USER MOD reduce.3.24.130724 H: found=0, std=0, add=923, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 921 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 107 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 109 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 78 ASN : amide:sc= -0.702 K(o=-0.93,f=-2.1!) USER MOD Set 2.2: A 80 GLN : amide:sc= -0.23 X(o=-0.93,f=-1.1) USER MOD Set 3.1: A 62 ASN :FLIP amide:sc= -3.4! C(o=-7.6!,f=-3.4!) USER MOD Set 3.2: A 64 HIS :FLIP no HD1:sc= -0.0496 F(o=-6.6,f=-3.4) USER MOD Set 4.1: A 27 GLN :FLIP amide:sc= 0.402 F(o=-0.35,f=0.39) USER MOD Set 4.2: A 61 HIS :FLIP no HD1:sc= -0.0077 F(o=-0.42,f=0.39) USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0415 (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 24:sc= 0.548 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot -80:sc= 1.18 USER MOD Single : A 11 SER OG : rot 140:sc= -0.171 USER MOD Single : A 12 SER OG : rot -150:sc= -0.599 USER MOD Single : A 16 THR OG1 : rot 180:sc=-0.00102 USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= -0.769 X(o=-0.77,f=-0.37) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0.00116 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 THR OG1 : rot 180:sc= -0.114 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc=-0.000783 X(o=-0.00078,f=-0.0024) USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 160:sc= -2.37 USER MOD Single : A 57 SER OG : rot -102:sc= 0.954 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -0.863 K(o=-0.86,f=-3.3!) USER MOD Single : A 68 ASN :FLIP amide:sc= -5.1! C(o=-6.7!,f=-5.1!) USER MOD Single : A 70 LYS NZ :NH3+ -110:sc= -0.43 (180deg=-1.28) USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 HIS : no HD1:sc= -0.721 X(o=-0.72,f=-0.9) USER MOD Single : A 93 ASN : amide:sc= 0.948 K(o=0.95,f=-0.12) USER MOD Single : A 96 GLN : amide:sc= 0.458 X(o=0.46,f=0) USER MOD Single : A 99 HIS : no HD1:sc= -3.23! C(o=-3.2!,f=-3.4!) USER MOD Single : A 101 THR OG1 : rot 81:sc= -0.284 USER MOD Single : A 106 LYS NZ :NH3+ -173:sc= 0.159 (180deg=0.149) USER MOD Single : A 108 SER OG : rot 180:sc= -0.0656 USER MOD Single : A 110 SER OG : rot -56:sc= 0.182 USER MOD Single : A 111 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= -0.0346 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= -0.146 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -6.609 13.181 -27.060 1.00 0.00 N ATOM 2 CA GLY A 1 -7.199 12.460 -25.947 1.00 0.00 C ATOM 3 C GLY A 1 -8.340 11.560 -26.379 1.00 0.00 C ATOM 4 O GLY A 1 -8.411 11.149 -27.537 1.00 0.00 O ATOM 0 H1 GLY A 1 -5.574 13.194 -26.956 1.00 0.00 H new ATOM 0 H2 GLY A 1 -6.861 12.709 -27.952 1.00 0.00 H new ATOM 0 H3 GLY A 1 -6.968 14.157 -27.071 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.431 11.859 -25.459 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -7.563 13.174 -25.208 1.00 0.00 H new ATOM 8 N SER A 2 -9.233 11.250 -25.445 1.00 0.00 N ATOM 9 CA SER A 2 -10.373 10.388 -25.733 1.00 0.00 C ATOM 10 C SER A 2 -11.443 11.145 -26.515 1.00 0.00 C ATOM 11 O SER A 2 -11.684 12.328 -26.274 1.00 0.00 O ATOM 12 CB SER A 2 -10.967 9.840 -24.434 1.00 0.00 C ATOM 13 OG SER A 2 -11.770 8.699 -24.682 1.00 0.00 O ATOM 0 H SER A 2 -9.189 11.583 -24.482 1.00 0.00 H new ATOM 0 HA SER A 2 -10.022 9.556 -26.343 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.164 9.580 -23.744 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.566 10.612 -23.950 1.00 0.00 H new ATOM 0 HG SER A 2 -12.137 8.367 -23.836 1.00 0.00 H new ATOM 19 N SER A 3 -12.080 10.454 -27.455 1.00 0.00 N ATOM 20 CA SER A 3 -13.122 11.061 -28.276 1.00 0.00 C ATOM 21 C SER A 3 -14.505 10.762 -27.707 1.00 0.00 C ATOM 22 O SER A 3 -15.281 11.673 -27.422 1.00 0.00 O ATOM 23 CB SER A 3 -13.028 10.549 -29.715 1.00 0.00 C ATOM 24 OG SER A 3 -11.933 11.138 -30.395 1.00 0.00 O ATOM 0 H SER A 3 -11.893 9.474 -27.667 1.00 0.00 H new ATOM 0 HA SER A 3 -12.972 12.141 -28.271 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.918 9.465 -29.712 1.00 0.00 H new ATOM 0 HB3 SER A 3 -13.953 10.774 -30.246 1.00 0.00 H new ATOM 0 HG SER A 3 -11.893 10.793 -31.312 1.00 0.00 H new ATOM 30 N GLY A 4 -14.807 9.477 -27.545 1.00 0.00 N ATOM 31 CA GLY A 4 -16.097 9.080 -27.011 1.00 0.00 C ATOM 32 C GLY A 4 -16.517 7.700 -27.478 1.00 0.00 C ATOM 33 O GLY A 4 -17.524 7.552 -28.171 1.00 0.00 O ATOM 0 H GLY A 4 -14.182 8.704 -27.774 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.056 9.095 -25.922 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -16.851 9.807 -27.312 1.00 0.00 H new ATOM 37 N SER A 5 -15.744 6.688 -27.099 1.00 0.00 N ATOM 38 CA SER A 5 -16.038 5.314 -27.488 1.00 0.00 C ATOM 39 C SER A 5 -15.094 4.338 -26.792 1.00 0.00 C ATOM 40 O SER A 5 -13.874 4.441 -26.918 1.00 0.00 O ATOM 41 CB SER A 5 -15.926 5.155 -29.005 1.00 0.00 C ATOM 42 OG SER A 5 -14.579 5.268 -29.431 1.00 0.00 O ATOM 0 H SER A 5 -14.909 6.794 -26.523 1.00 0.00 H new ATOM 0 HA SER A 5 -17.059 5.087 -27.181 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.325 4.185 -29.303 1.00 0.00 H new ATOM 0 HB3 SER A 5 -16.532 5.914 -29.499 1.00 0.00 H new ATOM 0 HG SER A 5 -13.981 5.051 -28.686 1.00 0.00 H new ATOM 48 N SER A 6 -15.668 3.391 -26.057 1.00 0.00 N ATOM 49 CA SER A 6 -14.879 2.398 -25.337 1.00 0.00 C ATOM 50 C SER A 6 -14.991 1.029 -26.002 1.00 0.00 C ATOM 51 O SER A 6 -16.069 0.624 -26.436 1.00 0.00 O ATOM 52 CB SER A 6 -15.337 2.310 -23.880 1.00 0.00 C ATOM 53 OG SER A 6 -16.723 2.025 -23.798 1.00 0.00 O ATOM 0 H SER A 6 -16.677 3.290 -25.944 1.00 0.00 H new ATOM 0 HA SER A 6 -13.835 2.711 -25.363 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.772 1.534 -23.364 1.00 0.00 H new ATOM 0 HB3 SER A 6 -15.125 3.250 -23.371 1.00 0.00 H new ATOM 0 HG SER A 6 -16.991 1.972 -22.857 1.00 0.00 H new ATOM 59 N GLY A 7 -13.869 0.321 -26.077 1.00 0.00 N ATOM 60 CA GLY A 7 -13.861 -0.995 -26.689 1.00 0.00 C ATOM 61 C GLY A 7 -13.971 -2.110 -25.669 1.00 0.00 C ATOM 62 O GLY A 7 -15.042 -2.687 -25.482 1.00 0.00 O ATOM 0 H GLY A 7 -12.965 0.635 -25.725 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.689 -1.069 -27.394 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.942 -1.120 -27.262 1.00 0.00 H new ATOM 66 N GLY A 8 -12.860 -2.416 -25.006 1.00 0.00 N ATOM 67 CA GLY A 8 -12.857 -3.470 -24.009 1.00 0.00 C ATOM 68 C GLY A 8 -13.929 -3.274 -22.955 1.00 0.00 C ATOM 69 O GLY A 8 -14.800 -2.417 -23.098 1.00 0.00 O ATOM 0 H GLY A 8 -11.962 -1.952 -25.142 1.00 0.00 H new ATOM 0 HA2 GLY A 8 -13.007 -4.431 -24.501 1.00 0.00 H new ATOM 0 HA3 GLY A 8 -11.880 -3.507 -23.527 1.00 0.00 H new ATOM 73 N SER A 9 -13.866 -4.072 -21.894 1.00 0.00 N ATOM 74 CA SER A 9 -14.843 -3.986 -20.814 1.00 0.00 C ATOM 75 C SER A 9 -14.191 -4.285 -19.467 1.00 0.00 C ATOM 76 O SER A 9 -13.753 -5.407 -19.213 1.00 0.00 O ATOM 77 CB SER A 9 -15.996 -4.959 -21.062 1.00 0.00 C ATOM 78 OG SER A 9 -17.072 -4.713 -20.173 1.00 0.00 O ATOM 0 H SER A 9 -13.149 -4.785 -21.759 1.00 0.00 H new ATOM 0 HA SER A 9 -15.234 -2.969 -20.791 1.00 0.00 H new ATOM 0 HB2 SER A 9 -16.342 -4.863 -22.091 1.00 0.00 H new ATOM 0 HB3 SER A 9 -15.645 -5.983 -20.938 1.00 0.00 H new ATOM 0 HG SER A 9 -16.877 -5.120 -19.303 1.00 0.00 H new ATOM 84 N ASP A 10 -14.131 -3.273 -18.609 1.00 0.00 N ATOM 85 CA ASP A 10 -13.534 -3.425 -17.287 1.00 0.00 C ATOM 86 C ASP A 10 -12.259 -4.258 -17.360 1.00 0.00 C ATOM 87 O ASP A 10 -12.005 -5.101 -16.499 1.00 0.00 O ATOM 88 CB ASP A 10 -14.530 -4.078 -16.327 1.00 0.00 C ATOM 89 CG ASP A 10 -15.334 -5.181 -16.988 1.00 0.00 C ATOM 90 OD1 ASP A 10 -16.316 -4.860 -17.690 1.00 0.00 O ATOM 91 OD2 ASP A 10 -14.981 -6.364 -16.803 1.00 0.00 O ATOM 0 H ASP A 10 -14.489 -2.338 -18.805 1.00 0.00 H new ATOM 0 HA ASP A 10 -13.278 -2.433 -16.914 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -13.991 -4.487 -15.472 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -15.210 -3.318 -15.941 1.00 0.00 H new ATOM 96 N SER A 11 -11.459 -4.017 -18.394 1.00 0.00 N ATOM 97 CA SER A 11 -10.211 -4.748 -18.582 1.00 0.00 C ATOM 98 C SER A 11 -9.136 -4.243 -17.625 1.00 0.00 C ATOM 99 O SER A 11 -8.670 -4.977 -16.754 1.00 0.00 O ATOM 100 CB SER A 11 -9.729 -4.612 -20.027 1.00 0.00 C ATOM 101 OG SER A 11 -10.435 -5.491 -20.886 1.00 0.00 O ATOM 0 H SER A 11 -11.653 -3.321 -19.114 1.00 0.00 H new ATOM 0 HA SER A 11 -10.399 -5.800 -18.367 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.864 -3.584 -20.363 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.662 -4.827 -20.079 1.00 0.00 H new ATOM 0 HG SER A 11 -10.631 -5.035 -21.731 1.00 0.00 H new ATOM 107 N SER A 12 -8.746 -2.984 -17.795 1.00 0.00 N ATOM 108 CA SER A 12 -7.723 -2.380 -16.949 1.00 0.00 C ATOM 109 C SER A 12 -8.352 -1.461 -15.906 1.00 0.00 C ATOM 110 O SER A 12 -8.466 -0.253 -16.114 1.00 0.00 O ATOM 111 CB SER A 12 -6.725 -1.593 -17.802 1.00 0.00 C ATOM 112 OG SER A 12 -6.118 -2.426 -18.775 1.00 0.00 O ATOM 0 H SER A 12 -9.123 -2.362 -18.511 1.00 0.00 H new ATOM 0 HA SER A 12 -7.196 -3.181 -16.431 1.00 0.00 H new ATOM 0 HB2 SER A 12 -7.236 -0.766 -18.295 1.00 0.00 H new ATOM 0 HB3 SER A 12 -5.958 -1.158 -17.161 1.00 0.00 H new ATOM 0 HG SER A 12 -5.215 -2.099 -18.968 1.00 0.00 H new ATOM 118 N LEU A 13 -8.760 -2.043 -14.784 1.00 0.00 N ATOM 119 CA LEU A 13 -9.378 -1.279 -13.706 1.00 0.00 C ATOM 120 C LEU A 13 -8.388 -0.288 -13.104 1.00 0.00 C ATOM 121 O LEU A 13 -8.765 0.807 -12.686 1.00 0.00 O ATOM 122 CB LEU A 13 -9.899 -2.221 -12.620 1.00 0.00 C ATOM 123 CG LEU A 13 -11.158 -3.016 -12.968 1.00 0.00 C ATOM 124 CD1 LEU A 13 -12.314 -2.077 -13.277 1.00 0.00 C ATOM 125 CD2 LEU A 13 -10.894 -3.944 -14.145 1.00 0.00 C ATOM 0 H LEU A 13 -8.674 -3.042 -14.597 1.00 0.00 H new ATOM 0 HA LEU A 13 -10.215 -0.719 -14.124 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -9.107 -2.926 -12.368 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -10.100 -1.634 -11.724 1.00 0.00 H new ATOM 0 HG LEU A 13 -11.431 -3.624 -12.105 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -13.201 -2.661 -13.522 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -12.519 -1.454 -12.407 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -12.051 -1.443 -14.124 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -11.801 -4.502 -14.379 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -10.596 -3.355 -15.013 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -10.096 -4.640 -13.887 1.00 0.00 H new ATOM 137 N PHE A 14 -7.118 -0.678 -13.064 1.00 0.00 N ATOM 138 CA PHE A 14 -6.072 0.177 -12.514 1.00 0.00 C ATOM 139 C PHE A 14 -5.185 0.734 -13.624 1.00 0.00 C ATOM 140 O PHE A 14 -5.268 0.303 -14.773 1.00 0.00 O ATOM 141 CB PHE A 14 -5.222 -0.604 -11.510 1.00 0.00 C ATOM 142 CG PHE A 14 -6.032 -1.432 -10.554 1.00 0.00 C ATOM 143 CD1 PHE A 14 -6.627 -2.611 -10.970 1.00 0.00 C ATOM 144 CD2 PHE A 14 -6.198 -1.030 -9.238 1.00 0.00 C ATOM 145 CE1 PHE A 14 -7.374 -3.374 -10.092 1.00 0.00 C ATOM 146 CE2 PHE A 14 -6.943 -1.789 -8.355 1.00 0.00 C ATOM 147 CZ PHE A 14 -7.531 -2.963 -8.783 1.00 0.00 C ATOM 0 H PHE A 14 -6.788 -1.581 -13.406 1.00 0.00 H new ATOM 0 HA PHE A 14 -6.551 1.012 -12.003 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -4.539 -1.256 -12.054 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.609 0.096 -10.942 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -6.506 -2.938 -11.992 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -5.740 -0.113 -8.898 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -7.834 -4.291 -10.430 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -7.065 -1.464 -7.332 1.00 0.00 H new ATOM 0 HZ PHE A 14 -8.113 -3.559 -8.095 1.00 0.00 H new ATOM 157 N GLU A 15 -4.339 1.696 -13.270 1.00 0.00 N ATOM 158 CA GLU A 15 -3.438 2.313 -14.236 1.00 0.00 C ATOM 159 C GLU A 15 -2.014 2.376 -13.690 1.00 0.00 C ATOM 160 O GLU A 15 -1.795 2.749 -12.537 1.00 0.00 O ATOM 161 CB GLU A 15 -3.922 3.720 -14.592 1.00 0.00 C ATOM 162 CG GLU A 15 -4.147 4.611 -13.381 1.00 0.00 C ATOM 163 CD GLU A 15 -4.304 6.072 -13.753 1.00 0.00 C ATOM 164 OE1 GLU A 15 -3.344 6.651 -14.304 1.00 0.00 O ATOM 165 OE2 GLU A 15 -5.387 6.637 -13.492 1.00 0.00 O ATOM 0 H GLU A 15 -4.259 2.065 -12.322 1.00 0.00 H new ATOM 0 HA GLU A 15 -3.436 1.698 -15.136 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -3.191 4.191 -15.249 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -4.853 3.644 -15.154 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -5.038 4.277 -12.850 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -3.308 4.503 -12.694 1.00 0.00 H new ATOM 172 N THR A 16 -1.049 2.008 -14.526 1.00 0.00 N ATOM 173 CA THR A 16 0.353 2.020 -14.128 1.00 0.00 C ATOM 174 C THR A 16 1.037 3.311 -14.563 1.00 0.00 C ATOM 175 O THR A 16 0.698 3.886 -15.598 1.00 0.00 O ATOM 176 CB THR A 16 1.117 0.822 -14.723 1.00 0.00 C ATOM 177 OG1 THR A 16 0.451 -0.400 -14.386 1.00 0.00 O ATOM 178 CG2 THR A 16 2.548 0.784 -14.209 1.00 0.00 C ATOM 0 H THR A 16 -1.213 1.698 -15.484 1.00 0.00 H new ATOM 0 HA THR A 16 0.373 1.950 -13.040 1.00 0.00 H new ATOM 0 HB THR A 16 1.140 0.936 -15.807 1.00 0.00 H new ATOM 0 HG1 THR A 16 0.942 -1.157 -14.769 1.00 0.00 H new ATOM 0 HG21 THR A 16 3.068 -0.070 -14.643 1.00 0.00 H new ATOM 0 HG22 THR A 16 3.061 1.703 -14.492 1.00 0.00 H new ATOM 0 HG23 THR A 16 2.542 0.692 -13.123 1.00 0.00 H new ATOM 186 N TYR A 17 2.001 3.762 -13.768 1.00 0.00 N ATOM 187 CA TYR A 17 2.731 4.987 -14.071 1.00 0.00 C ATOM 188 C TYR A 17 4.128 4.954 -13.457 1.00 0.00 C ATOM 189 O TYR A 17 4.346 4.336 -12.416 1.00 0.00 O ATOM 190 CB TYR A 17 1.963 6.205 -13.554 1.00 0.00 C ATOM 191 CG TYR A 17 1.721 6.179 -12.062 1.00 0.00 C ATOM 192 CD1 TYR A 17 0.661 5.461 -11.522 1.00 0.00 C ATOM 193 CD2 TYR A 17 2.552 6.874 -11.191 1.00 0.00 C ATOM 194 CE1 TYR A 17 0.436 5.436 -10.159 1.00 0.00 C ATOM 195 CE2 TYR A 17 2.335 6.853 -9.827 1.00 0.00 C ATOM 196 CZ TYR A 17 1.276 6.133 -9.316 1.00 0.00 C ATOM 197 OH TYR A 17 1.056 6.110 -7.958 1.00 0.00 O ATOM 0 H TYR A 17 2.295 3.297 -12.909 1.00 0.00 H new ATOM 0 HA TYR A 17 2.831 5.062 -15.154 1.00 0.00 H new ATOM 0 HB2 TYR A 17 2.517 7.108 -13.808 1.00 0.00 H new ATOM 0 HB3 TYR A 17 1.004 6.264 -14.068 1.00 0.00 H new ATOM 0 HD1 TYR A 17 0.002 4.913 -12.179 1.00 0.00 H new ATOM 0 HD2 TYR A 17 3.382 7.440 -11.588 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.393 4.874 -9.756 1.00 0.00 H new ATOM 0 HE2 TYR A 17 2.991 7.398 -9.164 1.00 0.00 H new ATOM 0 HH TYR A 17 1.738 6.651 -7.507 1.00 0.00 H new ATOM 207 N ASN A 18 5.070 5.626 -14.111 1.00 0.00 N ATOM 208 CA ASN A 18 6.446 5.675 -13.631 1.00 0.00 C ATOM 209 C ASN A 18 6.730 6.999 -12.927 1.00 0.00 C ATOM 210 O ASN A 18 6.439 8.071 -13.457 1.00 0.00 O ATOM 211 CB ASN A 18 7.421 5.483 -14.794 1.00 0.00 C ATOM 212 CG ASN A 18 6.864 6.001 -16.106 1.00 0.00 C ATOM 213 OD1 ASN A 18 7.189 7.107 -16.538 1.00 0.00 O ATOM 214 ND2 ASN A 18 6.020 5.200 -16.747 1.00 0.00 N ATOM 0 H ASN A 18 4.906 6.144 -14.974 1.00 0.00 H new ATOM 0 HA ASN A 18 6.583 4.866 -12.914 1.00 0.00 H new ATOM 0 HB2 ASN A 18 8.355 5.998 -14.570 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.657 4.424 -14.896 1.00 0.00 H new ATOM 0 HD21 ASN A 18 5.613 5.494 -17.635 1.00 0.00 H new ATOM 0 HD22 ASN A 18 5.779 4.291 -16.351 1.00 0.00 H new ATOM 221 N VAL A 19 7.301 6.915 -11.730 1.00 0.00 N ATOM 222 CA VAL A 19 7.626 8.106 -10.953 1.00 0.00 C ATOM 223 C VAL A 19 9.135 8.278 -10.817 1.00 0.00 C ATOM 224 O VAL A 19 9.816 7.429 -10.243 1.00 0.00 O ATOM 225 CB VAL A 19 6.998 8.049 -9.548 1.00 0.00 C ATOM 226 CG1 VAL A 19 6.878 9.447 -8.960 1.00 0.00 C ATOM 227 CG2 VAL A 19 5.640 7.365 -9.600 1.00 0.00 C ATOM 0 H VAL A 19 7.548 6.035 -11.277 1.00 0.00 H new ATOM 0 HA VAL A 19 7.213 8.958 -11.492 1.00 0.00 H new ATOM 0 HB VAL A 19 7.650 7.463 -8.900 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.432 9.387 -7.967 1.00 0.00 H new ATOM 0 HG12 VAL A 19 7.868 9.897 -8.887 1.00 0.00 H new ATOM 0 HG13 VAL A 19 6.248 10.060 -9.604 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.210 7.333 -8.599 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.977 7.922 -10.262 1.00 0.00 H new ATOM 0 HG23 VAL A 19 5.759 6.349 -9.976 1.00 0.00 H new ATOM 237 N GLU A 20 9.650 9.383 -11.348 1.00 0.00 N ATOM 238 CA GLU A 20 11.079 9.665 -11.285 1.00 0.00 C ATOM 239 C GLU A 20 11.406 10.553 -10.088 1.00 0.00 C ATOM 240 O GLU A 20 11.336 11.780 -10.173 1.00 0.00 O ATOM 241 CB GLU A 20 11.545 10.340 -12.577 1.00 0.00 C ATOM 242 CG GLU A 20 12.964 10.877 -12.504 1.00 0.00 C ATOM 243 CD GLU A 20 13.241 11.938 -13.552 1.00 0.00 C ATOM 244 OE1 GLU A 20 12.972 13.127 -13.277 1.00 0.00 O ATOM 245 OE2 GLU A 20 13.725 11.581 -14.646 1.00 0.00 O ATOM 0 H GLU A 20 9.099 10.096 -11.826 1.00 0.00 H new ATOM 0 HA GLU A 20 11.606 8.718 -11.167 1.00 0.00 H new ATOM 0 HB2 GLU A 20 11.478 9.624 -13.396 1.00 0.00 H new ATOM 0 HB3 GLU A 20 10.867 11.160 -12.814 1.00 0.00 H new ATOM 0 HG2 GLU A 20 13.139 11.296 -11.513 1.00 0.00 H new ATOM 0 HG3 GLU A 20 13.667 10.054 -12.631 1.00 0.00 H new ATOM 252 N LEU A 21 11.762 9.925 -8.973 1.00 0.00 N ATOM 253 CA LEU A 21 12.100 10.657 -7.757 1.00 0.00 C ATOM 254 C LEU A 21 13.466 11.323 -7.884 1.00 0.00 C ATOM 255 O LEU A 21 14.210 11.063 -8.829 1.00 0.00 O ATOM 256 CB LEU A 21 12.089 9.715 -6.551 1.00 0.00 C ATOM 257 CG LEU A 21 10.772 8.988 -6.280 1.00 0.00 C ATOM 258 CD1 LEU A 21 10.971 7.891 -5.246 1.00 0.00 C ATOM 259 CD2 LEU A 21 9.705 9.971 -5.818 1.00 0.00 C ATOM 0 H LEU A 21 11.824 8.911 -8.886 1.00 0.00 H new ATOM 0 HA LEU A 21 11.350 11.434 -7.610 1.00 0.00 H new ATOM 0 HB2 LEU A 21 12.871 8.969 -6.691 1.00 0.00 H new ATOM 0 HB3 LEU A 21 12.353 10.290 -5.663 1.00 0.00 H new ATOM 0 HG LEU A 21 10.436 8.527 -7.209 1.00 0.00 H new ATOM 0 HD11 LEU A 21 10.023 7.384 -5.066 1.00 0.00 H new ATOM 0 HD12 LEU A 21 11.702 7.172 -5.615 1.00 0.00 H new ATOM 0 HD13 LEU A 21 11.331 8.329 -4.315 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.774 9.436 -5.630 1.00 0.00 H new ATOM 0 HD22 LEU A 21 10.034 10.461 -4.901 1.00 0.00 H new ATOM 0 HD23 LEU A 21 9.542 10.721 -6.592 1.00 0.00 H new ATOM 271 N VAL A 22 13.791 12.183 -6.924 1.00 0.00 N ATOM 272 CA VAL A 22 15.069 12.884 -6.926 1.00 0.00 C ATOM 273 C VAL A 22 15.734 12.820 -5.555 1.00 0.00 C ATOM 274 O VAL A 22 15.087 13.035 -4.530 1.00 0.00 O ATOM 275 CB VAL A 22 14.899 14.360 -7.333 1.00 0.00 C ATOM 276 CG1 VAL A 22 14.105 15.117 -6.279 1.00 0.00 C ATOM 277 CG2 VAL A 22 16.256 15.010 -7.559 1.00 0.00 C ATOM 0 H VAL A 22 13.186 12.411 -6.135 1.00 0.00 H new ATOM 0 HA VAL A 22 15.703 12.383 -7.658 1.00 0.00 H new ATOM 0 HB VAL A 22 14.343 14.399 -8.270 1.00 0.00 H new ATOM 0 HG11 VAL A 22 13.995 16.158 -6.584 1.00 0.00 H new ATOM 0 HG12 VAL A 22 13.119 14.664 -6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 22 14.631 15.072 -5.325 1.00 0.00 H new ATOM 0 HG21 VAL A 22 16.117 16.052 -7.846 1.00 0.00 H new ATOM 0 HG22 VAL A 22 16.840 14.961 -6.640 1.00 0.00 H new ATOM 0 HG23 VAL A 22 16.784 14.483 -8.353 1.00 0.00 H new ATOM 287 N ARG A 23 17.029 12.523 -5.545 1.00 0.00 N ATOM 288 CA ARG A 23 17.782 12.430 -4.300 1.00 0.00 C ATOM 289 C ARG A 23 18.819 13.545 -4.207 1.00 0.00 C ATOM 290 O ARG A 23 19.840 13.518 -4.894 1.00 0.00 O ATOM 291 CB ARG A 23 18.472 11.068 -4.198 1.00 0.00 C ATOM 292 CG ARG A 23 17.521 9.891 -4.343 1.00 0.00 C ATOM 293 CD ARG A 23 18.076 8.641 -3.678 1.00 0.00 C ATOM 294 NE ARG A 23 19.324 8.200 -4.297 1.00 0.00 N ATOM 295 CZ ARG A 23 19.780 6.955 -4.225 1.00 0.00 C ATOM 296 NH1 ARG A 23 19.095 6.032 -3.564 1.00 0.00 N ATOM 297 NH2 ARG A 23 20.924 6.631 -4.815 1.00 0.00 N ATOM 0 H ARG A 23 17.579 12.343 -6.385 1.00 0.00 H new ATOM 0 HA ARG A 23 17.082 12.539 -3.472 1.00 0.00 H new ATOM 0 HB2 ARG A 23 19.240 11.001 -4.969 1.00 0.00 H new ATOM 0 HB3 ARG A 23 18.979 10.998 -3.236 1.00 0.00 H new ATOM 0 HG2 ARG A 23 16.558 10.143 -3.899 1.00 0.00 H new ATOM 0 HG3 ARG A 23 17.343 9.694 -5.400 1.00 0.00 H new ATOM 0 HD2 ARG A 23 18.246 8.839 -2.620 1.00 0.00 H new ATOM 0 HD3 ARG A 23 17.339 7.840 -3.738 1.00 0.00 H new ATOM 0 HE ARG A 23 19.875 8.886 -4.813 1.00 0.00 H new ATOM 0 HH11 ARG A 23 18.216 6.278 -3.109 1.00 0.00 H new ATOM 0 HH12 ARG A 23 19.447 5.076 -3.510 1.00 0.00 H new ATOM 0 HH21 ARG A 23 21.454 7.339 -5.324 1.00 0.00 H new ATOM 0 HH22 ARG A 23 21.274 5.674 -4.759 1.00 0.00 H new ATOM 311 N LYS A 24 18.549 14.526 -3.352 1.00 0.00 N ATOM 312 CA LYS A 24 19.458 15.652 -3.167 1.00 0.00 C ATOM 313 C LYS A 24 20.875 15.166 -2.884 1.00 0.00 C ATOM 314 O LYS A 24 21.150 13.966 -2.923 1.00 0.00 O ATOM 315 CB LYS A 24 18.973 16.541 -2.020 1.00 0.00 C ATOM 316 CG LYS A 24 17.695 17.299 -2.335 1.00 0.00 C ATOM 317 CD LYS A 24 17.990 18.652 -2.961 1.00 0.00 C ATOM 318 CE LYS A 24 18.050 18.562 -4.478 1.00 0.00 C ATOM 319 NZ LYS A 24 17.876 19.895 -5.120 1.00 0.00 N ATOM 0 H LYS A 24 17.708 14.564 -2.776 1.00 0.00 H new ATOM 0 HA LYS A 24 19.470 16.233 -4.089 1.00 0.00 H new ATOM 0 HB2 LYS A 24 18.811 15.923 -1.137 1.00 0.00 H new ATOM 0 HB3 LYS A 24 19.757 17.256 -1.769 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.079 16.709 -3.014 1.00 0.00 H new ATOM 0 HG3 LYS A 24 17.118 17.438 -1.421 1.00 0.00 H new ATOM 0 HD2 LYS A 24 17.220 19.366 -2.668 1.00 0.00 H new ATOM 0 HD3 LYS A 24 18.938 19.032 -2.580 1.00 0.00 H new ATOM 0 HE2 LYS A 24 19.007 18.136 -4.779 1.00 0.00 H new ATOM 0 HE3 LYS A 24 17.274 17.884 -4.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 17.923 19.791 -6.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 16.952 20.291 -4.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 18.631 20.535 -4.802 1.00 0.00 H new ATOM 333 N ASP A 25 21.771 16.104 -2.597 1.00 0.00 N ATOM 334 CA ASP A 25 23.161 15.770 -2.305 1.00 0.00 C ATOM 335 C ASP A 25 23.319 15.327 -0.854 1.00 0.00 C ATOM 336 O ASP A 25 24.228 15.771 -0.154 1.00 0.00 O ATOM 337 CB ASP A 25 24.066 16.971 -2.586 1.00 0.00 C ATOM 338 CG ASP A 25 23.633 18.211 -1.829 1.00 0.00 C ATOM 339 OD1 ASP A 25 23.388 18.106 -0.609 1.00 0.00 O ATOM 340 OD2 ASP A 25 23.540 19.287 -2.456 1.00 0.00 O ATOM 0 H ASP A 25 21.560 17.101 -2.560 1.00 0.00 H new ATOM 0 HA ASP A 25 23.455 14.944 -2.953 1.00 0.00 H new ATOM 0 HB2 ASP A 25 25.091 16.722 -2.313 1.00 0.00 H new ATOM 0 HB3 ASP A 25 24.063 17.182 -3.655 1.00 0.00 H new ATOM 345 N GLY A 26 22.427 14.447 -0.408 1.00 0.00 N ATOM 346 CA GLY A 26 22.484 13.960 0.957 1.00 0.00 C ATOM 347 C GLY A 26 21.126 13.534 1.479 1.00 0.00 C ATOM 348 O GLY A 26 20.826 13.707 2.660 1.00 0.00 O ATOM 0 H GLY A 26 21.666 14.063 -0.968 1.00 0.00 H new ATOM 0 HA2 GLY A 26 23.171 13.115 1.010 1.00 0.00 H new ATOM 0 HA3 GLY A 26 22.889 14.741 1.601 1.00 0.00 H new ATOM 352 N GLN A 27 20.302 12.979 0.596 1.00 0.00 N ATOM 353 CA GLN A 27 18.968 12.530 0.974 1.00 0.00 C ATOM 354 C GLN A 27 18.712 11.108 0.484 1.00 0.00 C ATOM 355 O GLN A 27 19.327 10.653 -0.480 1.00 0.00 O ATOM 356 CB GLN A 27 17.908 13.476 0.406 1.00 0.00 C ATOM 357 CG GLN A 27 16.482 13.023 0.672 1.00 0.00 C ATOM 358 CD GLN A 27 15.455 13.880 -0.041 1.00 0.00 C ATOM 359 OE1 GLN A 27 15.417 13.782 -1.365 1.00 0.00 O flip ATOM 360 NE2 GLN A 27 14.703 14.623 0.591 1.00 0.00 N flip ATOM 0 H GLN A 27 20.535 12.830 -0.386 1.00 0.00 H new ATOM 0 HA GLN A 27 18.905 12.537 2.062 1.00 0.00 H new ATOM 0 HB2 GLN A 27 18.051 14.468 0.835 1.00 0.00 H new ATOM 0 HB3 GLN A 27 18.056 13.570 -0.670 1.00 0.00 H new ATOM 0 HG2 GLN A 27 16.369 11.987 0.354 1.00 0.00 H new ATOM 0 HG3 GLN A 27 16.290 13.050 1.745 1.00 0.00 H new ATOM 0 HE21 GLN A 27 14.766 14.667 1.608 1.00 0.00 H new ATOM 0 HE22 GLN A 27 14.017 15.194 0.097 1.00 0.00 H new ATOM 369 N SER A 28 17.800 10.412 1.155 1.00 0.00 N ATOM 370 CA SER A 28 17.466 9.040 0.791 1.00 0.00 C ATOM 371 C SER A 28 16.062 8.962 0.199 1.00 0.00 C ATOM 372 O SER A 28 15.361 9.970 0.097 1.00 0.00 O ATOM 373 CB SER A 28 17.568 8.126 2.013 1.00 0.00 C ATOM 374 OG SER A 28 17.844 6.790 1.629 1.00 0.00 O ATOM 0 H SER A 28 17.279 10.775 1.953 1.00 0.00 H new ATOM 0 HA SER A 28 18.179 8.707 0.037 1.00 0.00 H new ATOM 0 HB2 SER A 28 18.354 8.487 2.676 1.00 0.00 H new ATOM 0 HB3 SER A 28 16.635 8.161 2.576 1.00 0.00 H new ATOM 0 HG SER A 28 17.906 6.226 2.428 1.00 0.00 H new ATOM 380 N LEU A 29 15.657 7.758 -0.190 1.00 0.00 N ATOM 381 CA LEU A 29 14.336 7.546 -0.773 1.00 0.00 C ATOM 382 C LEU A 29 13.241 7.766 0.266 1.00 0.00 C ATOM 383 O LEU A 29 12.320 8.553 0.055 1.00 0.00 O ATOM 384 CB LEU A 29 14.232 6.133 -1.349 1.00 0.00 C ATOM 385 CG LEU A 29 13.301 5.964 -2.549 1.00 0.00 C ATOM 386 CD1 LEU A 29 13.808 6.769 -3.736 1.00 0.00 C ATOM 387 CD2 LEU A 29 13.167 4.494 -2.919 1.00 0.00 C ATOM 0 H LEU A 29 16.224 6.914 -0.112 1.00 0.00 H new ATOM 0 HA LEU A 29 14.200 8.270 -1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 29 15.230 5.807 -1.640 1.00 0.00 H new ATOM 0 HB3 LEU A 29 13.896 5.463 -0.557 1.00 0.00 H new ATOM 0 HG LEU A 29 12.316 6.340 -2.274 1.00 0.00 H new ATOM 0 HD11 LEU A 29 13.132 6.636 -4.581 1.00 0.00 H new ATOM 0 HD12 LEU A 29 13.851 7.825 -3.468 1.00 0.00 H new ATOM 0 HD13 LEU A 29 14.805 6.424 -4.011 1.00 0.00 H new ATOM 0 HD21 LEU A 29 12.500 4.394 -3.775 1.00 0.00 H new ATOM 0 HD22 LEU A 29 14.148 4.092 -3.173 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.757 3.942 -2.073 1.00 0.00 H new ATOM 399 N GLY A 30 13.350 7.066 1.391 1.00 0.00 N ATOM 400 CA GLY A 30 12.364 7.200 2.447 1.00 0.00 C ATOM 401 C GLY A 30 11.029 6.586 2.076 1.00 0.00 C ATOM 402 O GLY A 30 9.986 7.227 2.205 1.00 0.00 O ATOM 0 H GLY A 30 14.104 6.408 1.590 1.00 0.00 H new ATOM 0 HA2 GLY A 30 12.740 6.724 3.353 1.00 0.00 H new ATOM 0 HA3 GLY A 30 12.223 8.256 2.676 1.00 0.00 H new ATOM 406 N ILE A 31 11.061 5.341 1.611 1.00 0.00 N ATOM 407 CA ILE A 31 9.845 4.641 1.219 1.00 0.00 C ATOM 408 C ILE A 31 9.831 3.216 1.763 1.00 0.00 C ATOM 409 O ILE A 31 10.499 2.331 1.229 1.00 0.00 O ATOM 410 CB ILE A 31 9.690 4.596 -0.312 1.00 0.00 C ATOM 411 CG1 ILE A 31 9.661 6.014 -0.886 1.00 0.00 C ATOM 412 CG2 ILE A 31 8.427 3.838 -0.695 1.00 0.00 C ATOM 413 CD1 ILE A 31 9.754 6.057 -2.395 1.00 0.00 C ATOM 0 H ILE A 31 11.916 4.797 1.497 1.00 0.00 H new ATOM 0 HA ILE A 31 9.010 5.198 1.644 1.00 0.00 H new ATOM 0 HB ILE A 31 10.547 4.071 -0.733 1.00 0.00 H new ATOM 0 HG12 ILE A 31 8.740 6.505 -0.573 1.00 0.00 H new ATOM 0 HG13 ILE A 31 10.487 6.586 -0.463 1.00 0.00 H new ATOM 0 HG21 ILE A 31 8.332 3.815 -1.781 1.00 0.00 H new ATOM 0 HG22 ILE A 31 8.485 2.818 -0.314 1.00 0.00 H new ATOM 0 HG23 ILE A 31 7.559 4.337 -0.265 1.00 0.00 H new ATOM 0 HD11 ILE A 31 9.728 7.093 -2.732 1.00 0.00 H new ATOM 0 HD12 ILE A 31 10.688 5.595 -2.715 1.00 0.00 H new ATOM 0 HD13 ILE A 31 8.914 5.514 -2.827 1.00 0.00 H new ATOM 425 N ARG A 32 9.064 3.002 2.827 1.00 0.00 N ATOM 426 CA ARG A 32 8.963 1.685 3.443 1.00 0.00 C ATOM 427 C ARG A 32 8.027 0.782 2.644 1.00 0.00 C ATOM 428 O ARG A 32 6.964 1.214 2.196 1.00 0.00 O ATOM 429 CB ARG A 32 8.462 1.809 4.883 1.00 0.00 C ATOM 430 CG ARG A 32 9.487 2.404 5.835 1.00 0.00 C ATOM 431 CD ARG A 32 10.629 1.435 6.100 1.00 0.00 C ATOM 432 NE ARG A 32 10.224 0.337 6.972 1.00 0.00 N ATOM 433 CZ ARG A 32 10.091 0.454 8.289 1.00 0.00 C ATOM 434 NH1 ARG A 32 10.331 1.616 8.881 1.00 0.00 N ATOM 435 NH2 ARG A 32 9.718 -0.592 9.015 1.00 0.00 N ATOM 0 H ARG A 32 8.504 3.724 3.280 1.00 0.00 H new ATOM 0 HA ARG A 32 9.957 1.237 3.448 1.00 0.00 H new ATOM 0 HB2 ARG A 32 7.565 2.428 4.895 1.00 0.00 H new ATOM 0 HB3 ARG A 32 8.173 0.822 5.244 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.883 3.328 5.414 1.00 0.00 H new ATOM 0 HG3 ARG A 32 9.003 2.664 6.776 1.00 0.00 H new ATOM 0 HD2 ARG A 32 10.989 1.032 5.154 1.00 0.00 H new ATOM 0 HD3 ARG A 32 11.461 1.972 6.556 1.00 0.00 H new ATOM 0 HE ARG A 32 10.032 -0.570 6.547 1.00 0.00 H new ATOM 0 HH11 ARG A 32 10.618 2.422 8.325 1.00 0.00 H new ATOM 0 HH12 ARG A 32 10.228 1.704 9.892 1.00 0.00 H new ATOM 0 HH21 ARG A 32 9.533 -1.487 8.562 1.00 0.00 H new ATOM 0 HH22 ARG A 32 9.616 -0.501 10.026 1.00 0.00 H new ATOM 449 N ILE A 33 8.430 -0.472 2.469 1.00 0.00 N ATOM 450 CA ILE A 33 7.627 -1.435 1.725 1.00 0.00 C ATOM 451 C ILE A 33 7.073 -2.517 2.646 1.00 0.00 C ATOM 452 O ILE A 33 7.477 -2.628 3.804 1.00 0.00 O ATOM 453 CB ILE A 33 8.445 -2.102 0.603 1.00 0.00 C ATOM 454 CG1 ILE A 33 9.614 -2.892 1.195 1.00 0.00 C ATOM 455 CG2 ILE A 33 8.949 -1.054 -0.378 1.00 0.00 C ATOM 456 CD1 ILE A 33 10.013 -4.093 0.366 1.00 0.00 C ATOM 0 H ILE A 33 9.307 -0.845 2.832 1.00 0.00 H new ATOM 0 HA ILE A 33 6.800 -0.880 1.281 1.00 0.00 H new ATOM 0 HB ILE A 33 7.799 -2.795 0.064 1.00 0.00 H new ATOM 0 HG12 ILE A 33 10.474 -2.230 1.298 1.00 0.00 H new ATOM 0 HG13 ILE A 33 9.346 -3.225 2.198 1.00 0.00 H new ATOM 0 HG21 ILE A 33 9.525 -1.540 -1.165 1.00 0.00 H new ATOM 0 HG22 ILE A 33 8.101 -0.531 -0.819 1.00 0.00 H new ATOM 0 HG23 ILE A 33 9.583 -0.339 0.147 1.00 0.00 H new ATOM 0 HD11 ILE A 33 10.847 -4.605 0.845 1.00 0.00 H new ATOM 0 HD12 ILE A 33 9.167 -4.776 0.284 1.00 0.00 H new ATOM 0 HD13 ILE A 33 10.313 -3.765 -0.629 1.00 0.00 H new ATOM 468 N VAL A 34 6.146 -3.313 2.124 1.00 0.00 N ATOM 469 CA VAL A 34 5.538 -4.389 2.898 1.00 0.00 C ATOM 470 C VAL A 34 5.211 -5.586 2.012 1.00 0.00 C ATOM 471 O VAL A 34 4.837 -5.429 0.850 1.00 0.00 O ATOM 472 CB VAL A 34 4.250 -3.917 3.599 1.00 0.00 C ATOM 473 CG1 VAL A 34 3.083 -3.909 2.624 1.00 0.00 C ATOM 474 CG2 VAL A 34 3.946 -4.797 4.802 1.00 0.00 C ATOM 0 H VAL A 34 5.799 -3.233 1.168 1.00 0.00 H new ATOM 0 HA VAL A 34 6.266 -4.687 3.653 1.00 0.00 H new ATOM 0 HB VAL A 34 4.402 -2.897 3.953 1.00 0.00 H new ATOM 0 HG11 VAL A 34 2.182 -3.573 3.137 1.00 0.00 H new ATOM 0 HG12 VAL A 34 3.304 -3.233 1.798 1.00 0.00 H new ATOM 0 HG13 VAL A 34 2.926 -4.916 2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 34 3.033 -4.450 5.286 1.00 0.00 H new ATOM 0 HG22 VAL A 34 3.813 -5.828 4.474 1.00 0.00 H new ATOM 0 HG23 VAL A 34 4.774 -4.745 5.509 1.00 0.00 H new ATOM 484 N GLY A 35 5.354 -6.785 2.570 1.00 0.00 N ATOM 485 CA GLY A 35 5.070 -7.992 1.817 1.00 0.00 C ATOM 486 C GLY A 35 3.754 -8.629 2.217 1.00 0.00 C ATOM 487 O GLY A 35 3.625 -9.165 3.318 1.00 0.00 O ATOM 0 H GLY A 35 5.661 -6.941 3.530 1.00 0.00 H new ATOM 0 HA2 GLY A 35 5.047 -7.756 0.753 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.877 -8.709 1.967 1.00 0.00 H new ATOM 491 N TYR A 36 2.774 -8.569 1.322 1.00 0.00 N ATOM 492 CA TYR A 36 1.459 -9.140 1.589 1.00 0.00 C ATOM 493 C TYR A 36 1.390 -10.590 1.120 1.00 0.00 C ATOM 494 O TYR A 36 2.043 -10.973 0.149 1.00 0.00 O ATOM 495 CB TYR A 36 0.372 -8.316 0.898 1.00 0.00 C ATOM 496 CG TYR A 36 -0.235 -7.250 1.782 1.00 0.00 C ATOM 497 CD1 TYR A 36 0.347 -5.993 1.886 1.00 0.00 C ATOM 498 CD2 TYR A 36 -1.389 -7.501 2.514 1.00 0.00 C ATOM 499 CE1 TYR A 36 -0.203 -5.016 2.694 1.00 0.00 C ATOM 500 CE2 TYR A 36 -1.947 -6.529 3.323 1.00 0.00 C ATOM 501 CZ TYR A 36 -1.350 -5.289 3.409 1.00 0.00 C ATOM 502 OH TYR A 36 -1.902 -4.319 4.215 1.00 0.00 O ATOM 0 H TYR A 36 2.865 -8.131 0.405 1.00 0.00 H new ATOM 0 HA TYR A 36 1.293 -9.117 2.666 1.00 0.00 H new ATOM 0 HB2 TYR A 36 0.795 -7.843 0.012 1.00 0.00 H new ATOM 0 HB3 TYR A 36 -0.417 -8.985 0.556 1.00 0.00 H new ATOM 0 HD1 TYR A 36 1.244 -5.776 1.326 1.00 0.00 H new ATOM 0 HD2 TYR A 36 -1.858 -8.472 2.450 1.00 0.00 H new ATOM 0 HE1 TYR A 36 0.263 -4.044 2.765 1.00 0.00 H new ATOM 0 HE2 TYR A 36 -2.845 -6.740 3.884 1.00 0.00 H new ATOM 0 HH TYR A 36 -2.707 -4.672 4.648 1.00 0.00 H new ATOM 512 N VAL A 37 0.593 -11.393 1.818 1.00 0.00 N ATOM 513 CA VAL A 37 0.435 -12.801 1.473 1.00 0.00 C ATOM 514 C VAL A 37 -1.030 -13.148 1.234 1.00 0.00 C ATOM 515 O VAL A 37 -1.345 -14.118 0.546 1.00 0.00 O ATOM 516 CB VAL A 37 0.993 -13.716 2.580 1.00 0.00 C ATOM 517 CG1 VAL A 37 0.778 -15.179 2.223 1.00 0.00 C ATOM 518 CG2 VAL A 37 2.469 -13.428 2.814 1.00 0.00 C ATOM 0 H VAL A 37 0.047 -11.093 2.625 1.00 0.00 H new ATOM 0 HA VAL A 37 0.999 -12.967 0.555 1.00 0.00 H new ATOM 0 HB VAL A 37 0.454 -13.509 3.504 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.179 -15.810 3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -0.289 -15.373 2.109 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.290 -15.404 1.287 1.00 0.00 H new ATOM 0 HG21 VAL A 37 2.847 -14.083 3.599 1.00 0.00 H new ATOM 0 HG22 VAL A 37 3.025 -13.606 1.893 1.00 0.00 H new ATOM 0 HG23 VAL A 37 2.593 -12.388 3.117 1.00 0.00 H new ATOM 528 N GLY A 38 -1.923 -12.347 1.807 1.00 0.00 N ATOM 529 CA GLY A 38 -3.346 -12.585 1.644 1.00 0.00 C ATOM 530 C GLY A 38 -3.782 -13.913 2.231 1.00 0.00 C ATOM 531 O GLY A 38 -3.099 -14.925 2.074 1.00 0.00 O ATOM 0 H GLY A 38 -1.687 -11.538 2.381 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -3.903 -11.779 2.122 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -3.596 -12.560 0.583 1.00 0.00 H new ATOM 535 N THR A 39 -4.924 -13.910 2.913 1.00 0.00 N ATOM 536 CA THR A 39 -5.449 -15.122 3.528 1.00 0.00 C ATOM 537 C THR A 39 -6.938 -15.284 3.241 1.00 0.00 C ATOM 538 O THR A 39 -7.565 -14.403 2.654 1.00 0.00 O ATOM 539 CB THR A 39 -5.229 -15.119 5.053 1.00 0.00 C ATOM 540 OG1 THR A 39 -5.544 -16.406 5.596 1.00 0.00 O ATOM 541 CG2 THR A 39 -6.089 -14.057 5.721 1.00 0.00 C ATOM 0 H THR A 39 -5.502 -13.081 3.053 1.00 0.00 H new ATOM 0 HA THR A 39 -4.904 -15.959 3.091 1.00 0.00 H new ATOM 0 HB THR A 39 -4.181 -14.890 5.247 1.00 0.00 H new ATOM 0 HG1 THR A 39 -5.400 -16.396 6.565 1.00 0.00 H new ATOM 0 HG21 THR A 39 -5.917 -14.074 6.797 1.00 0.00 H new ATOM 0 HG22 THR A 39 -5.827 -13.075 5.327 1.00 0.00 H new ATOM 0 HG23 THR A 39 -7.141 -14.260 5.519 1.00 0.00 H new ATOM 549 N SER A 40 -7.497 -16.414 3.660 1.00 0.00 N ATOM 550 CA SER A 40 -8.913 -16.692 3.445 1.00 0.00 C ATOM 551 C SER A 40 -9.769 -15.495 3.847 1.00 0.00 C ATOM 552 O SER A 40 -10.603 -15.026 3.073 1.00 0.00 O ATOM 553 CB SER A 40 -9.338 -17.928 4.241 1.00 0.00 C ATOM 554 OG SER A 40 -10.522 -18.495 3.707 1.00 0.00 O ATOM 0 H SER A 40 -6.992 -17.152 4.150 1.00 0.00 H new ATOM 0 HA SER A 40 -9.063 -16.883 2.382 1.00 0.00 H new ATOM 0 HB2 SER A 40 -8.538 -18.668 4.225 1.00 0.00 H new ATOM 0 HB3 SER A 40 -9.500 -17.655 5.284 1.00 0.00 H new ATOM 0 HG SER A 40 -10.772 -19.284 4.231 1.00 0.00 H new ATOM 560 N HIS A 41 -9.555 -15.005 5.065 1.00 0.00 N ATOM 561 CA HIS A 41 -10.306 -13.862 5.571 1.00 0.00 C ATOM 562 C HIS A 41 -10.496 -12.811 4.482 1.00 0.00 C ATOM 563 O HIS A 41 -9.704 -12.724 3.542 1.00 0.00 O ATOM 564 CB HIS A 41 -9.588 -13.245 6.772 1.00 0.00 C ATOM 565 CG HIS A 41 -9.737 -14.040 8.032 1.00 0.00 C ATOM 566 ND1 HIS A 41 -8.662 -14.527 8.746 1.00 0.00 N ATOM 567 CD2 HIS A 41 -10.843 -14.432 8.707 1.00 0.00 C ATOM 568 CE1 HIS A 41 -9.101 -15.185 9.804 1.00 0.00 C ATOM 569 NE2 HIS A 41 -10.421 -15.142 9.804 1.00 0.00 N ATOM 0 H HIS A 41 -8.868 -15.382 5.719 1.00 0.00 H new ATOM 0 HA HIS A 41 -11.288 -14.215 5.886 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -8.528 -13.144 6.539 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -9.974 -12.240 6.939 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -11.867 -14.225 8.434 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -8.485 -15.675 10.544 1.00 0.00 H new ATOM 0 HE2 HIS A 41 -11.028 -15.567 10.505 1.00 0.00 H new ATOM 578 N THR A 42 -11.551 -12.013 4.613 1.00 0.00 N ATOM 579 CA THR A 42 -11.847 -10.970 3.639 1.00 0.00 C ATOM 580 C THR A 42 -10.597 -10.164 3.301 1.00 0.00 C ATOM 581 O THR A 42 -9.564 -10.300 3.954 1.00 0.00 O ATOM 582 CB THR A 42 -12.937 -10.012 4.156 1.00 0.00 C ATOM 583 OG1 THR A 42 -12.462 -9.303 5.306 1.00 0.00 O ATOM 584 CG2 THR A 42 -14.204 -10.775 4.511 1.00 0.00 C ATOM 0 H THR A 42 -12.215 -12.069 5.385 1.00 0.00 H new ATOM 0 HA THR A 42 -12.209 -11.469 2.740 1.00 0.00 H new ATOM 0 HB THR A 42 -13.170 -9.301 3.363 1.00 0.00 H new ATOM 0 HG1 THR A 42 -13.160 -8.695 5.627 1.00 0.00 H new ATOM 0 HG21 THR A 42 -14.959 -10.078 4.874 1.00 0.00 H new ATOM 0 HG22 THR A 42 -14.579 -11.289 3.626 1.00 0.00 H new ATOM 0 HG23 THR A 42 -13.983 -11.506 5.288 1.00 0.00 H new ATOM 592 N GLY A 43 -10.700 -9.324 2.275 1.00 0.00 N ATOM 593 CA GLY A 43 -9.570 -8.509 1.868 1.00 0.00 C ATOM 594 C GLY A 43 -8.393 -9.341 1.402 1.00 0.00 C ATOM 595 O GLY A 43 -7.398 -9.474 2.114 1.00 0.00 O ATOM 0 H GLY A 43 -11.545 -9.194 1.719 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -9.879 -7.840 1.065 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -9.259 -7.881 2.703 1.00 0.00 H new ATOM 599 N GLU A 44 -8.506 -9.904 0.203 1.00 0.00 N ATOM 600 CA GLU A 44 -7.442 -10.730 -0.356 1.00 0.00 C ATOM 601 C GLU A 44 -6.529 -9.904 -1.257 1.00 0.00 C ATOM 602 O GLU A 44 -6.986 -9.262 -2.202 1.00 0.00 O ATOM 603 CB GLU A 44 -8.035 -11.899 -1.146 1.00 0.00 C ATOM 604 CG GLU A 44 -8.551 -11.505 -2.520 1.00 0.00 C ATOM 605 CD GLU A 44 -9.691 -12.387 -2.991 1.00 0.00 C ATOM 606 OE1 GLU A 44 -10.730 -12.432 -2.299 1.00 0.00 O ATOM 607 OE2 GLU A 44 -9.544 -13.033 -4.049 1.00 0.00 O ATOM 0 H GLU A 44 -9.323 -9.803 -0.399 1.00 0.00 H new ATOM 0 HA GLU A 44 -6.850 -11.123 0.470 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -7.275 -12.672 -1.260 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -8.852 -12.337 -0.572 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -8.886 -10.468 -2.494 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -7.734 -11.559 -3.240 1.00 0.00 H new ATOM 614 N ALA A 45 -5.234 -9.926 -0.957 1.00 0.00 N ATOM 615 CA ALA A 45 -4.256 -9.181 -1.739 1.00 0.00 C ATOM 616 C ALA A 45 -2.839 -9.669 -1.455 1.00 0.00 C ATOM 617 O ALA A 45 -2.493 -9.968 -0.312 1.00 0.00 O ATOM 618 CB ALA A 45 -4.371 -7.692 -1.449 1.00 0.00 C ATOM 0 H ALA A 45 -4.838 -10.452 -0.178 1.00 0.00 H new ATOM 0 HA ALA A 45 -4.467 -9.351 -2.795 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -3.634 -7.148 -2.040 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -5.372 -7.347 -1.709 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -4.190 -7.513 -0.389 1.00 0.00 H new ATOM 624 N SER A 46 -2.024 -9.747 -2.501 1.00 0.00 N ATOM 625 CA SER A 46 -0.645 -10.203 -2.364 1.00 0.00 C ATOM 626 C SER A 46 0.293 -9.362 -3.225 1.00 0.00 C ATOM 627 O SER A 46 -0.077 -8.910 -4.307 1.00 0.00 O ATOM 628 CB SER A 46 -0.532 -11.677 -2.757 1.00 0.00 C ATOM 629 OG SER A 46 -1.493 -12.462 -2.072 1.00 0.00 O ATOM 0 H SER A 46 -2.294 -9.500 -3.453 1.00 0.00 H new ATOM 0 HA SER A 46 -0.352 -10.089 -1.320 1.00 0.00 H new ATOM 0 HB2 SER A 46 -0.672 -11.782 -3.833 1.00 0.00 H new ATOM 0 HB3 SER A 46 0.470 -12.042 -2.529 1.00 0.00 H new ATOM 0 HG SER A 46 -1.401 -13.400 -2.341 1.00 0.00 H new ATOM 635 N GLY A 47 1.512 -9.157 -2.734 1.00 0.00 N ATOM 636 CA GLY A 47 2.485 -8.372 -3.470 1.00 0.00 C ATOM 637 C GLY A 47 3.232 -7.395 -2.583 1.00 0.00 C ATOM 638 O GLY A 47 3.354 -7.610 -1.377 1.00 0.00 O ATOM 0 H GLY A 47 1.842 -9.521 -1.840 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.199 -9.041 -3.950 1.00 0.00 H new ATOM 0 HA3 GLY A 47 1.979 -7.823 -4.264 1.00 0.00 H new ATOM 642 N ILE A 48 3.734 -6.320 -3.181 1.00 0.00 N ATOM 643 CA ILE A 48 4.473 -5.308 -2.437 1.00 0.00 C ATOM 644 C ILE A 48 3.702 -3.993 -2.383 1.00 0.00 C ATOM 645 O ILE A 48 3.247 -3.486 -3.408 1.00 0.00 O ATOM 646 CB ILE A 48 5.859 -5.052 -3.058 1.00 0.00 C ATOM 647 CG1 ILE A 48 6.664 -6.352 -3.114 1.00 0.00 C ATOM 648 CG2 ILE A 48 6.608 -3.993 -2.264 1.00 0.00 C ATOM 649 CD1 ILE A 48 6.996 -6.917 -1.751 1.00 0.00 C ATOM 0 H ILE A 48 3.642 -6.128 -4.178 1.00 0.00 H new ATOM 0 HA ILE A 48 4.603 -5.693 -1.425 1.00 0.00 H new ATOM 0 HB ILE A 48 5.723 -4.686 -4.076 1.00 0.00 H new ATOM 0 HG12 ILE A 48 6.100 -7.095 -3.679 1.00 0.00 H new ATOM 0 HG13 ILE A 48 7.591 -6.173 -3.659 1.00 0.00 H new ATOM 0 HG21 ILE A 48 7.586 -3.823 -2.715 1.00 0.00 H new ATOM 0 HG22 ILE A 48 6.039 -3.063 -2.270 1.00 0.00 H new ATOM 0 HG23 ILE A 48 6.737 -4.332 -1.236 1.00 0.00 H new ATOM 0 HD11 ILE A 48 7.567 -7.838 -1.868 1.00 0.00 H new ATOM 0 HD12 ILE A 48 7.587 -6.192 -1.191 1.00 0.00 H new ATOM 0 HD13 ILE A 48 6.074 -7.129 -1.210 1.00 0.00 H new ATOM 661 N TYR A 49 3.562 -3.446 -1.181 1.00 0.00 N ATOM 662 CA TYR A 49 2.846 -2.189 -0.993 1.00 0.00 C ATOM 663 C TYR A 49 3.630 -1.246 -0.086 1.00 0.00 C ATOM 664 O TYR A 49 4.438 -1.682 0.734 1.00 0.00 O ATOM 665 CB TYR A 49 1.461 -2.452 -0.398 1.00 0.00 C ATOM 666 CG TYR A 49 0.602 -3.364 -1.244 1.00 0.00 C ATOM 667 CD1 TYR A 49 0.904 -4.714 -1.371 1.00 0.00 C ATOM 668 CD2 TYR A 49 -0.511 -2.876 -1.917 1.00 0.00 C ATOM 669 CE1 TYR A 49 0.122 -5.552 -2.144 1.00 0.00 C ATOM 670 CE2 TYR A 49 -1.300 -3.706 -2.690 1.00 0.00 C ATOM 671 CZ TYR A 49 -0.979 -5.043 -2.801 1.00 0.00 C ATOM 672 OH TYR A 49 -1.760 -5.873 -3.571 1.00 0.00 O ATOM 0 H TYR A 49 3.934 -3.852 -0.323 1.00 0.00 H new ATOM 0 HA TYR A 49 2.732 -1.715 -1.968 1.00 0.00 H new ATOM 0 HB2 TYR A 49 1.578 -2.892 0.592 1.00 0.00 H new ATOM 0 HB3 TYR A 49 0.945 -1.501 -0.265 1.00 0.00 H new ATOM 0 HD1 TYR A 49 1.765 -5.116 -0.857 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -0.764 -1.829 -1.835 1.00 0.00 H new ATOM 0 HE1 TYR A 49 0.372 -6.599 -2.233 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -2.163 -3.310 -3.204 1.00 0.00 H new ATOM 0 HH TYR A 49 -2.496 -5.358 -3.964 1.00 0.00 H new ATOM 682 N VAL A 50 3.385 0.052 -0.240 1.00 0.00 N ATOM 683 CA VAL A 50 4.066 1.059 0.564 1.00 0.00 C ATOM 684 C VAL A 50 3.553 1.055 2.000 1.00 0.00 C ATOM 685 O VAL A 50 2.377 1.318 2.251 1.00 0.00 O ATOM 686 CB VAL A 50 3.885 2.468 -0.030 1.00 0.00 C ATOM 687 CG1 VAL A 50 4.506 3.516 0.882 1.00 0.00 C ATOM 688 CG2 VAL A 50 4.487 2.539 -1.425 1.00 0.00 C ATOM 0 H VAL A 50 2.720 0.430 -0.914 1.00 0.00 H new ATOM 0 HA VAL A 50 5.126 0.804 0.559 1.00 0.00 H new ATOM 0 HB VAL A 50 2.818 2.676 -0.109 1.00 0.00 H new ATOM 0 HG11 VAL A 50 4.368 4.505 0.446 1.00 0.00 H new ATOM 0 HG12 VAL A 50 4.024 3.480 1.859 1.00 0.00 H new ATOM 0 HG13 VAL A 50 5.571 3.315 0.995 1.00 0.00 H new ATOM 0 HG21 VAL A 50 4.350 3.542 -1.830 1.00 0.00 H new ATOM 0 HG22 VAL A 50 5.552 2.310 -1.374 1.00 0.00 H new ATOM 0 HG23 VAL A 50 3.991 1.816 -2.072 1.00 0.00 H new ATOM 698 N LYS A 51 4.443 0.755 2.940 1.00 0.00 N ATOM 699 CA LYS A 51 4.082 0.717 4.352 1.00 0.00 C ATOM 700 C LYS A 51 4.058 2.123 4.944 1.00 0.00 C ATOM 701 O LYS A 51 3.108 2.501 5.630 1.00 0.00 O ATOM 702 CB LYS A 51 5.069 -0.158 5.128 1.00 0.00 C ATOM 703 CG LYS A 51 4.811 -0.184 6.625 1.00 0.00 C ATOM 704 CD LYS A 51 3.608 -1.048 6.968 1.00 0.00 C ATOM 705 CE LYS A 51 3.485 -1.261 8.469 1.00 0.00 C ATOM 706 NZ LYS A 51 2.692 -0.182 9.120 1.00 0.00 N ATOM 0 H LYS A 51 5.420 0.534 2.749 1.00 0.00 H new ATOM 0 HA LYS A 51 3.083 0.289 4.436 1.00 0.00 H new ATOM 0 HB2 LYS A 51 5.021 -1.176 4.742 1.00 0.00 H new ATOM 0 HB3 LYS A 51 6.081 0.204 4.948 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.693 -0.565 7.141 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.645 0.832 6.984 1.00 0.00 H new ATOM 0 HD2 LYS A 51 2.701 -0.576 6.591 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.697 -2.013 6.469 1.00 0.00 H new ATOM 0 HE2 LYS A 51 3.013 -2.225 8.661 1.00 0.00 H new ATOM 0 HE3 LYS A 51 4.480 -1.299 8.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.632 -0.364 10.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.155 0.735 8.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 1.734 -0.162 8.715 1.00 0.00 H new ATOM 720 N SER A 52 5.107 2.892 4.674 1.00 0.00 N ATOM 721 CA SER A 52 5.206 4.256 5.183 1.00 0.00 C ATOM 722 C SER A 52 5.990 5.140 4.218 1.00 0.00 C ATOM 723 O SER A 52 6.618 4.650 3.278 1.00 0.00 O ATOM 724 CB SER A 52 5.878 4.262 6.558 1.00 0.00 C ATOM 725 OG SER A 52 7.273 4.041 6.445 1.00 0.00 O ATOM 0 H SER A 52 5.900 2.595 4.106 1.00 0.00 H new ATOM 0 HA SER A 52 4.197 4.657 5.278 1.00 0.00 H new ATOM 0 HB2 SER A 52 5.697 5.217 7.051 1.00 0.00 H new ATOM 0 HB3 SER A 52 5.434 3.490 7.187 1.00 0.00 H new ATOM 0 HG SER A 52 7.721 4.359 7.256 1.00 0.00 H new ATOM 731 N VAL A 53 5.950 6.447 4.456 1.00 0.00 N ATOM 732 CA VAL A 53 6.656 7.401 3.610 1.00 0.00 C ATOM 733 C VAL A 53 7.405 8.430 4.449 1.00 0.00 C ATOM 734 O VAL A 53 6.951 9.564 4.608 1.00 0.00 O ATOM 735 CB VAL A 53 5.689 8.133 2.661 1.00 0.00 C ATOM 736 CG1 VAL A 53 6.436 9.161 1.826 1.00 0.00 C ATOM 737 CG2 VAL A 53 4.961 7.138 1.770 1.00 0.00 C ATOM 0 H VAL A 53 5.435 6.869 5.229 1.00 0.00 H new ATOM 0 HA VAL A 53 7.371 6.830 3.018 1.00 0.00 H new ATOM 0 HB VAL A 53 4.947 8.658 3.262 1.00 0.00 H new ATOM 0 HG11 VAL A 53 5.736 9.668 1.162 1.00 0.00 H new ATOM 0 HG12 VAL A 53 6.906 9.892 2.484 1.00 0.00 H new ATOM 0 HG13 VAL A 53 7.202 8.661 1.233 1.00 0.00 H new ATOM 0 HG21 VAL A 53 4.282 7.673 1.106 1.00 0.00 H new ATOM 0 HG22 VAL A 53 5.687 6.583 1.176 1.00 0.00 H new ATOM 0 HG23 VAL A 53 4.392 6.444 2.389 1.00 0.00 H new ATOM 747 N ILE A 54 8.553 8.028 4.983 1.00 0.00 N ATOM 748 CA ILE A 54 9.365 8.917 5.805 1.00 0.00 C ATOM 749 C ILE A 54 9.335 10.343 5.267 1.00 0.00 C ATOM 750 O ILE A 54 9.554 10.591 4.081 1.00 0.00 O ATOM 751 CB ILE A 54 10.827 8.438 5.877 1.00 0.00 C ATOM 752 CG1 ILE A 54 10.899 7.043 6.501 1.00 0.00 C ATOM 753 CG2 ILE A 54 11.669 9.424 6.672 1.00 0.00 C ATOM 754 CD1 ILE A 54 10.697 5.923 5.503 1.00 0.00 C ATOM 0 H ILE A 54 8.942 7.093 4.861 1.00 0.00 H new ATOM 0 HA ILE A 54 8.936 8.900 6.807 1.00 0.00 H new ATOM 0 HB ILE A 54 11.226 8.384 4.864 1.00 0.00 H new ATOM 0 HG12 ILE A 54 11.869 6.919 6.983 1.00 0.00 H new ATOM 0 HG13 ILE A 54 10.143 6.964 7.282 1.00 0.00 H new ATOM 0 HG21 ILE A 54 12.700 9.071 6.714 1.00 0.00 H new ATOM 0 HG22 ILE A 54 11.639 10.401 6.189 1.00 0.00 H new ATOM 0 HG23 ILE A 54 11.273 9.508 7.684 1.00 0.00 H new ATOM 0 HD11 ILE A 54 10.761 4.963 6.015 1.00 0.00 H new ATOM 0 HD12 ILE A 54 9.716 6.022 5.039 1.00 0.00 H new ATOM 0 HD13 ILE A 54 11.469 5.976 4.735 1.00 0.00 H new ATOM 766 N PRO A 55 9.060 11.307 6.159 1.00 0.00 N ATOM 767 CA PRO A 55 8.998 12.726 5.797 1.00 0.00 C ATOM 768 C PRO A 55 10.369 13.298 5.456 1.00 0.00 C ATOM 769 O PRO A 55 11.398 12.702 5.772 1.00 0.00 O ATOM 770 CB PRO A 55 8.441 13.389 7.060 1.00 0.00 C ATOM 771 CG PRO A 55 8.821 12.471 8.169 1.00 0.00 C ATOM 772 CD PRO A 55 8.789 11.084 7.589 1.00 0.00 C ATOM 0 HA PRO A 55 8.391 12.894 4.907 1.00 0.00 H new ATOM 0 HB2 PRO A 55 8.865 14.382 7.206 1.00 0.00 H new ATOM 0 HB3 PRO A 55 7.359 13.510 6.999 1.00 0.00 H new ATOM 0 HG2 PRO A 55 9.813 12.711 8.551 1.00 0.00 H new ATOM 0 HG3 PRO A 55 8.127 12.560 9.005 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.541 10.440 8.045 1.00 0.00 H new ATOM 0 HD3 PRO A 55 7.822 10.605 7.745 1.00 0.00 H new ATOM 780 N GLY A 56 10.377 14.459 4.808 1.00 0.00 N ATOM 781 CA GLY A 56 11.628 15.092 4.435 1.00 0.00 C ATOM 782 C GLY A 56 12.455 14.234 3.499 1.00 0.00 C ATOM 783 O GLY A 56 13.672 14.400 3.406 1.00 0.00 O ATOM 0 H GLY A 56 9.539 14.972 4.535 1.00 0.00 H new ATOM 0 HA2 GLY A 56 11.419 16.049 3.957 1.00 0.00 H new ATOM 0 HA3 GLY A 56 12.206 15.305 5.334 1.00 0.00 H new ATOM 787 N SER A 57 11.796 13.313 2.804 1.00 0.00 N ATOM 788 CA SER A 57 12.479 12.421 1.875 1.00 0.00 C ATOM 789 C SER A 57 11.989 12.644 0.448 1.00 0.00 C ATOM 790 O SER A 57 10.969 13.295 0.225 1.00 0.00 O ATOM 791 CB SER A 57 12.259 10.962 2.279 1.00 0.00 C ATOM 792 OG SER A 57 11.058 10.454 1.725 1.00 0.00 O ATOM 0 H SER A 57 10.789 13.165 2.867 1.00 0.00 H new ATOM 0 HA SER A 57 13.545 12.644 1.914 1.00 0.00 H new ATOM 0 HB2 SER A 57 13.102 10.358 1.944 1.00 0.00 H new ATOM 0 HB3 SER A 57 12.223 10.884 3.366 1.00 0.00 H new ATOM 0 HG SER A 57 10.363 10.432 2.415 1.00 0.00 H new ATOM 798 N ALA A 58 12.723 12.098 -0.516 1.00 0.00 N ATOM 799 CA ALA A 58 12.363 12.235 -1.922 1.00 0.00 C ATOM 800 C ALA A 58 10.906 11.850 -2.155 1.00 0.00 C ATOM 801 O ALA A 58 10.184 12.531 -2.883 1.00 0.00 O ATOM 802 CB ALA A 58 13.281 11.385 -2.787 1.00 0.00 C ATOM 0 H ALA A 58 13.571 11.556 -0.349 1.00 0.00 H new ATOM 0 HA ALA A 58 12.484 13.281 -2.203 1.00 0.00 H new ATOM 0 HB1 ALA A 58 13.001 11.497 -3.834 1.00 0.00 H new ATOM 0 HB2 ALA A 58 14.313 11.709 -2.651 1.00 0.00 H new ATOM 0 HB3 ALA A 58 13.188 10.338 -2.497 1.00 0.00 H new ATOM 808 N ALA A 59 10.482 10.755 -1.534 1.00 0.00 N ATOM 809 CA ALA A 59 9.110 10.281 -1.674 1.00 0.00 C ATOM 810 C ALA A 59 8.115 11.327 -1.184 1.00 0.00 C ATOM 811 O ALA A 59 7.232 11.754 -1.928 1.00 0.00 O ATOM 812 CB ALA A 59 8.923 8.976 -0.914 1.00 0.00 C ATOM 0 H ALA A 59 11.068 10.179 -0.929 1.00 0.00 H new ATOM 0 HA ALA A 59 8.919 10.104 -2.732 1.00 0.00 H new ATOM 0 HB1 ALA A 59 7.894 8.633 -1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 59 9.602 8.222 -1.312 1.00 0.00 H new ATOM 0 HB3 ALA A 59 9.138 9.136 0.142 1.00 0.00 H new ATOM 818 N TYR A 60 8.263 11.736 0.071 1.00 0.00 N ATOM 819 CA TYR A 60 7.375 12.731 0.661 1.00 0.00 C ATOM 820 C TYR A 60 7.376 14.017 -0.159 1.00 0.00 C ATOM 821 O TYR A 60 6.324 14.602 -0.420 1.00 0.00 O ATOM 822 CB TYR A 60 7.795 13.030 2.101 1.00 0.00 C ATOM 823 CG TYR A 60 6.916 14.051 2.788 1.00 0.00 C ATOM 824 CD1 TYR A 60 5.676 13.694 3.305 1.00 0.00 C ATOM 825 CD2 TYR A 60 7.326 15.372 2.922 1.00 0.00 C ATOM 826 CE1 TYR A 60 4.870 14.623 3.933 1.00 0.00 C ATOM 827 CE2 TYR A 60 6.527 16.307 3.550 1.00 0.00 C ATOM 828 CZ TYR A 60 5.299 15.928 4.053 1.00 0.00 C ATOM 829 OH TYR A 60 4.500 16.857 4.679 1.00 0.00 O ATOM 0 H TYR A 60 8.990 11.394 0.700 1.00 0.00 H new ATOM 0 HA TYR A 60 6.364 12.324 0.662 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.779 12.104 2.675 1.00 0.00 H new ATOM 0 HB3 TYR A 60 8.824 13.389 2.103 1.00 0.00 H new ATOM 0 HD1 TYR A 60 5.337 12.673 3.214 1.00 0.00 H new ATOM 0 HD2 TYR A 60 8.286 15.673 2.528 1.00 0.00 H new ATOM 0 HE1 TYR A 60 3.909 14.329 4.328 1.00 0.00 H new ATOM 0 HE2 TYR A 60 6.861 17.329 3.647 1.00 0.00 H new ATOM 0 HH TYR A 60 4.950 17.728 4.680 1.00 0.00 H new ATOM 839 N HIS A 61 8.565 14.452 -0.564 1.00 0.00 N ATOM 840 CA HIS A 61 8.705 15.668 -1.356 1.00 0.00 C ATOM 841 C HIS A 61 8.010 15.521 -2.706 1.00 0.00 C ATOM 842 O HIS A 61 7.287 16.415 -3.144 1.00 0.00 O ATOM 843 CB HIS A 61 10.184 15.999 -1.564 1.00 0.00 C ATOM 844 CG HIS A 61 10.837 16.607 -0.361 1.00 0.00 C ATOM 845 ND1 HIS A 61 11.984 16.285 0.281 1.00 0.00 N flip ATOM 846 CD2 HIS A 61 10.304 17.679 0.323 1.00 0.00 C flip ATOM 847 CE1 HIS A 61 12.123 17.160 1.329 1.00 0.00 C flip ATOM 848 NE2 HIS A 61 11.097 17.991 1.333 1.00 0.00 N flip ATOM 0 H HIS A 61 9.445 13.980 -0.357 1.00 0.00 H new ATOM 0 HA HIS A 61 8.231 16.484 -0.810 1.00 0.00 H new ATOM 0 HB2 HIS A 61 10.717 15.088 -1.835 1.00 0.00 H new ATOM 0 HB3 HIS A 61 10.279 16.686 -2.405 1.00 0.00 H new ATOM 0 HD2 HIS A 61 9.383 18.184 0.073 1.00 0.00 H new ATOM 0 HE1 HIS A 61 12.939 17.168 2.036 1.00 0.00 H new ATOM 0 HE2 HIS A 61 10.943 18.745 2.002 1.00 0.00 H new ATOM 857 N ASN A 62 8.235 14.386 -3.361 1.00 0.00 N ATOM 858 CA ASN A 62 7.630 14.122 -4.662 1.00 0.00 C ATOM 859 C ASN A 62 6.109 14.194 -4.580 1.00 0.00 C ATOM 860 O ASN A 62 5.475 14.977 -5.287 1.00 0.00 O ATOM 861 CB ASN A 62 8.060 12.747 -5.178 1.00 0.00 C ATOM 862 CG ASN A 62 8.166 12.704 -6.690 1.00 0.00 C ATOM 863 OD1 ASN A 62 7.588 11.673 -7.294 1.00 0.00 O flip ATOM 864 ND2 ASN A 62 8.761 13.588 -7.307 1.00 0.00 N flip ATOM 0 H ASN A 62 8.831 13.635 -3.013 1.00 0.00 H new ATOM 0 HA ASN A 62 7.975 14.888 -5.357 1.00 0.00 H new ATOM 0 HB2 ASN A 62 9.023 12.483 -4.741 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.343 11.997 -4.845 1.00 0.00 H new ATOM 0 HD21 ASN A 62 9.191 14.362 -6.801 1.00 0.00 H new ATOM 0 HD22 ASN A 62 8.824 13.546 -8.324 1.00 0.00 H new ATOM 871 N GLY A 63 5.529 13.372 -3.711 1.00 0.00 N ATOM 872 CA GLY A 63 4.086 13.358 -3.552 1.00 0.00 C ATOM 873 C GLY A 63 3.400 12.465 -4.566 1.00 0.00 C ATOM 874 O GLY A 63 2.238 12.684 -4.910 1.00 0.00 O ATOM 0 H GLY A 63 6.032 12.716 -3.114 1.00 0.00 H new ATOM 0 HA2 GLY A 63 3.838 13.018 -2.546 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.703 14.374 -3.649 1.00 0.00 H new ATOM 878 N HIS A 64 4.119 11.456 -5.048 1.00 0.00 N ATOM 879 CA HIS A 64 3.572 10.527 -6.030 1.00 0.00 C ATOM 880 C HIS A 64 3.577 9.100 -5.490 1.00 0.00 C ATOM 881 O HIS A 64 2.761 8.271 -5.894 1.00 0.00 O ATOM 882 CB HIS A 64 4.374 10.596 -7.330 1.00 0.00 C ATOM 883 CG HIS A 64 4.357 11.948 -7.974 1.00 0.00 C ATOM 884 ND1 HIS A 64 5.098 13.054 -7.730 1.00 0.00 N flip ATOM 885 CD2 HIS A 64 3.499 12.282 -9.001 1.00 0.00 C flip ATOM 886 CE1 HIS A 64 4.679 14.026 -8.606 1.00 0.00 C flip ATOM 887 NE2 HIS A 64 3.715 13.534 -9.362 1.00 0.00 N flip ATOM 0 H HIS A 64 5.082 11.261 -4.774 1.00 0.00 H new ATOM 0 HA HIS A 64 2.541 10.816 -6.232 1.00 0.00 H new ATOM 0 HB2 HIS A 64 5.407 10.313 -7.125 1.00 0.00 H new ATOM 0 HB3 HIS A 64 3.976 9.863 -8.032 1.00 0.00 H new ATOM 0 HD2 HIS A 64 2.765 11.623 -9.441 1.00 0.00 H new ATOM 0 HE1 HIS A 64 5.074 15.029 -8.666 1.00 0.00 H new ATOM 0 HE2 HIS A 64 3.221 14.036 -10.100 1.00 0.00 H new ATOM 896 N ILE A 65 4.500 8.822 -4.576 1.00 0.00 N ATOM 897 CA ILE A 65 4.610 7.496 -3.982 1.00 0.00 C ATOM 898 C ILE A 65 4.285 7.532 -2.492 1.00 0.00 C ATOM 899 O ILE A 65 5.122 7.911 -1.674 1.00 0.00 O ATOM 900 CB ILE A 65 6.020 6.908 -4.173 1.00 0.00 C ATOM 901 CG1 ILE A 65 6.386 6.876 -5.659 1.00 0.00 C ATOM 902 CG2 ILE A 65 6.098 5.512 -3.573 1.00 0.00 C ATOM 903 CD1 ILE A 65 7.870 7.002 -5.919 1.00 0.00 C ATOM 0 H ILE A 65 5.182 9.497 -4.231 1.00 0.00 H new ATOM 0 HA ILE A 65 3.888 6.861 -4.495 1.00 0.00 H new ATOM 0 HB ILE A 65 6.736 7.545 -3.655 1.00 0.00 H new ATOM 0 HG12 ILE A 65 6.027 5.943 -6.093 1.00 0.00 H new ATOM 0 HG13 ILE A 65 5.866 7.686 -6.170 1.00 0.00 H new ATOM 0 HG21 ILE A 65 7.101 5.110 -3.716 1.00 0.00 H new ATOM 0 HG22 ILE A 65 5.875 5.561 -2.507 1.00 0.00 H new ATOM 0 HG23 ILE A 65 5.373 4.863 -4.065 1.00 0.00 H new ATOM 0 HD11 ILE A 65 8.055 6.972 -6.993 1.00 0.00 H new ATOM 0 HD12 ILE A 65 8.231 7.948 -5.515 1.00 0.00 H new ATOM 0 HD13 ILE A 65 8.395 6.178 -5.437 1.00 0.00 H new ATOM 915 N GLN A 66 3.064 7.135 -2.148 1.00 0.00 N ATOM 916 CA GLN A 66 2.629 7.122 -0.757 1.00 0.00 C ATOM 917 C GLN A 66 2.022 5.772 -0.389 1.00 0.00 C ATOM 918 O GLN A 66 1.890 4.888 -1.235 1.00 0.00 O ATOM 919 CB GLN A 66 1.611 8.236 -0.508 1.00 0.00 C ATOM 920 CG GLN A 66 0.704 8.508 -1.697 1.00 0.00 C ATOM 921 CD GLN A 66 1.294 9.516 -2.663 1.00 0.00 C ATOM 922 OE1 GLN A 66 2.096 10.367 -2.277 1.00 0.00 O ATOM 923 NE2 GLN A 66 0.900 9.425 -3.928 1.00 0.00 N ATOM 0 H GLN A 66 2.359 6.818 -2.814 1.00 0.00 H new ATOM 0 HA GLN A 66 3.503 7.291 -0.128 1.00 0.00 H new ATOM 0 HB2 GLN A 66 0.998 7.970 0.353 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.143 9.152 -0.250 1.00 0.00 H new ATOM 0 HG2 GLN A 66 0.513 7.574 -2.225 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -0.258 8.874 -1.339 1.00 0.00 H new ATOM 0 HE21 GLN A 66 0.233 8.704 -4.204 1.00 0.00 H new ATOM 0 HE22 GLN A 66 1.264 10.076 -4.624 1.00 0.00 H new ATOM 932 N VAL A 67 1.656 5.619 0.880 1.00 0.00 N ATOM 933 CA VAL A 67 1.063 4.377 1.360 1.00 0.00 C ATOM 934 C VAL A 67 -0.095 3.940 0.469 1.00 0.00 C ATOM 935 O VAL A 67 -0.441 4.622 -0.495 1.00 0.00 O ATOM 936 CB VAL A 67 0.557 4.519 2.808 1.00 0.00 C ATOM 937 CG1 VAL A 67 1.720 4.754 3.759 1.00 0.00 C ATOM 938 CG2 VAL A 67 -0.460 5.646 2.908 1.00 0.00 C ATOM 0 H VAL A 67 1.760 6.340 1.594 1.00 0.00 H new ATOM 0 HA VAL A 67 1.847 3.620 1.330 1.00 0.00 H new ATOM 0 HB VAL A 67 0.065 3.590 3.096 1.00 0.00 H new ATOM 0 HG11 VAL A 67 1.343 4.852 4.777 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.409 3.911 3.706 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.242 5.668 3.476 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -0.807 5.733 3.938 1.00 0.00 H new ATOM 0 HG22 VAL A 67 0.004 6.583 2.602 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.307 5.431 2.256 1.00 0.00 H new ATOM 948 N ASN A 68 -0.691 2.799 0.799 1.00 0.00 N ATOM 949 CA ASN A 68 -1.811 2.271 0.029 1.00 0.00 C ATOM 950 C ASN A 68 -1.491 2.267 -1.463 1.00 0.00 C ATOM 951 O ASN A 68 -2.369 2.492 -2.297 1.00 0.00 O ATOM 952 CB ASN A 68 -3.072 3.098 0.290 1.00 0.00 C ATOM 953 CG ASN A 68 -2.961 4.509 -0.257 1.00 0.00 C ATOM 954 OD1 ASN A 68 -3.000 5.493 0.634 1.00 0.00 O flip ATOM 955 ND2 ASN A 68 -2.840 4.711 -1.465 1.00 0.00 N flip ATOM 0 H ASN A 68 -0.417 2.222 1.594 1.00 0.00 H new ATOM 0 HA ASN A 68 -1.987 1.244 0.348 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -3.929 2.601 -0.164 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -3.260 3.141 1.363 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -2.815 3.924 -2.114 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -2.765 5.665 -1.818 1.00 0.00 H new ATOM 962 N ASP A 69 -0.230 2.009 -1.791 1.00 0.00 N ATOM 963 CA ASP A 69 0.206 1.974 -3.182 1.00 0.00 C ATOM 964 C ASP A 69 0.863 0.637 -3.512 1.00 0.00 C ATOM 965 O ASP A 69 1.616 0.088 -2.707 1.00 0.00 O ATOM 966 CB ASP A 69 1.180 3.119 -3.463 1.00 0.00 C ATOM 967 CG ASP A 69 0.481 4.459 -3.580 1.00 0.00 C ATOM 968 OD1 ASP A 69 -0.746 4.469 -3.814 1.00 0.00 O ATOM 969 OD2 ASP A 69 1.160 5.497 -3.438 1.00 0.00 O ATOM 0 H ASP A 69 0.508 1.821 -1.113 1.00 0.00 H new ATOM 0 HA ASP A 69 -0.673 2.092 -3.816 1.00 0.00 H new ATOM 0 HB2 ASP A 69 1.920 3.167 -2.664 1.00 0.00 H new ATOM 0 HB3 ASP A 69 1.721 2.913 -4.386 1.00 0.00 H new ATOM 974 N LYS A 70 0.573 0.118 -4.700 1.00 0.00 N ATOM 975 CA LYS A 70 1.136 -1.154 -5.137 1.00 0.00 C ATOM 976 C LYS A 70 2.262 -0.934 -6.142 1.00 0.00 C ATOM 977 O LYS A 70 2.141 -0.117 -7.055 1.00 0.00 O ATOM 978 CB LYS A 70 0.046 -2.030 -5.760 1.00 0.00 C ATOM 979 CG LYS A 70 0.318 -3.519 -5.636 1.00 0.00 C ATOM 980 CD LYS A 70 -0.282 -4.294 -6.797 1.00 0.00 C ATOM 981 CE LYS A 70 0.703 -4.423 -7.949 1.00 0.00 C ATOM 982 NZ LYS A 70 0.044 -4.923 -9.188 1.00 0.00 N ATOM 0 H LYS A 70 -0.049 0.559 -5.378 1.00 0.00 H new ATOM 0 HA LYS A 70 1.546 -1.661 -4.263 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -0.908 -1.802 -5.284 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -0.055 -1.774 -6.815 1.00 0.00 H new ATOM 0 HG2 LYS A 70 1.394 -3.691 -5.599 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -0.096 -3.889 -4.698 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -0.580 -5.286 -6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -1.185 -3.791 -7.143 1.00 0.00 H new ATOM 0 HE2 LYS A 70 1.160 -3.453 -8.147 1.00 0.00 H new ATOM 0 HE3 LYS A 70 1.507 -5.102 -7.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 0.366 -5.892 -9.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -0.988 -4.921 -9.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 0.293 -4.306 -9.987 1.00 0.00 H new ATOM 996 N ILE A 71 3.355 -1.669 -5.969 1.00 0.00 N ATOM 997 CA ILE A 71 4.501 -1.556 -6.863 1.00 0.00 C ATOM 998 C ILE A 71 4.606 -2.770 -7.780 1.00 0.00 C ATOM 999 O ILE A 71 4.384 -3.903 -7.354 1.00 0.00 O ATOM 1000 CB ILE A 71 5.817 -1.406 -6.075 1.00 0.00 C ATOM 1001 CG1 ILE A 71 5.749 -0.186 -5.155 1.00 0.00 C ATOM 1002 CG2 ILE A 71 6.995 -1.292 -7.030 1.00 0.00 C ATOM 1003 CD1 ILE A 71 6.618 -0.310 -3.923 1.00 0.00 C ATOM 0 H ILE A 71 3.471 -2.349 -5.218 1.00 0.00 H new ATOM 0 HA ILE A 71 4.344 -0.662 -7.466 1.00 0.00 H new ATOM 0 HB ILE A 71 5.959 -2.294 -5.459 1.00 0.00 H new ATOM 0 HG12 ILE A 71 6.051 0.699 -5.715 1.00 0.00 H new ATOM 0 HG13 ILE A 71 4.715 -0.031 -4.847 1.00 0.00 H new ATOM 0 HG21 ILE A 71 7.917 -1.187 -6.459 1.00 0.00 H new ATOM 0 HG22 ILE A 71 7.051 -2.188 -7.647 1.00 0.00 H new ATOM 0 HG23 ILE A 71 6.862 -0.419 -7.669 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.520 0.591 -3.317 1.00 0.00 H new ATOM 0 HD12 ILE A 71 6.302 -1.175 -3.341 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.659 -0.435 -4.223 1.00 0.00 H new ATOM 1015 N VAL A 72 4.947 -2.524 -9.041 1.00 0.00 N ATOM 1016 CA VAL A 72 5.085 -3.597 -10.018 1.00 0.00 C ATOM 1017 C VAL A 72 6.493 -3.634 -10.599 1.00 0.00 C ATOM 1018 O VAL A 72 6.928 -4.653 -11.136 1.00 0.00 O ATOM 1019 CB VAL A 72 4.071 -3.443 -11.167 1.00 0.00 C ATOM 1020 CG1 VAL A 72 2.688 -3.894 -10.724 1.00 0.00 C ATOM 1021 CG2 VAL A 72 4.039 -2.003 -11.659 1.00 0.00 C ATOM 0 H VAL A 72 5.133 -1.591 -9.410 1.00 0.00 H new ATOM 0 HA VAL A 72 4.888 -4.531 -9.492 1.00 0.00 H new ATOM 0 HB VAL A 72 4.386 -4.079 -11.994 1.00 0.00 H new ATOM 0 HG11 VAL A 72 1.986 -3.778 -11.549 1.00 0.00 H new ATOM 0 HG12 VAL A 72 2.725 -4.941 -10.424 1.00 0.00 H new ATOM 0 HG13 VAL A 72 2.360 -3.287 -9.880 1.00 0.00 H new ATOM 0 HG21 VAL A 72 3.317 -1.912 -12.471 1.00 0.00 H new ATOM 0 HG22 VAL A 72 3.749 -1.345 -10.840 1.00 0.00 H new ATOM 0 HG23 VAL A 72 5.028 -1.719 -12.019 1.00 0.00 H new ATOM 1031 N ALA A 73 7.203 -2.516 -10.489 1.00 0.00 N ATOM 1032 CA ALA A 73 8.564 -2.420 -11.001 1.00 0.00 C ATOM 1033 C ALA A 73 9.312 -1.257 -10.359 1.00 0.00 C ATOM 1034 O ALA A 73 8.715 -0.237 -10.014 1.00 0.00 O ATOM 1035 CB ALA A 73 8.549 -2.270 -12.515 1.00 0.00 C ATOM 0 H ALA A 73 6.857 -1.663 -10.049 1.00 0.00 H new ATOM 0 HA ALA A 73 9.088 -3.340 -10.743 1.00 0.00 H new ATOM 0 HB1 ALA A 73 9.572 -2.199 -12.884 1.00 0.00 H new ATOM 0 HB2 ALA A 73 8.061 -3.136 -12.962 1.00 0.00 H new ATOM 0 HB3 ALA A 73 8.003 -1.366 -12.786 1.00 0.00 H new ATOM 1041 N VAL A 74 10.622 -1.416 -10.201 1.00 0.00 N ATOM 1042 CA VAL A 74 11.452 -0.379 -9.601 1.00 0.00 C ATOM 1043 C VAL A 74 12.686 -0.101 -10.453 1.00 0.00 C ATOM 1044 O VAL A 74 13.466 -1.006 -10.747 1.00 0.00 O ATOM 1045 CB VAL A 74 11.900 -0.770 -8.180 1.00 0.00 C ATOM 1046 CG1 VAL A 74 12.723 0.345 -7.554 1.00 0.00 C ATOM 1047 CG2 VAL A 74 10.694 -1.104 -7.315 1.00 0.00 C ATOM 0 H VAL A 74 11.132 -2.254 -10.481 1.00 0.00 H new ATOM 0 HA VAL A 74 10.841 0.522 -9.546 1.00 0.00 H new ATOM 0 HB VAL A 74 12.528 -1.658 -8.247 1.00 0.00 H new ATOM 0 HG11 VAL A 74 13.031 0.051 -6.551 1.00 0.00 H new ATOM 0 HG12 VAL A 74 13.607 0.532 -8.164 1.00 0.00 H new ATOM 0 HG13 VAL A 74 12.123 1.253 -7.498 1.00 0.00 H new ATOM 0 HG21 VAL A 74 11.029 -1.378 -6.314 1.00 0.00 H new ATOM 0 HG22 VAL A 74 10.039 -0.235 -7.253 1.00 0.00 H new ATOM 0 HG23 VAL A 74 10.149 -1.938 -7.757 1.00 0.00 H new ATOM 1057 N ASP A 75 12.855 1.157 -10.845 1.00 0.00 N ATOM 1058 CA ASP A 75 13.996 1.556 -11.662 1.00 0.00 C ATOM 1059 C ASP A 75 14.008 0.797 -12.986 1.00 0.00 C ATOM 1060 O ASP A 75 15.066 0.548 -13.560 1.00 0.00 O ATOM 1061 CB ASP A 75 15.303 1.309 -10.907 1.00 0.00 C ATOM 1062 CG ASP A 75 16.394 2.284 -11.304 1.00 0.00 C ATOM 1063 OD1 ASP A 75 16.473 2.631 -12.501 1.00 0.00 O ATOM 1064 OD2 ASP A 75 17.168 2.700 -10.417 1.00 0.00 O ATOM 0 H ASP A 75 12.217 1.918 -10.611 1.00 0.00 H new ATOM 0 HA ASP A 75 13.904 2.621 -11.875 1.00 0.00 H new ATOM 0 HB2 ASP A 75 15.121 1.389 -9.835 1.00 0.00 H new ATOM 0 HB3 ASP A 75 15.643 0.291 -11.098 1.00 0.00 H new ATOM 1069 N GLY A 76 12.822 0.432 -13.463 1.00 0.00 N ATOM 1070 CA GLY A 76 12.718 -0.295 -14.715 1.00 0.00 C ATOM 1071 C GLY A 76 12.981 -1.779 -14.547 1.00 0.00 C ATOM 1072 O GLY A 76 13.333 -2.467 -15.505 1.00 0.00 O ATOM 0 H GLY A 76 11.932 0.627 -13.005 1.00 0.00 H new ATOM 0 HA2 GLY A 76 11.722 -0.151 -15.134 1.00 0.00 H new ATOM 0 HA3 GLY A 76 13.428 0.118 -15.432 1.00 0.00 H new ATOM 1076 N VAL A 77 12.813 -2.273 -13.324 1.00 0.00 N ATOM 1077 CA VAL A 77 13.035 -3.685 -13.033 1.00 0.00 C ATOM 1078 C VAL A 77 11.765 -4.343 -12.507 1.00 0.00 C ATOM 1079 O VAL A 77 11.274 -3.999 -11.433 1.00 0.00 O ATOM 1080 CB VAL A 77 14.164 -3.874 -12.003 1.00 0.00 C ATOM 1081 CG1 VAL A 77 14.272 -5.335 -11.592 1.00 0.00 C ATOM 1082 CG2 VAL A 77 15.485 -3.370 -12.562 1.00 0.00 C ATOM 0 H VAL A 77 12.524 -1.717 -12.519 1.00 0.00 H new ATOM 0 HA VAL A 77 13.325 -4.161 -13.970 1.00 0.00 H new ATOM 0 HB VAL A 77 13.925 -3.288 -11.116 1.00 0.00 H new ATOM 0 HG11 VAL A 77 15.075 -5.450 -10.864 1.00 0.00 H new ATOM 0 HG12 VAL A 77 13.331 -5.659 -11.148 1.00 0.00 H new ATOM 0 HG13 VAL A 77 14.488 -5.945 -12.469 1.00 0.00 H new ATOM 0 HG21 VAL A 77 16.271 -3.511 -11.821 1.00 0.00 H new ATOM 0 HG22 VAL A 77 15.734 -3.927 -13.466 1.00 0.00 H new ATOM 0 HG23 VAL A 77 15.398 -2.310 -12.801 1.00 0.00 H new ATOM 1092 N ASN A 78 11.237 -5.294 -13.272 1.00 0.00 N ATOM 1093 CA ASN A 78 10.023 -6.002 -12.882 1.00 0.00 C ATOM 1094 C ASN A 78 10.218 -6.727 -11.554 1.00 0.00 C ATOM 1095 O ASN A 78 10.742 -7.841 -11.514 1.00 0.00 O ATOM 1096 CB ASN A 78 9.621 -7.003 -13.967 1.00 0.00 C ATOM 1097 CG ASN A 78 8.168 -7.423 -13.857 1.00 0.00 C ATOM 1098 OD1 ASN A 78 7.862 -8.525 -13.401 1.00 0.00 O ATOM 1099 ND2 ASN A 78 7.265 -6.544 -14.274 1.00 0.00 N ATOM 0 H ASN A 78 11.631 -5.592 -14.165 1.00 0.00 H new ATOM 0 HA ASN A 78 9.227 -5.267 -12.761 1.00 0.00 H new ATOM 0 HB2 ASN A 78 9.795 -6.561 -14.948 1.00 0.00 H new ATOM 0 HB3 ASN A 78 10.258 -7.885 -13.897 1.00 0.00 H new ATOM 0 HD21 ASN A 78 6.272 -6.770 -14.224 1.00 0.00 H new ATOM 0 HD22 ASN A 78 7.564 -5.642 -14.645 1.00 0.00 H new ATOM 1106 N ILE A 79 9.794 -6.087 -10.469 1.00 0.00 N ATOM 1107 CA ILE A 79 9.920 -6.671 -9.140 1.00 0.00 C ATOM 1108 C ILE A 79 8.670 -7.459 -8.764 1.00 0.00 C ATOM 1109 O ILE A 79 8.439 -7.753 -7.592 1.00 0.00 O ATOM 1110 CB ILE A 79 10.173 -5.591 -8.072 1.00 0.00 C ATOM 1111 CG1 ILE A 79 8.939 -4.699 -7.916 1.00 0.00 C ATOM 1112 CG2 ILE A 79 11.392 -4.758 -8.439 1.00 0.00 C ATOM 1113 CD1 ILE A 79 8.770 -4.140 -6.520 1.00 0.00 C ATOM 0 H ILE A 79 9.360 -5.164 -10.485 1.00 0.00 H new ATOM 0 HA ILE A 79 10.775 -7.346 -9.172 1.00 0.00 H new ATOM 0 HB ILE A 79 10.367 -6.082 -7.118 1.00 0.00 H new ATOM 0 HG12 ILE A 79 9.006 -3.873 -8.624 1.00 0.00 H new ATOM 0 HG13 ILE A 79 8.050 -5.273 -8.179 1.00 0.00 H new ATOM 0 HG21 ILE A 79 11.558 -3.999 -7.674 1.00 0.00 H new ATOM 0 HG22 ILE A 79 12.268 -5.404 -8.505 1.00 0.00 H new ATOM 0 HG23 ILE A 79 11.225 -4.273 -9.401 1.00 0.00 H new ATOM 0 HD11 ILE A 79 7.876 -3.518 -6.483 1.00 0.00 H new ATOM 0 HD12 ILE A 79 8.671 -4.960 -5.809 1.00 0.00 H new ATOM 0 HD13 ILE A 79 9.641 -3.539 -6.261 1.00 0.00 H new ATOM 1125 N GLN A 80 7.868 -7.799 -9.768 1.00 0.00 N ATOM 1126 CA GLN A 80 6.641 -8.555 -9.542 1.00 0.00 C ATOM 1127 C GLN A 80 6.942 -9.902 -8.894 1.00 0.00 C ATOM 1128 O GLN A 80 7.218 -10.885 -9.580 1.00 0.00 O ATOM 1129 CB GLN A 80 5.897 -8.766 -10.862 1.00 0.00 C ATOM 1130 CG GLN A 80 5.253 -7.501 -11.407 1.00 0.00 C ATOM 1131 CD GLN A 80 4.223 -7.787 -12.482 1.00 0.00 C ATOM 1132 OE1 GLN A 80 4.290 -8.809 -13.166 1.00 0.00 O ATOM 1133 NE2 GLN A 80 3.262 -6.884 -12.636 1.00 0.00 N ATOM 0 H GLN A 80 8.045 -7.564 -10.744 1.00 0.00 H new ATOM 0 HA GLN A 80 6.010 -7.980 -8.864 1.00 0.00 H new ATOM 0 HB2 GLN A 80 6.594 -9.157 -11.603 1.00 0.00 H new ATOM 0 HB3 GLN A 80 5.126 -9.523 -10.718 1.00 0.00 H new ATOM 0 HG2 GLN A 80 4.778 -6.958 -10.590 1.00 0.00 H new ATOM 0 HG3 GLN A 80 6.027 -6.850 -11.814 1.00 0.00 H new ATOM 0 HE21 GLN A 80 3.245 -6.051 -12.047 1.00 0.00 H new ATOM 0 HE22 GLN A 80 2.540 -7.023 -13.343 1.00 0.00 H new ATOM 1142 N GLY A 81 6.889 -9.939 -7.566 1.00 0.00 N ATOM 1143 CA GLY A 81 7.159 -11.170 -6.847 1.00 0.00 C ATOM 1144 C GLY A 81 8.393 -11.072 -5.972 1.00 0.00 C ATOM 1145 O GLY A 81 8.588 -11.885 -5.068 1.00 0.00 O ATOM 0 H GLY A 81 6.664 -9.138 -6.975 1.00 0.00 H new ATOM 0 HA2 GLY A 81 6.298 -11.422 -6.228 1.00 0.00 H new ATOM 0 HA3 GLY A 81 7.287 -11.983 -7.561 1.00 0.00 H new ATOM 1149 N PHE A 82 9.229 -10.075 -6.241 1.00 0.00 N ATOM 1150 CA PHE A 82 10.452 -9.875 -5.473 1.00 0.00 C ATOM 1151 C PHE A 82 10.159 -9.865 -3.976 1.00 0.00 C ATOM 1152 O PHE A 82 9.246 -9.180 -3.516 1.00 0.00 O ATOM 1153 CB PHE A 82 11.127 -8.564 -5.881 1.00 0.00 C ATOM 1154 CG PHE A 82 12.108 -8.719 -7.008 1.00 0.00 C ATOM 1155 CD1 PHE A 82 11.721 -9.297 -8.206 1.00 0.00 C ATOM 1156 CD2 PHE A 82 13.418 -8.289 -6.868 1.00 0.00 C ATOM 1157 CE1 PHE A 82 12.622 -9.442 -9.245 1.00 0.00 C ATOM 1158 CE2 PHE A 82 14.322 -8.430 -7.903 1.00 0.00 C ATOM 1159 CZ PHE A 82 13.924 -9.009 -9.093 1.00 0.00 C ATOM 0 H PHE A 82 9.082 -9.393 -6.985 1.00 0.00 H new ATOM 0 HA PHE A 82 11.126 -10.705 -5.688 1.00 0.00 H new ATOM 0 HB2 PHE A 82 10.361 -7.846 -6.173 1.00 0.00 H new ATOM 0 HB3 PHE A 82 11.642 -8.146 -5.016 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.704 -9.638 -8.330 1.00 0.00 H new ATOM 0 HD2 PHE A 82 13.736 -7.839 -5.939 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.307 -9.893 -10.174 1.00 0.00 H new ATOM 0 HE2 PHE A 82 15.339 -8.088 -7.782 1.00 0.00 H new ATOM 0 HZ PHE A 82 14.630 -9.123 -9.902 1.00 0.00 H new ATOM 1169 N ALA A 83 10.941 -10.629 -3.221 1.00 0.00 N ATOM 1170 CA ALA A 83 10.767 -10.708 -1.776 1.00 0.00 C ATOM 1171 C ALA A 83 11.076 -9.370 -1.112 1.00 0.00 C ATOM 1172 O ALA A 83 11.794 -8.541 -1.669 1.00 0.00 O ATOM 1173 CB ALA A 83 11.650 -11.803 -1.196 1.00 0.00 C ATOM 0 H ALA A 83 11.702 -11.202 -3.586 1.00 0.00 H new ATOM 0 HA ALA A 83 9.724 -10.953 -1.574 1.00 0.00 H new ATOM 0 HB1 ALA A 83 11.509 -11.850 -0.116 1.00 0.00 H new ATOM 0 HB2 ALA A 83 11.380 -12.761 -1.639 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.695 -11.583 -1.416 1.00 0.00 H new ATOM 1179 N ASN A 84 10.528 -9.166 0.081 1.00 0.00 N ATOM 1180 CA ASN A 84 10.744 -7.928 0.820 1.00 0.00 C ATOM 1181 C ASN A 84 12.169 -7.418 0.623 1.00 0.00 C ATOM 1182 O ASN A 84 12.384 -6.357 0.036 1.00 0.00 O ATOM 1183 CB ASN A 84 10.470 -8.143 2.310 1.00 0.00 C ATOM 1184 CG ASN A 84 10.625 -6.869 3.117 1.00 0.00 C ATOM 1185 OD1 ASN A 84 11.607 -6.693 3.838 1.00 0.00 O ATOM 1186 ND2 ASN A 84 9.652 -5.973 3.000 1.00 0.00 N ATOM 0 H ASN A 84 9.931 -9.842 0.557 1.00 0.00 H new ATOM 0 HA ASN A 84 10.052 -7.180 0.434 1.00 0.00 H new ATOM 0 HB2 ASN A 84 9.459 -8.530 2.438 1.00 0.00 H new ATOM 0 HB3 ASN A 84 11.153 -8.900 2.696 1.00 0.00 H new ATOM 0 HD21 ASN A 84 9.700 -5.097 3.520 1.00 0.00 H new ATOM 0 HD22 ASN A 84 8.856 -6.161 2.390 1.00 0.00 H new ATOM 1193 N HIS A 85 13.138 -8.182 1.116 1.00 0.00 N ATOM 1194 CA HIS A 85 14.543 -7.809 0.993 1.00 0.00 C ATOM 1195 C HIS A 85 14.940 -7.664 -0.473 1.00 0.00 C ATOM 1196 O HIS A 85 15.627 -6.715 -0.849 1.00 0.00 O ATOM 1197 CB HIS A 85 15.431 -8.851 1.674 1.00 0.00 C ATOM 1198 CG HIS A 85 15.376 -10.200 1.026 1.00 0.00 C ATOM 1199 ND1 HIS A 85 14.383 -11.121 1.288 1.00 0.00 N ATOM 1200 CD2 HIS A 85 16.197 -10.782 0.121 1.00 0.00 C ATOM 1201 CE1 HIS A 85 14.597 -12.211 0.573 1.00 0.00 C ATOM 1202 NE2 HIS A 85 15.692 -12.031 -0.144 1.00 0.00 N ATOM 0 H HIS A 85 12.977 -9.063 1.604 1.00 0.00 H new ATOM 0 HA HIS A 85 14.683 -6.847 1.486 1.00 0.00 H new ATOM 0 HB2 HIS A 85 16.462 -8.497 1.670 1.00 0.00 H new ATOM 0 HB3 HIS A 85 15.131 -8.946 2.718 1.00 0.00 H new ATOM 0 HD2 HIS A 85 17.085 -10.345 -0.312 1.00 0.00 H new ATOM 0 HE1 HIS A 85 13.981 -13.098 0.574 1.00 0.00 H new ATOM 0 HE2 HIS A 85 16.096 -12.709 -0.789 1.00 0.00 H new ATOM 1211 N ASP A 86 14.504 -8.612 -1.295 1.00 0.00 N ATOM 1212 CA ASP A 86 14.814 -8.590 -2.720 1.00 0.00 C ATOM 1213 C ASP A 86 14.488 -7.228 -3.326 1.00 0.00 C ATOM 1214 O ASP A 86 15.150 -6.779 -4.261 1.00 0.00 O ATOM 1215 CB ASP A 86 14.036 -9.686 -3.450 1.00 0.00 C ATOM 1216 CG ASP A 86 14.607 -11.067 -3.197 1.00 0.00 C ATOM 1217 OD1 ASP A 86 15.843 -11.223 -3.288 1.00 0.00 O ATOM 1218 OD2 ASP A 86 13.819 -11.993 -2.910 1.00 0.00 O ATOM 0 H ASP A 86 13.935 -9.405 -0.999 1.00 0.00 H new ATOM 0 HA ASP A 86 15.882 -8.774 -2.837 1.00 0.00 H new ATOM 0 HB2 ASP A 86 12.994 -9.663 -3.130 1.00 0.00 H new ATOM 0 HB3 ASP A 86 14.045 -9.483 -4.521 1.00 0.00 H new ATOM 1223 N VAL A 87 13.462 -6.577 -2.787 1.00 0.00 N ATOM 1224 CA VAL A 87 13.048 -5.266 -3.275 1.00 0.00 C ATOM 1225 C VAL A 87 13.873 -4.156 -2.633 1.00 0.00 C ATOM 1226 O VAL A 87 14.289 -3.211 -3.303 1.00 0.00 O ATOM 1227 CB VAL A 87 11.555 -5.009 -2.995 1.00 0.00 C ATOM 1228 CG1 VAL A 87 11.169 -3.599 -3.413 1.00 0.00 C ATOM 1229 CG2 VAL A 87 10.695 -6.041 -3.710 1.00 0.00 C ATOM 0 H VAL A 87 12.903 -6.935 -2.013 1.00 0.00 H new ATOM 0 HA VAL A 87 13.214 -5.262 -4.352 1.00 0.00 H new ATOM 0 HB VAL A 87 11.381 -5.104 -1.923 1.00 0.00 H new ATOM 0 HG11 VAL A 87 10.111 -3.435 -3.208 1.00 0.00 H new ATOM 0 HG12 VAL A 87 11.763 -2.878 -2.852 1.00 0.00 H new ATOM 0 HG13 VAL A 87 11.356 -3.472 -4.479 1.00 0.00 H new ATOM 0 HG21 VAL A 87 9.643 -5.845 -3.502 1.00 0.00 H new ATOM 0 HG22 VAL A 87 10.870 -5.979 -4.784 1.00 0.00 H new ATOM 0 HG23 VAL A 87 10.955 -7.039 -3.357 1.00 0.00 H new ATOM 1239 N VAL A 88 14.105 -4.276 -1.330 1.00 0.00 N ATOM 1240 CA VAL A 88 14.881 -3.283 -0.597 1.00 0.00 C ATOM 1241 C VAL A 88 16.246 -3.068 -1.241 1.00 0.00 C ATOM 1242 O VAL A 88 16.703 -1.935 -1.385 1.00 0.00 O ATOM 1243 CB VAL A 88 15.079 -3.699 0.873 1.00 0.00 C ATOM 1244 CG1 VAL A 88 15.928 -2.674 1.609 1.00 0.00 C ATOM 1245 CG2 VAL A 88 13.735 -3.882 1.561 1.00 0.00 C ATOM 0 H VAL A 88 13.767 -5.051 -0.760 1.00 0.00 H new ATOM 0 HA VAL A 88 14.316 -2.352 -0.630 1.00 0.00 H new ATOM 0 HB VAL A 88 15.605 -4.653 0.894 1.00 0.00 H new ATOM 0 HG11 VAL A 88 16.057 -2.985 2.646 1.00 0.00 H new ATOM 0 HG12 VAL A 88 16.904 -2.598 1.129 1.00 0.00 H new ATOM 0 HG13 VAL A 88 15.433 -1.703 1.580 1.00 0.00 H new ATOM 0 HG21 VAL A 88 13.894 -4.176 2.598 1.00 0.00 H new ATOM 0 HG22 VAL A 88 13.180 -2.944 1.531 1.00 0.00 H new ATOM 0 HG23 VAL A 88 13.166 -4.657 1.048 1.00 0.00 H new ATOM 1255 N GLU A 89 16.892 -4.164 -1.626 1.00 0.00 N ATOM 1256 CA GLU A 89 18.206 -4.094 -2.255 1.00 0.00 C ATOM 1257 C GLU A 89 18.131 -3.362 -3.592 1.00 0.00 C ATOM 1258 O GLU A 89 19.054 -2.641 -3.971 1.00 0.00 O ATOM 1259 CB GLU A 89 18.772 -5.501 -2.462 1.00 0.00 C ATOM 1260 CG GLU A 89 18.064 -6.287 -3.553 1.00 0.00 C ATOM 1261 CD GLU A 89 18.822 -7.538 -3.955 1.00 0.00 C ATOM 1262 OE1 GLU A 89 20.054 -7.454 -4.134 1.00 0.00 O ATOM 1263 OE2 GLU A 89 18.180 -8.601 -4.090 1.00 0.00 O ATOM 0 H GLU A 89 16.528 -5.110 -1.514 1.00 0.00 H new ATOM 0 HA GLU A 89 18.869 -3.537 -1.593 1.00 0.00 H new ATOM 0 HB2 GLU A 89 19.831 -5.425 -2.709 1.00 0.00 H new ATOM 0 HB3 GLU A 89 18.703 -6.053 -1.525 1.00 0.00 H new ATOM 0 HG2 GLU A 89 17.068 -6.565 -3.208 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.932 -5.650 -4.427 1.00 0.00 H new ATOM 1270 N VAL A 90 17.024 -3.554 -4.304 1.00 0.00 N ATOM 1271 CA VAL A 90 16.827 -2.912 -5.598 1.00 0.00 C ATOM 1272 C VAL A 90 16.786 -1.395 -5.459 1.00 0.00 C ATOM 1273 O VAL A 90 17.387 -0.670 -6.252 1.00 0.00 O ATOM 1274 CB VAL A 90 15.527 -3.391 -6.270 1.00 0.00 C ATOM 1275 CG1 VAL A 90 15.317 -2.678 -7.597 1.00 0.00 C ATOM 1276 CG2 VAL A 90 15.552 -4.900 -6.464 1.00 0.00 C ATOM 0 H VAL A 90 16.251 -4.149 -4.006 1.00 0.00 H new ATOM 0 HA VAL A 90 17.675 -3.193 -6.223 1.00 0.00 H new ATOM 0 HB VAL A 90 14.690 -3.145 -5.617 1.00 0.00 H new ATOM 0 HG11 VAL A 90 14.393 -3.030 -8.057 1.00 0.00 H new ATOM 0 HG12 VAL A 90 15.251 -1.603 -7.426 1.00 0.00 H new ATOM 0 HG13 VAL A 90 16.156 -2.889 -8.260 1.00 0.00 H new ATOM 0 HG21 VAL A 90 14.626 -5.221 -6.940 1.00 0.00 H new ATOM 0 HG22 VAL A 90 16.398 -5.172 -7.096 1.00 0.00 H new ATOM 0 HG23 VAL A 90 15.651 -5.390 -5.495 1.00 0.00 H new ATOM 1286 N LEU A 91 16.071 -0.919 -4.445 1.00 0.00 N ATOM 1287 CA LEU A 91 15.951 0.514 -4.199 1.00 0.00 C ATOM 1288 C LEU A 91 17.307 1.125 -3.860 1.00 0.00 C ATOM 1289 O LEU A 91 17.663 2.190 -4.364 1.00 0.00 O ATOM 1290 CB LEU A 91 14.962 0.775 -3.062 1.00 0.00 C ATOM 1291 CG LEU A 91 13.575 0.152 -3.222 1.00 0.00 C ATOM 1292 CD1 LEU A 91 12.773 0.298 -1.938 1.00 0.00 C ATOM 1293 CD2 LEU A 91 12.836 0.789 -4.389 1.00 0.00 C ATOM 0 H LEU A 91 15.566 -1.505 -3.780 1.00 0.00 H new ATOM 0 HA LEU A 91 15.580 0.984 -5.110 1.00 0.00 H new ATOM 0 HB2 LEU A 91 15.400 0.405 -2.135 1.00 0.00 H new ATOM 0 HB3 LEU A 91 14.843 1.853 -2.951 1.00 0.00 H new ATOM 0 HG LEU A 91 13.697 -0.911 -3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 91 11.789 -0.151 -2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 91 13.295 -0.205 -1.124 1.00 0.00 H new ATOM 0 HD13 LEU A 91 12.660 1.355 -1.698 1.00 0.00 H new ATOM 0 HD21 LEU A 91 11.851 0.333 -4.488 1.00 0.00 H new ATOM 0 HD22 LEU A 91 12.725 1.858 -4.209 1.00 0.00 H new ATOM 0 HD23 LEU A 91 13.402 0.632 -5.307 1.00 0.00 H new ATOM 1305 N ARG A 92 18.060 0.441 -3.005 1.00 0.00 N ATOM 1306 CA ARG A 92 19.378 0.916 -2.599 1.00 0.00 C ATOM 1307 C ARG A 92 20.307 1.036 -3.804 1.00 0.00 C ATOM 1308 O ARG A 92 21.088 1.980 -3.906 1.00 0.00 O ATOM 1309 CB ARG A 92 19.987 -0.030 -1.563 1.00 0.00 C ATOM 1310 CG ARG A 92 19.188 -0.117 -0.273 1.00 0.00 C ATOM 1311 CD ARG A 92 19.755 -1.172 0.664 1.00 0.00 C ATOM 1312 NE ARG A 92 21.096 -0.828 1.129 1.00 0.00 N ATOM 1313 CZ ARG A 92 22.207 -1.163 0.483 1.00 0.00 C ATOM 1314 NH1 ARG A 92 22.138 -1.847 -0.650 1.00 0.00 N ATOM 1315 NH2 ARG A 92 23.391 -0.812 0.971 1.00 0.00 N ATOM 0 H ARG A 92 17.781 -0.443 -2.580 1.00 0.00 H new ATOM 0 HA ARG A 92 19.260 1.904 -2.153 1.00 0.00 H new ATOM 0 HB2 ARG A 92 20.069 -1.026 -1.997 1.00 0.00 H new ATOM 0 HB3 ARG A 92 20.999 0.301 -1.332 1.00 0.00 H new ATOM 0 HG2 ARG A 92 19.192 0.853 0.225 1.00 0.00 H new ATOM 0 HG3 ARG A 92 18.149 -0.353 -0.503 1.00 0.00 H new ATOM 0 HD2 ARG A 92 19.093 -1.288 1.522 1.00 0.00 H new ATOM 0 HD3 ARG A 92 19.785 -2.134 0.152 1.00 0.00 H new ATOM 0 HE ARG A 92 21.184 -0.301 1.998 1.00 0.00 H new ATOM 0 HH11 ARG A 92 21.230 -2.117 -1.028 1.00 0.00 H new ATOM 0 HH12 ARG A 92 22.993 -2.103 -1.144 1.00 0.00 H new ATOM 0 HH21 ARG A 92 23.448 -0.285 1.842 1.00 0.00 H new ATOM 0 HH22 ARG A 92 24.244 -1.070 0.474 1.00 0.00 H new ATOM 1329 N ASN A 93 20.216 0.070 -4.713 1.00 0.00 N ATOM 1330 CA ASN A 93 21.050 0.067 -5.909 1.00 0.00 C ATOM 1331 C ASN A 93 20.748 1.279 -6.786 1.00 0.00 C ATOM 1332 O ASN A 93 21.654 1.891 -7.350 1.00 0.00 O ATOM 1333 CB ASN A 93 20.829 -1.221 -6.706 1.00 0.00 C ATOM 1334 CG ASN A 93 21.733 -2.348 -6.246 1.00 0.00 C ATOM 1335 OD1 ASN A 93 22.926 -2.364 -6.547 1.00 0.00 O ATOM 1336 ND2 ASN A 93 21.166 -3.298 -5.511 1.00 0.00 N ATOM 0 H ASN A 93 19.574 -0.720 -4.644 1.00 0.00 H new ATOM 0 HA ASN A 93 22.093 0.119 -5.595 1.00 0.00 H new ATOM 0 HB2 ASN A 93 19.789 -1.531 -6.609 1.00 0.00 H new ATOM 0 HB3 ASN A 93 21.006 -1.025 -7.764 1.00 0.00 H new ATOM 0 HD21 ASN A 93 21.724 -4.082 -5.172 1.00 0.00 H new ATOM 0 HD22 ASN A 93 20.173 -3.244 -5.286 1.00 0.00 H new ATOM 1343 N ALA A 94 19.468 1.619 -6.895 1.00 0.00 N ATOM 1344 CA ALA A 94 19.046 2.759 -7.700 1.00 0.00 C ATOM 1345 C ALA A 94 19.851 4.006 -7.350 1.00 0.00 C ATOM 1346 O ALA A 94 20.451 4.089 -6.279 1.00 0.00 O ATOM 1347 CB ALA A 94 17.559 3.018 -7.511 1.00 0.00 C ATOM 0 H ALA A 94 18.705 1.121 -6.436 1.00 0.00 H new ATOM 0 HA ALA A 94 19.231 2.521 -8.747 1.00 0.00 H new ATOM 0 HB1 ALA A 94 17.258 3.872 -8.118 1.00 0.00 H new ATOM 0 HB2 ALA A 94 16.994 2.138 -7.818 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.357 3.230 -6.461 1.00 0.00 H new ATOM 1353 N GLY A 95 19.860 4.974 -8.261 1.00 0.00 N ATOM 1354 CA GLY A 95 20.595 6.204 -8.029 1.00 0.00 C ATOM 1355 C GLY A 95 19.685 7.411 -7.915 1.00 0.00 C ATOM 1356 O GLY A 95 18.497 7.274 -7.625 1.00 0.00 O ATOM 0 H GLY A 95 19.372 4.929 -9.155 1.00 0.00 H new ATOM 0 HA2 GLY A 95 21.180 6.107 -7.115 1.00 0.00 H new ATOM 0 HA3 GLY A 95 21.301 6.361 -8.844 1.00 0.00 H new ATOM 1360 N GLN A 96 20.244 8.595 -8.140 1.00 0.00 N ATOM 1361 CA GLN A 96 19.474 9.831 -8.058 1.00 0.00 C ATOM 1362 C GLN A 96 18.117 9.673 -8.736 1.00 0.00 C ATOM 1363 O GLN A 96 17.076 9.937 -8.134 1.00 0.00 O ATOM 1364 CB GLN A 96 20.248 10.983 -8.702 1.00 0.00 C ATOM 1365 CG GLN A 96 19.704 12.356 -8.345 1.00 0.00 C ATOM 1366 CD GLN A 96 20.702 13.466 -8.610 1.00 0.00 C ATOM 1367 OE1 GLN A 96 21.248 13.577 -9.708 1.00 0.00 O ATOM 1368 NE2 GLN A 96 20.945 14.297 -7.602 1.00 0.00 N ATOM 0 H GLN A 96 21.227 8.725 -8.380 1.00 0.00 H new ATOM 0 HA GLN A 96 19.309 10.057 -7.005 1.00 0.00 H new ATOM 0 HB2 GLN A 96 21.292 10.924 -8.395 1.00 0.00 H new ATOM 0 HB3 GLN A 96 20.227 10.863 -9.785 1.00 0.00 H new ATOM 0 HG2 GLN A 96 18.797 12.544 -8.919 1.00 0.00 H new ATOM 0 HG3 GLN A 96 19.423 12.369 -7.292 1.00 0.00 H new ATOM 0 HE21 GLN A 96 20.470 14.168 -6.709 1.00 0.00 H new ATOM 0 HE22 GLN A 96 21.607 15.064 -7.722 1.00 0.00 H new ATOM 1377 N VAL A 97 18.136 9.241 -9.993 1.00 0.00 N ATOM 1378 CA VAL A 97 16.907 9.047 -10.754 1.00 0.00 C ATOM 1379 C VAL A 97 16.304 7.674 -10.482 1.00 0.00 C ATOM 1380 O VAL A 97 16.782 6.661 -10.994 1.00 0.00 O ATOM 1381 CB VAL A 97 17.153 9.198 -12.266 1.00 0.00 C ATOM 1382 CG1 VAL A 97 15.890 8.873 -13.048 1.00 0.00 C ATOM 1383 CG2 VAL A 97 17.644 10.601 -12.589 1.00 0.00 C ATOM 0 H VAL A 97 18.989 9.019 -10.506 1.00 0.00 H new ATOM 0 HA VAL A 97 16.208 9.818 -10.429 1.00 0.00 H new ATOM 0 HB VAL A 97 17.927 8.490 -12.562 1.00 0.00 H new ATOM 0 HG11 VAL A 97 16.084 8.985 -14.115 1.00 0.00 H new ATOM 0 HG12 VAL A 97 15.587 7.847 -12.840 1.00 0.00 H new ATOM 0 HG13 VAL A 97 15.092 9.554 -12.750 1.00 0.00 H new ATOM 0 HG21 VAL A 97 17.813 10.689 -13.662 1.00 0.00 H new ATOM 0 HG22 VAL A 97 16.895 11.329 -12.278 1.00 0.00 H new ATOM 0 HG23 VAL A 97 18.577 10.791 -12.058 1.00 0.00 H new ATOM 1393 N VAL A 98 15.249 7.646 -9.673 1.00 0.00 N ATOM 1394 CA VAL A 98 14.579 6.397 -9.334 1.00 0.00 C ATOM 1395 C VAL A 98 13.186 6.336 -9.951 1.00 0.00 C ATOM 1396 O VAL A 98 12.254 6.985 -9.473 1.00 0.00 O ATOM 1397 CB VAL A 98 14.461 6.218 -7.809 1.00 0.00 C ATOM 1398 CG1 VAL A 98 13.680 4.956 -7.477 1.00 0.00 C ATOM 1399 CG2 VAL A 98 15.841 6.186 -7.169 1.00 0.00 C ATOM 0 H VAL A 98 14.840 8.475 -9.241 1.00 0.00 H new ATOM 0 HA VAL A 98 15.189 5.591 -9.740 1.00 0.00 H new ATOM 0 HB VAL A 98 13.916 7.070 -7.402 1.00 0.00 H new ATOM 0 HG11 VAL A 98 13.607 4.847 -6.395 1.00 0.00 H new ATOM 0 HG12 VAL A 98 12.679 5.025 -7.903 1.00 0.00 H new ATOM 0 HG13 VAL A 98 14.193 4.090 -7.895 1.00 0.00 H new ATOM 0 HG21 VAL A 98 15.739 6.059 -6.091 1.00 0.00 H new ATOM 0 HG22 VAL A 98 16.413 5.354 -7.580 1.00 0.00 H new ATOM 0 HG23 VAL A 98 16.360 7.122 -7.377 1.00 0.00 H new ATOM 1409 N HIS A 99 13.049 5.552 -11.015 1.00 0.00 N ATOM 1410 CA HIS A 99 11.768 5.405 -11.698 1.00 0.00 C ATOM 1411 C HIS A 99 10.929 4.309 -11.048 1.00 0.00 C ATOM 1412 O HIS A 99 11.086 3.127 -11.356 1.00 0.00 O ATOM 1413 CB HIS A 99 11.988 5.085 -13.177 1.00 0.00 C ATOM 1414 CG HIS A 99 12.195 6.300 -14.028 1.00 0.00 C ATOM 1415 ND1 HIS A 99 13.288 6.464 -14.853 1.00 0.00 N ATOM 1416 CD2 HIS A 99 11.440 7.413 -14.180 1.00 0.00 C ATOM 1417 CE1 HIS A 99 13.197 7.626 -15.474 1.00 0.00 C ATOM 1418 NE2 HIS A 99 12.085 8.222 -15.084 1.00 0.00 N ATOM 0 H HIS A 99 13.809 5.008 -11.423 1.00 0.00 H new ATOM 0 HA HIS A 99 11.229 6.349 -11.615 1.00 0.00 H new ATOM 0 HB2 HIS A 99 12.855 4.432 -13.274 1.00 0.00 H new ATOM 0 HB3 HIS A 99 11.128 4.531 -13.552 1.00 0.00 H new ATOM 0 HD2 HIS A 99 10.505 7.626 -13.683 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.911 8.022 -16.181 1.00 0.00 H new ATOM 0 HE2 HIS A 99 11.758 9.134 -15.402 1.00 0.00 H new ATOM 1427 N LEU A 100 10.039 4.709 -10.146 1.00 0.00 N ATOM 1428 CA LEU A 100 9.174 3.761 -9.452 1.00 0.00 C ATOM 1429 C LEU A 100 7.933 3.448 -10.280 1.00 0.00 C ATOM 1430 O LEU A 100 7.248 4.353 -10.760 1.00 0.00 O ATOM 1431 CB LEU A 100 8.764 4.320 -8.088 1.00 0.00 C ATOM 1432 CG LEU A 100 8.606 3.296 -6.963 1.00 0.00 C ATOM 1433 CD1 LEU A 100 7.504 2.303 -7.296 1.00 0.00 C ATOM 1434 CD2 LEU A 100 9.921 2.571 -6.713 1.00 0.00 C ATOM 0 H LEU A 100 9.898 5.683 -9.878 1.00 0.00 H new ATOM 0 HA LEU A 100 9.733 2.836 -9.307 1.00 0.00 H new ATOM 0 HB2 LEU A 100 9.507 5.056 -7.781 1.00 0.00 H new ATOM 0 HB3 LEU A 100 7.819 4.851 -8.204 1.00 0.00 H new ATOM 0 HG LEU A 100 8.327 3.826 -6.052 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.406 1.582 -6.484 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.561 2.835 -7.424 1.00 0.00 H new ATOM 0 HD13 LEU A 100 7.753 1.779 -8.219 1.00 0.00 H new ATOM 0 HD21 LEU A 100 9.790 1.846 -5.909 1.00 0.00 H new ATOM 0 HD22 LEU A 100 10.230 2.054 -7.621 1.00 0.00 H new ATOM 0 HD23 LEU A 100 10.686 3.293 -6.429 1.00 0.00 H new ATOM 1446 N THR A 101 7.645 2.160 -10.443 1.00 0.00 N ATOM 1447 CA THR A 101 6.485 1.728 -11.212 1.00 0.00 C ATOM 1448 C THR A 101 5.368 1.241 -10.296 1.00 0.00 C ATOM 1449 O THR A 101 5.493 0.204 -9.644 1.00 0.00 O ATOM 1450 CB THR A 101 6.852 0.602 -12.197 1.00 0.00 C ATOM 1451 OG1 THR A 101 8.047 0.944 -12.908 1.00 0.00 O ATOM 1452 CG2 THR A 101 5.721 0.355 -13.184 1.00 0.00 C ATOM 0 H THR A 101 8.200 1.398 -10.052 1.00 0.00 H new ATOM 0 HA THR A 101 6.138 2.595 -11.774 1.00 0.00 H new ATOM 0 HB THR A 101 7.018 -0.311 -11.625 1.00 0.00 H new ATOM 0 HG1 THR A 101 8.828 0.743 -12.351 1.00 0.00 H new ATOM 0 HG21 THR A 101 6.004 -0.444 -13.869 1.00 0.00 H new ATOM 0 HG22 THR A 101 4.821 0.066 -12.641 1.00 0.00 H new ATOM 0 HG23 THR A 101 5.527 1.266 -13.750 1.00 0.00 H new ATOM 1460 N LEU A 102 4.276 1.996 -10.250 1.00 0.00 N ATOM 1461 CA LEU A 102 3.135 1.641 -9.414 1.00 0.00 C ATOM 1462 C LEU A 102 1.843 1.641 -10.226 1.00 0.00 C ATOM 1463 O LEU A 102 1.774 2.233 -11.302 1.00 0.00 O ATOM 1464 CB LEU A 102 3.013 2.617 -8.242 1.00 0.00 C ATOM 1465 CG LEU A 102 4.329 3.086 -7.620 1.00 0.00 C ATOM 1466 CD1 LEU A 102 4.896 4.265 -8.395 1.00 0.00 C ATOM 1467 CD2 LEU A 102 4.126 3.455 -6.158 1.00 0.00 C ATOM 0 H LEU A 102 4.157 2.858 -10.782 1.00 0.00 H new ATOM 0 HA LEU A 102 3.299 0.635 -9.027 1.00 0.00 H new ATOM 0 HB2 LEU A 102 2.462 3.494 -8.581 1.00 0.00 H new ATOM 0 HB3 LEU A 102 2.414 2.145 -7.463 1.00 0.00 H new ATOM 0 HG LEU A 102 5.045 2.266 -7.671 1.00 0.00 H new ATOM 0 HD11 LEU A 102 5.832 4.585 -7.938 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.080 3.967 -9.427 1.00 0.00 H new ATOM 0 HD13 LEU A 102 4.183 5.089 -8.376 1.00 0.00 H new ATOM 0 HD21 LEU A 102 5.073 3.786 -5.732 1.00 0.00 H new ATOM 0 HD22 LEU A 102 3.393 4.259 -6.084 1.00 0.00 H new ATOM 0 HD23 LEU A 102 3.766 2.584 -5.610 1.00 0.00 H new ATOM 1479 N VAL A 103 0.821 0.973 -9.701 1.00 0.00 N ATOM 1480 CA VAL A 103 -0.470 0.898 -10.375 1.00 0.00 C ATOM 1481 C VAL A 103 -1.614 1.161 -9.403 1.00 0.00 C ATOM 1482 O VAL A 103 -1.890 0.350 -8.519 1.00 0.00 O ATOM 1483 CB VAL A 103 -0.679 -0.478 -11.035 1.00 0.00 C ATOM 1484 CG1 VAL A 103 -0.397 -1.596 -10.043 1.00 0.00 C ATOM 1485 CG2 VAL A 103 -2.089 -0.592 -11.593 1.00 0.00 C ATOM 0 H VAL A 103 0.862 0.476 -8.811 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.469 1.667 -11.147 1.00 0.00 H new ATOM 0 HB VAL A 103 0.024 -0.575 -11.863 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -0.550 -2.560 -10.528 1.00 0.00 H new ATOM 0 HG12 VAL A 103 0.634 -1.524 -9.697 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -1.073 -1.507 -9.192 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -2.219 -1.570 -12.056 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.811 -0.474 -10.785 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -2.249 0.186 -12.339 1.00 0.00 H new ATOM 1495 N ARG A 104 -2.276 2.301 -9.572 1.00 0.00 N ATOM 1496 CA ARG A 104 -3.391 2.673 -8.708 1.00 0.00 C ATOM 1497 C ARG A 104 -4.723 2.479 -9.427 1.00 0.00 C ATOM 1498 O ARG A 104 -4.812 2.639 -10.644 1.00 0.00 O ATOM 1499 CB ARG A 104 -3.250 4.127 -8.256 1.00 0.00 C ATOM 1500 CG ARG A 104 -3.328 5.130 -9.395 1.00 0.00 C ATOM 1501 CD ARG A 104 -2.683 6.454 -9.017 1.00 0.00 C ATOM 1502 NE ARG A 104 -3.365 7.590 -9.632 1.00 0.00 N ATOM 1503 CZ ARG A 104 -2.791 8.772 -9.830 1.00 0.00 C ATOM 1504 NH1 ARG A 104 -1.532 8.971 -9.464 1.00 0.00 N ATOM 1505 NH2 ARG A 104 -3.476 9.757 -10.396 1.00 0.00 N ATOM 0 H ARG A 104 -2.060 2.983 -10.299 1.00 0.00 H new ATOM 0 HA ARG A 104 -3.372 2.024 -7.832 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -4.033 4.351 -7.532 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -2.297 4.248 -7.742 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -2.833 4.721 -10.276 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -4.371 5.296 -9.664 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -2.696 6.567 -7.933 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -1.637 6.449 -9.325 1.00 0.00 H new ATOM 0 HE ARG A 104 -4.334 7.469 -9.925 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -1.002 8.216 -9.029 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -1.094 9.879 -9.617 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -4.444 9.607 -10.680 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -3.034 10.664 -10.547 1.00 0.00 H new ATOM 1519 N ARG A 105 -5.755 2.133 -8.665 1.00 0.00 N ATOM 1520 CA ARG A 105 -7.082 1.916 -9.229 1.00 0.00 C ATOM 1521 C ARG A 105 -7.622 3.197 -9.858 1.00 0.00 C ATOM 1522 O ARG A 105 -7.472 4.285 -9.302 1.00 0.00 O ATOM 1523 CB ARG A 105 -8.044 1.421 -8.147 1.00 0.00 C ATOM 1524 CG ARG A 105 -9.102 0.460 -8.666 1.00 0.00 C ATOM 1525 CD ARG A 105 -10.258 1.202 -9.316 1.00 0.00 C ATOM 1526 NE ARG A 105 -11.253 1.631 -8.337 1.00 0.00 N ATOM 1527 CZ ARG A 105 -12.051 0.793 -7.684 1.00 0.00 C ATOM 1528 NH1 ARG A 105 -11.970 -0.512 -7.906 1.00 0.00 N ATOM 1529 NH2 ARG A 105 -12.931 1.259 -6.808 1.00 0.00 N ATOM 0 H ARG A 105 -5.698 1.997 -7.656 1.00 0.00 H new ATOM 0 HA ARG A 105 -6.999 1.157 -10.007 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -7.471 0.928 -7.362 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.537 2.279 -7.691 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -8.653 -0.221 -9.389 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -9.476 -0.150 -7.843 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -9.876 2.072 -9.850 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -10.732 0.557 -10.056 1.00 0.00 H new ATOM 0 HE ARG A 105 -11.340 2.629 -8.144 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -11.294 -0.874 -8.579 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -12.583 -1.154 -7.404 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -12.996 2.262 -6.635 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.543 0.614 -6.308 1.00 0.00 H new ATOM 1543 N LYS A 106 -8.250 3.059 -11.021 1.00 0.00 N ATOM 1544 CA LYS A 106 -8.813 4.204 -11.727 1.00 0.00 C ATOM 1545 C LYS A 106 -10.107 4.668 -11.066 1.00 0.00 C ATOM 1546 O LYS A 106 -10.498 4.157 -10.016 1.00 0.00 O ATOM 1547 CB LYS A 106 -9.075 3.848 -13.192 1.00 0.00 C ATOM 1548 CG LYS A 106 -7.829 3.418 -13.946 1.00 0.00 C ATOM 1549 CD LYS A 106 -8.175 2.572 -15.160 1.00 0.00 C ATOM 1550 CE LYS A 106 -7.113 2.689 -16.242 1.00 0.00 C ATOM 1551 NZ LYS A 106 -7.640 2.302 -17.580 1.00 0.00 N ATOM 0 H LYS A 106 -8.382 2.165 -11.495 1.00 0.00 H new ATOM 0 HA LYS A 106 -8.090 5.018 -11.681 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -9.811 3.045 -13.236 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -9.514 4.711 -13.694 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -7.272 4.300 -14.263 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -7.177 2.852 -13.281 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -8.277 1.529 -14.861 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -9.139 2.885 -15.560 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -6.744 3.714 -16.280 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -6.264 2.054 -15.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -6.860 2.281 -18.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -8.076 1.360 -17.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -8.352 2.995 -17.886 1.00 0.00 H new ATOM 1565 N THR A 107 -10.769 5.639 -11.687 1.00 0.00 N ATOM 1566 CA THR A 107 -12.018 6.172 -11.160 1.00 0.00 C ATOM 1567 C THR A 107 -12.993 6.504 -12.284 1.00 0.00 C ATOM 1568 O THR A 107 -12.678 6.333 -13.462 1.00 0.00 O ATOM 1569 CB THR A 107 -11.778 7.436 -10.314 1.00 0.00 C ATOM 1570 OG1 THR A 107 -10.956 8.360 -11.037 1.00 0.00 O ATOM 1571 CG2 THR A 107 -11.112 7.085 -8.992 1.00 0.00 C ATOM 0 H THR A 107 -10.460 6.073 -12.557 1.00 0.00 H new ATOM 0 HA THR A 107 -12.449 5.397 -10.527 1.00 0.00 H new ATOM 0 HB THR A 107 -12.744 7.895 -10.105 1.00 0.00 H new ATOM 0 HG1 THR A 107 -10.809 9.162 -10.493 1.00 0.00 H new ATOM 0 HG21 THR A 107 -10.953 7.994 -8.412 1.00 0.00 H new ATOM 0 HG22 THR A 107 -11.753 6.404 -8.431 1.00 0.00 H new ATOM 0 HG23 THR A 107 -10.153 6.605 -9.184 1.00 0.00 H new ATOM 1579 N SER A 108 -14.177 6.980 -11.913 1.00 0.00 N ATOM 1580 CA SER A 108 -15.199 7.334 -12.891 1.00 0.00 C ATOM 1581 C SER A 108 -14.581 8.049 -14.089 1.00 0.00 C ATOM 1582 O SER A 108 -14.820 7.678 -15.238 1.00 0.00 O ATOM 1583 CB SER A 108 -16.266 8.222 -12.247 1.00 0.00 C ATOM 1584 OG SER A 108 -15.688 9.388 -11.686 1.00 0.00 O ATOM 0 H SER A 108 -14.452 7.129 -10.942 1.00 0.00 H new ATOM 0 HA SER A 108 -15.666 6.413 -13.241 1.00 0.00 H new ATOM 0 HB2 SER A 108 -17.009 8.503 -12.994 1.00 0.00 H new ATOM 0 HB3 SER A 108 -16.790 7.663 -11.472 1.00 0.00 H new ATOM 0 HG SER A 108 -16.390 9.940 -11.282 1.00 0.00 H new ATOM 1590 N SER A 109 -13.785 9.076 -13.810 1.00 0.00 N ATOM 1591 CA SER A 109 -13.134 9.847 -14.864 1.00 0.00 C ATOM 1592 C SER A 109 -11.994 9.052 -15.493 1.00 0.00 C ATOM 1593 O SER A 109 -11.564 8.031 -14.956 1.00 0.00 O ATOM 1594 CB SER A 109 -12.603 11.168 -14.304 1.00 0.00 C ATOM 1595 OG SER A 109 -11.444 10.959 -13.517 1.00 0.00 O ATOM 0 H SER A 109 -13.575 9.394 -12.864 1.00 0.00 H new ATOM 0 HA SER A 109 -13.874 10.059 -15.636 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.372 11.847 -15.124 1.00 0.00 H new ATOM 0 HB3 SER A 109 -13.374 11.647 -13.701 1.00 0.00 H new ATOM 0 HG SER A 109 -11.123 11.818 -13.172 1.00 0.00 H new ATOM 1601 N SER A 110 -11.507 9.529 -16.634 1.00 0.00 N ATOM 1602 CA SER A 110 -10.419 8.863 -17.339 1.00 0.00 C ATOM 1603 C SER A 110 -10.844 7.474 -17.806 1.00 0.00 C ATOM 1604 O SER A 110 -10.115 6.497 -17.632 1.00 0.00 O ATOM 1605 CB SER A 110 -9.188 8.756 -16.437 1.00 0.00 C ATOM 1606 OG SER A 110 -8.043 8.377 -17.180 1.00 0.00 O ATOM 0 H SER A 110 -11.849 10.375 -17.090 1.00 0.00 H new ATOM 0 HA SER A 110 -10.167 9.461 -18.215 1.00 0.00 H new ATOM 0 HB2 SER A 110 -9.007 9.713 -15.948 1.00 0.00 H new ATOM 0 HB3 SER A 110 -9.373 8.025 -15.650 1.00 0.00 H new ATOM 0 HG SER A 110 -8.222 7.536 -17.651 1.00 0.00 H new ATOM 1612 N THR A 111 -12.031 7.393 -18.400 1.00 0.00 N ATOM 1613 CA THR A 111 -12.556 6.125 -18.890 1.00 0.00 C ATOM 1614 C THR A 111 -11.565 5.446 -19.829 1.00 0.00 C ATOM 1615 O THR A 111 -10.807 6.113 -20.534 1.00 0.00 O ATOM 1616 CB THR A 111 -13.894 6.318 -19.628 1.00 0.00 C ATOM 1617 OG1 THR A 111 -14.436 5.047 -20.002 1.00 0.00 O ATOM 1618 CG2 THR A 111 -13.710 7.181 -20.867 1.00 0.00 C ATOM 0 H THR A 111 -12.647 8.192 -18.553 1.00 0.00 H new ATOM 0 HA THR A 111 -12.719 5.492 -18.017 1.00 0.00 H new ATOM 0 HB THR A 111 -14.585 6.822 -18.953 1.00 0.00 H new ATOM 0 HG1 THR A 111 -15.287 5.179 -20.469 1.00 0.00 H new ATOM 0 HG21 THR A 111 -14.669 7.303 -21.371 1.00 0.00 H new ATOM 0 HG22 THR A 111 -13.326 8.159 -20.576 1.00 0.00 H new ATOM 0 HG23 THR A 111 -13.003 6.701 -21.543 1.00 0.00 H new ATOM 1626 N SER A 112 -11.576 4.117 -19.834 1.00 0.00 N ATOM 1627 CA SER A 112 -10.676 3.348 -20.685 1.00 0.00 C ATOM 1628 C SER A 112 -10.630 3.931 -22.094 1.00 0.00 C ATOM 1629 O SER A 112 -11.549 4.618 -22.540 1.00 0.00 O ATOM 1630 CB SER A 112 -11.118 1.885 -20.740 1.00 0.00 C ATOM 1631 OG SER A 112 -10.584 1.149 -19.653 1.00 0.00 O ATOM 0 H SER A 112 -12.199 3.550 -19.258 1.00 0.00 H new ATOM 0 HA SER A 112 -9.675 3.402 -20.256 1.00 0.00 H new ATOM 0 HB2 SER A 112 -12.206 1.830 -20.721 1.00 0.00 H new ATOM 0 HB3 SER A 112 -10.793 1.439 -21.680 1.00 0.00 H new ATOM 0 HG SER A 112 -10.883 0.217 -19.710 1.00 0.00 H new ATOM 1637 N PRO A 113 -9.533 3.651 -22.814 1.00 0.00 N ATOM 1638 CA PRO A 113 -9.340 4.136 -24.183 1.00 0.00 C ATOM 1639 C PRO A 113 -10.282 3.464 -25.176 1.00 0.00 C ATOM 1640 O PRO A 113 -11.164 2.696 -24.787 1.00 0.00 O ATOM 1641 CB PRO A 113 -7.887 3.764 -24.490 1.00 0.00 C ATOM 1642 CG PRO A 113 -7.596 2.607 -23.597 1.00 0.00 C ATOM 1643 CD PRO A 113 -8.398 2.837 -22.346 1.00 0.00 C ATOM 0 HA PRO A 113 -9.550 5.202 -24.270 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -7.760 3.496 -25.539 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -7.214 4.598 -24.290 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -7.876 1.667 -24.073 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -6.531 2.546 -23.372 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -8.732 1.898 -21.904 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -7.816 3.358 -21.586 1.00 0.00 H new ATOM 1651 N LEU A 114 -10.091 3.756 -26.457 1.00 0.00 N ATOM 1652 CA LEU A 114 -10.924 3.178 -27.506 1.00 0.00 C ATOM 1653 C LEU A 114 -10.530 1.731 -27.780 1.00 0.00 C ATOM 1654 O LEU A 114 -11.359 0.919 -28.190 1.00 0.00 O ATOM 1655 CB LEU A 114 -10.807 4.002 -28.790 1.00 0.00 C ATOM 1656 CG LEU A 114 -9.408 4.102 -29.398 1.00 0.00 C ATOM 1657 CD1 LEU A 114 -9.179 2.979 -30.397 1.00 0.00 C ATOM 1658 CD2 LEU A 114 -9.210 5.457 -30.061 1.00 0.00 C ATOM 0 H LEU A 114 -9.367 4.390 -26.795 1.00 0.00 H new ATOM 0 HA LEU A 114 -11.959 3.195 -27.164 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -11.476 3.572 -29.536 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -11.165 5.011 -28.584 1.00 0.00 H new ATOM 0 HG LEU A 114 -8.676 4.002 -28.596 1.00 0.00 H new ATOM 0 HD11 LEU A 114 -8.178 3.066 -30.820 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -9.277 2.018 -29.893 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -9.917 3.047 -31.196 1.00 0.00 H new ATOM 0 HD21 LEU A 114 -8.209 5.510 -30.488 1.00 0.00 H new ATOM 0 HD22 LEU A 114 -9.949 5.587 -30.852 1.00 0.00 H new ATOM 0 HD23 LEU A 114 -9.330 6.246 -29.319 1.00 0.00 H new ATOM 1670 N GLU A 115 -9.259 1.415 -27.549 1.00 0.00 N ATOM 1671 CA GLU A 115 -8.756 0.064 -27.770 1.00 0.00 C ATOM 1672 C GLU A 115 -7.902 -0.397 -26.592 1.00 0.00 C ATOM 1673 O GLU A 115 -6.685 -0.553 -26.699 1.00 0.00 O ATOM 1674 CB GLU A 115 -7.938 0.006 -29.061 1.00 0.00 C ATOM 1675 CG GLU A 115 -6.996 1.185 -29.240 1.00 0.00 C ATOM 1676 CD GLU A 115 -6.549 1.362 -30.678 1.00 0.00 C ATOM 1677 OE1 GLU A 115 -7.385 1.178 -31.587 1.00 0.00 O ATOM 1678 OE2 GLU A 115 -5.362 1.685 -30.893 1.00 0.00 O ATOM 0 H GLU A 115 -8.560 2.075 -27.209 1.00 0.00 H new ATOM 0 HA GLU A 115 -9.612 -0.605 -27.860 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -7.358 -0.917 -29.072 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -8.619 -0.036 -29.911 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -7.492 2.095 -28.903 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -6.120 1.045 -28.606 1.00 0.00 H new ATOM 1685 N PRO A 116 -8.553 -0.622 -25.441 1.00 0.00 N ATOM 1686 CA PRO A 116 -7.874 -1.069 -24.222 1.00 0.00 C ATOM 1687 C PRO A 116 -7.371 -2.504 -24.331 1.00 0.00 C ATOM 1688 O PRO A 116 -7.868 -3.303 -25.125 1.00 0.00 O ATOM 1689 CB PRO A 116 -8.962 -0.963 -23.151 1.00 0.00 C ATOM 1690 CG PRO A 116 -10.244 -1.089 -23.899 1.00 0.00 C ATOM 1691 CD PRO A 116 -10.003 -0.457 -25.242 1.00 0.00 C ATOM 0 HA PRO A 116 -6.987 -0.473 -24.008 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -8.860 -1.751 -22.404 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -8.905 -0.012 -22.621 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -10.532 -2.135 -24.006 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -11.055 -0.587 -23.371 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -10.575 -0.951 -26.027 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -10.293 0.594 -25.250 1.00 0.00 H new ATOM 1699 N PRO A 117 -6.361 -2.842 -23.515 1.00 0.00 N ATOM 1700 CA PRO A 117 -5.770 -4.183 -23.501 1.00 0.00 C ATOM 1701 C PRO A 117 -6.718 -5.228 -22.922 1.00 0.00 C ATOM 1702 O PRO A 117 -6.732 -5.466 -21.714 1.00 0.00 O ATOM 1703 CB PRO A 117 -4.541 -4.020 -22.603 1.00 0.00 C ATOM 1704 CG PRO A 117 -4.869 -2.867 -21.718 1.00 0.00 C ATOM 1705 CD PRO A 117 -5.720 -1.941 -22.543 1.00 0.00 C ATOM 0 HA PRO A 117 -5.537 -4.536 -24.506 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -4.352 -4.923 -22.023 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -3.644 -3.825 -23.191 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -5.403 -3.198 -20.827 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -3.963 -2.366 -21.378 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -6.457 -1.420 -21.931 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -5.120 -1.178 -23.038 1.00 0.00 H new ATOM 1713 N SER A 118 -7.508 -5.850 -23.791 1.00 0.00 N ATOM 1714 CA SER A 118 -8.461 -6.868 -23.365 1.00 0.00 C ATOM 1715 C SER A 118 -7.801 -7.870 -22.422 1.00 0.00 C ATOM 1716 O SER A 118 -6.605 -8.142 -22.526 1.00 0.00 O ATOM 1717 CB SER A 118 -9.038 -7.598 -24.580 1.00 0.00 C ATOM 1718 OG SER A 118 -8.006 -8.125 -25.395 1.00 0.00 O ATOM 0 H SER A 118 -7.507 -5.667 -24.794 1.00 0.00 H new ATOM 0 HA SER A 118 -9.271 -6.371 -22.831 1.00 0.00 H new ATOM 0 HB2 SER A 118 -9.691 -8.405 -24.247 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.652 -6.911 -25.163 1.00 0.00 H new ATOM 0 HG SER A 118 -8.400 -8.588 -26.163 1.00 0.00 H new ATOM 1724 N ASP A 119 -8.590 -8.416 -21.503 1.00 0.00 N ATOM 1725 CA ASP A 119 -8.084 -9.388 -20.541 1.00 0.00 C ATOM 1726 C ASP A 119 -9.228 -10.027 -19.761 1.00 0.00 C ATOM 1727 O ASP A 119 -10.240 -9.382 -19.485 1.00 0.00 O ATOM 1728 CB ASP A 119 -7.102 -8.721 -19.577 1.00 0.00 C ATOM 1729 CG ASP A 119 -7.802 -7.874 -18.532 1.00 0.00 C ATOM 1730 OD1 ASP A 119 -8.730 -7.124 -18.901 1.00 0.00 O ATOM 1731 OD2 ASP A 119 -7.422 -7.962 -17.346 1.00 0.00 O ATOM 0 H ASP A 119 -9.582 -8.202 -21.404 1.00 0.00 H new ATOM 0 HA ASP A 119 -7.563 -10.171 -21.093 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -6.507 -9.488 -19.080 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -6.410 -8.097 -20.142 1.00 0.00 H new ATOM 1736 N ARG A 120 -9.061 -11.297 -19.408 1.00 0.00 N ATOM 1737 CA ARG A 120 -10.082 -12.023 -18.662 1.00 0.00 C ATOM 1738 C ARG A 120 -9.470 -12.738 -17.459 1.00 0.00 C ATOM 1739 O ARG A 120 -8.308 -13.141 -17.489 1.00 0.00 O ATOM 1740 CB ARG A 120 -10.783 -13.037 -19.568 1.00 0.00 C ATOM 1741 CG ARG A 120 -9.854 -14.106 -20.120 1.00 0.00 C ATOM 1742 CD ARG A 120 -10.385 -14.689 -21.419 1.00 0.00 C ATOM 1743 NE ARG A 120 -9.366 -15.451 -22.135 1.00 0.00 N ATOM 1744 CZ ARG A 120 -9.645 -16.397 -23.025 1.00 0.00 C ATOM 1745 NH1 ARG A 120 -10.905 -16.696 -23.307 1.00 0.00 N ATOM 1746 NH2 ARG A 120 -8.661 -17.047 -23.634 1.00 0.00 N ATOM 0 H ARG A 120 -8.229 -11.845 -19.626 1.00 0.00 H new ATOM 0 HA ARG A 120 -10.815 -11.301 -18.301 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -11.585 -13.518 -19.008 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -11.248 -12.508 -20.399 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -8.866 -13.679 -20.289 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -9.736 -14.902 -19.384 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -11.237 -15.335 -21.205 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -10.749 -13.883 -22.056 1.00 0.00 H new ATOM 0 HE ARG A 120 -8.386 -15.246 -21.941 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -11.664 -16.199 -22.840 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -11.116 -17.423 -23.991 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -7.690 -16.820 -23.419 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -8.876 -17.773 -24.317 1.00 0.00 H new ATOM 1760 N GLY A 121 -10.262 -12.890 -16.402 1.00 0.00 N ATOM 1761 CA GLY A 121 -9.782 -13.555 -15.205 1.00 0.00 C ATOM 1762 C GLY A 121 -10.324 -12.927 -13.936 1.00 0.00 C ATOM 1763 O GLY A 121 -9.572 -12.355 -13.146 1.00 0.00 O ATOM 0 H GLY A 121 -11.227 -12.564 -16.353 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -10.068 -14.606 -15.237 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -8.693 -13.522 -15.187 1.00 0.00 H new ATOM 1767 N THR A 122 -11.635 -13.032 -13.739 1.00 0.00 N ATOM 1768 CA THR A 122 -12.278 -12.468 -12.559 1.00 0.00 C ATOM 1769 C THR A 122 -13.196 -13.487 -11.894 1.00 0.00 C ATOM 1770 O THR A 122 -14.039 -14.099 -12.549 1.00 0.00 O ATOM 1771 CB THR A 122 -13.095 -11.211 -12.912 1.00 0.00 C ATOM 1772 OG1 THR A 122 -13.590 -10.597 -11.716 1.00 0.00 O ATOM 1773 CG2 THR A 122 -14.259 -11.560 -13.827 1.00 0.00 C ATOM 0 H THR A 122 -12.272 -13.503 -14.382 1.00 0.00 H new ATOM 0 HA THR A 122 -11.483 -12.193 -11.866 1.00 0.00 H new ATOM 0 HB THR A 122 -12.440 -10.514 -13.434 1.00 0.00 H new ATOM 0 HG1 THR A 122 -14.107 -9.798 -11.949 1.00 0.00 H new ATOM 0 HG21 THR A 122 -14.821 -10.656 -14.062 1.00 0.00 H new ATOM 0 HG22 THR A 122 -13.878 -12.000 -14.748 1.00 0.00 H new ATOM 0 HG23 THR A 122 -14.913 -12.274 -13.327 1.00 0.00 H new ATOM 1781 N VAL A 123 -13.028 -13.663 -10.587 1.00 0.00 N ATOM 1782 CA VAL A 123 -13.843 -14.607 -9.832 1.00 0.00 C ATOM 1783 C VAL A 123 -14.096 -14.104 -8.415 1.00 0.00 C ATOM 1784 O VAL A 123 -13.158 -13.864 -7.654 1.00 0.00 O ATOM 1785 CB VAL A 123 -13.176 -15.994 -9.761 1.00 0.00 C ATOM 1786 CG1 VAL A 123 -14.018 -16.949 -8.929 1.00 0.00 C ATOM 1787 CG2 VAL A 123 -12.951 -16.548 -11.160 1.00 0.00 C ATOM 0 H VAL A 123 -12.335 -13.164 -10.029 1.00 0.00 H new ATOM 0 HA VAL A 123 -14.793 -14.696 -10.358 1.00 0.00 H new ATOM 0 HB VAL A 123 -12.205 -15.888 -9.277 1.00 0.00 H new ATOM 0 HG11 VAL A 123 -13.531 -17.924 -8.890 1.00 0.00 H new ATOM 0 HG12 VAL A 123 -14.123 -16.555 -7.918 1.00 0.00 H new ATOM 0 HG13 VAL A 123 -15.004 -17.054 -9.382 1.00 0.00 H new ATOM 0 HG21 VAL A 123 -12.479 -17.528 -11.092 1.00 0.00 H new ATOM 0 HG22 VAL A 123 -13.908 -16.641 -11.673 1.00 0.00 H new ATOM 0 HG23 VAL A 123 -12.304 -15.872 -11.719 1.00 0.00 H new ATOM 1797 N SER A 124 -15.369 -13.947 -8.067 1.00 0.00 N ATOM 1798 CA SER A 124 -15.746 -13.469 -6.742 1.00 0.00 C ATOM 1799 C SER A 124 -17.083 -14.064 -6.310 1.00 0.00 C ATOM 1800 O SER A 124 -17.915 -14.419 -7.143 1.00 0.00 O ATOM 1801 CB SER A 124 -15.827 -11.941 -6.731 1.00 0.00 C ATOM 1802 OG SER A 124 -16.433 -11.471 -5.540 1.00 0.00 O ATOM 0 H SER A 124 -16.157 -14.144 -8.684 1.00 0.00 H new ATOM 0 HA SER A 124 -14.980 -13.790 -6.036 1.00 0.00 H new ATOM 0 HB2 SER A 124 -14.826 -11.520 -6.824 1.00 0.00 H new ATOM 0 HB3 SER A 124 -16.398 -11.598 -7.593 1.00 0.00 H new ATOM 0 HG SER A 124 -16.471 -10.492 -5.557 1.00 0.00 H new ATOM 1808 N GLY A 125 -17.280 -14.169 -4.999 1.00 0.00 N ATOM 1809 CA GLY A 125 -18.517 -14.721 -4.477 1.00 0.00 C ATOM 1810 C GLY A 125 -19.079 -13.904 -3.332 1.00 0.00 C ATOM 1811 O GLY A 125 -18.412 -13.029 -2.779 1.00 0.00 O ATOM 0 H GLY A 125 -16.606 -13.882 -4.290 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -19.254 -14.773 -5.278 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -18.341 -15.742 -4.139 1.00 0.00 H new ATOM 1815 N PRO A 126 -20.337 -14.184 -2.961 1.00 0.00 N ATOM 1816 CA PRO A 126 -21.018 -13.478 -1.871 1.00 0.00 C ATOM 1817 C PRO A 126 -20.434 -13.821 -0.505 1.00 0.00 C ATOM 1818 O PRO A 126 -20.000 -14.949 -0.270 1.00 0.00 O ATOM 1819 CB PRO A 126 -22.462 -13.973 -1.975 1.00 0.00 C ATOM 1820 CG PRO A 126 -22.360 -15.306 -2.633 1.00 0.00 C ATOM 1821 CD PRO A 126 -21.192 -15.213 -3.576 1.00 0.00 C ATOM 0 HA PRO A 126 -20.917 -12.396 -1.960 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -22.925 -14.052 -0.991 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -23.074 -13.288 -2.562 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -22.205 -16.094 -1.896 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -23.277 -15.547 -3.170 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -20.672 -16.166 -3.666 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -21.507 -14.926 -4.579 1.00 0.00 H new ATOM 1829 N SER A 127 -20.428 -12.841 0.393 1.00 0.00 N ATOM 1830 CA SER A 127 -19.894 -13.039 1.736 1.00 0.00 C ATOM 1831 C SER A 127 -20.750 -14.028 2.521 1.00 0.00 C ATOM 1832 O SER A 127 -21.603 -13.634 3.316 1.00 0.00 O ATOM 1833 CB SER A 127 -19.824 -11.705 2.481 1.00 0.00 C ATOM 1834 OG SER A 127 -18.772 -11.705 3.430 1.00 0.00 O ATOM 0 H SER A 127 -20.786 -11.903 0.215 1.00 0.00 H new ATOM 0 HA SER A 127 -18.888 -13.449 1.644 1.00 0.00 H new ATOM 0 HB2 SER A 127 -19.675 -10.894 1.768 1.00 0.00 H new ATOM 0 HB3 SER A 127 -20.772 -11.516 2.985 1.00 0.00 H new ATOM 0 HG SER A 127 -18.748 -10.841 3.891 1.00 0.00 H new ATOM 1840 N SER A 128 -20.516 -15.316 2.291 1.00 0.00 N ATOM 1841 CA SER A 128 -21.268 -16.364 2.972 1.00 0.00 C ATOM 1842 C SER A 128 -20.939 -16.386 4.462 1.00 0.00 C ATOM 1843 O SER A 128 -20.049 -15.673 4.924 1.00 0.00 O ATOM 1844 CB SER A 128 -20.962 -17.728 2.351 1.00 0.00 C ATOM 1845 OG SER A 128 -21.832 -18.725 2.855 1.00 0.00 O ATOM 0 H SER A 128 -19.811 -15.659 1.638 1.00 0.00 H new ATOM 0 HA SER A 128 -22.330 -16.150 2.854 1.00 0.00 H new ATOM 0 HB2 SER A 128 -21.062 -17.668 1.267 1.00 0.00 H new ATOM 0 HB3 SER A 128 -19.928 -18.003 2.561 1.00 0.00 H new ATOM 0 HG SER A 128 -21.617 -19.587 2.441 1.00 0.00 H new ATOM 1851 N GLY A 129 -21.666 -17.211 5.210 1.00 0.00 N ATOM 1852 CA GLY A 129 -21.438 -17.312 6.640 1.00 0.00 C ATOM 1853 C GLY A 129 -21.950 -18.617 7.218 1.00 0.00 C ATOM 1854 O GLY A 129 -22.719 -19.329 6.573 1.00 0.00 O ATOM 0 H GLY A 129 -22.409 -17.811 4.851 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -20.371 -17.223 6.842 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -21.928 -16.478 7.143 1.00 0.00 H new TER 1858 GLY A 129