.00 0.00 O ATOM 0 H GLY A 95 19.595 4.511 -9.467 1.00 0.00 H new ATOM 0 HA2 GLY A 95 21.350 5.882 -7.549 1.00 0.00 H new ATOM 0 HA3 GLY A 95 21.251 6.132 -9.281 1.00 0.00 H new ATOM 1360 N GLN A 96 20.213 8.335 -8.476 1.00 0.00 N ATOM 1361 CA GLN A 96 19.422 9.548 -8.304 1.00 0.00 C ATOM 1362 C GLN A 96 18.054 9.403 -8.962 1.00 0.00 C ATOM 1363 O GLN A 96 17.022 9.461 -8.293 1.00 0.00 O ATOM 1364 CB GLN A 96 20.160 10.752 -8.892 1.00 0.00 C ATOM 1365 CG GLN A 96 19.694 12.085 -8.330 1.00 0.00 C ATOM 1366 CD GLN A 96 20.759 13.160 -8.421 1.00 0.00 C ATOM 1367 OE1 GLN A 96 21.311 13.414 -9.492 1.00 0.00 O ATOM 1368 NE2 GLN A 96 21.052 13.800 -7.295 1.00 0.00 N ATOM 0 H GLN A 96 21.148 8.491 -8.852 1.00 0.00 H new ATOM 0 HA GLN A 96 19.276 9.708 -7.236 1.00 0.00 H new ATOM 0 HB2 GLN A 96 21.228 10.641 -8.703 1.00 0.00 H new ATOM 0 HB3 GLN A 96 20.026 10.757 -9.974 1.00 0.00 H new ATOM 0 HG2 GLN A 96 18.806 12.412 -8.870 1.00 0.00 H new ATOM 0 HG3 GLN A 96 19.403 11.954 -7.288 1.00 0.00 H new ATOM 0 HE21 GLN A 96 20.570 13.557 -6.430 1.00 0.00 H new ATOM 0 HE22 GLN A 96 21.759 14.535 -7.295 1.00 0.00 H new ATOM 1377 N VAL A 97 18.053 9.215 -10.278 1.00 0.00 N ATOM 1378 CA VAL A 97 16.811 9.061 -11.027 1.00 0.00 C ATOM 1379 C VAL A 97 16.152 7.719 -10.728 1.00 0.00 C ATOM 1380 O VAL A 97 16.549 6.686 -11.266 1.00 0.00 O ATOM 1381 CB VAL A 97 17.053 9.175 -12.544 1.00 0.00 C ATOM 1382 CG1 VAL A 97 15.768 8.906 -13.311 1.00 0.00 C ATOM 1383 CG2 VAL A 97 17.615 10.545 -12.892 1.00 0.00 C ATOM 0 H VAL A 97 18.898 9.166 -10.847 1.00 0.00 H new ATOM 0 HA VAL A 97 16.148 9.866 -10.711 1.00 0.00 H new ATOM 0 HB VAL A 97 17.786 8.423 -12.835 1.00 0.00 H new ATOM 0 HG11 VAL A 97 15.958 8.991 -14.381 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.413 7.901 -13.084 1.00 0.00 H new ATOM 0 HG13 VAL A 97 15.011 9.633 -13.018 1.00 0.00 H new ATOM 0 HG21 VAL A 97 17.780 10.608 -13.968 1.00 0.00 H new ATOM 0 HG22 VAL A 97 16.908 11.316 -12.587 1.00 0.00 H new ATOM 0 HG23 VAL A 97 18.561 10.693 -12.371 1.00 0.00 H new ATOM 1393 N VAL A 98 15.140 7.743 -9.866 1.00 0.00 N ATOM 1394 CA VAL A 98 14.423 6.528 -9.496 1.00 0.00 C ATOM 1395 C VAL A 98 13.007 6.533 -10.060 1.00 0.00 C ATOM 1396 O VAL A 98 12.131 7.241 -9.563 1.00 0.00 O ATOM 1397 CB VAL A 98 14.354 6.361 -7.966 1.00 0.00 C ATOM 1398 CG1 VAL A 98 13.591 5.097 -7.601 1.00 0.00 C ATOM 1399 CG2 VAL A 98 15.753 6.341 -7.369 1.00 0.00 C ATOM 0 H VAL A 98 14.798 8.590 -9.411 1.00 0.00 H new ATOM 0 HA VAL A 98 14.977 5.691 -9.921 1.00 0.00 H new ATOM 0 HB VAL A 98 13.818 7.213 -7.548 1.00 0.00 H new ATOM 0 HG11 VAL A 98 13.553 4.996 -6.516 1.00 0.00 H new ATOM 0 HG12 VAL A 98 12.577 5.157 -7.996 1.00 0.00 H new ATOM 0 HG13 VAL A 98 14.096 4.231 -8.029 1.00 0.00 H new ATOM 0 HG21 VAL A 98 15.685 6.222 -6.288 1.00 0.00 H new ATOM 0 HG22 VAL A 98 16.317 5.509 -7.791 1.00 0.00 H new ATOM 0 HG23 VAL A 98 16.261 7.277 -7.600 1.00 0.00 H new ATOM 1409 N HIS A 99 12.788 5.736 -11.102 1.00 0.00 N ATOM 1410 CA HIS A 99 11.477 5.647 -11.734 1.00 0.00 C ATOM 1411 C HIS A 99 10.639 4.545 -11.093 1.00 0.00 C ATOM 1412 O HIS A 99 10.720 3.381 -11.487 1.00 0.00 O ATOM 1413 CB HIS A 99 11.627 5.384 -13.233 1.00 0.00 C ATOM 1414 CG HIS A 99 11.866 6.625 -14.038 1.00 0.00 C ATOM 1415 ND1 HIS A 99 12.986 6.808 -14.822 1.00 0.00 N ATOM 1416 CD2 HIS A 99 11.122 7.746 -14.178 1.00 0.00 C ATOM 1417 CE1 HIS A 99 12.920 7.990 -15.408 1.00 0.00 C ATOM 1418 NE2 HIS A 99 11.799 8.579 -15.035 1.00 0.00 N ATOM 0 H HIS A 99 13.502 5.143 -11.526 1.00 0.00 H new ATOM 0 HA HIS A 99 10.965 6.599 -11.589 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.455 4.693 -13.391 1.00 0.00 H new ATOM 0 HB3 HIS A 99 10.726 4.891 -13.599 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.173 7.948 -13.704 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.658 8.404 -16.079 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.486 9.503 -15.335 1.00 0.00 H new ATOM 1427 N LEU A 100 9.834 4.920 -10.105 1.00 0.00 N ATOM 1428 CA LEU A 100 8.981 3.963 -9.408 1.00 0.00 C ATOM 1429 C LEU A 100 7.746 3.630 -10.239 1.00 0.00 C ATOM 1430 O LEU A 100 7.106 4.518 -10.804 1.00 0.00 O ATOM 1431 CB LEU A 100 8.560 4.521 -8.048 1.00 0.00 C ATOM 1432 CG LEU A 100 8.332 3.491 -6.941 1.00 0.00 C ATOM 1433 CD1 LEU A 100 7.515 2.319 -7.463 1.00 0.00 C ATOM 1434 CD2 LEU A 100 9.662 3.008 -6.380 1.00 0.00 C ATOM 0 H LEU A 100 9.754 5.880 -9.768 1.00 0.00 H new ATOM 0 HA LEU A 100 9.552 3.047 -9.256 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.325 5.222 -7.713 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.641 5.092 -8.181 1.00 0.00 H new ATOM 0 HG LEU A 100 7.773 3.968 -6.136 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.363 1.596 -6.662 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.548 2.678 -7.816 1.00 0.00 H new ATOM 0 HD13 LEU A 100 8.048 1.842 -8.286 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.481 2.276 -5.593 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.247 2.548 -7.176 1.00 0.00 H new ATOM 0 HD23 LEU A 100 10.212 3.854 -5.968 1.00 0.00 H new ATOM 1446 N THR A 101 7.414 2.344 -10.308 1.00 0.00 N ATOM 1447 CA THR A 101 6.255 1.894 -11.068 1.00 0.00 C ATOM 1448 C THR A 101 5.132 1.442 -10.141 1.00 0.00 C ATOM 1449 O THR A 101 5.206 0.374 -9.533 1.00 0.00 O ATOM 1450 CB THR A 101 6.620 0.736 -12.015 1.00 0.00 C ATOM 1451 OG1 THR A 101 7.815 1.053 -12.738 1.00 0.00 O ATOM 1452 CG2 THR A 101 5.488 0.459 -12.993 1.00 0.00 C ATOM 0 H THR A 101 7.932 1.596 -9.846 1.00 0.00 H new ATOM 0 HA THR A 101 5.915 2.744 -11.659 1.00 0.00 H new ATOM 0 HB THR A 101 6.786 -0.158 -11.413 1.00 0.00 H new ATOM 0 HG1 THR A 101 8.596 0.875 -12.173 1.00 0.00 H new ATOM 0 HG21 THR A 101 5.769 -0.363 -13.652 1.00 0.00 H new ATOM 0 HG22 THR A 101 4.588 0.190 -12.441 1.00 0.00 H new ATOM 0 HG23 THR A 101 5.295 1.351 -13.588 1.00 0.00 H new ATOM 1460 N LEU A 102 4.091 2.262 -10.038 1.00 0.00 N ATOM 1461 CA LEU A 102 2.950 1.946 -9.185 1.00 0.00 C ATOM 1462 C LEU A 102 1.679 1.789 -10.013 1.00 0.00 C ATOM 1463 O LEU A 102 1.589 2.289 -11.134 1.00 0.00 O ATOM 1464 CB LEU A 102 2.756 3.040 -8.133 1.00 0.00 C ATOM 1465 CG LEU A 102 4.026 3.541 -7.444 1.00 0.00 C ATOM 1466 CD1 LEU A 102 4.695 4.622 -8.278 1.00 0.00 C ATOM 1467 CD2 LEU A 102 3.706 4.061 -6.050 1.00 0.00 C ATOM 0 H LEU A 102 4.014 3.150 -10.534 1.00 0.00 H new ATOM 0 HA LEU A 102 3.154 1.000 -8.683 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.265 3.889 -8.607 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.076 2.665 -7.369 1.00 0.00 H new ATOM 0 HG LEU A 102 4.719 2.705 -7.348 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.597 4.966 -7.772 1.00 0.00 H new ATOM 0 HD12 LEU A 102 4.959 4.217 -9.255 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.009 5.459 -8.406 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.621 4.413 -5.574 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.995 4.884 -6.123 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.273 3.259 -5.453 1.00 0.00 H new ATOM 1479 N VAL A 103 0.695 1.092 -9.451 1.00 0.00 N ATOM 1480 CA VAL A 103 -0.573 0.872 -10.136 1.00 0.00 C ATOM 1481 C VAL A 103 -1.745 0.968 -9.165 1.00 0.00 C ATOM 1482 O VAL A 103 -1.907 0.121 -8.286 1.00 0.00 O ATOM 1483 CB VAL A 103 -0.605 -0.503 -10.829 1.00 0.00 C ATOM 1484 CG1 VAL A 103 -0.223 -1.603 -9.851 1.00 0.00 C ATOM 1485 CG2 VAL A 103 -1.979 -0.765 -11.429 1.00 0.00 C ATOM 0 H VAL A 103 0.752 0.671 -8.524 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.666 1.653 -10.891 1.00 0.00 H new ATOM 0 HB VAL A 103 0.125 -0.500 -11.638 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.251 -2.567 -10.359 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.783 -1.421 -9.474 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -0.927 -1.610 -9.019 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.984 -1.741 -11.915 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.730 -0.749 -10.639 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.209 0.007 -12.163 1.00 0.00 H new ATOM 1495 N ARG A 104 -2.560 2.004 -9.331 1.00 0.00 N ATOM 1496 CA ARG A 104 -3.718 2.211 -8.469 1.00 0.00 C ATOM 1497 C ARG A 104 -5.016 2.045 -9.253 1.00 0.00 C ATOM 1498 O ARG A 104 -5.048 2.241 -10.469 1.00 0.00 O ATOM 1499 CB ARG A 104 -3.666 3.602 -7.835 1.00 0.00 C ATOM 1500 CG ARG A 104 -3.692 4.734 -8.849 1.00 0.00 C ATOM 1501 CD ARG A 104 -2.941 5.955 -8.340 1.00 0.00 C ATOM 1502 NE ARG A 104 -3.656 6.626 -7.257 1.00 0.00 N ATOM 1503 CZ ARG A 104 -3.067 7.419 -6.369 1.00 0.00 C ATOM 1504 NH1 ARG A 104 -1.762 7.641 -6.436 1.00 0.00 N ATOM 1505 NH2 ARG A 104 -3.785 7.994 -5.413 1.00 0.00 N ATOM 0 H ARG A 104 -2.440 2.713 -10.054 1.00 0.00 H new ATOM 0 HA ARG A 104 -3.692 1.459 -7.680 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -4.511 3.714 -7.156 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -2.761 3.685 -7.234 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -3.247 4.396 -9.785 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -4.725 5.005 -9.067 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -1.954 5.653 -7.990 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -2.788 6.655 -9.162 1.00 0.00 H new ATOM 0 HE ARG A 104 -4.662 6.477 -7.179 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -1.207 7.202 -7.171 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -1.313 8.250 -5.753 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -4.790 7.827 -5.360 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -3.332 8.603 -4.731 1.00 0.00 H new ATOM 1519 N ARG A 105 -6.084 1.683 -8.550 1.00 0.00 N ATOM 1520 CA ARG A 105 -7.384 1.490 -9.181 1.00 0.00 C ATOM 1521 C ARG A 105 -7.876 2.784 -9.822 1.00 0.00 C ATOM 1522 O ARG A 105 -7.940 3.827 -9.171 1.00 0.00 O ATOM 1523 CB ARG A 105 -8.405 0.998 -8.153 1.00 0.00 C ATOM 1524 CG ARG A 105 -9.640 0.366 -8.775 1.00 0.00 C ATOM 1525 CD ARG A 105 -10.340 -0.566 -7.799 1.00 0.00 C ATOM 1526 NE ARG A 105 -11.188 0.162 -6.859 1.00 0.00 N ATOM 1527 CZ ARG A 105 -12.228 -0.380 -6.236 1.00 0.00 C ATOM 1528 NH1 ARG A 105 -12.547 -1.649 -6.451 1.00 0.00 N ATOM 1529 NH2 ARG A 105 -12.952 0.347 -5.394 1.00 0.00 N ATOM 0 H ARG A 105 -6.075 1.517 -7.544 1.00 0.00 H new ATOM 0 HA ARG A 105 -7.272 0.738 -9.962 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -7.926 0.271 -7.497 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.712 1.837 -7.528 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -10.330 1.148 -9.092 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -9.355 -0.189 -9.669 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -10.946 -1.283 -8.353 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -9.595 -1.138 -7.247 1.00 0.00 H new ATOM 0 HE ARG A 105 -10.970 1.140 -6.671 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -11.993 -2.212 -7.096 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -13.346 -2.062 -5.971 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -12.710 1.323 -5.225 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.751 -0.071 -4.916 1.00 0.00 H new ATOM 1543 N LYS A 106 -8.221 2.710 -11.103 1.00 0.00 N ATOM 1544 CA LYS A 106 -8.707 3.874 -11.834 1.00 0.00 C ATOM 1545 C LYS A 106 -10.015 4.384 -11.236 1.00 0.00 C ATOM 1546 O LYS A 106 -10.620 3.729 -10.387 1.00 0.00 O ATOM 1547 CB LYS A 106 -8.910 3.527 -13.310 1.00 0.00 C ATOM 1548 CG LYS A 106 -7.624 3.157 -14.030 1.00 0.00 C ATOM 1549 CD LYS A 106 -7.898 2.301 -15.255 1.00 0.00 C ATOM 1550 CE LYS A 106 -6.803 2.457 -16.299 1.00 0.00 C ATOM 1551 NZ LYS A 106 -7.114 1.703 -17.546 1.00 0.00 N ATOM 0 H LYS A 106 -8.173 1.855 -11.657 1.00 0.00 H new ATOM 0 HA LYS A 106 -7.958 4.662 -11.752 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.611 2.696 -13.386 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.368 4.378 -13.815 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.099 4.064 -14.329 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -6.966 2.618 -13.348 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -7.974 1.255 -14.960 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -8.858 2.581 -15.688 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.675 3.513 -16.536 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -5.857 2.105 -15.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -6.258 1.635 -18.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -7.443 0.747 -17.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -7.858 2.200 -18.076 1.00 0.00 H new ATOM 1565 N THR A 107 -10.449 5.557 -11.687 1.00 0.00 N ATOM 1566 CA THR A 107 -11.685 6.155 -11.198 1.00 0.00 C ATOM 1567 C THR A 107 -11.572 6.522 -9.722 1.00 0.00 C ATOM 1568 O THR A 107 -12.473 6.241 -8.932 1.00 0.00 O ATOM 1569 CB THR A 107 -12.882 5.204 -11.388 1.00 0.00 C ATOM 1570 OG1 THR A 107 -12.744 4.483 -12.618 1.00 0.00 O ATOM 1571 CG2 THR A 107 -14.192 5.978 -11.393 1.00 0.00 C ATOM 0 H THR A 107 -9.962 6.112 -12.391 1.00 0.00 H new ATOM 0 HA THR A 107 -11.852 7.059 -11.783 1.00 0.00 H new ATOM 0 HB THR A 107 -12.896 4.502 -10.555 1.00 0.00 H new ATOM 0 HG1 THR A 107 -13.508 3.879 -12.731 1.00 0.00 H new ATOM 0 HG21 THR A 107 -15.023 5.286 -11.529 1.00 0.00 H new ATOM 0 HG22 THR A 107 -14.308 6.503 -10.445 1.00 0.00 H new ATOM 0 HG23 THR A 107 -14.185 6.700 -12.209 1.00 0.00 H new ATOM 1579 N SER A 108 -10.459 7.151 -9.358 1.00 0.00 N ATOM 1580 CA SER A 108 -10.227 7.554 -7.976 1.00 0.00 C ATOM 1581 C SER A 108 -9.864 9.034 -7.895 1.00 0.00 C ATOM 1582 O SER A 108 -9.735 9.709 -8.915 1.00 0.00 O ATOM 1583 CB SER A 108 -9.112 6.709 -7.356 1.00 0.00 C ATOM 1584 OG SER A 108 -9.231 6.664 -5.945 1.00 0.00 O ATOM 0 H SER A 108 -9.704 7.392 -10.000 1.00 0.00 H new ATOM 0 HA SER A 108 -11.149 7.393 -7.417 1.00 0.00 H new ATOM 0 HB2 SER A 108 -9.151 5.697 -7.760 1.00 0.00 H new ATOM 0 HB3 SER A 108 -8.142 7.124 -7.629 1.00 0.00 H new ATOM 0 HG SER A 108 -8.508 6.117 -5.573 1.00 0.00 H new ATOM 1590 N SER A 109 -9.700 9.531 -6.673 1.00 0.00 N ATOM 1591 CA SER A 109 -9.356 10.931 -6.457 1.00 0.00 C ATOM 1592 C SER A 109 -8.422 11.436 -7.552 1.00 0.00 C ATOM 1593 O SER A 109 -8.583 12.547 -8.057 1.00 0.00 O ATOM 1594 CB SER A 109 -8.698 11.111 -5.087 1.00 0.00 C ATOM 1595 OG SER A 109 -7.483 10.385 -5.006 1.00 0.00 O ATOM 0 H SER A 109 -9.800 8.985 -5.818 1.00 0.00 H new ATOM 0 HA SER A 109 -10.276 11.515 -6.490 1.00 0.00 H new ATOM 0 HB2 SER A 109 -8.506 12.169 -4.908 1.00 0.00 H new ATOM 0 HB3 SER A 109 -9.379 10.774 -4.306 1.00 0.00 H new ATOM 0 HG SER A 109 -7.081 10.517 -4.122 1.00 0.00 H new ATOM 1601 N SER A 110 -7.445 10.611 -7.915 1.00 0.00 N ATOM 1602 CA SER A 110 -6.482 10.974 -8.949 1.00 0.00 C ATOM 1603 C SER A 110 -7.184 11.605 -10.148 1.00 0.00 C ATOM 1604 O SER A 110 -8.408 11.549 -10.266 1.00 0.00 O ATOM 1605 CB SER A 110 -5.693 9.742 -9.395 1.00 0.00 C ATOM 1606 OG SER A 110 -4.613 9.482 -8.515 1.00 0.00 O ATOM 0 H SER A 110 -7.299 9.687 -7.509 1.00 0.00 H new ATOM 0 HA SER A 110 -5.792 11.706 -8.528 1.00 0.00 H new ATOM 0 HB2 SER A 110 -6.354 8.876 -9.430 1.00 0.00 H new ATOM 0 HB3 SER A 110 -5.314 9.895 -10.405 1.00 0.00 H new ATOM 0 HG SER A 110 -4.125 8.689 -8.821 1.00 0.00 H new ATOM 1612 N THR A 111 -6.398 12.206 -11.036 1.00 0.00 N ATOM 1613 CA THR A 111 -6.942 12.849 -12.225 1.00 0.00 C ATOM 1614 C THR A 111 -6.745 11.977 -13.460 1.00 0.00 C ATOM 1615 O THR A 111 -5.784 11.214 -13.546 1.00 0.00 O ATOM 1616 CB THR A 111 -6.288 14.222 -12.471 1.00 0.00 C ATOM 1617 OG1 THR A 111 -6.877 14.847 -13.616 1.00 0.00 O ATOM 1618 CG2 THR A 111 -4.789 14.077 -12.680 1.00 0.00 C ATOM 0 H THR A 111 -5.383 12.261 -10.954 1.00 0.00 H new ATOM 0 HA THR A 111 -8.008 12.989 -12.048 1.00 0.00 H new ATOM 0 HB THR A 111 -6.457 14.844 -11.592 1.00 0.00 H new ATOM 0 HG1 THR A 111 -6.457 15.720 -13.765 1.00 0.00 H new ATOM 0 HG21 THR A 111 -4.349 15.059 -12.852 1.00 0.00 H new ATOM 0 HG22 THR A 111 -4.340 13.628 -11.794 1.00 0.00 H new ATOM 0 HG23 THR A 111 -4.602 13.439 -13.544 1.00 0.00 H new ATOM 1626 N SER A 112 -7.662 12.096 -14.415 1.00 0.00 N ATOM 1627 CA SER A 112 -7.591 11.316 -15.645 1.00 0.00 C ATOM 1628 C SER A 112 -6.154 11.228 -16.150 1.00 0.00 C ATOM 1629 O SER A 112 -5.332 12.115 -15.918 1.00 0.00 O ATOM 1630 CB SER A 112 -8.484 11.937 -16.721 1.00 0.00 C ATOM 1631 OG SER A 112 -9.826 12.034 -16.276 1.00 0.00 O ATOM 0 H SER A 112 -8.463 12.725 -14.360 1.00 0.00 H new ATOM 0 HA SER A 112 -7.944 10.308 -15.427 1.00 0.00 H new ATOM 0 HB2 SER A 112 -8.111 12.928 -16.980 1.00 0.00 H new ATOM 0 HB3 SER A 112 -8.441 11.333 -17.627 1.00 0.00 H new ATOM 0 HG SER A 112 -10.376 12.435 -16.981 1.00 0.00 H new ATOM 1637 N PRO A 113 -5.842 10.132 -16.857 1.00 0.00 N ATOM 1638 CA PRO A 113 -4.504 9.901 -17.411 1.00 0.00 C ATOM 1639 C PRO A 113 -4.178 10.853 -18.557 1.00 0.00 C ATOM 1640 O PRO A 113 -4.882 11.839 -18.777 1.00 0.00 O ATOM 1641 CB PRO A 113 -4.574 8.458 -17.917 1.00 0.00 C ATOM 1642 CG PRO A 113 -6.020 8.222 -18.191 1.00 0.00 C ATOM 1643 CD PRO A 113 -6.771 9.034 -17.172 1.00 0.00 C ATOM 0 HA PRO A 113 -3.722 10.070 -16.671 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -3.974 8.325 -18.817 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -4.193 7.759 -17.173 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -6.281 8.529 -19.204 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -6.266 7.164 -18.105 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -7.714 9.408 -17.572 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -7.011 8.445 -16.287 1.00 0.00 H new ATOM 1651 N LEU A 114 -3.108 10.551 -19.284 1.00 0.00 N ATOM 1652 CA LEU A 114 -2.689 11.380 -20.408 1.00 0.00 C ATOM 1653 C LEU A 114 -3.220 10.821 -21.725 1.00 0.00 C ATOM 1654 O LEU A 114 -3.926 11.508 -22.462 1.00 0.00 O ATOM 1655 CB LEU A 114 -1.163 11.473 -20.459 1.00 0.00 C ATOM 1656 CG LEU A 114 -0.476 11.939 -19.175 1.00 0.00 C ATOM 1657 CD1 LEU A 114 1.029 11.745 -19.273 1.00 0.00 C ATOM 1658 CD2 LEU A 114 -0.811 13.396 -18.890 1.00 0.00 C ATOM 0 H LEU A 114 -2.515 9.738 -19.115 1.00 0.00 H new ATOM 0 HA LEU A 114 -3.103 12.378 -20.265 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -0.768 10.492 -20.723 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -0.887 12.155 -21.263 1.00 0.00 H new ATOM 0 HG LEU A 114 -0.846 11.333 -18.348 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.500 12.082 -18.350 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.250 10.689 -19.429 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.417 12.324 -20.111 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -0.314 13.711 -17.973 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -0.470 14.017 -19.719 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -1.889 13.505 -18.774 1.00 0.00 H new ATOM 1670 N GLU A 115 -2.875 9.569 -22.011 1.00 0.00 N ATOM 1671 CA GLU A 115 -3.319 8.918 -23.238 1.00 0.00 C ATOM 1672 C GLU A 115 -3.870 7.525 -22.946 1.00 0.00 C ATOM 1673 O GLU A 115 -3.244 6.507 -23.243 1.00 0.00 O ATOM 1674 CB GLU A 115 -2.164 8.822 -24.237 1.00 0.00 C ATOM 1675 CG GLU A 115 -2.547 8.160 -25.550 1.00 0.00 C ATOM 1676 CD GLU A 115 -3.079 9.149 -26.569 1.00 0.00 C ATOM 1677 OE1 GLU A 115 -2.260 9.838 -27.212 1.00 0.00 O ATOM 1678 OE2 GLU A 115 -4.316 9.234 -26.723 1.00 0.00 O ATOM 0 H GLU A 115 -2.291 8.987 -21.411 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.116 9.522 -23.672 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -1.788 9.824 -24.442 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -1.347 8.262 -23.782 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -1.676 7.651 -25.963 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -3.302 7.397 -25.361 1.00 0.00 H new ATOM 1685 N PRO A 116 -5.071 7.478 -22.350 1.00 0.00 N ATOM 1686 CA PRO A 116 -5.733 6.216 -22.005 1.00 0.00 C ATOM 1687 C PRO A 116 -6.206 5.453 -23.237 1.00 0.00 C ATOM 1688 O PRO A 116 -6.573 6.038 -24.257 1.00 0.00 O ATOM 1689 CB PRO A 116 -6.930 6.664 -21.162 1.00 0.00 C ATOM 1690 CG PRO A 116 -7.208 8.058 -21.608 1.00 0.00 C ATOM 1691 CD PRO A 116 -5.874 8.651 -21.969 1.00 0.00 C ATOM 0 HA PRO A 116 -5.061 5.531 -21.488 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -7.792 6.017 -21.324 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -6.700 6.628 -20.097 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -7.883 8.067 -22.464 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -7.689 8.632 -20.816 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -5.960 9.363 -22.790 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -5.431 9.185 -21.128 1.00 0.00 H new ATOM 1699 N PRO A 117 -6.198 4.115 -23.145 1.00 0.00 N ATOM 1700 CA PRO A 117 -6.624 3.243 -24.243 1.00 0.00 C ATOM 1701 C PRO A 117 -8.127 3.315 -24.491 1.00 0.00 C ATOM 1702 O PRO A 117 -8.878 3.829 -23.663 1.00 0.00 O ATOM 1703 CB PRO A 117 -6.228 1.845 -23.761 1.00 0.00 C ATOM 1704 CG PRO A 117 -6.214 1.948 -22.275 1.00 0.00 C ATOM 1705 CD PRO A 117 -5.773 3.350 -21.960 1.00 0.00 C ATOM 0 HA PRO A 117 -6.166 3.528 -25.190 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -6.941 1.093 -24.099 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.251 1.555 -24.147 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -7.202 1.748 -21.861 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -5.532 1.218 -21.840 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -6.243 3.724 -21.050 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -4.695 3.408 -21.809 1.00 0.00 H new ATOM 1713 N SER A 118 -8.559 2.796 -25.636 1.00 0.00 N ATOM 1714 CA SER A 118 -9.972 2.804 -25.994 1.00 0.00 C ATOM 1715 C SER A 118 -10.437 1.411 -26.407 1.00 0.00 C ATOM 1716 O SER A 118 -9.712 0.677 -27.080 1.00 0.00 O ATOM 1717 CB SER A 118 -10.227 3.797 -27.130 1.00 0.00 C ATOM 1718 OG SER A 118 -10.455 5.101 -26.626 1.00 0.00 O ATOM 0 H SER A 118 -7.950 2.365 -26.332 1.00 0.00 H new ATOM 0 HA SER A 118 -10.541 3.112 -25.117 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.371 3.809 -27.805 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.089 3.473 -27.713 1.00 0.00 H new ATOM 0 HG SER A 118 -10.614 5.717 -27.372 1.00 0.00 H new ATOM 1724 N ASP A 119 -11.649 1.053 -25.999 1.00 0.00 N ATOM 1725 CA ASP A 119 -12.212 -0.252 -26.326 1.00 0.00 C ATOM 1726 C ASP A 119 -12.909 -0.218 -27.683 1.00 0.00 C ATOM 1727 O ASP A 119 -14.132 -0.100 -27.761 1.00 0.00 O ATOM 1728 CB ASP A 119 -13.198 -0.692 -25.243 1.00 0.00 C ATOM 1729 CG ASP A 119 -12.537 -0.855 -23.889 1.00 0.00 C ATOM 1730 OD1 ASP A 119 -11.614 -1.689 -23.776 1.00 0.00 O ATOM 1731 OD2 ASP A 119 -12.941 -0.147 -22.943 1.00 0.00 O ATOM 0 H ASP A 119 -12.261 1.648 -25.441 1.00 0.00 H new ATOM 0 HA ASP A 119 -11.394 -0.971 -26.375 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -14.000 0.042 -25.166 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -13.657 -1.636 -25.536 1.00 0.00 H new ATOM 1736 N ARG A 120 -12.122 -0.321 -28.749 1.00 0.00 N ATOM 1737 CA ARG A 120 -12.663 -0.300 -30.103 1.00 0.00 C ATOM 1738 C ARG A 120 -13.336 -1.628 -30.440 1.00 0.00 C ATOM 1739 O ARG A 120 -12.885 -2.690 -30.013 1.00 0.00 O ATOM 1740 CB ARG A 120 -11.554 -0.006 -31.114 1.00 0.00 C ATOM 1741 CG ARG A 120 -10.625 -1.185 -31.358 1.00 0.00 C ATOM 1742 CD ARG A 120 -9.540 -1.268 -30.296 1.00 0.00 C ATOM 1743 NE ARG A 120 -8.360 -1.983 -30.774 1.00 0.00 N ATOM 1744 CZ ARG A 120 -7.146 -1.829 -30.257 1.00 0.00 C ATOM 1745 NH1 ARG A 120 -6.954 -0.988 -29.249 1.00 0.00 N ATOM 1746 NH2 ARG A 120 -6.122 -2.515 -30.746 1.00 0.00 N ATOM 0 H ARG A 120 -11.108 -0.420 -28.701 1.00 0.00 H new ATOM 0 HA ARG A 120 -13.412 0.491 -30.156 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -12.006 0.292 -32.060 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -10.967 0.842 -30.761 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -11.202 -2.110 -31.363 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -10.166 -1.090 -32.342 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -9.255 -0.262 -29.990 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -9.935 -1.770 -29.413 1.00 0.00 H new ATOM 0 HE ARG A 120 -8.474 -2.637 -31.548 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -7.739 -0.459 -28.870 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -6.021 -0.871 -28.853 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -6.265 -3.163 -31.521 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -5.191 -2.395 -30.347 1.00 0.00 H new ATOM 1760 N GLY A 121 -14.417 -1.559 -31.211 1.00 0.00 N ATOM 1761 CA GLY A 121 -15.134 -2.761 -31.592 1.00 0.00 C ATOM 1762 C GLY A 121 -14.661 -3.323 -32.918 1.00 0.00 C ATOM 1763 O GLY A 121 -15.469 -3.647 -33.788 1.00 0.00 O ATOM 0 H GLY A 121 -14.809 -0.692 -31.578 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -15.009 -3.516 -30.816 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -16.200 -2.540 -31.654 1.00 0.00 H new ATOM 1767 N THR A 122 -13.345 -3.437 -33.075 1.00 0.00 N ATOM 1768 CA THR A 122 -12.765 -3.960 -34.305 1.00 0.00 C ATOM 1769 C THR A 122 -13.598 -3.562 -35.518 1.00 0.00 C ATOM 1770 O THR A 122 -13.787 -4.355 -36.441 1.00 0.00 O ATOM 1771 CB THR A 122 -12.644 -5.495 -34.261 1.00 0.00 C ATOM 1772 OG1 THR A 122 -11.972 -5.968 -35.434 1.00 0.00 O ATOM 1773 CG2 THR A 122 -14.017 -6.144 -34.160 1.00 0.00 C ATOM 0 H THR A 122 -12.662 -3.174 -32.365 1.00 0.00 H new ATOM 0 HA THR A 122 -11.769 -3.527 -34.394 1.00 0.00 H new ATOM 0 HB THR A 122 -12.066 -5.766 -33.378 1.00 0.00 H new ATOM 0 HG1 THR A 122 -12.378 -5.563 -36.229 1.00 0.00 H new ATOM 0 HG21 THR A 122 -13.906 -7.228 -34.130 1.00 0.00 H new ATOM 0 HG22 THR A 122 -14.514 -5.805 -33.251 1.00 0.00 H new ATOM 0 HG23 THR A 122 -14.616 -5.864 -35.026 1.00 0.00 H new ATOM 1781 N VAL A 123 -14.093 -2.329 -35.512 1.00 0.00 N ATOM 1782 CA VAL A 123 -14.904 -1.825 -36.613 1.00 0.00 C ATOM 1783 C VAL A 123 -14.033 -1.196 -37.695 1.00 0.00 C ATOM 1784 O VAL A 123 -13.019 -0.563 -37.399 1.00 0.00 O ATOM 1785 CB VAL A 123 -15.929 -0.784 -36.125 1.00 0.00 C ATOM 1786 CG1 VAL A 123 -15.235 0.329 -35.354 1.00 0.00 C ATOM 1787 CG2 VAL A 123 -16.716 -0.220 -37.299 1.00 0.00 C ATOM 0 H VAL A 123 -13.946 -1.660 -34.756 1.00 0.00 H new ATOM 0 HA VAL A 123 -15.436 -2.680 -37.031 1.00 0.00 H new ATOM 0 HB VAL A 123 -16.629 -1.278 -35.451 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -15.975 1.055 -35.017 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -14.721 -0.093 -34.490 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -14.511 0.823 -36.001 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -17.435 0.514 -36.936 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -16.032 0.259 -37.999 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -17.245 -1.028 -37.804 1.00 0.00 H new ATOM 1797 N SER A 124 -14.436 -1.373 -38.949 1.00 0.00 N ATOM 1798 CA SER A 124 -13.690 -0.825 -40.076 1.00 0.00 C ATOM 1799 C SER A 124 -14.237 0.541 -40.476 1.00 0.00 C ATOM 1800 O SER A 124 -14.398 0.836 -41.660 1.00 0.00 O ATOM 1801 CB SER A 124 -13.751 -1.782 -41.268 1.00 0.00 C ATOM 1802 OG SER A 124 -15.073 -1.891 -41.766 1.00 0.00 O ATOM 0 H SER A 124 -15.275 -1.891 -39.210 1.00 0.00 H new ATOM 0 HA SER A 124 -12.651 -0.705 -39.769 1.00 0.00 H new ATOM 0 HB2 SER A 124 -13.089 -1.427 -42.058 1.00 0.00 H new ATOM 0 HB3 SER A 124 -13.390 -2.766 -40.968 1.00 0.00 H new ATOM 0 HG SER A 124 -15.371 -1.018 -42.098 1.00 0.00 H new ATOM 1808 N GLY A 125 -14.521 1.374 -39.479 1.00 0.00 N ATOM 1809 CA GLY A 125 -15.047 2.700 -39.747 1.00 0.00 C ATOM 1810 C GLY A 125 -16.562 2.724 -39.790 1.00 0.00 C ATOM 1811 O GLY A 125 -17.232 1.782 -39.367 1.00 0.00 O ATOM 0 H GLY A 125 -14.396 1.154 -38.491 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -14.697 3.389 -38.978 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -14.654 3.058 -40.698 1.00 0.00 H new ATOM 1815 N PRO A 126 -17.125 3.825 -40.311 1.00 0.00 N ATOM 1816 CA PRO A 126 -18.577 3.996 -40.419 1.00 0.00 C ATOM 1817 C PRO A 126 -19.194 3.068 -41.460 1.00 0.00 C ATOM 1818 O PRO A 126 -20.402 3.099 -41.694 1.00 0.00 O ATOM 1819 CB PRO A 126 -18.732 5.457 -40.846 1.00 0.00 C ATOM 1820 CG PRO A 126 -17.451 5.789 -41.532 1.00 0.00 C ATOM 1821 CD PRO A 126 -16.388 4.987 -40.835 1.00 0.00 C ATOM 0 HA PRO A 126 -19.086 3.755 -39.486 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -19.584 5.586 -41.514 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -18.900 6.105 -39.986 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -17.499 5.536 -42.591 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -17.239 6.856 -41.468 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -15.598 4.685 -41.522 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -15.915 5.557 -40.035 1.00 0.00 H new ATOM 1829 N SER A 127 -18.357 2.244 -42.082 1.00 0.00 N ATOM 1830 CA SER A 127 -18.820 1.310 -43.101 1.00 0.00 C ATOM 1831 C SER A 127 -20.001 0.490 -42.590 1.00 0.00 C ATOM 1832 O SER A 127 -20.781 -0.051 -43.374 1.00 0.00 O ATOM 1833 CB SER A 127 -17.682 0.378 -43.524 1.00 0.00 C ATOM 1834 OG SER A 127 -17.033 -0.179 -42.394 1.00 0.00 O ATOM 0 H SER A 127 -17.355 2.204 -41.898 1.00 0.00 H new ATOM 0 HA SER A 127 -19.148 1.887 -43.966 1.00 0.00 H new ATOM 0 HB2 SER A 127 -18.076 -0.421 -44.152 1.00 0.00 H new ATOM 0 HB3 SER A 127 -16.961 0.930 -44.127 1.00 0.00 H new ATOM 0 HG SER A 127 -17.241 -1.135 -42.335 1.00 0.00 H new ATOM 1840 N SER A 128 -20.125 0.402 -41.270 1.00 0.00 N ATOM 1841 CA SER A 128 -21.208 -0.355 -40.652 1.00 0.00 C ATOM 1842 C SER A 128 -21.713 0.347 -39.396 1.00 0.00 C ATOM 1843 O SER A 128 -21.046 1.226 -38.851 1.00 0.00 O ATOM 1844 CB SER A 128 -20.737 -1.769 -40.307 1.00 0.00 C ATOM 1845 OG SER A 128 -21.815 -2.568 -39.851 1.00 0.00 O ATOM 0 H SER A 128 -19.489 0.845 -40.607 1.00 0.00 H new ATOM 0 HA SER A 128 -22.029 -0.418 -41.366 1.00 0.00 H new ATOM 0 HB2 SER A 128 -20.285 -2.230 -41.185 1.00 0.00 H new ATOM 0 HB3 SER A 128 -19.965 -1.721 -39.539 1.00 0.00 H new ATOM 0 HG SER A 128 -21.489 -3.467 -39.639 1.00 0.00 H new ATOM 1851 N GLY A 129 -22.898 -0.048 -38.940 1.00 0.00 N ATOM 1852 CA GLY A 129 -23.474 0.552 -37.751 1.00 0.00 C ATOM 1853 C GLY A 129 -23.135 2.024 -37.622 1.00 0.00 C ATOM 1854 O GLY A 129 -22.650 2.467 -36.581 1.00 0.00 O ATOM 0 H GLY A 129 -23.469 -0.773 -39.373 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -24.557 0.433 -37.776 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -23.115 0.021 -36.869 1.00 0.00 H new TER 1858 GLY A 129