USER MOD reduce.3.24.130724 H: found=0, std=0, add=894, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 890 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 45 ASN :FLIP amide:sc= -1.67! C(o=-3.6!,f=-2.7!) USER MOD Set 1.2: A 50 LYS NZ :NH3+ 151:sc= -0.98 (180deg=0) USER MOD Set 2.1: A 37 GLN : amide:sc= -4.23! C(o=-4.3!,f=-4.9!) USER MOD Set 2.2: A 38 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= -0.0449 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= -0.0705 USER MOD Single : A 9 ASN : amide:sc= -4.04! C(o=-4!,f=-3.7!) USER MOD Single : A 11 SER OG : rot 180:sc= -0.338 USER MOD Single : A 12 HIS : no HD1:sc= -0.0729 X(o=-0.073,f=-0.23) USER MOD Single : A 26 ASN : amide:sc= -0.376 X(o=-0.38,f=-0.21) USER MOD Single : A 28 SER OG : rot 180:sc= -0.129 USER MOD Single : A 32 SER OG : rot 77:sc= 0.277 USER MOD Single : A 41 LYS NZ :NH3+ -112:sc= -1.18 (180deg=-3.45!) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -139:sc= 1.3 (180deg=-0.867) USER MOD Single : A 56 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 61 SER OG : rot 111:sc= 0.372 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot -63:sc= 0.486 USER MOD Single : A 67 ASN :FLIP amide:sc= 1.02 F(o=-0.23,f=1) USER MOD Single : A 70 LYS NZ :NH3+ -127:sc= 0.00919 (180deg=-3.39) USER MOD Single : A 71 THR OG1 : rot 161:sc= 0.499 USER MOD Single : A 74 LYS NZ :NH3+ 179:sc= -2.66! (180deg=-2.73!) USER MOD Single : A 79 SER OG : rot -53:sc= -0.217 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 87 SER OG : rot -160:sc= -2.53! USER MOD Single : A 88 HIS : no HD1:sc= -14.5! C(o=-15!,f=-20!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ -117:sc= -0.0557 (180deg=-1.32) USER MOD Single : A 97 ASN :FLIP amide:sc= -3.69 F(o=-5!,f=-3.7) USER MOD Single : A 100 ASN : amide:sc= -7.14! C(o=-7.1!,f=-9.4!) USER MOD Single : A 107 GLN : amide:sc= -5.39 K(o=-5.4,f=-9.1!) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 17.559 -36.354 -15.759 1.00 0.00 N ATOM 2 CA GLY A 1 16.187 -35.911 -15.921 1.00 0.00 C ATOM 3 C GLY A 1 15.392 -35.999 -14.633 1.00 0.00 C ATOM 4 O GLY A 1 14.754 -37.015 -14.358 1.00 0.00 O ATOM 0 H1 GLY A 1 18.059 -36.274 -16.667 1.00 0.00 H new ATOM 0 H2 GLY A 1 18.034 -35.761 -15.049 1.00 0.00 H new ATOM 0 H3 GLY A 1 17.569 -37.345 -15.444 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.181 -34.881 -16.278 1.00 0.00 H new ATOM 0 HA3 GLY A 1 15.701 -36.517 -16.686 1.00 0.00 H new ATOM 8 N SER A 2 15.432 -34.933 -13.841 1.00 0.00 N ATOM 9 CA SER A 2 14.715 -34.896 -12.572 1.00 0.00 C ATOM 10 C SER A 2 13.538 -33.928 -12.641 1.00 0.00 C ATOM 11 O SER A 2 13.318 -33.272 -13.659 1.00 0.00 O ATOM 12 CB SER A 2 15.659 -34.488 -11.440 1.00 0.00 C ATOM 13 OG SER A 2 15.062 -34.706 -10.173 1.00 0.00 O ATOM 0 H SER A 2 15.953 -34.083 -14.056 1.00 0.00 H new ATOM 0 HA SER A 2 14.330 -35.896 -12.372 1.00 0.00 H new ATOM 0 HB2 SER A 2 16.585 -35.058 -11.512 1.00 0.00 H new ATOM 0 HB3 SER A 2 15.923 -33.436 -11.544 1.00 0.00 H new ATOM 0 HG SER A 2 15.687 -34.439 -9.467 1.00 0.00 H new ATOM 19 N SER A 3 12.783 -33.845 -11.550 1.00 0.00 N ATOM 20 CA SER A 3 11.625 -32.960 -11.487 1.00 0.00 C ATOM 21 C SER A 3 11.317 -32.571 -10.044 1.00 0.00 C ATOM 22 O SER A 3 11.760 -33.229 -9.104 1.00 0.00 O ATOM 23 CB SER A 3 10.406 -33.636 -12.117 1.00 0.00 C ATOM 24 OG SER A 3 10.196 -34.925 -11.566 1.00 0.00 O ATOM 0 H SER A 3 12.952 -34.380 -10.698 1.00 0.00 H new ATOM 0 HA SER A 3 11.859 -32.054 -12.047 1.00 0.00 H new ATOM 0 HB2 SER A 3 9.521 -33.020 -11.957 1.00 0.00 H new ATOM 0 HB3 SER A 3 10.547 -33.716 -13.195 1.00 0.00 H new ATOM 0 HG SER A 3 9.410 -35.335 -11.984 1.00 0.00 H new ATOM 30 N GLY A 4 10.553 -31.496 -9.878 1.00 0.00 N ATOM 31 CA GLY A 4 10.198 -31.037 -8.548 1.00 0.00 C ATOM 32 C GLY A 4 8.731 -30.673 -8.433 1.00 0.00 C ATOM 33 O GLY A 4 7.954 -30.896 -9.362 1.00 0.00 O ATOM 0 H GLY A 4 10.174 -30.935 -10.641 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.434 -31.816 -7.823 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.806 -30.169 -8.292 1.00 0.00 H new ATOM 37 N SER A 5 8.349 -30.113 -7.290 1.00 0.00 N ATOM 38 CA SER A 5 6.964 -29.723 -7.054 1.00 0.00 C ATOM 39 C SER A 5 6.891 -28.506 -6.137 1.00 0.00 C ATOM 40 O SER A 5 7.855 -28.178 -5.445 1.00 0.00 O ATOM 41 CB SER A 5 6.182 -30.886 -6.441 1.00 0.00 C ATOM 42 OG SER A 5 6.860 -31.420 -5.317 1.00 0.00 O ATOM 0 H SER A 5 8.980 -29.919 -6.512 1.00 0.00 H new ATOM 0 HA SER A 5 6.518 -29.460 -8.013 1.00 0.00 H new ATOM 0 HB2 SER A 5 5.190 -30.545 -6.143 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.039 -31.667 -7.188 1.00 0.00 H new ATOM 0 HG SER A 5 6.339 -32.161 -4.942 1.00 0.00 H new ATOM 48 N SER A 6 5.740 -27.841 -6.137 1.00 0.00 N ATOM 49 CA SER A 6 5.541 -26.658 -5.308 1.00 0.00 C ATOM 50 C SER A 6 4.525 -26.933 -4.204 1.00 0.00 C ATOM 51 O SER A 6 4.885 -27.096 -3.039 1.00 0.00 O ATOM 52 CB SER A 6 5.072 -25.481 -6.166 1.00 0.00 C ATOM 53 OG SER A 6 4.367 -24.531 -5.386 1.00 0.00 O ATOM 0 H SER A 6 4.931 -28.101 -6.702 1.00 0.00 H new ATOM 0 HA SER A 6 6.495 -26.404 -4.845 1.00 0.00 H new ATOM 0 HB2 SER A 6 5.932 -25.004 -6.636 1.00 0.00 H new ATOM 0 HB3 SER A 6 4.431 -25.845 -6.969 1.00 0.00 H new ATOM 0 HG SER A 6 4.079 -23.788 -5.957 1.00 0.00 H new ATOM 59 N GLY A 7 3.250 -26.984 -4.580 1.00 0.00 N ATOM 60 CA GLY A 7 2.200 -27.239 -3.611 1.00 0.00 C ATOM 61 C GLY A 7 1.220 -26.089 -3.502 1.00 0.00 C ATOM 62 O GLY A 7 1.582 -24.921 -3.643 1.00 0.00 O ATOM 0 H GLY A 7 2.926 -26.853 -5.538 1.00 0.00 H new ATOM 0 HA2 GLY A 7 1.663 -28.145 -3.892 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.648 -27.424 -2.635 1.00 0.00 H new ATOM 66 N PRO A 8 -0.056 -26.416 -3.247 1.00 0.00 N ATOM 67 CA PRO A 8 -1.119 -25.414 -3.115 1.00 0.00 C ATOM 68 C PRO A 8 -0.976 -24.581 -1.846 1.00 0.00 C ATOM 69 O PRO A 8 0.083 -24.564 -1.220 1.00 0.00 O ATOM 70 CB PRO A 8 -2.395 -26.257 -3.061 1.00 0.00 C ATOM 71 CG PRO A 8 -1.953 -27.582 -2.542 1.00 0.00 C ATOM 72 CD PRO A 8 -0.559 -27.788 -3.067 1.00 0.00 C ATOM 0 HA PRO A 8 -1.103 -24.692 -3.931 1.00 0.00 H new ATOM 0 HB2 PRO A 8 -3.141 -25.805 -2.407 1.00 0.00 H new ATOM 0 HB3 PRO A 8 -2.850 -26.350 -4.047 1.00 0.00 H new ATOM 0 HG2 PRO A 8 -1.966 -27.598 -1.452 1.00 0.00 H new ATOM 0 HG3 PRO A 8 -2.619 -28.376 -2.881 1.00 0.00 H new ATOM 0 HD2 PRO A 8 0.055 -28.352 -2.365 1.00 0.00 H new ATOM 0 HD3 PRO A 8 -0.561 -28.342 -4.006 1.00 0.00 H new ATOM 80 N ASN A 9 -2.049 -23.892 -1.472 1.00 0.00 N ATOM 81 CA ASN A 9 -2.042 -23.056 -0.277 1.00 0.00 C ATOM 82 C ASN A 9 -3.465 -22.765 0.191 1.00 0.00 C ATOM 83 O ASN A 9 -4.435 -23.112 -0.483 1.00 0.00 O ATOM 84 CB ASN A 9 -1.305 -21.744 -0.551 1.00 0.00 C ATOM 85 CG ASN A 9 0.038 -21.964 -1.220 1.00 0.00 C ATOM 86 OD1 ASN A 9 0.168 -21.826 -2.436 1.00 0.00 O ATOM 87 ND2 ASN A 9 1.045 -22.309 -0.426 1.00 0.00 N ATOM 0 H ASN A 9 -2.934 -23.896 -1.979 1.00 0.00 H new ATOM 0 HA ASN A 9 -1.522 -23.598 0.513 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -1.924 -21.108 -1.185 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -1.157 -21.211 0.388 1.00 0.00 H new ATOM 0 HD21 ASN A 9 1.972 -22.471 -0.819 1.00 0.00 H new ATOM 0 HD22 ASN A 9 0.891 -22.412 0.577 1.00 0.00 H new ATOM 94 N PHE A 10 -3.581 -22.125 1.350 1.00 0.00 N ATOM 95 CA PHE A 10 -4.885 -21.787 1.909 1.00 0.00 C ATOM 96 C PHE A 10 -5.418 -20.493 1.302 1.00 0.00 C ATOM 97 O PHE A 10 -6.318 -20.514 0.462 1.00 0.00 O ATOM 98 CB PHE A 10 -4.791 -21.649 3.430 1.00 0.00 C ATOM 99 CG PHE A 10 -5.015 -22.940 4.165 1.00 0.00 C ATOM 100 CD1 PHE A 10 -6.268 -23.532 4.186 1.00 0.00 C ATOM 101 CD2 PHE A 10 -3.974 -23.562 4.834 1.00 0.00 C ATOM 102 CE1 PHE A 10 -6.478 -24.720 4.860 1.00 0.00 C ATOM 103 CE2 PHE A 10 -4.177 -24.750 5.510 1.00 0.00 C ATOM 104 CZ PHE A 10 -5.431 -25.329 5.524 1.00 0.00 C ATOM 0 H PHE A 10 -2.788 -21.830 1.920 1.00 0.00 H new ATOM 0 HA PHE A 10 -5.577 -22.594 1.666 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -3.808 -21.258 3.691 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -5.525 -20.917 3.766 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -7.090 -23.059 3.669 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -2.992 -23.113 4.827 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -7.459 -25.172 4.868 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -3.356 -25.225 6.027 1.00 0.00 H new ATOM 0 HZ PHE A 10 -5.593 -26.256 6.053 1.00 0.00 H new ATOM 114 N SER A 11 -4.856 -19.368 1.733 1.00 0.00 N ATOM 115 CA SER A 11 -5.278 -18.064 1.236 1.00 0.00 C ATOM 116 C SER A 11 -5.671 -18.145 -0.236 1.00 0.00 C ATOM 117 O SER A 11 -5.160 -18.981 -0.983 1.00 0.00 O ATOM 118 CB SER A 11 -4.158 -17.038 1.420 1.00 0.00 C ATOM 119 OG SER A 11 -4.685 -15.746 1.666 1.00 0.00 O ATOM 0 H SER A 11 -4.108 -19.334 2.425 1.00 0.00 H new ATOM 0 HA SER A 11 -6.149 -17.748 1.810 1.00 0.00 H new ATOM 0 HB2 SER A 11 -3.519 -17.338 2.251 1.00 0.00 H new ATOM 0 HB3 SER A 11 -3.532 -17.015 0.528 1.00 0.00 H new ATOM 0 HG SER A 11 -3.949 -15.109 1.781 1.00 0.00 H new ATOM 125 N HIS A 12 -6.584 -17.270 -0.647 1.00 0.00 N ATOM 126 CA HIS A 12 -7.047 -17.242 -2.030 1.00 0.00 C ATOM 127 C HIS A 12 -7.053 -15.815 -2.572 1.00 0.00 C ATOM 128 O HIS A 12 -8.012 -15.069 -2.373 1.00 0.00 O ATOM 129 CB HIS A 12 -8.449 -17.844 -2.133 1.00 0.00 C ATOM 130 CG HIS A 12 -8.754 -18.424 -3.480 1.00 0.00 C ATOM 131 ND1 HIS A 12 -7.907 -19.294 -4.134 1.00 0.00 N ATOM 132 CD2 HIS A 12 -9.821 -18.256 -4.295 1.00 0.00 C ATOM 133 CE1 HIS A 12 -8.439 -19.634 -5.294 1.00 0.00 C ATOM 134 NE2 HIS A 12 -9.601 -19.018 -5.416 1.00 0.00 N ATOM 0 H HIS A 12 -7.017 -16.572 -0.043 1.00 0.00 H new ATOM 0 HA HIS A 12 -6.359 -17.838 -2.630 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -8.557 -18.623 -1.378 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -9.184 -17.073 -1.903 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -10.685 -17.638 -4.100 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -7.999 -20.302 -6.019 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -10.232 -19.096 -6.213 1.00 0.00 H new ATOM 142 N TRP A 13 -5.976 -15.443 -3.255 1.00 0.00 N ATOM 143 CA TRP A 13 -5.857 -14.106 -3.824 1.00 0.00 C ATOM 144 C TRP A 13 -6.364 -14.079 -5.262 1.00 0.00 C ATOM 145 O TRP A 13 -5.741 -14.644 -6.160 1.00 0.00 O ATOM 146 CB TRP A 13 -4.402 -13.636 -3.774 1.00 0.00 C ATOM 147 CG TRP A 13 -3.859 -13.534 -2.381 1.00 0.00 C ATOM 148 CD1 TRP A 13 -3.379 -14.556 -1.612 1.00 0.00 C ATOM 149 CD2 TRP A 13 -3.742 -12.346 -1.591 1.00 0.00 C ATOM 150 NE1 TRP A 13 -2.970 -14.074 -0.392 1.00 0.00 N ATOM 151 CE2 TRP A 13 -3.182 -12.721 -0.354 1.00 0.00 C ATOM 152 CE3 TRP A 13 -4.054 -11.001 -1.809 1.00 0.00 C ATOM 153 CZ2 TRP A 13 -2.930 -11.799 0.658 1.00 0.00 C ATOM 154 CZ3 TRP A 13 -3.804 -10.088 -0.803 1.00 0.00 C ATOM 155 CH2 TRP A 13 -3.245 -10.490 0.418 1.00 0.00 C ATOM 0 H TRP A 13 -5.173 -16.048 -3.428 1.00 0.00 H new ATOM 0 HA TRP A 13 -6.471 -13.429 -3.230 1.00 0.00 H new ATOM 0 HB2 TRP A 13 -3.784 -14.327 -4.347 1.00 0.00 H new ATOM 0 HB3 TRP A 13 -4.325 -12.663 -4.259 1.00 0.00 H new ATOM 0 HD1 TRP A 13 -3.328 -15.591 -1.918 1.00 0.00 H new ATOM 0 HE1 TRP A 13 -2.573 -14.633 0.363 1.00 0.00 H new ATOM 0 HE3 TRP A 13 -4.483 -10.681 -2.747 1.00 0.00 H new ATOM 0 HZ2 TRP A 13 -2.501 -12.107 1.600 1.00 0.00 H new ATOM 0 HZ3 TRP A 13 -4.043 -9.047 -0.960 1.00 0.00 H new ATOM 0 HH2 TRP A 13 -3.059 -9.752 1.184 1.00 0.00 H new ATOM 166 N GLY A 14 -7.498 -13.418 -5.474 1.00 0.00 N ATOM 167 CA GLY A 14 -8.068 -13.331 -6.805 1.00 0.00 C ATOM 168 C GLY A 14 -7.256 -12.441 -7.726 1.00 0.00 C ATOM 169 O GLY A 14 -6.097 -12.127 -7.457 1.00 0.00 O ATOM 0 H GLY A 14 -8.032 -12.941 -4.747 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.133 -14.330 -7.235 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -9.086 -12.946 -6.737 1.00 0.00 H new ATOM 173 N PRO A 15 -7.870 -12.022 -8.843 1.00 0.00 N ATOM 174 CA PRO A 15 -7.214 -11.159 -9.830 1.00 0.00 C ATOM 175 C PRO A 15 -6.990 -9.745 -9.306 1.00 0.00 C ATOM 176 O PRO A 15 -7.765 -9.225 -8.503 1.00 0.00 O ATOM 177 CB PRO A 15 -8.201 -11.146 -11.000 1.00 0.00 C ATOM 178 CG PRO A 15 -9.526 -11.435 -10.382 1.00 0.00 C ATOM 179 CD PRO A 15 -9.251 -12.359 -9.228 1.00 0.00 C ATOM 0 HA PRO A 15 -6.222 -11.524 -10.095 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -8.202 -10.181 -11.506 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -7.940 -11.896 -11.746 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -10.006 -10.518 -10.042 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -10.200 -11.899 -11.102 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -9.949 -12.195 -8.407 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -9.343 -13.405 -9.520 1.00 0.00 H new ATOM 187 N PRO A 16 -5.905 -9.107 -9.769 1.00 0.00 N ATOM 188 CA PRO A 16 -5.555 -7.743 -9.360 1.00 0.00 C ATOM 189 C PRO A 16 -6.524 -6.704 -9.915 1.00 0.00 C ATOM 190 O PRO A 16 -7.368 -7.016 -10.755 1.00 0.00 O ATOM 191 CB PRO A 16 -4.158 -7.543 -9.954 1.00 0.00 C ATOM 192 CG PRO A 16 -4.102 -8.477 -11.113 1.00 0.00 C ATOM 193 CD PRO A 16 -4.938 -9.666 -10.727 1.00 0.00 C ATOM 0 HA PRO A 16 -5.595 -7.619 -8.278 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -4.006 -6.511 -10.270 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -3.381 -7.771 -9.224 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -4.490 -8.003 -12.015 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -3.075 -8.774 -11.325 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -5.437 -10.104 -11.592 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -4.334 -10.452 -10.275 1.00 0.00 H new ATOM 201 N ARG A 17 -6.396 -5.470 -9.439 1.00 0.00 N ATOM 202 CA ARG A 17 -7.262 -4.386 -9.888 1.00 0.00 C ATOM 203 C ARG A 17 -6.493 -3.069 -9.956 1.00 0.00 C ATOM 204 O ARG A 17 -5.870 -2.652 -8.979 1.00 0.00 O ATOM 205 CB ARG A 17 -8.461 -4.240 -8.949 1.00 0.00 C ATOM 206 CG ARG A 17 -8.223 -3.271 -7.802 1.00 0.00 C ATOM 207 CD ARG A 17 -9.288 -3.409 -6.726 1.00 0.00 C ATOM 208 NE ARG A 17 -9.558 -4.807 -6.399 1.00 0.00 N ATOM 209 CZ ARG A 17 -10.657 -5.216 -5.775 1.00 0.00 C ATOM 210 NH1 ARG A 17 -11.583 -4.340 -5.413 1.00 0.00 N ATOM 211 NH2 ARG A 17 -10.831 -6.505 -5.513 1.00 0.00 N ATOM 0 H ARG A 17 -5.702 -5.196 -8.743 1.00 0.00 H new ATOM 0 HA ARG A 17 -7.620 -4.631 -10.888 1.00 0.00 H new ATOM 0 HB2 ARG A 17 -9.323 -3.904 -9.524 1.00 0.00 H new ATOM 0 HB3 ARG A 17 -8.713 -5.219 -8.540 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -7.240 -3.454 -7.368 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -8.219 -2.249 -8.182 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -8.966 -2.882 -5.828 1.00 0.00 H new ATOM 0 HD3 ARG A 17 -10.208 -2.931 -7.063 1.00 0.00 H new ATOM 0 HE ARG A 17 -8.865 -5.507 -6.664 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -11.453 -3.348 -5.613 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -12.426 -4.657 -4.934 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -10.121 -7.182 -5.791 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -11.675 -6.819 -5.034 1.00 0.00 H new ATOM 225 N ILE A 18 -6.542 -2.421 -11.115 1.00 0.00 N ATOM 226 CA ILE A 18 -5.850 -1.153 -11.310 1.00 0.00 C ATOM 227 C ILE A 18 -6.764 0.026 -10.990 1.00 0.00 C ATOM 228 O ILE A 18 -7.898 0.092 -11.463 1.00 0.00 O ATOM 229 CB ILE A 18 -5.333 -1.010 -12.754 1.00 0.00 C ATOM 230 CG1 ILE A 18 -4.089 -1.876 -12.961 1.00 0.00 C ATOM 231 CG2 ILE A 18 -5.029 0.448 -13.065 1.00 0.00 C ATOM 232 CD1 ILE A 18 -3.578 -1.869 -14.384 1.00 0.00 C ATOM 0 H ILE A 18 -7.053 -2.753 -11.933 1.00 0.00 H new ATOM 0 HA ILE A 18 -5.001 -1.148 -10.627 1.00 0.00 H new ATOM 0 HB ILE A 18 -6.109 -1.353 -13.439 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -3.298 -1.526 -12.298 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -4.318 -2.901 -12.671 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -4.665 0.533 -14.089 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -5.937 1.041 -12.952 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -4.268 0.816 -12.377 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -2.695 -2.504 -14.457 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -4.353 -2.247 -15.051 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -3.317 -0.851 -14.672 1.00 0.00 H new ATOM 244 N VAL A 19 -6.260 0.956 -10.185 1.00 0.00 N ATOM 245 CA VAL A 19 -7.029 2.134 -9.804 1.00 0.00 C ATOM 246 C VAL A 19 -6.154 3.383 -9.797 1.00 0.00 C ATOM 247 O VAL A 19 -5.064 3.385 -9.227 1.00 0.00 O ATOM 248 CB VAL A 19 -7.669 1.962 -8.413 1.00 0.00 C ATOM 249 CG1 VAL A 19 -8.553 3.154 -8.080 1.00 0.00 C ATOM 250 CG2 VAL A 19 -8.462 0.665 -8.349 1.00 0.00 C ATOM 0 H VAL A 19 -5.323 0.916 -9.784 1.00 0.00 H new ATOM 0 HA VAL A 19 -7.818 2.250 -10.547 1.00 0.00 H new ATOM 0 HB VAL A 19 -6.873 1.912 -7.670 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -8.996 3.014 -7.094 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -7.953 4.064 -8.082 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -9.344 3.239 -8.825 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.907 0.559 -7.360 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -9.250 0.683 -9.102 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -7.797 -0.178 -8.540 1.00 0.00 H new ATOM 260 N GLU A 20 -6.640 4.443 -10.435 1.00 0.00 N ATOM 261 CA GLU A 20 -5.902 5.699 -10.502 1.00 0.00 C ATOM 262 C GLU A 20 -6.235 6.591 -9.310 1.00 0.00 C ATOM 263 O GLU A 20 -7.386 6.985 -9.119 1.00 0.00 O ATOM 264 CB GLU A 20 -6.218 6.433 -11.807 1.00 0.00 C ATOM 265 CG GLU A 20 -5.311 6.040 -12.961 1.00 0.00 C ATOM 266 CD GLU A 20 -6.007 6.129 -14.306 1.00 0.00 C ATOM 267 OE1 GLU A 20 -6.529 7.215 -14.633 1.00 0.00 O ATOM 268 OE2 GLU A 20 -6.028 5.112 -15.030 1.00 0.00 O ATOM 0 H GLU A 20 -7.541 4.457 -10.913 1.00 0.00 H new ATOM 0 HA GLU A 20 -4.837 5.467 -10.473 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -7.253 6.233 -12.085 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -6.134 7.507 -11.640 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -4.434 6.688 -12.966 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -4.954 5.022 -12.807 1.00 0.00 H new ATOM 275 N ILE A 21 -5.221 6.904 -8.511 1.00 0.00 N ATOM 276 CA ILE A 21 -5.406 7.749 -7.338 1.00 0.00 C ATOM 277 C ILE A 21 -4.569 9.020 -7.439 1.00 0.00 C ATOM 278 O ILE A 21 -3.341 8.965 -7.501 1.00 0.00 O ATOM 279 CB ILE A 21 -5.033 7.004 -6.042 1.00 0.00 C ATOM 280 CG1 ILE A 21 -5.523 5.556 -6.102 1.00 0.00 C ATOM 281 CG2 ILE A 21 -5.619 7.719 -4.834 1.00 0.00 C ATOM 282 CD1 ILE A 21 -5.059 4.713 -4.935 1.00 0.00 C ATOM 0 H ILE A 21 -4.263 6.585 -8.654 1.00 0.00 H new ATOM 0 HA ILE A 21 -6.463 8.014 -7.304 1.00 0.00 H new ATOM 0 HB ILE A 21 -3.948 6.996 -5.943 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -6.613 5.551 -6.133 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -5.175 5.101 -7.029 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -5.347 7.181 -3.926 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -5.226 8.734 -4.786 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -6.705 7.754 -4.924 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -5.443 3.699 -5.043 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -3.969 4.688 -4.915 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -5.429 5.144 -4.005 1.00 0.00 H new ATOM 294 N PHE A 22 -5.243 10.166 -7.453 1.00 0.00 N ATOM 295 CA PHE A 22 -4.562 11.452 -7.545 1.00 0.00 C ATOM 296 C PHE A 22 -4.074 11.909 -6.174 1.00 0.00 C ATOM 297 O PHE A 22 -4.820 11.877 -5.195 1.00 0.00 O ATOM 298 CB PHE A 22 -5.496 12.506 -8.144 1.00 0.00 C ATOM 299 CG PHE A 22 -5.257 12.758 -9.605 1.00 0.00 C ATOM 300 CD1 PHE A 22 -5.722 11.868 -10.560 1.00 0.00 C ATOM 301 CD2 PHE A 22 -4.569 13.885 -10.024 1.00 0.00 C ATOM 302 CE1 PHE A 22 -5.503 12.097 -11.905 1.00 0.00 C ATOM 303 CE2 PHE A 22 -4.348 14.120 -11.368 1.00 0.00 C ATOM 304 CZ PHE A 22 -4.817 13.225 -12.310 1.00 0.00 C ATOM 0 H PHE A 22 -6.260 10.230 -7.402 1.00 0.00 H new ATOM 0 HA PHE A 22 -3.697 11.331 -8.197 1.00 0.00 H new ATOM 0 HB2 PHE A 22 -6.529 12.187 -8.003 1.00 0.00 H new ATOM 0 HB3 PHE A 22 -5.374 13.441 -7.597 1.00 0.00 H new ATOM 0 HD1 PHE A 22 -6.262 10.985 -10.250 1.00 0.00 H new ATOM 0 HD2 PHE A 22 -4.201 14.588 -9.292 1.00 0.00 H new ATOM 0 HE1 PHE A 22 -5.868 11.394 -12.639 1.00 0.00 H new ATOM 0 HE2 PHE A 22 -3.809 15.002 -11.681 1.00 0.00 H new ATOM 0 HZ PHE A 22 -4.648 13.407 -13.361 1.00 0.00 H new ATOM 314 N ARG A 23 -2.815 12.332 -6.111 1.00 0.00 N ATOM 315 CA ARG A 23 -2.226 12.794 -4.860 1.00 0.00 C ATOM 316 C ARG A 23 -2.832 14.128 -4.433 1.00 0.00 C ATOM 317 O ARG A 23 -3.254 14.924 -5.271 1.00 0.00 O ATOM 318 CB ARG A 23 -0.710 12.933 -5.006 1.00 0.00 C ATOM 319 CG ARG A 23 -0.052 11.745 -5.690 1.00 0.00 C ATOM 320 CD ARG A 23 1.402 12.033 -6.030 1.00 0.00 C ATOM 321 NE ARG A 23 2.273 11.898 -4.865 1.00 0.00 N ATOM 322 CZ ARG A 23 2.473 12.868 -3.981 1.00 0.00 C ATOM 323 NH1 ARG A 23 1.868 14.039 -4.127 1.00 0.00 N ATOM 324 NH2 ARG A 23 3.281 12.668 -2.947 1.00 0.00 N ATOM 0 H ARG A 23 -2.184 12.364 -6.912 1.00 0.00 H new ATOM 0 HA ARG A 23 -2.443 12.054 -4.090 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -0.490 13.837 -5.574 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -0.269 13.063 -4.018 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -0.109 10.872 -5.040 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -0.598 11.500 -6.601 1.00 0.00 H new ATOM 0 HD2 ARG A 23 1.734 11.350 -6.812 1.00 0.00 H new ATOM 0 HD3 ARG A 23 1.487 13.043 -6.432 1.00 0.00 H new ATOM 0 HE ARG A 23 2.754 11.010 -4.723 1.00 0.00 H new ATOM 0 HH11 ARG A 23 1.247 14.197 -4.920 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.024 14.782 -3.446 1.00 0.00 H new ATOM 0 HH21 ARG A 23 3.748 11.769 -2.831 1.00 0.00 H new ATOM 0 HH22 ARG A 23 3.434 13.414 -2.268 1.00 0.00 H new ATOM 338 N GLU A 24 -2.870 14.363 -3.125 1.00 0.00 N ATOM 339 CA GLU A 24 -3.425 15.600 -2.589 1.00 0.00 C ATOM 340 C GLU A 24 -2.387 16.346 -1.756 1.00 0.00 C ATOM 341 O GLU A 24 -1.523 15.749 -1.114 1.00 0.00 O ATOM 342 CB GLU A 24 -4.661 15.303 -1.736 1.00 0.00 C ATOM 343 CG GLU A 24 -5.958 15.291 -2.528 1.00 0.00 C ATOM 344 CD GLU A 24 -6.064 16.456 -3.492 1.00 0.00 C ATOM 345 OE1 GLU A 24 -6.581 17.518 -3.086 1.00 0.00 O ATOM 346 OE2 GLU A 24 -5.630 16.306 -4.653 1.00 0.00 O ATOM 0 H GLU A 24 -2.524 13.714 -2.418 1.00 0.00 H new ATOM 0 HA GLU A 24 -3.715 16.232 -3.429 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -4.533 14.336 -1.250 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -4.735 16.050 -0.945 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -6.031 14.356 -3.084 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -6.801 15.318 -1.838 1.00 0.00 H new ATOM 353 N PRO A 25 -2.472 17.685 -1.767 1.00 0.00 N ATOM 354 CA PRO A 25 -1.548 18.542 -1.018 1.00 0.00 C ATOM 355 C PRO A 25 -1.757 18.443 0.489 1.00 0.00 C ATOM 356 O PRO A 25 -1.154 17.602 1.154 1.00 0.00 O ATOM 357 CB PRO A 25 -1.890 19.950 -1.514 1.00 0.00 C ATOM 358 CG PRO A 25 -3.305 19.857 -1.969 1.00 0.00 C ATOM 359 CD PRO A 25 -3.476 18.464 -2.509 1.00 0.00 C ATOM 0 HA PRO A 25 -0.508 18.259 -1.179 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -1.777 20.688 -0.720 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -1.232 20.254 -2.328 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -3.993 20.043 -1.144 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -3.518 20.602 -2.736 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.484 18.087 -2.337 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.300 18.425 -3.584 1.00 0.00 H new ATOM 367 N ASN A 26 -2.615 19.307 1.021 1.00 0.00 N ATOM 368 CA ASN A 26 -2.903 19.316 2.451 1.00 0.00 C ATOM 369 C ASN A 26 -3.121 17.899 2.971 1.00 0.00 C ATOM 370 O ASN A 26 -2.711 17.564 4.083 1.00 0.00 O ATOM 371 CB ASN A 26 -4.138 20.172 2.738 1.00 0.00 C ATOM 372 CG ASN A 26 -4.036 21.557 2.129 1.00 0.00 C ATOM 373 OD1 ASN A 26 -4.974 22.039 1.493 1.00 0.00 O ATOM 374 ND2 ASN A 26 -2.893 22.205 2.321 1.00 0.00 N ATOM 0 H ASN A 26 -3.123 20.010 0.484 1.00 0.00 H new ATOM 0 HA ASN A 26 -2.044 19.745 2.967 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -5.023 19.670 2.347 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.272 20.261 3.816 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -2.766 23.140 1.935 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -2.142 21.767 2.855 1.00 0.00 H new ATOM 381 N VAL A 27 -3.768 17.069 2.159 1.00 0.00 N ATOM 382 CA VAL A 27 -4.039 15.687 2.535 1.00 0.00 C ATOM 383 C VAL A 27 -3.286 14.714 1.634 1.00 0.00 C ATOM 384 O VAL A 27 -3.156 14.940 0.431 1.00 0.00 O ATOM 385 CB VAL A 27 -5.545 15.372 2.467 1.00 0.00 C ATOM 386 CG1 VAL A 27 -6.043 15.449 1.032 1.00 0.00 C ATOM 387 CG2 VAL A 27 -5.830 14.003 3.066 1.00 0.00 C ATOM 0 H VAL A 27 -4.114 17.330 1.236 1.00 0.00 H new ATOM 0 HA VAL A 27 -3.696 15.566 3.562 1.00 0.00 H new ATOM 0 HB VAL A 27 -6.081 16.119 3.053 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -7.109 15.223 1.004 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -5.874 16.453 0.642 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -5.503 14.726 0.420 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -6.899 13.797 3.010 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -5.284 13.241 2.510 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -5.512 13.989 4.109 1.00 0.00 H new ATOM 397 N SER A 28 -2.793 13.630 2.224 1.00 0.00 N ATOM 398 CA SER A 28 -2.050 12.624 1.475 1.00 0.00 C ATOM 399 C SER A 28 -3.000 11.668 0.760 1.00 0.00 C ATOM 400 O SER A 28 -4.214 11.714 0.961 1.00 0.00 O ATOM 401 CB SER A 28 -1.128 11.839 2.411 1.00 0.00 C ATOM 402 OG SER A 28 -0.256 10.995 1.678 1.00 0.00 O ATOM 0 H SER A 28 -2.895 13.426 3.218 1.00 0.00 H new ATOM 0 HA SER A 28 -1.446 13.136 0.726 1.00 0.00 H new ATOM 0 HB2 SER A 28 -0.544 12.532 3.017 1.00 0.00 H new ATOM 0 HB3 SER A 28 -1.726 11.241 3.098 1.00 0.00 H new ATOM 0 HG SER A 28 0.324 10.506 2.298 1.00 0.00 H new ATOM 408 N LEU A 29 -2.438 10.802 -0.076 1.00 0.00 N ATOM 409 CA LEU A 29 -3.234 9.833 -0.823 1.00 0.00 C ATOM 410 C LEU A 29 -4.238 9.135 0.089 1.00 0.00 C ATOM 411 O LEU A 29 -5.232 8.579 -0.376 1.00 0.00 O ATOM 412 CB LEU A 29 -2.323 8.798 -1.485 1.00 0.00 C ATOM 413 CG LEU A 29 -2.035 9.010 -2.972 1.00 0.00 C ATOM 414 CD1 LEU A 29 -1.373 7.778 -3.569 1.00 0.00 C ATOM 415 CD2 LEU A 29 -3.317 9.345 -3.721 1.00 0.00 C ATOM 0 H LEU A 29 -1.435 10.751 -0.254 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.785 10.370 -1.595 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -1.373 8.784 -0.950 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -2.774 7.814 -1.360 1.00 0.00 H new ATOM 0 HG LEU A 29 -1.348 9.851 -3.073 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -1.176 7.948 -4.627 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -0.434 7.583 -3.052 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -2.034 6.919 -3.456 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.093 9.493 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.027 8.525 -3.612 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.750 10.257 -3.311 1.00 0.00 H new ATOM 427 N GLY A 30 -3.972 9.171 1.391 1.00 0.00 N ATOM 428 CA GLY A 30 -4.863 8.540 2.348 1.00 0.00 C ATOM 429 C GLY A 30 -4.566 7.064 2.530 1.00 0.00 C ATOM 430 O GLY A 30 -4.977 6.460 3.521 1.00 0.00 O ATOM 0 H GLY A 30 -3.156 9.626 1.800 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -4.776 9.046 3.309 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -5.894 8.662 2.015 1.00 0.00 H new ATOM 434 N ILE A 31 -3.852 6.483 1.572 1.00 0.00 N ATOM 435 CA ILE A 31 -3.502 5.070 1.632 1.00 0.00 C ATOM 436 C ILE A 31 -2.253 4.848 2.479 1.00 0.00 C ATOM 437 O ILE A 31 -1.367 5.701 2.532 1.00 0.00 O ATOM 438 CB ILE A 31 -3.264 4.488 0.226 1.00 0.00 C ATOM 439 CG1 ILE A 31 -4.323 5.007 -0.750 1.00 0.00 C ATOM 440 CG2 ILE A 31 -3.278 2.968 0.272 1.00 0.00 C ATOM 441 CD1 ILE A 31 -3.928 4.863 -2.203 1.00 0.00 C ATOM 0 H ILE A 31 -3.505 6.969 0.745 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.346 4.556 2.091 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.284 4.812 -0.124 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -5.256 4.470 -0.581 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.517 6.058 -0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.108 2.572 -0.729 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -2.491 2.617 0.939 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -4.245 2.624 0.639 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.725 5.251 -2.837 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.012 5.424 -2.388 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -3.762 3.810 -2.432 1.00 0.00 H new ATOM 453 N SER A 32 -2.190 3.696 3.140 1.00 0.00 N ATOM 454 CA SER A 32 -1.051 3.363 3.987 1.00 0.00 C ATOM 455 C SER A 32 -0.502 1.982 3.640 1.00 0.00 C ATOM 456 O SER A 32 -1.105 1.239 2.865 1.00 0.00 O ATOM 457 CB SER A 32 -1.454 3.408 5.462 1.00 0.00 C ATOM 458 OG SER A 32 -2.126 4.617 5.770 1.00 0.00 O ATOM 0 H SER A 32 -2.914 2.978 3.105 1.00 0.00 H new ATOM 0 HA SER A 32 -0.269 4.102 3.809 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.100 2.561 5.692 1.00 0.00 H new ATOM 0 HB3 SER A 32 -0.567 3.312 6.088 1.00 0.00 H new ATOM 0 HG SER A 32 -3.047 4.573 5.439 1.00 0.00 H new ATOM 464 N ILE A 33 0.645 1.646 4.220 1.00 0.00 N ATOM 465 CA ILE A 33 1.275 0.354 3.974 1.00 0.00 C ATOM 466 C ILE A 33 1.829 -0.242 5.263 1.00 0.00 C ATOM 467 O ILE A 33 2.253 0.483 6.163 1.00 0.00 O ATOM 468 CB ILE A 33 2.415 0.471 2.945 1.00 0.00 C ATOM 469 CG1 ILE A 33 3.294 1.684 3.260 1.00 0.00 C ATOM 470 CG2 ILE A 33 1.849 0.571 1.536 1.00 0.00 C ATOM 471 CD1 ILE A 33 4.721 1.537 2.780 1.00 0.00 C ATOM 0 H ILE A 33 1.157 2.250 4.863 1.00 0.00 H new ATOM 0 HA ILE A 33 0.502 -0.303 3.576 1.00 0.00 H new ATOM 0 HB ILE A 33 3.032 -0.426 3.005 1.00 0.00 H new ATOM 0 HG12 ILE A 33 2.854 2.570 2.802 1.00 0.00 H new ATOM 0 HG13 ILE A 33 3.297 1.851 4.337 1.00 0.00 H new ATOM 0 HG21 ILE A 33 2.667 0.653 0.820 1.00 0.00 H new ATOM 0 HG22 ILE A 33 1.262 -0.321 1.316 1.00 0.00 H new ATOM 0 HG23 ILE A 33 1.212 1.452 1.462 1.00 0.00 H new ATOM 0 HD11 ILE A 33 5.286 2.433 3.037 1.00 0.00 H new ATOM 0 HD12 ILE A 33 5.178 0.671 3.258 1.00 0.00 H new ATOM 0 HD13 ILE A 33 4.729 1.401 1.699 1.00 0.00 H new ATOM 483 N VAL A 34 1.823 -1.569 5.345 1.00 0.00 N ATOM 484 CA VAL A 34 2.327 -2.264 6.524 1.00 0.00 C ATOM 485 C VAL A 34 3.675 -2.918 6.241 1.00 0.00 C ATOM 486 O VAL A 34 4.117 -2.984 5.095 1.00 0.00 O ATOM 487 CB VAL A 34 1.337 -3.341 7.006 1.00 0.00 C ATOM 488 CG1 VAL A 34 -0.095 -2.923 6.707 1.00 0.00 C ATOM 489 CG2 VAL A 34 1.655 -4.683 6.364 1.00 0.00 C ATOM 0 H VAL A 34 1.475 -2.184 4.609 1.00 0.00 H new ATOM 0 HA VAL A 34 2.447 -1.515 7.307 1.00 0.00 H new ATOM 0 HB VAL A 34 1.441 -3.447 8.086 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.780 -3.696 7.055 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -0.315 -1.986 7.219 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -0.217 -2.786 5.633 1.00 0.00 H new ATOM 0 HG21 VAL A 34 0.946 -5.432 6.716 1.00 0.00 H new ATOM 0 HG22 VAL A 34 1.581 -4.594 5.280 1.00 0.00 H new ATOM 0 HG23 VAL A 34 2.666 -4.986 6.635 1.00 0.00 H new ATOM 499 N GLY A 35 4.324 -3.403 7.295 1.00 0.00 N ATOM 500 CA GLY A 35 5.615 -4.047 7.140 1.00 0.00 C ATOM 501 C GLY A 35 6.449 -3.416 6.043 1.00 0.00 C ATOM 502 O GLY A 35 6.436 -2.198 5.866 1.00 0.00 O ATOM 0 H GLY A 35 3.979 -3.361 8.254 1.00 0.00 H new ATOM 0 HA2 GLY A 35 6.160 -3.994 8.083 1.00 0.00 H new ATOM 0 HA3 GLY A 35 5.466 -5.104 6.917 1.00 0.00 H new ATOM 506 N GLY A 36 7.179 -4.246 5.304 1.00 0.00 N ATOM 507 CA GLY A 36 8.014 -3.744 4.229 1.00 0.00 C ATOM 508 C GLY A 36 9.490 -3.974 4.485 1.00 0.00 C ATOM 509 O GLY A 36 10.209 -3.054 4.874 1.00 0.00 O ATOM 0 H GLY A 36 7.207 -5.258 5.431 1.00 0.00 H new ATOM 0 HA2 GLY A 36 7.730 -4.230 3.296 1.00 0.00 H new ATOM 0 HA3 GLY A 36 7.833 -2.677 4.100 1.00 0.00 H new ATOM 513 N GLN A 37 9.942 -5.205 4.269 1.00 0.00 N ATOM 514 CA GLN A 37 11.342 -5.553 4.482 1.00 0.00 C ATOM 515 C GLN A 37 11.983 -6.045 3.188 1.00 0.00 C ATOM 516 O GLN A 37 11.293 -6.340 2.213 1.00 0.00 O ATOM 517 CB GLN A 37 11.464 -6.626 5.565 1.00 0.00 C ATOM 518 CG GLN A 37 12.782 -6.580 6.321 1.00 0.00 C ATOM 519 CD GLN A 37 13.857 -7.428 5.669 1.00 0.00 C ATOM 520 OE1 GLN A 37 13.576 -8.493 5.119 1.00 0.00 O ATOM 521 NE2 GLN A 37 15.098 -6.958 5.728 1.00 0.00 N ATOM 0 H GLN A 37 9.359 -5.978 3.947 1.00 0.00 H new ATOM 0 HA GLN A 37 11.868 -4.656 4.809 1.00 0.00 H new ATOM 0 HB2 GLN A 37 10.644 -6.510 6.274 1.00 0.00 H new ATOM 0 HB3 GLN A 37 11.352 -7.608 5.106 1.00 0.00 H new ATOM 0 HG2 GLN A 37 13.126 -5.547 6.382 1.00 0.00 H new ATOM 0 HG3 GLN A 37 12.623 -6.924 7.343 1.00 0.00 H new ATOM 0 HE21 GLN A 37 15.286 -6.070 6.194 1.00 0.00 H new ATOM 0 HE22 GLN A 37 15.863 -7.485 5.307 1.00 0.00 H new ATOM 530 N THR A 38 13.310 -6.130 3.187 1.00 0.00 N ATOM 531 CA THR A 38 14.045 -6.585 2.014 1.00 0.00 C ATOM 532 C THR A 38 14.007 -8.104 1.895 1.00 0.00 C ATOM 533 O THR A 38 13.398 -8.786 2.719 1.00 0.00 O ATOM 534 CB THR A 38 15.514 -6.121 2.056 1.00 0.00 C ATOM 535 OG1 THR A 38 16.207 -6.788 3.117 1.00 0.00 O ATOM 536 CG2 THR A 38 15.600 -4.615 2.255 1.00 0.00 C ATOM 0 H THR A 38 13.897 -5.890 3.986 1.00 0.00 H new ATOM 0 HA THR A 38 13.557 -6.143 1.145 1.00 0.00 H new ATOM 0 HB THR A 38 15.980 -6.373 1.103 1.00 0.00 H new ATOM 0 HG1 THR A 38 17.140 -6.489 3.137 1.00 0.00 H new ATOM 0 HG21 THR A 38 16.646 -4.311 2.281 1.00 0.00 H new ATOM 0 HG22 THR A 38 15.096 -4.110 1.431 1.00 0.00 H new ATOM 0 HG23 THR A 38 15.120 -4.344 3.195 1.00 0.00 H new ATOM 544 N VAL A 39 14.663 -8.629 0.865 1.00 0.00 N ATOM 545 CA VAL A 39 14.705 -10.069 0.640 1.00 0.00 C ATOM 546 C VAL A 39 16.046 -10.495 0.053 1.00 0.00 C ATOM 547 O VAL A 39 16.537 -9.891 -0.902 1.00 0.00 O ATOM 548 CB VAL A 39 13.577 -10.523 -0.305 1.00 0.00 C ATOM 549 CG1 VAL A 39 12.370 -9.606 -0.175 1.00 0.00 C ATOM 550 CG2 VAL A 39 14.072 -10.567 -1.743 1.00 0.00 C ATOM 0 H VAL A 39 15.172 -8.079 0.173 1.00 0.00 H new ATOM 0 HA VAL A 39 14.569 -10.545 1.611 1.00 0.00 H new ATOM 0 HB VAL A 39 13.271 -11.529 -0.020 1.00 0.00 H new ATOM 0 HG11 VAL A 39 11.583 -9.942 -0.850 1.00 0.00 H new ATOM 0 HG12 VAL A 39 12.003 -9.631 0.851 1.00 0.00 H new ATOM 0 HG13 VAL A 39 12.658 -8.587 -0.433 1.00 0.00 H new ATOM 0 HG21 VAL A 39 13.262 -10.890 -2.397 1.00 0.00 H new ATOM 0 HG22 VAL A 39 14.407 -9.574 -2.043 1.00 0.00 H new ATOM 0 HG23 VAL A 39 14.902 -11.269 -1.821 1.00 0.00 H new ATOM 560 N ILE A 40 16.635 -11.537 0.630 1.00 0.00 N ATOM 561 CA ILE A 40 17.919 -12.044 0.162 1.00 0.00 C ATOM 562 C ILE A 40 17.731 -13.173 -0.845 1.00 0.00 C ATOM 563 O ILE A 40 16.645 -13.742 -0.961 1.00 0.00 O ATOM 564 CB ILE A 40 18.783 -12.553 1.332 1.00 0.00 C ATOM 565 CG1 ILE A 40 18.916 -11.470 2.405 1.00 0.00 C ATOM 566 CG2 ILE A 40 20.153 -12.982 0.830 1.00 0.00 C ATOM 567 CD1 ILE A 40 19.371 -12.002 3.746 1.00 0.00 C ATOM 0 H ILE A 40 16.244 -12.047 1.422 1.00 0.00 H new ATOM 0 HA ILE A 40 18.430 -11.211 -0.321 1.00 0.00 H new ATOM 0 HB ILE A 40 18.294 -13.419 1.777 1.00 0.00 H new ATOM 0 HG12 ILE A 40 19.625 -10.716 2.063 1.00 0.00 H new ATOM 0 HG13 ILE A 40 17.955 -10.972 2.528 1.00 0.00 H new ATOM 0 HG21 ILE A 40 20.752 -13.339 1.668 1.00 0.00 H new ATOM 0 HG22 ILE A 40 20.038 -13.782 0.099 1.00 0.00 H new ATOM 0 HG23 ILE A 40 20.652 -12.133 0.363 1.00 0.00 H new ATOM 0 HD11 ILE A 40 19.443 -11.180 4.458 1.00 0.00 H new ATOM 0 HD12 ILE A 40 18.651 -12.735 4.110 1.00 0.00 H new ATOM 0 HD13 ILE A 40 20.347 -12.475 3.638 1.00 0.00 H new ATOM 579 N LYS A 41 18.796 -13.494 -1.571 1.00 0.00 N ATOM 580 CA LYS A 41 18.751 -14.558 -2.567 1.00 0.00 C ATOM 581 C LYS A 41 18.974 -15.920 -1.919 1.00 0.00 C ATOM 582 O LYS A 41 20.104 -16.402 -1.838 1.00 0.00 O ATOM 583 CB LYS A 41 19.807 -14.317 -3.649 1.00 0.00 C ATOM 584 CG LYS A 41 19.327 -13.422 -4.779 1.00 0.00 C ATOM 585 CD LYS A 41 18.422 -14.175 -5.740 1.00 0.00 C ATOM 586 CE LYS A 41 19.211 -15.154 -6.596 1.00 0.00 C ATOM 587 NZ LYS A 41 19.359 -16.478 -5.931 1.00 0.00 N ATOM 0 H LYS A 41 19.702 -13.032 -1.488 1.00 0.00 H new ATOM 0 HA LYS A 41 17.762 -14.551 -3.025 1.00 0.00 H new ATOM 0 HB2 LYS A 41 20.689 -13.868 -3.191 1.00 0.00 H new ATOM 0 HB3 LYS A 41 20.116 -15.277 -4.063 1.00 0.00 H new ATOM 0 HG2 LYS A 41 18.790 -12.568 -4.365 1.00 0.00 H new ATOM 0 HG3 LYS A 41 20.186 -13.026 -5.321 1.00 0.00 H new ATOM 0 HD2 LYS A 41 17.660 -14.714 -5.177 1.00 0.00 H new ATOM 0 HD3 LYS A 41 17.901 -13.465 -6.383 1.00 0.00 H new ATOM 0 HE2 LYS A 41 18.710 -15.283 -7.555 1.00 0.00 H new ATOM 0 HE3 LYS A 41 20.198 -14.740 -6.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 20.356 -16.629 -5.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 18.774 -16.502 -5.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 19.051 -17.229 -6.581 1.00 0.00 H new ATOM 601 N ARG A 42 17.890 -16.537 -1.461 1.00 0.00 N ATOM 602 CA ARG A 42 17.968 -17.845 -0.821 1.00 0.00 C ATOM 603 C ARG A 42 17.150 -18.877 -1.591 1.00 0.00 C ATOM 604 O ARG A 42 17.445 -20.072 -1.554 1.00 0.00 O ATOM 605 CB ARG A 42 17.471 -17.759 0.624 1.00 0.00 C ATOM 606 CG ARG A 42 17.722 -19.023 1.430 1.00 0.00 C ATOM 607 CD ARG A 42 19.107 -19.016 2.058 1.00 0.00 C ATOM 608 NE ARG A 42 19.152 -18.214 3.278 1.00 0.00 N ATOM 609 CZ ARG A 42 20.274 -17.730 3.798 1.00 0.00 C ATOM 610 NH1 ARG A 42 21.437 -17.964 3.209 1.00 0.00 N ATOM 611 NH2 ARG A 42 20.233 -17.008 4.911 1.00 0.00 N ATOM 0 H ARG A 42 16.947 -16.152 -1.521 1.00 0.00 H new ATOM 0 HA ARG A 42 19.011 -18.161 -0.822 1.00 0.00 H new ATOM 0 HB2 ARG A 42 17.960 -16.920 1.118 1.00 0.00 H new ATOM 0 HB3 ARG A 42 16.402 -17.547 0.620 1.00 0.00 H new ATOM 0 HG2 ARG A 42 16.967 -19.114 2.211 1.00 0.00 H new ATOM 0 HG3 ARG A 42 17.618 -19.895 0.784 1.00 0.00 H new ATOM 0 HD2 ARG A 42 19.407 -20.039 2.286 1.00 0.00 H new ATOM 0 HD3 ARG A 42 19.828 -18.625 1.340 1.00 0.00 H new ATOM 0 HE ARG A 42 18.274 -18.015 3.757 1.00 0.00 H new ATOM 0 HH11 ARG A 42 21.473 -18.518 2.353 1.00 0.00 H new ATOM 0 HH12 ARG A 42 22.297 -17.591 3.611 1.00 0.00 H new ATOM 0 HH21 ARG A 42 19.339 -16.825 5.367 1.00 0.00 H new ATOM 0 HH22 ARG A 42 21.095 -16.637 5.310 1.00 0.00 H new ATOM 625 N LEU A 43 16.120 -18.408 -2.287 1.00 0.00 N ATOM 626 CA LEU A 43 15.258 -19.290 -3.066 1.00 0.00 C ATOM 627 C LEU A 43 14.693 -20.408 -2.195 1.00 0.00 C ATOM 628 O LEU A 43 14.756 -21.583 -2.556 1.00 0.00 O ATOM 629 CB LEU A 43 16.034 -19.887 -4.241 1.00 0.00 C ATOM 630 CG LEU A 43 16.716 -18.884 -5.174 1.00 0.00 C ATOM 631 CD1 LEU A 43 17.260 -19.587 -6.408 1.00 0.00 C ATOM 632 CD2 LEU A 43 15.746 -17.781 -5.570 1.00 0.00 C ATOM 0 H LEU A 43 15.862 -17.422 -2.328 1.00 0.00 H new ATOM 0 HA LEU A 43 14.427 -18.698 -3.450 1.00 0.00 H new ATOM 0 HB2 LEU A 43 16.795 -20.559 -3.844 1.00 0.00 H new ATOM 0 HB3 LEU A 43 15.349 -20.495 -4.832 1.00 0.00 H new ATOM 0 HG LEU A 43 17.552 -18.431 -4.641 1.00 0.00 H new ATOM 0 HD11 LEU A 43 17.741 -18.858 -7.060 1.00 0.00 H new ATOM 0 HD12 LEU A 43 17.988 -20.340 -6.106 1.00 0.00 H new ATOM 0 HD13 LEU A 43 16.441 -20.067 -6.944 1.00 0.00 H new ATOM 0 HD21 LEU A 43 16.247 -17.076 -6.234 1.00 0.00 H new ATOM 0 HD22 LEU A 43 14.889 -18.217 -6.084 1.00 0.00 H new ATOM 0 HD23 LEU A 43 15.405 -17.258 -4.676 1.00 0.00 H new ATOM 644 N LYS A 44 14.140 -20.034 -1.047 1.00 0.00 N ATOM 645 CA LYS A 44 13.560 -21.003 -0.125 1.00 0.00 C ATOM 646 C LYS A 44 12.052 -20.809 -0.008 1.00 0.00 C ATOM 647 O LYS A 44 11.295 -21.777 0.057 1.00 0.00 O ATOM 648 CB LYS A 44 14.209 -20.877 1.256 1.00 0.00 C ATOM 649 CG LYS A 44 14.207 -22.171 2.050 1.00 0.00 C ATOM 650 CD LYS A 44 12.929 -22.329 2.856 1.00 0.00 C ATOM 651 CE LYS A 44 12.961 -23.586 3.711 1.00 0.00 C ATOM 652 NZ LYS A 44 13.583 -23.337 5.041 1.00 0.00 N ATOM 0 H LYS A 44 14.081 -19.066 -0.732 1.00 0.00 H new ATOM 0 HA LYS A 44 13.751 -22.001 -0.520 1.00 0.00 H new ATOM 0 HB2 LYS A 44 15.237 -20.537 1.135 1.00 0.00 H new ATOM 0 HB3 LYS A 44 13.684 -20.110 1.826 1.00 0.00 H new ATOM 0 HG2 LYS A 44 14.316 -23.016 1.370 1.00 0.00 H new ATOM 0 HG3 LYS A 44 15.066 -22.188 2.721 1.00 0.00 H new ATOM 0 HD2 LYS A 44 12.790 -21.457 3.495 1.00 0.00 H new ATOM 0 HD3 LYS A 44 12.074 -22.369 2.181 1.00 0.00 H new ATOM 0 HE2 LYS A 44 11.945 -23.957 3.849 1.00 0.00 H new ATOM 0 HE3 LYS A 44 13.517 -24.365 3.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 13.586 -24.218 5.593 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 14.561 -23.007 4.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 13.038 -22.612 5.549 1.00 0.00 H new ATOM 666 N ASN A 45 11.622 -19.552 0.016 1.00 0.00 N ATOM 667 CA ASN A 45 10.203 -19.231 0.123 1.00 0.00 C ATOM 668 C ASN A 45 9.423 -19.817 -1.049 1.00 0.00 C ATOM 669 O ASN A 45 9.997 -20.162 -2.081 1.00 0.00 O ATOM 670 CB ASN A 45 10.004 -17.715 0.175 1.00 0.00 C ATOM 671 CG ASN A 45 8.670 -17.286 -0.405 1.00 0.00 C ATOM 672 OD1 ASN A 45 8.648 -17.022 -1.706 1.00 0.00 O flip ATOM 673 ND2 ASN A 45 7.671 -17.195 0.309 1.00 0.00 N flip ATOM 0 H ASN A 45 12.235 -18.739 -0.037 1.00 0.00 H new ATOM 0 HA ASN A 45 9.825 -19.672 1.045 1.00 0.00 H new ATOM 0 HB2 ASN A 45 10.073 -17.378 1.209 1.00 0.00 H new ATOM 0 HB3 ASN A 45 10.809 -17.227 -0.374 1.00 0.00 H new ATOM 0 HD21 ASN A 45 7.735 -17.408 1.305 1.00 0.00 H new ATOM 0 HD22 ASN A 45 6.780 -16.907 -0.095 1.00 0.00 H new ATOM 680 N GLY A 46 8.108 -19.927 -0.883 1.00 0.00 N ATOM 681 CA GLY A 46 7.270 -20.471 -1.935 1.00 0.00 C ATOM 682 C GLY A 46 5.908 -20.902 -1.427 1.00 0.00 C ATOM 683 O GLY A 46 4.912 -20.804 -2.143 1.00 0.00 O ATOM 0 H GLY A 46 7.609 -19.649 -0.038 1.00 0.00 H new ATOM 0 HA2 GLY A 46 7.142 -19.723 -2.717 1.00 0.00 H new ATOM 0 HA3 GLY A 46 7.772 -21.325 -2.390 1.00 0.00 H new ATOM 687 N GLU A 47 5.865 -21.382 -0.188 1.00 0.00 N ATOM 688 CA GLU A 47 4.615 -21.832 0.414 1.00 0.00 C ATOM 689 C GLU A 47 3.825 -20.652 0.973 1.00 0.00 C ATOM 690 O GLU A 47 2.807 -20.835 1.640 1.00 0.00 O ATOM 691 CB GLU A 47 4.894 -22.846 1.525 1.00 0.00 C ATOM 692 CG GLU A 47 5.656 -22.263 2.704 1.00 0.00 C ATOM 693 CD GLU A 47 7.159 -22.371 2.537 1.00 0.00 C ATOM 694 OE1 GLU A 47 7.627 -23.407 2.021 1.00 0.00 O ATOM 695 OE2 GLU A 47 7.868 -21.418 2.923 1.00 0.00 O ATOM 0 H GLU A 47 6.681 -21.469 0.418 1.00 0.00 H new ATOM 0 HA GLU A 47 4.019 -22.311 -0.363 1.00 0.00 H new ATOM 0 HB2 GLU A 47 3.947 -23.253 1.880 1.00 0.00 H new ATOM 0 HB3 GLU A 47 5.463 -23.678 1.111 1.00 0.00 H new ATOM 0 HG2 GLU A 47 5.382 -21.215 2.827 1.00 0.00 H new ATOM 0 HG3 GLU A 47 5.357 -22.779 3.616 1.00 0.00 H new ATOM 702 N GLU A 48 4.303 -19.443 0.697 1.00 0.00 N ATOM 703 CA GLU A 48 3.642 -18.234 1.173 1.00 0.00 C ATOM 704 C GLU A 48 3.970 -17.044 0.275 1.00 0.00 C ATOM 705 O GLU A 48 4.773 -17.155 -0.652 1.00 0.00 O ATOM 706 CB GLU A 48 4.062 -17.930 2.613 1.00 0.00 C ATOM 707 CG GLU A 48 3.384 -18.816 3.644 1.00 0.00 C ATOM 708 CD GLU A 48 3.448 -18.237 5.044 1.00 0.00 C ATOM 709 OE1 GLU A 48 3.348 -16.999 5.178 1.00 0.00 O ATOM 710 OE2 GLU A 48 3.597 -19.020 6.005 1.00 0.00 O ATOM 0 H GLU A 48 5.145 -19.275 0.147 1.00 0.00 H new ATOM 0 HA GLU A 48 2.566 -18.404 1.143 1.00 0.00 H new ATOM 0 HB2 GLU A 48 5.142 -18.047 2.700 1.00 0.00 H new ATOM 0 HB3 GLU A 48 3.835 -16.888 2.836 1.00 0.00 H new ATOM 0 HG2 GLU A 48 2.341 -18.962 3.363 1.00 0.00 H new ATOM 0 HG3 GLU A 48 3.856 -19.799 3.639 1.00 0.00 H new ATOM 717 N LEU A 49 3.342 -15.908 0.556 1.00 0.00 N ATOM 718 CA LEU A 49 3.565 -14.697 -0.226 1.00 0.00 C ATOM 719 C LEU A 49 3.798 -13.495 0.685 1.00 0.00 C ATOM 720 O LEU A 49 3.229 -13.409 1.774 1.00 0.00 O ATOM 721 CB LEU A 49 2.371 -14.431 -1.144 1.00 0.00 C ATOM 722 CG LEU A 49 1.133 -13.830 -0.478 1.00 0.00 C ATOM 723 CD1 LEU A 49 0.716 -14.662 0.724 1.00 0.00 C ATOM 724 CD2 LEU A 49 1.396 -12.388 -0.067 1.00 0.00 C ATOM 0 H LEU A 49 2.674 -15.800 1.319 1.00 0.00 H new ATOM 0 HA LEU A 49 4.457 -14.847 -0.834 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.693 -13.759 -1.940 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.085 -15.371 -1.616 1.00 0.00 H new ATOM 0 HG LEU A 49 0.316 -13.838 -1.199 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.167 -14.219 1.185 1.00 0.00 H new ATOM 0 HD12 LEU A 49 0.486 -15.677 0.401 1.00 0.00 H new ATOM 0 HD13 LEU A 49 1.530 -14.687 1.449 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.504 -11.976 0.405 1.00 0.00 H new ATOM 0 HD22 LEU A 49 2.227 -12.356 0.637 1.00 0.00 H new ATOM 0 HD23 LEU A 49 1.645 -11.798 -0.949 1.00 0.00 H new ATOM 736 N LYS A 50 4.635 -12.569 0.231 1.00 0.00 N ATOM 737 CA LYS A 50 4.941 -11.370 1.003 1.00 0.00 C ATOM 738 C LYS A 50 5.134 -10.167 0.085 1.00 0.00 C ATOM 739 O LYS A 50 4.986 -10.272 -1.132 1.00 0.00 O ATOM 740 CB LYS A 50 6.199 -11.588 1.846 1.00 0.00 C ATOM 741 CG LYS A 50 7.488 -11.513 1.046 1.00 0.00 C ATOM 742 CD LYS A 50 7.763 -12.812 0.307 1.00 0.00 C ATOM 743 CE LYS A 50 9.255 -13.053 0.140 1.00 0.00 C ATOM 744 NZ LYS A 50 9.544 -14.438 -0.324 1.00 0.00 N ATOM 0 H LYS A 50 5.114 -12.625 -0.668 1.00 0.00 H new ATOM 0 HA LYS A 50 4.098 -11.169 1.665 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.229 -10.840 2.639 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.138 -12.563 2.330 1.00 0.00 H new ATOM 0 HG2 LYS A 50 7.426 -10.693 0.331 1.00 0.00 H new ATOM 0 HG3 LYS A 50 8.320 -11.291 1.715 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.318 -13.644 0.853 1.00 0.00 H new ATOM 0 HD3 LYS A 50 7.286 -12.782 -0.673 1.00 0.00 H new ATOM 0 HE2 LYS A 50 9.661 -12.338 -0.576 1.00 0.00 H new ATOM 0 HE3 LYS A 50 9.760 -12.875 1.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 10.424 -14.442 -0.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 9.650 -15.065 0.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 8.760 -14.776 -0.918 1.00 0.00 H new ATOM 758 N GLY A 51 5.467 -9.024 0.677 1.00 0.00 N ATOM 759 CA GLY A 51 5.676 -7.818 -0.103 1.00 0.00 C ATOM 760 C GLY A 51 5.105 -6.586 0.570 1.00 0.00 C ATOM 761 O GLY A 51 5.457 -6.273 1.708 1.00 0.00 O ATOM 0 H GLY A 51 5.596 -8.912 1.683 1.00 0.00 H new ATOM 0 HA2 GLY A 51 6.744 -7.676 -0.268 1.00 0.00 H new ATOM 0 HA3 GLY A 51 5.216 -7.939 -1.084 1.00 0.00 H new ATOM 765 N ILE A 52 4.224 -5.884 -0.134 1.00 0.00 N ATOM 766 CA ILE A 52 3.604 -4.679 0.403 1.00 0.00 C ATOM 767 C ILE A 52 2.089 -4.830 0.486 1.00 0.00 C ATOM 768 O ILE A 52 1.423 -5.080 -0.519 1.00 0.00 O ATOM 769 CB ILE A 52 3.939 -3.444 -0.454 1.00 0.00 C ATOM 770 CG1 ILE A 52 5.447 -3.183 -0.445 1.00 0.00 C ATOM 771 CG2 ILE A 52 3.183 -2.225 0.054 1.00 0.00 C ATOM 772 CD1 ILE A 52 6.035 -3.086 0.945 1.00 0.00 C ATOM 0 H ILE A 52 3.923 -6.129 -1.077 1.00 0.00 H new ATOM 0 HA ILE A 52 4.008 -4.536 1.405 1.00 0.00 H new ATOM 0 HB ILE A 52 3.629 -3.638 -1.481 1.00 0.00 H new ATOM 0 HG12 ILE A 52 5.949 -3.983 -0.988 1.00 0.00 H new ATOM 0 HG13 ILE A 52 5.650 -2.257 -0.982 1.00 0.00 H new ATOM 0 HG21 ILE A 52 3.431 -1.361 -0.562 1.00 0.00 H new ATOM 0 HG22 ILE A 52 2.111 -2.414 0.001 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.465 -2.026 1.088 1.00 0.00 H new ATOM 0 HD11 ILE A 52 7.107 -2.900 0.875 1.00 0.00 H new ATOM 0 HD12 ILE A 52 5.560 -2.267 1.485 1.00 0.00 H new ATOM 0 HD13 ILE A 52 5.863 -4.021 1.479 1.00 0.00 H new ATOM 784 N PHE A 53 1.549 -4.674 1.690 1.00 0.00 N ATOM 785 CA PHE A 53 0.112 -4.793 1.905 1.00 0.00 C ATOM 786 C PHE A 53 -0.452 -3.517 2.524 1.00 0.00 C ATOM 787 O PHE A 53 0.106 -2.979 3.481 1.00 0.00 O ATOM 788 CB PHE A 53 -0.194 -5.989 2.808 1.00 0.00 C ATOM 789 CG PHE A 53 0.489 -7.256 2.376 1.00 0.00 C ATOM 790 CD1 PHE A 53 1.848 -7.431 2.583 1.00 0.00 C ATOM 791 CD2 PHE A 53 -0.228 -8.271 1.763 1.00 0.00 C ATOM 792 CE1 PHE A 53 2.478 -8.595 2.186 1.00 0.00 C ATOM 793 CE2 PHE A 53 0.397 -9.437 1.364 1.00 0.00 C ATOM 794 CZ PHE A 53 1.752 -9.600 1.577 1.00 0.00 C ATOM 0 H PHE A 53 2.085 -4.465 2.532 1.00 0.00 H new ATOM 0 HA PHE A 53 -0.363 -4.948 0.936 1.00 0.00 H new ATOM 0 HB2 PHE A 53 0.109 -5.751 3.828 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -1.271 -6.154 2.826 1.00 0.00 H new ATOM 0 HD1 PHE A 53 2.421 -6.649 3.060 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -1.288 -8.149 1.595 1.00 0.00 H new ATOM 0 HE1 PHE A 53 3.538 -8.719 2.352 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -0.173 -10.220 0.886 1.00 0.00 H new ATOM 0 HZ PHE A 53 2.243 -10.511 1.268 1.00 0.00 H new ATOM 804 N ILE A 54 -1.562 -3.039 1.971 1.00 0.00 N ATOM 805 CA ILE A 54 -2.202 -1.827 2.469 1.00 0.00 C ATOM 806 C ILE A 54 -2.301 -1.844 3.991 1.00 0.00 C ATOM 807 O ILE A 54 -2.578 -2.880 4.595 1.00 0.00 O ATOM 808 CB ILE A 54 -3.612 -1.651 1.876 1.00 0.00 C ATOM 809 CG1 ILE A 54 -3.560 -1.729 0.349 1.00 0.00 C ATOM 810 CG2 ILE A 54 -4.214 -0.328 2.324 1.00 0.00 C ATOM 811 CD1 ILE A 54 -4.820 -1.232 -0.325 1.00 0.00 C ATOM 0 H ILE A 54 -2.037 -3.472 1.179 1.00 0.00 H new ATOM 0 HA ILE A 54 -1.578 -0.989 2.157 1.00 0.00 H new ATOM 0 HB ILE A 54 -4.247 -2.458 2.241 1.00 0.00 H new ATOM 0 HG12 ILE A 54 -2.712 -1.144 -0.008 1.00 0.00 H new ATOM 0 HG13 ILE A 54 -3.382 -2.763 0.052 1.00 0.00 H new ATOM 0 HG21 ILE A 54 -5.211 -0.218 1.896 1.00 0.00 H new ATOM 0 HG22 ILE A 54 -4.282 -0.309 3.412 1.00 0.00 H new ATOM 0 HG23 ILE A 54 -3.582 0.493 1.985 1.00 0.00 H new ATOM 0 HD11 ILE A 54 -4.712 -1.317 -1.406 1.00 0.00 H new ATOM 0 HD12 ILE A 54 -5.669 -1.832 0.003 1.00 0.00 H new ATOM 0 HD13 ILE A 54 -4.988 -0.189 -0.058 1.00 0.00 H new ATOM 823 N LYS A 55 -2.075 -0.687 4.605 1.00 0.00 N ATOM 824 CA LYS A 55 -2.141 -0.566 6.057 1.00 0.00 C ATOM 825 C LYS A 55 -3.460 0.067 6.490 1.00 0.00 C ATOM 826 O LYS A 55 -4.062 -0.348 7.479 1.00 0.00 O ATOM 827 CB LYS A 55 -0.968 0.270 6.573 1.00 0.00 C ATOM 828 CG LYS A 55 -1.198 0.851 7.957 1.00 0.00 C ATOM 829 CD LYS A 55 -1.413 -0.241 8.992 1.00 0.00 C ATOM 830 CE LYS A 55 -2.128 0.292 10.225 1.00 0.00 C ATOM 831 NZ LYS A 55 -3.606 0.306 10.045 1.00 0.00 N ATOM 0 H LYS A 55 -1.845 0.180 4.120 1.00 0.00 H new ATOM 0 HA LYS A 55 -2.081 -1.567 6.484 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.072 -0.350 6.593 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.777 1.084 5.873 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.341 1.461 8.243 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -2.066 1.510 7.936 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -1.997 -1.050 8.553 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -0.451 -0.663 9.282 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.873 -0.324 11.088 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -1.778 1.302 10.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.996 1.182 10.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -3.833 0.259 9.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -4.023 -0.513 10.531 1.00 0.00 H new ATOM 845 N GLN A 56 -3.902 1.073 5.742 1.00 0.00 N ATOM 846 CA GLN A 56 -5.150 1.762 6.049 1.00 0.00 C ATOM 847 C GLN A 56 -5.438 2.852 5.022 1.00 0.00 C ATOM 848 O GLN A 56 -4.519 3.432 4.444 1.00 0.00 O ATOM 849 CB GLN A 56 -5.089 2.369 7.452 1.00 0.00 C ATOM 850 CG GLN A 56 -5.500 3.832 7.499 1.00 0.00 C ATOM 851 CD GLN A 56 -5.465 4.403 8.903 1.00 0.00 C ATOM 852 OE1 GLN A 56 -5.675 3.687 9.882 1.00 0.00 O ATOM 853 NE2 GLN A 56 -5.199 5.700 9.009 1.00 0.00 N ATOM 0 H GLN A 56 -3.415 1.429 4.920 1.00 0.00 H new ATOM 0 HA GLN A 56 -5.958 1.031 6.011 1.00 0.00 H new ATOM 0 HB2 GLN A 56 -5.737 1.796 8.115 1.00 0.00 H new ATOM 0 HB3 GLN A 56 -4.074 2.273 7.837 1.00 0.00 H new ATOM 0 HG2 GLN A 56 -4.837 4.413 6.858 1.00 0.00 H new ATOM 0 HG3 GLN A 56 -6.506 3.936 7.094 1.00 0.00 H new ATOM 0 HE21 GLN A 56 -5.031 6.256 8.171 1.00 0.00 H new ATOM 0 HE22 GLN A 56 -5.163 6.140 9.929 1.00 0.00 H new ATOM 862 N VAL A 57 -6.719 3.124 4.799 1.00 0.00 N ATOM 863 CA VAL A 57 -7.128 4.145 3.841 1.00 0.00 C ATOM 864 C VAL A 57 -8.081 5.149 4.481 1.00 0.00 C ATOM 865 O VAL A 57 -9.190 4.798 4.886 1.00 0.00 O ATOM 866 CB VAL A 57 -7.811 3.519 2.610 1.00 0.00 C ATOM 867 CG1 VAL A 57 -8.711 4.535 1.925 1.00 0.00 C ATOM 868 CG2 VAL A 57 -6.769 2.978 1.642 1.00 0.00 C ATOM 0 H VAL A 57 -7.492 2.652 5.268 1.00 0.00 H new ATOM 0 HA VAL A 57 -6.222 4.660 3.522 1.00 0.00 H new ATOM 0 HB VAL A 57 -8.431 2.687 2.943 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -9.185 4.075 1.058 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -9.478 4.870 2.623 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -8.116 5.389 1.603 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -7.268 2.539 0.778 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -6.121 3.791 1.313 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -6.170 2.216 2.141 1.00 0.00 H new ATOM 878 N LEU A 58 -7.642 6.399 4.570 1.00 0.00 N ATOM 879 CA LEU A 58 -8.456 7.456 5.161 1.00 0.00 C ATOM 880 C LEU A 58 -9.819 7.537 4.482 1.00 0.00 C ATOM 881 O LEU A 58 -10.202 6.643 3.728 1.00 0.00 O ATOM 882 CB LEU A 58 -7.737 8.802 5.051 1.00 0.00 C ATOM 883 CG LEU A 58 -6.273 8.820 5.491 1.00 0.00 C ATOM 884 CD1 LEU A 58 -5.648 10.177 5.211 1.00 0.00 C ATOM 885 CD2 LEU A 58 -6.157 8.471 6.968 1.00 0.00 C ATOM 0 H LEU A 58 -6.727 6.706 4.241 1.00 0.00 H new ATOM 0 HA LEU A 58 -8.609 7.218 6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.788 9.134 4.014 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -8.284 9.533 5.647 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.731 8.069 4.917 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -4.606 10.171 5.531 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.698 10.387 4.143 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -6.191 10.948 5.758 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -5.108 8.488 7.265 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -6.713 9.199 7.559 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -6.566 7.475 7.140 1.00 0.00 H new ATOM 897 N GLU A 59 -10.546 8.617 4.753 1.00 0.00 N ATOM 898 CA GLU A 59 -11.866 8.814 4.166 1.00 0.00 C ATOM 899 C GLU A 59 -11.880 10.039 3.256 1.00 0.00 C ATOM 900 O GLU A 59 -12.268 9.956 2.091 1.00 0.00 O ATOM 901 CB GLU A 59 -12.919 8.971 5.266 1.00 0.00 C ATOM 902 CG GLU A 59 -14.336 9.117 4.736 1.00 0.00 C ATOM 903 CD GLU A 59 -15.385 8.744 5.764 1.00 0.00 C ATOM 904 OE1 GLU A 59 -15.216 7.704 6.434 1.00 0.00 O ATOM 905 OE2 GLU A 59 -16.375 9.493 5.900 1.00 0.00 O ATOM 0 H GLU A 59 -10.244 9.367 5.374 1.00 0.00 H new ATOM 0 HA GLU A 59 -12.104 7.935 3.567 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -12.874 8.105 5.926 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -12.674 9.845 5.870 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -14.496 10.147 4.417 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -14.457 8.487 3.854 1.00 0.00 H new ATOM 912 N ASP A 60 -11.453 11.175 3.797 1.00 0.00 N ATOM 913 CA ASP A 60 -11.415 12.418 3.034 1.00 0.00 C ATOM 914 C ASP A 60 -10.169 12.478 2.156 1.00 0.00 C ATOM 915 O ASP A 60 -9.522 13.520 2.049 1.00 0.00 O ATOM 916 CB ASP A 60 -11.447 13.621 3.978 1.00 0.00 C ATOM 917 CG ASP A 60 -12.820 13.848 4.580 1.00 0.00 C ATOM 918 OD1 ASP A 60 -13.821 13.486 3.927 1.00 0.00 O ATOM 919 OD2 ASP A 60 -12.893 14.387 5.705 1.00 0.00 O ATOM 0 H ASP A 60 -11.129 11.261 4.760 1.00 0.00 H new ATOM 0 HA ASP A 60 -12.294 12.448 2.390 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.723 13.470 4.779 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -11.140 14.514 3.434 1.00 0.00 H new ATOM 924 N SER A 61 -9.839 11.354 1.528 1.00 0.00 N ATOM 925 CA SER A 61 -8.668 11.277 0.663 1.00 0.00 C ATOM 926 C SER A 61 -9.053 10.787 -0.730 1.00 0.00 C ATOM 927 O SER A 61 -10.168 10.321 -0.966 1.00 0.00 O ATOM 928 CB SER A 61 -7.618 10.346 1.271 1.00 0.00 C ATOM 929 OG SER A 61 -7.445 9.185 0.477 1.00 0.00 O ATOM 0 H SER A 61 -10.366 10.484 1.602 1.00 0.00 H new ATOM 0 HA SER A 61 -8.247 12.278 0.574 1.00 0.00 H new ATOM 0 HB2 SER A 61 -6.668 10.873 1.361 1.00 0.00 H new ATOM 0 HB3 SER A 61 -7.921 10.060 2.278 1.00 0.00 H new ATOM 0 HG SER A 61 -6.561 9.206 0.055 1.00 0.00 H new ATOM 935 N PRO A 62 -8.109 10.895 -1.676 1.00 0.00 N ATOM 936 CA PRO A 62 -8.324 10.468 -3.062 1.00 0.00 C ATOM 937 C PRO A 62 -8.422 8.952 -3.193 1.00 0.00 C ATOM 938 O PRO A 62 -8.871 8.435 -4.216 1.00 0.00 O ATOM 939 CB PRO A 62 -7.083 10.989 -3.791 1.00 0.00 C ATOM 940 CG PRO A 62 -6.035 11.082 -2.736 1.00 0.00 C ATOM 941 CD PRO A 62 -6.757 11.440 -1.466 1.00 0.00 C ATOM 0 HA PRO A 62 -9.263 10.849 -3.465 1.00 0.00 H new ATOM 0 HB2 PRO A 62 -6.781 10.313 -4.591 1.00 0.00 H new ATOM 0 HB3 PRO A 62 -7.271 11.960 -4.249 1.00 0.00 H new ATOM 0 HG2 PRO A 62 -5.503 10.136 -2.629 1.00 0.00 H new ATOM 0 HG3 PRO A 62 -5.292 11.838 -2.989 1.00 0.00 H new ATOM 0 HD2 PRO A 62 -6.277 10.998 -0.593 1.00 0.00 H new ATOM 0 HD3 PRO A 62 -6.779 12.518 -1.306 1.00 0.00 H new ATOM 949 N ALA A 63 -7.999 8.244 -2.151 1.00 0.00 N ATOM 950 CA ALA A 63 -8.042 6.787 -2.149 1.00 0.00 C ATOM 951 C ALA A 63 -9.255 6.274 -1.380 1.00 0.00 C ATOM 952 O ALA A 63 -9.756 5.183 -1.649 1.00 0.00 O ATOM 953 CB ALA A 63 -6.760 6.222 -1.554 1.00 0.00 C ATOM 0 H ALA A 63 -7.623 8.656 -1.297 1.00 0.00 H new ATOM 0 HA ALA A 63 -8.130 6.450 -3.182 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -6.806 5.133 -1.559 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -5.907 6.552 -2.147 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -6.648 6.576 -0.529 1.00 0.00 H new ATOM 959 N GLY A 64 -9.722 7.068 -0.422 1.00 0.00 N ATOM 960 CA GLY A 64 -10.872 6.677 0.371 1.00 0.00 C ATOM 961 C GLY A 64 -12.176 6.817 -0.389 1.00 0.00 C ATOM 962 O GLY A 64 -13.166 6.161 -0.065 1.00 0.00 O ATOM 0 H GLY A 64 -9.324 7.976 -0.181 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -10.752 5.643 0.693 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -10.913 7.289 1.272 1.00 0.00 H new ATOM 966 N LYS A 65 -12.178 7.675 -1.403 1.00 0.00 N ATOM 967 CA LYS A 65 -13.369 7.901 -2.213 1.00 0.00 C ATOM 968 C LYS A 65 -13.503 6.833 -3.294 1.00 0.00 C ATOM 969 O LYS A 65 -14.606 6.377 -3.599 1.00 0.00 O ATOM 970 CB LYS A 65 -13.319 9.289 -2.856 1.00 0.00 C ATOM 971 CG LYS A 65 -13.365 10.426 -1.851 1.00 0.00 C ATOM 972 CD LYS A 65 -13.835 11.720 -2.494 1.00 0.00 C ATOM 973 CE LYS A 65 -13.339 12.936 -1.727 1.00 0.00 C ATOM 974 NZ LYS A 65 -13.821 14.209 -2.334 1.00 0.00 N ATOM 0 H LYS A 65 -11.367 8.226 -1.684 1.00 0.00 H new ATOM 0 HA LYS A 65 -14.239 7.842 -1.559 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -12.407 9.374 -3.447 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -14.156 9.391 -3.546 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -14.034 10.162 -1.032 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -12.375 10.572 -1.420 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -13.478 11.767 -3.523 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -14.924 11.733 -2.534 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -13.677 12.876 -0.693 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -12.249 12.933 -1.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -13.462 15.014 -1.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -13.477 14.279 -3.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -14.861 14.223 -2.330 1.00 0.00 H new ATOM 988 N THR A 66 -12.373 6.436 -3.870 1.00 0.00 N ATOM 989 CA THR A 66 -12.363 5.422 -4.917 1.00 0.00 C ATOM 990 C THR A 66 -13.003 4.125 -4.432 1.00 0.00 C ATOM 991 O THR A 66 -13.454 3.308 -5.232 1.00 0.00 O ATOM 992 CB THR A 66 -10.931 5.125 -5.399 1.00 0.00 C ATOM 993 OG1 THR A 66 -10.256 4.293 -4.449 1.00 0.00 O ATOM 994 CG2 THR A 66 -10.149 6.415 -5.597 1.00 0.00 C ATOM 0 H THR A 66 -11.452 6.802 -3.629 1.00 0.00 H new ATOM 0 HA THR A 66 -12.942 5.822 -5.749 1.00 0.00 H new ATOM 0 HB THR A 66 -10.994 4.606 -6.355 1.00 0.00 H new ATOM 0 HG1 THR A 66 -10.175 4.769 -3.596 1.00 0.00 H new ATOM 0 HG21 THR A 66 -9.140 6.180 -5.938 1.00 0.00 H new ATOM 0 HG22 THR A 66 -10.649 7.033 -6.343 1.00 0.00 H new ATOM 0 HG23 THR A 66 -10.096 6.957 -4.653 1.00 0.00 H new ATOM 1002 N ASN A 67 -13.038 3.945 -3.115 1.00 0.00 N ATOM 1003 CA ASN A 67 -13.623 2.747 -2.524 1.00 0.00 C ATOM 1004 C ASN A 67 -13.227 1.502 -3.312 1.00 0.00 C ATOM 1005 O ASN A 67 -13.926 0.490 -3.285 1.00 0.00 O ATOM 1006 CB ASN A 67 -15.148 2.870 -2.474 1.00 0.00 C ATOM 1007 CG ASN A 67 -15.757 2.053 -1.351 1.00 0.00 C ATOM 1008 OD1 ASN A 67 -16.291 2.736 -0.345 1.00 0.00 O flip ATOM 1009 ND2 ASN A 67 -15.749 0.823 -1.389 1.00 0.00 N flip ATOM 0 H ASN A 67 -12.669 4.613 -2.438 1.00 0.00 H new ATOM 0 HA ASN A 67 -13.240 2.649 -1.508 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -15.421 3.918 -2.347 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -15.568 2.544 -3.426 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -15.327 0.340 -2.182 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -16.164 0.287 -0.627 1.00 0.00 H new ATOM 1016 N ALA A 68 -12.101 1.585 -4.012 1.00 0.00 N ATOM 1017 CA ALA A 68 -11.610 0.465 -4.805 1.00 0.00 C ATOM 1018 C ALA A 68 -10.392 -0.178 -4.151 1.00 0.00 C ATOM 1019 O ALA A 68 -9.768 -1.073 -4.723 1.00 0.00 O ATOM 1020 CB ALA A 68 -11.273 0.925 -6.216 1.00 0.00 C ATOM 0 H ALA A 68 -11.511 2.417 -4.046 1.00 0.00 H new ATOM 0 HA ALA A 68 -12.399 -0.285 -4.858 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -10.907 0.078 -6.797 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.167 1.331 -6.689 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -10.503 1.695 -6.173 1.00 0.00 H new ATOM 1026 N LEU A 69 -10.058 0.283 -2.951 1.00 0.00 N ATOM 1027 CA LEU A 69 -8.913 -0.248 -2.219 1.00 0.00 C ATOM 1028 C LEU A 69 -9.194 -0.285 -0.720 1.00 0.00 C ATOM 1029 O LEU A 69 -9.717 0.674 -0.152 1.00 0.00 O ATOM 1030 CB LEU A 69 -7.669 0.599 -2.495 1.00 0.00 C ATOM 1031 CG LEU A 69 -7.356 0.871 -3.967 1.00 0.00 C ATOM 1032 CD1 LEU A 69 -6.600 2.182 -4.118 1.00 0.00 C ATOM 1033 CD2 LEU A 69 -6.557 -0.278 -4.564 1.00 0.00 C ATOM 0 H LEU A 69 -10.563 1.023 -2.464 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.735 -1.267 -2.562 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -7.785 1.556 -1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -6.809 0.102 -2.047 1.00 0.00 H new ATOM 0 HG LEU A 69 -8.298 0.953 -4.509 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -6.386 2.359 -5.172 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -7.207 2.999 -3.729 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.664 2.129 -3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -6.344 -0.067 -5.612 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -5.620 -0.392 -4.019 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.134 -1.200 -4.490 1.00 0.00 H new ATOM 1045 N LYS A 70 -8.843 -1.398 -0.085 1.00 0.00 N ATOM 1046 CA LYS A 70 -9.054 -1.560 1.348 1.00 0.00 C ATOM 1047 C LYS A 70 -7.780 -2.043 2.035 1.00 0.00 C ATOM 1048 O LYS A 70 -6.868 -2.555 1.385 1.00 0.00 O ATOM 1049 CB LYS A 70 -10.192 -2.550 1.608 1.00 0.00 C ATOM 1050 CG LYS A 70 -11.423 -2.300 0.754 1.00 0.00 C ATOM 1051 CD LYS A 70 -12.414 -1.388 1.456 1.00 0.00 C ATOM 1052 CE LYS A 70 -12.143 0.076 1.144 1.00 0.00 C ATOM 1053 NZ LYS A 70 -12.239 0.359 -0.314 1.00 0.00 N ATOM 0 H LYS A 70 -8.411 -2.202 -0.541 1.00 0.00 H new ATOM 0 HA LYS A 70 -9.323 -0.588 1.762 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -9.831 -3.562 1.423 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -10.473 -2.499 2.660 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -11.124 -1.853 -0.194 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -11.904 -3.250 0.521 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -13.428 -1.645 1.148 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -12.358 -1.548 2.533 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -12.856 0.700 1.683 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -11.149 0.346 1.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -11.370 0.833 -0.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -12.357 -0.534 -0.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -13.057 0.976 -0.495 1.00 0.00 H new ATOM 1067 N THR A 71 -7.724 -1.878 3.353 1.00 0.00 N ATOM 1068 CA THR A 71 -6.563 -2.297 4.127 1.00 0.00 C ATOM 1069 C THR A 71 -6.434 -3.816 4.146 1.00 0.00 C ATOM 1070 O THR A 71 -7.414 -4.529 4.354 1.00 0.00 O ATOM 1071 CB THR A 71 -6.637 -1.781 5.576 1.00 0.00 C ATOM 1072 OG1 THR A 71 -5.389 -2.004 6.241 1.00 0.00 O ATOM 1073 CG2 THR A 71 -7.756 -2.473 6.340 1.00 0.00 C ATOM 0 H THR A 71 -8.470 -1.457 3.907 1.00 0.00 H new ATOM 0 HA THR A 71 -5.687 -1.867 3.641 1.00 0.00 H new ATOM 0 HB THR A 71 -6.845 -0.712 5.547 1.00 0.00 H new ATOM 0 HG1 THR A 71 -5.326 -1.417 7.023 1.00 0.00 H new ATOM 0 HG21 THR A 71 -7.789 -2.092 7.361 1.00 0.00 H new ATOM 0 HG22 THR A 71 -8.709 -2.276 5.848 1.00 0.00 H new ATOM 0 HG23 THR A 71 -7.573 -3.547 6.359 1.00 0.00 H new ATOM 1081 N GLY A 72 -5.216 -4.305 3.930 1.00 0.00 N ATOM 1082 CA GLY A 72 -4.982 -5.737 3.928 1.00 0.00 C ATOM 1083 C GLY A 72 -4.611 -6.261 2.554 1.00 0.00 C ATOM 1084 O GLY A 72 -3.954 -7.295 2.434 1.00 0.00 O ATOM 0 H GLY A 72 -4.388 -3.735 3.757 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -4.183 -5.973 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -5.878 -6.249 4.279 1.00 0.00 H new ATOM 1088 N ASP A 73 -5.036 -5.549 1.517 1.00 0.00 N ATOM 1089 CA ASP A 73 -4.745 -5.949 0.145 1.00 0.00 C ATOM 1090 C ASP A 73 -3.253 -6.206 -0.042 1.00 0.00 C ATOM 1091 O ASP A 73 -2.464 -6.054 0.891 1.00 0.00 O ATOM 1092 CB ASP A 73 -5.217 -4.872 -0.834 1.00 0.00 C ATOM 1093 CG ASP A 73 -6.629 -5.116 -1.327 1.00 0.00 C ATOM 1094 OD1 ASP A 73 -6.813 -6.004 -2.186 1.00 0.00 O ATOM 1095 OD2 ASP A 73 -7.552 -4.419 -0.855 1.00 0.00 O ATOM 0 H ASP A 73 -5.583 -4.692 1.600 1.00 0.00 H new ATOM 0 HA ASP A 73 -5.283 -6.875 -0.059 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -5.168 -3.897 -0.348 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -4.539 -4.838 -1.686 1.00 0.00 H new ATOM 1100 N LYS A 74 -2.873 -6.597 -1.254 1.00 0.00 N ATOM 1101 CA LYS A 74 -1.476 -6.875 -1.565 1.00 0.00 C ATOM 1102 C LYS A 74 -1.003 -6.034 -2.746 1.00 0.00 C ATOM 1103 O LYS A 74 -1.288 -6.354 -3.901 1.00 0.00 O ATOM 1104 CB LYS A 74 -1.287 -8.362 -1.876 1.00 0.00 C ATOM 1105 CG LYS A 74 0.165 -8.766 -2.060 1.00 0.00 C ATOM 1106 CD LYS A 74 0.286 -10.107 -2.764 1.00 0.00 C ATOM 1107 CE LYS A 74 1.729 -10.589 -2.800 1.00 0.00 C ATOM 1108 NZ LYS A 74 2.469 -10.037 -3.969 1.00 0.00 N ATOM 0 H LYS A 74 -3.513 -6.728 -2.037 1.00 0.00 H new ATOM 0 HA LYS A 74 -0.877 -6.613 -0.693 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -1.719 -8.951 -1.067 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -1.841 -8.608 -2.782 1.00 0.00 H new ATOM 0 HG2 LYS A 74 0.686 -8.002 -2.638 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.655 -8.819 -1.088 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -0.333 -10.845 -2.253 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.096 -10.021 -3.781 1.00 0.00 H new ATOM 0 HE2 LYS A 74 2.233 -10.295 -1.879 1.00 0.00 H new ATOM 0 HE3 LYS A 74 1.747 -11.678 -2.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 3.452 -10.375 -3.949 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 2.013 -10.352 -4.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 2.459 -8.998 -3.927 1.00 0.00 H new ATOM 1122 N ILE A 75 -0.280 -4.960 -2.450 1.00 0.00 N ATOM 1123 CA ILE A 75 0.234 -4.076 -3.489 1.00 0.00 C ATOM 1124 C ILE A 75 1.366 -4.739 -4.265 1.00 0.00 C ATOM 1125 O ILE A 75 2.419 -5.049 -3.706 1.00 0.00 O ATOM 1126 CB ILE A 75 0.742 -2.748 -2.896 1.00 0.00 C ATOM 1127 CG1 ILE A 75 -0.284 -2.176 -1.916 1.00 0.00 C ATOM 1128 CG2 ILE A 75 1.035 -1.750 -4.007 1.00 0.00 C ATOM 1129 CD1 ILE A 75 0.220 -0.976 -1.145 1.00 0.00 C ATOM 0 H ILE A 75 -0.037 -4.681 -1.500 1.00 0.00 H new ATOM 0 HA ILE A 75 -0.595 -3.870 -4.166 1.00 0.00 H new ATOM 0 HB ILE A 75 1.667 -2.940 -2.353 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.182 -1.893 -2.466 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.574 -2.955 -1.211 1.00 0.00 H new ATOM 0 HG21 ILE A 75 1.393 -0.817 -3.573 1.00 0.00 H new ATOM 0 HG22 ILE A 75 1.798 -2.158 -4.670 1.00 0.00 H new ATOM 0 HG23 ILE A 75 0.124 -1.560 -4.575 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -0.560 -0.624 -0.470 1.00 0.00 H new ATOM 0 HD12 ILE A 75 1.100 -1.258 -0.567 1.00 0.00 H new ATOM 0 HD13 ILE A 75 0.483 -0.180 -1.842 1.00 0.00 H new ATOM 1141 N LEU A 76 1.144 -4.953 -5.557 1.00 0.00 N ATOM 1142 CA LEU A 76 2.146 -5.579 -6.413 1.00 0.00 C ATOM 1143 C LEU A 76 2.876 -4.533 -7.250 1.00 0.00 C ATOM 1144 O LEU A 76 4.008 -4.750 -7.681 1.00 0.00 O ATOM 1145 CB LEU A 76 1.490 -6.614 -7.328 1.00 0.00 C ATOM 1146 CG LEU A 76 0.305 -7.379 -6.735 1.00 0.00 C ATOM 1147 CD1 LEU A 76 -0.675 -7.774 -7.828 1.00 0.00 C ATOM 1148 CD2 LEU A 76 0.788 -8.608 -5.979 1.00 0.00 C ATOM 0 H LEU A 76 0.279 -4.702 -6.035 1.00 0.00 H new ATOM 0 HA LEU A 76 2.873 -6.079 -5.773 1.00 0.00 H new ATOM 0 HB2 LEU A 76 1.154 -6.108 -8.233 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.249 -7.336 -7.629 1.00 0.00 H new ATOM 0 HG LEU A 76 -0.211 -6.725 -6.032 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -1.511 -8.317 -7.388 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.046 -6.878 -8.325 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.171 -8.411 -8.555 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -0.068 -9.140 -5.564 1.00 0.00 H new ATOM 0 HD22 LEU A 76 1.328 -9.265 -6.660 1.00 0.00 H new ATOM 0 HD23 LEU A 76 1.451 -8.300 -5.170 1.00 0.00 H new ATOM 1160 N GLU A 77 2.220 -3.399 -7.474 1.00 0.00 N ATOM 1161 CA GLU A 77 2.808 -2.319 -8.259 1.00 0.00 C ATOM 1162 C GLU A 77 2.021 -1.024 -8.078 1.00 0.00 C ATOM 1163 O GLU A 77 0.818 -1.046 -7.817 1.00 0.00 O ATOM 1164 CB GLU A 77 2.849 -2.700 -9.741 1.00 0.00 C ATOM 1165 CG GLU A 77 4.035 -2.113 -10.487 1.00 0.00 C ATOM 1166 CD GLU A 77 3.891 -2.224 -11.992 1.00 0.00 C ATOM 1167 OE1 GLU A 77 2.806 -2.633 -12.456 1.00 0.00 O ATOM 1168 OE2 GLU A 77 4.863 -1.901 -12.706 1.00 0.00 O ATOM 0 H GLU A 77 1.282 -3.204 -7.124 1.00 0.00 H new ATOM 0 HA GLU A 77 3.826 -2.158 -7.904 1.00 0.00 H new ATOM 0 HB2 GLU A 77 2.877 -3.786 -9.828 1.00 0.00 H new ATOM 0 HB3 GLU A 77 1.928 -2.366 -10.219 1.00 0.00 H new ATOM 0 HG2 GLU A 77 4.149 -1.064 -10.213 1.00 0.00 H new ATOM 0 HG3 GLU A 77 4.945 -2.624 -10.174 1.00 0.00 H new ATOM 1175 N VAL A 78 2.710 0.104 -8.217 1.00 0.00 N ATOM 1176 CA VAL A 78 2.078 1.409 -8.069 1.00 0.00 C ATOM 1177 C VAL A 78 2.672 2.421 -9.042 1.00 0.00 C ATOM 1178 O VAL A 78 3.885 2.625 -9.079 1.00 0.00 O ATOM 1179 CB VAL A 78 2.228 1.946 -6.633 1.00 0.00 C ATOM 1180 CG1 VAL A 78 3.413 2.895 -6.538 1.00 0.00 C ATOM 1181 CG2 VAL A 78 0.947 2.634 -6.186 1.00 0.00 C ATOM 0 H VAL A 78 3.706 0.140 -8.432 1.00 0.00 H new ATOM 0 HA VAL A 78 1.019 1.274 -8.290 1.00 0.00 H new ATOM 0 HB VAL A 78 2.414 1.104 -5.966 1.00 0.00 H new ATOM 0 HG11 VAL A 78 3.503 3.264 -5.516 1.00 0.00 H new ATOM 0 HG12 VAL A 78 4.325 2.367 -6.814 1.00 0.00 H new ATOM 0 HG13 VAL A 78 3.261 3.736 -7.215 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.070 3.007 -5.169 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.729 3.467 -6.855 1.00 0.00 H new ATOM 0 HG23 VAL A 78 0.123 1.921 -6.213 1.00 0.00 H new ATOM 1191 N SER A 79 1.808 3.053 -9.830 1.00 0.00 N ATOM 1192 CA SER A 79 2.247 4.043 -10.808 1.00 0.00 C ATOM 1193 C SER A 79 3.198 3.417 -11.824 1.00 0.00 C ATOM 1194 O SER A 79 3.901 4.121 -12.548 1.00 0.00 O ATOM 1195 CB SER A 79 2.933 5.216 -10.104 1.00 0.00 C ATOM 1196 OG SER A 79 2.762 6.418 -10.834 1.00 0.00 O ATOM 0 H SER A 79 0.800 2.898 -9.811 1.00 0.00 H new ATOM 0 HA SER A 79 1.368 4.410 -11.338 1.00 0.00 H new ATOM 0 HB2 SER A 79 2.522 5.334 -9.102 1.00 0.00 H new ATOM 0 HB3 SER A 79 3.996 5.004 -9.989 1.00 0.00 H new ATOM 0 HG SER A 79 3.047 6.281 -11.761 1.00 0.00 H new ATOM 1202 N GLY A 80 3.214 2.089 -11.871 1.00 0.00 N ATOM 1203 CA GLY A 80 4.082 1.390 -12.800 1.00 0.00 C ATOM 1204 C GLY A 80 5.422 1.036 -12.188 1.00 0.00 C ATOM 1205 O GLY A 80 6.440 1.000 -12.880 1.00 0.00 O ATOM 0 H GLY A 80 2.641 1.484 -11.282 1.00 0.00 H new ATOM 0 HA2 GLY A 80 3.588 0.479 -13.138 1.00 0.00 H new ATOM 0 HA3 GLY A 80 4.241 2.012 -13.681 1.00 0.00 H new ATOM 1209 N VAL A 81 5.425 0.774 -10.885 1.00 0.00 N ATOM 1210 CA VAL A 81 6.651 0.422 -10.178 1.00 0.00 C ATOM 1211 C VAL A 81 6.469 -0.854 -9.364 1.00 0.00 C ATOM 1212 O VAL A 81 5.553 -0.956 -8.548 1.00 0.00 O ATOM 1213 CB VAL A 81 7.105 1.556 -9.240 1.00 0.00 C ATOM 1214 CG1 VAL A 81 6.354 1.489 -7.919 1.00 0.00 C ATOM 1215 CG2 VAL A 81 8.607 1.490 -9.013 1.00 0.00 C ATOM 0 H VAL A 81 4.592 0.799 -10.297 1.00 0.00 H new ATOM 0 HA VAL A 81 7.417 0.260 -10.936 1.00 0.00 H new ATOM 0 HB VAL A 81 6.874 2.510 -9.713 1.00 0.00 H new ATOM 0 HG11 VAL A 81 6.688 2.298 -7.269 1.00 0.00 H new ATOM 0 HG12 VAL A 81 5.284 1.590 -8.103 1.00 0.00 H new ATOM 0 HG13 VAL A 81 6.551 0.531 -7.437 1.00 0.00 H new ATOM 0 HG21 VAL A 81 8.910 2.299 -8.348 1.00 0.00 H new ATOM 0 HG22 VAL A 81 8.865 0.532 -8.561 1.00 0.00 H new ATOM 0 HG23 VAL A 81 9.124 1.592 -9.967 1.00 0.00 H new ATOM 1225 N ASP A 82 7.347 -1.825 -9.591 1.00 0.00 N ATOM 1226 CA ASP A 82 7.285 -3.095 -8.877 1.00 0.00 C ATOM 1227 C ASP A 82 7.602 -2.902 -7.397 1.00 0.00 C ATOM 1228 O ASP A 82 8.744 -2.625 -7.027 1.00 0.00 O ATOM 1229 CB ASP A 82 8.259 -4.100 -9.493 1.00 0.00 C ATOM 1230 CG ASP A 82 8.590 -5.239 -8.550 1.00 0.00 C ATOM 1231 OD1 ASP A 82 7.715 -6.103 -8.333 1.00 0.00 O ATOM 1232 OD2 ASP A 82 9.724 -5.266 -8.028 1.00 0.00 O ATOM 0 H ASP A 82 8.110 -1.757 -10.264 1.00 0.00 H new ATOM 0 HA ASP A 82 6.271 -3.484 -8.966 1.00 0.00 H new ATOM 0 HB2 ASP A 82 7.828 -4.504 -10.409 1.00 0.00 H new ATOM 0 HB3 ASP A 82 9.178 -3.586 -9.773 1.00 0.00 H new ATOM 1237 N LEU A 83 6.585 -3.050 -6.555 1.00 0.00 N ATOM 1238 CA LEU A 83 6.755 -2.892 -5.115 1.00 0.00 C ATOM 1239 C LEU A 83 6.580 -4.226 -4.396 1.00 0.00 C ATOM 1240 O LEU A 83 6.818 -4.329 -3.193 1.00 0.00 O ATOM 1241 CB LEU A 83 5.753 -1.872 -4.572 1.00 0.00 C ATOM 1242 CG LEU A 83 5.908 -0.440 -5.085 1.00 0.00 C ATOM 1243 CD1 LEU A 83 5.004 0.506 -4.310 1.00 0.00 C ATOM 1244 CD2 LEU A 83 7.359 0.007 -4.988 1.00 0.00 C ATOM 0 H LEU A 83 5.634 -3.279 -6.845 1.00 0.00 H new ATOM 0 HA LEU A 83 7.767 -2.531 -4.931 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.747 -2.216 -4.814 1.00 0.00 H new ATOM 0 HB3 LEU A 83 5.832 -1.858 -3.485 1.00 0.00 H new ATOM 0 HG LEU A 83 5.610 -0.416 -6.133 1.00 0.00 H new ATOM 0 HD11 LEU A 83 5.128 1.520 -4.689 1.00 0.00 H new ATOM 0 HD12 LEU A 83 3.966 0.198 -4.431 1.00 0.00 H new ATOM 0 HD13 LEU A 83 5.269 0.479 -3.253 1.00 0.00 H new ATOM 0 HD21 LEU A 83 7.451 1.028 -5.357 1.00 0.00 H new ATOM 0 HD22 LEU A 83 7.683 -0.033 -3.948 1.00 0.00 H new ATOM 0 HD23 LEU A 83 7.984 -0.654 -5.589 1.00 0.00 H new ATOM 1256 N GLN A 84 6.166 -5.244 -5.142 1.00 0.00 N ATOM 1257 CA GLN A 84 5.961 -6.572 -4.575 1.00 0.00 C ATOM 1258 C GLN A 84 7.014 -6.881 -3.516 1.00 0.00 C ATOM 1259 O GLN A 84 6.714 -6.926 -2.324 1.00 0.00 O ATOM 1260 CB GLN A 84 6.003 -7.632 -5.677 1.00 0.00 C ATOM 1261 CG GLN A 84 4.684 -7.796 -6.416 1.00 0.00 C ATOM 1262 CD GLN A 84 4.722 -8.916 -7.436 1.00 0.00 C ATOM 1263 OE1 GLN A 84 4.859 -10.088 -7.084 1.00 0.00 O ATOM 1264 NE2 GLN A 84 4.600 -8.561 -8.710 1.00 0.00 N ATOM 0 H GLN A 84 5.966 -5.175 -6.140 1.00 0.00 H new ATOM 0 HA GLN A 84 4.980 -6.589 -4.101 1.00 0.00 H new ATOM 0 HB2 GLN A 84 6.781 -7.368 -6.394 1.00 0.00 H new ATOM 0 HB3 GLN A 84 6.285 -8.589 -5.238 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.890 -7.993 -5.695 1.00 0.00 H new ATOM 0 HG3 GLN A 84 4.434 -6.861 -6.918 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.488 -7.578 -8.957 1.00 0.00 H new ATOM 0 HE22 GLN A 84 4.618 -9.272 -9.441 1.00 0.00 H new ATOM 1273 N ASN A 85 8.248 -7.092 -3.960 1.00 0.00 N ATOM 1274 CA ASN A 85 9.346 -7.397 -3.050 1.00 0.00 C ATOM 1275 C ASN A 85 10.050 -6.121 -2.599 1.00 0.00 C ATOM 1276 O ASN A 85 11.266 -6.103 -2.412 1.00 0.00 O ATOM 1277 CB ASN A 85 10.350 -8.335 -3.724 1.00 0.00 C ATOM 1278 CG ASN A 85 9.703 -9.613 -4.221 1.00 0.00 C ATOM 1279 OD1 ASN A 85 9.099 -10.357 -3.448 1.00 0.00 O ATOM 1280 ND2 ASN A 85 9.829 -9.876 -5.516 1.00 0.00 N ATOM 0 H ASN A 85 8.513 -7.057 -4.944 1.00 0.00 H new ATOM 0 HA ASN A 85 8.930 -7.891 -2.172 1.00 0.00 H new ATOM 0 HB2 ASN A 85 10.819 -7.819 -4.562 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.142 -8.583 -3.018 1.00 0.00 H new ATOM 0 HD21 ASN A 85 9.416 -10.723 -5.907 1.00 0.00 H new ATOM 0 HD22 ASN A 85 10.338 -9.231 -6.120 1.00 0.00 H new ATOM 1287 N ALA A 86 9.275 -5.054 -2.426 1.00 0.00 N ATOM 1288 CA ALA A 86 9.823 -3.775 -1.994 1.00 0.00 C ATOM 1289 C ALA A 86 9.528 -3.520 -0.520 1.00 0.00 C ATOM 1290 O ALA A 86 8.410 -3.740 -0.054 1.00 0.00 O ATOM 1291 CB ALA A 86 9.264 -2.646 -2.848 1.00 0.00 C ATOM 0 H ALA A 86 8.266 -5.051 -2.579 1.00 0.00 H new ATOM 0 HA ALA A 86 10.905 -3.811 -2.120 1.00 0.00 H new ATOM 0 HB1 ALA A 86 9.682 -1.696 -2.514 1.00 0.00 H new ATOM 0 HB2 ALA A 86 9.531 -2.813 -3.892 1.00 0.00 H new ATOM 0 HB3 ALA A 86 8.179 -2.619 -2.751 1.00 0.00 H new ATOM 1297 N SER A 87 10.538 -3.057 0.210 1.00 0.00 N ATOM 1298 CA SER A 87 10.387 -2.778 1.633 1.00 0.00 C ATOM 1299 C SER A 87 9.379 -1.656 1.863 1.00 0.00 C ATOM 1300 O SER A 87 8.735 -1.183 0.926 1.00 0.00 O ATOM 1301 CB SER A 87 11.737 -2.399 2.246 1.00 0.00 C ATOM 1302 OG SER A 87 12.508 -3.552 2.535 1.00 0.00 O ATOM 0 H SER A 87 11.469 -2.867 -0.161 1.00 0.00 H new ATOM 0 HA SER A 87 10.016 -3.681 2.118 1.00 0.00 H new ATOM 0 HB2 SER A 87 12.284 -1.755 1.558 1.00 0.00 H new ATOM 0 HB3 SER A 87 11.577 -1.826 3.160 1.00 0.00 H new ATOM 0 HG SER A 87 13.198 -3.328 3.194 1.00 0.00 H new ATOM 1308 N HIS A 88 9.247 -1.235 3.117 1.00 0.00 N ATOM 1309 CA HIS A 88 8.318 -0.168 3.471 1.00 0.00 C ATOM 1310 C HIS A 88 8.758 1.160 2.863 1.00 0.00 C ATOM 1311 O HIS A 88 7.929 1.960 2.428 1.00 0.00 O ATOM 1312 CB HIS A 88 8.215 -0.037 4.991 1.00 0.00 C ATOM 1313 CG HIS A 88 6.857 0.383 5.465 1.00 0.00 C ATOM 1314 ND1 HIS A 88 6.663 1.237 6.530 1.00 0.00 N ATOM 1315 CD2 HIS A 88 5.623 0.062 5.012 1.00 0.00 C ATOM 1316 CE1 HIS A 88 5.368 1.422 6.712 1.00 0.00 C ATOM 1317 NE2 HIS A 88 4.714 0.720 5.803 1.00 0.00 N ATOM 0 H HIS A 88 9.771 -1.616 3.904 1.00 0.00 H new ATOM 0 HA HIS A 88 7.338 -0.424 3.068 1.00 0.00 H new ATOM 0 HB2 HIS A 88 8.471 -0.993 5.448 1.00 0.00 H new ATOM 0 HB3 HIS A 88 8.952 0.689 5.336 1.00 0.00 H new ATOM 0 HD2 HIS A 88 5.395 -0.591 4.182 1.00 0.00 H new ATOM 0 HE1 HIS A 88 4.920 2.042 7.474 1.00 0.00 H new ATOM 0 HE2 HIS A 88 3.700 0.675 5.705 1.00 0.00 H new ATOM 1325 N SER A 89 10.067 1.389 2.836 1.00 0.00 N ATOM 1326 CA SER A 89 10.617 2.622 2.285 1.00 0.00 C ATOM 1327 C SER A 89 10.595 2.593 0.760 1.00 0.00 C ATOM 1328 O SER A 89 10.239 3.579 0.116 1.00 0.00 O ATOM 1329 CB SER A 89 12.048 2.834 2.783 1.00 0.00 C ATOM 1330 OG SER A 89 12.505 4.141 2.480 1.00 0.00 O ATOM 0 H SER A 89 10.767 0.736 3.189 1.00 0.00 H new ATOM 0 HA SER A 89 9.996 3.451 2.624 1.00 0.00 H new ATOM 0 HB2 SER A 89 12.089 2.671 3.860 1.00 0.00 H new ATOM 0 HB3 SER A 89 12.709 2.099 2.324 1.00 0.00 H new ATOM 0 HG SER A 89 13.421 4.252 2.810 1.00 0.00 H new ATOM 1336 N GLU A 90 10.980 1.455 0.191 1.00 0.00 N ATOM 1337 CA GLU A 90 11.005 1.297 -1.259 1.00 0.00 C ATOM 1338 C GLU A 90 9.644 1.623 -1.866 1.00 0.00 C ATOM 1339 O GLU A 90 9.557 2.224 -2.936 1.00 0.00 O ATOM 1340 CB GLU A 90 11.414 -0.129 -1.632 1.00 0.00 C ATOM 1341 CG GLU A 90 12.875 -0.437 -1.350 1.00 0.00 C ATOM 1342 CD GLU A 90 13.777 -0.113 -2.525 1.00 0.00 C ATOM 1343 OE1 GLU A 90 13.262 -0.025 -3.660 1.00 0.00 O ATOM 1344 OE2 GLU A 90 14.996 0.053 -2.311 1.00 0.00 O ATOM 0 H GLU A 90 11.279 0.630 0.711 1.00 0.00 H new ATOM 0 HA GLU A 90 11.739 1.995 -1.662 1.00 0.00 H new ATOM 0 HB2 GLU A 90 10.790 -0.833 -1.081 1.00 0.00 H new ATOM 0 HB3 GLU A 90 11.216 -0.289 -2.692 1.00 0.00 H new ATOM 0 HG2 GLU A 90 13.201 0.132 -0.479 1.00 0.00 H new ATOM 0 HG3 GLU A 90 12.978 -1.492 -1.098 1.00 0.00 H new ATOM 1351 N ALA A 91 8.583 1.221 -1.173 1.00 0.00 N ATOM 1352 CA ALA A 91 7.225 1.471 -1.642 1.00 0.00 C ATOM 1353 C ALA A 91 6.780 2.890 -1.303 1.00 0.00 C ATOM 1354 O ALA A 91 6.117 3.551 -2.103 1.00 0.00 O ATOM 1355 CB ALA A 91 6.264 0.456 -1.042 1.00 0.00 C ATOM 0 H ALA A 91 8.638 0.721 -0.286 1.00 0.00 H new ATOM 0 HA ALA A 91 7.216 1.365 -2.727 1.00 0.00 H new ATOM 0 HB1 ALA A 91 5.254 0.655 -1.401 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.564 -0.549 -1.340 1.00 0.00 H new ATOM 0 HB3 ALA A 91 6.285 0.534 0.045 1.00 0.00 H new ATOM 1361 N VAL A 92 7.147 3.351 -0.112 1.00 0.00 N ATOM 1362 CA VAL A 92 6.785 4.692 0.333 1.00 0.00 C ATOM 1363 C VAL A 92 7.189 5.741 -0.697 1.00 0.00 C ATOM 1364 O VAL A 92 6.419 6.649 -1.007 1.00 0.00 O ATOM 1365 CB VAL A 92 7.445 5.033 1.682 1.00 0.00 C ATOM 1366 CG1 VAL A 92 7.673 6.532 1.802 1.00 0.00 C ATOM 1367 CG2 VAL A 92 6.595 4.521 2.835 1.00 0.00 C ATOM 0 H VAL A 92 7.695 2.816 0.562 1.00 0.00 H new ATOM 0 HA VAL A 92 5.702 4.703 0.453 1.00 0.00 H new ATOM 0 HB VAL A 92 8.415 4.538 1.727 1.00 0.00 H new ATOM 0 HG11 VAL A 92 8.140 6.753 2.762 1.00 0.00 H new ATOM 0 HG12 VAL A 92 8.325 6.867 0.995 1.00 0.00 H new ATOM 0 HG13 VAL A 92 6.717 7.052 1.735 1.00 0.00 H new ATOM 0 HG21 VAL A 92 7.076 4.771 3.781 1.00 0.00 H new ATOM 0 HG22 VAL A 92 5.610 4.986 2.795 1.00 0.00 H new ATOM 0 HG23 VAL A 92 6.489 3.439 2.756 1.00 0.00 H new ATOM 1377 N GLU A 93 8.402 5.607 -1.225 1.00 0.00 N ATOM 1378 CA GLU A 93 8.908 6.544 -2.221 1.00 0.00 C ATOM 1379 C GLU A 93 8.147 6.405 -3.536 1.00 0.00 C ATOM 1380 O GLU A 93 7.930 7.385 -4.248 1.00 0.00 O ATOM 1381 CB GLU A 93 10.402 6.314 -2.457 1.00 0.00 C ATOM 1382 CG GLU A 93 11.222 6.277 -1.179 1.00 0.00 C ATOM 1383 CD GLU A 93 12.623 6.826 -1.368 1.00 0.00 C ATOM 1384 OE1 GLU A 93 13.430 6.169 -2.058 1.00 0.00 O ATOM 1385 OE2 GLU A 93 12.912 7.913 -0.826 1.00 0.00 O ATOM 0 H GLU A 93 9.051 4.860 -0.980 1.00 0.00 H new ATOM 0 HA GLU A 93 8.759 7.554 -1.840 1.00 0.00 H new ATOM 0 HB2 GLU A 93 10.536 5.374 -2.992 1.00 0.00 H new ATOM 0 HB3 GLU A 93 10.785 7.105 -3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 93 10.711 6.853 -0.407 1.00 0.00 H new ATOM 0 HG3 GLU A 93 11.284 5.249 -0.821 1.00 0.00 H new ATOM 1392 N ALA A 94 7.744 5.178 -3.852 1.00 0.00 N ATOM 1393 CA ALA A 94 7.005 4.909 -5.080 1.00 0.00 C ATOM 1394 C ALA A 94 5.644 5.596 -5.064 1.00 0.00 C ATOM 1395 O ALA A 94 5.281 6.298 -6.009 1.00 0.00 O ATOM 1396 CB ALA A 94 6.840 3.410 -5.279 1.00 0.00 C ATOM 0 H ALA A 94 7.917 4.355 -3.275 1.00 0.00 H new ATOM 0 HA ALA A 94 7.577 5.314 -5.915 1.00 0.00 H new ATOM 0 HB1 ALA A 94 6.287 3.224 -6.199 1.00 0.00 H new ATOM 0 HB2 ALA A 94 7.822 2.941 -5.345 1.00 0.00 H new ATOM 0 HB3 ALA A 94 6.293 2.989 -4.435 1.00 0.00 H new ATOM 1402 N ILE A 95 4.895 5.390 -3.986 1.00 0.00 N ATOM 1403 CA ILE A 95 3.574 5.990 -3.848 1.00 0.00 C ATOM 1404 C ILE A 95 3.669 7.509 -3.745 1.00 0.00 C ATOM 1405 O ILE A 95 2.800 8.231 -4.235 1.00 0.00 O ATOM 1406 CB ILE A 95 2.836 5.448 -2.610 1.00 0.00 C ATOM 1407 CG1 ILE A 95 2.487 3.971 -2.804 1.00 0.00 C ATOM 1408 CG2 ILE A 95 1.580 6.264 -2.342 1.00 0.00 C ATOM 1409 CD1 ILE A 95 3.532 3.026 -2.253 1.00 0.00 C ATOM 0 H ILE A 95 5.181 4.812 -3.195 1.00 0.00 H new ATOM 0 HA ILE A 95 3.011 5.723 -4.742 1.00 0.00 H new ATOM 0 HB ILE A 95 3.494 5.536 -1.745 1.00 0.00 H new ATOM 0 HG12 ILE A 95 1.532 3.765 -2.321 1.00 0.00 H new ATOM 0 HG13 ILE A 95 2.355 3.774 -3.868 1.00 0.00 H new ATOM 0 HG21 ILE A 95 1.070 5.868 -1.464 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.853 7.304 -2.165 1.00 0.00 H new ATOM 0 HG23 ILE A 95 0.917 6.205 -3.205 1.00 0.00 H new ATOM 0 HD11 ILE A 95 3.219 1.996 -2.426 1.00 0.00 H new ATOM 0 HD12 ILE A 95 4.484 3.204 -2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 95 3.648 3.196 -1.182 1.00 0.00 H new ATOM 1421 N LYS A 96 4.731 7.988 -3.107 1.00 0.00 N ATOM 1422 CA LYS A 96 4.942 9.422 -2.941 1.00 0.00 C ATOM 1423 C LYS A 96 5.564 10.028 -4.195 1.00 0.00 C ATOM 1424 O LYS A 96 5.375 11.208 -4.485 1.00 0.00 O ATOM 1425 CB LYS A 96 5.841 9.689 -1.732 1.00 0.00 C ATOM 1426 CG LYS A 96 7.319 9.752 -2.076 1.00 0.00 C ATOM 1427 CD LYS A 96 8.184 9.705 -0.827 1.00 0.00 C ATOM 1428 CE LYS A 96 8.301 11.075 -0.178 1.00 0.00 C ATOM 1429 NZ LYS A 96 7.142 11.370 0.708 1.00 0.00 N ATOM 0 H LYS A 96 5.460 7.404 -2.696 1.00 0.00 H new ATOM 0 HA LYS A 96 3.972 9.891 -2.775 1.00 0.00 H new ATOM 0 HB2 LYS A 96 5.544 10.630 -1.269 1.00 0.00 H new ATOM 0 HB3 LYS A 96 5.682 8.905 -0.991 1.00 0.00 H new ATOM 0 HG2 LYS A 96 7.577 8.919 -2.730 1.00 0.00 H new ATOM 0 HG3 LYS A 96 7.526 10.668 -2.629 1.00 0.00 H new ATOM 0 HD2 LYS A 96 7.758 8.999 -0.114 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.177 9.337 -1.085 1.00 0.00 H new ATOM 0 HE2 LYS A 96 9.223 11.125 0.401 1.00 0.00 H new ATOM 0 HE3 LYS A 96 8.370 11.839 -0.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 6.622 12.191 0.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 6.509 10.545 0.738 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 7.483 11.580 1.668 1.00 0.00 H new ATOM 1443 N ASN A 97 6.307 9.211 -4.936 1.00 0.00 N ATOM 1444 CA ASN A 97 6.956 9.668 -6.159 1.00 0.00 C ATOM 1445 C ASN A 97 6.259 9.097 -7.390 1.00 0.00 C ATOM 1446 O ASN A 97 6.805 9.123 -8.493 1.00 0.00 O ATOM 1447 CB ASN A 97 8.432 9.262 -6.160 1.00 0.00 C ATOM 1448 CG ASN A 97 9.159 9.722 -4.912 1.00 0.00 C ATOM 1449 OD1 ASN A 97 9.917 8.819 -4.302 1.00 0.00 O flip ATOM 1450 ND2 ASN A 97 9.041 10.877 -4.502 1.00 0.00 N flip ATOM 0 H ASN A 97 6.474 8.230 -4.711 1.00 0.00 H new ATOM 0 HA ASN A 97 6.885 10.755 -6.195 1.00 0.00 H new ATOM 0 HB2 ASN A 97 8.508 8.178 -6.242 1.00 0.00 H new ATOM 0 HB3 ASN A 97 8.921 9.683 -7.038 1.00 0.00 H new ATOM 0 HD21 ASN A 97 8.447 11.538 -5.003 1.00 0.00 H new ATOM 0 HD22 ASN A 97 9.537 11.173 -3.661 1.00 0.00 H new ATOM 1457 N ALA A 98 5.050 8.583 -7.194 1.00 0.00 N ATOM 1458 CA ALA A 98 4.277 8.009 -8.288 1.00 0.00 C ATOM 1459 C ALA A 98 3.789 9.093 -9.243 1.00 0.00 C ATOM 1460 O ALA A 98 2.919 9.892 -8.900 1.00 0.00 O ATOM 1461 CB ALA A 98 3.099 7.215 -7.742 1.00 0.00 C ATOM 0 H ALA A 98 4.584 8.552 -6.287 1.00 0.00 H new ATOM 0 HA ALA A 98 4.928 7.336 -8.846 1.00 0.00 H new ATOM 0 HB1 ALA A 98 2.530 6.792 -8.570 1.00 0.00 H new ATOM 0 HB2 ALA A 98 3.466 6.410 -7.105 1.00 0.00 H new ATOM 0 HB3 ALA A 98 2.455 7.874 -7.159 1.00 0.00 H new ATOM 1467 N GLY A 99 4.356 9.114 -10.446 1.00 0.00 N ATOM 1468 CA GLY A 99 3.967 10.104 -11.433 1.00 0.00 C ATOM 1469 C GLY A 99 2.462 10.250 -11.545 1.00 0.00 C ATOM 1470 O GLY A 99 1.811 9.495 -12.265 1.00 0.00 O ATOM 0 H GLY A 99 5.078 8.463 -10.754 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.404 11.067 -11.169 1.00 0.00 H new ATOM 0 HA3 GLY A 99 4.375 9.824 -12.404 1.00 0.00 H new ATOM 1474 N ASN A 100 1.909 11.224 -10.830 1.00 0.00 N ATOM 1475 CA ASN A 100 0.470 11.465 -10.851 1.00 0.00 C ATOM 1476 C ASN A 100 -0.090 11.291 -12.259 1.00 0.00 C ATOM 1477 O ASN A 100 0.479 11.763 -13.243 1.00 0.00 O ATOM 1478 CB ASN A 100 0.160 12.873 -10.338 1.00 0.00 C ATOM 1479 CG ASN A 100 -1.323 13.093 -10.112 1.00 0.00 C ATOM 1480 OD1 ASN A 100 -2.135 12.903 -11.018 1.00 0.00 O ATOM 1481 ND2 ASN A 100 -1.684 13.494 -8.899 1.00 0.00 N ATOM 0 H ASN A 100 2.434 11.859 -10.229 1.00 0.00 H new ATOM 0 HA ASN A 100 -0.005 10.734 -10.197 1.00 0.00 H new ATOM 0 HB2 ASN A 100 0.696 13.043 -9.404 1.00 0.00 H new ATOM 0 HB3 ASN A 100 0.528 13.607 -11.055 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -2.668 13.657 -8.688 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -0.977 13.639 -8.178 1.00 0.00 H new ATOM 1488 N PRO A 101 -1.233 10.596 -12.359 1.00 0.00 N ATOM 1489 CA PRO A 101 -1.919 10.029 -11.195 1.00 0.00 C ATOM 1490 C PRO A 101 -1.151 8.864 -10.580 1.00 0.00 C ATOM 1491 O PRO A 101 -0.153 8.403 -11.135 1.00 0.00 O ATOM 1492 CB PRO A 101 -3.253 9.546 -11.770 1.00 0.00 C ATOM 1493 CG PRO A 101 -2.976 9.296 -13.212 1.00 0.00 C ATOM 1494 CD PRO A 101 -1.944 10.311 -13.617 1.00 0.00 C ATOM 0 HA PRO A 101 -2.024 10.756 -10.390 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -3.595 8.640 -11.270 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -4.034 10.295 -11.641 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -2.608 8.282 -13.369 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -3.883 9.402 -13.808 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -1.271 9.918 -14.379 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -2.404 11.208 -14.031 1.00 0.00 H new ATOM 1502 N VAL A 102 -1.622 8.391 -9.431 1.00 0.00 N ATOM 1503 CA VAL A 102 -0.980 7.278 -8.741 1.00 0.00 C ATOM 1504 C VAL A 102 -1.790 5.996 -8.894 1.00 0.00 C ATOM 1505 O VAL A 102 -2.749 5.763 -8.157 1.00 0.00 O ATOM 1506 CB VAL A 102 -0.793 7.579 -7.242 1.00 0.00 C ATOM 1507 CG1 VAL A 102 0.089 6.525 -6.592 1.00 0.00 C ATOM 1508 CG2 VAL A 102 -0.208 8.970 -7.047 1.00 0.00 C ATOM 0 H VAL A 102 -2.446 8.761 -8.958 1.00 0.00 H new ATOM 0 HA VAL A 102 -0.001 7.143 -9.201 1.00 0.00 H new ATOM 0 HB VAL A 102 -1.769 7.549 -6.759 1.00 0.00 H new ATOM 0 HG11 VAL A 102 0.210 6.754 -5.533 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.375 5.545 -6.700 1.00 0.00 H new ATOM 0 HG13 VAL A 102 1.066 6.519 -7.076 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.083 9.166 -5.982 1.00 0.00 H new ATOM 0 HG22 VAL A 102 0.760 9.030 -7.544 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -0.882 9.712 -7.475 1.00 0.00 H new ATOM 1518 N VAL A 103 -1.398 5.165 -9.855 1.00 0.00 N ATOM 1519 CA VAL A 103 -2.087 3.905 -10.104 1.00 0.00 C ATOM 1520 C VAL A 103 -1.715 2.859 -9.058 1.00 0.00 C ATOM 1521 O VAL A 103 -0.565 2.780 -8.626 1.00 0.00 O ATOM 1522 CB VAL A 103 -1.760 3.353 -11.504 1.00 0.00 C ATOM 1523 CG1 VAL A 103 -2.847 2.396 -11.969 1.00 0.00 C ATOM 1524 CG2 VAL A 103 -1.582 4.492 -12.496 1.00 0.00 C ATOM 0 H VAL A 103 -0.607 5.342 -10.474 1.00 0.00 H new ATOM 0 HA VAL A 103 -3.156 4.112 -10.044 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.823 2.800 -11.447 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -2.598 2.017 -12.960 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -2.922 1.563 -11.270 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -3.801 2.922 -12.011 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -1.351 4.085 -13.480 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -2.502 5.074 -12.551 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -0.765 5.135 -12.169 1.00 0.00 H new ATOM 1534 N PHE A 104 -2.696 2.058 -8.656 1.00 0.00 N ATOM 1535 CA PHE A 104 -2.472 1.017 -7.660 1.00 0.00 C ATOM 1536 C PHE A 104 -2.869 -0.352 -8.205 1.00 0.00 C ATOM 1537 O PHE A 104 -3.975 -0.531 -8.716 1.00 0.00 O ATOM 1538 CB PHE A 104 -3.265 1.320 -6.386 1.00 0.00 C ATOM 1539 CG PHE A 104 -2.502 2.142 -5.387 1.00 0.00 C ATOM 1540 CD1 PHE A 104 -2.528 3.526 -5.443 1.00 0.00 C ATOM 1541 CD2 PHE A 104 -1.758 1.529 -4.391 1.00 0.00 C ATOM 1542 CE1 PHE A 104 -1.827 4.284 -4.525 1.00 0.00 C ATOM 1543 CE2 PHE A 104 -1.056 2.283 -3.469 1.00 0.00 C ATOM 1544 CZ PHE A 104 -1.089 3.662 -3.537 1.00 0.00 C ATOM 0 H PHE A 104 -3.653 2.110 -9.004 1.00 0.00 H new ATOM 0 HA PHE A 104 -1.408 1.000 -7.422 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -4.181 1.847 -6.654 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -3.562 0.380 -5.920 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -3.103 4.018 -6.213 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -1.726 0.451 -4.335 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -1.856 5.362 -4.580 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -0.482 1.794 -2.696 1.00 0.00 H new ATOM 0 HZ PHE A 104 -0.539 4.253 -2.819 1.00 0.00 H new ATOM 1554 N ILE A 105 -1.959 -1.313 -8.093 1.00 0.00 N ATOM 1555 CA ILE A 105 -2.214 -2.665 -8.575 1.00 0.00 C ATOM 1556 C ILE A 105 -2.186 -3.671 -7.429 1.00 0.00 C ATOM 1557 O ILE A 105 -1.139 -4.231 -7.105 1.00 0.00 O ATOM 1558 CB ILE A 105 -1.183 -3.088 -9.638 1.00 0.00 C ATOM 1559 CG1 ILE A 105 -1.009 -1.980 -10.679 1.00 0.00 C ATOM 1560 CG2 ILE A 105 -1.612 -4.386 -10.305 1.00 0.00 C ATOM 1561 CD1 ILE A 105 -0.547 -2.486 -12.028 1.00 0.00 C ATOM 0 H ILE A 105 -1.039 -1.181 -7.673 1.00 0.00 H new ATOM 0 HA ILE A 105 -3.206 -2.657 -9.026 1.00 0.00 H new ATOM 0 HB ILE A 105 -0.224 -3.254 -9.147 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -1.957 -1.456 -10.802 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.288 -1.252 -10.306 1.00 0.00 H new ATOM 0 HG21 ILE A 105 -0.873 -4.672 -11.054 1.00 0.00 H new ATOM 0 HG22 ILE A 105 -1.691 -5.172 -9.554 1.00 0.00 H new ATOM 0 HG23 ILE A 105 -2.580 -4.245 -10.786 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -0.445 -1.647 -12.716 1.00 0.00 H new ATOM 0 HD12 ILE A 105 0.416 -2.985 -11.919 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.279 -3.191 -12.422 1.00 0.00 H new ATOM 1573 N VAL A 106 -3.345 -3.897 -6.818 1.00 0.00 N ATOM 1574 CA VAL A 106 -3.456 -4.837 -5.710 1.00 0.00 C ATOM 1575 C VAL A 106 -4.476 -5.928 -6.014 1.00 0.00 C ATOM 1576 O VAL A 106 -5.170 -5.876 -7.029 1.00 0.00 O ATOM 1577 CB VAL A 106 -3.858 -4.123 -4.406 1.00 0.00 C ATOM 1578 CG1 VAL A 106 -2.835 -3.057 -4.043 1.00 0.00 C ATOM 1579 CG2 VAL A 106 -5.247 -3.518 -4.537 1.00 0.00 C ATOM 0 H VAL A 106 -4.221 -3.441 -7.073 1.00 0.00 H new ATOM 0 HA VAL A 106 -2.473 -5.289 -5.580 1.00 0.00 H new ATOM 0 HB VAL A 106 -3.881 -4.858 -3.602 1.00 0.00 H new ATOM 0 HG11 VAL A 106 -3.136 -2.563 -3.119 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -1.859 -3.522 -3.905 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -2.776 -2.321 -4.845 1.00 0.00 H new ATOM 0 HG21 VAL A 106 -5.515 -3.017 -3.607 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -5.254 -2.795 -5.353 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -5.969 -4.307 -4.746 1.00 0.00 H new ATOM 1589 N GLN A 107 -4.561 -6.915 -5.128 1.00 0.00 N ATOM 1590 CA GLN A 107 -5.497 -8.020 -5.303 1.00 0.00 C ATOM 1591 C GLN A 107 -6.201 -8.349 -3.991 1.00 0.00 C ATOM 1592 O GLN A 107 -5.569 -8.777 -3.026 1.00 0.00 O ATOM 1593 CB GLN A 107 -4.766 -9.257 -5.828 1.00 0.00 C ATOM 1594 CG GLN A 107 -3.579 -8.930 -6.719 1.00 0.00 C ATOM 1595 CD GLN A 107 -3.274 -10.033 -7.713 1.00 0.00 C ATOM 1596 OE1 GLN A 107 -2.650 -9.797 -8.748 1.00 0.00 O ATOM 1597 NE2 GLN A 107 -3.713 -11.247 -7.404 1.00 0.00 N ATOM 0 H GLN A 107 -3.994 -6.972 -4.282 1.00 0.00 H new ATOM 0 HA GLN A 107 -6.249 -7.715 -6.031 1.00 0.00 H new ATOM 0 HB2 GLN A 107 -4.422 -9.852 -4.982 1.00 0.00 H new ATOM 0 HB3 GLN A 107 -5.469 -9.875 -6.386 1.00 0.00 H new ATOM 0 HG2 GLN A 107 -3.779 -8.005 -7.259 1.00 0.00 H new ATOM 0 HG3 GLN A 107 -2.701 -8.753 -6.098 1.00 0.00 H new ATOM 0 HE21 GLN A 107 -4.226 -11.398 -6.536 1.00 0.00 H new ATOM 0 HE22 GLN A 107 -3.537 -12.029 -8.035 1.00 0.00 H new ATOM 1606 N SER A 108 -7.515 -8.146 -3.963 1.00 0.00 N ATOM 1607 CA SER A 108 -8.305 -8.417 -2.768 1.00 0.00 C ATOM 1608 C SER A 108 -8.530 -9.916 -2.595 1.00 0.00 C ATOM 1609 O SER A 108 -8.988 -10.598 -3.513 1.00 0.00 O ATOM 1610 CB SER A 108 -9.650 -7.694 -2.846 1.00 0.00 C ATOM 1611 OG SER A 108 -10.202 -7.503 -1.555 1.00 0.00 O ATOM 0 H SER A 108 -8.054 -7.795 -4.754 1.00 0.00 H new ATOM 0 HA SER A 108 -7.752 -8.048 -1.905 1.00 0.00 H new ATOM 0 HB2 SER A 108 -9.520 -6.729 -3.336 1.00 0.00 H new ATOM 0 HB3 SER A 108 -10.342 -8.272 -3.459 1.00 0.00 H new ATOM 0 HG SER A 108 -11.061 -7.037 -1.632 1.00 0.00 H new ATOM 1617 N LEU A 109 -8.204 -10.424 -1.411 1.00 0.00 N ATOM 1618 CA LEU A 109 -8.370 -11.842 -1.115 1.00 0.00 C ATOM 1619 C LEU A 109 -9.839 -12.246 -1.191 1.00 0.00 C ATOM 1620 O LEU A 109 -10.703 -11.427 -1.501 1.00 0.00 O ATOM 1621 CB LEU A 109 -7.813 -12.162 0.274 1.00 0.00 C ATOM 1622 CG LEU A 109 -6.344 -12.585 0.326 1.00 0.00 C ATOM 1623 CD1 LEU A 109 -5.818 -12.509 1.751 1.00 0.00 C ATOM 1624 CD2 LEU A 109 -6.173 -13.989 -0.234 1.00 0.00 C ATOM 0 H LEU A 109 -7.823 -9.874 -0.641 1.00 0.00 H new ATOM 0 HA LEU A 109 -7.816 -12.411 -1.862 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -7.940 -11.283 0.906 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -8.416 -12.958 0.711 1.00 0.00 H new ATOM 0 HG LEU A 109 -5.765 -11.897 -0.291 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.772 -12.813 1.769 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -5.905 -11.486 2.117 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -6.400 -13.173 2.390 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -5.122 -14.273 -0.189 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -6.764 -14.690 0.355 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -6.511 -14.011 -1.270 1.00 0.00 H new ATOM 1636 N SER A 110 -10.114 -13.515 -0.905 1.00 0.00 N ATOM 1637 CA SER A 110 -11.478 -14.028 -0.943 1.00 0.00 C ATOM 1638 C SER A 110 -12.473 -12.962 -0.494 1.00 0.00 C ATOM 1639 O SER A 110 -12.144 -12.089 0.309 1.00 0.00 O ATOM 1640 CB SER A 110 -11.605 -15.266 -0.052 1.00 0.00 C ATOM 1641 OG SER A 110 -11.761 -14.902 1.308 1.00 0.00 O ATOM 0 H SER A 110 -9.410 -14.206 -0.645 1.00 0.00 H new ATOM 0 HA SER A 110 -11.707 -14.304 -1.972 1.00 0.00 H new ATOM 0 HB2 SER A 110 -12.459 -15.862 -0.372 1.00 0.00 H new ATOM 0 HB3 SER A 110 -10.720 -15.891 -0.165 1.00 0.00 H new ATOM 0 HG SER A 110 -11.842 -15.711 1.856 1.00 0.00 H new ATOM 1647 N SER A 111 -13.691 -13.039 -1.020 1.00 0.00 N ATOM 1648 CA SER A 111 -14.734 -12.079 -0.678 1.00 0.00 C ATOM 1649 C SER A 111 -14.661 -11.701 0.798 1.00 0.00 C ATOM 1650 O SER A 111 -14.126 -12.448 1.618 1.00 0.00 O ATOM 1651 CB SER A 111 -16.114 -12.656 -1.001 1.00 0.00 C ATOM 1652 OG SER A 111 -16.255 -12.893 -2.391 1.00 0.00 O ATOM 0 H SER A 111 -13.980 -13.756 -1.685 1.00 0.00 H new ATOM 0 HA SER A 111 -14.576 -11.180 -1.274 1.00 0.00 H new ATOM 0 HB2 SER A 111 -16.259 -13.587 -0.454 1.00 0.00 H new ATOM 0 HB3 SER A 111 -16.888 -11.965 -0.666 1.00 0.00 H new ATOM 0 HG SER A 111 -17.144 -13.263 -2.571 1.00 0.00 H new ATOM 1658 N THR A 112 -15.204 -10.533 1.131 1.00 0.00 N ATOM 1659 CA THR A 112 -15.200 -10.054 2.507 1.00 0.00 C ATOM 1660 C THR A 112 -16.304 -9.027 2.734 1.00 0.00 C ATOM 1661 O THR A 112 -16.626 -8.222 1.860 1.00 0.00 O ATOM 1662 CB THR A 112 -13.844 -9.423 2.879 1.00 0.00 C ATOM 1663 OG1 THR A 112 -13.377 -8.599 1.805 1.00 0.00 O ATOM 1664 CG2 THR A 112 -12.813 -10.499 3.185 1.00 0.00 C ATOM 0 H THR A 112 -15.652 -9.902 0.466 1.00 0.00 H new ATOM 0 HA THR A 112 -15.376 -10.921 3.144 1.00 0.00 H new ATOM 0 HB THR A 112 -13.984 -8.812 3.771 1.00 0.00 H new ATOM 0 HG1 THR A 112 -12.516 -8.200 2.049 1.00 0.00 H new ATOM 0 HG21 THR A 112 -11.864 -10.030 3.445 1.00 0.00 H new ATOM 0 HG22 THR A 112 -13.159 -11.107 4.021 1.00 0.00 H new ATOM 0 HG23 THR A 112 -12.677 -11.132 2.308 1.00 0.00 H new ATOM 1672 N PRO A 113 -16.899 -9.054 3.936 1.00 0.00 N ATOM 1673 CA PRO A 113 -17.975 -8.130 4.307 1.00 0.00 C ATOM 1674 C PRO A 113 -17.479 -6.698 4.475 1.00 0.00 C ATOM 1675 O PRO A 113 -16.278 -6.458 4.599 1.00 0.00 O ATOM 1676 CB PRO A 113 -18.473 -8.684 5.644 1.00 0.00 C ATOM 1677 CG PRO A 113 -17.307 -9.421 6.207 1.00 0.00 C ATOM 1678 CD PRO A 113 -16.566 -9.986 5.026 1.00 0.00 C ATOM 0 HA PRO A 113 -18.746 -8.074 3.539 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -18.794 -7.883 6.310 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -19.329 -9.344 5.505 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -16.668 -8.756 6.787 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -17.634 -10.215 6.879 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -15.492 -10.025 5.207 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -16.888 -11.002 4.798 1.00 0.00 H new ATOM 1686 N ARG A 114 -18.411 -5.751 4.478 1.00 0.00 N ATOM 1687 CA ARG A 114 -18.067 -4.342 4.630 1.00 0.00 C ATOM 1688 C ARG A 114 -19.324 -3.483 4.728 1.00 0.00 C ATOM 1689 O ARG A 114 -20.384 -3.854 4.222 1.00 0.00 O ATOM 1690 CB ARG A 114 -17.208 -3.875 3.453 1.00 0.00 C ATOM 1691 CG ARG A 114 -17.025 -2.367 3.394 1.00 0.00 C ATOM 1692 CD ARG A 114 -15.725 -1.990 2.701 1.00 0.00 C ATOM 1693 NE ARG A 114 -14.589 -2.748 3.219 1.00 0.00 N ATOM 1694 CZ ARG A 114 -14.040 -2.528 4.408 1.00 0.00 C ATOM 1695 NH1 ARG A 114 -14.520 -1.577 5.198 1.00 0.00 N ATOM 1696 NH2 ARG A 114 -13.008 -3.259 4.810 1.00 0.00 N ATOM 0 H ARG A 114 -19.409 -5.933 4.377 1.00 0.00 H new ATOM 0 HA ARG A 114 -17.498 -4.230 5.553 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -16.229 -4.349 3.518 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -17.665 -4.214 2.523 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -17.865 -1.918 2.864 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -17.031 -1.959 4.405 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -15.821 -2.167 1.630 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -15.540 -0.924 2.833 1.00 0.00 H new ATOM 0 HE ARG A 114 -14.196 -3.487 2.636 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -15.313 -1.012 4.893 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -14.096 -1.410 6.111 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -12.635 -3.991 4.205 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -12.587 -3.089 5.724 1.00 0.00 H new ATOM 1710 N VAL A 115 -19.200 -2.334 5.384 1.00 0.00 N ATOM 1711 CA VAL A 115 -20.325 -1.421 5.548 1.00 0.00 C ATOM 1712 C VAL A 115 -19.863 0.031 5.527 1.00 0.00 C ATOM 1713 O VAL A 115 -18.670 0.315 5.635 1.00 0.00 O ATOM 1714 CB VAL A 115 -21.078 -1.690 6.865 1.00 0.00 C ATOM 1715 CG1 VAL A 115 -20.187 -1.389 8.061 1.00 0.00 C ATOM 1716 CG2 VAL A 115 -22.358 -0.871 6.924 1.00 0.00 C ATOM 0 H VAL A 115 -18.331 -2.013 5.811 1.00 0.00 H new ATOM 0 HA VAL A 115 -20.999 -1.596 4.710 1.00 0.00 H new ATOM 0 HB VAL A 115 -21.348 -2.746 6.900 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -20.736 -1.585 8.982 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -19.302 -2.024 8.024 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -19.884 -0.342 8.035 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -22.877 -1.074 7.861 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -22.114 0.190 6.866 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -23.002 -1.141 6.087 1.00 0.00 H new ATOM 1726 N ILE A 116 -20.816 0.947 5.389 1.00 0.00 N ATOM 1727 CA ILE A 116 -20.506 2.371 5.355 1.00 0.00 C ATOM 1728 C ILE A 116 -21.165 3.104 6.519 1.00 0.00 C ATOM 1729 O ILE A 116 -22.320 2.858 6.866 1.00 0.00 O ATOM 1730 CB ILE A 116 -20.963 3.016 4.033 1.00 0.00 C ATOM 1731 CG1 ILE A 116 -21.078 1.955 2.936 1.00 0.00 C ATOM 1732 CG2 ILE A 116 -19.994 4.112 3.616 1.00 0.00 C ATOM 1733 CD1 ILE A 116 -21.592 2.498 1.621 1.00 0.00 C ATOM 0 H ILE A 116 -21.808 0.729 5.299 1.00 0.00 H new ATOM 0 HA ILE A 116 -19.423 2.460 5.438 1.00 0.00 H new ATOM 0 HB ILE A 116 -21.945 3.464 4.185 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -20.099 1.503 2.775 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -21.743 1.162 3.277 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -20.330 4.558 2.680 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -19.956 4.878 4.390 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -19.000 3.686 3.478 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -21.648 1.691 0.891 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -22.584 2.925 1.767 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -20.915 3.271 1.257 1.00 0.00 H new ATOM 1745 N PRO A 117 -20.415 4.029 7.136 1.00 0.00 N ATOM 1746 CA PRO A 117 -20.905 4.820 8.268 1.00 0.00 C ATOM 1747 C PRO A 117 -21.976 5.823 7.854 1.00 0.00 C ATOM 1748 O PRO A 117 -23.142 5.466 7.682 1.00 0.00 O ATOM 1749 CB PRO A 117 -19.653 5.548 8.762 1.00 0.00 C ATOM 1750 CG PRO A 117 -18.764 5.624 7.570 1.00 0.00 C ATOM 1751 CD PRO A 117 -19.029 4.375 6.775 1.00 0.00 C ATOM 0 HA PRO A 117 -21.378 4.196 9.026 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -19.896 6.542 9.139 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -19.176 5.005 9.578 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -18.978 6.515 6.980 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -17.717 5.683 7.867 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -18.924 4.550 5.704 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -18.334 3.577 7.037 1.00 0.00 H new TER 1759 PRO A 117