USER MOD reduce.3.24.130724 H: found=0, std=0, add=967, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 965 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 91 ASN : amide:sc= -0.119 K(o=-0.12,f=-2.9!) USER MOD Set 1.2: A 110 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 98 THR OG1 : rot 160:sc= -0.145 USER MOD Set 2.2: A 100 ASN : amide:sc= 0 X(o=-0.15,f=-0.24) USER MOD Set 3.1: A 76 GLN : amide:sc= -0.715 X(o=-2.2,f=-1.8) USER MOD Set 3.2: A 79 GLN : amide:sc= -1.53 K(o=-2.2,f=-3.4) USER MOD Set 4.1: A 58 TYR OH : rot 180:sc= -0.0141 USER MOD Set 4.2: A 68 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 31 ASN :FLIP amide:sc= -1.86! F(o=-2.5,f=-1.7!) USER MOD Set 5.2: A 34 SER OG : rot -133:sc= 0.165 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -170:sc= -0.2 USER MOD Single : A 19 SER OG : rot -54:sc= 0.0119 USER MOD Single : A 23 GLN : amide:sc= -0.149 X(o=-0.15,f=0) USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 62:sc= 1.25 USER MOD Single : A 32 SER OG : rot -89:sc= 0.0124 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 HIS : no HD1:sc= -0.703 K(o=-0.7,f=-2) USER MOD Single : A 40 GLN : amide:sc= -0.316 K(o=-0.32,f=-2) USER MOD Single : A 46 THR OG1 : rot 22:sc= 0.692 USER MOD Single : A 47 GLN : amide:sc= -0.0201 K(o=-0.02,f=-0.75) USER MOD Single : A 48 ASN : amide:sc= -1.72 K(o=-1.7,f=-5.5!) USER MOD Single : A 50 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 52 THR OG1 : rot -53:sc= 0.169 USER MOD Single : A 54 TYR OH : rot 180:sc= -0.135 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -170:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 THR OG1 : rot -52:sc= 1.19 USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot 74:sc= 0.676 USER MOD Single : A 90 TYR OH : rot -15:sc= 0.115 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot -160:sc= 0.914 USER MOD Single : A 113 THR OG1 : rot -173:sc= 1.57 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -36.754 3.159 -34.254 1.00 0.00 N ATOM 2 CA GLY A 1 -37.311 2.560 -33.055 1.00 0.00 C ATOM 3 C GLY A 1 -36.369 2.647 -31.871 1.00 0.00 C ATOM 4 O GLY A 1 -36.759 3.088 -30.790 1.00 0.00 O ATOM 0 H1 GLY A 1 -37.437 3.074 -35.034 1.00 0.00 H new ATOM 0 H2 GLY A 1 -36.553 4.164 -34.079 1.00 0.00 H new ATOM 0 H3 GLY A 1 -35.873 2.669 -34.510 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -38.249 3.057 -32.806 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -37.547 1.514 -33.251 1.00 0.00 H new ATOM 8 N SER A 2 -35.125 2.226 -32.075 1.00 0.00 N ATOM 9 CA SER A 2 -34.125 2.253 -31.014 1.00 0.00 C ATOM 10 C SER A 2 -34.152 3.588 -30.276 1.00 0.00 C ATOM 11 O SER A 2 -34.354 4.641 -30.882 1.00 0.00 O ATOM 12 CB SER A 2 -32.730 2.005 -31.591 1.00 0.00 C ATOM 13 OG SER A 2 -32.503 0.621 -31.797 1.00 0.00 O ATOM 0 H SER A 2 -34.785 1.862 -32.965 1.00 0.00 H new ATOM 0 HA SER A 2 -34.363 1.460 -30.305 1.00 0.00 H new ATOM 0 HB2 SER A 2 -32.623 2.539 -32.535 1.00 0.00 H new ATOM 0 HB3 SER A 2 -31.976 2.404 -30.912 1.00 0.00 H new ATOM 0 HG SER A 2 -31.606 0.488 -32.168 1.00 0.00 H new ATOM 19 N SER A 3 -33.947 3.537 -28.964 1.00 0.00 N ATOM 20 CA SER A 3 -33.951 4.741 -28.142 1.00 0.00 C ATOM 21 C SER A 3 -32.543 5.315 -28.011 1.00 0.00 C ATOM 22 O SER A 3 -31.572 4.716 -28.469 1.00 0.00 O ATOM 23 CB SER A 3 -34.520 4.435 -26.755 1.00 0.00 C ATOM 24 OG SER A 3 -33.655 3.583 -26.025 1.00 0.00 O ATOM 0 H SER A 3 -33.776 2.674 -28.447 1.00 0.00 H new ATOM 0 HA SER A 3 -34.583 5.483 -28.631 1.00 0.00 H new ATOM 0 HB2 SER A 3 -34.668 5.365 -26.206 1.00 0.00 H new ATOM 0 HB3 SER A 3 -35.498 3.965 -26.856 1.00 0.00 H new ATOM 0 HG SER A 3 -34.041 3.404 -25.142 1.00 0.00 H new ATOM 30 N GLY A 4 -32.443 6.482 -27.381 1.00 0.00 N ATOM 31 CA GLY A 4 -31.151 7.118 -27.201 1.00 0.00 C ATOM 32 C GLY A 4 -30.703 7.121 -25.753 1.00 0.00 C ATOM 33 O GLY A 4 -30.134 6.142 -25.270 1.00 0.00 O ATOM 0 H GLY A 4 -33.233 6.998 -26.993 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -30.407 6.601 -27.807 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -31.201 8.144 -27.565 1.00 0.00 H new ATOM 37 N SER A 5 -30.958 8.225 -25.058 1.00 0.00 N ATOM 38 CA SER A 5 -30.573 8.353 -23.658 1.00 0.00 C ATOM 39 C SER A 5 -29.098 8.013 -23.467 1.00 0.00 C ATOM 40 O SER A 5 -28.726 7.325 -22.517 1.00 0.00 O ATOM 41 CB SER A 5 -31.435 7.441 -22.784 1.00 0.00 C ATOM 42 OG SER A 5 -32.814 7.688 -22.994 1.00 0.00 O ATOM 0 H SER A 5 -31.430 9.044 -25.442 1.00 0.00 H new ATOM 0 HA SER A 5 -30.732 9.388 -23.357 1.00 0.00 H new ATOM 0 HB2 SER A 5 -31.211 6.398 -23.009 1.00 0.00 H new ATOM 0 HB3 SER A 5 -31.190 7.600 -21.734 1.00 0.00 H new ATOM 0 HG SER A 5 -33.344 7.091 -22.425 1.00 0.00 H new ATOM 48 N SER A 6 -28.262 8.500 -24.379 1.00 0.00 N ATOM 49 CA SER A 6 -26.828 8.245 -24.315 1.00 0.00 C ATOM 50 C SER A 6 -26.205 8.944 -23.111 1.00 0.00 C ATOM 51 O SER A 6 -26.590 10.057 -22.757 1.00 0.00 O ATOM 52 CB SER A 6 -26.146 8.716 -25.601 1.00 0.00 C ATOM 53 OG SER A 6 -24.802 8.273 -25.658 1.00 0.00 O ATOM 0 H SER A 6 -28.553 9.073 -25.171 1.00 0.00 H new ATOM 0 HA SER A 6 -26.680 7.171 -24.206 1.00 0.00 H new ATOM 0 HB2 SER A 6 -26.693 8.339 -26.465 1.00 0.00 H new ATOM 0 HB3 SER A 6 -26.176 9.804 -25.654 1.00 0.00 H new ATOM 0 HG SER A 6 -24.389 8.586 -26.490 1.00 0.00 H new ATOM 59 N GLY A 7 -25.238 8.280 -22.484 1.00 0.00 N ATOM 60 CA GLY A 7 -24.577 8.852 -21.325 1.00 0.00 C ATOM 61 C GLY A 7 -23.365 9.682 -21.701 1.00 0.00 C ATOM 62 O GLY A 7 -22.937 9.681 -22.855 1.00 0.00 O ATOM 0 H GLY A 7 -24.901 7.357 -22.758 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -25.284 9.475 -20.777 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -24.271 8.051 -20.653 1.00 0.00 H new ATOM 66 N ASP A 8 -22.813 10.394 -20.725 1.00 0.00 N ATOM 67 CA ASP A 8 -21.644 11.234 -20.958 1.00 0.00 C ATOM 68 C ASP A 8 -20.881 11.477 -19.660 1.00 0.00 C ATOM 69 O ASP A 8 -21.429 12.012 -18.696 1.00 0.00 O ATOM 70 CB ASP A 8 -22.063 12.569 -21.575 1.00 0.00 C ATOM 71 CG ASP A 8 -23.325 13.127 -20.945 1.00 0.00 C ATOM 72 OD1 ASP A 8 -23.217 13.815 -19.909 1.00 0.00 O ATOM 73 OD2 ASP A 8 -24.420 12.875 -21.490 1.00 0.00 O ATOM 0 H ASP A 8 -23.156 10.406 -19.765 1.00 0.00 H new ATOM 0 HA ASP A 8 -20.986 10.712 -21.653 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -21.253 13.290 -21.459 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -22.222 12.437 -22.645 1.00 0.00 H new ATOM 78 N VAL A 9 -19.613 11.079 -19.641 1.00 0.00 N ATOM 79 CA VAL A 9 -18.774 11.252 -18.461 1.00 0.00 C ATOM 80 C VAL A 9 -17.321 10.903 -18.764 1.00 0.00 C ATOM 81 O VAL A 9 -17.039 9.931 -19.463 1.00 0.00 O ATOM 82 CB VAL A 9 -19.266 10.383 -17.289 1.00 0.00 C ATOM 83 CG1 VAL A 9 -19.095 8.906 -17.611 1.00 0.00 C ATOM 84 CG2 VAL A 9 -18.529 10.748 -16.010 1.00 0.00 C ATOM 0 H VAL A 9 -19.144 10.634 -20.430 1.00 0.00 H new ATOM 0 HA VAL A 9 -18.841 12.302 -18.177 1.00 0.00 H new ATOM 0 HB VAL A 9 -20.328 10.576 -17.136 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -19.448 8.307 -16.771 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -19.673 8.658 -18.501 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -18.041 8.693 -17.791 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -18.889 10.124 -15.192 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -17.460 10.585 -16.147 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -18.709 11.797 -15.773 1.00 0.00 H new ATOM 94 N ALA A 10 -16.403 11.702 -18.231 1.00 0.00 N ATOM 95 CA ALA A 10 -14.978 11.476 -18.441 1.00 0.00 C ATOM 96 C ALA A 10 -14.187 11.731 -17.163 1.00 0.00 C ATOM 97 O ALA A 10 -14.401 12.730 -16.477 1.00 0.00 O ATOM 98 CB ALA A 10 -14.464 12.360 -19.567 1.00 0.00 C ATOM 0 H ALA A 10 -16.620 12.512 -17.650 1.00 0.00 H new ATOM 0 HA ALA A 10 -14.839 10.432 -18.721 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -13.399 12.181 -19.713 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -15.000 12.127 -20.487 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -14.624 13.407 -19.309 1.00 0.00 H new ATOM 104 N VAL A 11 -13.273 10.819 -16.846 1.00 0.00 N ATOM 105 CA VAL A 11 -12.449 10.945 -15.650 1.00 0.00 C ATOM 106 C VAL A 11 -11.422 12.062 -15.805 1.00 0.00 C ATOM 107 O VAL A 11 -10.301 11.830 -16.257 1.00 0.00 O ATOM 108 CB VAL A 11 -11.716 9.629 -15.332 1.00 0.00 C ATOM 109 CG1 VAL A 11 -12.599 8.712 -14.500 1.00 0.00 C ATOM 110 CG2 VAL A 11 -11.278 8.940 -16.616 1.00 0.00 C ATOM 0 H VAL A 11 -13.085 9.984 -17.401 1.00 0.00 H new ATOM 0 HA VAL A 11 -13.121 11.185 -14.827 1.00 0.00 H new ATOM 0 HB VAL A 11 -10.825 9.862 -14.749 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -12.063 7.787 -14.286 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -12.858 9.207 -13.564 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -13.510 8.484 -15.053 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -10.761 8.011 -16.373 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -12.153 8.719 -17.227 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -10.605 9.595 -17.169 1.00 0.00 H new ATOM 120 N ARG A 12 -11.813 13.274 -15.425 1.00 0.00 N ATOM 121 CA ARG A 12 -10.927 14.428 -15.522 1.00 0.00 C ATOM 122 C ARG A 12 -10.896 15.202 -14.208 1.00 0.00 C ATOM 123 O ARG A 12 -10.989 16.430 -14.195 1.00 0.00 O ATOM 124 CB ARG A 12 -11.376 15.348 -16.659 1.00 0.00 C ATOM 125 CG ARG A 12 -12.747 15.966 -16.436 1.00 0.00 C ATOM 126 CD ARG A 12 -12.986 17.142 -17.370 1.00 0.00 C ATOM 127 NE ARG A 12 -13.563 16.721 -18.644 1.00 0.00 N ATOM 128 CZ ARG A 12 -14.761 16.161 -18.759 1.00 0.00 C ATOM 129 NH1 ARG A 12 -15.507 15.955 -17.682 1.00 0.00 N ATOM 130 NH2 ARG A 12 -15.217 15.805 -19.953 1.00 0.00 N ATOM 0 H ARG A 12 -12.737 13.482 -15.047 1.00 0.00 H new ATOM 0 HA ARG A 12 -9.921 14.066 -15.733 1.00 0.00 H new ATOM 0 HB2 ARG A 12 -10.643 16.145 -16.781 1.00 0.00 H new ATOM 0 HB3 ARG A 12 -11.389 14.781 -17.590 1.00 0.00 H new ATOM 0 HG2 ARG A 12 -13.518 15.212 -16.594 1.00 0.00 H new ATOM 0 HG3 ARG A 12 -12.834 16.298 -15.401 1.00 0.00 H new ATOM 0 HD2 ARG A 12 -13.653 17.857 -16.889 1.00 0.00 H new ATOM 0 HD3 ARG A 12 -12.043 17.658 -17.552 1.00 0.00 H new ATOM 0 HE ARG A 12 -13.015 16.865 -19.492 1.00 0.00 H new ATOM 0 HH11 ARG A 12 -15.161 16.227 -16.762 1.00 0.00 H new ATOM 0 HH12 ARG A 12 -16.427 15.524 -17.774 1.00 0.00 H new ATOM 0 HH21 ARG A 12 -14.647 15.961 -20.784 1.00 0.00 H new ATOM 0 HH22 ARG A 12 -16.138 15.375 -20.040 1.00 0.00 H new ATOM 144 N THR A 13 -10.766 14.475 -13.102 1.00 0.00 N ATOM 145 CA THR A 13 -10.725 15.093 -11.783 1.00 0.00 C ATOM 146 C THR A 13 -9.289 15.351 -11.341 1.00 0.00 C ATOM 147 O THR A 13 -8.401 14.527 -11.566 1.00 0.00 O ATOM 148 CB THR A 13 -11.424 14.213 -10.729 1.00 0.00 C ATOM 149 OG1 THR A 13 -12.791 14.000 -11.097 1.00 0.00 O ATOM 150 CG2 THR A 13 -11.359 14.861 -9.354 1.00 0.00 C ATOM 0 H THR A 13 -10.687 13.458 -13.094 1.00 0.00 H new ATOM 0 HA THR A 13 -11.254 16.043 -11.862 1.00 0.00 H new ATOM 0 HB THR A 13 -10.906 13.255 -10.687 1.00 0.00 H new ATOM 0 HG1 THR A 13 -13.228 13.438 -10.423 1.00 0.00 H new ATOM 0 HG21 THR A 13 -11.859 14.222 -8.626 1.00 0.00 H new ATOM 0 HG22 THR A 13 -10.317 14.995 -9.064 1.00 0.00 H new ATOM 0 HG23 THR A 13 -11.855 15.831 -9.385 1.00 0.00 H new ATOM 158 N LEU A 14 -9.066 16.499 -10.711 1.00 0.00 N ATOM 159 CA LEU A 14 -7.736 16.866 -10.236 1.00 0.00 C ATOM 160 C LEU A 14 -7.615 16.646 -8.731 1.00 0.00 C ATOM 161 O LEU A 14 -8.041 17.483 -7.935 1.00 0.00 O ATOM 162 CB LEU A 14 -7.437 18.327 -10.575 1.00 0.00 C ATOM 163 CG LEU A 14 -7.225 18.643 -12.056 1.00 0.00 C ATOM 164 CD1 LEU A 14 -7.163 20.146 -12.278 1.00 0.00 C ATOM 165 CD2 LEU A 14 -5.959 17.973 -12.568 1.00 0.00 C ATOM 0 H LEU A 14 -9.789 17.192 -10.517 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.009 16.227 -10.737 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -8.260 18.940 -10.208 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -6.544 18.631 -10.028 1.00 0.00 H new ATOM 0 HG LEU A 14 -8.073 18.249 -12.617 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -7.012 20.351 -13.338 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -8.098 20.601 -11.950 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -6.335 20.564 -11.706 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -5.824 18.209 -13.624 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -5.101 18.336 -12.002 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -6.044 16.893 -12.445 1.00 0.00 H new ATOM 177 N SER A 15 -7.030 15.516 -8.349 1.00 0.00 N ATOM 178 CA SER A 15 -6.854 15.185 -6.940 1.00 0.00 C ATOM 179 C SER A 15 -5.374 15.048 -6.595 1.00 0.00 C ATOM 180 O SER A 15 -4.533 14.872 -7.477 1.00 0.00 O ATOM 181 CB SER A 15 -7.590 13.887 -6.603 1.00 0.00 C ATOM 182 OG SER A 15 -7.054 12.794 -7.329 1.00 0.00 O ATOM 0 H SER A 15 -6.670 14.814 -8.995 1.00 0.00 H new ATOM 0 HA SER A 15 -7.274 15.997 -6.346 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.515 13.689 -5.534 1.00 0.00 H new ATOM 0 HB3 SER A 15 -8.650 13.996 -6.833 1.00 0.00 H new ATOM 0 HG SER A 15 -7.635 12.012 -7.220 1.00 0.00 H new ATOM 188 N ASP A 16 -5.064 15.129 -5.306 1.00 0.00 N ATOM 189 CA ASP A 16 -3.686 15.013 -4.842 1.00 0.00 C ATOM 190 C ASP A 16 -3.244 13.554 -4.811 1.00 0.00 C ATOM 191 O ASP A 16 -2.134 13.221 -5.226 1.00 0.00 O ATOM 192 CB ASP A 16 -3.539 15.633 -3.451 1.00 0.00 C ATOM 193 CG ASP A 16 -3.386 17.141 -3.503 1.00 0.00 C ATOM 194 OD1 ASP A 16 -4.419 17.844 -3.487 1.00 0.00 O ATOM 195 OD2 ASP A 16 -2.233 17.618 -3.558 1.00 0.00 O ATOM 0 H ASP A 16 -5.748 15.275 -4.564 1.00 0.00 H new ATOM 0 HA ASP A 16 -3.047 15.553 -5.541 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -4.412 15.380 -2.849 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -2.672 15.200 -2.953 1.00 0.00 H new ATOM 200 N VAL A 17 -4.120 12.686 -4.314 1.00 0.00 N ATOM 201 CA VAL A 17 -3.820 11.261 -4.229 1.00 0.00 C ATOM 202 C VAL A 17 -3.015 10.796 -5.436 1.00 0.00 C ATOM 203 O VAL A 17 -3.108 11.355 -6.529 1.00 0.00 O ATOM 204 CB VAL A 17 -5.108 10.422 -4.130 1.00 0.00 C ATOM 205 CG1 VAL A 17 -5.530 10.262 -2.677 1.00 0.00 C ATOM 206 CG2 VAL A 17 -6.221 11.056 -4.950 1.00 0.00 C ATOM 0 H VAL A 17 -5.043 12.944 -3.964 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.229 11.115 -3.325 1.00 0.00 H new ATOM 0 HB VAL A 17 -4.908 9.431 -4.537 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.442 9.667 -2.626 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -4.738 9.761 -2.121 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -5.713 11.244 -2.241 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -7.123 10.450 -4.869 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.423 12.059 -4.575 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -5.916 11.114 -5.995 1.00 0.00 H new ATOM 216 N PRO A 18 -2.204 9.746 -5.238 1.00 0.00 N ATOM 217 CA PRO A 18 -1.367 9.180 -6.300 1.00 0.00 C ATOM 218 C PRO A 18 -2.189 8.468 -7.369 1.00 0.00 C ATOM 219 O PRO A 18 -3.256 7.923 -7.085 1.00 0.00 O ATOM 220 CB PRO A 18 -0.477 8.181 -5.556 1.00 0.00 C ATOM 221 CG PRO A 18 -1.260 7.804 -4.345 1.00 0.00 C ATOM 222 CD PRO A 18 -2.043 9.029 -3.961 1.00 0.00 C ATOM 0 HA PRO A 18 -0.812 9.950 -6.835 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -0.258 7.310 -6.173 1.00 0.00 H new ATOM 0 HB3 PRO A 18 0.480 8.628 -5.286 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -1.925 6.966 -4.555 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -0.600 7.492 -3.535 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -3.006 8.769 -3.522 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -1.510 9.632 -3.226 1.00 0.00 H new ATOM 230 N SER A 19 -1.685 8.476 -8.599 1.00 0.00 N ATOM 231 CA SER A 19 -2.374 7.833 -9.711 1.00 0.00 C ATOM 232 C SER A 19 -1.487 6.778 -10.364 1.00 0.00 C ATOM 233 O SER A 19 -1.522 6.586 -11.579 1.00 0.00 O ATOM 234 CB SER A 19 -2.794 8.876 -10.750 1.00 0.00 C ATOM 235 OG SER A 19 -3.872 8.405 -11.539 1.00 0.00 O ATOM 0 H SER A 19 -0.802 8.921 -8.850 1.00 0.00 H new ATOM 0 HA SER A 19 -3.264 7.341 -9.318 1.00 0.00 H new ATOM 0 HB2 SER A 19 -3.083 9.799 -10.247 1.00 0.00 H new ATOM 0 HB3 SER A 19 -1.947 9.115 -11.392 1.00 0.00 H new ATOM 0 HG SER A 19 -3.637 7.537 -11.929 1.00 0.00 H new ATOM 241 N ALA A 20 -0.692 6.095 -9.546 1.00 0.00 N ATOM 242 CA ALA A 20 0.204 5.057 -10.042 1.00 0.00 C ATOM 243 C ALA A 20 -0.044 3.732 -9.330 1.00 0.00 C ATOM 244 O ALA A 20 -0.061 3.671 -8.101 1.00 0.00 O ATOM 245 CB ALA A 20 1.653 5.486 -9.874 1.00 0.00 C ATOM 0 H ALA A 20 -0.650 6.242 -8.537 1.00 0.00 H new ATOM 0 HA ALA A 20 0.001 4.913 -11.103 1.00 0.00 H new ATOM 0 HB1 ALA A 20 2.310 4.701 -10.248 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.828 6.404 -10.435 1.00 0.00 H new ATOM 0 HB3 ALA A 20 1.861 5.660 -8.818 1.00 0.00 H new ATOM 251 N ALA A 21 -0.237 2.673 -10.109 1.00 0.00 N ATOM 252 CA ALA A 21 -0.483 1.349 -9.552 1.00 0.00 C ATOM 253 C ALA A 21 0.688 0.411 -9.829 1.00 0.00 C ATOM 254 O ALA A 21 1.449 0.593 -10.779 1.00 0.00 O ATOM 255 CB ALA A 21 -1.771 0.769 -10.118 1.00 0.00 C ATOM 0 H ALA A 21 -0.228 2.706 -11.128 1.00 0.00 H new ATOM 0 HA ALA A 21 -0.587 1.450 -8.472 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -1.942 -0.220 -9.693 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -2.606 1.422 -9.865 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -1.689 0.689 -11.202 1.00 0.00 H new ATOM 261 N PRO A 22 0.837 -0.616 -8.980 1.00 0.00 N ATOM 262 CA PRO A 22 1.913 -1.603 -9.112 1.00 0.00 C ATOM 263 C PRO A 22 1.725 -2.506 -10.326 1.00 0.00 C ATOM 264 O PRO A 22 0.622 -2.982 -10.591 1.00 0.00 O ATOM 265 CB PRO A 22 1.810 -2.416 -7.819 1.00 0.00 C ATOM 266 CG PRO A 22 0.390 -2.271 -7.393 1.00 0.00 C ATOM 267 CD PRO A 22 -0.034 -0.894 -7.825 1.00 0.00 C ATOM 0 HA PRO A 22 2.884 -1.130 -9.257 1.00 0.00 H new ATOM 0 HB2 PRO A 22 2.068 -3.462 -7.987 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.492 -2.038 -7.058 1.00 0.00 H new ATOM 0 HG2 PRO A 22 -0.236 -3.035 -7.855 1.00 0.00 H new ATOM 0 HG3 PRO A 22 0.292 -2.389 -6.314 1.00 0.00 H new ATOM 0 HD2 PRO A 22 -1.088 -0.866 -8.101 1.00 0.00 H new ATOM 0 HD3 PRO A 22 0.107 -0.162 -7.030 1.00 0.00 H new ATOM 275 N GLN A 23 2.810 -2.737 -11.059 1.00 0.00 N ATOM 276 CA GLN A 23 2.763 -3.584 -12.246 1.00 0.00 C ATOM 277 C GLN A 23 3.381 -4.949 -11.965 1.00 0.00 C ATOM 278 O GLN A 23 3.855 -5.211 -10.860 1.00 0.00 O ATOM 279 CB GLN A 23 3.493 -2.909 -13.408 1.00 0.00 C ATOM 280 CG GLN A 23 3.421 -1.391 -13.373 1.00 0.00 C ATOM 281 CD GLN A 23 4.301 -0.741 -14.422 1.00 0.00 C ATOM 282 OE1 GLN A 23 4.188 -1.034 -15.613 1.00 0.00 O ATOM 283 NE2 GLN A 23 5.186 0.148 -13.984 1.00 0.00 N ATOM 0 H GLN A 23 3.731 -2.350 -10.852 1.00 0.00 H new ATOM 0 HA GLN A 23 1.717 -3.729 -12.518 1.00 0.00 H new ATOM 0 HB2 GLN A 23 4.539 -3.215 -13.396 1.00 0.00 H new ATOM 0 HB3 GLN A 23 3.068 -3.263 -14.347 1.00 0.00 H new ATOM 0 HG2 GLN A 23 2.388 -1.076 -13.525 1.00 0.00 H new ATOM 0 HG3 GLN A 23 3.719 -1.040 -12.385 1.00 0.00 H new ATOM 0 HE21 GLN A 23 5.245 0.360 -12.988 1.00 0.00 H new ATOM 0 HE22 GLN A 23 5.806 0.618 -14.644 1.00 0.00 H new ATOM 292 N ASN A 24 3.374 -5.815 -12.973 1.00 0.00 N ATOM 293 CA ASN A 24 3.934 -7.155 -12.834 1.00 0.00 C ATOM 294 C ASN A 24 3.187 -7.948 -11.766 1.00 0.00 C ATOM 295 O ASN A 24 3.748 -8.848 -11.139 1.00 0.00 O ATOM 296 CB ASN A 24 5.420 -7.075 -12.479 1.00 0.00 C ATOM 297 CG ASN A 24 6.306 -7.034 -13.709 1.00 0.00 C ATOM 298 OD1 ASN A 24 6.890 -8.045 -14.100 1.00 0.00 O ATOM 299 ND2 ASN A 24 6.411 -5.863 -14.325 1.00 0.00 N ATOM 0 H ASN A 24 2.987 -5.613 -13.895 1.00 0.00 H new ATOM 0 HA ASN A 24 3.822 -7.669 -13.788 1.00 0.00 H new ATOM 0 HB2 ASN A 24 5.599 -6.185 -11.875 1.00 0.00 H new ATOM 0 HB3 ASN A 24 5.692 -7.935 -11.867 1.00 0.00 H new ATOM 0 HD21 ASN A 24 6.994 -5.775 -15.158 1.00 0.00 H new ATOM 0 HD22 ASN A 24 5.909 -5.051 -13.966 1.00 0.00 H new ATOM 306 N LEU A 25 1.918 -7.610 -11.565 1.00 0.00 N ATOM 307 CA LEU A 25 1.092 -8.292 -10.574 1.00 0.00 C ATOM 308 C LEU A 25 1.017 -9.787 -10.863 1.00 0.00 C ATOM 309 O LEU A 25 1.162 -10.216 -12.008 1.00 0.00 O ATOM 310 CB LEU A 25 -0.315 -7.693 -10.555 1.00 0.00 C ATOM 311 CG LEU A 25 -1.306 -8.338 -9.585 1.00 0.00 C ATOM 312 CD1 LEU A 25 -0.925 -8.026 -8.147 1.00 0.00 C ATOM 313 CD2 LEU A 25 -2.723 -7.865 -9.878 1.00 0.00 C ATOM 0 H LEU A 25 1.438 -6.868 -12.075 1.00 0.00 H new ATOM 0 HA LEU A 25 1.553 -8.153 -9.596 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -0.234 -6.634 -10.310 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -0.729 -7.756 -11.561 1.00 0.00 H new ATOM 0 HG LEU A 25 -1.269 -9.419 -9.723 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -1.641 -8.493 -7.471 1.00 0.00 H new ATOM 0 HD12 LEU A 25 0.073 -8.414 -7.943 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.933 -6.947 -7.994 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -3.415 -8.334 -9.178 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.775 -6.782 -9.769 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -2.995 -8.140 -10.897 1.00 0.00 H new ATOM 325 N SER A 26 0.787 -10.576 -9.819 1.00 0.00 N ATOM 326 CA SER A 26 0.693 -12.024 -9.960 1.00 0.00 C ATOM 327 C SER A 26 0.264 -12.672 -8.647 1.00 0.00 C ATOM 328 O SER A 26 0.364 -12.065 -7.580 1.00 0.00 O ATOM 329 CB SER A 26 2.036 -12.602 -10.412 1.00 0.00 C ATOM 330 OG SER A 26 2.164 -12.550 -11.822 1.00 0.00 O ATOM 0 H SER A 26 0.662 -10.237 -8.865 1.00 0.00 H new ATOM 0 HA SER A 26 -0.062 -12.242 -10.716 1.00 0.00 H new ATOM 0 HB2 SER A 26 2.850 -12.044 -9.949 1.00 0.00 H new ATOM 0 HB3 SER A 26 2.124 -13.634 -10.073 1.00 0.00 H new ATOM 0 HG SER A 26 2.132 -11.617 -12.119 1.00 0.00 H new ATOM 336 N LEU A 27 -0.214 -13.909 -8.733 1.00 0.00 N ATOM 337 CA LEU A 27 -0.658 -14.641 -7.552 1.00 0.00 C ATOM 338 C LEU A 27 -0.119 -16.067 -7.561 1.00 0.00 C ATOM 339 O LEU A 27 -0.622 -16.926 -8.285 1.00 0.00 O ATOM 340 CB LEU A 27 -2.186 -14.662 -7.486 1.00 0.00 C ATOM 341 CG LEU A 27 -2.888 -13.331 -7.760 1.00 0.00 C ATOM 342 CD1 LEU A 27 -4.344 -13.562 -8.134 1.00 0.00 C ATOM 343 CD2 LEU A 27 -2.786 -12.415 -6.549 1.00 0.00 C ATOM 0 H LEU A 27 -0.304 -14.426 -9.608 1.00 0.00 H new ATOM 0 HA LEU A 27 -0.269 -14.131 -6.671 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -2.551 -15.397 -8.204 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -2.482 -15.009 -6.496 1.00 0.00 H new ATOM 0 HG LEU A 27 -2.391 -12.847 -8.600 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -4.827 -12.604 -8.325 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -4.396 -14.180 -9.031 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -4.854 -14.068 -7.315 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -3.291 -11.473 -6.762 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -3.257 -12.893 -5.690 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -1.737 -12.222 -6.326 1.00 0.00 H new ATOM 355 N GLU A 28 0.906 -16.312 -6.750 1.00 0.00 N ATOM 356 CA GLU A 28 1.512 -17.636 -6.665 1.00 0.00 C ATOM 357 C GLU A 28 0.764 -18.513 -5.664 1.00 0.00 C ATOM 358 O GLU A 28 1.065 -18.507 -4.470 1.00 0.00 O ATOM 359 CB GLU A 28 2.983 -17.522 -6.260 1.00 0.00 C ATOM 360 CG GLU A 28 3.699 -18.861 -6.185 1.00 0.00 C ATOM 361 CD GLU A 28 3.981 -19.449 -7.554 1.00 0.00 C ATOM 362 OE1 GLU A 28 4.732 -18.819 -8.327 1.00 0.00 O ATOM 363 OE2 GLU A 28 3.451 -20.540 -7.851 1.00 0.00 O ATOM 0 H GLU A 28 1.333 -15.612 -6.143 1.00 0.00 H new ATOM 0 HA GLU A 28 1.448 -18.101 -7.649 1.00 0.00 H new ATOM 0 HB2 GLU A 28 3.500 -16.883 -6.976 1.00 0.00 H new ATOM 0 HB3 GLU A 28 3.047 -17.030 -5.289 1.00 0.00 H new ATOM 0 HG2 GLU A 28 4.639 -18.737 -5.646 1.00 0.00 H new ATOM 0 HG3 GLU A 28 3.093 -19.561 -5.611 1.00 0.00 H new ATOM 370 N VAL A 29 -0.213 -19.265 -6.160 1.00 0.00 N ATOM 371 CA VAL A 29 -1.004 -20.148 -5.312 1.00 0.00 C ATOM 372 C VAL A 29 -0.122 -21.182 -4.621 1.00 0.00 C ATOM 373 O VAL A 29 0.181 -22.232 -5.188 1.00 0.00 O ATOM 374 CB VAL A 29 -2.093 -20.877 -6.121 1.00 0.00 C ATOM 375 CG1 VAL A 29 -2.964 -21.722 -5.204 1.00 0.00 C ATOM 376 CG2 VAL A 29 -2.937 -19.878 -6.899 1.00 0.00 C ATOM 0 H VAL A 29 -0.476 -19.280 -7.145 1.00 0.00 H new ATOM 0 HA VAL A 29 -1.481 -19.520 -4.559 1.00 0.00 H new ATOM 0 HB VAL A 29 -1.607 -21.542 -6.835 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -3.728 -22.229 -5.793 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -2.346 -22.462 -4.696 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -3.443 -21.080 -4.465 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.701 -20.410 -7.465 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.415 -19.187 -6.205 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.300 -19.320 -7.585 1.00 0.00 H new ATOM 386 N ARG A 30 0.287 -20.878 -3.394 1.00 0.00 N ATOM 387 CA ARG A 30 1.135 -21.781 -2.625 1.00 0.00 C ATOM 388 C ARG A 30 0.350 -23.007 -2.167 1.00 0.00 C ATOM 389 O ARG A 30 0.814 -24.139 -2.300 1.00 0.00 O ATOM 390 CB ARG A 30 1.722 -21.056 -1.413 1.00 0.00 C ATOM 391 CG ARG A 30 2.554 -19.837 -1.777 1.00 0.00 C ATOM 392 CD ARG A 30 3.944 -20.231 -2.249 1.00 0.00 C ATOM 393 NE ARG A 30 4.771 -20.736 -1.156 1.00 0.00 N ATOM 394 CZ ARG A 30 6.055 -21.050 -1.290 1.00 0.00 C ATOM 395 NH1 ARG A 30 6.655 -20.913 -2.464 1.00 0.00 N ATOM 396 NH2 ARG A 30 6.740 -21.503 -0.248 1.00 0.00 N ATOM 0 H ARG A 30 0.045 -20.013 -2.911 1.00 0.00 H new ATOM 0 HA ARG A 30 1.948 -22.112 -3.271 1.00 0.00 H new ATOM 0 HB2 ARG A 30 0.909 -20.747 -0.756 1.00 0.00 H new ATOM 0 HB3 ARG A 30 2.341 -21.753 -0.848 1.00 0.00 H new ATOM 0 HG2 ARG A 30 2.049 -19.272 -2.561 1.00 0.00 H new ATOM 0 HG3 ARG A 30 2.635 -19.179 -0.912 1.00 0.00 H new ATOM 0 HD2 ARG A 30 3.861 -20.994 -3.023 1.00 0.00 H new ATOM 0 HD3 ARG A 30 4.431 -19.368 -2.703 1.00 0.00 H new ATOM 0 HE ARG A 30 4.339 -20.854 -0.240 1.00 0.00 H new ATOM 0 HH11 ARG A 30 6.131 -20.566 -3.267 1.00 0.00 H new ATOM 0 HH12 ARG A 30 7.641 -21.155 -2.564 1.00 0.00 H new ATOM 0 HH21 ARG A 30 6.281 -21.610 0.656 1.00 0.00 H new ATOM 0 HH22 ARG A 30 7.726 -21.744 -0.351 1.00 0.00 H new ATOM 410 N ASN A 31 -0.842 -22.772 -1.627 1.00 0.00 N ATOM 411 CA ASN A 31 -1.691 -23.856 -1.148 1.00 0.00 C ATOM 412 C ASN A 31 -3.149 -23.613 -1.526 1.00 0.00 C ATOM 413 O ASN A 31 -3.471 -22.638 -2.205 1.00 0.00 O ATOM 414 CB ASN A 31 -1.563 -24.000 0.370 1.00 0.00 C ATOM 415 CG ASN A 31 -0.117 -24.038 0.827 1.00 0.00 C ATOM 416 OD1 ASN A 31 0.134 -23.547 2.035 1.00 0.00 O flip ATOM 417 ND2 ASN A 31 0.762 -24.504 0.103 1.00 0.00 N flip ATOM 0 H ASN A 31 -1.241 -21.841 -1.510 1.00 0.00 H new ATOM 0 HA ASN A 31 -1.360 -24.780 -1.623 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -2.073 -23.168 0.856 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -2.066 -24.913 0.689 1.00 0.00 H new ATOM 0 HD21 ASN A 31 0.523 -24.871 -0.818 1.00 0.00 H new ATOM 0 HD22 ASN A 31 1.730 -24.524 0.424 1.00 0.00 H new ATOM 424 N SER A 32 -4.027 -24.505 -1.080 1.00 0.00 N ATOM 425 CA SER A 32 -5.451 -24.390 -1.373 1.00 0.00 C ATOM 426 C SER A 32 -6.130 -23.430 -0.401 1.00 0.00 C ATOM 427 O SER A 32 -7.222 -22.928 -0.666 1.00 0.00 O ATOM 428 CB SER A 32 -6.121 -25.763 -1.303 1.00 0.00 C ATOM 429 OG SER A 32 -5.845 -26.403 -0.069 1.00 0.00 O ATOM 0 H SER A 32 -3.777 -25.316 -0.514 1.00 0.00 H new ATOM 0 HA SER A 32 -5.558 -23.993 -2.383 1.00 0.00 H new ATOM 0 HB2 SER A 32 -7.198 -25.652 -1.426 1.00 0.00 H new ATOM 0 HB3 SER A 32 -5.769 -26.385 -2.126 1.00 0.00 H new ATOM 0 HG SER A 32 -5.019 -26.924 -0.148 1.00 0.00 H new ATOM 435 N LYS A 33 -5.474 -23.179 0.727 1.00 0.00 N ATOM 436 CA LYS A 33 -6.011 -22.279 1.741 1.00 0.00 C ATOM 437 C LYS A 33 -5.135 -21.039 1.887 1.00 0.00 C ATOM 438 O LYS A 33 -5.393 -20.181 2.731 1.00 0.00 O ATOM 439 CB LYS A 33 -6.121 -23.000 3.086 1.00 0.00 C ATOM 440 CG LYS A 33 -4.799 -23.551 3.591 1.00 0.00 C ATOM 441 CD LYS A 33 -4.049 -22.527 4.425 1.00 0.00 C ATOM 442 CE LYS A 33 -4.632 -22.415 5.826 1.00 0.00 C ATOM 443 NZ LYS A 33 -4.058 -23.434 6.748 1.00 0.00 N ATOM 0 H LYS A 33 -4.569 -23.587 0.962 1.00 0.00 H new ATOM 0 HA LYS A 33 -7.005 -21.965 1.422 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -6.524 -22.309 3.827 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -6.834 -23.819 2.992 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -4.981 -24.445 4.188 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -4.183 -23.853 2.744 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -2.998 -22.807 4.489 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.091 -21.555 3.934 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -4.439 -21.418 6.221 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -5.714 -22.535 5.780 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -4.480 -23.325 7.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -4.264 -24.386 6.384 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.028 -23.303 6.812 1.00 0.00 H new ATOM 457 N SER A 34 -4.099 -20.951 1.059 1.00 0.00 N ATOM 458 CA SER A 34 -3.184 -19.817 1.097 1.00 0.00 C ATOM 459 C SER A 34 -2.736 -19.432 -0.309 1.00 0.00 C ATOM 460 O SER A 34 -2.563 -20.291 -1.174 1.00 0.00 O ATOM 461 CB SER A 34 -1.964 -20.148 1.961 1.00 0.00 C ATOM 462 OG SER A 34 -1.077 -21.017 1.278 1.00 0.00 O ATOM 0 H SER A 34 -3.873 -21.652 0.353 1.00 0.00 H new ATOM 0 HA SER A 34 -3.712 -18.970 1.535 1.00 0.00 H new ATOM 0 HB2 SER A 34 -1.443 -19.228 2.228 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.289 -20.613 2.892 1.00 0.00 H new ATOM 0 HG SER A 34 -0.811 -21.748 1.874 1.00 0.00 H new ATOM 468 N ILE A 35 -2.549 -18.135 -0.530 1.00 0.00 N ATOM 469 CA ILE A 35 -2.121 -17.635 -1.830 1.00 0.00 C ATOM 470 C ILE A 35 -1.117 -16.498 -1.679 1.00 0.00 C ATOM 471 O ILE A 35 -1.307 -15.593 -0.866 1.00 0.00 O ATOM 472 CB ILE A 35 -3.316 -17.142 -2.666 1.00 0.00 C ATOM 473 CG1 ILE A 35 -4.125 -18.331 -3.191 1.00 0.00 C ATOM 474 CG2 ILE A 35 -2.835 -16.272 -3.818 1.00 0.00 C ATOM 475 CD1 ILE A 35 -5.188 -17.942 -4.194 1.00 0.00 C ATOM 0 H ILE A 35 -2.687 -17.411 0.175 1.00 0.00 H new ATOM 0 HA ILE A 35 -1.647 -18.469 -2.347 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.962 -16.540 -2.027 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.445 -19.047 -3.653 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -4.598 -18.838 -2.350 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.692 -15.932 -4.399 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -2.299 -15.409 -3.423 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.169 -16.851 -4.458 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -5.722 -18.834 -4.523 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -5.890 -17.250 -3.730 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -4.719 -17.462 -5.053 1.00 0.00 H new ATOM 487 N MET A 36 -0.049 -16.549 -2.468 1.00 0.00 N ATOM 488 CA MET A 36 0.984 -15.520 -2.423 1.00 0.00 C ATOM 489 C MET A 36 0.789 -14.505 -3.545 1.00 0.00 C ATOM 490 O MET A 36 0.470 -14.871 -4.677 1.00 0.00 O ATOM 491 CB MET A 36 2.372 -16.155 -2.530 1.00 0.00 C ATOM 492 CG MET A 36 3.498 -15.140 -2.635 1.00 0.00 C ATOM 493 SD MET A 36 3.534 -13.996 -1.242 1.00 0.00 S ATOM 494 CE MET A 36 5.001 -14.556 -0.381 1.00 0.00 C ATOM 0 H MET A 36 0.124 -17.291 -3.146 1.00 0.00 H new ATOM 0 HA MET A 36 0.903 -15.000 -1.468 1.00 0.00 H new ATOM 0 HB2 MET A 36 2.542 -16.785 -1.657 1.00 0.00 H new ATOM 0 HB3 MET A 36 2.398 -16.806 -3.404 1.00 0.00 H new ATOM 0 HG2 MET A 36 4.451 -15.665 -2.693 1.00 0.00 H new ATOM 0 HG3 MET A 36 3.388 -14.576 -3.561 1.00 0.00 H new ATOM 0 HE1 MET A 36 5.158 -13.944 0.507 1.00 0.00 H new ATOM 0 HE2 MET A 36 4.874 -15.598 -0.086 1.00 0.00 H new ATOM 0 HE3 MET A 36 5.865 -14.468 -1.039 1.00 0.00 H new ATOM 504 N ILE A 37 0.982 -13.230 -3.224 1.00 0.00 N ATOM 505 CA ILE A 37 0.828 -12.164 -4.206 1.00 0.00 C ATOM 506 C ILE A 37 2.172 -11.526 -4.540 1.00 0.00 C ATOM 507 O ILE A 37 2.962 -11.213 -3.649 1.00 0.00 O ATOM 508 CB ILE A 37 -0.135 -11.072 -3.704 1.00 0.00 C ATOM 509 CG1 ILE A 37 -1.227 -11.687 -2.826 1.00 0.00 C ATOM 510 CG2 ILE A 37 -0.750 -10.327 -4.879 1.00 0.00 C ATOM 511 CD1 ILE A 37 -2.256 -10.686 -2.350 1.00 0.00 C ATOM 0 H ILE A 37 1.245 -12.910 -2.292 1.00 0.00 H new ATOM 0 HA ILE A 37 0.412 -12.620 -5.104 1.00 0.00 H new ATOM 0 HB ILE A 37 0.430 -10.360 -3.102 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -1.731 -12.475 -3.386 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -0.763 -12.158 -1.960 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.428 -9.559 -4.508 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.040 -9.860 -5.468 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -1.303 -11.028 -5.505 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -2.998 -11.193 -1.733 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.765 -9.910 -1.763 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.748 -10.232 -3.211 1.00 0.00 H new ATOM 523 N HIS A 38 2.425 -11.335 -5.831 1.00 0.00 N ATOM 524 CA HIS A 38 3.673 -10.731 -6.284 1.00 0.00 C ATOM 525 C HIS A 38 3.401 -9.532 -7.186 1.00 0.00 C ATOM 526 O HIS A 38 2.836 -9.674 -8.271 1.00 0.00 O ATOM 527 CB HIS A 38 4.521 -11.762 -7.029 1.00 0.00 C ATOM 528 CG HIS A 38 5.033 -12.864 -6.153 1.00 0.00 C ATOM 529 ND1 HIS A 38 6.144 -12.730 -5.348 1.00 0.00 N ATOM 530 CD2 HIS A 38 4.577 -14.123 -5.956 1.00 0.00 C ATOM 531 CE1 HIS A 38 6.351 -13.860 -4.695 1.00 0.00 C ATOM 532 NE2 HIS A 38 5.413 -14.721 -5.046 1.00 0.00 N ATOM 0 H HIS A 38 1.783 -11.590 -6.581 1.00 0.00 H new ATOM 0 HA HIS A 38 4.220 -10.386 -5.407 1.00 0.00 H new ATOM 0 HB2 HIS A 38 3.927 -12.195 -7.834 1.00 0.00 H new ATOM 0 HB3 HIS A 38 5.367 -11.256 -7.494 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.716 -14.573 -6.427 1.00 0.00 H new ATOM 0 HE1 HIS A 38 7.151 -14.048 -3.994 1.00 0.00 H new ATOM 0 HE2 HIS A 38 5.324 -15.675 -4.697 1.00 0.00 H new ATOM 541 N TRP A 39 3.805 -8.351 -6.730 1.00 0.00 N ATOM 542 CA TRP A 39 3.603 -7.127 -7.496 1.00 0.00 C ATOM 543 C TRP A 39 4.873 -6.283 -7.518 1.00 0.00 C ATOM 544 O TRP A 39 5.815 -6.546 -6.772 1.00 0.00 O ATOM 545 CB TRP A 39 2.447 -6.316 -6.907 1.00 0.00 C ATOM 546 CG TRP A 39 2.752 -5.743 -5.556 1.00 0.00 C ATOM 547 CD1 TRP A 39 3.359 -4.549 -5.290 1.00 0.00 C ATOM 548 CD2 TRP A 39 2.467 -6.342 -4.287 1.00 0.00 C ATOM 549 NE1 TRP A 39 3.468 -4.369 -3.932 1.00 0.00 N ATOM 550 CE2 TRP A 39 2.927 -5.454 -3.294 1.00 0.00 C ATOM 551 CE3 TRP A 39 1.865 -7.540 -3.892 1.00 0.00 C ATOM 552 CZ2 TRP A 39 2.804 -5.730 -1.935 1.00 0.00 C ATOM 553 CZ3 TRP A 39 1.745 -7.812 -2.543 1.00 0.00 C ATOM 554 CH2 TRP A 39 2.212 -6.910 -1.577 1.00 0.00 C ATOM 0 H TRP A 39 4.274 -8.216 -5.834 1.00 0.00 H new ATOM 0 HA TRP A 39 3.356 -7.406 -8.520 1.00 0.00 H new ATOM 0 HB2 TRP A 39 2.197 -5.504 -7.590 1.00 0.00 H new ATOM 0 HB3 TRP A 39 1.566 -6.953 -6.833 1.00 0.00 H new ATOM 0 HD1 TRP A 39 3.703 -3.849 -6.037 1.00 0.00 H new ATOM 0 HE1 TRP A 39 3.884 -3.559 -3.473 1.00 0.00 H new ATOM 0 HE3 TRP A 39 1.500 -8.241 -4.628 1.00 0.00 H new ATOM 0 HZ2 TRP A 39 3.164 -5.036 -1.189 1.00 0.00 H new ATOM 0 HZ3 TRP A 39 1.283 -8.736 -2.227 1.00 0.00 H new ATOM 0 HH2 TRP A 39 2.102 -7.151 -0.530 1.00 0.00 H new ATOM 565 N GLN A 40 4.890 -5.269 -8.378 1.00 0.00 N ATOM 566 CA GLN A 40 6.045 -4.388 -8.496 1.00 0.00 C ATOM 567 C GLN A 40 5.630 -2.926 -8.374 1.00 0.00 C ATOM 568 O GLN A 40 4.503 -2.547 -8.693 1.00 0.00 O ATOM 569 CB GLN A 40 6.755 -4.619 -9.831 1.00 0.00 C ATOM 570 CG GLN A 40 7.490 -5.948 -9.908 1.00 0.00 C ATOM 571 CD GLN A 40 8.869 -5.890 -9.280 1.00 0.00 C ATOM 572 OE1 GLN A 40 9.562 -4.876 -9.370 1.00 0.00 O ATOM 573 NE2 GLN A 40 9.274 -6.980 -8.640 1.00 0.00 N ATOM 0 H GLN A 40 4.117 -5.038 -9.002 1.00 0.00 H new ATOM 0 HA GLN A 40 6.732 -4.621 -7.682 1.00 0.00 H new ATOM 0 HB2 GLN A 40 6.022 -4.572 -10.636 1.00 0.00 H new ATOM 0 HB3 GLN A 40 7.466 -3.810 -10.000 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.899 -6.715 -9.408 1.00 0.00 H new ATOM 0 HG3 GLN A 40 7.583 -6.248 -10.952 1.00 0.00 H new ATOM 0 HE21 GLN A 40 8.666 -7.798 -8.590 1.00 0.00 H new ATOM 0 HE22 GLN A 40 10.193 -7.000 -8.198 1.00 0.00 H new ATOM 582 N PRO A 41 6.559 -2.083 -7.900 1.00 0.00 N ATOM 583 CA PRO A 41 6.312 -0.649 -7.724 1.00 0.00 C ATOM 584 C PRO A 41 6.186 0.084 -9.056 1.00 0.00 C ATOM 585 O PRO A 41 6.876 -0.221 -10.028 1.00 0.00 O ATOM 586 CB PRO A 41 7.550 -0.166 -6.964 1.00 0.00 C ATOM 587 CG PRO A 41 8.617 -1.144 -7.317 1.00 0.00 C ATOM 588 CD PRO A 41 7.924 -2.466 -7.499 1.00 0.00 C ATOM 0 HA PRO A 41 5.374 -0.458 -7.203 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.827 0.846 -7.260 1.00 0.00 H new ATOM 0 HB3 PRO A 41 7.372 -0.146 -5.889 1.00 0.00 H new ATOM 0 HG2 PRO A 41 9.134 -0.845 -8.229 1.00 0.00 H new ATOM 0 HG3 PRO A 41 9.369 -1.203 -6.530 1.00 0.00 H new ATOM 0 HD2 PRO A 41 8.411 -3.074 -8.262 1.00 0.00 H new ATOM 0 HD3 PRO A 41 7.924 -3.050 -6.578 1.00 0.00 H new ATOM 596 N PRO A 42 5.283 1.076 -9.102 1.00 0.00 N ATOM 597 CA PRO A 42 5.046 1.874 -10.309 1.00 0.00 C ATOM 598 C PRO A 42 6.218 2.793 -10.636 1.00 0.00 C ATOM 599 O PRO A 42 7.108 2.997 -9.811 1.00 0.00 O ATOM 600 CB PRO A 42 3.805 2.696 -9.952 1.00 0.00 C ATOM 601 CG PRO A 42 3.824 2.785 -8.465 1.00 0.00 C ATOM 602 CD PRO A 42 4.426 1.494 -7.981 1.00 0.00 C ATOM 0 HA PRO A 42 4.920 1.249 -11.193 1.00 0.00 H new ATOM 0 HB2 PRO A 42 3.841 3.685 -10.408 1.00 0.00 H new ATOM 0 HB3 PRO A 42 2.895 2.214 -10.308 1.00 0.00 H new ATOM 0 HG2 PRO A 42 4.414 3.639 -8.133 1.00 0.00 H new ATOM 0 HG3 PRO A 42 2.817 2.919 -8.069 1.00 0.00 H new ATOM 0 HD2 PRO A 42 5.002 1.637 -7.067 1.00 0.00 H new ATOM 0 HD3 PRO A 42 3.660 0.750 -7.762 1.00 0.00 H new ATOM 610 N ALA A 43 6.212 3.345 -11.845 1.00 0.00 N ATOM 611 CA ALA A 43 7.273 4.244 -12.280 1.00 0.00 C ATOM 612 C ALA A 43 7.420 5.422 -11.323 1.00 0.00 C ATOM 613 O ALA A 43 6.474 5.825 -10.646 1.00 0.00 O ATOM 614 CB ALA A 43 7.000 4.739 -13.692 1.00 0.00 C ATOM 0 H ALA A 43 5.483 3.185 -12.541 1.00 0.00 H new ATOM 0 HA ALA A 43 8.211 3.688 -12.277 1.00 0.00 H new ATOM 0 HB1 ALA A 43 7.801 5.410 -14.004 1.00 0.00 H new ATOM 0 HB2 ALA A 43 6.953 3.889 -14.373 1.00 0.00 H new ATOM 0 HB3 ALA A 43 6.050 5.274 -13.713 1.00 0.00 H new ATOM 620 N PRO A 44 8.634 5.989 -11.264 1.00 0.00 N ATOM 621 CA PRO A 44 8.934 7.130 -10.393 1.00 0.00 C ATOM 622 C PRO A 44 8.250 8.411 -10.860 1.00 0.00 C ATOM 623 O PRO A 44 7.926 9.282 -10.053 1.00 0.00 O ATOM 624 CB PRO A 44 10.455 7.267 -10.498 1.00 0.00 C ATOM 625 CG PRO A 44 10.799 6.670 -11.819 1.00 0.00 C ATOM 626 CD PRO A 44 9.808 5.561 -12.043 1.00 0.00 C ATOM 0 HA PRO A 44 8.576 6.971 -9.376 1.00 0.00 H new ATOM 0 HB2 PRO A 44 10.763 8.311 -10.443 1.00 0.00 H new ATOM 0 HB3 PRO A 44 10.957 6.743 -9.684 1.00 0.00 H new ATOM 0 HG2 PRO A 44 10.737 7.415 -12.612 1.00 0.00 H new ATOM 0 HG3 PRO A 44 11.820 6.287 -11.820 1.00 0.00 H new ATOM 0 HD2 PRO A 44 9.568 5.444 -13.100 1.00 0.00 H new ATOM 0 HD3 PRO A 44 10.193 4.602 -11.696 1.00 0.00 H new ATOM 634 N ALA A 45 8.035 8.518 -12.167 1.00 0.00 N ATOM 635 CA ALA A 45 7.388 9.692 -12.740 1.00 0.00 C ATOM 636 C ALA A 45 5.907 9.734 -12.380 1.00 0.00 C ATOM 637 O ALA A 45 5.357 10.797 -12.091 1.00 0.00 O ATOM 638 CB ALA A 45 7.566 9.707 -14.252 1.00 0.00 C ATOM 0 H ALA A 45 8.299 7.807 -12.849 1.00 0.00 H new ATOM 0 HA ALA A 45 7.862 10.579 -12.320 1.00 0.00 H new ATOM 0 HB1 ALA A 45 7.078 10.589 -14.667 1.00 0.00 H new ATOM 0 HB2 ALA A 45 8.629 9.733 -14.493 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.119 8.810 -14.680 1.00 0.00 H new ATOM 644 N THR A 46 5.265 8.570 -12.398 1.00 0.00 N ATOM 645 CA THR A 46 3.847 8.474 -12.075 1.00 0.00 C ATOM 646 C THR A 46 3.603 8.730 -10.592 1.00 0.00 C ATOM 647 O THR A 46 2.634 9.391 -10.220 1.00 0.00 O ATOM 648 CB THR A 46 3.279 7.091 -12.446 1.00 0.00 C ATOM 649 OG1 THR A 46 4.220 6.067 -12.105 1.00 0.00 O ATOM 650 CG2 THR A 46 2.958 7.018 -13.931 1.00 0.00 C ATOM 0 H THR A 46 5.705 7.680 -12.633 1.00 0.00 H new ATOM 0 HA THR A 46 3.336 9.238 -12.662 1.00 0.00 H new ATOM 0 HB THR A 46 2.358 6.939 -11.884 1.00 0.00 H new ATOM 0 HG1 THR A 46 4.831 6.401 -11.416 1.00 0.00 H new ATOM 0 HG21 THR A 46 2.558 6.032 -14.169 1.00 0.00 H new ATOM 0 HG22 THR A 46 2.219 7.779 -14.181 1.00 0.00 H new ATOM 0 HG23 THR A 46 3.866 7.190 -14.508 1.00 0.00 H new ATOM 658 N GLN A 47 4.487 8.203 -9.752 1.00 0.00 N ATOM 659 CA GLN A 47 4.366 8.376 -8.309 1.00 0.00 C ATOM 660 C GLN A 47 4.192 9.848 -7.950 1.00 0.00 C ATOM 661 O GLN A 47 4.661 10.731 -8.666 1.00 0.00 O ATOM 662 CB GLN A 47 5.598 7.809 -7.601 1.00 0.00 C ATOM 663 CG GLN A 47 5.581 6.294 -7.470 1.00 0.00 C ATOM 664 CD GLN A 47 6.865 5.745 -6.881 1.00 0.00 C ATOM 665 OE1 GLN A 47 7.621 6.466 -6.229 1.00 0.00 O ATOM 666 NE2 GLN A 47 7.119 4.461 -7.108 1.00 0.00 N ATOM 0 H GLN A 47 5.294 7.653 -10.045 1.00 0.00 H new ATOM 0 HA GLN A 47 3.482 7.832 -7.976 1.00 0.00 H new ATOM 0 HB2 GLN A 47 6.491 8.108 -8.149 1.00 0.00 H new ATOM 0 HB3 GLN A 47 5.671 8.251 -6.607 1.00 0.00 H new ATOM 0 HG2 GLN A 47 4.741 5.997 -6.842 1.00 0.00 H new ATOM 0 HG3 GLN A 47 5.417 5.850 -8.452 1.00 0.00 H new ATOM 0 HE21 GLN A 47 6.465 3.900 -7.654 1.00 0.00 H new ATOM 0 HE22 GLN A 47 7.968 4.036 -6.736 1.00 0.00 H new ATOM 675 N ASN A 48 3.513 10.104 -6.836 1.00 0.00 N ATOM 676 CA ASN A 48 3.275 11.469 -6.382 1.00 0.00 C ATOM 677 C ASN A 48 3.761 11.658 -4.949 1.00 0.00 C ATOM 678 O ASN A 48 3.203 12.452 -4.192 1.00 0.00 O ATOM 679 CB ASN A 48 1.786 11.808 -6.477 1.00 0.00 C ATOM 680 CG ASN A 48 1.267 11.740 -7.900 1.00 0.00 C ATOM 681 OD1 ASN A 48 2.017 11.452 -8.833 1.00 0.00 O ATOM 682 ND2 ASN A 48 -0.023 12.007 -8.073 1.00 0.00 N ATOM 0 H ASN A 48 3.118 9.384 -6.231 1.00 0.00 H new ATOM 0 HA ASN A 48 3.836 12.144 -7.029 1.00 0.00 H new ATOM 0 HB2 ASN A 48 1.219 11.118 -5.853 1.00 0.00 H new ATOM 0 HB3 ASN A 48 1.618 12.809 -6.079 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -0.429 11.978 -9.008 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -0.607 12.241 -7.270 1.00 0.00 H new ATOM 689 N GLY A 49 4.806 10.923 -4.582 1.00 0.00 N ATOM 690 CA GLY A 49 5.351 11.024 -3.241 1.00 0.00 C ATOM 691 C GLY A 49 5.932 9.713 -2.750 1.00 0.00 C ATOM 692 O GLY A 49 6.049 8.755 -3.514 1.00 0.00 O ATOM 0 H GLY A 49 5.285 10.259 -5.190 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.126 11.790 -3.224 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.567 11.349 -2.557 1.00 0.00 H new ATOM 696 N GLN A 50 6.297 9.670 -1.473 1.00 0.00 N ATOM 697 CA GLN A 50 6.872 8.467 -0.883 1.00 0.00 C ATOM 698 C GLN A 50 5.777 7.497 -0.450 1.00 0.00 C ATOM 699 O GLN A 50 4.776 7.900 0.142 1.00 0.00 O ATOM 700 CB GLN A 50 7.750 8.830 0.316 1.00 0.00 C ATOM 701 CG GLN A 50 6.961 9.287 1.532 1.00 0.00 C ATOM 702 CD GLN A 50 7.853 9.745 2.669 1.00 0.00 C ATOM 703 OE1 GLN A 50 8.499 10.790 2.583 1.00 0.00 O ATOM 704 NE2 GLN A 50 7.894 8.964 3.742 1.00 0.00 N ATOM 0 H GLN A 50 6.205 10.454 -0.827 1.00 0.00 H new ATOM 0 HA GLN A 50 7.487 7.980 -1.640 1.00 0.00 H new ATOM 0 HB2 GLN A 50 8.353 7.964 0.589 1.00 0.00 H new ATOM 0 HB3 GLN A 50 8.441 9.621 0.024 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.298 10.103 1.244 1.00 0.00 H new ATOM 0 HG3 GLN A 50 6.329 8.469 1.878 1.00 0.00 H new ATOM 0 HE21 GLN A 50 7.342 8.107 3.770 1.00 0.00 H new ATOM 0 HE22 GLN A 50 8.477 9.221 4.538 1.00 0.00 H new ATOM 713 N ILE A 51 5.974 6.218 -0.751 1.00 0.00 N ATOM 714 CA ILE A 51 5.004 5.191 -0.393 1.00 0.00 C ATOM 715 C ILE A 51 5.151 4.781 1.069 1.00 0.00 C ATOM 716 O ILE A 51 6.263 4.672 1.586 1.00 0.00 O ATOM 717 CB ILE A 51 5.152 3.942 -1.282 1.00 0.00 C ATOM 718 CG1 ILE A 51 4.768 4.268 -2.726 1.00 0.00 C ATOM 719 CG2 ILE A 51 4.296 2.805 -0.744 1.00 0.00 C ATOM 720 CD1 ILE A 51 5.273 3.255 -3.729 1.00 0.00 C ATOM 0 H ILE A 51 6.797 5.868 -1.242 1.00 0.00 H new ATOM 0 HA ILE A 51 4.016 5.623 -0.549 1.00 0.00 H new ATOM 0 HB ILE A 51 6.195 3.625 -1.267 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.682 4.330 -2.800 1.00 0.00 H new ATOM 0 HG13 ILE A 51 5.162 5.251 -2.985 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.411 1.929 -1.383 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.613 2.559 0.270 1.00 0.00 H new ATOM 0 HG23 ILE A 51 3.250 3.111 -0.733 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.963 3.550 -4.732 1.00 0.00 H new ATOM 0 HD12 ILE A 51 6.361 3.209 -3.684 1.00 0.00 H new ATOM 0 HD13 ILE A 51 4.859 2.274 -3.496 1.00 0.00 H new ATOM 732 N THR A 52 4.021 4.554 1.731 1.00 0.00 N ATOM 733 CA THR A 52 4.023 4.156 3.133 1.00 0.00 C ATOM 734 C THR A 52 3.600 2.700 3.291 1.00 0.00 C ATOM 735 O THR A 52 3.989 2.031 4.248 1.00 0.00 O ATOM 736 CB THR A 52 3.086 5.046 3.971 1.00 0.00 C ATOM 737 OG1 THR A 52 1.725 4.831 3.578 1.00 0.00 O ATOM 738 CG2 THR A 52 3.441 6.515 3.804 1.00 0.00 C ATOM 0 H THR A 52 3.092 4.639 1.318 1.00 0.00 H new ATOM 0 HA THR A 52 5.044 4.276 3.495 1.00 0.00 H new ATOM 0 HB THR A 52 3.208 4.777 5.020 1.00 0.00 H new ATOM 0 HG1 THR A 52 1.643 4.944 2.608 1.00 0.00 H new ATOM 0 HG21 THR A 52 2.765 7.123 4.405 1.00 0.00 H new ATOM 0 HG22 THR A 52 4.467 6.681 4.132 1.00 0.00 H new ATOM 0 HG23 THR A 52 3.345 6.796 2.755 1.00 0.00 H new ATOM 746 N GLY A 53 2.801 2.214 2.346 1.00 0.00 N ATOM 747 CA GLY A 53 2.339 0.840 2.400 1.00 0.00 C ATOM 748 C GLY A 53 1.322 0.527 1.320 1.00 0.00 C ATOM 749 O GLY A 53 0.831 1.429 0.641 1.00 0.00 O ATOM 0 H GLY A 53 2.466 2.748 1.544 1.00 0.00 H new ATOM 0 HA2 GLY A 53 3.192 0.169 2.297 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.897 0.647 3.378 1.00 0.00 H new ATOM 753 N TYR A 54 1.006 -0.753 1.160 1.00 0.00 N ATOM 754 CA TYR A 54 0.044 -1.183 0.152 1.00 0.00 C ATOM 755 C TYR A 54 -1.205 -1.766 0.805 1.00 0.00 C ATOM 756 O TYR A 54 -1.173 -2.204 1.955 1.00 0.00 O ATOM 757 CB TYR A 54 0.678 -2.218 -0.779 1.00 0.00 C ATOM 758 CG TYR A 54 1.769 -1.654 -1.660 1.00 0.00 C ATOM 759 CD1 TYR A 54 1.461 -0.980 -2.835 1.00 0.00 C ATOM 760 CD2 TYR A 54 3.108 -1.793 -1.316 1.00 0.00 C ATOM 761 CE1 TYR A 54 2.455 -0.463 -3.644 1.00 0.00 C ATOM 762 CE2 TYR A 54 4.109 -1.278 -2.117 1.00 0.00 C ATOM 763 CZ TYR A 54 3.777 -0.614 -3.280 1.00 0.00 C ATOM 764 OH TYR A 54 4.770 -0.100 -4.082 1.00 0.00 O ATOM 0 H TYR A 54 1.402 -1.511 1.715 1.00 0.00 H new ATOM 0 HA TYR A 54 -0.248 -0.310 -0.432 1.00 0.00 H new ATOM 0 HB2 TYR A 54 1.090 -3.029 -0.179 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -0.099 -2.651 -1.409 1.00 0.00 H new ATOM 0 HD1 TYR A 54 0.427 -0.858 -3.121 1.00 0.00 H new ATOM 0 HD2 TYR A 54 3.371 -2.313 -0.407 1.00 0.00 H new ATOM 0 HE1 TYR A 54 2.198 0.056 -4.556 1.00 0.00 H new ATOM 0 HE2 TYR A 54 5.145 -1.394 -1.835 1.00 0.00 H new ATOM 0 HH TYR A 54 5.644 -0.291 -3.683 1.00 0.00 H new ATOM 774 N LYS A 55 -2.306 -1.769 0.061 1.00 0.00 N ATOM 775 CA LYS A 55 -3.568 -2.299 0.564 1.00 0.00 C ATOM 776 C LYS A 55 -4.018 -3.503 -0.257 1.00 0.00 C ATOM 777 O LYS A 55 -4.610 -3.350 -1.326 1.00 0.00 O ATOM 778 CB LYS A 55 -4.648 -1.216 0.535 1.00 0.00 C ATOM 779 CG LYS A 55 -5.700 -1.375 1.619 1.00 0.00 C ATOM 780 CD LYS A 55 -6.594 -0.151 1.713 1.00 0.00 C ATOM 781 CE LYS A 55 -7.318 -0.091 3.050 1.00 0.00 C ATOM 782 NZ LYS A 55 -8.251 1.068 3.124 1.00 0.00 N ATOM 0 H LYS A 55 -2.350 -1.410 -0.893 1.00 0.00 H new ATOM 0 HA LYS A 55 -3.413 -2.621 1.594 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -4.174 -0.240 0.641 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -5.137 -1.229 -0.439 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -6.308 -2.255 1.411 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -5.212 -1.545 2.579 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -5.994 0.750 1.582 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -7.324 -0.169 0.903 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -7.874 -1.016 3.203 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -6.587 -0.021 3.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -8.725 1.074 4.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -7.717 1.952 3.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -8.964 0.988 2.371 1.00 0.00 H new ATOM 796 N ILE A 56 -3.735 -4.698 0.249 1.00 0.00 N ATOM 797 CA ILE A 56 -4.114 -5.927 -0.437 1.00 0.00 C ATOM 798 C ILE A 56 -5.468 -6.433 0.048 1.00 0.00 C ATOM 799 O ILE A 56 -5.572 -7.026 1.122 1.00 0.00 O ATOM 800 CB ILE A 56 -3.062 -7.033 -0.233 1.00 0.00 C ATOM 801 CG1 ILE A 56 -1.710 -6.592 -0.797 1.00 0.00 C ATOM 802 CG2 ILE A 56 -3.519 -8.327 -0.890 1.00 0.00 C ATOM 803 CD1 ILE A 56 -0.529 -7.260 -0.129 1.00 0.00 C ATOM 0 H ILE A 56 -3.244 -4.842 1.132 1.00 0.00 H new ATOM 0 HA ILE A 56 -4.177 -5.689 -1.499 1.00 0.00 H new ATOM 0 HB ILE A 56 -2.948 -7.212 0.836 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.683 -6.808 -1.865 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -1.615 -5.512 -0.688 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -2.765 -9.099 -0.737 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -4.461 -8.647 -0.446 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -3.659 -8.163 -1.958 1.00 0.00 H new ATOM 0 HD11 ILE A 56 0.396 -6.900 -0.580 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -0.531 -7.023 0.935 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -0.600 -8.340 -0.260 1.00 0.00 H new ATOM 815 N ARG A 57 -6.503 -6.197 -0.752 1.00 0.00 N ATOM 816 CA ARG A 57 -7.851 -6.630 -0.404 1.00 0.00 C ATOM 817 C ARG A 57 -8.328 -7.733 -1.344 1.00 0.00 C ATOM 818 O ARG A 57 -8.290 -7.580 -2.566 1.00 0.00 O ATOM 819 CB ARG A 57 -8.819 -5.446 -0.457 1.00 0.00 C ATOM 820 CG ARG A 57 -8.830 -4.611 0.813 1.00 0.00 C ATOM 821 CD ARG A 57 -10.172 -3.925 1.018 1.00 0.00 C ATOM 822 NE ARG A 57 -10.305 -3.374 2.363 1.00 0.00 N ATOM 823 CZ ARG A 57 -11.423 -2.822 2.824 1.00 0.00 C ATOM 824 NH1 ARG A 57 -12.497 -2.749 2.051 1.00 0.00 N ATOM 825 NH2 ARG A 57 -11.467 -2.343 4.060 1.00 0.00 N ATOM 0 H ARG A 57 -6.434 -5.709 -1.645 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.827 -7.027 0.611 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -8.553 -4.807 -1.299 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -9.826 -5.819 -0.645 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -8.611 -5.248 1.670 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -8.041 -3.861 0.763 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -10.286 -3.126 0.286 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -10.975 -4.639 0.838 1.00 0.00 H new ATOM 0 HE ARG A 57 -9.496 -3.415 2.983 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -12.467 -3.117 1.100 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -13.354 -2.325 2.407 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -10.642 -2.398 4.658 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -12.325 -1.920 4.413 1.00 0.00 H new ATOM 839 N TYR A 58 -8.776 -8.842 -0.768 1.00 0.00 N ATOM 840 CA TYR A 58 -9.257 -9.972 -1.554 1.00 0.00 C ATOM 841 C TYR A 58 -10.669 -10.367 -1.132 1.00 0.00 C ATOM 842 O TYR A 58 -11.126 -10.014 -0.045 1.00 0.00 O ATOM 843 CB TYR A 58 -8.313 -11.166 -1.400 1.00 0.00 C ATOM 844 CG TYR A 58 -8.084 -11.575 0.037 1.00 0.00 C ATOM 845 CD1 TYR A 58 -7.299 -10.802 0.883 1.00 0.00 C ATOM 846 CD2 TYR A 58 -8.652 -12.735 0.549 1.00 0.00 C ATOM 847 CE1 TYR A 58 -7.086 -11.172 2.197 1.00 0.00 C ATOM 848 CE2 TYR A 58 -8.445 -13.113 1.862 1.00 0.00 C ATOM 849 CZ TYR A 58 -7.662 -12.328 2.682 1.00 0.00 C ATOM 850 OH TYR A 58 -7.452 -12.701 3.990 1.00 0.00 O ATOM 0 H TYR A 58 -8.816 -8.983 0.241 1.00 0.00 H new ATOM 0 HA TYR A 58 -9.282 -9.670 -2.601 1.00 0.00 H new ATOM 0 HB2 TYR A 58 -8.721 -12.014 -1.950 1.00 0.00 H new ATOM 0 HB3 TYR A 58 -7.354 -10.922 -1.857 1.00 0.00 H new ATOM 0 HD1 TYR A 58 -6.847 -9.896 0.507 1.00 0.00 H new ATOM 0 HD2 TYR A 58 -9.266 -13.352 -0.090 1.00 0.00 H new ATOM 0 HE1 TYR A 58 -6.472 -10.560 2.841 1.00 0.00 H new ATOM 0 HE2 TYR A 58 -8.894 -14.018 2.244 1.00 0.00 H new ATOM 0 HH TYR A 58 -7.928 -13.538 4.172 1.00 0.00 H new ATOM 860 N ARG A 59 -11.354 -11.103 -2.001 1.00 0.00 N ATOM 861 CA ARG A 59 -12.714 -11.547 -1.720 1.00 0.00 C ATOM 862 C ARG A 59 -13.124 -12.673 -2.664 1.00 0.00 C ATOM 863 O ARG A 59 -12.650 -12.752 -3.798 1.00 0.00 O ATOM 864 CB ARG A 59 -13.692 -10.377 -1.849 1.00 0.00 C ATOM 865 CG ARG A 59 -13.895 -9.908 -3.280 1.00 0.00 C ATOM 866 CD ARG A 59 -14.638 -8.583 -3.332 1.00 0.00 C ATOM 867 NE ARG A 59 -13.771 -7.455 -3.002 1.00 0.00 N ATOM 868 CZ ARG A 59 -14.224 -6.265 -2.624 1.00 0.00 C ATOM 869 NH1 ARG A 59 -15.528 -6.049 -2.528 1.00 0.00 N ATOM 870 NH2 ARG A 59 -13.371 -5.289 -2.339 1.00 0.00 N ATOM 0 H ARG A 59 -10.990 -11.404 -2.905 1.00 0.00 H new ATOM 0 HA ARG A 59 -12.742 -11.925 -0.698 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -14.655 -10.672 -1.432 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -13.328 -9.542 -1.250 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -12.927 -9.803 -3.770 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -14.454 -10.662 -3.835 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -15.055 -8.440 -4.329 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -15.477 -8.611 -2.637 1.00 0.00 H new ATOM 0 HE ARG A 59 -12.762 -7.588 -3.065 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -16.186 -6.797 -2.745 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -15.873 -5.134 -2.237 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -12.367 -5.452 -2.410 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -13.720 -4.375 -2.049 1.00 0.00 H new ATOM 884 N LYS A 60 -14.008 -13.544 -2.189 1.00 0.00 N ATOM 885 CA LYS A 60 -14.484 -14.667 -2.990 1.00 0.00 C ATOM 886 C LYS A 60 -15.481 -14.198 -4.044 1.00 0.00 C ATOM 887 O LYS A 60 -16.263 -13.279 -3.807 1.00 0.00 O ATOM 888 CB LYS A 60 -15.133 -15.722 -2.091 1.00 0.00 C ATOM 889 CG LYS A 60 -14.171 -16.801 -1.628 1.00 0.00 C ATOM 890 CD LYS A 60 -14.901 -17.940 -0.936 1.00 0.00 C ATOM 891 CE LYS A 60 -15.010 -17.704 0.563 1.00 0.00 C ATOM 892 NZ LYS A 60 -16.237 -18.324 1.135 1.00 0.00 N ATOM 0 H LYS A 60 -14.410 -13.494 -1.253 1.00 0.00 H new ATOM 0 HA LYS A 60 -13.627 -15.109 -3.498 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -15.561 -15.230 -1.218 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -15.958 -16.189 -2.630 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -13.618 -17.189 -2.484 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -13.439 -16.369 -0.945 1.00 0.00 H new ATOM 0 HD2 LYS A 60 -15.899 -18.046 -1.362 1.00 0.00 H new ATOM 0 HD3 LYS A 60 -14.374 -18.876 -1.121 1.00 0.00 H new ATOM 0 HE2 LYS A 60 -14.131 -18.114 1.060 1.00 0.00 H new ATOM 0 HE3 LYS A 60 -15.018 -16.632 0.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 -16.274 -18.141 2.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 -17.078 -17.915 0.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 -16.218 -19.350 0.968 1.00 0.00 H new ATOM 906 N ALA A 61 -15.448 -14.838 -5.209 1.00 0.00 N ATOM 907 CA ALA A 61 -16.351 -14.489 -6.298 1.00 0.00 C ATOM 908 C ALA A 61 -17.808 -14.603 -5.861 1.00 0.00 C ATOM 909 O ALA A 61 -18.637 -13.763 -6.209 1.00 0.00 O ATOM 910 CB ALA A 61 -16.089 -15.377 -7.506 1.00 0.00 C ATOM 0 H ALA A 61 -14.805 -15.601 -5.422 1.00 0.00 H new ATOM 0 HA ALA A 61 -16.162 -13.452 -6.575 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -16.771 -15.105 -8.312 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -15.060 -15.243 -7.840 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -16.248 -16.420 -7.232 1.00 0.00 H new ATOM 916 N SER A 62 -18.112 -15.648 -5.098 1.00 0.00 N ATOM 917 CA SER A 62 -19.470 -15.874 -4.618 1.00 0.00 C ATOM 918 C SER A 62 -19.817 -14.902 -3.495 1.00 0.00 C ATOM 919 O SER A 62 -20.880 -14.280 -3.504 1.00 0.00 O ATOM 920 CB SER A 62 -19.627 -17.315 -4.128 1.00 0.00 C ATOM 921 OG SER A 62 -19.238 -18.239 -5.129 1.00 0.00 O ATOM 0 H SER A 62 -17.436 -16.351 -4.799 1.00 0.00 H new ATOM 0 HA SER A 62 -20.156 -15.703 -5.448 1.00 0.00 H new ATOM 0 HB2 SER A 62 -19.022 -17.466 -3.234 1.00 0.00 H new ATOM 0 HB3 SER A 62 -20.664 -17.495 -3.845 1.00 0.00 H new ATOM 0 HG SER A 62 -19.346 -19.152 -4.791 1.00 0.00 H new ATOM 927 N ARG A 63 -18.914 -14.776 -2.528 1.00 0.00 N ATOM 928 CA ARG A 63 -19.124 -13.882 -1.397 1.00 0.00 C ATOM 929 C ARG A 63 -18.225 -12.653 -1.501 1.00 0.00 C ATOM 930 O ARG A 63 -17.263 -12.509 -0.745 1.00 0.00 O ATOM 931 CB ARG A 63 -18.854 -14.615 -0.082 1.00 0.00 C ATOM 932 CG ARG A 63 -19.467 -13.936 1.132 1.00 0.00 C ATOM 933 CD ARG A 63 -20.979 -14.098 1.156 1.00 0.00 C ATOM 934 NE ARG A 63 -21.656 -13.030 0.425 1.00 0.00 N ATOM 935 CZ ARG A 63 -22.977 -12.908 0.357 1.00 0.00 C ATOM 936 NH1 ARG A 63 -23.759 -13.784 0.973 1.00 0.00 N ATOM 937 NH2 ARG A 63 -23.518 -11.909 -0.328 1.00 0.00 N ATOM 0 H ARG A 63 -18.029 -15.283 -2.506 1.00 0.00 H new ATOM 0 HA ARG A 63 -20.163 -13.553 -1.414 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -19.244 -15.630 -0.155 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -17.777 -14.697 0.064 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -19.040 -14.359 2.041 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -19.214 -12.876 1.124 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -21.247 -15.061 0.722 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -21.326 -14.107 2.189 1.00 0.00 H new ATOM 0 HE ARG A 63 -21.083 -12.340 -0.060 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -23.346 -14.553 1.500 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -24.773 -13.688 0.919 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -22.919 -11.233 -0.803 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -24.532 -11.816 -0.379 1.00 0.00 H new ATOM 951 N LYS A 64 -18.544 -11.771 -2.441 1.00 0.00 N ATOM 952 CA LYS A 64 -17.766 -10.554 -2.645 1.00 0.00 C ATOM 953 C LYS A 64 -17.797 -9.674 -1.399 1.00 0.00 C ATOM 954 O LYS A 64 -16.754 -9.243 -0.907 1.00 0.00 O ATOM 955 CB LYS A 64 -18.306 -9.775 -3.846 1.00 0.00 C ATOM 956 CG LYS A 64 -17.684 -10.188 -5.169 1.00 0.00 C ATOM 957 CD LYS A 64 -18.583 -9.836 -6.342 1.00 0.00 C ATOM 958 CE LYS A 64 -17.914 -10.153 -7.671 1.00 0.00 C ATOM 959 NZ LYS A 64 -18.649 -9.552 -8.818 1.00 0.00 N ATOM 0 H LYS A 64 -19.336 -11.876 -3.075 1.00 0.00 H new ATOM 0 HA LYS A 64 -16.733 -10.841 -2.840 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -19.386 -9.914 -3.903 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -18.129 -8.711 -3.688 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -16.719 -9.695 -5.288 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -17.495 -11.261 -5.164 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -19.519 -10.389 -6.263 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -18.835 -8.776 -6.304 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -16.890 -9.780 -7.660 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -17.858 -11.234 -7.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -18.162 -9.790 -9.706 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -19.619 -9.927 -8.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -18.680 -8.518 -8.707 1.00 0.00 H new ATOM 973 N SER A 65 -18.998 -9.413 -0.894 1.00 0.00 N ATOM 974 CA SER A 65 -19.164 -8.583 0.294 1.00 0.00 C ATOM 975 C SER A 65 -18.093 -8.901 1.333 1.00 0.00 C ATOM 976 O SER A 65 -17.546 -8.002 1.971 1.00 0.00 O ATOM 977 CB SER A 65 -20.554 -8.791 0.897 1.00 0.00 C ATOM 978 OG SER A 65 -20.964 -7.655 1.638 1.00 0.00 O ATOM 0 H SER A 65 -19.871 -9.764 -1.289 1.00 0.00 H new ATOM 0 HA SER A 65 -19.058 -7.540 -0.004 1.00 0.00 H new ATOM 0 HB2 SER A 65 -21.273 -8.989 0.102 1.00 0.00 H new ATOM 0 HB3 SER A 65 -20.545 -9.668 1.545 1.00 0.00 H new ATOM 0 HG SER A 65 -21.856 -7.813 2.012 1.00 0.00 H new ATOM 984 N ASP A 66 -17.801 -10.187 1.497 1.00 0.00 N ATOM 985 CA ASP A 66 -16.795 -10.625 2.458 1.00 0.00 C ATOM 986 C ASP A 66 -15.390 -10.301 1.960 1.00 0.00 C ATOM 987 O ASP A 66 -14.873 -10.960 1.057 1.00 0.00 O ATOM 988 CB ASP A 66 -16.925 -12.127 2.714 1.00 0.00 C ATOM 989 CG ASP A 66 -16.211 -12.563 3.979 1.00 0.00 C ATOM 990 OD1 ASP A 66 -16.063 -11.727 4.895 1.00 0.00 O ATOM 991 OD2 ASP A 66 -15.800 -13.740 4.052 1.00 0.00 O ATOM 0 H ASP A 66 -18.246 -10.944 0.978 1.00 0.00 H new ATOM 0 HA ASP A 66 -16.962 -10.089 3.392 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -17.980 -12.390 2.787 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -16.518 -12.674 1.864 1.00 0.00 H new ATOM 996 N VAL A 67 -14.778 -9.282 2.553 1.00 0.00 N ATOM 997 CA VAL A 67 -13.432 -8.870 2.170 1.00 0.00 C ATOM 998 C VAL A 67 -12.521 -8.767 3.388 1.00 0.00 C ATOM 999 O VAL A 67 -12.973 -8.463 4.493 1.00 0.00 O ATOM 1000 CB VAL A 67 -13.447 -7.514 1.439 1.00 0.00 C ATOM 1001 CG1 VAL A 67 -12.217 -7.371 0.555 1.00 0.00 C ATOM 1002 CG2 VAL A 67 -14.721 -7.365 0.621 1.00 0.00 C ATOM 0 H VAL A 67 -15.192 -8.726 3.301 1.00 0.00 H new ATOM 0 HA VAL A 67 -13.047 -9.635 1.495 1.00 0.00 H new ATOM 0 HB VAL A 67 -13.425 -6.718 2.184 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -12.244 -6.407 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -11.319 -7.432 1.169 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -12.206 -8.171 -0.185 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -14.715 -6.402 0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -14.776 -8.166 -0.117 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -15.586 -7.421 1.282 1.00 0.00 H new ATOM 1012 N THR A 68 -11.233 -9.024 3.180 1.00 0.00 N ATOM 1013 CA THR A 68 -10.258 -8.962 4.261 1.00 0.00 C ATOM 1014 C THR A 68 -9.168 -7.939 3.960 1.00 0.00 C ATOM 1015 O THR A 68 -8.621 -7.908 2.858 1.00 0.00 O ATOM 1016 CB THR A 68 -9.603 -10.334 4.507 1.00 0.00 C ATOM 1017 OG1 THR A 68 -10.612 -11.343 4.632 1.00 0.00 O ATOM 1018 CG2 THR A 68 -8.747 -10.308 5.764 1.00 0.00 C ATOM 0 H THR A 68 -10.842 -9.277 2.273 1.00 0.00 H new ATOM 0 HA THR A 68 -10.800 -8.660 5.157 1.00 0.00 H new ATOM 0 HB THR A 68 -8.963 -10.564 3.655 1.00 0.00 H new ATOM 0 HG1 THR A 68 -10.188 -12.213 4.787 1.00 0.00 H new ATOM 0 HG21 THR A 68 -8.295 -11.288 5.917 1.00 0.00 H new ATOM 0 HG22 THR A 68 -7.962 -9.560 5.654 1.00 0.00 H new ATOM 0 HG23 THR A 68 -9.370 -10.058 6.623 1.00 0.00 H new ATOM 1026 N GLU A 69 -8.858 -7.103 4.947 1.00 0.00 N ATOM 1027 CA GLU A 69 -7.833 -6.079 4.786 1.00 0.00 C ATOM 1028 C GLU A 69 -6.476 -6.586 5.265 1.00 0.00 C ATOM 1029 O GLU A 69 -6.356 -7.130 6.364 1.00 0.00 O ATOM 1030 CB GLU A 69 -8.219 -4.815 5.557 1.00 0.00 C ATOM 1031 CG GLU A 69 -7.132 -3.753 5.568 1.00 0.00 C ATOM 1032 CD GLU A 69 -6.158 -3.927 6.717 1.00 0.00 C ATOM 1033 OE1 GLU A 69 -6.551 -4.524 7.742 1.00 0.00 O ATOM 1034 OE2 GLU A 69 -5.004 -3.467 6.593 1.00 0.00 O ATOM 0 H GLU A 69 -9.302 -7.115 5.865 1.00 0.00 H new ATOM 0 HA GLU A 69 -7.758 -5.841 3.725 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -9.123 -4.393 5.117 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -8.461 -5.086 6.585 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -6.586 -3.788 4.625 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -7.593 -2.767 5.633 1.00 0.00 H new ATOM 1041 N THR A 70 -5.456 -6.406 4.432 1.00 0.00 N ATOM 1042 CA THR A 70 -4.108 -6.846 4.769 1.00 0.00 C ATOM 1043 C THR A 70 -3.085 -5.753 4.482 1.00 0.00 C ATOM 1044 O THR A 70 -2.716 -5.520 3.330 1.00 0.00 O ATOM 1045 CB THR A 70 -3.719 -8.115 3.987 1.00 0.00 C ATOM 1046 OG1 THR A 70 -4.647 -9.168 4.270 1.00 0.00 O ATOM 1047 CG2 THR A 70 -2.310 -8.562 4.346 1.00 0.00 C ATOM 0 H THR A 70 -5.538 -5.959 3.519 1.00 0.00 H new ATOM 0 HA THR A 70 -4.107 -7.071 5.836 1.00 0.00 H new ATOM 0 HB THR A 70 -3.748 -7.883 2.922 1.00 0.00 H new ATOM 0 HG1 THR A 70 -4.309 -10.010 3.899 1.00 0.00 H new ATOM 0 HG21 THR A 70 -2.058 -9.460 3.781 1.00 0.00 H new ATOM 0 HG22 THR A 70 -1.603 -7.769 4.101 1.00 0.00 H new ATOM 0 HG23 THR A 70 -2.258 -8.778 5.413 1.00 0.00 H new ATOM 1055 N LEU A 71 -2.629 -5.085 5.536 1.00 0.00 N ATOM 1056 CA LEU A 71 -1.646 -4.016 5.398 1.00 0.00 C ATOM 1057 C LEU A 71 -0.228 -4.577 5.387 1.00 0.00 C ATOM 1058 O LEU A 71 0.117 -5.437 6.198 1.00 0.00 O ATOM 1059 CB LEU A 71 -1.798 -3.006 6.537 1.00 0.00 C ATOM 1060 CG LEU A 71 -1.388 -1.568 6.218 1.00 0.00 C ATOM 1061 CD1 LEU A 71 0.116 -1.475 6.013 1.00 0.00 C ATOM 1062 CD2 LEU A 71 -2.129 -1.062 4.989 1.00 0.00 C ATOM 0 H LEU A 71 -2.924 -5.265 6.496 1.00 0.00 H new ATOM 0 HA LEU A 71 -1.825 -3.513 4.448 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -2.840 -3.003 6.857 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -1.206 -3.352 7.384 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.658 -0.937 7.065 1.00 0.00 H new ATOM 0 HD11 LEU A 71 0.389 -0.444 5.787 1.00 0.00 H new ATOM 0 HD12 LEU A 71 0.627 -1.795 6.921 1.00 0.00 H new ATOM 0 HD13 LEU A 71 0.411 -2.119 5.184 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -1.825 -0.037 4.777 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -1.891 -1.695 4.134 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -3.203 -1.091 5.174 1.00 0.00 H new ATOM 1074 N VAL A 72 0.592 -4.084 4.464 1.00 0.00 N ATOM 1075 CA VAL A 72 1.974 -4.534 4.350 1.00 0.00 C ATOM 1076 C VAL A 72 2.944 -3.365 4.476 1.00 0.00 C ATOM 1077 O VAL A 72 2.533 -2.220 4.664 1.00 0.00 O ATOM 1078 CB VAL A 72 2.222 -5.251 3.009 1.00 0.00 C ATOM 1079 CG1 VAL A 72 1.406 -6.532 2.931 1.00 0.00 C ATOM 1080 CG2 VAL A 72 1.895 -4.329 1.844 1.00 0.00 C ATOM 0 H VAL A 72 0.323 -3.373 3.784 1.00 0.00 H new ATOM 0 HA VAL A 72 2.147 -5.236 5.166 1.00 0.00 H new ATOM 0 HB VAL A 72 3.277 -5.516 2.947 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.593 -7.025 1.977 1.00 0.00 H new ATOM 0 HG12 VAL A 72 1.693 -7.197 3.746 1.00 0.00 H new ATOM 0 HG13 VAL A 72 0.346 -6.294 3.014 1.00 0.00 H new ATOM 0 HG21 VAL A 72 2.076 -4.851 0.905 1.00 0.00 H new ATOM 0 HG22 VAL A 72 0.848 -4.032 1.898 1.00 0.00 H new ATOM 0 HG23 VAL A 72 2.527 -3.442 1.893 1.00 0.00 H new ATOM 1090 N SER A 73 4.236 -3.661 4.369 1.00 0.00 N ATOM 1091 CA SER A 73 5.266 -2.635 4.474 1.00 0.00 C ATOM 1092 C SER A 73 5.493 -1.952 3.129 1.00 0.00 C ATOM 1093 O SER A 73 5.356 -2.572 2.075 1.00 0.00 O ATOM 1094 CB SER A 73 6.576 -3.247 4.975 1.00 0.00 C ATOM 1095 OG SER A 73 6.637 -3.233 6.391 1.00 0.00 O ATOM 0 H SER A 73 4.594 -4.603 4.210 1.00 0.00 H new ATOM 0 HA SER A 73 4.926 -1.886 5.189 1.00 0.00 H new ATOM 0 HB2 SER A 73 6.664 -4.272 4.614 1.00 0.00 H new ATOM 0 HB3 SER A 73 7.420 -2.692 4.566 1.00 0.00 H new ATOM 0 HG SER A 73 7.483 -3.631 6.686 1.00 0.00 H new ATOM 1101 N GLY A 74 5.839 -0.670 3.173 1.00 0.00 N ATOM 1102 CA GLY A 74 6.079 0.077 1.952 1.00 0.00 C ATOM 1103 C GLY A 74 7.109 -0.586 1.060 1.00 0.00 C ATOM 1104 O GLY A 74 6.957 -0.615 -0.162 1.00 0.00 O ATOM 0 H GLY A 74 5.958 -0.134 4.033 1.00 0.00 H new ATOM 0 HA2 GLY A 74 5.143 0.182 1.404 1.00 0.00 H new ATOM 0 HA3 GLY A 74 6.415 1.082 2.205 1.00 0.00 H new ATOM 1108 N THR A 75 8.163 -1.120 1.670 1.00 0.00 N ATOM 1109 CA THR A 75 9.223 -1.784 0.922 1.00 0.00 C ATOM 1110 C THR A 75 8.890 -3.251 0.680 1.00 0.00 C ATOM 1111 O THR A 75 9.761 -4.043 0.320 1.00 0.00 O ATOM 1112 CB THR A 75 10.573 -1.691 1.659 1.00 0.00 C ATOM 1113 OG1 THR A 75 11.596 -2.335 0.892 1.00 0.00 O ATOM 1114 CG2 THR A 75 10.484 -2.333 3.035 1.00 0.00 C ATOM 0 H THR A 75 8.305 -1.105 2.680 1.00 0.00 H new ATOM 0 HA THR A 75 9.303 -1.270 -0.036 1.00 0.00 H new ATOM 0 HB THR A 75 10.822 -0.637 1.783 1.00 0.00 H new ATOM 0 HG1 THR A 75 11.304 -3.239 0.652 1.00 0.00 H new ATOM 0 HG21 THR A 75 11.449 -2.255 3.536 1.00 0.00 H new ATOM 0 HG22 THR A 75 9.725 -1.821 3.627 1.00 0.00 H new ATOM 0 HG23 THR A 75 10.214 -3.384 2.929 1.00 0.00 H new ATOM 1122 N GLN A 76 7.625 -3.606 0.878 1.00 0.00 N ATOM 1123 CA GLN A 76 7.177 -4.980 0.681 1.00 0.00 C ATOM 1124 C GLN A 76 6.466 -5.133 -0.659 1.00 0.00 C ATOM 1125 O GLN A 76 5.504 -4.420 -0.949 1.00 0.00 O ATOM 1126 CB GLN A 76 6.246 -5.404 1.818 1.00 0.00 C ATOM 1127 CG GLN A 76 5.795 -6.853 1.727 1.00 0.00 C ATOM 1128 CD GLN A 76 5.510 -7.461 3.086 1.00 0.00 C ATOM 1129 OE1 GLN A 76 6.276 -7.281 4.033 1.00 0.00 O ATOM 1130 NE2 GLN A 76 4.403 -8.187 3.189 1.00 0.00 N ATOM 0 H GLN A 76 6.892 -2.962 1.175 1.00 0.00 H new ATOM 0 HA GLN A 76 8.055 -5.626 0.682 1.00 0.00 H new ATOM 0 HB2 GLN A 76 6.755 -5.250 2.770 1.00 0.00 H new ATOM 0 HB3 GLN A 76 5.368 -4.758 1.817 1.00 0.00 H new ATOM 0 HG2 GLN A 76 4.898 -6.912 1.111 1.00 0.00 H new ATOM 0 HG3 GLN A 76 6.565 -7.439 1.225 1.00 0.00 H new ATOM 0 HE21 GLN A 76 3.797 -8.310 2.378 1.00 0.00 H new ATOM 0 HE22 GLN A 76 4.159 -8.622 4.079 1.00 0.00 H new ATOM 1139 N LEU A 77 6.944 -6.068 -1.474 1.00 0.00 N ATOM 1140 CA LEU A 77 6.354 -6.315 -2.785 1.00 0.00 C ATOM 1141 C LEU A 77 5.691 -7.688 -2.833 1.00 0.00 C ATOM 1142 O LEU A 77 5.274 -8.150 -3.895 1.00 0.00 O ATOM 1143 CB LEU A 77 7.422 -6.213 -3.874 1.00 0.00 C ATOM 1144 CG LEU A 77 8.144 -4.869 -3.983 1.00 0.00 C ATOM 1145 CD1 LEU A 77 9.246 -4.938 -5.028 1.00 0.00 C ATOM 1146 CD2 LEU A 77 7.158 -3.760 -4.318 1.00 0.00 C ATOM 0 H LEU A 77 7.738 -6.667 -1.250 1.00 0.00 H new ATOM 0 HA LEU A 77 5.591 -5.557 -2.962 1.00 0.00 H new ATOM 0 HB2 LEU A 77 8.167 -6.989 -3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.955 -6.431 -4.834 1.00 0.00 H new ATOM 0 HG LEU A 77 8.600 -4.644 -3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 77 9.748 -3.973 -5.091 1.00 0.00 H new ATOM 0 HD12 LEU A 77 9.968 -5.705 -4.746 1.00 0.00 H new ATOM 0 HD13 LEU A 77 8.813 -5.186 -5.997 1.00 0.00 H new ATOM 0 HD21 LEU A 77 7.689 -2.811 -4.392 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.673 -3.979 -5.269 1.00 0.00 H new ATOM 0 HD23 LEU A 77 6.404 -3.694 -3.533 1.00 0.00 H new ATOM 1158 N SER A 78 5.596 -8.335 -1.676 1.00 0.00 N ATOM 1159 CA SER A 78 4.985 -9.656 -1.587 1.00 0.00 C ATOM 1160 C SER A 78 4.113 -9.768 -0.340 1.00 0.00 C ATOM 1161 O SER A 78 4.245 -8.979 0.595 1.00 0.00 O ATOM 1162 CB SER A 78 6.065 -10.740 -1.566 1.00 0.00 C ATOM 1163 OG SER A 78 6.778 -10.727 -0.342 1.00 0.00 O ATOM 0 H SER A 78 5.934 -7.966 -0.787 1.00 0.00 H new ATOM 0 HA SER A 78 4.354 -9.798 -2.465 1.00 0.00 H new ATOM 0 HB2 SER A 78 5.606 -11.718 -1.712 1.00 0.00 H new ATOM 0 HB3 SER A 78 6.756 -10.585 -2.395 1.00 0.00 H new ATOM 0 HG SER A 78 7.461 -11.430 -0.354 1.00 0.00 H new ATOM 1169 N GLN A 79 3.222 -10.754 -0.336 1.00 0.00 N ATOM 1170 CA GLN A 79 2.326 -10.969 0.795 1.00 0.00 C ATOM 1171 C GLN A 79 1.627 -12.320 0.686 1.00 0.00 C ATOM 1172 O GLN A 79 1.115 -12.682 -0.374 1.00 0.00 O ATOM 1173 CB GLN A 79 1.288 -9.849 0.871 1.00 0.00 C ATOM 1174 CG GLN A 79 0.365 -9.955 2.074 1.00 0.00 C ATOM 1175 CD GLN A 79 1.122 -10.105 3.379 1.00 0.00 C ATOM 1176 OE1 GLN A 79 2.255 -9.640 3.510 1.00 0.00 O ATOM 1177 NE2 GLN A 79 0.499 -10.757 4.354 1.00 0.00 N ATOM 0 H GLN A 79 3.101 -11.416 -1.102 1.00 0.00 H new ATOM 0 HA GLN A 79 2.924 -10.962 1.706 1.00 0.00 H new ATOM 0 HB2 GLN A 79 1.803 -8.889 0.902 1.00 0.00 H new ATOM 0 HB3 GLN A 79 0.688 -9.859 -0.039 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -0.264 -9.067 2.124 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -0.299 -10.809 1.943 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -0.440 -11.126 4.202 1.00 0.00 H new ATOM 0 HE22 GLN A 79 0.959 -10.889 5.255 1.00 0.00 H new ATOM 1186 N LEU A 80 1.610 -13.062 1.788 1.00 0.00 N ATOM 1187 CA LEU A 80 0.974 -14.375 1.817 1.00 0.00 C ATOM 1188 C LEU A 80 -0.414 -14.293 2.446 1.00 0.00 C ATOM 1189 O LEU A 80 -0.548 -14.067 3.649 1.00 0.00 O ATOM 1190 CB LEU A 80 1.841 -15.367 2.594 1.00 0.00 C ATOM 1191 CG LEU A 80 1.448 -16.840 2.473 1.00 0.00 C ATOM 1192 CD1 LEU A 80 1.536 -17.299 1.026 1.00 0.00 C ATOM 1193 CD2 LEU A 80 2.332 -17.702 3.363 1.00 0.00 C ATOM 0 H LEU A 80 2.029 -12.777 2.673 1.00 0.00 H new ATOM 0 HA LEU A 80 0.868 -14.723 0.790 1.00 0.00 H new ATOM 0 HB2 LEU A 80 2.872 -15.258 2.258 1.00 0.00 H new ATOM 0 HB3 LEU A 80 1.818 -15.091 3.648 1.00 0.00 H new ATOM 0 HG LEU A 80 0.415 -16.949 2.805 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.253 -18.349 0.960 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.861 -16.702 0.413 1.00 0.00 H new ATOM 0 HD13 LEU A 80 2.558 -17.175 0.667 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.038 -18.747 3.265 1.00 0.00 H new ATOM 0 HD22 LEU A 80 3.373 -17.588 3.062 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.218 -17.389 4.401 1.00 0.00 H new ATOM 1205 N ILE A 81 -1.442 -14.481 1.625 1.00 0.00 N ATOM 1206 CA ILE A 81 -2.818 -14.432 2.102 1.00 0.00 C ATOM 1207 C ILE A 81 -3.307 -15.817 2.512 1.00 0.00 C ATOM 1208 O ILE A 81 -3.688 -16.626 1.667 1.00 0.00 O ATOM 1209 CB ILE A 81 -3.765 -13.862 1.029 1.00 0.00 C ATOM 1210 CG1 ILE A 81 -3.347 -12.440 0.652 1.00 0.00 C ATOM 1211 CG2 ILE A 81 -5.203 -13.883 1.528 1.00 0.00 C ATOM 1212 CD1 ILE A 81 -3.375 -11.473 1.815 1.00 0.00 C ATOM 0 H ILE A 81 -1.348 -14.669 0.627 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.828 -13.774 2.971 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.700 -14.487 0.138 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.340 -12.465 0.235 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.008 -12.072 -0.132 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.861 -13.477 0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.496 -14.909 1.752 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.284 -13.278 2.431 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -3.067 -10.485 1.474 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.386 -11.419 2.219 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.692 -11.818 2.591 1.00 0.00 H new ATOM 1224 N GLU A 82 -3.294 -16.081 3.815 1.00 0.00 N ATOM 1225 CA GLU A 82 -3.738 -17.368 4.337 1.00 0.00 C ATOM 1226 C GLU A 82 -5.209 -17.314 4.740 1.00 0.00 C ATOM 1227 O GLU A 82 -5.797 -16.238 4.841 1.00 0.00 O ATOM 1228 CB GLU A 82 -2.883 -17.778 5.538 1.00 0.00 C ATOM 1229 CG GLU A 82 -1.411 -17.953 5.206 1.00 0.00 C ATOM 1230 CD GLU A 82 -0.530 -17.953 6.441 1.00 0.00 C ATOM 1231 OE1 GLU A 82 -0.368 -19.030 7.053 1.00 0.00 O ATOM 1232 OE2 GLU A 82 -0.004 -16.878 6.795 1.00 0.00 O ATOM 0 H GLU A 82 -2.981 -15.422 4.527 1.00 0.00 H new ATOM 0 HA GLU A 82 -3.623 -18.111 3.548 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -2.983 -17.024 6.319 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -3.268 -18.713 5.946 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -1.273 -18.890 4.666 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -1.095 -17.151 4.539 1.00 0.00 H new ATOM 1239 N GLY A 83 -5.797 -18.484 4.970 1.00 0.00 N ATOM 1240 CA GLY A 83 -7.194 -18.549 5.359 1.00 0.00 C ATOM 1241 C GLY A 83 -8.129 -18.518 4.166 1.00 0.00 C ATOM 1242 O GLY A 83 -9.060 -17.713 4.119 1.00 0.00 O ATOM 0 H GLY A 83 -5.331 -19.388 4.894 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -7.367 -19.462 5.929 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -7.424 -17.712 6.019 1.00 0.00 H new ATOM 1246 N LEU A 84 -7.882 -19.395 3.200 1.00 0.00 N ATOM 1247 CA LEU A 84 -8.709 -19.464 2.000 1.00 0.00 C ATOM 1248 C LEU A 84 -9.345 -20.843 1.855 1.00 0.00 C ATOM 1249 O LEU A 84 -9.046 -21.759 2.622 1.00 0.00 O ATOM 1250 CB LEU A 84 -7.872 -19.143 0.761 1.00 0.00 C ATOM 1251 CG LEU A 84 -6.968 -17.915 0.861 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -5.973 -17.888 -0.289 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -7.799 -16.640 0.880 1.00 0.00 C ATOM 0 H LEU A 84 -7.116 -20.068 3.224 1.00 0.00 H new ATOM 0 HA LEU A 84 -9.505 -18.726 2.094 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -7.251 -20.009 0.533 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -8.548 -19.004 -0.083 1.00 0.00 H new ATOM 0 HG LEU A 84 -6.410 -17.975 1.795 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -5.338 -17.006 -0.200 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -5.355 -18.785 -0.256 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.512 -17.853 -1.236 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.138 -15.776 0.952 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.385 -16.574 -0.037 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.470 -16.656 1.739 1.00 0.00 H new ATOM 1265 N ASP A 85 -10.221 -20.985 0.867 1.00 0.00 N ATOM 1266 CA ASP A 85 -10.896 -22.253 0.619 1.00 0.00 C ATOM 1267 C ASP A 85 -10.302 -22.957 -0.597 1.00 0.00 C ATOM 1268 O ASP A 85 -9.599 -22.342 -1.400 1.00 0.00 O ATOM 1269 CB ASP A 85 -12.394 -22.026 0.411 1.00 0.00 C ATOM 1270 CG ASP A 85 -13.229 -23.201 0.879 1.00 0.00 C ATOM 1271 OD1 ASP A 85 -12.750 -23.961 1.746 1.00 0.00 O ATOM 1272 OD2 ASP A 85 -14.362 -23.362 0.377 1.00 0.00 O ATOM 0 H ASP A 85 -10.481 -20.237 0.224 1.00 0.00 H new ATOM 0 HA ASP A 85 -10.751 -22.890 1.492 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -12.701 -21.129 0.949 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -12.588 -21.845 -0.646 1.00 0.00 H new ATOM 1277 N ARG A 86 -10.587 -24.248 -0.725 1.00 0.00 N ATOM 1278 CA ARG A 86 -10.079 -25.036 -1.842 1.00 0.00 C ATOM 1279 C ARG A 86 -11.040 -24.984 -3.026 1.00 0.00 C ATOM 1280 O ARG A 86 -12.208 -24.629 -2.875 1.00 0.00 O ATOM 1281 CB ARG A 86 -9.861 -26.488 -1.412 1.00 0.00 C ATOM 1282 CG ARG A 86 -11.099 -27.140 -0.819 1.00 0.00 C ATOM 1283 CD ARG A 86 -11.059 -28.653 -0.971 1.00 0.00 C ATOM 1284 NE ARG A 86 -12.152 -29.304 -0.255 1.00 0.00 N ATOM 1285 CZ ARG A 86 -12.210 -30.613 -0.036 1.00 0.00 C ATOM 1286 NH1 ARG A 86 -11.242 -31.406 -0.474 1.00 0.00 N ATOM 1287 NH2 ARG A 86 -13.239 -31.132 0.623 1.00 0.00 N ATOM 0 H ARG A 86 -11.167 -24.771 -0.069 1.00 0.00 H new ATOM 0 HA ARG A 86 -9.125 -24.608 -2.151 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -9.533 -27.068 -2.275 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -9.055 -26.524 -0.679 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -11.177 -26.881 0.237 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -11.989 -26.747 -1.310 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -11.113 -28.913 -2.028 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -10.106 -29.030 -0.598 1.00 0.00 H new ATOM 0 HE ARG A 86 -12.913 -28.722 0.096 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -10.450 -31.011 -0.981 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -11.290 -32.411 -0.304 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -13.986 -30.526 0.962 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -13.283 -32.137 0.791 1.00 0.00 H new ATOM 1301 N GLY A 87 -10.539 -25.341 -4.204 1.00 0.00 N ATOM 1302 CA GLY A 87 -11.366 -25.327 -5.397 1.00 0.00 C ATOM 1303 C GLY A 87 -12.368 -24.190 -5.395 1.00 0.00 C ATOM 1304 O GLY A 87 -13.571 -24.411 -5.539 1.00 0.00 O ATOM 0 H GLY A 87 -9.575 -25.640 -4.354 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -10.728 -25.243 -6.277 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -11.897 -26.275 -5.478 1.00 0.00 H new ATOM 1308 N THR A 88 -11.873 -22.967 -5.228 1.00 0.00 N ATOM 1309 CA THR A 88 -12.734 -21.791 -5.204 1.00 0.00 C ATOM 1310 C THR A 88 -12.001 -20.563 -5.733 1.00 0.00 C ATOM 1311 O THR A 88 -10.855 -20.308 -5.365 1.00 0.00 O ATOM 1312 CB THR A 88 -13.244 -21.498 -3.781 1.00 0.00 C ATOM 1313 OG1 THR A 88 -14.148 -22.527 -3.363 1.00 0.00 O ATOM 1314 CG2 THR A 88 -13.944 -20.148 -3.725 1.00 0.00 C ATOM 0 H THR A 88 -10.880 -22.766 -5.107 1.00 0.00 H new ATOM 0 HA THR A 88 -13.585 -22.008 -5.849 1.00 0.00 H new ATOM 0 HB THR A 88 -12.386 -21.474 -3.109 1.00 0.00 H new ATOM 0 HG1 THR A 88 -13.643 -23.340 -3.152 1.00 0.00 H new ATOM 0 HG21 THR A 88 -14.296 -19.962 -2.710 1.00 0.00 H new ATOM 0 HG22 THR A 88 -13.245 -19.364 -4.016 1.00 0.00 H new ATOM 0 HG23 THR A 88 -14.793 -20.150 -4.409 1.00 0.00 H new ATOM 1322 N GLU A 89 -12.671 -19.806 -6.596 1.00 0.00 N ATOM 1323 CA GLU A 89 -12.081 -18.605 -7.175 1.00 0.00 C ATOM 1324 C GLU A 89 -11.943 -17.506 -6.124 1.00 0.00 C ATOM 1325 O GLU A 89 -12.812 -17.339 -5.268 1.00 0.00 O ATOM 1326 CB GLU A 89 -12.932 -18.104 -8.343 1.00 0.00 C ATOM 1327 CG GLU A 89 -12.331 -16.911 -9.068 1.00 0.00 C ATOM 1328 CD GLU A 89 -13.022 -16.619 -10.385 1.00 0.00 C ATOM 1329 OE1 GLU A 89 -12.731 -17.321 -11.376 1.00 0.00 O ATOM 1330 OE2 GLU A 89 -13.855 -15.689 -10.425 1.00 0.00 O ATOM 0 H GLU A 89 -13.622 -20.003 -6.909 1.00 0.00 H new ATOM 0 HA GLU A 89 -11.087 -18.860 -7.542 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -13.072 -18.918 -9.055 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -13.920 -17.832 -7.971 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -12.394 -16.032 -8.427 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -11.273 -17.097 -9.251 1.00 0.00 H new ATOM 1337 N TYR A 90 -10.846 -16.762 -6.196 1.00 0.00 N ATOM 1338 CA TYR A 90 -10.591 -15.682 -5.250 1.00 0.00 C ATOM 1339 C TYR A 90 -10.103 -14.430 -5.972 1.00 0.00 C ATOM 1340 O TYR A 90 -9.276 -14.506 -6.880 1.00 0.00 O ATOM 1341 CB TYR A 90 -9.560 -16.119 -4.209 1.00 0.00 C ATOM 1342 CG TYR A 90 -10.154 -16.904 -3.061 1.00 0.00 C ATOM 1343 CD1 TYR A 90 -10.648 -16.259 -1.934 1.00 0.00 C ATOM 1344 CD2 TYR A 90 -10.221 -18.291 -3.104 1.00 0.00 C ATOM 1345 CE1 TYR A 90 -11.191 -16.972 -0.883 1.00 0.00 C ATOM 1346 CE2 TYR A 90 -10.764 -19.013 -2.057 1.00 0.00 C ATOM 1347 CZ TYR A 90 -11.246 -18.348 -0.949 1.00 0.00 C ATOM 1348 OH TYR A 90 -11.787 -19.062 0.095 1.00 0.00 O ATOM 0 H TYR A 90 -10.118 -16.887 -6.900 1.00 0.00 H new ATOM 0 HA TYR A 90 -11.528 -15.447 -4.745 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -8.798 -16.726 -4.697 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -9.059 -15.236 -3.813 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -10.607 -15.181 -1.879 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -9.843 -18.814 -3.970 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -11.570 -16.454 -0.014 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -10.810 -20.091 -2.107 1.00 0.00 H new ATOM 0 HH TYR A 90 -11.859 -18.485 0.884 1.00 0.00 H new ATOM 1358 N ASN A 91 -10.620 -13.277 -5.559 1.00 0.00 N ATOM 1359 CA ASN A 91 -10.237 -12.007 -6.165 1.00 0.00 C ATOM 1360 C ASN A 91 -9.157 -11.314 -5.339 1.00 0.00 C ATOM 1361 O ASN A 91 -9.236 -11.263 -4.111 1.00 0.00 O ATOM 1362 CB ASN A 91 -11.457 -11.093 -6.299 1.00 0.00 C ATOM 1363 CG ASN A 91 -12.704 -11.852 -6.710 1.00 0.00 C ATOM 1364 OD1 ASN A 91 -13.748 -11.748 -6.064 1.00 0.00 O ATOM 1365 ND2 ASN A 91 -12.602 -12.620 -7.788 1.00 0.00 N ATOM 0 H ASN A 91 -11.305 -13.196 -4.807 1.00 0.00 H new ATOM 0 HA ASN A 91 -9.835 -12.213 -7.157 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -11.637 -10.590 -5.349 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -11.248 -10.317 -7.035 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -13.408 -13.154 -8.112 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -11.717 -12.676 -8.292 1.00 0.00 H new ATOM 1372 N PHE A 92 -8.149 -10.780 -6.021 1.00 0.00 N ATOM 1373 CA PHE A 92 -7.053 -10.090 -5.351 1.00 0.00 C ATOM 1374 C PHE A 92 -6.733 -8.772 -6.050 1.00 0.00 C ATOM 1375 O PHE A 92 -6.766 -8.683 -7.277 1.00 0.00 O ATOM 1376 CB PHE A 92 -5.808 -10.978 -5.318 1.00 0.00 C ATOM 1377 CG PHE A 92 -5.997 -12.247 -4.536 1.00 0.00 C ATOM 1378 CD1 PHE A 92 -5.778 -12.273 -3.168 1.00 0.00 C ATOM 1379 CD2 PHE A 92 -6.395 -13.413 -5.170 1.00 0.00 C ATOM 1380 CE1 PHE A 92 -5.951 -13.439 -2.447 1.00 0.00 C ATOM 1381 CE2 PHE A 92 -6.570 -14.582 -4.454 1.00 0.00 C ATOM 1382 CZ PHE A 92 -6.349 -14.595 -3.091 1.00 0.00 C ATOM 0 H PHE A 92 -8.069 -10.812 -7.037 1.00 0.00 H new ATOM 0 HA PHE A 92 -7.363 -9.873 -4.329 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -5.524 -11.229 -6.340 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -4.981 -10.414 -4.886 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -5.469 -11.372 -2.660 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -6.570 -13.408 -6.236 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -5.775 -13.447 -1.381 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -6.879 -15.485 -4.960 1.00 0.00 H new ATOM 0 HZ PHE A 92 -6.487 -15.507 -2.529 1.00 0.00 H new ATOM 1392 N ARG A 93 -6.424 -7.749 -5.259 1.00 0.00 N ATOM 1393 CA ARG A 93 -6.099 -6.435 -5.800 1.00 0.00 C ATOM 1394 C ARG A 93 -5.106 -5.706 -4.899 1.00 0.00 C ATOM 1395 O ARG A 93 -5.227 -5.734 -3.674 1.00 0.00 O ATOM 1396 CB ARG A 93 -7.369 -5.598 -5.960 1.00 0.00 C ATOM 1397 CG ARG A 93 -8.011 -5.206 -4.638 1.00 0.00 C ATOM 1398 CD ARG A 93 -9.026 -4.089 -4.822 1.00 0.00 C ATOM 1399 NE ARG A 93 -9.963 -4.012 -3.704 1.00 0.00 N ATOM 1400 CZ ARG A 93 -10.918 -3.094 -3.608 1.00 0.00 C ATOM 1401 NH1 ARG A 93 -11.062 -2.180 -4.557 1.00 0.00 N ATOM 1402 NH2 ARG A 93 -11.732 -3.090 -2.560 1.00 0.00 N ATOM 0 H ARG A 93 -6.392 -7.805 -4.241 1.00 0.00 H new ATOM 0 HA ARG A 93 -5.639 -6.576 -6.778 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -7.130 -4.694 -6.520 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.091 -6.159 -6.553 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.500 -6.075 -4.198 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -7.239 -4.886 -3.938 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -8.504 -3.138 -4.924 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.578 -4.250 -5.748 1.00 0.00 H new ATOM 0 HE ARG A 93 -9.879 -4.701 -2.956 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -10.438 -2.180 -5.364 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -11.796 -1.476 -4.480 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -11.624 -3.792 -1.828 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -12.465 -2.385 -2.487 1.00 0.00 H new ATOM 1416 N VAL A 94 -4.125 -5.054 -5.514 1.00 0.00 N ATOM 1417 CA VAL A 94 -3.111 -4.318 -4.769 1.00 0.00 C ATOM 1418 C VAL A 94 -3.204 -2.821 -5.047 1.00 0.00 C ATOM 1419 O VAL A 94 -3.500 -2.405 -6.167 1.00 0.00 O ATOM 1420 CB VAL A 94 -1.693 -4.807 -5.116 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -0.660 -4.113 -4.241 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -1.600 -6.318 -4.969 1.00 0.00 C ATOM 0 H VAL A 94 -4.011 -5.020 -6.527 1.00 0.00 H new ATOM 0 HA VAL A 94 -3.300 -4.501 -3.711 1.00 0.00 H new ATOM 0 HB VAL A 94 -1.484 -4.553 -6.155 1.00 0.00 H new ATOM 0 HG11 VAL A 94 0.336 -4.471 -4.500 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -0.712 -3.036 -4.402 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -0.863 -4.334 -3.193 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -0.591 -6.646 -5.218 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -1.829 -6.598 -3.941 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -2.313 -6.794 -5.642 1.00 0.00 H new ATOM 1432 N ALA A 95 -2.948 -2.017 -4.020 1.00 0.00 N ATOM 1433 CA ALA A 95 -3.000 -0.567 -4.155 1.00 0.00 C ATOM 1434 C ALA A 95 -1.915 0.101 -3.316 1.00 0.00 C ATOM 1435 O ALA A 95 -1.550 -0.392 -2.250 1.00 0.00 O ATOM 1436 CB ALA A 95 -4.373 -0.048 -3.755 1.00 0.00 C ATOM 0 H ALA A 95 -2.703 -2.345 -3.086 1.00 0.00 H new ATOM 0 HA ALA A 95 -2.820 -0.318 -5.201 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -4.397 1.037 -3.861 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -5.132 -0.492 -4.399 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -4.575 -0.316 -2.718 1.00 0.00 H new ATOM 1442 N ALA A 96 -1.404 1.226 -3.806 1.00 0.00 N ATOM 1443 CA ALA A 96 -0.362 1.962 -3.101 1.00 0.00 C ATOM 1444 C ALA A 96 -0.963 3.027 -2.190 1.00 0.00 C ATOM 1445 O ALA A 96 -1.958 3.665 -2.536 1.00 0.00 O ATOM 1446 CB ALA A 96 0.601 2.596 -4.094 1.00 0.00 C ATOM 0 H ALA A 96 -1.695 1.647 -4.688 1.00 0.00 H new ATOM 0 HA ALA A 96 0.188 1.257 -2.478 1.00 0.00 H new ATOM 0 HB1 ALA A 96 1.374 3.142 -3.553 1.00 0.00 H new ATOM 0 HB2 ALA A 96 1.064 1.817 -4.700 1.00 0.00 H new ATOM 0 HB3 ALA A 96 0.056 3.283 -4.741 1.00 0.00 H new ATOM 1452 N LEU A 97 -0.354 3.213 -1.024 1.00 0.00 N ATOM 1453 CA LEU A 97 -0.830 4.201 -0.062 1.00 0.00 C ATOM 1454 C LEU A 97 0.242 5.250 0.217 1.00 0.00 C ATOM 1455 O LEU A 97 1.407 4.919 0.445 1.00 0.00 O ATOM 1456 CB LEU A 97 -1.240 3.516 1.242 1.00 0.00 C ATOM 1457 CG LEU A 97 -2.249 2.374 1.112 1.00 0.00 C ATOM 1458 CD1 LEU A 97 -2.105 1.399 2.270 1.00 0.00 C ATOM 1459 CD2 LEU A 97 -3.668 2.921 1.045 1.00 0.00 C ATOM 0 H LEU A 97 0.470 2.693 -0.722 1.00 0.00 H new ATOM 0 HA LEU A 97 -1.698 4.701 -0.492 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -0.342 3.128 1.723 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -1.658 4.270 1.909 1.00 0.00 H new ATOM 0 HG LEU A 97 -2.044 1.837 0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -2.831 0.594 2.160 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -1.098 0.982 2.271 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -2.283 1.922 3.210 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -4.373 2.094 0.953 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -3.885 3.483 1.954 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -3.764 3.578 0.181 1.00 0.00 H new ATOM 1471 N THR A 98 -0.158 6.517 0.200 1.00 0.00 N ATOM 1472 CA THR A 98 0.767 7.615 0.452 1.00 0.00 C ATOM 1473 C THR A 98 0.148 8.655 1.378 1.00 0.00 C ATOM 1474 O THR A 98 -1.027 8.560 1.736 1.00 0.00 O ATOM 1475 CB THR A 98 1.196 8.301 -0.859 1.00 0.00 C ATOM 1476 OG1 THR A 98 0.057 8.884 -1.501 1.00 0.00 O ATOM 1477 CG2 THR A 98 1.860 7.306 -1.798 1.00 0.00 C ATOM 0 H THR A 98 -1.118 6.809 0.014 1.00 0.00 H new ATOM 0 HA THR A 98 1.646 7.183 0.932 1.00 0.00 H new ATOM 0 HB THR A 98 1.916 9.083 -0.616 1.00 0.00 H new ATOM 0 HG1 THR A 98 0.354 9.571 -2.134 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.154 7.813 -2.717 1.00 0.00 H new ATOM 0 HG22 THR A 98 2.743 6.885 -1.317 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.159 6.505 -2.034 1.00 0.00 H new ATOM 1485 N ILE A 99 0.943 9.648 1.762 1.00 0.00 N ATOM 1486 CA ILE A 99 0.471 10.707 2.645 1.00 0.00 C ATOM 1487 C ILE A 99 -0.712 11.448 2.031 1.00 0.00 C ATOM 1488 O ILE A 99 -1.478 12.105 2.734 1.00 0.00 O ATOM 1489 CB ILE A 99 1.589 11.718 2.959 1.00 0.00 C ATOM 1490 CG1 ILE A 99 1.025 12.911 3.734 1.00 0.00 C ATOM 1491 CG2 ILE A 99 2.258 12.184 1.674 1.00 0.00 C ATOM 1492 CD1 ILE A 99 2.027 13.553 4.668 1.00 0.00 C ATOM 0 H ILE A 99 1.917 9.741 1.475 1.00 0.00 H new ATOM 0 HA ILE A 99 0.155 10.228 3.572 1.00 0.00 H new ATOM 0 HB ILE A 99 2.339 11.227 3.579 1.00 0.00 H new ATOM 0 HG12 ILE A 99 0.670 13.659 3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 99 0.161 12.583 4.311 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.046 12.898 1.912 1.00 0.00 H new ATOM 0 HG22 ILE A 99 2.689 11.327 1.157 1.00 0.00 H new ATOM 0 HG23 ILE A 99 1.518 12.661 1.031 1.00 0.00 H new ATOM 0 HD11 ILE A 99 1.558 14.391 5.184 1.00 0.00 H new ATOM 0 HD12 ILE A 99 2.364 12.819 5.400 1.00 0.00 H new ATOM 0 HD13 ILE A 99 2.881 13.912 4.094 1.00 0.00 H new ATOM 1504 N ASN A 100 -0.855 11.335 0.714 1.00 0.00 N ATOM 1505 CA ASN A 100 -1.946 11.993 0.005 1.00 0.00 C ATOM 1506 C ASN A 100 -3.236 11.188 0.123 1.00 0.00 C ATOM 1507 O ASN A 100 -4.308 11.654 -0.259 1.00 0.00 O ATOM 1508 CB ASN A 100 -1.582 12.182 -1.470 1.00 0.00 C ATOM 1509 CG ASN A 100 -0.433 13.153 -1.662 1.00 0.00 C ATOM 1510 OD1 ASN A 100 -0.599 14.365 -1.524 1.00 0.00 O ATOM 1511 ND2 ASN A 100 0.742 12.622 -1.983 1.00 0.00 N ATOM 0 H ASN A 100 -0.229 10.794 0.117 1.00 0.00 H new ATOM 0 HA ASN A 100 -2.106 12.970 0.461 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -1.315 11.218 -1.902 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -2.455 12.544 -2.013 1.00 0.00 H new ATOM 0 HD21 ASN A 100 1.552 13.225 -2.125 1.00 0.00 H new ATOM 0 HD22 ASN A 100 0.834 11.611 -2.087 1.00 0.00 H new ATOM 1518 N GLY A 101 -3.124 9.975 0.656 1.00 0.00 N ATOM 1519 CA GLY A 101 -4.288 9.124 0.815 1.00 0.00 C ATOM 1520 C GLY A 101 -4.091 7.751 0.204 1.00 0.00 C ATOM 1521 O GLY A 101 -3.022 7.153 0.331 1.00 0.00 O ATOM 0 H GLY A 101 -2.247 9.567 0.980 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.514 9.017 1.876 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -5.151 9.604 0.352 1.00 0.00 H new ATOM 1525 N THR A 102 -5.126 7.248 -0.462 1.00 0.00 N ATOM 1526 CA THR A 102 -5.064 5.936 -1.093 1.00 0.00 C ATOM 1527 C THR A 102 -4.696 6.052 -2.568 1.00 0.00 C ATOM 1528 O THR A 102 -4.990 7.056 -3.214 1.00 0.00 O ATOM 1529 CB THR A 102 -6.404 5.187 -0.968 1.00 0.00 C ATOM 1530 OG1 THR A 102 -7.050 5.540 0.261 1.00 0.00 O ATOM 1531 CG2 THR A 102 -6.191 3.682 -1.020 1.00 0.00 C ATOM 0 H THR A 102 -6.017 7.730 -0.578 1.00 0.00 H new ATOM 0 HA THR A 102 -4.291 5.372 -0.571 1.00 0.00 H new ATOM 0 HB THR A 102 -7.036 5.477 -1.807 1.00 0.00 H new ATOM 0 HG1 THR A 102 -7.902 5.061 0.332 1.00 0.00 H new ATOM 0 HG21 THR A 102 -7.152 3.175 -0.930 1.00 0.00 H new ATOM 0 HG22 THR A 102 -5.726 3.413 -1.969 1.00 0.00 H new ATOM 0 HG23 THR A 102 -5.542 3.378 -0.199 1.00 0.00 H new ATOM 1539 N GLY A 103 -4.049 5.016 -3.095 1.00 0.00 N ATOM 1540 CA GLY A 103 -3.652 5.023 -4.491 1.00 0.00 C ATOM 1541 C GLY A 103 -4.530 4.133 -5.348 1.00 0.00 C ATOM 1542 O GLY A 103 -5.571 3.643 -4.908 1.00 0.00 O ATOM 0 H GLY A 103 -3.793 4.173 -2.581 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -3.693 6.043 -4.872 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -2.616 4.693 -4.573 1.00 0.00 H new ATOM 1546 N PRO A 104 -4.112 3.915 -6.604 1.00 0.00 N ATOM 1547 CA PRO A 104 -4.854 3.078 -7.551 1.00 0.00 C ATOM 1548 C PRO A 104 -4.813 1.600 -7.176 1.00 0.00 C ATOM 1549 O PRO A 104 -3.918 1.158 -6.456 1.00 0.00 O ATOM 1550 CB PRO A 104 -4.127 3.313 -8.877 1.00 0.00 C ATOM 1551 CG PRO A 104 -2.746 3.710 -8.487 1.00 0.00 C ATOM 1552 CD PRO A 104 -2.882 4.467 -7.195 1.00 0.00 C ATOM 0 HA PRO A 104 -5.913 3.335 -7.578 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -4.121 2.412 -9.490 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -4.613 4.094 -9.462 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.109 2.834 -8.361 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -2.286 4.330 -9.256 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -2.020 4.312 -6.546 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -2.965 5.540 -7.365 1.00 0.00 H new ATOM 1560 N ALA A 105 -5.786 0.842 -7.669 1.00 0.00 N ATOM 1561 CA ALA A 105 -5.859 -0.586 -7.387 1.00 0.00 C ATOM 1562 C ALA A 105 -5.691 -1.407 -8.661 1.00 0.00 C ATOM 1563 O ALA A 105 -6.245 -1.068 -9.708 1.00 0.00 O ATOM 1564 CB ALA A 105 -7.178 -0.924 -6.709 1.00 0.00 C ATOM 0 H ALA A 105 -6.535 1.193 -8.266 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.041 -0.840 -6.712 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.218 -1.994 -6.505 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.257 -0.372 -5.772 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -8.005 -0.648 -7.364 1.00 0.00 H new ATOM 1570 N THR A 106 -4.923 -2.488 -8.568 1.00 0.00 N ATOM 1571 CA THR A 106 -4.682 -3.355 -9.713 1.00 0.00 C ATOM 1572 C THR A 106 -5.939 -4.130 -10.091 1.00 0.00 C ATOM 1573 O THR A 106 -6.629 -4.671 -9.228 1.00 0.00 O ATOM 1574 CB THR A 106 -3.543 -4.353 -9.432 1.00 0.00 C ATOM 1575 OG1 THR A 106 -3.856 -5.142 -8.279 1.00 0.00 O ATOM 1576 CG2 THR A 106 -2.226 -3.624 -9.210 1.00 0.00 C ATOM 0 H THR A 106 -4.457 -2.784 -7.710 1.00 0.00 H new ATOM 0 HA THR A 106 -4.394 -2.709 -10.542 1.00 0.00 H new ATOM 0 HB THR A 106 -3.438 -5.004 -10.300 1.00 0.00 H new ATOM 0 HG1 THR A 106 -3.034 -5.534 -7.918 1.00 0.00 H new ATOM 0 HG21 THR A 106 -1.437 -4.350 -9.013 1.00 0.00 H new ATOM 0 HG22 THR A 106 -1.975 -3.047 -10.100 1.00 0.00 H new ATOM 0 HG23 THR A 106 -2.321 -2.952 -8.357 1.00 0.00 H new ATOM 1584 N ASP A 107 -6.230 -4.180 -11.387 1.00 0.00 N ATOM 1585 CA ASP A 107 -7.404 -4.891 -11.879 1.00 0.00 C ATOM 1586 C ASP A 107 -7.691 -6.123 -11.027 1.00 0.00 C ATOM 1587 O ASP A 107 -6.771 -6.813 -10.587 1.00 0.00 O ATOM 1588 CB ASP A 107 -7.203 -5.301 -13.339 1.00 0.00 C ATOM 1589 CG ASP A 107 -6.264 -4.368 -14.078 1.00 0.00 C ATOM 1590 OD1 ASP A 107 -5.037 -4.480 -13.876 1.00 0.00 O ATOM 1591 OD2 ASP A 107 -6.756 -3.525 -14.858 1.00 0.00 O ATOM 0 H ASP A 107 -5.669 -3.737 -12.115 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.259 -4.219 -11.812 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -6.807 -6.316 -13.377 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -8.168 -5.316 -13.845 1.00 0.00 H new ATOM 1596 N TRP A 108 -8.971 -6.393 -10.798 1.00 0.00 N ATOM 1597 CA TRP A 108 -9.378 -7.542 -9.997 1.00 0.00 C ATOM 1598 C TRP A 108 -8.933 -8.846 -10.650 1.00 0.00 C ATOM 1599 O TRP A 108 -9.535 -9.302 -11.623 1.00 0.00 O ATOM 1600 CB TRP A 108 -10.896 -7.544 -9.808 1.00 0.00 C ATOM 1601 CG TRP A 108 -11.353 -6.695 -8.660 1.00 0.00 C ATOM 1602 CD1 TRP A 108 -12.100 -5.555 -8.730 1.00 0.00 C ATOM 1603 CD2 TRP A 108 -11.089 -6.919 -7.270 1.00 0.00 C ATOM 1604 NE1 TRP A 108 -12.317 -5.056 -7.468 1.00 0.00 N ATOM 1605 CE2 TRP A 108 -11.708 -5.875 -6.555 1.00 0.00 C ATOM 1606 CE3 TRP A 108 -10.392 -7.901 -6.561 1.00 0.00 C ATOM 1607 CZ2 TRP A 108 -11.648 -5.787 -5.167 1.00 0.00 C ATOM 1608 CZ3 TRP A 108 -10.334 -7.812 -5.183 1.00 0.00 C ATOM 1609 CH2 TRP A 108 -10.959 -6.762 -4.498 1.00 0.00 C ATOM 0 H TRP A 108 -9.745 -5.832 -11.155 1.00 0.00 H new ATOM 0 HA TRP A 108 -8.897 -7.463 -9.022 1.00 0.00 H new ATOM 0 HB2 TRP A 108 -11.369 -7.190 -10.724 1.00 0.00 H new ATOM 0 HB3 TRP A 108 -11.234 -8.568 -9.650 1.00 0.00 H new ATOM 0 HD1 TRP A 108 -12.467 -5.110 -9.643 1.00 0.00 H new ATOM 0 HE1 TRP A 108 -12.846 -4.212 -7.247 1.00 0.00 H new ATOM 0 HE3 TRP A 108 -9.908 -8.715 -7.080 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 -12.128 -4.978 -4.637 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 -9.798 -8.565 -4.625 1.00 0.00 H new ATOM 0 HH2 TRP A 108 -10.896 -6.721 -3.421 1.00 0.00 H new ATOM 1620 N LEU A 109 -7.876 -9.442 -10.109 1.00 0.00 N ATOM 1621 CA LEU A 109 -7.350 -10.695 -10.640 1.00 0.00 C ATOM 1622 C LEU A 109 -7.931 -11.890 -9.890 1.00 0.00 C ATOM 1623 O LEU A 109 -7.707 -12.051 -8.690 1.00 0.00 O ATOM 1624 CB LEU A 109 -5.824 -10.711 -10.544 1.00 0.00 C ATOM 1625 CG LEU A 109 -5.092 -11.517 -11.619 1.00 0.00 C ATOM 1626 CD1 LEU A 109 -5.454 -11.008 -13.005 1.00 0.00 C ATOM 1627 CD2 LEU A 109 -3.588 -11.453 -11.401 1.00 0.00 C ATOM 0 H LEU A 109 -7.367 -9.078 -9.304 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.643 -10.769 -11.687 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -5.467 -9.682 -10.583 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -5.545 -11.108 -9.568 1.00 0.00 H new ATOM 0 HG LEU A 109 -5.406 -12.558 -11.543 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.924 -11.593 -13.757 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -6.529 -11.106 -13.159 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.169 -9.960 -13.094 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.083 -12.032 -12.175 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -3.257 -10.416 -11.450 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -3.344 -11.866 -10.422 1.00 0.00 H new ATOM 1639 N SER A 110 -8.676 -12.726 -10.606 1.00 0.00 N ATOM 1640 CA SER A 110 -9.290 -13.906 -10.008 1.00 0.00 C ATOM 1641 C SER A 110 -8.346 -15.102 -10.073 1.00 0.00 C ATOM 1642 O SER A 110 -7.604 -15.269 -11.040 1.00 0.00 O ATOM 1643 CB SER A 110 -10.603 -14.239 -10.719 1.00 0.00 C ATOM 1644 OG SER A 110 -11.509 -13.151 -10.655 1.00 0.00 O ATOM 0 H SER A 110 -8.869 -12.608 -11.601 1.00 0.00 H new ATOM 0 HA SER A 110 -9.497 -13.686 -8.961 1.00 0.00 H new ATOM 0 HB2 SER A 110 -10.403 -14.488 -11.761 1.00 0.00 H new ATOM 0 HB3 SER A 110 -11.054 -15.119 -10.262 1.00 0.00 H new ATOM 0 HG SER A 110 -12.339 -13.389 -11.118 1.00 0.00 H new ATOM 1650 N ALA A 111 -8.379 -15.931 -9.035 1.00 0.00 N ATOM 1651 CA ALA A 111 -7.529 -17.113 -8.974 1.00 0.00 C ATOM 1652 C ALA A 111 -8.276 -18.297 -8.370 1.00 0.00 C ATOM 1653 O ALA A 111 -8.924 -18.169 -7.332 1.00 0.00 O ATOM 1654 CB ALA A 111 -6.270 -16.817 -8.173 1.00 0.00 C ATOM 0 H ALA A 111 -8.986 -15.806 -8.225 1.00 0.00 H new ATOM 0 HA ALA A 111 -7.245 -17.378 -9.992 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -5.644 -17.709 -8.136 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -5.718 -16.006 -8.649 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -6.544 -16.523 -7.160 1.00 0.00 H new ATOM 1660 N GLU A 112 -8.181 -19.449 -9.027 1.00 0.00 N ATOM 1661 CA GLU A 112 -8.851 -20.655 -8.554 1.00 0.00 C ATOM 1662 C GLU A 112 -7.879 -21.555 -7.796 1.00 0.00 C ATOM 1663 O GLU A 112 -6.939 -22.100 -8.375 1.00 0.00 O ATOM 1664 CB GLU A 112 -9.461 -21.421 -9.729 1.00 0.00 C ATOM 1665 CG GLU A 112 -10.577 -22.370 -9.324 1.00 0.00 C ATOM 1666 CD GLU A 112 -11.426 -22.809 -10.501 1.00 0.00 C ATOM 1667 OE1 GLU A 112 -10.849 -23.122 -11.564 1.00 0.00 O ATOM 1668 OE2 GLU A 112 -12.666 -22.839 -10.360 1.00 0.00 O ATOM 0 H GLU A 112 -7.647 -19.572 -9.887 1.00 0.00 H new ATOM 0 HA GLU A 112 -9.647 -20.354 -7.874 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -9.849 -20.707 -10.455 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -8.676 -21.989 -10.228 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -10.145 -23.249 -8.845 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -11.212 -21.883 -8.584 1.00 0.00 H new ATOM 1675 N THR A 113 -8.112 -21.705 -6.496 1.00 0.00 N ATOM 1676 CA THR A 113 -7.258 -22.537 -5.657 1.00 0.00 C ATOM 1677 C THR A 113 -7.274 -23.988 -6.124 1.00 0.00 C ATOM 1678 O THR A 113 -8.126 -24.385 -6.919 1.00 0.00 O ATOM 1679 CB THR A 113 -7.692 -22.480 -4.181 1.00 0.00 C ATOM 1680 OG1 THR A 113 -9.113 -22.326 -4.094 1.00 0.00 O ATOM 1681 CG2 THR A 113 -7.008 -21.329 -3.459 1.00 0.00 C ATOM 0 H THR A 113 -8.885 -21.261 -6.001 1.00 0.00 H new ATOM 0 HA THR A 113 -6.247 -22.141 -5.746 1.00 0.00 H new ATOM 0 HB THR A 113 -7.397 -23.414 -3.703 1.00 0.00 H new ATOM 0 HG1 THR A 113 -9.369 -22.178 -3.160 1.00 0.00 H new ATOM 0 HG21 THR A 113 -7.331 -21.309 -2.418 1.00 0.00 H new ATOM 0 HG22 THR A 113 -5.927 -21.464 -3.502 1.00 0.00 H new ATOM 0 HG23 THR A 113 -7.275 -20.388 -3.939 1.00 0.00 H new ATOM 1689 N PHE A 114 -6.327 -24.776 -5.625 1.00 0.00 N ATOM 1690 CA PHE A 114 -6.233 -26.184 -5.992 1.00 0.00 C ATOM 1691 C PHE A 114 -7.265 -27.014 -5.233 1.00 0.00 C ATOM 1692 O PHE A 114 -7.349 -26.947 -4.008 1.00 0.00 O ATOM 1693 CB PHE A 114 -4.826 -26.714 -5.706 1.00 0.00 C ATOM 1694 CG PHE A 114 -3.743 -25.957 -6.420 1.00 0.00 C ATOM 1695 CD1 PHE A 114 -3.731 -25.879 -7.804 1.00 0.00 C ATOM 1696 CD2 PHE A 114 -2.738 -25.322 -5.709 1.00 0.00 C ATOM 1697 CE1 PHE A 114 -2.736 -25.183 -8.464 1.00 0.00 C ATOM 1698 CE2 PHE A 114 -1.741 -24.624 -6.364 1.00 0.00 C ATOM 1699 CZ PHE A 114 -1.740 -24.555 -7.743 1.00 0.00 C ATOM 0 H PHE A 114 -5.614 -24.463 -4.966 1.00 0.00 H new ATOM 0 HA PHE A 114 -6.437 -26.270 -7.059 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -4.641 -26.670 -4.633 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -4.776 -27.764 -5.996 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -4.508 -26.368 -8.373 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -2.733 -25.373 -4.630 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -2.738 -25.130 -9.543 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -0.963 -24.133 -5.798 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.961 -24.011 -8.257 1.00 0.00 H new ATOM 1709 N GLU A 115 -8.047 -27.794 -5.973 1.00 0.00 N ATOM 1710 CA GLU A 115 -9.074 -28.635 -5.371 1.00 0.00 C ATOM 1711 C GLU A 115 -8.521 -29.391 -4.166 1.00 0.00 C ATOM 1712 O GLU A 115 -9.273 -29.827 -3.294 1.00 0.00 O ATOM 1713 CB GLU A 115 -9.622 -29.626 -6.400 1.00 0.00 C ATOM 1714 CG GLU A 115 -10.615 -29.008 -7.371 1.00 0.00 C ATOM 1715 CD GLU A 115 -11.125 -30.002 -8.396 1.00 0.00 C ATOM 1716 OE1 GLU A 115 -11.351 -31.173 -8.024 1.00 0.00 O ATOM 1717 OE2 GLU A 115 -11.297 -29.610 -9.569 1.00 0.00 O ATOM 0 H GLU A 115 -7.989 -27.861 -6.989 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.884 -27.988 -5.033 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -8.790 -30.049 -6.964 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -10.104 -30.451 -5.876 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -11.459 -28.602 -6.813 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -10.142 -28.172 -7.886 1.00 0.00 H new ATOM 1724 N SER A 116 -7.201 -29.544 -4.126 1.00 0.00 N ATOM 1725 CA SER A 116 -6.546 -30.251 -3.031 1.00 0.00 C ATOM 1726 C SER A 116 -5.069 -29.877 -2.950 1.00 0.00 C ATOM 1727 O SER A 116 -4.490 -29.376 -3.914 1.00 0.00 O ATOM 1728 CB SER A 116 -6.692 -31.763 -3.213 1.00 0.00 C ATOM 1729 OG SER A 116 -6.612 -32.436 -1.969 1.00 0.00 O ATOM 0 H SER A 116 -6.564 -29.188 -4.839 1.00 0.00 H new ATOM 0 HA SER A 116 -7.029 -29.956 -2.100 1.00 0.00 H new ATOM 0 HB2 SER A 116 -7.647 -31.985 -3.689 1.00 0.00 H new ATOM 0 HB3 SER A 116 -5.911 -32.129 -3.879 1.00 0.00 H new ATOM 0 HG SER A 116 -6.710 -33.401 -2.112 1.00 0.00 H new ATOM 1735 N ASP A 117 -4.466 -30.125 -1.793 1.00 0.00 N ATOM 1736 CA ASP A 117 -3.056 -29.816 -1.584 1.00 0.00 C ATOM 1737 C ASP A 117 -2.198 -30.417 -2.692 1.00 0.00 C ATOM 1738 O ASP A 117 -1.255 -29.787 -3.173 1.00 0.00 O ATOM 1739 CB ASP A 117 -2.593 -30.340 -0.223 1.00 0.00 C ATOM 1740 CG ASP A 117 -3.196 -29.564 0.932 1.00 0.00 C ATOM 1741 OD1 ASP A 117 -3.400 -28.341 0.782 1.00 0.00 O ATOM 1742 OD2 ASP A 117 -3.464 -30.180 1.985 1.00 0.00 O ATOM 0 H ASP A 117 -4.931 -30.539 -0.985 1.00 0.00 H new ATOM 0 HA ASP A 117 -2.940 -28.732 -1.606 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -2.864 -31.392 -0.131 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -1.506 -30.284 -0.166 1.00 0.00 H new ATOM 1747 N LEU A 118 -2.530 -31.639 -3.094 1.00 0.00 N ATOM 1748 CA LEU A 118 -1.789 -32.327 -4.146 1.00 0.00 C ATOM 1749 C LEU A 118 -1.325 -31.344 -5.216 1.00 0.00 C ATOM 1750 O LEU A 118 -2.141 -30.706 -5.882 1.00 0.00 O ATOM 1751 CB LEU A 118 -2.657 -33.416 -4.779 1.00 0.00 C ATOM 1752 CG LEU A 118 -2.834 -34.694 -3.958 1.00 0.00 C ATOM 1753 CD1 LEU A 118 -4.116 -35.410 -4.355 1.00 0.00 C ATOM 1754 CD2 LEU A 118 -1.633 -35.612 -4.133 1.00 0.00 C ATOM 0 H LEU A 118 -3.308 -32.174 -2.707 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.910 -32.788 -3.696 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -3.643 -32.997 -4.979 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -2.224 -33.684 -5.743 1.00 0.00 H new ATOM 0 HG LEU A 118 -2.906 -34.419 -2.906 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -4.225 -36.317 -3.760 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -4.969 -34.755 -4.177 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.074 -35.672 -5.412 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -1.777 -36.516 -3.541 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -1.529 -35.879 -5.185 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.731 -35.099 -3.798 1.00 0.00 H new ATOM 1766 N ASP A 119 -0.012 -31.230 -5.378 1.00 0.00 N ATOM 1767 CA ASP A 119 0.561 -30.328 -6.370 1.00 0.00 C ATOM 1768 C ASP A 119 1.862 -30.894 -6.932 1.00 0.00 C ATOM 1769 O ASP A 119 2.807 -31.156 -6.189 1.00 0.00 O ATOM 1770 CB ASP A 119 0.814 -28.952 -5.753 1.00 0.00 C ATOM 1771 CG ASP A 119 0.764 -27.839 -6.781 1.00 0.00 C ATOM 1772 OD1 ASP A 119 0.133 -28.037 -7.840 1.00 0.00 O ATOM 1773 OD2 ASP A 119 1.357 -26.769 -6.528 1.00 0.00 O ATOM 0 H ASP A 119 0.676 -31.751 -4.835 1.00 0.00 H new ATOM 0 HA ASP A 119 -0.153 -30.226 -7.187 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.070 -28.762 -4.979 1.00 0.00 H new ATOM 0 HB3 ASP A 119 1.789 -28.949 -5.266 1.00 0.00 H new ATOM 1778 N GLU A 120 1.900 -31.080 -8.248 1.00 0.00 N ATOM 1779 CA GLU A 120 3.085 -31.617 -8.908 1.00 0.00 C ATOM 1780 C GLU A 120 3.989 -30.491 -9.402 1.00 0.00 C ATOM 1781 O GLU A 120 3.513 -29.453 -9.863 1.00 0.00 O ATOM 1782 CB GLU A 120 2.680 -32.513 -10.080 1.00 0.00 C ATOM 1783 CG GLU A 120 3.861 -33.138 -10.804 1.00 0.00 C ATOM 1784 CD GLU A 120 4.723 -33.986 -9.890 1.00 0.00 C ATOM 1785 OE1 GLU A 120 4.165 -34.631 -8.978 1.00 0.00 O ATOM 1786 OE2 GLU A 120 5.957 -34.004 -10.086 1.00 0.00 O ATOM 0 H GLU A 120 1.126 -30.867 -8.877 1.00 0.00 H new ATOM 0 HA GLU A 120 3.638 -32.211 -8.180 1.00 0.00 H new ATOM 0 HB2 GLU A 120 2.029 -33.306 -9.712 1.00 0.00 H new ATOM 0 HB3 GLU A 120 2.098 -31.926 -10.791 1.00 0.00 H new ATOM 0 HG2 GLU A 120 3.494 -33.753 -11.626 1.00 0.00 H new ATOM 0 HG3 GLU A 120 4.471 -32.349 -11.244 1.00 0.00 H new ATOM 1793 N THR A 121 5.297 -30.704 -9.304 1.00 0.00 N ATOM 1794 CA THR A 121 6.269 -29.709 -9.739 1.00 0.00 C ATOM 1795 C THR A 121 6.798 -30.029 -11.132 1.00 0.00 C ATOM 1796 O THR A 121 7.128 -31.176 -11.433 1.00 0.00 O ATOM 1797 CB THR A 121 7.455 -29.617 -8.760 1.00 0.00 C ATOM 1798 OG1 THR A 121 6.977 -29.380 -7.432 1.00 0.00 O ATOM 1799 CG2 THR A 121 8.409 -28.504 -9.169 1.00 0.00 C ATOM 0 H THR A 121 5.708 -31.558 -8.927 1.00 0.00 H new ATOM 0 HA THR A 121 5.751 -28.750 -9.762 1.00 0.00 H new ATOM 0 HB THR A 121 7.994 -30.564 -8.787 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.737 -29.325 -6.816 1.00 0.00 H new ATOM 0 HG21 THR A 121 9.238 -28.458 -8.463 1.00 0.00 H new ATOM 0 HG22 THR A 121 8.794 -28.704 -10.169 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.879 -27.552 -9.168 1.00 0.00 H new ATOM 1807 N ARG A 122 6.877 -29.008 -11.979 1.00 0.00 N ATOM 1808 CA ARG A 122 7.366 -29.181 -13.341 1.00 0.00 C ATOM 1809 C ARG A 122 8.591 -28.307 -13.595 1.00 0.00 C ATOM 1810 O ARG A 122 8.777 -27.277 -12.947 1.00 0.00 O ATOM 1811 CB ARG A 122 6.265 -28.839 -14.348 1.00 0.00 C ATOM 1812 CG ARG A 122 5.946 -27.355 -14.420 1.00 0.00 C ATOM 1813 CD ARG A 122 5.112 -27.023 -15.648 1.00 0.00 C ATOM 1814 NE ARG A 122 5.800 -27.375 -16.887 1.00 0.00 N ATOM 1815 CZ ARG A 122 5.196 -27.449 -18.068 1.00 0.00 C ATOM 1816 NH1 ARG A 122 3.898 -27.197 -18.169 1.00 0.00 N ATOM 1817 NH2 ARG A 122 5.890 -27.775 -19.151 1.00 0.00 N ATOM 0 H ARG A 122 6.608 -28.052 -11.746 1.00 0.00 H new ATOM 0 HA ARG A 122 7.654 -30.225 -13.467 1.00 0.00 H new ATOM 0 HB2 ARG A 122 6.568 -29.185 -15.336 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.359 -29.384 -14.083 1.00 0.00 H new ATOM 0 HG2 ARG A 122 5.408 -27.053 -13.521 1.00 0.00 H new ATOM 0 HG3 ARG A 122 6.874 -26.783 -14.443 1.00 0.00 H new ATOM 0 HD2 ARG A 122 4.162 -27.556 -15.596 1.00 0.00 H new ATOM 0 HD3 ARG A 122 4.880 -25.958 -15.652 1.00 0.00 H new ATOM 0 HE ARG A 122 6.799 -27.575 -16.843 1.00 0.00 H new ATOM 0 HH11 ARG A 122 3.361 -26.946 -17.339 1.00 0.00 H new ATOM 0 HH12 ARG A 122 3.436 -27.254 -19.077 1.00 0.00 H new ATOM 0 HH21 ARG A 122 6.889 -27.969 -19.077 1.00 0.00 H new ATOM 0 HH22 ARG A 122 5.425 -27.831 -20.057 1.00 0.00 H new ATOM 1831 N VAL A 123 9.425 -28.726 -14.541 1.00 0.00 N ATOM 1832 CA VAL A 123 10.632 -27.983 -14.881 1.00 0.00 C ATOM 1833 C VAL A 123 10.606 -27.528 -16.336 1.00 0.00 C ATOM 1834 O VAL A 123 10.363 -28.312 -17.253 1.00 0.00 O ATOM 1835 CB VAL A 123 11.897 -28.827 -14.641 1.00 0.00 C ATOM 1836 CG1 VAL A 123 13.143 -27.959 -14.729 1.00 0.00 C ATOM 1837 CG2 VAL A 123 11.821 -29.530 -13.294 1.00 0.00 C ATOM 0 H VAL A 123 9.287 -29.577 -15.086 1.00 0.00 H new ATOM 0 HA VAL A 123 10.659 -27.109 -14.231 1.00 0.00 H new ATOM 0 HB VAL A 123 11.958 -29.588 -15.419 1.00 0.00 H new ATOM 0 HG11 VAL A 123 14.027 -28.573 -14.557 1.00 0.00 H new ATOM 0 HG12 VAL A 123 13.202 -27.507 -15.719 1.00 0.00 H new ATOM 0 HG13 VAL A 123 13.094 -27.174 -13.974 1.00 0.00 H new ATOM 0 HG21 VAL A 123 12.723 -30.122 -13.141 1.00 0.00 H new ATOM 0 HG22 VAL A 123 11.735 -28.788 -12.500 1.00 0.00 H new ATOM 0 HG23 VAL A 123 10.950 -30.185 -13.274 1.00 0.00 H new ATOM 1847 N PRO A 124 10.863 -26.230 -16.554 1.00 0.00 N ATOM 1848 CA PRO A 124 10.876 -25.640 -17.897 1.00 0.00 C ATOM 1849 C PRO A 124 12.064 -26.116 -18.727 1.00 0.00 C ATOM 1850 O PRO A 124 13.043 -26.630 -18.188 1.00 0.00 O ATOM 1851 CB PRO A 124 10.983 -24.138 -17.623 1.00 0.00 C ATOM 1852 CG PRO A 124 11.635 -24.041 -16.287 1.00 0.00 C ATOM 1853 CD PRO A 124 11.161 -25.237 -15.508 1.00 0.00 C ATOM 0 HA PRO A 124 9.995 -25.920 -18.474 1.00 0.00 H new ATOM 0 HB2 PRO A 124 11.575 -23.637 -18.389 1.00 0.00 H new ATOM 0 HB3 PRO A 124 10.001 -23.666 -17.619 1.00 0.00 H new ATOM 0 HG2 PRO A 124 12.721 -24.042 -16.382 1.00 0.00 H new ATOM 0 HG3 PRO A 124 11.360 -23.114 -15.785 1.00 0.00 H new ATOM 0 HD2 PRO A 124 11.925 -25.596 -14.819 1.00 0.00 H new ATOM 0 HD3 PRO A 124 10.279 -25.004 -14.912 1.00 0.00 H new ATOM 1861 N GLU A 125 11.969 -25.942 -20.041 1.00 0.00 N ATOM 1862 CA GLU A 125 13.036 -26.354 -20.945 1.00 0.00 C ATOM 1863 C GLU A 125 13.697 -25.142 -21.596 1.00 0.00 C ATOM 1864 O GLU A 125 13.151 -24.039 -21.578 1.00 0.00 O ATOM 1865 CB GLU A 125 12.487 -27.290 -22.024 1.00 0.00 C ATOM 1866 CG GLU A 125 13.535 -28.219 -22.615 1.00 0.00 C ATOM 1867 CD GLU A 125 12.937 -29.500 -23.163 1.00 0.00 C ATOM 1868 OE1 GLU A 125 12.042 -29.413 -24.030 1.00 0.00 O ATOM 1869 OE2 GLU A 125 13.362 -30.589 -22.725 1.00 0.00 O ATOM 0 H GLU A 125 11.164 -25.519 -20.503 1.00 0.00 H new ATOM 0 HA GLU A 125 13.787 -26.885 -20.361 1.00 0.00 H new ATOM 0 HB2 GLU A 125 11.682 -27.889 -21.598 1.00 0.00 H new ATOM 0 HB3 GLU A 125 12.051 -26.692 -22.824 1.00 0.00 H new ATOM 0 HG2 GLU A 125 14.066 -27.700 -23.413 1.00 0.00 H new ATOM 0 HG3 GLU A 125 14.271 -28.465 -21.849 1.00 0.00 H new ATOM 1876 N VAL A 126 14.877 -25.356 -22.169 1.00 0.00 N ATOM 1877 CA VAL A 126 15.614 -24.283 -22.825 1.00 0.00 C ATOM 1878 C VAL A 126 15.275 -24.212 -24.310 1.00 0.00 C ATOM 1879 O VAL A 126 15.207 -25.235 -24.991 1.00 0.00 O ATOM 1880 CB VAL A 126 17.135 -24.466 -22.665 1.00 0.00 C ATOM 1881 CG1 VAL A 126 17.887 -23.397 -23.443 1.00 0.00 C ATOM 1882 CG2 VAL A 126 17.523 -24.439 -21.194 1.00 0.00 C ATOM 0 H VAL A 126 15.343 -26.263 -22.192 1.00 0.00 H new ATOM 0 HA VAL A 126 15.315 -23.353 -22.342 1.00 0.00 H new ATOM 0 HB VAL A 126 17.411 -25.439 -23.072 1.00 0.00 H new ATOM 0 HG11 VAL A 126 18.960 -23.543 -23.318 1.00 0.00 H new ATOM 0 HG12 VAL A 126 17.632 -23.469 -24.500 1.00 0.00 H new ATOM 0 HG13 VAL A 126 17.609 -22.412 -23.069 1.00 0.00 H new ATOM 0 HG21 VAL A 126 18.601 -24.570 -21.100 1.00 0.00 H new ATOM 0 HG22 VAL A 126 17.234 -23.482 -20.759 1.00 0.00 H new ATOM 0 HG23 VAL A 126 17.012 -25.246 -20.668 1.00 0.00 H new ATOM 1892 N SER A 127 15.064 -22.997 -24.806 1.00 0.00 N ATOM 1893 CA SER A 127 14.729 -22.792 -26.210 1.00 0.00 C ATOM 1894 C SER A 127 15.937 -22.280 -26.988 1.00 0.00 C ATOM 1895 O SER A 127 16.948 -21.894 -26.403 1.00 0.00 O ATOM 1896 CB SER A 127 13.568 -21.804 -26.341 1.00 0.00 C ATOM 1897 OG SER A 127 12.835 -22.034 -27.531 1.00 0.00 O ATOM 0 H SER A 127 15.119 -22.140 -24.256 1.00 0.00 H new ATOM 0 HA SER A 127 14.429 -23.752 -26.630 1.00 0.00 H new ATOM 0 HB2 SER A 127 12.907 -21.898 -25.479 1.00 0.00 H new ATOM 0 HB3 SER A 127 13.952 -20.784 -26.338 1.00 0.00 H new ATOM 0 HG SER A 127 12.098 -21.391 -27.591 1.00 0.00 H new ATOM 1903 N GLY A 128 15.824 -22.280 -28.313 1.00 0.00 N ATOM 1904 CA GLY A 128 16.914 -21.814 -29.151 1.00 0.00 C ATOM 1905 C GLY A 128 16.463 -20.787 -30.170 1.00 0.00 C ATOM 1906 O GLY A 128 15.271 -20.628 -30.438 1.00 0.00 O ATOM 0 H GLY A 128 14.997 -22.594 -28.821 1.00 0.00 H new ATOM 0 HA2 GLY A 128 17.692 -21.380 -28.522 1.00 0.00 H new ATOM 0 HA3 GLY A 128 17.359 -22.664 -29.669 1.00 0.00 H new ATOM 1910 N PRO A 129 17.429 -20.066 -30.757 1.00 0.00 N ATOM 1911 CA PRO A 129 17.149 -19.036 -31.761 1.00 0.00 C ATOM 1912 C PRO A 129 16.655 -19.627 -33.077 1.00 0.00 C ATOM 1913 O PRO A 129 16.898 -20.797 -33.373 1.00 0.00 O ATOM 1914 CB PRO A 129 18.506 -18.354 -31.957 1.00 0.00 C ATOM 1915 CG PRO A 129 19.508 -19.388 -31.578 1.00 0.00 C ATOM 1916 CD PRO A 129 18.870 -20.203 -30.487 1.00 0.00 C ATOM 0 HA PRO A 129 16.358 -18.358 -31.440 1.00 0.00 H new ATOM 0 HB2 PRO A 129 18.641 -18.031 -32.989 1.00 0.00 H new ATOM 0 HB3 PRO A 129 18.597 -17.466 -31.331 1.00 0.00 H new ATOM 0 HG2 PRO A 129 19.765 -20.014 -32.433 1.00 0.00 H new ATOM 0 HG3 PRO A 129 20.432 -18.927 -31.231 1.00 0.00 H new ATOM 0 HD2 PRO A 129 19.189 -21.245 -30.525 1.00 0.00 H new ATOM 0 HD3 PRO A 129 19.131 -19.826 -29.498 1.00 0.00 H new ATOM 1924 N SER A 130 15.962 -18.811 -33.864 1.00 0.00 N ATOM 1925 CA SER A 130 15.431 -19.255 -35.148 1.00 0.00 C ATOM 1926 C SER A 130 16.373 -18.874 -36.286 1.00 0.00 C ATOM 1927 O SER A 130 16.804 -19.728 -37.061 1.00 0.00 O ATOM 1928 CB SER A 130 14.048 -18.646 -35.390 1.00 0.00 C ATOM 1929 OG SER A 130 13.601 -18.905 -36.709 1.00 0.00 O ATOM 0 H SER A 130 15.755 -17.839 -33.635 1.00 0.00 H new ATOM 0 HA SER A 130 15.342 -20.341 -35.121 1.00 0.00 H new ATOM 0 HB2 SER A 130 13.336 -19.057 -34.674 1.00 0.00 H new ATOM 0 HB3 SER A 130 14.086 -17.570 -35.220 1.00 0.00 H new ATOM 0 HG SER A 130 12.715 -18.507 -36.838 1.00 0.00 H new ATOM 1935 N SER A 131 16.687 -17.586 -36.380 1.00 0.00 N ATOM 1936 CA SER A 131 17.575 -17.090 -37.426 1.00 0.00 C ATOM 1937 C SER A 131 18.601 -16.118 -36.851 1.00 0.00 C ATOM 1938 O SER A 131 18.571 -15.796 -35.664 1.00 0.00 O ATOM 1939 CB SER A 131 16.766 -16.403 -38.527 1.00 0.00 C ATOM 1940 OG SER A 131 15.952 -15.372 -37.995 1.00 0.00 O ATOM 0 H SER A 131 16.340 -16.867 -35.745 1.00 0.00 H new ATOM 0 HA SER A 131 18.106 -17.941 -37.852 1.00 0.00 H new ATOM 0 HB2 SER A 131 17.442 -15.988 -39.274 1.00 0.00 H new ATOM 0 HB3 SER A 131 16.142 -17.137 -39.036 1.00 0.00 H new ATOM 0 HG SER A 131 15.447 -14.948 -38.719 1.00 0.00 H new ATOM 1946 N GLY A 132 19.510 -15.654 -37.704 1.00 0.00 N ATOM 1947 CA GLY A 132 20.533 -14.724 -37.264 1.00 0.00 C ATOM 1948 C GLY A 132 20.115 -13.277 -37.438 1.00 0.00 C ATOM 1949 O GLY A 132 19.226 -12.973 -38.233 1.00 0.00 O ATOM 0 H GLY A 132 19.556 -15.906 -38.691 1.00 0.00 H new ATOM 0 HA2 GLY A 132 20.761 -14.909 -36.214 1.00 0.00 H new ATOM 0 HA3 GLY A 132 21.449 -14.904 -37.826 1.00 0.00 H new TER 1953 GLY A 132