USER MOD reduce.3.24.130724 H: found=0, std=0, add=1626, rem=0, adj=59 USER MOD reduce.3.24.130724 removed 1626 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: B 85 MET CE :methyl 169:sc=-0.00098 (180deg=0) USER MOD Set 1.2: B 86 CYS SG : rot -6:sc= 0.772 USER MOD Set 2.1: B 80 SER OG : rot -41:sc= -0.379 USER MOD Set 2.2: B 81 CYS SG : rot 74:sc= 0.54 USER MOD Set 2.3: B 96 LYS NZ :NH3+ 161:sc= -0.0426 (180deg=-0.413) USER MOD Set 3.1: A 76 CYS SG : rot -53:sc= -1.46! USER MOD Set 3.2: B 76 CYS SG : rot -53:sc= -1.71 USER MOD Set 4.1: A 85 MET CE :methyl 171:sc= 0 (180deg=-0.0104) USER MOD Set 4.2: A 86 CYS SG : rot -11:sc= 0.712 USER MOD Set 5.1: A 80 SER OG : rot -40:sc= -0.568 USER MOD Set 5.2: A 81 CYS SG : rot 76:sc= 0.77 USER MOD Set 5.3: A 96 LYS NZ :NH3+ 160:sc= -0.0453 (180deg=-0.474) USER MOD Single : A 1 MET CE :methyl -156:sc= -0.125 (180deg=-1.17) USER MOD Single : A 1 MET N :NH3+ -167:sc= -0.132 (180deg=-0.415) USER MOD Single : A 3 CYS SG : rot 134:sc= -0.113 USER MOD Single : A 7 LYS NZ :NH3+ 134:sc= -0.262 (180deg=-1.17!) USER MOD Single : A 12 MET CE :methyl 156:sc= -0.263 (180deg=-1.55!) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 HIS : no HD1:sc= -0.0259 X(o=-0.026,f=-0.44) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 149:sc= -2.98! USER MOD Single : A 20 SER OG : rot -133:sc= 0.194 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 1.04 (180deg=1.04) USER MOD Single : A 26 LYS NZ :NH3+ 140:sc= -0.204 (180deg=-1.34!) USER MOD Single : A 28 LYS NZ :NH3+ -120:sc= 0.239 (180deg=-0.674) USER MOD Single : A 30 ASN : amide:sc= -1.94! X(o=-1.9!,f=-1.5) USER MOD Single : A 31 LYS NZ :NH3+ -177:sc= -1.38 (180deg=-1.57) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 147:sc= -0.046 (180deg=-0.486) USER MOD Single : A 39 THR OG1 : rot 79:sc= 0.959 USER MOD Single : A 44 SER OG : rot 180:sc= -0.0808 USER MOD Single : A 48 LYS NZ :NH3+ 144:sc= -0.0837 (180deg=-0.626) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.396 X(o=-0.4,f=-0.26) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.885 K(o=-0.88,f=-1.7) USER MOD Single : A 64 SER OG : rot 180:sc= -0.373 USER MOD Single : A 65 ASN : amide:sc= -0.488 K(o=-0.49,f=-5.7!) USER MOD Single : A 68 ASN : amide:sc= -0.036 K(o=-0.036,f=-6.6!) USER MOD Single : A 73 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : A 75 TYR OH : rot 165:sc= -0.756 USER MOD Single : A 84 MET CE :methyl -160:sc= -0.625 (180deg=-1.49!) USER MOD Single : A 87 ASN : amide:sc= -4.63! K(o=-4.6!,f=-2.6) USER MOD Single : A 97 GLN : amide:sc= -4.82! C(o=-4.8!,f=-4.3!) USER MOD Single : A 100 LYS NZ :NH3+ -163:sc= -0.0191 (180deg=-0.263) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET CE :methyl -156:sc= -0.151 (180deg=-0.992) USER MOD Single : B 1 MET N :NH3+ -168:sc= -0.142 (180deg=-0.406) USER MOD Single : B 3 CYS SG : rot 133:sc= -0.11 USER MOD Single : B 7 LYS NZ :NH3+ 155:sc= -0.238 (180deg=-1.21!) USER MOD Single : B 12 MET CE :methyl 159:sc= -0.182 (180deg=-1.37!) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot 180:sc= 0 USER MOD Single : B 17 HIS : no HD1:sc= -0.0367 X(o=-0.037,f=-0.41) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 145:sc= -2.92! USER MOD Single : B 20 SER OG : rot -136:sc= 0.193 USER MOD Single : B 22 LYS NZ :NH3+ -171:sc= 0.937 (180deg=0.729) USER MOD Single : B 26 LYS NZ :NH3+ 154:sc= -0.286 (180deg=-1.36!) USER MOD Single : B 28 LYS NZ :NH3+ -112:sc= -0.0847 (180deg=-0.731) USER MOD Single : B 30 ASN : amide:sc= -1.81! X(o=-1.8!,f=-1.5) USER MOD Single : B 31 LYS NZ :NH3+ -176:sc= -1.29 (180deg=-1.37) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 148:sc= -0.041 (180deg=-0.542) USER MOD Single : B 39 THR OG1 : rot 79:sc= 0.907 USER MOD Single : B 44 SER OG : rot 180:sc= -0.0722 USER MOD Single : B 48 LYS NZ :NH3+ 159:sc= -0.0712 (180deg=-0.677) USER MOD Single : B 50 THR OG1 : rot 180:sc= 0 USER MOD Single : B 56 GLN : amide:sc= -0.431 X(o=-0.43,f=-0.28) USER MOD Single : B 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 61 ASN : amide:sc= -0.788 K(o=-0.79,f=-1.5) USER MOD Single : B 64 SER OG : rot 180:sc= -0.323 USER MOD Single : B 65 ASN : amide:sc= -0.553 K(o=-0.55,f=-5.5!) USER MOD Single : B 68 ASN : amide:sc= -0.0195 K(o=-0.019,f=-6.5!) USER MOD Single : B 73 GLN : amide:sc=-0.00977 K(o=-0.0098,f=-1.8!) USER MOD Single : B 75 TYR OH : rot 165:sc= -0.502 USER MOD Single : B 84 MET CE :methyl -157:sc= -0.527 (180deg=-1.37) USER MOD Single : B 87 ASN : amide:sc= -4.34! K(o=-4.3!,f=-2.5) USER MOD Single : B 97 GLN : amide:sc= -4.86! C(o=-4.9!,f=-4.3!) USER MOD Single : B 100 LYS NZ :NH3+ -162:sc= -0.0235 (180deg=-0.307) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 79.155 4.946 -19.511 1.00 0.00 N ATOM 2 CA MET A 1 78.287 5.847 -18.705 1.00 0.00 C ATOM 3 C MET A 1 76.975 5.129 -18.388 1.00 0.00 C ATOM 4 O MET A 1 76.220 5.543 -17.532 1.00 0.00 O ATOM 5 CB MET A 1 77.992 7.120 -19.503 1.00 0.00 C ATOM 6 CG MET A 1 79.272 7.949 -19.634 1.00 0.00 C ATOM 7 SD MET A 1 78.902 9.513 -20.469 1.00 0.00 S ATOM 8 CE MET A 1 78.443 8.826 -22.080 1.00 0.00 C ATOM 0 H1 MET A 1 80.120 5.332 -19.543 1.00 0.00 H new ATOM 0 H2 MET A 1 79.174 4.002 -19.076 1.00 0.00 H new ATOM 0 H3 MET A 1 78.778 4.874 -20.478 1.00 0.00 H new ATOM 0 HA MET A 1 78.794 6.111 -17.777 1.00 0.00 H new ATOM 0 HB2 MET A 1 77.610 6.862 -20.491 1.00 0.00 H new ATOM 0 HB3 MET A 1 77.218 7.703 -19.004 1.00 0.00 H new ATOM 0 HG2 MET A 1 79.694 8.143 -18.648 1.00 0.00 H new ATOM 0 HG3 MET A 1 80.021 7.393 -20.198 1.00 0.00 H new ATOM 0 HE1 MET A 1 78.587 9.582 -22.852 1.00 0.00 H new ATOM 0 HE2 MET A 1 79.068 7.960 -22.298 1.00 0.00 H new ATOM 0 HE3 MET A 1 77.396 8.522 -22.061 1.00 0.00 H new ATOM 20 N ALA A 2 76.698 4.053 -19.075 1.00 0.00 N ATOM 21 CA ALA A 2 75.435 3.307 -18.817 1.00 0.00 C ATOM 22 C ALA A 2 75.410 2.831 -17.363 1.00 0.00 C ATOM 23 O ALA A 2 74.434 3.006 -16.661 1.00 0.00 O ATOM 24 CB ALA A 2 75.363 2.095 -19.751 1.00 0.00 C ATOM 0 H ALA A 2 77.293 3.659 -19.804 1.00 0.00 H new ATOM 0 HA ALA A 2 74.582 3.961 -18.999 1.00 0.00 H new ATOM 0 HB1 ALA A 2 74.440 1.547 -19.565 1.00 0.00 H new ATOM 0 HB2 ALA A 2 75.382 2.433 -20.787 1.00 0.00 H new ATOM 0 HB3 ALA A 2 76.216 1.442 -19.566 1.00 0.00 H new ATOM 30 N CYS A 3 76.476 2.236 -16.901 1.00 0.00 N ATOM 31 CA CYS A 3 76.504 1.758 -15.489 1.00 0.00 C ATOM 32 C CYS A 3 77.941 1.391 -15.089 1.00 0.00 C ATOM 33 O CYS A 3 78.237 0.240 -14.838 1.00 0.00 O ATOM 34 CB CYS A 3 75.608 0.523 -15.359 1.00 0.00 C ATOM 35 SG CYS A 3 75.964 -0.628 -16.710 1.00 0.00 S ATOM 0 H CYS A 3 77.326 2.061 -17.438 1.00 0.00 H new ATOM 0 HA CYS A 3 76.142 2.549 -14.832 1.00 0.00 H new ATOM 0 HB2 CYS A 3 75.779 0.037 -14.399 1.00 0.00 H new ATOM 0 HB3 CYS A 3 74.559 0.818 -15.385 1.00 0.00 H new ATOM 0 HG CYS A 3 76.082 -1.832 -16.234 1.00 0.00 H new ATOM 41 N PRO A 4 78.831 2.355 -15.024 1.00 0.00 N ATOM 42 CA PRO A 4 80.242 2.069 -14.640 1.00 0.00 C ATOM 43 C PRO A 4 80.367 1.663 -13.162 1.00 0.00 C ATOM 44 O PRO A 4 81.275 0.952 -12.781 1.00 0.00 O ATOM 45 CB PRO A 4 80.947 3.410 -14.930 1.00 0.00 C ATOM 46 CG PRO A 4 79.864 4.483 -15.169 1.00 0.00 C ATOM 47 CD PRO A 4 78.502 3.778 -15.324 1.00 0.00 C ATOM 0 HA PRO A 4 80.673 1.228 -15.184 1.00 0.00 H new ATOM 0 HB2 PRO A 4 81.584 3.693 -14.092 1.00 0.00 H new ATOM 0 HB3 PRO A 4 81.592 3.319 -15.804 1.00 0.00 H new ATOM 0 HG2 PRO A 4 79.835 5.184 -14.335 1.00 0.00 H new ATOM 0 HG3 PRO A 4 80.095 5.061 -16.063 1.00 0.00 H new ATOM 0 HD2 PRO A 4 77.759 4.176 -14.632 1.00 0.00 H new ATOM 0 HD3 PRO A 4 78.097 3.896 -16.329 1.00 0.00 H new ATOM 55 N LEU A 5 79.456 2.096 -12.338 1.00 0.00 N ATOM 56 CA LEU A 5 79.517 1.726 -10.895 1.00 0.00 C ATOM 57 C LEU A 5 79.443 0.204 -10.776 1.00 0.00 C ATOM 58 O LEU A 5 79.994 -0.387 -9.869 1.00 0.00 O ATOM 59 CB LEU A 5 78.332 2.360 -10.154 1.00 0.00 C ATOM 60 CG LEU A 5 78.345 1.956 -8.670 1.00 0.00 C ATOM 61 CD1 LEU A 5 79.642 2.436 -7.997 1.00 0.00 C ATOM 62 CD2 LEU A 5 77.134 2.586 -7.974 1.00 0.00 C ATOM 0 H LEU A 5 78.670 2.691 -12.600 1.00 0.00 H new ATOM 0 HA LEU A 5 80.447 2.087 -10.456 1.00 0.00 H new ATOM 0 HB2 LEU A 5 78.380 3.445 -10.242 1.00 0.00 H new ATOM 0 HB3 LEU A 5 77.396 2.044 -10.615 1.00 0.00 H new ATOM 0 HG LEU A 5 78.296 0.870 -8.590 1.00 0.00 H new ATOM 0 HD11 LEU A 5 79.637 2.143 -6.947 1.00 0.00 H new ATOM 0 HD12 LEU A 5 80.499 1.984 -8.496 1.00 0.00 H new ATOM 0 HD13 LEU A 5 79.710 3.521 -8.070 1.00 0.00 H new ATOM 0 HD21 LEU A 5 77.133 2.306 -6.921 1.00 0.00 H new ATOM 0 HD22 LEU A 5 77.188 3.671 -8.061 1.00 0.00 H new ATOM 0 HD23 LEU A 5 76.218 2.230 -8.445 1.00 0.00 H new ATOM 74 N GLU A 6 78.749 -0.433 -11.676 1.00 0.00 N ATOM 75 CA GLU A 6 78.618 -1.916 -11.609 1.00 0.00 C ATOM 76 C GLU A 6 79.997 -2.576 -11.692 1.00 0.00 C ATOM 77 O GLU A 6 80.326 -3.444 -10.908 1.00 0.00 O ATOM 78 CB GLU A 6 77.778 -2.389 -12.799 1.00 0.00 C ATOM 79 CG GLU A 6 77.490 -3.886 -12.655 1.00 0.00 C ATOM 80 CD GLU A 6 76.650 -4.367 -13.840 1.00 0.00 C ATOM 81 OE1 GLU A 6 76.174 -3.526 -14.583 1.00 0.00 O ATOM 82 OE2 GLU A 6 76.502 -5.571 -13.984 1.00 0.00 O ATOM 0 H GLU A 6 78.265 0.010 -12.457 1.00 0.00 H new ATOM 0 HA GLU A 6 78.145 -2.191 -10.666 1.00 0.00 H new ATOM 0 HB2 GLU A 6 76.843 -1.830 -12.843 1.00 0.00 H new ATOM 0 HB3 GLU A 6 78.308 -2.198 -13.732 1.00 0.00 H new ATOM 0 HG2 GLU A 6 78.426 -4.443 -12.610 1.00 0.00 H new ATOM 0 HG3 GLU A 6 76.961 -4.076 -11.721 1.00 0.00 H new ATOM 89 N LYS A 7 80.811 -2.173 -12.627 1.00 0.00 N ATOM 90 CA LYS A 7 82.162 -2.784 -12.737 1.00 0.00 C ATOM 91 C LYS A 7 82.997 -2.326 -11.550 1.00 0.00 C ATOM 92 O LYS A 7 83.656 -3.109 -10.901 1.00 0.00 O ATOM 93 CB LYS A 7 82.822 -2.350 -14.049 1.00 0.00 C ATOM 94 CG LYS A 7 84.213 -2.988 -14.160 1.00 0.00 C ATOM 95 CD LYS A 7 84.773 -2.808 -15.581 1.00 0.00 C ATOM 96 CE LYS A 7 85.312 -1.387 -15.762 1.00 0.00 C ATOM 97 NZ LYS A 7 86.396 -1.135 -14.773 1.00 0.00 N ATOM 0 H LYS A 7 80.600 -1.451 -13.316 1.00 0.00 H new ATOM 0 HA LYS A 7 82.084 -3.871 -12.734 1.00 0.00 H new ATOM 0 HB2 LYS A 7 82.204 -2.650 -14.895 1.00 0.00 H new ATOM 0 HB3 LYS A 7 82.905 -1.264 -14.084 1.00 0.00 H new ATOM 0 HG2 LYS A 7 84.888 -2.532 -13.436 1.00 0.00 H new ATOM 0 HG3 LYS A 7 84.154 -4.049 -13.917 1.00 0.00 H new ATOM 0 HD2 LYS A 7 85.568 -3.532 -15.761 1.00 0.00 H new ATOM 0 HD3 LYS A 7 83.992 -3.004 -16.315 1.00 0.00 H new ATOM 0 HE2 LYS A 7 85.693 -1.258 -16.775 1.00 0.00 H new ATOM 0 HE3 LYS A 7 84.509 -0.663 -15.629 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 87.204 -0.686 -15.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 86.043 -0.506 -14.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 86.700 -2.037 -14.354 1.00 0.00 H new ATOM 111 N ALA A 8 82.948 -1.066 -11.232 1.00 0.00 N ATOM 112 CA ALA A 8 83.718 -0.592 -10.061 1.00 0.00 C ATOM 113 C ALA A 8 83.196 -1.351 -8.852 1.00 0.00 C ATOM 114 O ALA A 8 83.943 -1.803 -8.009 1.00 0.00 O ATOM 115 CB ALA A 8 83.518 0.904 -9.875 1.00 0.00 C ATOM 0 H ALA A 8 82.413 -0.353 -11.728 1.00 0.00 H new ATOM 0 HA ALA A 8 84.785 -0.768 -10.196 1.00 0.00 H new ATOM 0 HB1 ALA A 8 84.089 1.243 -9.010 1.00 0.00 H new ATOM 0 HB2 ALA A 8 83.861 1.430 -10.766 1.00 0.00 H new ATOM 0 HB3 ALA A 8 82.460 1.113 -9.715 1.00 0.00 H new ATOM 121 N LEU A 9 81.909 -1.540 -8.789 1.00 0.00 N ATOM 122 CA LEU A 9 81.344 -2.328 -7.671 1.00 0.00 C ATOM 123 C LEU A 9 81.974 -3.707 -7.764 1.00 0.00 C ATOM 124 O LEU A 9 82.356 -4.306 -6.777 1.00 0.00 O ATOM 125 CB LEU A 9 79.817 -2.421 -7.810 1.00 0.00 C ATOM 126 CG LEU A 9 79.214 -3.237 -6.655 1.00 0.00 C ATOM 127 CD1 LEU A 9 79.336 -2.464 -5.331 1.00 0.00 C ATOM 128 CD2 LEU A 9 77.737 -3.501 -6.960 1.00 0.00 C ATOM 0 H LEU A 9 81.230 -1.183 -9.462 1.00 0.00 H new ATOM 0 HA LEU A 9 81.554 -1.865 -6.707 1.00 0.00 H new ATOM 0 HB2 LEU A 9 79.386 -1.420 -7.818 1.00 0.00 H new ATOM 0 HB3 LEU A 9 79.561 -2.886 -8.762 1.00 0.00 H new ATOM 0 HG LEU A 9 79.754 -4.179 -6.557 1.00 0.00 H new ATOM 0 HD11 LEU A 9 78.904 -3.055 -4.523 1.00 0.00 H new ATOM 0 HD12 LEU A 9 80.387 -2.271 -5.118 1.00 0.00 H new ATOM 0 HD13 LEU A 9 78.803 -1.517 -5.412 1.00 0.00 H new ATOM 0 HD21 LEU A 9 77.296 -4.080 -6.148 1.00 0.00 H new ATOM 0 HD22 LEU A 9 77.210 -2.552 -7.057 1.00 0.00 H new ATOM 0 HD23 LEU A 9 77.652 -4.060 -7.892 1.00 0.00 H new ATOM 140 N ASP A 10 82.115 -4.201 -8.965 1.00 0.00 N ATOM 141 CA ASP A 10 82.755 -5.525 -9.146 1.00 0.00 C ATOM 142 C ASP A 10 84.230 -5.398 -8.763 1.00 0.00 C ATOM 143 O ASP A 10 84.812 -6.299 -8.197 1.00 0.00 O ATOM 144 CB ASP A 10 82.626 -5.977 -10.603 1.00 0.00 C ATOM 145 CG ASP A 10 83.040 -7.444 -10.718 1.00 0.00 C ATOM 146 OD1 ASP A 10 83.594 -7.959 -9.762 1.00 0.00 O ATOM 147 OD2 ASP A 10 82.797 -8.026 -11.763 1.00 0.00 O ATOM 0 H ASP A 10 81.813 -3.742 -9.824 1.00 0.00 H new ATOM 0 HA ASP A 10 82.266 -6.267 -8.515 1.00 0.00 H new ATOM 0 HB2 ASP A 10 81.599 -5.850 -10.945 1.00 0.00 H new ATOM 0 HB3 ASP A 10 83.255 -5.359 -11.244 1.00 0.00 H new ATOM 152 N VAL A 11 84.845 -4.280 -9.066 1.00 0.00 N ATOM 153 CA VAL A 11 86.285 -4.110 -8.704 1.00 0.00 C ATOM 154 C VAL A 11 86.427 -4.232 -7.183 1.00 0.00 C ATOM 155 O VAL A 11 87.351 -4.839 -6.680 1.00 0.00 O ATOM 156 CB VAL A 11 86.785 -2.725 -9.148 1.00 0.00 C ATOM 157 CG1 VAL A 11 88.185 -2.467 -8.578 1.00 0.00 C ATOM 158 CG2 VAL A 11 86.826 -2.642 -10.683 1.00 0.00 C ATOM 0 H VAL A 11 84.417 -3.487 -9.543 1.00 0.00 H new ATOM 0 HA VAL A 11 86.877 -4.877 -9.204 1.00 0.00 H new ATOM 0 HB VAL A 11 86.098 -1.967 -8.771 1.00 0.00 H new ATOM 0 HG11 VAL A 11 88.532 -1.484 -8.897 1.00 0.00 H new ATOM 0 HG12 VAL A 11 88.147 -2.503 -7.489 1.00 0.00 H new ATOM 0 HG13 VAL A 11 88.872 -3.230 -8.942 1.00 0.00 H new ATOM 0 HG21 VAL A 11 87.182 -1.657 -10.985 1.00 0.00 H new ATOM 0 HG22 VAL A 11 87.500 -3.406 -11.071 1.00 0.00 H new ATOM 0 HG23 VAL A 11 85.825 -2.805 -11.083 1.00 0.00 H new ATOM 168 N MET A 12 85.509 -3.661 -6.451 1.00 0.00 N ATOM 169 CA MET A 12 85.576 -3.741 -4.965 1.00 0.00 C ATOM 170 C MET A 12 85.505 -5.205 -4.540 1.00 0.00 C ATOM 171 O MET A 12 86.206 -5.647 -3.651 1.00 0.00 O ATOM 172 CB MET A 12 84.383 -2.986 -4.371 1.00 0.00 C ATOM 173 CG MET A 12 84.557 -1.481 -4.596 1.00 0.00 C ATOM 174 SD MET A 12 82.947 -0.664 -4.454 1.00 0.00 S ATOM 175 CE MET A 12 82.425 -1.454 -2.915 1.00 0.00 C ATOM 0 H MET A 12 84.713 -3.141 -6.820 1.00 0.00 H new ATOM 0 HA MET A 12 86.507 -3.299 -4.611 1.00 0.00 H new ATOM 0 HB2 MET A 12 83.457 -3.328 -4.834 1.00 0.00 H new ATOM 0 HB3 MET A 12 84.302 -3.197 -3.305 1.00 0.00 H new ATOM 0 HG2 MET A 12 85.252 -1.070 -3.864 1.00 0.00 H new ATOM 0 HG3 MET A 12 84.986 -1.296 -5.581 1.00 0.00 H new ATOM 0 HE1 MET A 12 81.690 -0.824 -2.414 1.00 0.00 H new ATOM 0 HE2 MET A 12 81.981 -2.425 -3.137 1.00 0.00 H new ATOM 0 HE3 MET A 12 83.289 -1.590 -2.265 1.00 0.00 H new ATOM 185 N VAL A 13 84.648 -5.954 -5.167 1.00 0.00 N ATOM 186 CA VAL A 13 84.505 -7.394 -4.813 1.00 0.00 C ATOM 187 C VAL A 13 85.592 -8.222 -5.513 1.00 0.00 C ATOM 188 O VAL A 13 86.160 -9.128 -4.938 1.00 0.00 O ATOM 189 CB VAL A 13 83.117 -7.874 -5.250 1.00 0.00 C ATOM 190 CG1 VAL A 13 82.867 -9.284 -4.714 1.00 0.00 C ATOM 191 CG2 VAL A 13 82.050 -6.923 -4.695 1.00 0.00 C ATOM 0 H VAL A 13 84.035 -5.631 -5.915 1.00 0.00 H new ATOM 0 HA VAL A 13 84.617 -7.519 -3.736 1.00 0.00 H new ATOM 0 HB VAL A 13 83.066 -7.886 -6.339 1.00 0.00 H new ATOM 0 HG11 VAL A 13 81.879 -9.622 -5.027 1.00 0.00 H new ATOM 0 HG12 VAL A 13 83.624 -9.962 -5.107 1.00 0.00 H new ATOM 0 HG13 VAL A 13 82.919 -9.274 -3.625 1.00 0.00 H new ATOM 0 HG21 VAL A 13 81.062 -7.264 -5.005 1.00 0.00 H new ATOM 0 HG22 VAL A 13 82.104 -6.911 -3.606 1.00 0.00 H new ATOM 0 HG23 VAL A 13 82.224 -5.918 -5.078 1.00 0.00 H new ATOM 201 N SER A 14 85.877 -7.925 -6.755 1.00 0.00 N ATOM 202 CA SER A 14 86.919 -8.703 -7.495 1.00 0.00 C ATOM 203 C SER A 14 88.279 -8.554 -6.804 1.00 0.00 C ATOM 204 O SER A 14 88.989 -9.517 -6.598 1.00 0.00 O ATOM 205 CB SER A 14 87.027 -8.178 -8.928 1.00 0.00 C ATOM 206 OG SER A 14 87.892 -9.024 -9.675 1.00 0.00 O ATOM 0 H SER A 14 85.434 -7.178 -7.290 1.00 0.00 H new ATOM 0 HA SER A 14 86.633 -9.755 -7.505 1.00 0.00 H new ATOM 0 HB2 SER A 14 86.041 -8.147 -9.391 1.00 0.00 H new ATOM 0 HB3 SER A 14 87.410 -7.158 -8.926 1.00 0.00 H new ATOM 0 HG SER A 14 87.962 -8.691 -10.594 1.00 0.00 H new ATOM 212 N THR A 15 88.650 -7.350 -6.455 1.00 0.00 N ATOM 213 CA THR A 15 89.966 -7.132 -5.783 1.00 0.00 C ATOM 214 C THR A 15 90.004 -7.908 -4.464 1.00 0.00 C ATOM 215 O THR A 15 90.999 -8.502 -4.105 1.00 0.00 O ATOM 216 CB THR A 15 90.155 -5.627 -5.538 1.00 0.00 C ATOM 217 OG1 THR A 15 91.539 -5.338 -5.412 1.00 0.00 O ATOM 218 CG2 THR A 15 89.420 -5.181 -4.268 1.00 0.00 C ATOM 0 H THR A 15 88.097 -6.506 -6.607 1.00 0.00 H new ATOM 0 HA THR A 15 90.777 -7.493 -6.415 1.00 0.00 H new ATOM 0 HB THR A 15 89.738 -5.084 -6.386 1.00 0.00 H new ATOM 0 HG1 THR A 15 91.660 -4.378 -5.257 1.00 0.00 H new ATOM 0 HG21 THR A 15 89.570 -4.112 -4.117 1.00 0.00 H new ATOM 0 HG22 THR A 15 88.355 -5.387 -4.373 1.00 0.00 H new ATOM 0 HG23 THR A 15 89.812 -5.727 -3.410 1.00 0.00 H new ATOM 226 N PHE A 16 88.913 -7.909 -3.754 1.00 0.00 N ATOM 227 CA PHE A 16 88.843 -8.640 -2.451 1.00 0.00 C ATOM 228 C PHE A 16 89.125 -10.123 -2.683 1.00 0.00 C ATOM 229 O PHE A 16 89.789 -10.772 -1.900 1.00 0.00 O ATOM 230 CB PHE A 16 87.439 -8.466 -1.864 1.00 0.00 C ATOM 231 CG PHE A 16 87.325 -9.194 -0.544 1.00 0.00 C ATOM 232 CD1 PHE A 16 87.638 -8.536 0.651 1.00 0.00 C ATOM 233 CD2 PHE A 16 86.893 -10.526 -0.519 1.00 0.00 C ATOM 234 CE1 PHE A 16 87.517 -9.212 1.874 1.00 0.00 C ATOM 235 CE2 PHE A 16 86.775 -11.201 0.702 1.00 0.00 C ATOM 236 CZ PHE A 16 87.085 -10.544 1.898 1.00 0.00 C ATOM 0 H PHE A 16 88.053 -7.429 -4.021 1.00 0.00 H new ATOM 0 HA PHE A 16 89.584 -8.241 -1.759 1.00 0.00 H new ATOM 0 HB2 PHE A 16 87.226 -7.406 -1.722 1.00 0.00 H new ATOM 0 HB3 PHE A 16 86.696 -8.849 -2.563 1.00 0.00 H new ATOM 0 HD1 PHE A 16 87.972 -7.509 0.631 1.00 0.00 H new ATOM 0 HD2 PHE A 16 86.651 -11.033 -1.442 1.00 0.00 H new ATOM 0 HE1 PHE A 16 87.757 -8.705 2.797 1.00 0.00 H new ATOM 0 HE2 PHE A 16 86.445 -12.229 0.721 1.00 0.00 H new ATOM 0 HZ PHE A 16 86.991 -11.064 2.840 1.00 0.00 H new ATOM 246 N HIS A 17 88.630 -10.657 -3.754 1.00 0.00 N ATOM 247 CA HIS A 17 88.865 -12.092 -4.058 1.00 0.00 C ATOM 248 C HIS A 17 90.371 -12.338 -4.185 1.00 0.00 C ATOM 249 O HIS A 17 90.883 -13.349 -3.748 1.00 0.00 O ATOM 250 CB HIS A 17 88.170 -12.450 -5.373 1.00 0.00 C ATOM 251 CG HIS A 17 88.402 -13.902 -5.690 1.00 0.00 C ATOM 252 ND1 HIS A 17 89.478 -14.332 -6.455 1.00 0.00 N ATOM 253 CD2 HIS A 17 87.701 -15.034 -5.356 1.00 0.00 C ATOM 254 CE1 HIS A 17 89.394 -15.672 -6.553 1.00 0.00 C ATOM 255 NE2 HIS A 17 88.329 -16.146 -5.902 1.00 0.00 N ATOM 0 H HIS A 17 88.066 -10.158 -4.442 1.00 0.00 H new ATOM 0 HA HIS A 17 88.462 -12.712 -3.257 1.00 0.00 H new ATOM 0 HB2 HIS A 17 87.101 -12.251 -5.297 1.00 0.00 H new ATOM 0 HB3 HIS A 17 88.554 -11.826 -6.180 1.00 0.00 H new ATOM 0 HD2 HIS A 17 86.800 -15.056 -4.761 1.00 0.00 H new ATOM 0 HE1 HIS A 17 90.100 -16.287 -7.091 1.00 0.00 H new ATOM 0 HE2 HIS A 17 88.038 -17.120 -5.822 1.00 0.00 H new ATOM 264 N LYS A 18 91.083 -11.427 -4.793 1.00 0.00 N ATOM 265 CA LYS A 18 92.553 -11.618 -4.964 1.00 0.00 C ATOM 266 C LYS A 18 93.231 -11.748 -3.594 1.00 0.00 C ATOM 267 O LYS A 18 94.124 -12.552 -3.414 1.00 0.00 O ATOM 268 CB LYS A 18 93.140 -10.412 -5.705 1.00 0.00 C ATOM 269 CG LYS A 18 92.617 -10.366 -7.155 1.00 0.00 C ATOM 270 CD LYS A 18 93.485 -11.252 -8.075 1.00 0.00 C ATOM 271 CE LYS A 18 94.657 -10.436 -8.636 1.00 0.00 C ATOM 272 NZ LYS A 18 95.473 -11.294 -9.540 1.00 0.00 N ATOM 0 H LYS A 18 90.711 -10.559 -5.179 1.00 0.00 H new ATOM 0 HA LYS A 18 92.728 -12.528 -5.538 1.00 0.00 H new ATOM 0 HB2 LYS A 18 92.872 -9.492 -5.185 1.00 0.00 H new ATOM 0 HB3 LYS A 18 94.228 -10.472 -5.706 1.00 0.00 H new ATOM 0 HG2 LYS A 18 91.582 -10.706 -7.185 1.00 0.00 H new ATOM 0 HG3 LYS A 18 92.625 -9.338 -7.518 1.00 0.00 H new ATOM 0 HD2 LYS A 18 93.862 -12.110 -7.518 1.00 0.00 H new ATOM 0 HD3 LYS A 18 92.880 -11.644 -8.892 1.00 0.00 H new ATOM 0 HE2 LYS A 18 94.283 -9.569 -9.180 1.00 0.00 H new ATOM 0 HE3 LYS A 18 95.274 -10.058 -7.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 96.267 -10.741 -9.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 95.841 -12.108 -9.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 94.881 -11.633 -10.325 1.00 0.00 H new ATOM 286 N TYR A 19 92.819 -10.973 -2.625 1.00 0.00 N ATOM 287 CA TYR A 19 93.454 -11.082 -1.274 1.00 0.00 C ATOM 288 C TYR A 19 93.066 -12.416 -0.638 1.00 0.00 C ATOM 289 O TYR A 19 93.864 -13.072 0.000 1.00 0.00 O ATOM 290 CB TYR A 19 92.982 -9.941 -0.368 1.00 0.00 C ATOM 291 CG TYR A 19 93.658 -8.649 -0.767 1.00 0.00 C ATOM 292 CD1 TYR A 19 94.890 -8.300 -0.200 1.00 0.00 C ATOM 293 CD2 TYR A 19 93.061 -7.807 -1.707 1.00 0.00 C ATOM 294 CE1 TYR A 19 95.522 -7.112 -0.573 1.00 0.00 C ATOM 295 CE2 TYR A 19 93.695 -6.618 -2.084 1.00 0.00 C ATOM 296 CZ TYR A 19 94.924 -6.272 -1.516 1.00 0.00 C ATOM 297 OH TYR A 19 95.551 -5.105 -1.892 1.00 0.00 O ATOM 0 H TYR A 19 92.079 -10.276 -2.706 1.00 0.00 H new ATOM 0 HA TYR A 19 94.536 -11.021 -1.389 1.00 0.00 H new ATOM 0 HB2 TYR A 19 91.900 -9.832 -0.441 1.00 0.00 H new ATOM 0 HB3 TYR A 19 93.210 -10.174 0.672 1.00 0.00 H new ATOM 0 HD1 TYR A 19 95.352 -8.951 0.527 1.00 0.00 H new ATOM 0 HD2 TYR A 19 92.110 -8.073 -2.143 1.00 0.00 H new ATOM 0 HE1 TYR A 19 96.471 -6.843 -0.133 1.00 0.00 H new ATOM 0 HE2 TYR A 19 93.235 -5.968 -2.814 1.00 0.00 H new ATOM 0 HH TYR A 19 95.326 -4.898 -2.823 1.00 0.00 H new ATOM 307 N SER A 20 91.840 -12.810 -0.805 1.00 0.00 N ATOM 308 CA SER A 20 91.374 -14.093 -0.215 1.00 0.00 C ATOM 309 C SER A 20 92.281 -15.234 -0.687 1.00 0.00 C ATOM 310 O SER A 20 92.294 -16.306 -0.115 1.00 0.00 O ATOM 311 CB SER A 20 89.928 -14.344 -0.667 1.00 0.00 C ATOM 312 OG SER A 20 89.037 -13.776 0.284 1.00 0.00 O ATOM 0 H SER A 20 91.133 -12.295 -1.329 1.00 0.00 H new ATOM 0 HA SER A 20 91.413 -14.044 0.873 1.00 0.00 H new ATOM 0 HB2 SER A 20 89.760 -13.903 -1.650 1.00 0.00 H new ATOM 0 HB3 SER A 20 89.744 -15.414 -0.762 1.00 0.00 H new ATOM 0 HG SER A 20 88.331 -14.422 0.497 1.00 0.00 H new ATOM 318 N GLY A 21 93.024 -15.017 -1.734 1.00 0.00 N ATOM 319 CA GLY A 21 93.914 -16.101 -2.247 1.00 0.00 C ATOM 320 C GLY A 21 95.201 -16.182 -1.420 1.00 0.00 C ATOM 321 O GLY A 21 95.874 -17.191 -1.404 1.00 0.00 O ATOM 0 H GLY A 21 93.056 -14.142 -2.257 1.00 0.00 H new ATOM 0 HA2 GLY A 21 93.391 -17.056 -2.209 1.00 0.00 H new ATOM 0 HA3 GLY A 21 94.159 -15.913 -3.292 1.00 0.00 H new ATOM 325 N LYS A 22 95.559 -15.124 -0.749 1.00 0.00 N ATOM 326 CA LYS A 22 96.815 -15.140 0.053 1.00 0.00 C ATOM 327 C LYS A 22 96.659 -16.056 1.270 1.00 0.00 C ATOM 328 O LYS A 22 97.572 -16.769 1.638 1.00 0.00 O ATOM 329 CB LYS A 22 97.118 -13.722 0.530 1.00 0.00 C ATOM 330 CG LYS A 22 97.284 -12.800 -0.683 1.00 0.00 C ATOM 331 CD LYS A 22 98.003 -11.516 -0.264 1.00 0.00 C ATOM 332 CE LYS A 22 97.336 -10.924 0.980 1.00 0.00 C ATOM 333 NZ LYS A 22 97.718 -9.491 1.108 1.00 0.00 N ATOM 0 H LYS A 22 95.037 -14.248 -0.721 1.00 0.00 H new ATOM 0 HA LYS A 22 97.629 -15.513 -0.568 1.00 0.00 H new ATOM 0 HB2 LYS A 22 96.311 -13.361 1.167 1.00 0.00 H new ATOM 0 HB3 LYS A 22 98.027 -13.716 1.132 1.00 0.00 H new ATOM 0 HG2 LYS A 22 97.852 -13.308 -1.462 1.00 0.00 H new ATOM 0 HG3 LYS A 22 96.308 -12.560 -1.105 1.00 0.00 H new ATOM 0 HD2 LYS A 22 99.052 -11.728 -0.058 1.00 0.00 H new ATOM 0 HD3 LYS A 22 97.978 -10.793 -1.079 1.00 0.00 H new ATOM 0 HE2 LYS A 22 96.253 -11.018 0.906 1.00 0.00 H new ATOM 0 HE3 LYS A 22 97.644 -11.475 1.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 97.266 -9.085 1.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 98.751 -9.414 1.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 97.404 -8.971 0.264 1.00 0.00 H new ATOM 347 N GLU A 23 95.515 -16.030 1.907 1.00 0.00 N ATOM 348 CA GLU A 23 95.293 -16.886 3.118 1.00 0.00 C ATOM 349 C GLU A 23 94.400 -18.071 2.770 1.00 0.00 C ATOM 350 O GLU A 23 93.680 -18.058 1.792 1.00 0.00 O ATOM 351 CB GLU A 23 94.615 -16.054 4.210 1.00 0.00 C ATOM 352 CG GLU A 23 95.649 -15.142 4.865 1.00 0.00 C ATOM 353 CD GLU A 23 94.979 -14.307 5.956 1.00 0.00 C ATOM 354 OE1 GLU A 23 94.805 -14.825 7.047 1.00 0.00 O ATOM 355 OE2 GLU A 23 94.656 -13.162 5.685 1.00 0.00 O ATOM 0 H GLU A 23 94.719 -15.450 1.640 1.00 0.00 H new ATOM 0 HA GLU A 23 96.256 -17.254 3.471 1.00 0.00 H new ATOM 0 HB2 GLU A 23 93.808 -15.459 3.782 1.00 0.00 H new ATOM 0 HB3 GLU A 23 94.166 -16.709 4.957 1.00 0.00 H new ATOM 0 HG2 GLU A 23 96.455 -15.738 5.293 1.00 0.00 H new ATOM 0 HG3 GLU A 23 96.098 -14.488 4.117 1.00 0.00 H new ATOM 362 N GLY A 24 94.442 -19.094 3.575 1.00 0.00 N ATOM 363 CA GLY A 24 93.598 -20.283 3.307 1.00 0.00 C ATOM 364 C GLY A 24 92.140 -19.947 3.628 1.00 0.00 C ATOM 365 O GLY A 24 91.238 -20.696 3.312 1.00 0.00 O ATOM 0 H GLY A 24 95.027 -19.155 4.408 1.00 0.00 H new ATOM 0 HA2 GLY A 24 93.693 -20.584 2.264 1.00 0.00 H new ATOM 0 HA3 GLY A 24 93.932 -21.125 3.913 1.00 0.00 H new ATOM 369 N ASP A 25 91.901 -18.816 4.247 1.00 0.00 N ATOM 370 CA ASP A 25 90.498 -18.419 4.581 1.00 0.00 C ATOM 371 C ASP A 25 90.000 -17.453 3.506 1.00 0.00 C ATOM 372 O ASP A 25 90.424 -16.316 3.437 1.00 0.00 O ATOM 373 CB ASP A 25 90.477 -17.721 5.945 1.00 0.00 C ATOM 374 CG ASP A 25 90.870 -18.720 7.035 1.00 0.00 C ATOM 375 OD1 ASP A 25 90.915 -19.901 6.739 1.00 0.00 O ATOM 376 OD2 ASP A 25 91.126 -18.284 8.147 1.00 0.00 O ATOM 0 H ASP A 25 92.618 -18.150 4.535 1.00 0.00 H new ATOM 0 HA ASP A 25 89.857 -19.300 4.620 1.00 0.00 H new ATOM 0 HB2 ASP A 25 91.167 -16.877 5.944 1.00 0.00 H new ATOM 0 HB3 ASP A 25 89.483 -17.320 6.145 1.00 0.00 H new ATOM 381 N LYS A 26 89.119 -17.904 2.652 1.00 0.00 N ATOM 382 CA LYS A 26 88.607 -17.022 1.557 1.00 0.00 C ATOM 383 C LYS A 26 87.277 -16.388 1.960 1.00 0.00 C ATOM 384 O LYS A 26 86.688 -15.637 1.208 1.00 0.00 O ATOM 385 CB LYS A 26 88.390 -17.866 0.297 1.00 0.00 C ATOM 386 CG LYS A 26 89.726 -18.458 -0.167 1.00 0.00 C ATOM 387 CD LYS A 26 89.492 -19.464 -1.308 1.00 0.00 C ATOM 388 CE LYS A 26 89.268 -18.725 -2.631 1.00 0.00 C ATOM 389 NZ LYS A 26 90.426 -17.829 -2.905 1.00 0.00 N ATOM 0 H LYS A 26 88.730 -18.847 2.664 1.00 0.00 H new ATOM 0 HA LYS A 26 89.336 -16.233 1.369 1.00 0.00 H new ATOM 0 HB2 LYS A 26 87.679 -18.666 0.502 1.00 0.00 H new ATOM 0 HB3 LYS A 26 87.960 -17.252 -0.494 1.00 0.00 H new ATOM 0 HG2 LYS A 26 90.388 -17.661 -0.505 1.00 0.00 H new ATOM 0 HG3 LYS A 26 90.223 -18.952 0.668 1.00 0.00 H new ATOM 0 HD2 LYS A 26 90.350 -20.130 -1.396 1.00 0.00 H new ATOM 0 HD3 LYS A 26 88.627 -20.087 -1.081 1.00 0.00 H new ATOM 0 HE2 LYS A 26 89.149 -19.441 -3.444 1.00 0.00 H new ATOM 0 HE3 LYS A 26 88.348 -18.143 -2.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 90.660 -17.864 -3.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 90.181 -16.854 -2.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 91.247 -18.143 -2.349 1.00 0.00 H new ATOM 403 N PHE A 27 86.790 -16.689 3.132 1.00 0.00 N ATOM 404 CA PHE A 27 85.485 -16.110 3.574 1.00 0.00 C ATOM 405 C PHE A 27 85.727 -14.890 4.468 1.00 0.00 C ATOM 406 O PHE A 27 84.795 -14.280 4.953 1.00 0.00 O ATOM 407 CB PHE A 27 84.712 -17.168 4.366 1.00 0.00 C ATOM 408 CG PHE A 27 84.452 -18.369 3.486 1.00 0.00 C ATOM 409 CD1 PHE A 27 83.293 -18.430 2.699 1.00 0.00 C ATOM 410 CD2 PHE A 27 85.371 -19.425 3.462 1.00 0.00 C ATOM 411 CE1 PHE A 27 83.056 -19.548 1.889 1.00 0.00 C ATOM 412 CE2 PHE A 27 85.134 -20.542 2.652 1.00 0.00 C ATOM 413 CZ PHE A 27 83.976 -20.603 1.865 1.00 0.00 C ATOM 0 H PHE A 27 87.238 -17.311 3.805 1.00 0.00 H new ATOM 0 HA PHE A 27 84.913 -15.803 2.698 1.00 0.00 H new ATOM 0 HB2 PHE A 27 85.281 -17.466 5.247 1.00 0.00 H new ATOM 0 HB3 PHE A 27 83.769 -16.754 4.722 1.00 0.00 H new ATOM 0 HD1 PHE A 27 82.584 -17.616 2.717 1.00 0.00 H new ATOM 0 HD2 PHE A 27 86.263 -19.378 4.069 1.00 0.00 H new ATOM 0 HE1 PHE A 27 82.163 -19.596 1.283 1.00 0.00 H new ATOM 0 HE2 PHE A 27 85.843 -21.356 2.634 1.00 0.00 H new ATOM 0 HZ PHE A 27 83.793 -21.464 1.240 1.00 0.00 H new ATOM 423 N LYS A 28 86.961 -14.532 4.713 1.00 0.00 N ATOM 424 CA LYS A 28 87.211 -13.358 5.603 1.00 0.00 C ATOM 425 C LYS A 28 88.640 -12.824 5.432 1.00 0.00 C ATOM 426 O LYS A 28 89.490 -13.469 4.852 1.00 0.00 O ATOM 427 CB LYS A 28 87.006 -13.797 7.050 1.00 0.00 C ATOM 428 CG LYS A 28 87.965 -14.947 7.373 1.00 0.00 C ATOM 429 CD LYS A 28 87.731 -15.428 8.806 1.00 0.00 C ATOM 430 CE LYS A 28 88.756 -16.509 9.152 1.00 0.00 C ATOM 431 NZ LYS A 28 90.127 -15.934 9.057 1.00 0.00 N ATOM 0 H LYS A 28 87.793 -14.992 4.343 1.00 0.00 H new ATOM 0 HA LYS A 28 86.518 -12.559 5.337 1.00 0.00 H new ATOM 0 HB2 LYS A 28 87.184 -12.960 7.725 1.00 0.00 H new ATOM 0 HB3 LYS A 28 85.975 -14.115 7.203 1.00 0.00 H new ATOM 0 HG2 LYS A 28 87.811 -15.769 6.674 1.00 0.00 H new ATOM 0 HG3 LYS A 28 88.997 -14.617 7.254 1.00 0.00 H new ATOM 0 HD2 LYS A 28 87.818 -14.593 9.501 1.00 0.00 H new ATOM 0 HD3 LYS A 28 86.720 -15.823 8.908 1.00 0.00 H new ATOM 0 HE2 LYS A 28 88.577 -16.888 10.158 1.00 0.00 H new ATOM 0 HE3 LYS A 28 88.655 -17.354 8.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 90.675 -16.459 8.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 90.065 -14.934 8.778 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 90.599 -16.007 9.981 1.00 0.00 H new ATOM 445 N LEU A 29 88.907 -11.647 5.960 1.00 0.00 N ATOM 446 CA LEU A 29 90.279 -11.047 5.868 1.00 0.00 C ATOM 447 C LEU A 29 90.706 -10.603 7.274 1.00 0.00 C ATOM 448 O LEU A 29 89.892 -10.468 8.165 1.00 0.00 O ATOM 449 CB LEU A 29 90.259 -9.822 4.915 1.00 0.00 C ATOM 450 CG LEU A 29 91.186 -10.037 3.710 1.00 0.00 C ATOM 451 CD1 LEU A 29 90.578 -11.064 2.755 1.00 0.00 C ATOM 452 CD2 LEU A 29 91.367 -8.700 2.983 1.00 0.00 C ATOM 0 H LEU A 29 88.224 -11.073 6.455 1.00 0.00 H new ATOM 0 HA LEU A 29 90.982 -11.782 5.475 1.00 0.00 H new ATOM 0 HB2 LEU A 29 89.241 -9.646 4.567 1.00 0.00 H new ATOM 0 HB3 LEU A 29 90.568 -8.930 5.460 1.00 0.00 H new ATOM 0 HG LEU A 29 92.151 -10.409 4.053 1.00 0.00 H new ATOM 0 HD11 LEU A 29 91.244 -11.209 1.904 1.00 0.00 H new ATOM 0 HD12 LEU A 29 90.445 -12.012 3.277 1.00 0.00 H new ATOM 0 HD13 LEU A 29 89.611 -10.705 2.402 1.00 0.00 H new ATOM 0 HD21 LEU A 29 92.024 -8.839 2.124 1.00 0.00 H new ATOM 0 HD22 LEU A 29 90.397 -8.336 2.643 1.00 0.00 H new ATOM 0 HD23 LEU A 29 91.809 -7.972 3.664 1.00 0.00 H new ATOM 464 N ASN A 30 91.979 -10.380 7.471 1.00 0.00 N ATOM 465 CA ASN A 30 92.482 -9.939 8.805 1.00 0.00 C ATOM 466 C ASN A 30 92.733 -8.425 8.787 1.00 0.00 C ATOM 467 O ASN A 30 93.276 -7.877 7.850 1.00 0.00 O ATOM 468 CB ASN A 30 93.790 -10.667 9.123 1.00 0.00 C ATOM 469 CG ASN A 30 93.523 -12.170 9.249 1.00 0.00 C ATOM 470 OD1 ASN A 30 92.615 -12.581 9.943 1.00 0.00 O ATOM 471 ND2 ASN A 30 94.285 -13.012 8.607 1.00 0.00 N ATOM 0 H ASN A 30 92.699 -10.486 6.756 1.00 0.00 H new ATOM 0 HA ASN A 30 91.739 -10.174 9.567 1.00 0.00 H new ATOM 0 HB2 ASN A 30 94.522 -10.482 8.337 1.00 0.00 H new ATOM 0 HB3 ASN A 30 94.215 -10.284 10.051 1.00 0.00 H new ATOM 0 HD21 ASN A 30 94.118 -14.015 8.688 1.00 0.00 H new ATOM 0 HD22 ASN A 30 95.048 -12.667 8.024 1.00 0.00 H new ATOM 478 N LYS A 31 92.333 -7.759 9.832 1.00 0.00 N ATOM 479 CA LYS A 31 92.518 -6.285 9.936 1.00 0.00 C ATOM 480 C LYS A 31 93.913 -5.884 9.459 1.00 0.00 C ATOM 481 O LYS A 31 94.121 -4.811 8.947 1.00 0.00 O ATOM 482 CB LYS A 31 92.346 -5.867 11.405 1.00 0.00 C ATOM 483 CG LYS A 31 93.334 -6.629 12.299 1.00 0.00 C ATOM 484 CD LYS A 31 93.236 -6.103 13.737 1.00 0.00 C ATOM 485 CE LYS A 31 94.231 -6.848 14.630 1.00 0.00 C ATOM 486 NZ LYS A 31 93.996 -8.314 14.528 1.00 0.00 N ATOM 0 H LYS A 31 91.875 -8.184 10.638 1.00 0.00 H new ATOM 0 HA LYS A 31 91.778 -5.787 9.309 1.00 0.00 H new ATOM 0 HB2 LYS A 31 92.508 -4.794 11.505 1.00 0.00 H new ATOM 0 HB3 LYS A 31 91.325 -6.067 11.729 1.00 0.00 H new ATOM 0 HG2 LYS A 31 93.113 -7.696 12.275 1.00 0.00 H new ATOM 0 HG3 LYS A 31 94.350 -6.505 11.924 1.00 0.00 H new ATOM 0 HD2 LYS A 31 93.445 -5.033 13.758 1.00 0.00 H new ATOM 0 HD3 LYS A 31 92.223 -6.237 14.115 1.00 0.00 H new ATOM 0 HE2 LYS A 31 95.252 -6.612 14.330 1.00 0.00 H new ATOM 0 HE3 LYS A 31 94.120 -6.523 15.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 94.639 -8.814 15.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 93.011 -8.527 14.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 94.173 -8.627 13.552 1.00 0.00 H new ATOM 500 N SER A 32 94.869 -6.734 9.617 1.00 0.00 N ATOM 501 CA SER A 32 96.234 -6.386 9.164 1.00 0.00 C ATOM 502 C SER A 32 96.184 -6.143 7.671 1.00 0.00 C ATOM 503 O SER A 32 96.818 -5.250 7.145 1.00 0.00 O ATOM 504 CB SER A 32 97.206 -7.519 9.452 1.00 0.00 C ATOM 505 OG SER A 32 97.278 -7.741 10.853 1.00 0.00 O ATOM 0 H SER A 32 94.769 -7.657 10.040 1.00 0.00 H new ATOM 0 HA SER A 32 96.576 -5.498 9.696 1.00 0.00 H new ATOM 0 HB2 SER A 32 96.881 -8.428 8.946 1.00 0.00 H new ATOM 0 HB3 SER A 32 98.193 -7.273 9.062 1.00 0.00 H new ATOM 0 HG SER A 32 97.904 -8.473 11.037 1.00 0.00 H new ATOM 511 N GLU A 33 95.425 -6.943 6.982 1.00 0.00 N ATOM 512 CA GLU A 33 95.326 -6.767 5.518 1.00 0.00 C ATOM 513 C GLU A 33 94.810 -5.381 5.258 1.00 0.00 C ATOM 514 O GLU A 33 95.101 -4.797 4.243 1.00 0.00 O ATOM 515 CB GLU A 33 94.383 -7.813 4.920 1.00 0.00 C ATOM 516 CG GLU A 33 95.029 -9.200 5.018 1.00 0.00 C ATOM 517 CD GLU A 33 96.279 -9.256 4.138 1.00 0.00 C ATOM 518 OE1 GLU A 33 96.180 -8.896 2.977 1.00 0.00 O ATOM 519 OE2 GLU A 33 97.316 -9.653 4.643 1.00 0.00 O ATOM 0 H GLU A 33 94.872 -7.707 7.371 1.00 0.00 H new ATOM 0 HA GLU A 33 96.302 -6.898 5.052 1.00 0.00 H new ATOM 0 HB2 GLU A 33 93.431 -7.805 5.451 1.00 0.00 H new ATOM 0 HB3 GLU A 33 94.169 -7.572 3.879 1.00 0.00 H new ATOM 0 HG2 GLU A 33 95.293 -9.415 6.053 1.00 0.00 H new ATOM 0 HG3 GLU A 33 94.318 -9.965 4.704 1.00 0.00 H new ATOM 526 N LEU A 34 94.089 -4.809 6.174 1.00 0.00 N ATOM 527 CA LEU A 34 93.646 -3.417 5.908 1.00 0.00 C ATOM 528 C LEU A 34 94.908 -2.577 5.773 1.00 0.00 C ATOM 529 O LEU A 34 95.011 -1.727 4.915 1.00 0.00 O ATOM 530 CB LEU A 34 92.762 -2.887 7.054 1.00 0.00 C ATOM 531 CG LEU A 34 92.353 -1.405 6.842 1.00 0.00 C ATOM 532 CD1 LEU A 34 93.526 -0.437 7.173 1.00 0.00 C ATOM 533 CD2 LEU A 34 91.884 -1.192 5.396 1.00 0.00 C ATOM 0 H LEU A 34 93.796 -5.222 7.060 1.00 0.00 H new ATOM 0 HA LEU A 34 93.043 -3.372 5.001 1.00 0.00 H new ATOM 0 HB2 LEU A 34 91.865 -3.502 7.133 1.00 0.00 H new ATOM 0 HB3 LEU A 34 93.298 -2.983 7.998 1.00 0.00 H new ATOM 0 HG LEU A 34 91.533 -1.181 7.525 1.00 0.00 H new ATOM 0 HD11 LEU A 34 93.204 0.592 7.014 1.00 0.00 H new ATOM 0 HD12 LEU A 34 93.823 -0.567 8.214 1.00 0.00 H new ATOM 0 HD13 LEU A 34 94.374 -0.657 6.524 1.00 0.00 H new ATOM 0 HD21 LEU A 34 91.599 -0.149 5.256 1.00 0.00 H new ATOM 0 HD22 LEU A 34 92.694 -1.442 4.710 1.00 0.00 H new ATOM 0 HD23 LEU A 34 91.026 -1.833 5.194 1.00 0.00 H new ATOM 545 N LYS A 35 95.887 -2.834 6.599 1.00 0.00 N ATOM 546 CA LYS A 35 97.149 -2.064 6.491 1.00 0.00 C ATOM 547 C LYS A 35 97.900 -2.475 5.222 1.00 0.00 C ATOM 548 O LYS A 35 98.295 -1.644 4.430 1.00 0.00 O ATOM 549 CB LYS A 35 98.013 -2.342 7.721 1.00 0.00 C ATOM 550 CG LYS A 35 99.291 -1.508 7.662 1.00 0.00 C ATOM 551 CD LYS A 35 100.133 -1.805 8.899 1.00 0.00 C ATOM 552 CE LYS A 35 101.418 -0.985 8.848 1.00 0.00 C ATOM 553 NZ LYS A 35 101.084 0.464 8.926 1.00 0.00 N ATOM 0 H LYS A 35 95.864 -3.539 7.336 1.00 0.00 H new ATOM 0 HA LYS A 35 96.924 -0.999 6.438 1.00 0.00 H new ATOM 0 HB2 LYS A 35 97.456 -2.105 8.628 1.00 0.00 H new ATOM 0 HB3 LYS A 35 98.263 -3.402 7.768 1.00 0.00 H new ATOM 0 HG2 LYS A 35 99.853 -1.743 6.758 1.00 0.00 H new ATOM 0 HG3 LYS A 35 99.047 -0.447 7.618 1.00 0.00 H new ATOM 0 HD2 LYS A 35 99.571 -1.564 9.801 1.00 0.00 H new ATOM 0 HD3 LYS A 35 100.369 -2.868 8.945 1.00 0.00 H new ATOM 0 HE2 LYS A 35 102.073 -1.263 9.674 1.00 0.00 H new ATOM 0 HE3 LYS A 35 101.960 -1.195 7.926 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 101.840 0.968 9.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 100.993 0.851 7.965 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 100.185 0.586 9.435 1.00 0.00 H new ATOM 567 N GLU A 36 98.109 -3.750 5.020 1.00 0.00 N ATOM 568 CA GLU A 36 98.842 -4.187 3.797 1.00 0.00 C ATOM 569 C GLU A 36 98.001 -3.921 2.552 1.00 0.00 C ATOM 570 O GLU A 36 98.511 -3.496 1.535 1.00 0.00 O ATOM 571 CB GLU A 36 99.165 -5.682 3.875 1.00 0.00 C ATOM 572 CG GLU A 36 99.889 -6.113 2.594 1.00 0.00 C ATOM 573 CD GLU A 36 100.414 -7.542 2.750 1.00 0.00 C ATOM 574 OE1 GLU A 36 100.239 -8.103 3.819 1.00 0.00 O ATOM 575 OE2 GLU A 36 100.979 -8.050 1.796 1.00 0.00 O ATOM 0 H GLU A 36 97.807 -4.500 5.642 1.00 0.00 H new ATOM 0 HA GLU A 36 99.770 -3.619 3.736 1.00 0.00 H new ATOM 0 HB2 GLU A 36 99.789 -5.886 4.745 1.00 0.00 H new ATOM 0 HB3 GLU A 36 98.248 -6.258 3.999 1.00 0.00 H new ATOM 0 HG2 GLU A 36 99.208 -6.057 1.744 1.00 0.00 H new ATOM 0 HG3 GLU A 36 100.715 -5.433 2.386 1.00 0.00 H new ATOM 582 N LEU A 37 96.721 -4.154 2.612 1.00 0.00 N ATOM 583 CA LEU A 37 95.885 -3.895 1.417 1.00 0.00 C ATOM 584 C LEU A 37 95.985 -2.433 1.067 1.00 0.00 C ATOM 585 O LEU A 37 96.021 -2.058 -0.089 1.00 0.00 O ATOM 586 CB LEU A 37 94.415 -4.243 1.709 1.00 0.00 C ATOM 587 CG LEU A 37 93.526 -3.972 0.459 1.00 0.00 C ATOM 588 CD1 LEU A 37 92.402 -5.013 0.372 1.00 0.00 C ATOM 589 CD2 LEU A 37 92.887 -2.566 0.527 1.00 0.00 C ATOM 0 H LEU A 37 96.225 -4.509 3.429 1.00 0.00 H new ATOM 0 HA LEU A 37 96.236 -4.511 0.590 1.00 0.00 H new ATOM 0 HB2 LEU A 37 94.335 -5.291 1.998 1.00 0.00 H new ATOM 0 HB3 LEU A 37 94.057 -3.652 2.551 1.00 0.00 H new ATOM 0 HG LEU A 37 94.167 -4.036 -0.421 1.00 0.00 H new ATOM 0 HD11 LEU A 37 91.788 -4.813 -0.506 1.00 0.00 H new ATOM 0 HD12 LEU A 37 92.835 -6.010 0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 37 91.784 -4.957 1.268 1.00 0.00 H new ATOM 0 HD21 LEU A 37 92.272 -2.403 -0.358 1.00 0.00 H new ATOM 0 HD22 LEU A 37 92.266 -2.491 1.420 1.00 0.00 H new ATOM 0 HD23 LEU A 37 93.672 -1.811 0.567 1.00 0.00 H new ATOM 601 N LEU A 38 95.989 -1.590 2.051 1.00 0.00 N ATOM 602 CA LEU A 38 96.041 -0.134 1.735 1.00 0.00 C ATOM 603 C LEU A 38 97.401 0.270 1.185 1.00 0.00 C ATOM 604 O LEU A 38 97.496 1.036 0.247 1.00 0.00 O ATOM 605 CB LEU A 38 95.728 0.700 2.998 1.00 0.00 C ATOM 606 CG LEU A 38 94.232 1.064 3.055 1.00 0.00 C ATOM 607 CD1 LEU A 38 93.936 1.854 4.353 1.00 0.00 C ATOM 608 CD2 LEU A 38 93.848 1.899 1.802 1.00 0.00 C ATOM 0 H LEU A 38 95.959 -1.832 3.041 1.00 0.00 H new ATOM 0 HA LEU A 38 95.289 0.062 0.970 1.00 0.00 H new ATOM 0 HB2 LEU A 38 96.004 0.137 3.889 1.00 0.00 H new ATOM 0 HB3 LEU A 38 96.329 1.610 2.997 1.00 0.00 H new ATOM 0 HG LEU A 38 93.634 0.153 3.060 1.00 0.00 H new ATOM 0 HD11 LEU A 38 92.877 2.110 4.390 1.00 0.00 H new ATOM 0 HD12 LEU A 38 94.192 1.242 5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 38 94.531 2.768 4.367 1.00 0.00 H new ATOM 0 HD21 LEU A 38 92.789 2.155 1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 38 94.441 2.813 1.778 1.00 0.00 H new ATOM 0 HD23 LEU A 38 94.044 1.316 0.902 1.00 0.00 H new ATOM 620 N THR A 39 98.448 -0.187 1.779 1.00 0.00 N ATOM 621 CA THR A 39 99.783 0.233 1.305 1.00 0.00 C ATOM 622 C THR A 39 100.100 -0.370 -0.059 1.00 0.00 C ATOM 623 O THR A 39 100.929 0.149 -0.782 1.00 0.00 O ATOM 624 CB THR A 39 100.844 -0.188 2.318 1.00 0.00 C ATOM 625 OG1 THR A 39 100.348 0.026 3.632 1.00 0.00 O ATOM 626 CG2 THR A 39 102.095 0.657 2.101 1.00 0.00 C ATOM 0 H THR A 39 98.443 -0.831 2.570 1.00 0.00 H new ATOM 0 HA THR A 39 99.783 1.318 1.203 1.00 0.00 H new ATOM 0 HB THR A 39 101.085 -1.243 2.190 1.00 0.00 H new ATOM 0 HG1 THR A 39 99.743 -0.705 3.876 1.00 0.00 H new ATOM 0 HG21 THR A 39 102.861 0.365 2.820 1.00 0.00 H new ATOM 0 HG22 THR A 39 102.469 0.501 1.089 1.00 0.00 H new ATOM 0 HG23 THR A 39 101.851 1.710 2.239 1.00 0.00 H new ATOM 634 N ARG A 40 99.474 -1.462 -0.428 1.00 0.00 N ATOM 635 CA ARG A 40 99.787 -2.076 -1.758 1.00 0.00 C ATOM 636 C ARG A 40 98.776 -1.586 -2.789 1.00 0.00 C ATOM 637 O ARG A 40 98.993 -1.698 -3.979 1.00 0.00 O ATOM 638 CB ARG A 40 99.799 -3.617 -1.629 1.00 0.00 C ATOM 639 CG ARG A 40 98.461 -4.268 -2.008 1.00 0.00 C ATOM 640 CD ARG A 40 98.596 -5.784 -1.832 1.00 0.00 C ATOM 641 NE ARG A 40 97.424 -6.471 -2.445 1.00 0.00 N ATOM 642 CZ ARG A 40 97.459 -7.758 -2.660 1.00 0.00 C ATOM 643 NH1 ARG A 40 98.520 -8.446 -2.337 1.00 0.00 N ATOM 644 NH2 ARG A 40 96.431 -8.358 -3.198 1.00 0.00 N ATOM 0 H ARG A 40 98.769 -1.949 0.125 1.00 0.00 H new ATOM 0 HA ARG A 40 100.778 -1.772 -2.096 1.00 0.00 H new ATOM 0 HB2 ARG A 40 100.586 -4.022 -2.266 1.00 0.00 H new ATOM 0 HB3 ARG A 40 100.049 -3.887 -0.603 1.00 0.00 H new ATOM 0 HG2 ARG A 40 97.659 -3.883 -1.378 1.00 0.00 H new ATOM 0 HG3 ARG A 40 98.200 -4.027 -3.039 1.00 0.00 H new ATOM 0 HD2 ARG A 40 99.518 -6.133 -2.298 1.00 0.00 H new ATOM 0 HD3 ARG A 40 98.661 -6.032 -0.773 1.00 0.00 H new ATOM 0 HE ARG A 40 96.594 -5.935 -2.697 1.00 0.00 H new ATOM 0 HH11 ARG A 40 99.323 -7.978 -1.916 1.00 0.00 H new ATOM 0 HH12 ARG A 40 98.546 -9.452 -2.505 1.00 0.00 H new ATOM 0 HH21 ARG A 40 95.601 -7.821 -3.450 1.00 0.00 H new ATOM 0 HH22 ARG A 40 96.458 -9.364 -3.366 1.00 0.00 H new ATOM 658 N GLU A 41 97.676 -1.030 -2.343 1.00 0.00 N ATOM 659 CA GLU A 41 96.651 -0.515 -3.308 1.00 0.00 C ATOM 660 C GLU A 41 96.692 0.993 -3.311 1.00 0.00 C ATOM 661 O GLU A 41 96.441 1.619 -4.317 1.00 0.00 O ATOM 662 CB GLU A 41 95.258 -0.985 -2.892 1.00 0.00 C ATOM 663 CG GLU A 41 95.146 -2.489 -3.121 1.00 0.00 C ATOM 664 CD GLU A 41 95.128 -2.782 -4.623 1.00 0.00 C ATOM 665 OE1 GLU A 41 94.830 -1.873 -5.381 1.00 0.00 O ATOM 666 OE2 GLU A 41 95.414 -3.908 -4.990 1.00 0.00 O ATOM 0 H GLU A 41 97.443 -0.910 -1.357 1.00 0.00 H new ATOM 0 HA GLU A 41 96.870 -0.895 -4.306 1.00 0.00 H new ATOM 0 HB2 GLU A 41 95.081 -0.751 -1.842 1.00 0.00 H new ATOM 0 HB3 GLU A 41 94.497 -0.460 -3.469 1.00 0.00 H new ATOM 0 HG2 GLU A 41 95.985 -3.002 -2.651 1.00 0.00 H new ATOM 0 HG3 GLU A 41 94.238 -2.871 -2.655 1.00 0.00 H new ATOM 673 N LEU A 42 97.032 1.587 -2.200 1.00 0.00 N ATOM 674 CA LEU A 42 97.115 3.075 -2.147 1.00 0.00 C ATOM 675 C LEU A 42 98.342 3.467 -1.300 1.00 0.00 C ATOM 676 O LEU A 42 98.225 3.655 -0.107 1.00 0.00 O ATOM 677 CB LEU A 42 95.850 3.672 -1.497 1.00 0.00 C ATOM 678 CG LEU A 42 94.575 3.221 -2.229 1.00 0.00 C ATOM 679 CD1 LEU A 42 93.349 3.574 -1.378 1.00 0.00 C ATOM 680 CD2 LEU A 42 94.457 3.945 -3.575 1.00 0.00 C ATOM 0 H LEU A 42 97.256 1.108 -1.328 1.00 0.00 H new ATOM 0 HA LEU A 42 97.202 3.462 -3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 42 95.798 3.367 -0.452 1.00 0.00 H new ATOM 0 HB3 LEU A 42 95.912 4.760 -1.509 1.00 0.00 H new ATOM 0 HG LEU A 42 94.626 2.145 -2.394 1.00 0.00 H new ATOM 0 HD11 LEU A 42 92.444 3.255 -1.895 1.00 0.00 H new ATOM 0 HD12 LEU A 42 93.416 3.066 -0.416 1.00 0.00 H new ATOM 0 HD13 LEU A 42 93.315 4.652 -1.218 1.00 0.00 H new ATOM 0 HD21 LEU A 42 93.551 3.619 -4.085 1.00 0.00 H new ATOM 0 HD22 LEU A 42 94.411 5.021 -3.407 1.00 0.00 H new ATOM 0 HD23 LEU A 42 95.325 3.711 -4.191 1.00 0.00 H new ATOM 692 N PRO A 43 99.519 3.567 -1.885 1.00 0.00 N ATOM 693 CA PRO A 43 100.736 3.921 -1.100 1.00 0.00 C ATOM 694 C PRO A 43 100.821 5.428 -0.790 1.00 0.00 C ATOM 695 O PRO A 43 100.258 5.901 0.178 1.00 0.00 O ATOM 696 CB PRO A 43 101.861 3.458 -2.046 1.00 0.00 C ATOM 697 CG PRO A 43 101.267 3.348 -3.464 1.00 0.00 C ATOM 698 CD PRO A 43 99.730 3.339 -3.343 1.00 0.00 C ATOM 0 HA PRO A 43 100.769 3.459 -0.113 1.00 0.00 H new ATOM 0 HB2 PRO A 43 102.688 4.168 -2.032 1.00 0.00 H new ATOM 0 HB3 PRO A 43 102.260 2.497 -1.723 1.00 0.00 H new ATOM 0 HG2 PRO A 43 101.595 4.186 -4.080 1.00 0.00 H new ATOM 0 HG3 PRO A 43 101.615 2.438 -3.952 1.00 0.00 H new ATOM 0 HD2 PRO A 43 99.271 4.122 -3.947 1.00 0.00 H new ATOM 0 HD3 PRO A 43 99.303 2.392 -3.671 1.00 0.00 H new ATOM 706 N SER A 44 101.523 6.181 -1.596 1.00 0.00 N ATOM 707 CA SER A 44 101.644 7.645 -1.340 1.00 0.00 C ATOM 708 C SER A 44 100.286 8.318 -1.542 1.00 0.00 C ATOM 709 O SER A 44 99.906 9.200 -0.804 1.00 0.00 O ATOM 710 CB SER A 44 102.661 8.248 -2.310 1.00 0.00 C ATOM 711 OG SER A 44 102.160 8.147 -3.637 1.00 0.00 O ATOM 0 H SER A 44 102.018 5.844 -2.422 1.00 0.00 H new ATOM 0 HA SER A 44 101.977 7.806 -0.315 1.00 0.00 H new ATOM 0 HB2 SER A 44 102.847 9.292 -2.058 1.00 0.00 H new ATOM 0 HB3 SER A 44 103.614 7.725 -2.228 1.00 0.00 H new ATOM 0 HG SER A 44 102.808 8.534 -4.262 1.00 0.00 H new ATOM 717 N PHE A 45 99.561 7.906 -2.541 1.00 0.00 N ATOM 718 CA PHE A 45 98.223 8.508 -2.820 1.00 0.00 C ATOM 719 C PHE A 45 97.330 8.422 -1.581 1.00 0.00 C ATOM 720 O PHE A 45 96.225 8.927 -1.557 1.00 0.00 O ATOM 721 CB PHE A 45 97.561 7.706 -3.929 1.00 0.00 C ATOM 722 CG PHE A 45 98.304 7.911 -5.228 1.00 0.00 C ATOM 723 CD1 PHE A 45 97.936 8.952 -6.091 1.00 0.00 C ATOM 724 CD2 PHE A 45 99.360 7.058 -5.573 1.00 0.00 C ATOM 725 CE1 PHE A 45 98.625 9.139 -7.296 1.00 0.00 C ATOM 726 CE2 PHE A 45 100.049 7.246 -6.777 1.00 0.00 C ATOM 727 CZ PHE A 45 99.682 8.286 -7.639 1.00 0.00 C ATOM 0 H PHE A 45 99.840 7.168 -3.187 1.00 0.00 H new ATOM 0 HA PHE A 45 98.354 9.553 -3.103 1.00 0.00 H new ATOM 0 HB2 PHE A 45 97.552 6.648 -3.668 1.00 0.00 H new ATOM 0 HB3 PHE A 45 96.522 8.015 -4.042 1.00 0.00 H new ATOM 0 HD1 PHE A 45 97.121 9.610 -5.827 1.00 0.00 H new ATOM 0 HD2 PHE A 45 99.643 6.254 -4.909 1.00 0.00 H new ATOM 0 HE1 PHE A 45 98.341 9.941 -7.961 1.00 0.00 H new ATOM 0 HE2 PHE A 45 100.864 6.588 -7.041 1.00 0.00 H new ATOM 0 HZ PHE A 45 100.213 8.431 -8.568 1.00 0.00 H new ATOM 737 N LEU A 46 97.801 7.768 -0.565 1.00 0.00 N ATOM 738 CA LEU A 46 96.999 7.602 0.697 1.00 0.00 C ATOM 739 C LEU A 46 97.588 8.512 1.760 1.00 0.00 C ATOM 740 O LEU A 46 96.943 9.407 2.272 1.00 0.00 O ATOM 741 CB LEU A 46 97.114 6.148 1.160 1.00 0.00 C ATOM 742 CG LEU A 46 96.151 5.855 2.319 1.00 0.00 C ATOM 743 CD1 LEU A 46 94.689 5.835 1.825 1.00 0.00 C ATOM 744 CD2 LEU A 46 96.510 4.488 2.911 1.00 0.00 C ATOM 0 H LEU A 46 98.722 7.330 -0.543 1.00 0.00 H new ATOM 0 HA LEU A 46 95.953 7.855 0.525 1.00 0.00 H new ATOM 0 HB2 LEU A 46 96.897 5.480 0.326 1.00 0.00 H new ATOM 0 HB3 LEU A 46 98.138 5.944 1.474 1.00 0.00 H new ATOM 0 HG LEU A 46 96.245 6.637 3.073 1.00 0.00 H new ATOM 0 HD11 LEU A 46 94.025 5.626 2.663 1.00 0.00 H new ATOM 0 HD12 LEU A 46 94.437 6.805 1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 46 94.572 5.061 1.067 1.00 0.00 H new ATOM 0 HD21 LEU A 46 95.836 4.261 3.737 1.00 0.00 H new ATOM 0 HD22 LEU A 46 96.412 3.722 2.142 1.00 0.00 H new ATOM 0 HD23 LEU A 46 97.537 4.508 3.275 1.00 0.00 H new ATOM 756 N GLY A 47 98.836 8.310 2.050 1.00 0.00 N ATOM 757 CA GLY A 47 99.537 9.174 3.032 1.00 0.00 C ATOM 758 C GLY A 47 100.051 10.352 2.232 1.00 0.00 C ATOM 759 O GLY A 47 100.999 11.021 2.592 1.00 0.00 O ATOM 0 H GLY A 47 99.410 7.572 1.643 1.00 0.00 H new ATOM 0 HA2 GLY A 47 98.861 9.500 3.822 1.00 0.00 H new ATOM 0 HA3 GLY A 47 100.355 8.638 3.514 1.00 0.00 H new ATOM 763 N LYS A 48 99.424 10.569 1.109 1.00 0.00 N ATOM 764 CA LYS A 48 99.838 11.657 0.200 1.00 0.00 C ATOM 765 C LYS A 48 100.036 12.955 0.988 1.00 0.00 C ATOM 766 O LYS A 48 101.035 13.633 0.850 1.00 0.00 O ATOM 767 CB LYS A 48 98.729 11.872 -0.827 1.00 0.00 C ATOM 768 CG LYS A 48 99.212 12.807 -1.929 1.00 0.00 C ATOM 769 CD LYS A 48 98.168 12.823 -3.039 1.00 0.00 C ATOM 770 CE LYS A 48 98.609 13.777 -4.151 1.00 0.00 C ATOM 771 NZ LYS A 48 99.944 13.358 -4.664 1.00 0.00 N ATOM 0 H LYS A 48 98.627 10.023 0.783 1.00 0.00 H new ATOM 0 HA LYS A 48 100.775 11.388 -0.288 1.00 0.00 H new ATOM 0 HB2 LYS A 48 98.429 10.916 -1.256 1.00 0.00 H new ATOM 0 HB3 LYS A 48 97.849 12.293 -0.341 1.00 0.00 H new ATOM 0 HG2 LYS A 48 99.362 13.812 -1.535 1.00 0.00 H new ATOM 0 HG3 LYS A 48 100.173 12.471 -2.317 1.00 0.00 H new ATOM 0 HD2 LYS A 48 98.035 11.818 -3.440 1.00 0.00 H new ATOM 0 HD3 LYS A 48 97.204 13.137 -2.639 1.00 0.00 H new ATOM 0 HE2 LYS A 48 97.879 13.772 -4.960 1.00 0.00 H new ATOM 0 HE3 LYS A 48 98.657 14.798 -3.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 99.990 13.526 -5.689 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 100.687 13.909 -4.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 100.087 12.346 -4.473 1.00 0.00 H new ATOM 785 N ARG A 49 99.081 13.308 1.805 1.00 0.00 N ATOM 786 CA ARG A 49 99.193 14.567 2.597 1.00 0.00 C ATOM 787 C ARG A 49 100.125 14.353 3.788 1.00 0.00 C ATOM 788 O ARG A 49 100.321 13.247 4.250 1.00 0.00 O ATOM 789 CB ARG A 49 97.808 14.971 3.112 1.00 0.00 C ATOM 790 CG ARG A 49 96.911 15.370 1.939 1.00 0.00 C ATOM 791 CD ARG A 49 95.534 15.771 2.473 1.00 0.00 C ATOM 792 NE ARG A 49 94.592 15.978 1.336 1.00 0.00 N ATOM 793 CZ ARG A 49 93.306 16.008 1.554 1.00 0.00 C ATOM 794 NH1 ARG A 49 92.845 15.841 2.763 1.00 0.00 N ATOM 795 NH2 ARG A 49 92.481 16.204 0.563 1.00 0.00 N ATOM 0 H ARG A 49 98.224 12.776 1.959 1.00 0.00 H new ATOM 0 HA ARG A 49 99.596 15.353 1.959 1.00 0.00 H new ATOM 0 HB2 ARG A 49 97.358 14.143 3.659 1.00 0.00 H new ATOM 0 HB3 ARG A 49 97.899 15.803 3.811 1.00 0.00 H new ATOM 0 HG2 ARG A 49 97.357 16.199 1.390 1.00 0.00 H new ATOM 0 HG3 ARG A 49 96.815 14.539 1.240 1.00 0.00 H new ATOM 0 HD2 ARG A 49 95.152 14.996 3.137 1.00 0.00 H new ATOM 0 HD3 ARG A 49 95.614 16.685 3.062 1.00 0.00 H new ATOM 0 HE ARG A 49 94.952 16.096 0.389 1.00 0.00 H new ATOM 0 HH11 ARG A 49 93.490 15.687 3.538 1.00 0.00 H new ATOM 0 HH12 ARG A 49 91.840 15.865 2.933 1.00 0.00 H new ATOM 0 HH21 ARG A 49 92.841 16.334 -0.382 1.00 0.00 H new ATOM 0 HH22 ARG A 49 91.476 16.227 0.733 1.00 0.00 H new ATOM 809 N THR A 50 100.694 15.413 4.298 1.00 0.00 N ATOM 810 CA THR A 50 101.602 15.281 5.469 1.00 0.00 C ATOM 811 C THR A 50 100.768 14.874 6.682 1.00 0.00 C ATOM 812 O THR A 50 101.284 14.419 7.684 1.00 0.00 O ATOM 813 CB THR A 50 102.286 16.623 5.743 1.00 0.00 C ATOM 814 OG1 THR A 50 103.136 16.949 4.653 1.00 0.00 O ATOM 815 CG2 THR A 50 103.116 16.526 7.024 1.00 0.00 C ATOM 0 H THR A 50 100.568 16.364 3.952 1.00 0.00 H new ATOM 0 HA THR A 50 102.365 14.529 5.269 1.00 0.00 H new ATOM 0 HB THR A 50 101.529 17.398 5.862 1.00 0.00 H new ATOM 0 HG1 THR A 50 103.574 17.809 4.825 1.00 0.00 H new ATOM 0 HG21 THR A 50 103.602 17.483 7.216 1.00 0.00 H new ATOM 0 HG22 THR A 50 102.465 16.275 7.861 1.00 0.00 H new ATOM 0 HG23 THR A 50 103.874 15.751 6.909 1.00 0.00 H new ATOM 823 N ASP A 51 99.476 15.027 6.592 1.00 0.00 N ATOM 824 CA ASP A 51 98.599 14.644 7.728 1.00 0.00 C ATOM 825 C ASP A 51 98.498 13.122 7.787 1.00 0.00 C ATOM 826 O ASP A 51 97.434 12.559 7.951 1.00 0.00 O ATOM 827 CB ASP A 51 97.210 15.252 7.528 1.00 0.00 C ATOM 828 CG ASP A 51 97.274 16.761 7.769 1.00 0.00 C ATOM 829 OD1 ASP A 51 98.232 17.205 8.380 1.00 0.00 O ATOM 830 OD2 ASP A 51 96.365 17.450 7.336 1.00 0.00 O ATOM 0 H ASP A 51 98.991 15.402 5.777 1.00 0.00 H new ATOM 0 HA ASP A 51 99.018 15.017 8.663 1.00 0.00 H new ATOM 0 HB2 ASP A 51 96.855 15.049 6.518 1.00 0.00 H new ATOM 0 HB3 ASP A 51 96.498 14.793 8.214 1.00 0.00 H new ATOM 835 N GLU A 52 99.610 12.454 7.649 1.00 0.00 N ATOM 836 CA GLU A 52 99.608 10.963 7.690 1.00 0.00 C ATOM 837 C GLU A 52 99.038 10.485 9.028 1.00 0.00 C ATOM 838 O GLU A 52 98.525 9.389 9.142 1.00 0.00 O ATOM 839 CB GLU A 52 101.048 10.456 7.533 1.00 0.00 C ATOM 840 CG GLU A 52 101.911 10.932 8.711 1.00 0.00 C ATOM 841 CD GLU A 52 103.342 10.425 8.529 1.00 0.00 C ATOM 842 OE1 GLU A 52 103.543 9.568 7.685 1.00 0.00 O ATOM 843 OE2 GLU A 52 104.214 10.899 9.240 1.00 0.00 O ATOM 0 H GLU A 52 100.526 12.879 7.509 1.00 0.00 H new ATOM 0 HA GLU A 52 98.991 10.574 6.880 1.00 0.00 H new ATOM 0 HB2 GLU A 52 101.054 9.367 7.485 1.00 0.00 H new ATOM 0 HB3 GLU A 52 101.468 10.819 6.595 1.00 0.00 H new ATOM 0 HG2 GLU A 52 101.903 12.021 8.765 1.00 0.00 H new ATOM 0 HG3 GLU A 52 101.499 10.563 9.650 1.00 0.00 H new ATOM 850 N ALA A 53 99.133 11.298 10.040 1.00 0.00 N ATOM 851 CA ALA A 53 98.606 10.901 11.379 1.00 0.00 C ATOM 852 C ALA A 53 97.213 10.283 11.230 1.00 0.00 C ATOM 853 O ALA A 53 96.866 9.350 11.919 1.00 0.00 O ATOM 854 CB ALA A 53 98.524 12.134 12.280 1.00 0.00 C ATOM 0 H ALA A 53 99.555 12.226 10.000 1.00 0.00 H new ATOM 0 HA ALA A 53 99.277 10.166 11.824 1.00 0.00 H new ATOM 0 HB1 ALA A 53 98.139 11.845 13.258 1.00 0.00 H new ATOM 0 HB2 ALA A 53 99.517 12.568 12.395 1.00 0.00 H new ATOM 0 HB3 ALA A 53 97.857 12.869 11.830 1.00 0.00 H new ATOM 860 N ALA A 54 96.416 10.790 10.336 1.00 0.00 N ATOM 861 CA ALA A 54 95.049 10.222 10.148 1.00 0.00 C ATOM 862 C ALA A 54 95.156 8.751 9.755 1.00 0.00 C ATOM 863 O ALA A 54 94.402 7.918 10.209 1.00 0.00 O ATOM 864 CB ALA A 54 94.329 10.988 9.050 1.00 0.00 C ATOM 0 H ALA A 54 96.649 11.573 9.725 1.00 0.00 H new ATOM 0 HA ALA A 54 94.490 10.308 11.080 1.00 0.00 H new ATOM 0 HB1 ALA A 54 93.330 10.574 8.912 1.00 0.00 H new ATOM 0 HB2 ALA A 54 94.250 12.038 9.331 1.00 0.00 H new ATOM 0 HB3 ALA A 54 94.889 10.902 8.119 1.00 0.00 H new ATOM 870 N PHE A 55 96.095 8.418 8.925 1.00 0.00 N ATOM 871 CA PHE A 55 96.247 6.995 8.533 1.00 0.00 C ATOM 872 C PHE A 55 96.500 6.197 9.796 1.00 0.00 C ATOM 873 O PHE A 55 95.987 5.112 9.983 1.00 0.00 O ATOM 874 CB PHE A 55 97.452 6.855 7.616 1.00 0.00 C ATOM 875 CG PHE A 55 97.713 5.392 7.336 1.00 0.00 C ATOM 876 CD1 PHE A 55 97.099 4.756 6.250 1.00 0.00 C ATOM 877 CD2 PHE A 55 98.569 4.669 8.177 1.00 0.00 C ATOM 878 CE1 PHE A 55 97.345 3.398 6.005 1.00 0.00 C ATOM 879 CE2 PHE A 55 98.813 3.313 7.930 1.00 0.00 C ATOM 880 CZ PHE A 55 98.201 2.678 6.844 1.00 0.00 C ATOM 0 H PHE A 55 96.761 9.064 8.502 1.00 0.00 H new ATOM 0 HA PHE A 55 95.354 6.640 8.018 1.00 0.00 H new ATOM 0 HB2 PHE A 55 97.274 7.388 6.682 1.00 0.00 H new ATOM 0 HB3 PHE A 55 98.328 7.308 8.079 1.00 0.00 H new ATOM 0 HD1 PHE A 55 96.437 5.311 5.602 1.00 0.00 H new ATOM 0 HD2 PHE A 55 99.041 5.158 9.016 1.00 0.00 H new ATOM 0 HE1 PHE A 55 96.873 2.907 5.167 1.00 0.00 H new ATOM 0 HE2 PHE A 55 99.474 2.757 8.578 1.00 0.00 H new ATOM 0 HZ PHE A 55 98.390 1.632 6.654 1.00 0.00 H new ATOM 890 N GLN A 56 97.282 6.744 10.671 1.00 0.00 N ATOM 891 CA GLN A 56 97.568 6.037 11.939 1.00 0.00 C ATOM 892 C GLN A 56 96.254 5.842 12.675 1.00 0.00 C ATOM 893 O GLN A 56 96.047 4.864 13.364 1.00 0.00 O ATOM 894 CB GLN A 56 98.536 6.856 12.796 1.00 0.00 C ATOM 895 CG GLN A 56 98.949 6.042 14.026 1.00 0.00 C ATOM 896 CD GLN A 56 99.778 4.833 13.587 1.00 0.00 C ATOM 897 OE1 GLN A 56 100.876 4.984 13.089 1.00 0.00 O ATOM 898 NE2 GLN A 56 99.295 3.633 13.753 1.00 0.00 N ATOM 0 H GLN A 56 97.736 7.651 10.564 1.00 0.00 H new ATOM 0 HA GLN A 56 98.033 5.072 11.734 1.00 0.00 H new ATOM 0 HB2 GLN A 56 99.417 7.124 12.212 1.00 0.00 H new ATOM 0 HB3 GLN A 56 98.064 7.788 13.106 1.00 0.00 H new ATOM 0 HG2 GLN A 56 99.528 6.664 14.709 1.00 0.00 H new ATOM 0 HG3 GLN A 56 98.064 5.711 14.569 1.00 0.00 H new ATOM 0 HE21 GLN A 56 98.373 3.508 14.171 1.00 0.00 H new ATOM 0 HE22 GLN A 56 99.839 2.820 13.465 1.00 0.00 H new ATOM 907 N LYS A 57 95.359 6.772 12.523 1.00 0.00 N ATOM 908 CA LYS A 57 94.040 6.645 13.204 1.00 0.00 C ATOM 909 C LYS A 57 93.270 5.533 12.521 1.00 0.00 C ATOM 910 O LYS A 57 92.620 4.723 13.151 1.00 0.00 O ATOM 911 CB LYS A 57 93.249 7.952 13.103 1.00 0.00 C ATOM 912 CG LYS A 57 94.033 9.087 13.765 1.00 0.00 C ATOM 913 CD LYS A 57 93.233 10.392 13.659 1.00 0.00 C ATOM 914 CE LYS A 57 94.156 11.594 13.890 1.00 0.00 C ATOM 915 NZ LYS A 57 93.339 12.783 14.259 1.00 0.00 N ATOM 0 H LYS A 57 95.480 7.613 11.959 1.00 0.00 H new ATOM 0 HA LYS A 57 94.191 6.423 14.260 1.00 0.00 H new ATOM 0 HB2 LYS A 57 93.058 8.192 12.057 1.00 0.00 H new ATOM 0 HB3 LYS A 57 92.279 7.838 13.586 1.00 0.00 H new ATOM 0 HG2 LYS A 57 94.224 8.849 14.811 1.00 0.00 H new ATOM 0 HG3 LYS A 57 95.003 9.203 13.282 1.00 0.00 H new ATOM 0 HD2 LYS A 57 92.768 10.464 12.676 1.00 0.00 H new ATOM 0 HD3 LYS A 57 92.428 10.395 14.394 1.00 0.00 H new ATOM 0 HE2 LYS A 57 94.871 11.370 14.682 1.00 0.00 H new ATOM 0 HE3 LYS A 57 94.733 11.801 12.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 93.965 13.599 14.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 92.674 13.000 13.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 92.807 12.582 15.130 1.00 0.00 H new ATOM 929 N LEU A 58 93.368 5.478 11.224 1.00 0.00 N ATOM 930 CA LEU A 58 92.674 4.403 10.481 1.00 0.00 C ATOM 931 C LEU A 58 93.374 3.123 10.872 1.00 0.00 C ATOM 932 O LEU A 58 92.767 2.106 11.126 1.00 0.00 O ATOM 933 CB LEU A 58 92.811 4.651 8.974 1.00 0.00 C ATOM 934 CG LEU A 58 92.097 3.546 8.180 1.00 0.00 C ATOM 935 CD1 LEU A 58 90.575 3.672 8.347 1.00 0.00 C ATOM 936 CD2 LEU A 58 92.466 3.676 6.698 1.00 0.00 C ATOM 0 H LEU A 58 93.899 6.133 10.650 1.00 0.00 H new ATOM 0 HA LEU A 58 91.610 4.360 10.712 1.00 0.00 H new ATOM 0 HB2 LEU A 58 92.387 5.622 8.719 1.00 0.00 H new ATOM 0 HB3 LEU A 58 93.865 4.682 8.699 1.00 0.00 H new ATOM 0 HG LEU A 58 92.411 2.572 8.555 1.00 0.00 H new ATOM 0 HD11 LEU A 58 90.080 2.884 7.780 1.00 0.00 H new ATOM 0 HD12 LEU A 58 90.316 3.578 9.401 1.00 0.00 H new ATOM 0 HD13 LEU A 58 90.248 4.644 7.978 1.00 0.00 H new ATOM 0 HD21 LEU A 58 91.963 2.895 6.128 1.00 0.00 H new ATOM 0 HD22 LEU A 58 92.153 4.653 6.329 1.00 0.00 H new ATOM 0 HD23 LEU A 58 93.545 3.573 6.581 1.00 0.00 H new ATOM 948 N MET A 59 94.664 3.191 10.958 1.00 0.00 N ATOM 949 CA MET A 59 95.430 2.008 11.377 1.00 0.00 C ATOM 950 C MET A 59 95.081 1.722 12.831 1.00 0.00 C ATOM 951 O MET A 59 94.951 0.589 13.248 1.00 0.00 O ATOM 952 CB MET A 59 96.931 2.270 11.248 1.00 0.00 C ATOM 953 CG MET A 59 97.714 0.965 11.445 1.00 0.00 C ATOM 954 SD MET A 59 98.015 0.701 13.210 1.00 0.00 S ATOM 955 CE MET A 59 98.783 -0.936 13.081 1.00 0.00 C ATOM 0 H MET A 59 95.220 4.021 10.754 1.00 0.00 H new ATOM 0 HA MET A 59 95.180 1.156 10.744 1.00 0.00 H new ATOM 0 HB2 MET A 59 97.151 2.691 10.267 1.00 0.00 H new ATOM 0 HB3 MET A 59 97.244 3.006 11.988 1.00 0.00 H new ATOM 0 HG2 MET A 59 97.154 0.126 11.032 1.00 0.00 H new ATOM 0 HG3 MET A 59 98.661 1.012 10.907 1.00 0.00 H new ATOM 0 HE1 MET A 59 99.051 -1.291 14.076 1.00 0.00 H new ATOM 0 HE2 MET A 59 98.080 -1.633 12.624 1.00 0.00 H new ATOM 0 HE3 MET A 59 99.680 -0.870 12.465 1.00 0.00 H new ATOM 965 N SER A 60 94.928 2.754 13.608 1.00 0.00 N ATOM 966 CA SER A 60 94.578 2.555 15.045 1.00 0.00 C ATOM 967 C SER A 60 93.240 1.834 15.134 1.00 0.00 C ATOM 968 O SER A 60 92.949 1.163 16.102 1.00 0.00 O ATOM 969 CB SER A 60 94.470 3.903 15.751 1.00 0.00 C ATOM 970 OG SER A 60 94.282 3.693 17.146 1.00 0.00 O ATOM 0 H SER A 60 95.029 3.726 13.315 1.00 0.00 H new ATOM 0 HA SER A 60 95.357 1.963 15.526 1.00 0.00 H new ATOM 0 HB2 SER A 60 95.373 4.489 15.579 1.00 0.00 H new ATOM 0 HB3 SER A 60 93.636 4.474 15.342 1.00 0.00 H new ATOM 0 HG SER A 60 94.214 4.558 17.601 1.00 0.00 H new ATOM 976 N ASN A 61 92.419 1.954 14.134 1.00 0.00 N ATOM 977 CA ASN A 61 91.109 1.247 14.196 1.00 0.00 C ATOM 978 C ASN A 61 91.395 -0.244 14.147 1.00 0.00 C ATOM 979 O ASN A 61 90.740 -1.035 14.784 1.00 0.00 O ATOM 980 CB ASN A 61 90.212 1.654 13.027 1.00 0.00 C ATOM 981 CG ASN A 61 89.768 3.107 13.207 1.00 0.00 C ATOM 982 OD1 ASN A 61 89.797 3.882 12.272 1.00 0.00 O ATOM 983 ND2 ASN A 61 89.354 3.510 14.376 1.00 0.00 N ATOM 0 H ASN A 61 92.590 2.500 13.289 1.00 0.00 H new ATOM 0 HA ASN A 61 90.583 1.510 15.114 1.00 0.00 H new ATOM 0 HB2 ASN A 61 90.750 1.541 12.086 1.00 0.00 H new ATOM 0 HB3 ASN A 61 89.341 1.000 12.978 1.00 0.00 H new ATOM 0 HD21 ASN A 61 89.054 4.476 14.506 1.00 0.00 H new ATOM 0 HD22 ASN A 61 89.330 2.859 15.161 1.00 0.00 H new ATOM 990 N LEU A 62 92.405 -0.640 13.429 1.00 0.00 N ATOM 991 CA LEU A 62 92.746 -2.086 13.404 1.00 0.00 C ATOM 992 C LEU A 62 93.024 -2.456 14.857 1.00 0.00 C ATOM 993 O LEU A 62 92.695 -3.526 15.329 1.00 0.00 O ATOM 994 CB LEU A 62 94.007 -2.313 12.562 1.00 0.00 C ATOM 995 CG LEU A 62 93.931 -1.516 11.256 1.00 0.00 C ATOM 996 CD1 LEU A 62 95.207 -1.767 10.429 1.00 0.00 C ATOM 997 CD2 LEU A 62 92.697 -1.914 10.437 1.00 0.00 C ATOM 0 H LEU A 62 93.002 -0.035 12.865 1.00 0.00 H new ATOM 0 HA LEU A 62 91.946 -2.687 12.970 1.00 0.00 H new ATOM 0 HB2 LEU A 62 94.888 -2.012 13.128 1.00 0.00 H new ATOM 0 HB3 LEU A 62 94.118 -3.375 12.341 1.00 0.00 H new ATOM 0 HG LEU A 62 93.849 -0.457 11.501 1.00 0.00 H new ATOM 0 HD11 LEU A 62 95.155 -1.201 9.499 1.00 0.00 H new ATOM 0 HD12 LEU A 62 96.079 -1.448 11.000 1.00 0.00 H new ATOM 0 HD13 LEU A 62 95.291 -2.830 10.202 1.00 0.00 H new ATOM 0 HD21 LEU A 62 92.669 -1.332 9.516 1.00 0.00 H new ATOM 0 HD22 LEU A 62 92.748 -2.976 10.195 1.00 0.00 H new ATOM 0 HD23 LEU A 62 91.796 -1.717 11.018 1.00 0.00 H new ATOM 1009 N ASP A 63 93.594 -1.528 15.573 1.00 0.00 N ATOM 1010 CA ASP A 63 93.871 -1.744 17.009 1.00 0.00 C ATOM 1011 C ASP A 63 92.564 -1.533 17.779 1.00 0.00 C ATOM 1012 O ASP A 63 92.522 -1.618 18.990 1.00 0.00 O ATOM 1013 CB ASP A 63 94.925 -0.742 17.487 1.00 0.00 C ATOM 1014 CG ASP A 63 95.484 -1.188 18.839 1.00 0.00 C ATOM 1015 OD1 ASP A 63 94.831 -1.980 19.498 1.00 0.00 O ATOM 1016 OD2 ASP A 63 96.560 -0.731 19.191 1.00 0.00 O ATOM 0 H ASP A 63 93.882 -0.618 15.213 1.00 0.00 H new ATOM 0 HA ASP A 63 94.249 -2.752 17.177 1.00 0.00 H new ATOM 0 HB2 ASP A 63 95.730 -0.670 16.756 1.00 0.00 H new ATOM 0 HB3 ASP A 63 94.484 0.251 17.575 1.00 0.00 H new ATOM 1021 N SER A 64 91.489 -1.250 17.077 1.00 0.00 N ATOM 1022 CA SER A 64 90.189 -1.027 17.776 1.00 0.00 C ATOM 1023 C SER A 64 89.892 -2.256 18.638 1.00 0.00 C ATOM 1024 O SER A 64 90.556 -3.267 18.529 1.00 0.00 O ATOM 1025 CB SER A 64 89.044 -0.875 16.770 1.00 0.00 C ATOM 1026 OG SER A 64 87.819 -0.758 17.482 1.00 0.00 O ATOM 0 H SER A 64 91.459 -1.165 16.061 1.00 0.00 H new ATOM 0 HA SER A 64 90.264 -0.119 18.374 1.00 0.00 H new ATOM 0 HB2 SER A 64 89.204 0.005 16.147 1.00 0.00 H new ATOM 0 HB3 SER A 64 89.012 -1.736 16.103 1.00 0.00 H new ATOM 0 HG SER A 64 87.080 -0.658 16.847 1.00 0.00 H new ATOM 1032 N ASN A 65 88.898 -2.201 19.482 1.00 0.00 N ATOM 1033 CA ASN A 65 88.590 -3.401 20.313 1.00 0.00 C ATOM 1034 C ASN A 65 88.290 -4.570 19.373 1.00 0.00 C ATOM 1035 O ASN A 65 87.631 -4.406 18.366 1.00 0.00 O ATOM 1036 CB ASN A 65 87.366 -3.129 21.191 1.00 0.00 C ATOM 1037 CG ASN A 65 87.206 -4.261 22.209 1.00 0.00 C ATOM 1038 OD1 ASN A 65 88.005 -5.176 22.249 1.00 0.00 O ATOM 1039 ND2 ASN A 65 86.197 -4.240 23.037 1.00 0.00 N ATOM 0 H ASN A 65 88.295 -1.392 19.632 1.00 0.00 H new ATOM 0 HA ASN A 65 89.439 -3.635 20.956 1.00 0.00 H new ATOM 0 HB2 ASN A 65 87.480 -2.175 21.707 1.00 0.00 H new ATOM 0 HB3 ASN A 65 86.472 -3.052 20.573 1.00 0.00 H new ATOM 0 HD21 ASN A 65 86.080 -4.991 23.717 1.00 0.00 H new ATOM 0 HD22 ASN A 65 85.526 -3.472 23.004 1.00 0.00 H new ATOM 1046 N ARG A 66 88.778 -5.744 19.688 1.00 0.00 N ATOM 1047 CA ARG A 66 88.541 -6.931 18.804 1.00 0.00 C ATOM 1048 C ARG A 66 88.704 -6.512 17.334 1.00 0.00 C ATOM 1049 O ARG A 66 89.712 -5.951 16.958 1.00 0.00 O ATOM 1050 CB ARG A 66 87.130 -7.480 19.042 1.00 0.00 C ATOM 1051 CG ARG A 66 87.032 -8.915 18.504 1.00 0.00 C ATOM 1052 CD ARG A 66 85.676 -9.510 18.883 1.00 0.00 C ATOM 1053 NE ARG A 66 84.592 -8.713 18.246 1.00 0.00 N ATOM 1054 CZ ARG A 66 83.376 -9.184 18.202 1.00 0.00 C ATOM 1055 NH1 ARG A 66 83.110 -10.356 18.714 1.00 0.00 N ATOM 1056 NH2 ARG A 66 82.424 -8.483 17.648 1.00 0.00 N ATOM 0 H ARG A 66 89.333 -5.934 20.523 1.00 0.00 H new ATOM 0 HA ARG A 66 89.266 -7.711 19.037 1.00 0.00 H new ATOM 0 HB2 ARG A 66 86.899 -7.465 20.107 1.00 0.00 H new ATOM 0 HB3 ARG A 66 86.395 -6.845 18.547 1.00 0.00 H new ATOM 0 HG2 ARG A 66 87.152 -8.918 17.421 1.00 0.00 H new ATOM 0 HG3 ARG A 66 87.836 -9.525 18.915 1.00 0.00 H new ATOM 0 HD2 ARG A 66 85.618 -10.549 18.558 1.00 0.00 H new ATOM 0 HD3 ARG A 66 85.555 -9.508 19.966 1.00 0.00 H new ATOM 0 HE ARG A 66 84.800 -7.799 17.844 1.00 0.00 H new ATOM 0 HH11 ARG A 66 83.853 -10.903 19.148 1.00 0.00 H new ATOM 0 HH12 ARG A 66 82.159 -10.724 18.679 1.00 0.00 H new ATOM 0 HH21 ARG A 66 82.631 -7.567 17.250 1.00 0.00 H new ATOM 0 HH22 ARG A 66 81.473 -8.851 17.614 1.00 0.00 H new ATOM 1070 N ASP A 67 87.732 -6.782 16.504 1.00 0.00 N ATOM 1071 CA ASP A 67 87.845 -6.392 15.066 1.00 0.00 C ATOM 1072 C ASP A 67 89.073 -7.069 14.451 1.00 0.00 C ATOM 1073 O ASP A 67 89.791 -6.479 13.668 1.00 0.00 O ATOM 1074 CB ASP A 67 87.985 -4.869 14.950 1.00 0.00 C ATOM 1075 CG ASP A 67 87.734 -4.441 13.503 1.00 0.00 C ATOM 1076 OD1 ASP A 67 87.804 -5.292 12.633 1.00 0.00 O ATOM 1077 OD2 ASP A 67 87.474 -3.268 13.292 1.00 0.00 O ATOM 0 H ASP A 67 86.865 -7.255 16.758 1.00 0.00 H new ATOM 0 HA ASP A 67 86.948 -6.710 14.534 1.00 0.00 H new ATOM 0 HB2 ASP A 67 87.275 -4.376 15.614 1.00 0.00 H new ATOM 0 HB3 ASP A 67 88.982 -4.560 15.264 1.00 0.00 H new ATOM 1082 N ASN A 68 89.317 -8.305 14.797 1.00 0.00 N ATOM 1083 CA ASN A 68 90.496 -9.025 14.232 1.00 0.00 C ATOM 1084 C ASN A 68 90.129 -9.620 12.872 1.00 0.00 C ATOM 1085 O ASN A 68 90.952 -10.210 12.202 1.00 0.00 O ATOM 1086 CB ASN A 68 90.911 -10.147 15.187 1.00 0.00 C ATOM 1087 CG ASN A 68 89.766 -11.151 15.329 1.00 0.00 C ATOM 1088 OD1 ASN A 68 88.617 -10.813 15.127 1.00 0.00 O ATOM 1089 ND2 ASN A 68 90.032 -12.382 15.669 1.00 0.00 N ATOM 0 H ASN A 68 88.750 -8.848 15.448 1.00 0.00 H new ATOM 0 HA ASN A 68 91.324 -8.327 14.109 1.00 0.00 H new ATOM 0 HB2 ASN A 68 91.802 -10.648 14.810 1.00 0.00 H new ATOM 0 HB3 ASN A 68 91.167 -9.732 16.162 1.00 0.00 H new ATOM 0 HD21 ASN A 68 89.275 -13.059 15.765 1.00 0.00 H new ATOM 0 HD22 ASN A 68 90.996 -12.667 15.839 1.00 0.00 H new ATOM 1096 N GLU A 69 88.892 -9.474 12.466 1.00 0.00 N ATOM 1097 CA GLU A 69 88.440 -10.031 11.151 1.00 0.00 C ATOM 1098 C GLU A 69 87.838 -8.919 10.291 1.00 0.00 C ATOM 1099 O GLU A 69 87.265 -7.977 10.791 1.00 0.00 O ATOM 1100 CB GLU A 69 87.372 -11.088 11.406 1.00 0.00 C ATOM 1101 CG GLU A 69 87.074 -11.835 10.112 1.00 0.00 C ATOM 1102 CD GLU A 69 86.019 -12.909 10.381 1.00 0.00 C ATOM 1103 OE1 GLU A 69 85.678 -13.097 11.537 1.00 0.00 O ATOM 1104 OE2 GLU A 69 85.573 -13.527 9.428 1.00 0.00 O ATOM 0 H GLU A 69 88.168 -8.988 12.995 1.00 0.00 H new ATOM 0 HA GLU A 69 89.293 -10.467 10.631 1.00 0.00 H new ATOM 0 HB2 GLU A 69 87.712 -11.786 12.171 1.00 0.00 H new ATOM 0 HB3 GLU A 69 86.464 -10.618 11.784 1.00 0.00 H new ATOM 0 HG2 GLU A 69 86.717 -11.141 9.351 1.00 0.00 H new ATOM 0 HG3 GLU A 69 87.984 -12.292 9.724 1.00 0.00 H new ATOM 1111 N VAL A 70 87.960 -9.038 8.995 1.00 0.00 N ATOM 1112 CA VAL A 70 87.391 -8.011 8.067 1.00 0.00 C ATOM 1113 C VAL A 70 86.282 -8.649 7.254 1.00 0.00 C ATOM 1114 O VAL A 70 86.520 -9.354 6.294 1.00 0.00 O ATOM 1115 CB VAL A 70 88.483 -7.544 7.107 1.00 0.00 C ATOM 1116 CG1 VAL A 70 88.041 -6.263 6.418 1.00 0.00 C ATOM 1117 CG2 VAL A 70 89.775 -7.277 7.874 1.00 0.00 C ATOM 0 H VAL A 70 88.436 -9.813 8.532 1.00 0.00 H new ATOM 0 HA VAL A 70 87.008 -7.167 8.641 1.00 0.00 H new ATOM 0 HB VAL A 70 88.657 -8.323 6.365 1.00 0.00 H new ATOM 0 HG11 VAL A 70 88.821 -5.930 5.733 1.00 0.00 H new ATOM 0 HG12 VAL A 70 87.123 -6.448 5.860 1.00 0.00 H new ATOM 0 HG13 VAL A 70 87.862 -5.491 7.166 1.00 0.00 H new ATOM 0 HG21 VAL A 70 90.548 -6.945 7.181 1.00 0.00 H new ATOM 0 HG22 VAL A 70 89.601 -6.503 8.622 1.00 0.00 H new ATOM 0 HG23 VAL A 70 90.101 -8.192 8.368 1.00 0.00 H new ATOM 1127 N ASP A 71 85.072 -8.373 7.604 1.00 0.00 N ATOM 1128 CA ASP A 71 83.943 -8.925 6.826 1.00 0.00 C ATOM 1129 C ASP A 71 83.770 -8.017 5.621 1.00 0.00 C ATOM 1130 O ASP A 71 84.346 -6.948 5.567 1.00 0.00 O ATOM 1131 CB ASP A 71 82.673 -8.912 7.680 1.00 0.00 C ATOM 1132 CG ASP A 71 82.798 -9.953 8.793 1.00 0.00 C ATOM 1133 OD1 ASP A 71 83.420 -10.974 8.554 1.00 0.00 O ATOM 1134 OD2 ASP A 71 82.267 -9.712 9.864 1.00 0.00 O ATOM 0 H ASP A 71 84.811 -7.787 8.397 1.00 0.00 H new ATOM 0 HA ASP A 71 84.132 -9.954 6.520 1.00 0.00 H new ATOM 0 HB2 ASP A 71 82.520 -7.922 8.109 1.00 0.00 H new ATOM 0 HB3 ASP A 71 81.803 -9.129 7.060 1.00 0.00 H new ATOM 1139 N PHE A 72 82.996 -8.394 4.654 1.00 0.00 N ATOM 1140 CA PHE A 72 82.832 -7.496 3.494 1.00 0.00 C ATOM 1141 C PHE A 72 82.324 -6.157 4.023 1.00 0.00 C ATOM 1142 O PHE A 72 82.689 -5.101 3.547 1.00 0.00 O ATOM 1143 CB PHE A 72 81.825 -8.099 2.521 1.00 0.00 C ATOM 1144 CG PHE A 72 81.844 -7.300 1.251 1.00 0.00 C ATOM 1145 CD1 PHE A 72 82.736 -7.644 0.234 1.00 0.00 C ATOM 1146 CD2 PHE A 72 80.987 -6.209 1.096 1.00 0.00 C ATOM 1147 CE1 PHE A 72 82.770 -6.898 -0.945 1.00 0.00 C ATOM 1148 CE2 PHE A 72 81.020 -5.460 -0.083 1.00 0.00 C ATOM 1149 CZ PHE A 72 81.912 -5.804 -1.105 1.00 0.00 C ATOM 0 H PHE A 72 82.477 -9.271 4.616 1.00 0.00 H new ATOM 0 HA PHE A 72 83.776 -7.360 2.965 1.00 0.00 H new ATOM 0 HB2 PHE A 72 82.075 -9.140 2.316 1.00 0.00 H new ATOM 0 HB3 PHE A 72 80.826 -8.091 2.958 1.00 0.00 H new ATOM 0 HD1 PHE A 72 83.399 -8.487 0.359 1.00 0.00 H new ATOM 0 HD2 PHE A 72 80.300 -5.944 1.886 1.00 0.00 H new ATOM 0 HE1 PHE A 72 83.458 -7.165 -1.734 1.00 0.00 H new ATOM 0 HE2 PHE A 72 80.357 -4.616 -0.206 1.00 0.00 H new ATOM 0 HZ PHE A 72 81.938 -5.226 -2.017 1.00 0.00 H new ATOM 1159 N GLN A 73 81.486 -6.205 5.021 1.00 0.00 N ATOM 1160 CA GLN A 73 80.945 -4.957 5.612 1.00 0.00 C ATOM 1161 C GLN A 73 82.059 -4.156 6.306 1.00 0.00 C ATOM 1162 O GLN A 73 82.086 -2.947 6.225 1.00 0.00 O ATOM 1163 CB GLN A 73 79.849 -5.301 6.627 1.00 0.00 C ATOM 1164 CG GLN A 73 79.281 -4.012 7.232 1.00 0.00 C ATOM 1165 CD GLN A 73 78.094 -4.350 8.136 1.00 0.00 C ATOM 1166 OE1 GLN A 73 77.622 -5.469 8.144 1.00 0.00 O ATOM 1167 NE2 GLN A 73 77.581 -3.420 8.896 1.00 0.00 N ATOM 0 H GLN A 73 81.152 -7.066 5.454 1.00 0.00 H new ATOM 0 HA GLN A 73 80.526 -4.347 4.812 1.00 0.00 H new ATOM 0 HB2 GLN A 73 79.054 -5.867 6.141 1.00 0.00 H new ATOM 0 HB3 GLN A 73 80.256 -5.935 7.415 1.00 0.00 H new ATOM 0 HG2 GLN A 73 80.052 -3.496 7.804 1.00 0.00 H new ATOM 0 HG3 GLN A 73 78.966 -3.334 6.439 1.00 0.00 H new ATOM 0 HE21 GLN A 73 77.977 -2.480 8.890 1.00 0.00 H new ATOM 0 HE22 GLN A 73 76.784 -3.634 9.496 1.00 0.00 H new ATOM 1176 N GLU A 74 82.978 -4.788 7.004 1.00 0.00 N ATOM 1177 CA GLU A 74 84.032 -3.987 7.679 1.00 0.00 C ATOM 1178 C GLU A 74 84.960 -3.392 6.633 1.00 0.00 C ATOM 1179 O GLU A 74 85.446 -2.288 6.774 1.00 0.00 O ATOM 1180 CB GLU A 74 84.826 -4.865 8.641 1.00 0.00 C ATOM 1181 CG GLU A 74 83.929 -5.260 9.813 1.00 0.00 C ATOM 1182 CD GLU A 74 84.727 -6.105 10.801 1.00 0.00 C ATOM 1183 OE1 GLU A 74 85.941 -6.072 10.726 1.00 0.00 O ATOM 1184 OE2 GLU A 74 84.111 -6.760 11.626 1.00 0.00 O ATOM 0 H GLU A 74 83.038 -5.799 7.129 1.00 0.00 H new ATOM 0 HA GLU A 74 83.563 -3.184 8.248 1.00 0.00 H new ATOM 0 HB2 GLU A 74 85.187 -5.756 8.127 1.00 0.00 H new ATOM 0 HB3 GLU A 74 85.703 -4.329 9.003 1.00 0.00 H new ATOM 0 HG2 GLU A 74 83.545 -4.368 10.308 1.00 0.00 H new ATOM 0 HG3 GLU A 74 83.067 -5.820 9.452 1.00 0.00 H new ATOM 1191 N TYR A 75 85.213 -4.114 5.582 1.00 0.00 N ATOM 1192 CA TYR A 75 86.114 -3.587 4.532 1.00 0.00 C ATOM 1193 C TYR A 75 85.521 -2.289 3.977 1.00 0.00 C ATOM 1194 O TYR A 75 86.217 -1.322 3.737 1.00 0.00 O ATOM 1195 CB TYR A 75 86.228 -4.622 3.413 1.00 0.00 C ATOM 1196 CG TYR A 75 87.086 -4.076 2.296 1.00 0.00 C ATOM 1197 CD1 TYR A 75 88.447 -3.823 2.515 1.00 0.00 C ATOM 1198 CD2 TYR A 75 86.524 -3.828 1.034 1.00 0.00 C ATOM 1199 CE1 TYR A 75 89.240 -3.323 1.477 1.00 0.00 C ATOM 1200 CE2 TYR A 75 87.320 -3.330 -0.003 1.00 0.00 C ATOM 1201 CZ TYR A 75 88.678 -3.078 0.219 1.00 0.00 C ATOM 1202 OH TYR A 75 89.464 -2.591 -0.804 1.00 0.00 O ATOM 0 H TYR A 75 84.834 -5.045 5.407 1.00 0.00 H new ATOM 0 HA TYR A 75 87.103 -3.388 4.946 1.00 0.00 H new ATOM 0 HB2 TYR A 75 86.663 -5.543 3.800 1.00 0.00 H new ATOM 0 HB3 TYR A 75 85.237 -4.872 3.034 1.00 0.00 H new ATOM 0 HD1 TYR A 75 88.883 -4.014 3.484 1.00 0.00 H new ATOM 0 HD2 TYR A 75 85.475 -4.022 0.863 1.00 0.00 H new ATOM 0 HE1 TYR A 75 90.288 -3.126 1.647 1.00 0.00 H new ATOM 0 HE2 TYR A 75 86.887 -3.140 -0.974 1.00 0.00 H new ATOM 0 HH TYR A 75 88.995 -2.702 -1.658 1.00 0.00 H new ATOM 1212 N CYS A 76 84.230 -2.261 3.799 1.00 0.00 N ATOM 1213 CA CYS A 76 83.559 -1.038 3.289 1.00 0.00 C ATOM 1214 C CYS A 76 83.586 0.020 4.384 1.00 0.00 C ATOM 1215 O CYS A 76 83.786 1.189 4.122 1.00 0.00 O ATOM 1216 CB CYS A 76 82.110 -1.360 2.889 1.00 0.00 C ATOM 1217 SG CYS A 76 81.031 -1.356 4.347 1.00 0.00 S ATOM 0 H CYS A 76 83.605 -3.045 3.988 1.00 0.00 H new ATOM 0 HA CYS A 76 84.079 -0.666 2.406 1.00 0.00 H new ATOM 0 HB2 CYS A 76 81.755 -0.627 2.165 1.00 0.00 H new ATOM 0 HB3 CYS A 76 82.069 -2.334 2.402 1.00 0.00 H new ATOM 0 HG CYS A 76 81.525 -2.144 5.255 1.00 0.00 H new ATOM 1223 N VAL A 77 83.401 -0.375 5.617 1.00 0.00 N ATOM 1224 CA VAL A 77 83.438 0.632 6.700 1.00 0.00 C ATOM 1225 C VAL A 77 84.816 1.275 6.665 1.00 0.00 C ATOM 1226 O VAL A 77 84.957 2.473 6.811 1.00 0.00 O ATOM 1227 CB VAL A 77 83.212 -0.047 8.054 1.00 0.00 C ATOM 1228 CG1 VAL A 77 83.499 0.948 9.192 1.00 0.00 C ATOM 1229 CG2 VAL A 77 81.757 -0.539 8.143 1.00 0.00 C ATOM 0 H VAL A 77 83.229 -1.337 5.911 1.00 0.00 H new ATOM 0 HA VAL A 77 82.657 1.379 6.563 1.00 0.00 H new ATOM 0 HB VAL A 77 83.887 -0.897 8.150 1.00 0.00 H new ATOM 0 HG11 VAL A 77 83.336 0.459 10.152 1.00 0.00 H new ATOM 0 HG12 VAL A 77 84.533 1.286 9.127 1.00 0.00 H new ATOM 0 HG13 VAL A 77 82.831 1.805 9.103 1.00 0.00 H new ATOM 0 HG21 VAL A 77 81.595 -1.023 9.106 1.00 0.00 H new ATOM 0 HG22 VAL A 77 81.079 0.309 8.044 1.00 0.00 H new ATOM 0 HG23 VAL A 77 81.565 -1.253 7.342 1.00 0.00 H new ATOM 1239 N PHE A 78 85.838 0.493 6.438 1.00 0.00 N ATOM 1240 CA PHE A 78 87.194 1.081 6.356 1.00 0.00 C ATOM 1241 C PHE A 78 87.269 1.950 5.101 1.00 0.00 C ATOM 1242 O PHE A 78 87.804 3.035 5.132 1.00 0.00 O ATOM 1243 CB PHE A 78 88.254 -0.022 6.278 1.00 0.00 C ATOM 1244 CG PHE A 78 88.443 -0.656 7.642 1.00 0.00 C ATOM 1245 CD1 PHE A 78 88.943 0.107 8.705 1.00 0.00 C ATOM 1246 CD2 PHE A 78 88.118 -2.003 7.846 1.00 0.00 C ATOM 1247 CE1 PHE A 78 89.117 -0.477 9.965 1.00 0.00 C ATOM 1248 CE2 PHE A 78 88.290 -2.585 9.106 1.00 0.00 C ATOM 1249 CZ PHE A 78 88.791 -1.822 10.166 1.00 0.00 C ATOM 0 H PHE A 78 85.788 -0.517 6.308 1.00 0.00 H new ATOM 0 HA PHE A 78 87.385 1.680 7.247 1.00 0.00 H new ATOM 0 HB2 PHE A 78 87.951 -0.779 5.555 1.00 0.00 H new ATOM 0 HB3 PHE A 78 89.198 0.394 5.927 1.00 0.00 H new ATOM 0 HD1 PHE A 78 89.194 1.146 8.552 1.00 0.00 H new ATOM 0 HD2 PHE A 78 87.733 -2.594 7.028 1.00 0.00 H new ATOM 0 HE1 PHE A 78 89.504 0.112 10.783 1.00 0.00 H new ATOM 0 HE2 PHE A 78 88.036 -3.623 9.261 1.00 0.00 H new ATOM 0 HZ PHE A 78 88.926 -2.271 11.139 1.00 0.00 H new ATOM 1259 N LEU A 79 86.716 1.510 3.994 1.00 0.00 N ATOM 1260 CA LEU A 79 86.773 2.385 2.778 1.00 0.00 C ATOM 1261 C LEU A 79 85.864 3.592 2.988 1.00 0.00 C ATOM 1262 O LEU A 79 86.149 4.687 2.547 1.00 0.00 O ATOM 1263 CB LEU A 79 86.338 1.629 1.516 1.00 0.00 C ATOM 1264 CG LEU A 79 87.424 0.633 1.083 1.00 0.00 C ATOM 1265 CD1 LEU A 79 86.883 -0.196 -0.092 1.00 0.00 C ATOM 1266 CD2 LEU A 79 88.710 1.386 0.649 1.00 0.00 C ATOM 0 H LEU A 79 86.243 0.614 3.880 1.00 0.00 H new ATOM 0 HA LEU A 79 87.805 2.706 2.636 1.00 0.00 H new ATOM 0 HB2 LEU A 79 85.405 1.098 1.706 1.00 0.00 H new ATOM 0 HB3 LEU A 79 86.143 2.337 0.710 1.00 0.00 H new ATOM 0 HG LEU A 79 87.677 -0.019 1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 79 87.642 -0.910 -0.413 1.00 0.00 H new ATOM 0 HD12 LEU A 79 85.989 -0.734 0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 79 86.634 0.467 -0.921 1.00 0.00 H new ATOM 0 HD21 LEU A 79 89.469 0.665 0.345 1.00 0.00 H new ATOM 0 HD22 LEU A 79 88.481 2.045 -0.188 1.00 0.00 H new ATOM 0 HD23 LEU A 79 89.085 1.977 1.484 1.00 0.00 H new ATOM 1278 N SER A 80 84.770 3.394 3.662 1.00 0.00 N ATOM 1279 CA SER A 80 83.829 4.517 3.912 1.00 0.00 C ATOM 1280 C SER A 80 84.502 5.518 4.835 1.00 0.00 C ATOM 1281 O SER A 80 84.396 6.717 4.666 1.00 0.00 O ATOM 1282 CB SER A 80 82.570 3.981 4.585 1.00 0.00 C ATOM 1283 OG SER A 80 82.869 3.636 5.931 1.00 0.00 O ATOM 0 H SER A 80 84.485 2.496 4.053 1.00 0.00 H new ATOM 0 HA SER A 80 83.561 4.996 2.970 1.00 0.00 H new ATOM 0 HB2 SER A 80 81.780 4.732 4.557 1.00 0.00 H new ATOM 0 HB3 SER A 80 82.199 3.108 4.047 1.00 0.00 H new ATOM 0 HG SER A 80 83.751 3.210 5.971 1.00 0.00 H new ATOM 1289 N CYS A 81 85.211 5.022 5.802 1.00 0.00 N ATOM 1290 CA CYS A 81 85.920 5.916 6.741 1.00 0.00 C ATOM 1291 C CYS A 81 87.049 6.602 5.986 1.00 0.00 C ATOM 1292 O CYS A 81 87.401 7.729 6.267 1.00 0.00 O ATOM 1293 CB CYS A 81 86.508 5.091 7.887 1.00 0.00 C ATOM 1294 SG CYS A 81 85.168 4.340 8.842 1.00 0.00 S ATOM 0 H CYS A 81 85.329 4.025 5.982 1.00 0.00 H new ATOM 0 HA CYS A 81 85.231 6.655 7.149 1.00 0.00 H new ATOM 0 HB2 CYS A 81 87.165 4.316 7.491 1.00 0.00 H new ATOM 0 HB3 CYS A 81 87.116 5.726 8.531 1.00 0.00 H new ATOM 0 HG CYS A 81 84.677 3.333 8.183 1.00 0.00 H new ATOM 1300 N ILE A 82 87.619 5.932 5.017 1.00 0.00 N ATOM 1301 CA ILE A 82 88.729 6.569 4.245 1.00 0.00 C ATOM 1302 C ILE A 82 88.168 7.722 3.414 1.00 0.00 C ATOM 1303 O ILE A 82 88.769 8.773 3.310 1.00 0.00 O ATOM 1304 CB ILE A 82 89.405 5.529 3.335 1.00 0.00 C ATOM 1305 CG1 ILE A 82 90.250 4.572 4.194 1.00 0.00 C ATOM 1306 CG2 ILE A 82 90.314 6.231 2.316 1.00 0.00 C ATOM 1307 CD1 ILE A 82 90.565 3.285 3.416 1.00 0.00 C ATOM 0 H ILE A 82 87.369 4.986 4.730 1.00 0.00 H new ATOM 0 HA ILE A 82 89.477 6.957 4.936 1.00 0.00 H new ATOM 0 HB ILE A 82 88.636 4.969 2.803 1.00 0.00 H new ATOM 0 HG12 ILE A 82 91.178 5.062 4.489 1.00 0.00 H new ATOM 0 HG13 ILE A 82 89.714 4.327 5.111 1.00 0.00 H new ATOM 0 HG21 ILE A 82 90.788 5.486 1.677 1.00 0.00 H new ATOM 0 HG22 ILE A 82 89.719 6.909 1.704 1.00 0.00 H new ATOM 0 HG23 ILE A 82 91.082 6.798 2.843 1.00 0.00 H new ATOM 0 HD11 ILE A 82 91.163 2.620 4.039 1.00 0.00 H new ATOM 0 HD12 ILE A 82 89.634 2.787 3.144 1.00 0.00 H new ATOM 0 HD13 ILE A 82 91.121 3.533 2.512 1.00 0.00 H new ATOM 1319 N ALA A 83 87.017 7.545 2.831 1.00 0.00 N ATOM 1320 CA ALA A 83 86.428 8.646 2.023 1.00 0.00 C ATOM 1321 C ALA A 83 86.191 9.857 2.920 1.00 0.00 C ATOM 1322 O ALA A 83 86.555 10.966 2.593 1.00 0.00 O ATOM 1323 CB ALA A 83 85.098 8.197 1.439 1.00 0.00 C ATOM 0 H ALA A 83 86.461 6.691 2.878 1.00 0.00 H new ATOM 0 HA ALA A 83 87.113 8.907 1.216 1.00 0.00 H new ATOM 0 HB1 ALA A 83 84.669 9.006 0.848 1.00 0.00 H new ATOM 0 HB2 ALA A 83 85.255 7.326 0.803 1.00 0.00 H new ATOM 0 HB3 ALA A 83 84.415 7.937 2.248 1.00 0.00 H new ATOM 1329 N MET A 84 85.582 9.652 4.055 1.00 0.00 N ATOM 1330 CA MET A 84 85.327 10.797 4.971 1.00 0.00 C ATOM 1331 C MET A 84 86.660 11.291 5.505 1.00 0.00 C ATOM 1332 O MET A 84 86.877 12.474 5.673 1.00 0.00 O ATOM 1333 CB MET A 84 84.424 10.361 6.128 1.00 0.00 C ATOM 1334 CG MET A 84 83.010 10.095 5.601 1.00 0.00 C ATOM 1335 SD MET A 84 81.933 9.601 6.971 1.00 0.00 S ATOM 1336 CE MET A 84 82.742 8.029 7.357 1.00 0.00 C ATOM 0 H MET A 84 85.252 8.746 4.386 1.00 0.00 H new ATOM 0 HA MET A 84 84.822 11.598 4.431 1.00 0.00 H new ATOM 0 HB2 MET A 84 84.824 9.462 6.596 1.00 0.00 H new ATOM 0 HB3 MET A 84 84.398 11.135 6.895 1.00 0.00 H new ATOM 0 HG2 MET A 84 82.616 10.990 5.120 1.00 0.00 H new ATOM 0 HG3 MET A 84 83.035 9.311 4.844 1.00 0.00 H new ATOM 0 HE1 MET A 84 82.055 7.394 7.917 1.00 0.00 H new ATOM 0 HE2 MET A 84 83.025 7.528 6.431 1.00 0.00 H new ATOM 0 HE3 MET A 84 83.634 8.216 7.955 1.00 0.00 H new ATOM 1346 N MET A 85 87.567 10.396 5.746 1.00 0.00 N ATOM 1347 CA MET A 85 88.895 10.822 6.236 1.00 0.00 C ATOM 1348 C MET A 85 89.490 11.741 5.180 1.00 0.00 C ATOM 1349 O MET A 85 90.270 12.625 5.476 1.00 0.00 O ATOM 1350 CB MET A 85 89.800 9.602 6.422 1.00 0.00 C ATOM 1351 CG MET A 85 91.099 10.033 7.104 1.00 0.00 C ATOM 1352 SD MET A 85 92.261 8.643 7.131 1.00 0.00 S ATOM 1353 CE MET A 85 92.968 8.887 5.482 1.00 0.00 C ATOM 0 H MET A 85 87.446 9.390 5.625 1.00 0.00 H new ATOM 0 HA MET A 85 88.806 11.332 7.195 1.00 0.00 H new ATOM 0 HB2 MET A 85 89.293 8.848 7.024 1.00 0.00 H new ATOM 0 HB3 MET A 85 90.017 9.146 5.456 1.00 0.00 H new ATOM 0 HG2 MET A 85 91.538 10.877 6.572 1.00 0.00 H new ATOM 0 HG3 MET A 85 90.894 10.369 8.121 1.00 0.00 H new ATOM 0 HE1 MET A 85 93.826 8.228 5.353 1.00 0.00 H new ATOM 0 HE2 MET A 85 92.217 8.657 4.726 1.00 0.00 H new ATOM 0 HE3 MET A 85 93.287 9.924 5.373 1.00 0.00 H new ATOM 1363 N CYS A 86 89.118 11.548 3.939 1.00 0.00 N ATOM 1364 CA CYS A 86 89.658 12.426 2.878 1.00 0.00 C ATOM 1365 C CYS A 86 88.869 12.229 1.588 1.00 0.00 C ATOM 1366 O CYS A 86 89.315 11.585 0.659 1.00 0.00 O ATOM 1367 CB CYS A 86 91.136 12.106 2.646 1.00 0.00 C ATOM 1368 SG CYS A 86 91.340 10.320 2.427 1.00 0.00 S ATOM 0 H CYS A 86 88.470 10.826 3.625 1.00 0.00 H new ATOM 0 HA CYS A 86 89.565 13.466 3.191 1.00 0.00 H new ATOM 0 HB2 CYS A 86 91.500 12.635 1.765 1.00 0.00 H new ATOM 0 HB3 CYS A 86 91.731 12.450 3.492 1.00 0.00 H new ATOM 0 HG CYS A 86 90.234 9.715 2.745 1.00 0.00 H new ATOM 1374 N ASN A 87 87.698 12.789 1.531 1.00 0.00 N ATOM 1375 CA ASN A 87 86.855 12.657 0.309 1.00 0.00 C ATOM 1376 C ASN A 87 87.607 13.252 -0.886 1.00 0.00 C ATOM 1377 O ASN A 87 87.567 12.713 -1.969 1.00 0.00 O ATOM 1378 CB ASN A 87 85.546 13.421 0.514 1.00 0.00 C ATOM 1379 CG ASN A 87 84.691 12.699 1.559 1.00 0.00 C ATOM 1380 OD1 ASN A 87 84.290 13.289 2.543 1.00 0.00 O ATOM 1381 ND2 ASN A 87 84.394 11.439 1.386 1.00 0.00 N ATOM 0 H ASN A 87 87.282 13.338 2.283 1.00 0.00 H new ATOM 0 HA ASN A 87 86.639 11.605 0.122 1.00 0.00 H new ATOM 0 HB2 ASN A 87 85.755 14.440 0.840 1.00 0.00 H new ATOM 0 HB3 ASN A 87 85.003 13.493 -0.429 1.00 0.00 H new ATOM 0 HD21 ASN A 87 83.825 10.950 2.077 1.00 0.00 H new ATOM 0 HD22 ASN A 87 84.731 10.944 0.560 1.00 0.00 H new ATOM 1388 N GLU A 88 88.282 14.360 -0.676 1.00 0.00 N ATOM 1389 CA GLU A 88 89.061 15.042 -1.767 1.00 0.00 C ATOM 1390 C GLU A 88 88.142 15.988 -2.544 1.00 0.00 C ATOM 1391 O GLU A 88 88.587 16.781 -3.351 1.00 0.00 O ATOM 1392 CB GLU A 88 89.672 14.016 -2.740 1.00 0.00 C ATOM 1393 CG GLU A 88 90.823 14.668 -3.505 1.00 0.00 C ATOM 1394 CD GLU A 88 91.437 13.657 -4.475 1.00 0.00 C ATOM 1395 OE1 GLU A 88 91.092 12.490 -4.381 1.00 0.00 O ATOM 1396 OE2 GLU A 88 92.233 14.069 -5.303 1.00 0.00 O ATOM 0 H GLU A 88 88.327 14.832 0.227 1.00 0.00 H new ATOM 0 HA GLU A 88 89.871 15.605 -1.303 1.00 0.00 H new ATOM 0 HB2 GLU A 88 90.032 13.146 -2.190 1.00 0.00 H new ATOM 0 HB3 GLU A 88 88.912 13.661 -3.436 1.00 0.00 H new ATOM 0 HG2 GLU A 88 90.461 15.538 -4.053 1.00 0.00 H new ATOM 0 HG3 GLU A 88 91.581 15.023 -2.807 1.00 0.00 H new ATOM 1403 N PHE A 89 86.865 15.908 -2.308 1.00 0.00 N ATOM 1404 CA PHE A 89 85.899 16.794 -3.030 1.00 0.00 C ATOM 1405 C PHE A 89 85.666 18.083 -2.229 1.00 0.00 C ATOM 1406 O PHE A 89 86.377 18.387 -1.292 1.00 0.00 O ATOM 1407 CB PHE A 89 84.571 16.040 -3.219 1.00 0.00 C ATOM 1408 CG PHE A 89 84.643 15.192 -4.472 1.00 0.00 C ATOM 1409 CD1 PHE A 89 85.334 13.974 -4.459 1.00 0.00 C ATOM 1410 CD2 PHE A 89 84.028 15.633 -5.650 1.00 0.00 C ATOM 1411 CE1 PHE A 89 85.408 13.199 -5.625 1.00 0.00 C ATOM 1412 CE2 PHE A 89 84.100 14.858 -6.812 1.00 0.00 C ATOM 1413 CZ PHE A 89 84.790 13.642 -6.800 1.00 0.00 C ATOM 0 H PHE A 89 86.440 15.263 -1.641 1.00 0.00 H new ATOM 0 HA PHE A 89 86.307 17.062 -4.004 1.00 0.00 H new ATOM 0 HB2 PHE A 89 84.372 15.410 -2.352 1.00 0.00 H new ATOM 0 HB3 PHE A 89 83.746 16.749 -3.294 1.00 0.00 H new ATOM 0 HD1 PHE A 89 85.809 13.632 -3.552 1.00 0.00 H new ATOM 0 HD2 PHE A 89 83.497 16.573 -5.661 1.00 0.00 H new ATOM 0 HE1 PHE A 89 85.942 12.260 -5.616 1.00 0.00 H new ATOM 0 HE2 PHE A 89 83.623 15.199 -7.719 1.00 0.00 H new ATOM 0 HZ PHE A 89 84.846 13.044 -7.698 1.00 0.00 H new ATOM 1423 N PHE A 90 84.675 18.847 -2.612 1.00 0.00 N ATOM 1424 CA PHE A 90 84.381 20.128 -1.906 1.00 0.00 C ATOM 1425 C PHE A 90 83.525 19.847 -0.671 1.00 0.00 C ATOM 1426 O PHE A 90 83.038 20.749 -0.020 1.00 0.00 O ATOM 1427 CB PHE A 90 83.619 21.049 -2.857 1.00 0.00 C ATOM 1428 CG PHE A 90 84.287 21.007 -4.206 1.00 0.00 C ATOM 1429 CD1 PHE A 90 85.412 21.797 -4.460 1.00 0.00 C ATOM 1430 CD2 PHE A 90 83.786 20.160 -5.199 1.00 0.00 C ATOM 1431 CE1 PHE A 90 86.036 21.741 -5.712 1.00 0.00 C ATOM 1432 CE2 PHE A 90 84.408 20.102 -6.447 1.00 0.00 C ATOM 1433 CZ PHE A 90 85.535 20.893 -6.706 1.00 0.00 C ATOM 0 H PHE A 90 84.052 18.635 -3.391 1.00 0.00 H new ATOM 0 HA PHE A 90 85.312 20.603 -1.595 1.00 0.00 H new ATOM 0 HB2 PHE A 90 82.580 20.731 -2.940 1.00 0.00 H new ATOM 0 HB3 PHE A 90 83.611 22.068 -2.471 1.00 0.00 H new ATOM 0 HD1 PHE A 90 85.799 22.450 -3.692 1.00 0.00 H new ATOM 0 HD2 PHE A 90 82.917 19.550 -5.000 1.00 0.00 H new ATOM 0 HE1 PHE A 90 86.904 22.352 -5.911 1.00 0.00 H new ATOM 0 HE2 PHE A 90 84.020 19.447 -7.213 1.00 0.00 H new ATOM 0 HZ PHE A 90 86.017 20.848 -7.672 1.00 0.00 H new ATOM 1443 N GLU A 91 83.334 18.599 -0.350 1.00 0.00 N ATOM 1444 CA GLU A 91 82.503 18.247 0.840 1.00 0.00 C ATOM 1445 C GLU A 91 82.954 19.089 2.039 1.00 0.00 C ATOM 1446 O GLU A 91 84.126 19.342 2.226 1.00 0.00 O ATOM 1447 CB GLU A 91 82.687 16.759 1.163 1.00 0.00 C ATOM 1448 CG GLU A 91 81.752 16.345 2.304 1.00 0.00 C ATOM 1449 CD GLU A 91 80.300 16.421 1.830 1.00 0.00 C ATOM 1450 OE1 GLU A 91 80.094 16.526 0.632 1.00 0.00 O ATOM 1451 OE2 GLU A 91 79.420 16.368 2.671 1.00 0.00 O ATOM 0 H GLU A 91 83.717 17.803 -0.860 1.00 0.00 H new ATOM 0 HA GLU A 91 81.453 18.447 0.628 1.00 0.00 H new ATOM 0 HB2 GLU A 91 82.479 16.159 0.277 1.00 0.00 H new ATOM 0 HB3 GLU A 91 83.722 16.566 1.443 1.00 0.00 H new ATOM 0 HG2 GLU A 91 81.986 15.332 2.630 1.00 0.00 H new ATOM 0 HG3 GLU A 91 81.899 16.999 3.164 1.00 0.00 H new ATOM 1458 N GLY A 92 82.027 19.532 2.847 1.00 0.00 N ATOM 1459 CA GLY A 92 82.393 20.366 4.029 1.00 0.00 C ATOM 1460 C GLY A 92 83.145 19.512 5.049 1.00 0.00 C ATOM 1461 O GLY A 92 84.051 18.777 4.709 1.00 0.00 O ATOM 0 H GLY A 92 81.029 19.351 2.739 1.00 0.00 H new ATOM 0 HA2 GLY A 92 83.013 21.206 3.716 1.00 0.00 H new ATOM 0 HA3 GLY A 92 81.495 20.785 4.483 1.00 0.00 H new ATOM 1465 N PHE A 93 82.782 19.607 6.299 1.00 0.00 N ATOM 1466 CA PHE A 93 83.483 18.803 7.339 1.00 0.00 C ATOM 1467 C PHE A 93 83.061 17.323 7.198 1.00 0.00 C ATOM 1468 O PHE A 93 81.898 17.044 6.987 1.00 0.00 O ATOM 1469 CB PHE A 93 83.075 19.311 8.725 1.00 0.00 C ATOM 1470 CG PHE A 93 83.608 20.709 8.933 1.00 0.00 C ATOM 1471 CD1 PHE A 93 82.870 21.813 8.487 1.00 0.00 C ATOM 1472 CD2 PHE A 93 84.837 20.905 9.575 1.00 0.00 C ATOM 1473 CE1 PHE A 93 83.361 23.110 8.681 1.00 0.00 C ATOM 1474 CE2 PHE A 93 85.328 22.202 9.770 1.00 0.00 C ATOM 1475 CZ PHE A 93 84.591 23.304 9.324 1.00 0.00 C ATOM 0 H PHE A 93 82.032 20.206 6.644 1.00 0.00 H new ATOM 0 HA PHE A 93 84.562 18.895 7.215 1.00 0.00 H new ATOM 0 HB2 PHE A 93 81.989 19.308 8.819 1.00 0.00 H new ATOM 0 HB3 PHE A 93 83.463 18.645 9.496 1.00 0.00 H new ATOM 0 HD1 PHE A 93 81.921 21.664 7.993 1.00 0.00 H new ATOM 0 HD2 PHE A 93 85.407 20.055 9.920 1.00 0.00 H new ATOM 0 HE1 PHE A 93 82.792 23.960 8.335 1.00 0.00 H new ATOM 0 HE2 PHE A 93 86.276 22.351 10.265 1.00 0.00 H new ATOM 0 HZ PHE A 93 84.970 24.304 9.475 1.00 0.00 H new ATOM 1485 N PRO A 94 83.969 16.370 7.318 1.00 0.00 N ATOM 1486 CA PRO A 94 83.583 14.932 7.194 1.00 0.00 C ATOM 1487 C PRO A 94 82.816 14.432 8.427 1.00 0.00 C ATOM 1488 O PRO A 94 83.323 14.452 9.532 1.00 0.00 O ATOM 1489 CB PRO A 94 84.954 14.248 7.085 1.00 0.00 C ATOM 1490 CG PRO A 94 85.989 15.204 7.687 1.00 0.00 C ATOM 1491 CD PRO A 94 85.420 16.627 7.573 1.00 0.00 C ATOM 0 HA PRO A 94 82.914 14.735 6.357 1.00 0.00 H new ATOM 0 HB2 PRO A 94 84.953 13.297 7.618 1.00 0.00 H new ATOM 0 HB3 PRO A 94 85.193 14.029 6.044 1.00 0.00 H new ATOM 0 HG2 PRO A 94 86.185 14.951 8.729 1.00 0.00 H new ATOM 0 HG3 PRO A 94 86.938 15.126 7.156 1.00 0.00 H new ATOM 0 HD2 PRO A 94 85.577 17.202 8.486 1.00 0.00 H new ATOM 0 HD3 PRO A 94 85.883 17.186 6.760 1.00 0.00 H new ATOM 1499 N ASP A 95 81.603 13.977 8.250 1.00 0.00 N ATOM 1500 CA ASP A 95 80.820 13.470 9.416 1.00 0.00 C ATOM 1501 C ASP A 95 81.181 12.003 9.666 1.00 0.00 C ATOM 1502 O ASP A 95 80.781 11.120 8.935 1.00 0.00 O ATOM 1503 CB ASP A 95 79.323 13.578 9.116 1.00 0.00 C ATOM 1504 CG ASP A 95 78.528 13.207 10.370 1.00 0.00 C ATOM 1505 OD1 ASP A 95 78.533 12.041 10.728 1.00 0.00 O ATOM 1506 OD2 ASP A 95 77.927 14.096 10.951 1.00 0.00 O ATOM 0 H ASP A 95 81.122 13.935 7.352 1.00 0.00 H new ATOM 0 HA ASP A 95 81.056 14.064 10.299 1.00 0.00 H new ATOM 0 HB2 ASP A 95 79.076 14.592 8.801 1.00 0.00 H new ATOM 0 HB3 ASP A 95 79.057 12.915 8.293 1.00 0.00 H new ATOM 1511 N LYS A 96 81.940 11.741 10.699 1.00 0.00 N ATOM 1512 CA LYS A 96 82.335 10.334 11.008 1.00 0.00 C ATOM 1513 C LYS A 96 81.295 9.702 11.941 1.00 0.00 C ATOM 1514 O LYS A 96 80.428 8.968 11.509 1.00 0.00 O ATOM 1515 CB LYS A 96 83.709 10.340 11.686 1.00 0.00 C ATOM 1516 CG LYS A 96 84.219 8.904 11.836 1.00 0.00 C ATOM 1517 CD LYS A 96 85.594 8.920 12.510 1.00 0.00 C ATOM 1518 CE LYS A 96 86.126 7.489 12.627 1.00 0.00 C ATOM 1519 NZ LYS A 96 86.360 6.930 11.266 1.00 0.00 N ATOM 0 H LYS A 96 82.304 12.443 11.343 1.00 0.00 H new ATOM 0 HA LYS A 96 82.385 9.752 10.088 1.00 0.00 H new ATOM 0 HB2 LYS A 96 84.413 10.926 11.096 1.00 0.00 H new ATOM 0 HB3 LYS A 96 83.640 10.815 12.664 1.00 0.00 H new ATOM 0 HG2 LYS A 96 83.518 8.318 12.430 1.00 0.00 H new ATOM 0 HG3 LYS A 96 84.286 8.426 10.859 1.00 0.00 H new ATOM 0 HD2 LYS A 96 86.287 9.530 11.931 1.00 0.00 H new ATOM 0 HD3 LYS A 96 85.520 9.373 13.499 1.00 0.00 H new ATOM 0 HE2 LYS A 96 87.054 7.481 13.199 1.00 0.00 H new ATOM 0 HE3 LYS A 96 85.412 6.868 13.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 87.017 6.126 11.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 85.457 6.608 10.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 86.770 7.665 10.655 1.00 0.00 H new ATOM 1533 N GLN A 97 81.365 9.989 13.216 1.00 0.00 N ATOM 1534 CA GLN A 97 80.372 9.409 14.170 1.00 0.00 C ATOM 1535 C GLN A 97 79.081 10.242 14.110 1.00 0.00 C ATOM 1536 O GLN A 97 79.134 11.428 13.844 1.00 0.00 O ATOM 1537 CB GLN A 97 80.944 9.449 15.598 1.00 0.00 C ATOM 1538 CG GLN A 97 81.512 10.844 15.907 1.00 0.00 C ATOM 1539 CD GLN A 97 82.940 10.962 15.365 1.00 0.00 C ATOM 1540 OE1 GLN A 97 83.306 11.973 14.802 1.00 0.00 O ATOM 1541 NE2 GLN A 97 83.768 9.963 15.515 1.00 0.00 N ATOM 0 H GLN A 97 82.066 10.599 13.637 1.00 0.00 H new ATOM 0 HA GLN A 97 80.159 8.375 13.899 1.00 0.00 H new ATOM 0 HB2 GLN A 97 80.163 9.199 16.317 1.00 0.00 H new ATOM 0 HB3 GLN A 97 81.727 8.698 15.704 1.00 0.00 H new ATOM 0 HG2 GLN A 97 80.880 11.610 15.458 1.00 0.00 H new ATOM 0 HG3 GLN A 97 81.508 11.017 16.983 1.00 0.00 H new ATOM 0 HE21 GLN A 97 83.461 9.113 15.988 1.00 0.00 H new ATOM 0 HE22 GLN A 97 84.721 10.033 15.159 1.00 0.00 H new ATOM 1550 N PRO A 98 77.924 9.653 14.350 1.00 0.00 N ATOM 1551 CA PRO A 98 76.654 10.432 14.299 1.00 0.00 C ATOM 1552 C PRO A 98 76.652 11.586 15.309 1.00 0.00 C ATOM 1553 O PRO A 98 76.719 11.380 16.505 1.00 0.00 O ATOM 1554 CB PRO A 98 75.589 9.370 14.646 1.00 0.00 C ATOM 1555 CG PRO A 98 76.316 8.090 15.100 1.00 0.00 C ATOM 1556 CD PRO A 98 77.792 8.204 14.682 1.00 0.00 C ATOM 0 HA PRO A 98 76.485 10.913 13.336 1.00 0.00 H new ATOM 0 HB2 PRO A 98 74.932 9.734 15.436 1.00 0.00 H new ATOM 0 HB3 PRO A 98 74.961 9.164 13.779 1.00 0.00 H new ATOM 0 HG2 PRO A 98 76.235 7.969 16.180 1.00 0.00 H new ATOM 0 HG3 PRO A 98 75.859 7.211 14.646 1.00 0.00 H new ATOM 0 HD2 PRO A 98 78.465 7.909 15.487 1.00 0.00 H new ATOM 0 HD3 PRO A 98 78.021 7.569 13.826 1.00 0.00 H new ATOM 1564 N ARG A 99 76.578 12.796 14.833 1.00 0.00 N ATOM 1565 CA ARG A 99 76.575 13.958 15.762 1.00 0.00 C ATOM 1566 C ARG A 99 75.212 14.054 16.450 1.00 0.00 C ATOM 1567 O ARG A 99 74.182 13.864 15.835 1.00 0.00 O ATOM 1568 CB ARG A 99 76.842 15.237 14.966 1.00 0.00 C ATOM 1569 CG ARG A 99 78.291 15.230 14.476 1.00 0.00 C ATOM 1570 CD ARG A 99 78.570 16.504 13.680 1.00 0.00 C ATOM 1571 NE ARG A 99 78.388 17.692 14.557 1.00 0.00 N ATOM 1572 CZ ARG A 99 78.886 18.844 14.202 1.00 0.00 C ATOM 1573 NH1 ARG A 99 79.563 18.947 13.091 1.00 0.00 N ATOM 1574 NH2 ARG A 99 78.711 19.892 14.959 1.00 0.00 N ATOM 0 H ARG A 99 76.520 13.031 13.842 1.00 0.00 H new ATOM 0 HA ARG A 99 77.351 13.830 16.517 1.00 0.00 H new ATOM 0 HB2 ARG A 99 76.159 15.302 14.119 1.00 0.00 H new ATOM 0 HB3 ARG A 99 76.660 16.112 15.589 1.00 0.00 H new ATOM 0 HG2 ARG A 99 78.972 15.163 15.325 1.00 0.00 H new ATOM 0 HG3 ARG A 99 78.471 14.354 13.853 1.00 0.00 H new ATOM 0 HD2 ARG A 99 79.586 16.483 13.286 1.00 0.00 H new ATOM 0 HD3 ARG A 99 77.897 16.565 12.825 1.00 0.00 H new ATOM 0 HE ARG A 99 77.875 17.606 15.434 1.00 0.00 H new ATOM 0 HH11 ARG A 99 79.702 18.127 12.501 1.00 0.00 H new ATOM 0 HH12 ARG A 99 79.953 19.848 12.813 1.00 0.00 H new ATOM 0 HH21 ARG A 99 78.185 19.811 15.829 1.00 0.00 H new ATOM 0 HH22 ARG A 99 79.101 20.793 14.681 1.00 0.00 H new ATOM 1588 N LYS A 100 75.198 14.347 17.722 1.00 0.00 N ATOM 1589 CA LYS A 100 73.902 14.450 18.447 1.00 0.00 C ATOM 1590 C LYS A 100 73.164 15.712 17.994 1.00 0.00 C ATOM 1591 O LYS A 100 73.770 16.723 17.701 1.00 0.00 O ATOM 1592 CB LYS A 100 74.165 14.526 19.951 1.00 0.00 C ATOM 1593 CG LYS A 100 74.821 13.225 20.415 1.00 0.00 C ATOM 1594 CD LYS A 100 75.086 13.297 21.920 1.00 0.00 C ATOM 1595 CE LYS A 100 75.743 11.997 22.384 1.00 0.00 C ATOM 1596 NZ LYS A 100 74.760 10.879 22.300 1.00 0.00 N ATOM 0 H LYS A 100 76.028 14.519 18.289 1.00 0.00 H new ATOM 0 HA LYS A 100 73.292 13.574 18.228 1.00 0.00 H new ATOM 0 HB2 LYS A 100 74.812 15.374 20.176 1.00 0.00 H new ATOM 0 HB3 LYS A 100 73.230 14.687 20.488 1.00 0.00 H new ATOM 0 HG2 LYS A 100 74.174 12.378 20.189 1.00 0.00 H new ATOM 0 HG3 LYS A 100 75.756 13.064 19.877 1.00 0.00 H new ATOM 0 HD2 LYS A 100 75.733 14.145 22.146 1.00 0.00 H new ATOM 0 HD3 LYS A 100 74.151 13.457 22.458 1.00 0.00 H new ATOM 0 HE2 LYS A 100 76.613 11.777 21.765 1.00 0.00 H new ATOM 0 HE3 LYS A 100 76.100 12.104 23.408 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 75.097 10.077 22.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 73.839 11.199 22.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 74.658 10.580 21.309 1.00 0.00 H new ATOM 1610 N LYS A 101 71.859 15.660 17.932 1.00 0.00 N ATOM 1611 CA LYS A 101 71.074 16.857 17.497 1.00 0.00 C ATOM 1612 C LYS A 101 70.570 17.612 18.729 1.00 0.00 C ATOM 1613 O LYS A 101 71.378 18.264 19.372 1.00 0.00 O ATOM 1614 CB LYS A 101 69.880 16.401 16.655 1.00 0.00 C ATOM 1615 CG LYS A 101 70.386 15.786 15.349 1.00 0.00 C ATOM 1616 CD LYS A 101 69.197 15.327 14.502 1.00 0.00 C ATOM 1617 CE LYS A 101 69.707 14.719 13.196 1.00 0.00 C ATOM 1618 NZ LYS A 101 68.571 14.588 12.238 1.00 0.00 N ATOM 1619 OXT LYS A 101 69.386 17.527 19.010 1.00 0.00 O ATOM 0 H LYS A 101 71.300 14.839 18.164 1.00 0.00 H new ATOM 0 HA LYS A 101 71.710 17.514 16.904 1.00 0.00 H new ATOM 0 HB2 LYS A 101 69.288 15.672 17.208 1.00 0.00 H new ATOM 0 HB3 LYS A 101 69.226 17.247 16.442 1.00 0.00 H new ATOM 0 HG2 LYS A 101 70.978 16.516 14.797 1.00 0.00 H new ATOM 0 HG3 LYS A 101 71.041 14.941 15.563 1.00 0.00 H new ATOM 0 HD2 LYS A 101 68.607 14.593 15.051 1.00 0.00 H new ATOM 0 HD3 LYS A 101 68.540 16.171 14.291 1.00 0.00 H new ATOM 0 HE2 LYS A 101 70.488 15.348 12.769 1.00 0.00 H new ATOM 0 HE3 LYS A 101 70.153 13.743 13.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 68.914 14.174 11.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 67.841 13.971 12.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 68.165 15.527 12.050 1.00 0.00 H new TER 1633 LYS A 101 ATOM 1634 N MET B 1 96.736 -3.106 -13.060 1.00 0.00 N ATOM 1635 CA MET B 1 96.857 -4.047 -11.915 1.00 0.00 C ATOM 1636 C MET B 1 97.633 -3.362 -10.790 1.00 0.00 C ATOM 1637 O MET B 1 97.641 -3.811 -9.660 1.00 0.00 O ATOM 1638 CB MET B 1 97.610 -5.303 -12.362 1.00 0.00 C ATOM 1639 CG MET B 1 96.731 -6.110 -13.320 1.00 0.00 C ATOM 1640 SD MET B 1 97.558 -7.665 -13.742 1.00 0.00 S ATOM 1641 CE MET B 1 98.956 -6.959 -14.651 1.00 0.00 C ATOM 0 H1 MET B 1 96.045 -3.477 -13.743 1.00 0.00 H new ATOM 0 H2 MET B 1 96.417 -2.178 -12.715 1.00 0.00 H new ATOM 0 H3 MET B 1 97.661 -3.003 -13.524 1.00 0.00 H new ATOM 0 HA MET B 1 95.865 -4.329 -11.563 1.00 0.00 H new ATOM 0 HB2 MET B 1 98.543 -5.025 -12.853 1.00 0.00 H new ATOM 0 HB3 MET B 1 97.874 -5.909 -11.496 1.00 0.00 H new ATOM 0 HG2 MET B 1 95.765 -6.314 -12.858 1.00 0.00 H new ATOM 0 HG3 MET B 1 96.537 -5.533 -14.224 1.00 0.00 H new ATOM 0 HE1 MET B 1 99.351 -7.701 -15.345 1.00 0.00 H new ATOM 0 HE2 MET B 1 98.623 -6.083 -15.207 1.00 0.00 H new ATOM 0 HE3 MET B 1 99.737 -6.668 -13.949 1.00 0.00 H new ATOM 1653 N ALA B 2 98.290 -2.273 -11.092 1.00 0.00 N ATOM 1654 CA ALA B 2 99.069 -1.557 -10.045 1.00 0.00 C ATOM 1655 C ALA B 2 98.129 -1.123 -8.919 1.00 0.00 C ATOM 1656 O ALA B 2 98.401 -1.341 -7.755 1.00 0.00 O ATOM 1657 CB ALA B 2 99.729 -0.319 -10.657 1.00 0.00 C ATOM 0 H ALA B 2 98.319 -1.850 -12.020 1.00 0.00 H new ATOM 0 HA ALA B 2 99.836 -2.221 -9.646 1.00 0.00 H new ATOM 0 HB1 ALA B 2 100.300 0.206 -9.891 1.00 0.00 H new ATOM 0 HB2 ALA B 2 100.398 -0.624 -11.462 1.00 0.00 H new ATOM 0 HB3 ALA B 2 98.961 0.344 -11.055 1.00 0.00 H new ATOM 1663 N CYS B 3 97.025 -0.510 -9.252 1.00 0.00 N ATOM 1664 CA CYS B 3 96.074 -0.068 -8.193 1.00 0.00 C ATOM 1665 C CYS B 3 94.726 0.313 -8.825 1.00 0.00 C ATOM 1666 O CYS B 3 94.334 1.464 -8.797 1.00 0.00 O ATOM 1667 CB CYS B 3 96.653 1.152 -7.471 1.00 0.00 C ATOM 1668 SG CYS B 3 97.267 2.340 -8.691 1.00 0.00 S ATOM 0 H CYS B 3 96.742 -0.297 -10.208 1.00 0.00 H new ATOM 0 HA CYS B 3 95.923 -0.883 -7.485 1.00 0.00 H new ATOM 0 HB2 CYS B 3 95.888 1.616 -6.848 1.00 0.00 H new ATOM 0 HB3 CYS B 3 97.461 0.845 -6.807 1.00 0.00 H new ATOM 0 HG CYS B 3 96.836 3.530 -8.393 1.00 0.00 H new ATOM 1674 N PRO B 4 94.016 -0.634 -9.393 1.00 0.00 N ATOM 1675 CA PRO B 4 92.700 -0.332 -10.024 1.00 0.00 C ATOM 1676 C PRO B 4 91.634 0.044 -8.983 1.00 0.00 C ATOM 1677 O PRO B 4 90.699 0.765 -9.269 1.00 0.00 O ATOM 1678 CB PRO B 4 92.364 -1.653 -10.744 1.00 0.00 C ATOM 1679 CG PRO B 4 93.331 -2.741 -10.231 1.00 0.00 C ATOM 1680 CD PRO B 4 94.468 -2.053 -9.450 1.00 0.00 C ATOM 0 HA PRO B 4 92.730 0.528 -10.693 1.00 0.00 H new ATOM 0 HB2 PRO B 4 91.331 -1.940 -10.549 1.00 0.00 H new ATOM 0 HB3 PRO B 4 92.464 -1.534 -11.823 1.00 0.00 H new ATOM 0 HG2 PRO B 4 92.803 -3.446 -9.589 1.00 0.00 H new ATOM 0 HG3 PRO B 4 93.736 -3.312 -11.066 1.00 0.00 H new ATOM 0 HD2 PRO B 4 94.590 -2.479 -8.454 1.00 0.00 H new ATOM 0 HD3 PRO B 4 95.427 -2.152 -9.959 1.00 0.00 H new ATOM 1688 N LEU B 5 91.779 -0.428 -7.778 1.00 0.00 N ATOM 1689 CA LEU B 5 90.784 -0.088 -6.722 1.00 0.00 C ATOM 1690 C LEU B 5 90.761 1.430 -6.537 1.00 0.00 C ATOM 1691 O LEU B 5 89.749 2.009 -6.198 1.00 0.00 O ATOM 1692 CB LEU B 5 91.179 -0.769 -5.400 1.00 0.00 C ATOM 1693 CG LEU B 5 90.195 -0.386 -4.278 1.00 0.00 C ATOM 1694 CD1 LEU B 5 88.778 -0.867 -4.626 1.00 0.00 C ATOM 1695 CD2 LEU B 5 90.654 -1.037 -2.967 1.00 0.00 C ATOM 0 H LEU B 5 92.542 -1.034 -7.477 1.00 0.00 H new ATOM 0 HA LEU B 5 89.795 -0.438 -7.017 1.00 0.00 H new ATOM 0 HB2 LEU B 5 91.187 -1.851 -5.530 1.00 0.00 H new ATOM 0 HB3 LEU B 5 92.190 -0.474 -5.121 1.00 0.00 H new ATOM 0 HG LEU B 5 90.178 0.698 -4.168 1.00 0.00 H new ATOM 0 HD11 LEU B 5 88.093 -0.590 -3.825 1.00 0.00 H new ATOM 0 HD12 LEU B 5 88.454 -0.402 -5.557 1.00 0.00 H new ATOM 0 HD13 LEU B 5 88.780 -1.951 -4.743 1.00 0.00 H new ATOM 0 HD21 LEU B 5 89.963 -0.771 -2.167 1.00 0.00 H new ATOM 0 HD22 LEU B 5 90.672 -2.120 -3.086 1.00 0.00 H new ATOM 0 HD23 LEU B 5 91.654 -0.683 -2.715 1.00 0.00 H new ATOM 1707 N GLU B 6 91.875 2.074 -6.741 1.00 0.00 N ATOM 1708 CA GLU B 6 91.926 3.553 -6.558 1.00 0.00 C ATOM 1709 C GLU B 6 90.938 4.236 -7.506 1.00 0.00 C ATOM 1710 O GLU B 6 90.168 5.087 -7.105 1.00 0.00 O ATOM 1711 CB GLU B 6 93.338 4.040 -6.879 1.00 0.00 C ATOM 1712 CG GLU B 6 93.445 5.538 -6.576 1.00 0.00 C ATOM 1713 CD GLU B 6 94.867 6.022 -6.872 1.00 0.00 C ATOM 1714 OE1 GLU B 6 95.720 5.182 -7.105 1.00 0.00 O ATOM 1715 OE2 GLU B 6 95.076 7.223 -6.857 1.00 0.00 O ATOM 0 H GLU B 6 92.753 1.641 -7.027 1.00 0.00 H new ATOM 0 HA GLU B 6 91.662 3.798 -5.529 1.00 0.00 H new ATOM 0 HB2 GLU B 6 94.068 3.486 -6.289 1.00 0.00 H new ATOM 0 HB3 GLU B 6 93.569 3.853 -7.928 1.00 0.00 H new ATOM 0 HG2 GLU B 6 92.728 6.094 -7.180 1.00 0.00 H new ATOM 0 HG3 GLU B 6 93.196 5.727 -5.532 1.00 0.00 H new ATOM 1722 N LYS B 7 90.946 3.878 -8.758 1.00 0.00 N ATOM 1723 CA LYS B 7 89.999 4.515 -9.710 1.00 0.00 C ATOM 1724 C LYS B 7 88.589 4.043 -9.380 1.00 0.00 C ATOM 1725 O LYS B 7 87.666 4.824 -9.302 1.00 0.00 O ATOM 1726 CB LYS B 7 90.367 4.126 -11.143 1.00 0.00 C ATOM 1727 CG LYS B 7 89.389 4.793 -12.120 1.00 0.00 C ATOM 1728 CD LYS B 7 89.898 4.658 -13.563 1.00 0.00 C ATOM 1729 CE LYS B 7 89.608 3.251 -14.098 1.00 0.00 C ATOM 1730 NZ LYS B 7 88.140 3.002 -14.071 1.00 0.00 N ATOM 0 H LYS B 7 91.565 3.175 -9.162 1.00 0.00 H new ATOM 0 HA LYS B 7 90.051 5.600 -9.623 1.00 0.00 H new ATOM 0 HB2 LYS B 7 91.388 4.436 -11.365 1.00 0.00 H new ATOM 0 HB3 LYS B 7 90.331 3.043 -11.258 1.00 0.00 H new ATOM 0 HG2 LYS B 7 88.405 4.333 -12.030 1.00 0.00 H new ATOM 0 HG3 LYS B 7 89.273 5.847 -11.866 1.00 0.00 H new ATOM 0 HD2 LYS B 7 89.416 5.402 -14.197 1.00 0.00 H new ATOM 0 HD3 LYS B 7 90.970 4.854 -13.598 1.00 0.00 H new ATOM 0 HE2 LYS B 7 89.986 3.152 -15.116 1.00 0.00 H new ATOM 0 HE3 LYS B 7 90.125 2.506 -13.493 1.00 0.00 H new ATOM 0 HZ1 LYS B 7 87.896 2.284 -14.783 1.00 0.00 H new ATOM 0 HZ2 LYS B 7 87.863 2.662 -13.128 1.00 0.00 H new ATOM 0 HZ3 LYS B 7 87.634 3.886 -14.283 1.00 0.00 H new ATOM 1744 N ALA B 8 88.416 2.774 -9.144 1.00 0.00 N ATOM 1745 CA ALA B 8 87.066 2.288 -8.784 1.00 0.00 C ATOM 1746 C ALA B 8 86.665 3.014 -7.505 1.00 0.00 C ATOM 1747 O ALA B 8 85.549 3.462 -7.345 1.00 0.00 O ATOM 1748 CB ALA B 8 87.090 0.769 -8.568 1.00 0.00 C ATOM 0 H ALA B 8 89.145 2.062 -9.185 1.00 0.00 H new ATOM 0 HA ALA B 8 86.348 2.488 -9.579 1.00 0.00 H new ATOM 0 HB1 ALA B 8 86.091 0.423 -8.304 1.00 0.00 H new ATOM 0 HB2 ALA B 8 87.414 0.276 -9.485 1.00 0.00 H new ATOM 0 HB3 ALA B 8 87.783 0.527 -7.762 1.00 0.00 H new ATOM 1754 N LEU B 9 87.593 3.177 -6.607 1.00 0.00 N ATOM 1755 CA LEU B 9 87.282 3.926 -5.369 1.00 0.00 C ATOM 1756 C LEU B 9 86.867 5.319 -5.814 1.00 0.00 C ATOM 1757 O LEU B 9 85.931 5.904 -5.305 1.00 0.00 O ATOM 1758 CB LEU B 9 88.523 3.993 -4.470 1.00 0.00 C ATOM 1759 CG LEU B 9 88.216 4.768 -3.180 1.00 0.00 C ATOM 1760 CD1 LEU B 9 87.210 3.987 -2.313 1.00 0.00 C ATOM 1761 CD2 LEU B 9 89.524 4.972 -2.406 1.00 0.00 C ATOM 0 H LEU B 9 88.548 2.825 -6.679 1.00 0.00 H new ATOM 0 HA LEU B 9 86.491 3.445 -4.793 1.00 0.00 H new ATOM 0 HB2 LEU B 9 88.855 2.984 -4.224 1.00 0.00 H new ATOM 0 HB3 LEU B 9 89.340 4.476 -5.005 1.00 0.00 H new ATOM 0 HG LEU B 9 87.776 5.734 -3.430 1.00 0.00 H new ATOM 0 HD11 LEU B 9 87.002 4.548 -1.402 1.00 0.00 H new ATOM 0 HD12 LEU B 9 86.284 3.843 -2.870 1.00 0.00 H new ATOM 0 HD13 LEU B 9 87.631 3.016 -2.052 1.00 0.00 H new ATOM 0 HD21 LEU B 9 89.321 5.522 -1.487 1.00 0.00 H new ATOM 0 HD22 LEU B 9 89.957 4.002 -2.161 1.00 0.00 H new ATOM 0 HD23 LEU B 9 90.225 5.538 -3.019 1.00 0.00 H new ATOM 1773 N ASP B 10 87.552 5.843 -6.798 1.00 0.00 N ATOM 1774 CA ASP B 10 87.188 7.182 -7.316 1.00 0.00 C ATOM 1775 C ASP B 10 85.826 7.075 -8.005 1.00 0.00 C ATOM 1776 O ASP B 10 85.014 7.974 -7.934 1.00 0.00 O ATOM 1777 CB ASP B 10 88.249 7.667 -8.309 1.00 0.00 C ATOM 1778 CG ASP B 10 88.009 9.142 -8.629 1.00 0.00 C ATOM 1779 OD1 ASP B 10 86.959 9.643 -8.261 1.00 0.00 O ATOM 1780 OD2 ASP B 10 88.878 9.745 -9.235 1.00 0.00 O ATOM 0 H ASP B 10 88.345 5.397 -7.260 1.00 0.00 H new ATOM 0 HA ASP B 10 87.135 7.900 -6.498 1.00 0.00 H new ATOM 0 HB2 ASP B 10 89.245 7.532 -7.888 1.00 0.00 H new ATOM 0 HB3 ASP B 10 88.206 7.074 -9.222 1.00 0.00 H new ATOM 1785 N VAL B 11 85.561 5.975 -8.669 1.00 0.00 N ATOM 1786 CA VAL B 11 84.238 5.827 -9.350 1.00 0.00 C ATOM 1787 C VAL B 11 83.134 5.918 -8.292 1.00 0.00 C ATOM 1788 O VAL B 11 82.110 6.542 -8.498 1.00 0.00 O ATOM 1789 CB VAL B 11 84.156 4.459 -10.045 1.00 0.00 C ATOM 1790 CG1 VAL B 11 82.726 4.203 -10.541 1.00 0.00 C ATOM 1791 CG2 VAL B 11 85.132 4.411 -11.231 1.00 0.00 C ATOM 0 H VAL B 11 86.196 5.183 -8.768 1.00 0.00 H new ATOM 0 HA VAL B 11 84.119 6.613 -10.095 1.00 0.00 H new ATOM 0 HB VAL B 11 84.428 3.685 -9.327 1.00 0.00 H new ATOM 0 HG11 VAL B 11 82.680 3.231 -11.032 1.00 0.00 H new ATOM 0 HG12 VAL B 11 82.040 4.215 -9.694 1.00 0.00 H new ATOM 0 HG13 VAL B 11 82.442 4.981 -11.250 1.00 0.00 H new ATOM 0 HG21 VAL B 11 85.066 3.438 -11.717 1.00 0.00 H new ATOM 0 HG22 VAL B 11 84.874 5.192 -11.946 1.00 0.00 H new ATOM 0 HG23 VAL B 11 86.149 4.570 -10.872 1.00 0.00 H new ATOM 1801 N MET B 12 83.340 5.302 -7.159 1.00 0.00 N ATOM 1802 CA MET B 12 82.313 5.353 -6.081 1.00 0.00 C ATOM 1803 C MET B 12 82.085 6.805 -5.670 1.00 0.00 C ATOM 1804 O MET B 12 80.973 7.241 -5.450 1.00 0.00 O ATOM 1805 CB MET B 12 82.820 4.562 -4.873 1.00 0.00 C ATOM 1806 CG MET B 12 82.835 3.065 -5.199 1.00 0.00 C ATOM 1807 SD MET B 12 83.947 2.210 -4.054 1.00 0.00 S ATOM 1808 CE MET B 12 83.335 2.964 -2.528 1.00 0.00 C ATOM 0 H MET B 12 84.177 4.765 -6.934 1.00 0.00 H new ATOM 0 HA MET B 12 81.378 4.923 -6.441 1.00 0.00 H new ATOM 0 HB2 MET B 12 83.823 4.895 -4.604 1.00 0.00 H new ATOM 0 HB3 MET B 12 82.180 4.749 -4.010 1.00 0.00 H new ATOM 0 HG2 MET B 12 81.828 2.654 -5.120 1.00 0.00 H new ATOM 0 HG3 MET B 12 83.163 2.909 -6.227 1.00 0.00 H new ATOM 0 HE1 MET B 12 83.602 2.335 -1.679 1.00 0.00 H new ATOM 0 HE2 MET B 12 83.783 3.950 -2.404 1.00 0.00 H new ATOM 0 HE3 MET B 12 82.251 3.062 -2.580 1.00 0.00 H new ATOM 1818 N VAL B 13 83.143 7.551 -5.550 1.00 0.00 N ATOM 1819 CA VAL B 13 83.016 8.978 -5.145 1.00 0.00 C ATOM 1820 C VAL B 13 82.657 9.842 -6.363 1.00 0.00 C ATOM 1821 O VAL B 13 81.850 10.745 -6.277 1.00 0.00 O ATOM 1822 CB VAL B 13 84.345 9.446 -4.545 1.00 0.00 C ATOM 1823 CG1 VAL B 13 84.174 10.838 -3.932 1.00 0.00 C ATOM 1824 CG2 VAL B 13 84.786 8.467 -3.452 1.00 0.00 C ATOM 0 H VAL B 13 84.098 7.233 -5.716 1.00 0.00 H new ATOM 0 HA VAL B 13 82.224 9.078 -4.403 1.00 0.00 H new ATOM 0 HB VAL B 13 85.099 9.484 -5.332 1.00 0.00 H new ATOM 0 HG11 VAL B 13 85.122 11.167 -3.506 1.00 0.00 H new ATOM 0 HG12 VAL B 13 83.860 11.540 -4.705 1.00 0.00 H new ATOM 0 HG13 VAL B 13 83.418 10.800 -3.148 1.00 0.00 H new ATOM 0 HG21 VAL B 13 85.732 8.800 -3.025 1.00 0.00 H new ATOM 0 HG22 VAL B 13 84.028 8.430 -2.670 1.00 0.00 H new ATOM 0 HG23 VAL B 13 84.912 7.474 -3.883 1.00 0.00 H new ATOM 1834 N SER B 14 83.260 9.582 -7.494 1.00 0.00 N ATOM 1835 CA SER B 14 82.960 10.401 -8.709 1.00 0.00 C ATOM 1836 C SER B 14 81.483 10.257 -9.095 1.00 0.00 C ATOM 1837 O SER B 14 80.810 11.230 -9.379 1.00 0.00 O ATOM 1838 CB SER B 14 83.835 9.925 -9.871 1.00 0.00 C ATOM 1839 OG SER B 14 83.644 10.784 -10.987 1.00 0.00 O ATOM 0 H SER B 14 83.946 8.840 -7.630 1.00 0.00 H new ATOM 0 HA SER B 14 83.170 11.448 -8.491 1.00 0.00 H new ATOM 0 HB2 SER B 14 84.884 9.923 -9.574 1.00 0.00 H new ATOM 0 HB3 SER B 14 83.578 8.900 -10.138 1.00 0.00 H new ATOM 0 HG SER B 14 84.205 10.482 -11.732 1.00 0.00 H new ATOM 1845 N THR B 15 80.976 9.054 -9.111 1.00 0.00 N ATOM 1846 CA THR B 15 79.546 8.845 -9.483 1.00 0.00 C ATOM 1847 C THR B 15 78.645 9.593 -8.495 1.00 0.00 C ATOM 1848 O THR B 15 77.658 10.193 -8.863 1.00 0.00 O ATOM 1849 CB THR B 15 79.243 7.340 -9.469 1.00 0.00 C ATOM 1850 OG1 THR B 15 78.107 7.079 -10.282 1.00 0.00 O ATOM 1851 CG2 THR B 15 78.981 6.848 -8.041 1.00 0.00 C ATOM 0 H THR B 15 81.492 8.204 -8.882 1.00 0.00 H new ATOM 0 HA THR B 15 79.355 9.235 -10.483 1.00 0.00 H new ATOM 0 HB THR B 15 80.109 6.807 -9.862 1.00 0.00 H new ATOM 0 HG1 THR B 15 77.914 6.118 -10.275 1.00 0.00 H new ATOM 0 HG21 THR B 15 78.769 5.779 -8.058 1.00 0.00 H new ATOM 0 HG22 THR B 15 79.861 7.034 -7.425 1.00 0.00 H new ATOM 0 HG23 THR B 15 78.127 7.381 -7.624 1.00 0.00 H new ATOM 1859 N PHE B 16 78.997 9.556 -7.243 1.00 0.00 N ATOM 1860 CA PHE B 16 78.192 10.252 -6.193 1.00 0.00 C ATOM 1861 C PHE B 16 78.132 11.744 -6.506 1.00 0.00 C ATOM 1862 O PHE B 16 77.116 12.389 -6.335 1.00 0.00 O ATOM 1863 CB PHE B 16 78.860 10.037 -4.830 1.00 0.00 C ATOM 1864 CG PHE B 16 78.073 10.734 -3.743 1.00 0.00 C ATOM 1865 CD1 PHE B 16 77.049 10.056 -3.072 1.00 0.00 C ATOM 1866 CD2 PHE B 16 78.381 12.058 -3.396 1.00 0.00 C ATOM 1867 CE1 PHE B 16 76.331 10.701 -2.056 1.00 0.00 C ATOM 1868 CE2 PHE B 16 77.662 12.702 -2.382 1.00 0.00 C ATOM 1869 CZ PHE B 16 76.637 12.023 -1.711 1.00 0.00 C ATOM 0 H PHE B 16 79.821 9.066 -6.893 1.00 0.00 H new ATOM 0 HA PHE B 16 77.179 9.849 -6.173 1.00 0.00 H new ATOM 0 HB2 PHE B 16 78.926 8.971 -4.614 1.00 0.00 H new ATOM 0 HB3 PHE B 16 79.880 10.421 -4.853 1.00 0.00 H new ATOM 0 HD1 PHE B 16 76.812 9.036 -3.337 1.00 0.00 H new ATOM 0 HD2 PHE B 16 79.173 12.581 -3.911 1.00 0.00 H new ATOM 0 HE1 PHE B 16 75.541 10.178 -1.538 1.00 0.00 H new ATOM 0 HE2 PHE B 16 77.898 13.722 -2.117 1.00 0.00 H new ATOM 0 HZ PHE B 16 76.083 12.519 -0.928 1.00 0.00 H new ATOM 1879 N HIS B 17 79.211 12.293 -6.970 1.00 0.00 N ATOM 1880 CA HIS B 17 79.233 13.741 -7.306 1.00 0.00 C ATOM 1881 C HIS B 17 78.180 14.021 -8.384 1.00 0.00 C ATOM 1882 O HIS B 17 77.506 15.031 -8.360 1.00 0.00 O ATOM 1883 CB HIS B 17 80.622 14.118 -7.834 1.00 0.00 C ATOM 1884 CG HIS B 17 80.656 15.582 -8.177 1.00 0.00 C ATOM 1885 ND1 HIS B 17 80.351 16.054 -9.447 1.00 0.00 N ATOM 1886 CD2 HIS B 17 80.961 16.694 -7.430 1.00 0.00 C ATOM 1887 CE1 HIS B 17 80.478 17.393 -9.425 1.00 0.00 C ATOM 1888 NE2 HIS B 17 80.849 17.831 -8.221 1.00 0.00 N ATOM 0 H HIS B 17 80.088 11.799 -7.133 1.00 0.00 H new ATOM 0 HA HIS B 17 79.012 14.331 -6.417 1.00 0.00 H new ATOM 0 HB2 HIS B 17 81.380 13.893 -7.084 1.00 0.00 H new ATOM 0 HB3 HIS B 17 80.860 13.523 -8.716 1.00 0.00 H new ATOM 0 HD2 HIS B 17 81.244 16.686 -6.388 1.00 0.00 H new ATOM 0 HE1 HIS B 17 80.302 18.034 -10.276 1.00 0.00 H new ATOM 0 HE2 HIS B 17 81.015 18.797 -7.940 1.00 0.00 H new ATOM 1897 N LYS B 18 78.044 13.138 -9.338 1.00 0.00 N ATOM 1898 CA LYS B 18 77.048 13.358 -10.430 1.00 0.00 C ATOM 1899 C LYS B 18 75.636 13.468 -9.841 1.00 0.00 C ATOM 1900 O LYS B 18 74.845 14.285 -10.268 1.00 0.00 O ATOM 1901 CB LYS B 18 77.098 12.176 -11.407 1.00 0.00 C ATOM 1902 CG LYS B 18 78.443 12.161 -12.159 1.00 0.00 C ATOM 1903 CD LYS B 18 78.387 13.085 -13.396 1.00 0.00 C ATOM 1904 CE LYS B 18 77.883 12.301 -14.616 1.00 0.00 C ATOM 1905 NZ LYS B 18 77.867 13.194 -15.809 1.00 0.00 N ATOM 0 H LYS B 18 78.580 12.273 -9.409 1.00 0.00 H new ATOM 0 HA LYS B 18 77.290 14.283 -10.953 1.00 0.00 H new ATOM 0 HB2 LYS B 18 76.967 11.240 -10.864 1.00 0.00 H new ATOM 0 HB3 LYS B 18 76.276 12.249 -12.119 1.00 0.00 H new ATOM 0 HG2 LYS B 18 79.242 12.486 -11.492 1.00 0.00 H new ATOM 0 HG3 LYS B 18 78.681 11.143 -12.469 1.00 0.00 H new ATOM 0 HD2 LYS B 18 77.728 13.930 -13.199 1.00 0.00 H new ATOM 0 HD3 LYS B 18 79.377 13.494 -13.600 1.00 0.00 H new ATOM 0 HE2 LYS B 18 78.527 11.441 -14.801 1.00 0.00 H new ATOM 0 HE3 LYS B 18 76.882 11.914 -14.425 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 77.526 12.663 -16.636 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 77.235 14.001 -15.630 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 78.829 13.542 -15.995 1.00 0.00 H new ATOM 1919 N TYR B 19 75.306 12.664 -8.863 1.00 0.00 N ATOM 1920 CA TYR B 19 73.938 12.755 -8.263 1.00 0.00 C ATOM 1921 C TYR B 19 73.813 14.066 -7.488 1.00 0.00 C ATOM 1922 O TYR B 19 72.792 14.724 -7.516 1.00 0.00 O ATOM 1923 CB TYR B 19 73.699 11.585 -7.305 1.00 0.00 C ATOM 1924 CG TYR B 19 73.456 10.316 -8.088 1.00 0.00 C ATOM 1925 CD1 TYR B 19 72.158 9.979 -8.488 1.00 0.00 C ATOM 1926 CD2 TYR B 19 74.526 9.484 -8.423 1.00 0.00 C ATOM 1927 CE1 TYR B 19 71.929 8.810 -9.220 1.00 0.00 C ATOM 1928 CE2 TYR B 19 74.299 8.315 -9.158 1.00 0.00 C ATOM 1929 CZ TYR B 19 73.001 7.980 -9.556 1.00 0.00 C ATOM 1930 OH TYR B 19 72.779 6.832 -10.283 1.00 0.00 O ATOM 0 H TYR B 19 75.916 11.955 -8.456 1.00 0.00 H new ATOM 0 HA TYR B 19 73.199 12.719 -9.063 1.00 0.00 H new ATOM 0 HB2 TYR B 19 74.561 11.458 -6.650 1.00 0.00 H new ATOM 0 HB3 TYR B 19 72.842 11.797 -6.666 1.00 0.00 H new ATOM 0 HD1 TYR B 19 71.331 10.624 -8.231 1.00 0.00 H new ATOM 0 HD2 TYR B 19 75.528 9.742 -8.115 1.00 0.00 H new ATOM 0 HE1 TYR B 19 70.926 8.550 -9.525 1.00 0.00 H new ATOM 0 HE2 TYR B 19 75.126 7.671 -9.418 1.00 0.00 H new ATOM 0 HH TYR B 19 73.535 6.676 -10.886 1.00 0.00 H new ATOM 1940 N SER B 20 74.847 14.441 -6.794 1.00 0.00 N ATOM 1941 CA SER B 20 74.809 15.703 -6.005 1.00 0.00 C ATOM 1942 C SER B 20 74.435 16.869 -6.926 1.00 0.00 C ATOM 1943 O SER B 20 74.045 17.928 -6.474 1.00 0.00 O ATOM 1944 CB SER B 20 76.194 15.938 -5.388 1.00 0.00 C ATOM 1945 OG SER B 20 76.241 15.336 -4.101 1.00 0.00 O ATOM 0 H SER B 20 75.725 13.924 -6.738 1.00 0.00 H new ATOM 0 HA SER B 20 74.065 15.631 -5.212 1.00 0.00 H new ATOM 0 HB2 SER B 20 76.967 15.515 -6.029 1.00 0.00 H new ATOM 0 HB3 SER B 20 76.394 17.007 -5.310 1.00 0.00 H new ATOM 0 HG SER B 20 76.675 15.947 -3.470 1.00 0.00 H new ATOM 1951 N GLY B 21 74.566 16.691 -8.210 1.00 0.00 N ATOM 1952 CA GLY B 21 74.232 17.804 -9.150 1.00 0.00 C ATOM 1953 C GLY B 21 72.718 17.886 -9.369 1.00 0.00 C ATOM 1954 O GLY B 21 72.198 18.909 -9.769 1.00 0.00 O ATOM 0 H GLY B 21 74.888 15.829 -8.651 1.00 0.00 H new ATOM 0 HA2 GLY B 21 74.599 18.749 -8.749 1.00 0.00 H new ATOM 0 HA3 GLY B 21 74.735 17.646 -10.104 1.00 0.00 H new ATOM 1958 N LYS B 22 72.010 16.821 -9.130 1.00 0.00 N ATOM 1959 CA LYS B 22 70.535 16.845 -9.350 1.00 0.00 C ATOM 1960 C LYS B 22 69.849 17.730 -8.305 1.00 0.00 C ATOM 1961 O LYS B 22 68.919 18.451 -8.608 1.00 0.00 O ATOM 1962 CB LYS B 22 69.992 15.425 -9.232 1.00 0.00 C ATOM 1963 CG LYS B 22 70.666 14.532 -10.281 1.00 0.00 C ATOM 1964 CD LYS B 22 69.848 13.254 -10.482 1.00 0.00 C ATOM 1965 CE LYS B 22 69.528 12.615 -9.127 1.00 0.00 C ATOM 1966 NZ LYS B 22 69.180 11.180 -9.327 1.00 0.00 N ATOM 0 H LYS B 22 72.385 15.935 -8.792 1.00 0.00 H new ATOM 0 HA LYS B 22 70.333 17.249 -10.342 1.00 0.00 H new ATOM 0 HB2 LYS B 22 70.179 15.034 -8.232 1.00 0.00 H new ATOM 0 HB3 LYS B 22 68.912 15.424 -9.378 1.00 0.00 H new ATOM 0 HG2 LYS B 22 70.755 15.069 -11.225 1.00 0.00 H new ATOM 0 HG3 LYS B 22 71.677 14.280 -9.961 1.00 0.00 H new ATOM 0 HD2 LYS B 22 68.924 13.484 -11.012 1.00 0.00 H new ATOM 0 HD3 LYS B 22 70.404 12.551 -11.102 1.00 0.00 H new ATOM 0 HE2 LYS B 22 70.385 12.703 -8.459 1.00 0.00 H new ATOM 0 HE3 LYS B 22 68.699 13.139 -8.652 1.00 0.00 H new ATOM 0 HZ1 LYS B 22 68.816 10.784 -8.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 22 68.452 11.099 -10.065 1.00 0.00 H new ATOM 0 HZ3 LYS B 22 70.029 10.654 -9.619 1.00 0.00 H new ATOM 1980 N GLU B 23 70.290 17.670 -7.073 1.00 0.00 N ATOM 1981 CA GLU B 23 69.659 18.491 -5.991 1.00 0.00 C ATOM 1982 C GLU B 23 70.563 19.663 -5.629 1.00 0.00 C ATOM 1983 O GLU B 23 71.750 19.654 -5.888 1.00 0.00 O ATOM 1984 CB GLU B 23 69.451 17.619 -4.750 1.00 0.00 C ATOM 1985 CG GLU B 23 68.249 16.706 -4.972 1.00 0.00 C ATOM 1986 CD GLU B 23 68.037 15.833 -3.735 1.00 0.00 C ATOM 1987 OE1 GLU B 23 67.451 16.321 -2.784 1.00 0.00 O ATOM 1988 OE2 GLU B 23 68.463 14.690 -3.760 1.00 0.00 O ATOM 0 H GLU B 23 71.066 17.083 -6.767 1.00 0.00 H new ATOM 0 HA GLU B 23 68.701 18.871 -6.346 1.00 0.00 H new ATOM 0 HB2 GLU B 23 70.343 17.024 -4.556 1.00 0.00 H new ATOM 0 HB3 GLU B 23 69.289 18.246 -3.873 1.00 0.00 H new ATOM 0 HG2 GLU B 23 67.357 17.302 -5.167 1.00 0.00 H new ATOM 0 HG3 GLU B 23 68.412 16.079 -5.849 1.00 0.00 H new ATOM 1995 N GLY B 24 70.003 20.672 -5.025 1.00 0.00 N ATOM 1996 CA GLY B 24 70.817 21.849 -4.634 1.00 0.00 C ATOM 1997 C GLY B 24 71.703 21.479 -3.444 1.00 0.00 C ATOM 1998 O GLY B 24 72.594 22.215 -3.068 1.00 0.00 O ATOM 0 H GLY B 24 69.013 20.730 -4.786 1.00 0.00 H new ATOM 0 HA2 GLY B 24 71.432 22.175 -5.473 1.00 0.00 H new ATOM 0 HA3 GLY B 24 70.167 22.684 -4.372 1.00 0.00 H new ATOM 2002 N ASP B 25 71.473 20.332 -2.854 1.00 0.00 N ATOM 2003 CA ASP B 25 72.309 19.900 -1.691 1.00 0.00 C ATOM 2004 C ASP B 25 73.392 18.950 -2.204 1.00 0.00 C ATOM 2005 O ASP B 25 73.119 17.821 -2.563 1.00 0.00 O ATOM 2006 CB ASP B 25 71.426 19.168 -0.677 1.00 0.00 C ATOM 2007 CG ASP B 25 70.411 20.148 -0.085 1.00 0.00 C ATOM 2008 OD1 ASP B 25 70.572 21.337 -0.297 1.00 0.00 O ATOM 2009 OD2 ASP B 25 69.484 19.690 0.564 1.00 0.00 O ATOM 0 H ASP B 25 70.742 19.676 -3.128 1.00 0.00 H new ATOM 0 HA ASP B 25 72.765 20.765 -1.210 1.00 0.00 H new ATOM 0 HB2 ASP B 25 70.909 18.339 -1.160 1.00 0.00 H new ATOM 0 HB3 ASP B 25 72.041 18.741 0.116 1.00 0.00 H new ATOM 2014 N LYS B 26 74.617 19.403 -2.257 1.00 0.00 N ATOM 2015 CA LYS B 26 75.722 18.534 -2.769 1.00 0.00 C ATOM 2016 C LYS B 26 76.457 17.868 -1.608 1.00 0.00 C ATOM 2017 O LYS B 26 77.396 17.124 -1.809 1.00 0.00 O ATOM 2018 CB LYS B 26 76.712 19.398 -3.552 1.00 0.00 C ATOM 2019 CG LYS B 26 76.008 20.025 -4.761 1.00 0.00 C ATOM 2020 CD LYS B 26 76.926 21.061 -5.432 1.00 0.00 C ATOM 2021 CE LYS B 26 77.977 20.358 -6.298 1.00 0.00 C ATOM 2022 NZ LYS B 26 77.298 19.480 -7.293 1.00 0.00 N ATOM 0 H LYS B 26 74.902 20.339 -1.968 1.00 0.00 H new ATOM 0 HA LYS B 26 75.298 17.762 -3.411 1.00 0.00 H new ATOM 0 HB2 LYS B 26 77.115 20.180 -2.908 1.00 0.00 H new ATOM 0 HB3 LYS B 26 77.555 18.792 -3.884 1.00 0.00 H new ATOM 0 HG2 LYS B 26 75.739 19.249 -5.477 1.00 0.00 H new ATOM 0 HG3 LYS B 26 75.080 20.502 -4.444 1.00 0.00 H new ATOM 0 HD2 LYS B 26 76.333 21.739 -6.046 1.00 0.00 H new ATOM 0 HD3 LYS B 26 77.418 21.668 -4.672 1.00 0.00 H new ATOM 0 HE2 LYS B 26 78.594 21.096 -6.810 1.00 0.00 H new ATOM 0 HE3 LYS B 26 78.643 19.766 -5.670 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 77.912 19.357 -8.124 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 77.107 18.552 -6.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 76.401 19.917 -7.587 1.00 0.00 H new ATOM 2036 N PHE B 27 76.051 18.133 -0.399 1.00 0.00 N ATOM 2037 CA PHE B 27 76.741 17.520 0.776 1.00 0.00 C ATOM 2038 C PHE B 27 75.974 16.285 1.254 1.00 0.00 C ATOM 2039 O PHE B 27 76.359 15.647 2.213 1.00 0.00 O ATOM 2040 CB PHE B 27 76.804 18.544 1.912 1.00 0.00 C ATOM 2041 CG PHE B 27 77.572 19.761 1.457 1.00 0.00 C ATOM 2042 CD1 PHE B 27 78.960 19.810 1.623 1.00 0.00 C ATOM 2043 CD2 PHE B 27 76.900 20.841 0.874 1.00 0.00 C ATOM 2044 CE1 PHE B 27 79.678 20.939 1.207 1.00 0.00 C ATOM 2045 CE2 PHE B 27 77.616 21.971 0.456 1.00 0.00 C ATOM 2046 CZ PHE B 27 79.005 22.018 0.623 1.00 0.00 C ATOM 0 H PHE B 27 75.270 18.748 -0.170 1.00 0.00 H new ATOM 0 HA PHE B 27 77.748 17.223 0.483 1.00 0.00 H new ATOM 0 HB2 PHE B 27 75.796 18.830 2.214 1.00 0.00 H new ATOM 0 HB3 PHE B 27 77.285 18.104 2.785 1.00 0.00 H new ATOM 0 HD1 PHE B 27 79.479 18.976 2.072 1.00 0.00 H new ATOM 0 HD2 PHE B 27 75.828 20.804 0.746 1.00 0.00 H new ATOM 0 HE1 PHE B 27 80.750 20.976 1.337 1.00 0.00 H new ATOM 0 HE2 PHE B 27 77.097 22.804 0.006 1.00 0.00 H new ATOM 0 HZ PHE B 27 79.558 22.888 0.301 1.00 0.00 H new ATOM 2056 N LYS B 28 74.884 15.943 0.616 1.00 0.00 N ATOM 2057 CA LYS B 28 74.116 14.750 1.088 1.00 0.00 C ATOM 2058 C LYS B 28 73.152 14.250 0.005 1.00 0.00 C ATOM 2059 O LYS B 28 72.890 14.931 -0.967 1.00 0.00 O ATOM 2060 CB LYS B 28 73.319 15.149 2.327 1.00 0.00 C ATOM 2061 CG LYS B 28 72.352 16.278 1.963 1.00 0.00 C ATOM 2062 CD LYS B 28 71.644 16.778 3.223 1.00 0.00 C ATOM 2063 CE LYS B 28 70.628 17.856 2.838 1.00 0.00 C ATOM 2064 NZ LYS B 28 69.638 17.285 1.878 1.00 0.00 N ATOM 0 H LYS B 28 74.498 16.426 -0.195 1.00 0.00 H new ATOM 0 HA LYS B 28 74.815 13.946 1.318 1.00 0.00 H new ATOM 0 HB2 LYS B 28 72.767 14.291 2.710 1.00 0.00 H new ATOM 0 HB3 LYS B 28 73.994 15.474 3.119 1.00 0.00 H new ATOM 0 HG2 LYS B 28 72.895 17.097 1.491 1.00 0.00 H new ATOM 0 HG3 LYS B 28 71.619 15.922 1.239 1.00 0.00 H new ATOM 0 HD2 LYS B 28 71.141 15.951 3.724 1.00 0.00 H new ATOM 0 HD3 LYS B 28 72.372 17.182 3.927 1.00 0.00 H new ATOM 0 HE2 LYS B 28 70.117 18.224 3.728 1.00 0.00 H new ATOM 0 HE3 LYS B 28 71.138 18.708 2.388 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 69.765 17.727 0.945 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 69.784 16.258 1.798 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 68.674 17.471 2.221 1.00 0.00 H new ATOM 2078 N LEU B 29 72.606 13.065 0.187 1.00 0.00 N ATOM 2079 CA LEU B 29 71.633 12.496 -0.804 1.00 0.00 C ATOM 2080 C LEU B 29 70.385 12.033 -0.038 1.00 0.00 C ATOM 2081 O LEU B 29 70.407 11.878 1.166 1.00 0.00 O ATOM 2082 CB LEU B 29 72.279 11.294 -1.543 1.00 0.00 C ATOM 2083 CG LEU B 29 72.377 11.553 -3.054 1.00 0.00 C ATOM 2084 CD1 LEU B 29 73.475 12.578 -3.341 1.00 0.00 C ATOM 2085 CD2 LEU B 29 72.714 10.235 -3.762 1.00 0.00 C ATOM 0 H LEU B 29 72.796 12.464 0.989 1.00 0.00 H new ATOM 0 HA LEU B 29 71.360 13.250 -1.543 1.00 0.00 H new ATOM 0 HB2 LEU B 29 73.274 11.108 -1.139 1.00 0.00 H new ATOM 0 HB3 LEU B 29 71.689 10.395 -1.364 1.00 0.00 H new ATOM 0 HG LEU B 29 71.426 11.942 -3.418 1.00 0.00 H new ATOM 0 HD11 LEU B 29 73.536 12.754 -4.415 1.00 0.00 H new ATOM 0 HD12 LEU B 29 73.242 13.513 -2.832 1.00 0.00 H new ATOM 0 HD13 LEU B 29 74.431 12.198 -2.981 1.00 0.00 H new ATOM 0 HD21 LEU B 29 72.786 10.407 -4.836 1.00 0.00 H new ATOM 0 HD22 LEU B 29 73.666 9.856 -3.391 1.00 0.00 H new ATOM 0 HD23 LEU B 29 71.930 9.504 -3.563 1.00 0.00 H new ATOM 2097 N ASN B 30 69.300 11.816 -0.735 1.00 0.00 N ATOM 2098 CA ASN B 30 68.044 11.358 -0.073 1.00 0.00 C ATOM 2099 C ASN B 30 67.865 9.851 -0.293 1.00 0.00 C ATOM 2100 O ASN B 30 68.077 9.334 -1.371 1.00 0.00 O ATOM 2101 CB ASN B 30 66.849 12.104 -0.673 1.00 0.00 C ATOM 2102 CG ASN B 30 66.965 13.598 -0.357 1.00 0.00 C ATOM 2103 OD1 ASN B 30 67.196 13.974 0.775 1.00 0.00 O ATOM 2104 ND2 ASN B 30 66.807 14.469 -1.315 1.00 0.00 N ATOM 0 H ASN B 30 69.231 11.938 -1.745 1.00 0.00 H new ATOM 0 HA ASN B 30 68.104 11.564 0.996 1.00 0.00 H new ATOM 0 HB2 ASN B 30 66.817 11.952 -1.752 1.00 0.00 H new ATOM 0 HB3 ASN B 30 65.919 11.707 -0.267 1.00 0.00 H new ATOM 0 HD21 ASN B 30 66.877 15.467 -1.114 1.00 0.00 H new ATOM 0 HD22 ASN B 30 66.613 14.153 -2.265 1.00 0.00 H new ATOM 2111 N LYS B 31 67.477 9.156 0.735 1.00 0.00 N ATOM 2112 CA LYS B 31 67.271 7.683 0.648 1.00 0.00 C ATOM 2113 C LYS B 31 66.539 7.319 -0.643 1.00 0.00 C ATOM 2114 O LYS B 31 66.729 6.265 -1.202 1.00 0.00 O ATOM 2115 CB LYS B 31 66.432 7.228 1.851 1.00 0.00 C ATOM 2116 CG LYS B 31 65.095 7.981 1.891 1.00 0.00 C ATOM 2117 CD LYS B 31 64.232 7.426 3.031 1.00 0.00 C ATOM 2118 CE LYS B 31 62.891 8.164 3.080 1.00 0.00 C ATOM 2119 NZ LYS B 31 63.122 9.633 3.172 1.00 0.00 N ATOM 0 H LYS B 31 67.289 9.555 1.655 1.00 0.00 H new ATOM 0 HA LYS B 31 68.241 7.186 0.651 1.00 0.00 H new ATOM 0 HB2 LYS B 31 66.250 6.155 1.790 1.00 0.00 H new ATOM 0 HB3 LYS B 31 66.984 7.405 2.774 1.00 0.00 H new ATOM 0 HG2 LYS B 31 65.270 9.047 2.038 1.00 0.00 H new ATOM 0 HG3 LYS B 31 64.575 7.871 0.940 1.00 0.00 H new ATOM 0 HD2 LYS B 31 64.064 6.359 2.885 1.00 0.00 H new ATOM 0 HD3 LYS B 31 64.754 7.539 3.981 1.00 0.00 H new ATOM 0 HE2 LYS B 31 62.307 7.934 2.189 1.00 0.00 H new ATOM 0 HE3 LYS B 31 62.310 7.824 3.938 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 62.210 10.122 3.273 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 63.719 9.839 3.998 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 63.599 9.964 2.309 1.00 0.00 H new ATOM 2133 N SER B 32 65.711 8.179 -1.125 1.00 0.00 N ATOM 2134 CA SER B 32 64.985 7.874 -2.380 1.00 0.00 C ATOM 2135 C SER B 32 66.006 7.668 -3.478 1.00 0.00 C ATOM 2136 O SER B 32 65.873 6.802 -4.320 1.00 0.00 O ATOM 2137 CB SER B 32 64.065 9.020 -2.769 1.00 0.00 C ATOM 2138 OG SER B 32 63.088 9.212 -1.756 1.00 0.00 O ATOM 0 H SER B 32 65.500 9.085 -0.707 1.00 0.00 H new ATOM 0 HA SER B 32 64.378 6.980 -2.234 1.00 0.00 H new ATOM 0 HB2 SER B 32 64.644 9.933 -2.908 1.00 0.00 H new ATOM 0 HB3 SER B 32 63.579 8.803 -3.720 1.00 0.00 H new ATOM 0 HG SER B 32 62.497 9.952 -2.008 1.00 0.00 H new ATOM 2144 N GLU B 33 67.030 8.468 -3.472 1.00 0.00 N ATOM 2145 CA GLU B 33 68.068 8.326 -4.516 1.00 0.00 C ATOM 2146 C GLU B 33 68.627 6.934 -4.414 1.00 0.00 C ATOM 2147 O GLU B 33 69.074 6.379 -5.387 1.00 0.00 O ATOM 2148 CB GLU B 33 69.170 9.368 -4.312 1.00 0.00 C ATOM 2149 CG GLU B 33 68.622 10.765 -4.622 1.00 0.00 C ATOM 2150 CD GLU B 33 68.257 10.864 -6.105 1.00 0.00 C ATOM 2151 OE1 GLU B 33 69.098 10.535 -6.925 1.00 0.00 O ATOM 2152 OE2 GLU B 33 67.142 11.264 -6.394 1.00 0.00 O ATOM 0 H GLU B 33 67.191 9.210 -2.791 1.00 0.00 H new ATOM 0 HA GLU B 33 67.642 8.489 -5.506 1.00 0.00 H new ATOM 0 HB2 GLU B 33 69.535 9.329 -3.286 1.00 0.00 H new ATOM 0 HB3 GLU B 33 70.018 9.147 -4.961 1.00 0.00 H new ATOM 0 HG2 GLU B 33 67.744 10.965 -4.008 1.00 0.00 H new ATOM 0 HG3 GLU B 33 69.366 11.521 -4.370 1.00 0.00 H new ATOM 2159 N LEU B 34 68.571 6.326 -3.267 1.00 0.00 N ATOM 2160 CA LEU B 34 69.079 4.931 -3.217 1.00 0.00 C ATOM 2161 C LEU B 34 68.221 4.118 -4.173 1.00 0.00 C ATOM 2162 O LEU B 34 68.709 3.289 -4.910 1.00 0.00 O ATOM 2163 CB LEU B 34 68.984 4.356 -1.792 1.00 0.00 C ATOM 2164 CG LEU B 34 69.442 2.872 -1.726 1.00 0.00 C ATOM 2165 CD1 LEU B 34 68.352 1.909 -2.280 1.00 0.00 C ATOM 2166 CD2 LEU B 34 70.752 2.686 -2.505 1.00 0.00 C ATOM 0 H LEU B 34 68.211 6.713 -2.394 1.00 0.00 H new ATOM 0 HA LEU B 34 70.130 4.898 -3.503 1.00 0.00 H new ATOM 0 HB2 LEU B 34 69.598 4.954 -1.119 1.00 0.00 H new ATOM 0 HB3 LEU B 34 67.956 4.433 -1.439 1.00 0.00 H new ATOM 0 HG LEU B 34 69.606 2.623 -0.678 1.00 0.00 H new ATOM 0 HD11 LEU B 34 68.709 0.881 -2.217 1.00 0.00 H new ATOM 0 HD12 LEU B 34 67.441 2.013 -1.691 1.00 0.00 H new ATOM 0 HD13 LEU B 34 68.142 2.157 -3.320 1.00 0.00 H new ATOM 0 HD21 LEU B 34 71.062 1.642 -2.451 1.00 0.00 H new ATOM 0 HD22 LEU B 34 70.598 2.966 -3.547 1.00 0.00 H new ATOM 0 HD23 LEU B 34 71.527 3.318 -2.070 1.00 0.00 H new ATOM 2178 N LYS B 35 66.940 4.374 -4.189 1.00 0.00 N ATOM 2179 CA LYS B 35 66.062 3.629 -5.122 1.00 0.00 C ATOM 2180 C LYS B 35 66.333 4.084 -6.558 1.00 0.00 C ATOM 2181 O LYS B 35 66.568 3.278 -7.437 1.00 0.00 O ATOM 2182 CB LYS B 35 64.601 3.892 -4.751 1.00 0.00 C ATOM 2183 CG LYS B 35 63.673 3.092 -5.664 1.00 0.00 C ATOM 2184 CD LYS B 35 62.224 3.373 -5.272 1.00 0.00 C ATOM 2185 CE LYS B 35 61.288 2.578 -6.179 1.00 0.00 C ATOM 2186 NZ LYS B 35 61.509 1.120 -5.966 1.00 0.00 N ATOM 0 H LYS B 35 66.471 5.062 -3.600 1.00 0.00 H new ATOM 0 HA LYS B 35 66.266 2.561 -5.049 1.00 0.00 H new ATOM 0 HB2 LYS B 35 64.427 3.616 -3.711 1.00 0.00 H new ATOM 0 HB3 LYS B 35 64.382 4.956 -4.839 1.00 0.00 H new ATOM 0 HG2 LYS B 35 63.841 3.367 -6.705 1.00 0.00 H new ATOM 0 HG3 LYS B 35 63.886 2.027 -5.577 1.00 0.00 H new ATOM 0 HD2 LYS B 35 62.058 3.099 -4.230 1.00 0.00 H new ATOM 0 HD3 LYS B 35 62.013 4.439 -5.358 1.00 0.00 H new ATOM 0 HE2 LYS B 35 60.251 2.835 -5.963 1.00 0.00 H new ATOM 0 HE3 LYS B 35 61.470 2.836 -7.222 1.00 0.00 H new ATOM 0 HZ1 LYS B 35 60.615 0.609 -6.109 1.00 0.00 H new ATOM 0 HZ2 LYS B 35 62.218 0.774 -6.643 1.00 0.00 H new ATOM 0 HZ3 LYS B 35 61.849 0.958 -4.996 1.00 0.00 H new ATOM 2200 N GLU B 36 66.299 5.368 -6.811 1.00 0.00 N ATOM 2201 CA GLU B 36 66.553 5.848 -8.202 1.00 0.00 C ATOM 2202 C GLU B 36 68.007 5.596 -8.593 1.00 0.00 C ATOM 2203 O GLU B 36 68.293 5.202 -9.705 1.00 0.00 O ATOM 2204 CB GLU B 36 66.252 7.348 -8.308 1.00 0.00 C ATOM 2205 CG GLU B 36 66.563 7.827 -9.730 1.00 0.00 C ATOM 2206 CD GLU B 36 66.050 9.255 -9.922 1.00 0.00 C ATOM 2207 OE1 GLU B 36 65.474 9.787 -8.987 1.00 0.00 O ATOM 2208 OE2 GLU B 36 66.245 9.792 -10.999 1.00 0.00 O ATOM 0 H GLU B 36 66.109 6.097 -6.123 1.00 0.00 H new ATOM 0 HA GLU B 36 65.899 5.299 -8.879 1.00 0.00 H new ATOM 0 HB2 GLU B 36 65.206 7.539 -8.068 1.00 0.00 H new ATOM 0 HB3 GLU B 36 66.851 7.903 -7.586 1.00 0.00 H new ATOM 0 HG2 GLU B 36 67.638 7.790 -9.909 1.00 0.00 H new ATOM 0 HG3 GLU B 36 66.096 7.163 -10.457 1.00 0.00 H new ATOM 2215 N LEU B 37 68.932 5.803 -7.698 1.00 0.00 N ATOM 2216 CA LEU B 37 70.350 5.553 -8.055 1.00 0.00 C ATOM 2217 C LEU B 37 70.507 4.102 -8.427 1.00 0.00 C ATOM 2218 O LEU B 37 71.239 3.754 -9.331 1.00 0.00 O ATOM 2219 CB LEU B 37 71.268 5.871 -6.857 1.00 0.00 C ATOM 2220 CG LEU B 37 72.760 5.600 -7.218 1.00 0.00 C ATOM 2221 CD1 LEU B 37 73.670 6.623 -6.524 1.00 0.00 C ATOM 2222 CD2 LEU B 37 73.184 4.182 -6.773 1.00 0.00 C ATOM 0 H LEU B 37 68.768 6.131 -6.746 1.00 0.00 H new ATOM 0 HA LEU B 37 70.629 6.193 -8.892 1.00 0.00 H new ATOM 0 HB2 LEU B 37 71.143 6.913 -6.564 1.00 0.00 H new ATOM 0 HB3 LEU B 37 70.980 5.262 -6.000 1.00 0.00 H new ATOM 0 HG LEU B 37 72.860 5.686 -8.300 1.00 0.00 H new ATOM 0 HD11 LEU B 37 74.709 6.422 -6.785 1.00 0.00 H new ATOM 0 HD12 LEU B 37 73.402 7.628 -6.850 1.00 0.00 H new ATOM 0 HD13 LEU B 37 73.546 6.547 -5.444 1.00 0.00 H new ATOM 0 HD21 LEU B 37 74.229 4.016 -7.035 1.00 0.00 H new ATOM 0 HD22 LEU B 37 73.061 4.087 -5.694 1.00 0.00 H new ATOM 0 HD23 LEU B 37 72.561 3.442 -7.275 1.00 0.00 H new ATOM 2234 N LEU B 38 69.856 3.238 -7.712 1.00 0.00 N ATOM 2235 CA LEU B 38 70.026 1.789 -8.026 1.00 0.00 C ATOM 2236 C LEU B 38 69.366 1.420 -9.348 1.00 0.00 C ATOM 2237 O LEU B 38 69.914 0.678 -10.138 1.00 0.00 O ATOM 2238 CB LEU B 38 69.431 0.922 -6.893 1.00 0.00 C ATOM 2239 CG LEU B 38 70.520 0.526 -5.879 1.00 0.00 C ATOM 2240 CD1 LEU B 38 69.888 -0.298 -4.728 1.00 0.00 C ATOM 2241 CD2 LEU B 38 71.630 -0.294 -6.597 1.00 0.00 C ATOM 0 H LEU B 38 69.226 3.458 -6.940 1.00 0.00 H new ATOM 0 HA LEU B 38 71.095 1.597 -8.112 1.00 0.00 H new ATOM 0 HB2 LEU B 38 68.638 1.472 -6.386 1.00 0.00 H new ATOM 0 HB3 LEU B 38 68.977 0.025 -7.315 1.00 0.00 H new ATOM 0 HG LEU B 38 70.970 1.424 -5.456 1.00 0.00 H new ATOM 0 HD11 LEU B 38 70.662 -0.576 -4.012 1.00 0.00 H new ATOM 0 HD12 LEU B 38 69.128 0.301 -4.226 1.00 0.00 H new ATOM 0 HD13 LEU B 38 69.429 -1.199 -5.135 1.00 0.00 H new ATOM 0 HD21 LEU B 38 72.399 -0.573 -5.877 1.00 0.00 H new ATOM 0 HD22 LEU B 38 71.195 -1.195 -7.030 1.00 0.00 H new ATOM 0 HD23 LEU B 38 72.075 0.310 -7.388 1.00 0.00 H new ATOM 2253 N THR B 39 68.185 1.883 -9.580 1.00 0.00 N ATOM 2254 CA THR B 39 67.495 1.498 -10.828 1.00 0.00 C ATOM 2255 C THR B 39 68.156 2.139 -12.044 1.00 0.00 C ATOM 2256 O THR B 39 68.015 1.650 -13.147 1.00 0.00 O ATOM 2257 CB THR B 39 66.029 1.921 -10.755 1.00 0.00 C ATOM 2258 OG1 THR B 39 65.536 1.675 -9.445 1.00 0.00 O ATOM 2259 CG2 THR B 39 65.228 1.097 -11.761 1.00 0.00 C ATOM 0 H THR B 39 67.666 2.509 -8.964 1.00 0.00 H new ATOM 0 HA THR B 39 67.562 0.415 -10.936 1.00 0.00 H new ATOM 0 HB THR B 39 65.934 2.982 -10.986 1.00 0.00 H new ATOM 0 HG1 THR B 39 65.838 2.387 -8.843 1.00 0.00 H new ATOM 0 HG21 THR B 39 64.179 1.390 -11.718 1.00 0.00 H new ATOM 0 HG22 THR B 39 65.614 1.274 -12.765 1.00 0.00 H new ATOM 0 HG23 THR B 39 65.319 0.038 -11.519 1.00 0.00 H new ATOM 2267 N ARG B 40 68.865 3.232 -11.876 1.00 0.00 N ATOM 2268 CA ARG B 40 69.505 3.883 -13.065 1.00 0.00 C ATOM 2269 C ARG B 40 70.944 3.398 -13.192 1.00 0.00 C ATOM 2270 O ARG B 40 71.562 3.541 -14.229 1.00 0.00 O ATOM 2271 CB ARG B 40 69.412 5.423 -12.936 1.00 0.00 C ATOM 2272 CG ARG B 40 70.662 6.056 -12.304 1.00 0.00 C ATOM 2273 CD ARG B 40 70.446 7.571 -12.225 1.00 0.00 C ATOM 2274 NE ARG B 40 71.729 8.250 -11.888 1.00 0.00 N ATOM 2275 CZ ARG B 40 71.842 9.542 -12.039 1.00 0.00 C ATOM 2276 NH1 ARG B 40 70.830 10.237 -12.480 1.00 0.00 N ATOM 2277 NH2 ARG B 40 72.964 10.140 -11.745 1.00 0.00 N ATOM 0 H ARG B 40 69.026 3.695 -10.982 1.00 0.00 H new ATOM 0 HA ARG B 40 68.979 3.604 -13.978 1.00 0.00 H new ATOM 0 HB2 ARG B 40 69.255 5.855 -13.924 1.00 0.00 H new ATOM 0 HB3 ARG B 40 68.540 5.678 -12.334 1.00 0.00 H new ATOM 0 HG2 ARG B 40 70.834 5.645 -11.309 1.00 0.00 H new ATOM 0 HG3 ARG B 40 71.546 5.829 -12.901 1.00 0.00 H new ATOM 0 HD2 ARG B 40 70.067 7.943 -13.177 1.00 0.00 H new ATOM 0 HD3 ARG B 40 69.694 7.801 -11.470 1.00 0.00 H new ATOM 0 HE ARG B 40 72.518 7.706 -11.540 1.00 0.00 H new ATOM 0 HH11 ARG B 40 69.951 9.771 -12.707 1.00 0.00 H new ATOM 0 HH12 ARG B 40 70.917 11.246 -12.598 1.00 0.00 H new ATOM 0 HH21 ARG B 40 73.755 9.598 -11.397 1.00 0.00 H new ATOM 0 HH22 ARG B 40 73.050 11.149 -11.864 1.00 0.00 H new ATOM 2291 N GLU B 41 71.478 2.814 -12.149 1.00 0.00 N ATOM 2292 CA GLU B 41 72.885 2.303 -12.215 1.00 0.00 C ATOM 2293 C GLU B 41 72.861 0.795 -12.287 1.00 0.00 C ATOM 2294 O GLU B 41 73.713 0.192 -12.903 1.00 0.00 O ATOM 2295 CB GLU B 41 73.657 2.738 -10.970 1.00 0.00 C ATOM 2296 CG GLU B 41 73.890 4.245 -11.027 1.00 0.00 C ATOM 2297 CD GLU B 41 74.897 4.570 -12.132 1.00 0.00 C ATOM 2298 OE1 GLU B 41 75.625 3.676 -12.526 1.00 0.00 O ATOM 2299 OE2 GLU B 41 74.919 5.711 -12.567 1.00 0.00 O ATOM 0 H GLU B 41 71.005 2.668 -11.257 1.00 0.00 H new ATOM 0 HA GLU B 41 73.375 2.710 -13.099 1.00 0.00 H new ATOM 0 HB2 GLU B 41 73.098 2.478 -10.071 1.00 0.00 H new ATOM 0 HB3 GLU B 41 74.610 2.212 -10.916 1.00 0.00 H new ATOM 0 HG2 GLU B 41 72.949 4.761 -11.216 1.00 0.00 H new ATOM 0 HG3 GLU B 41 74.262 4.602 -10.066 1.00 0.00 H new ATOM 2306 N LEU B 42 71.879 0.178 -11.692 1.00 0.00 N ATOM 2307 CA LEU B 42 71.787 -1.310 -11.756 1.00 0.00 C ATOM 2308 C LEU B 42 70.304 -1.699 -11.936 1.00 0.00 C ATOM 2309 O LEU B 42 69.608 -1.917 -10.966 1.00 0.00 O ATOM 2310 CB LEU B 42 72.309 -1.948 -10.455 1.00 0.00 C ATOM 2311 CG LEU B 42 73.748 -1.501 -10.149 1.00 0.00 C ATOM 2312 CD1 LEU B 42 74.113 -1.909 -8.719 1.00 0.00 C ATOM 2313 CD2 LEU B 42 74.730 -2.179 -11.115 1.00 0.00 C ATOM 0 H LEU B 42 71.137 0.637 -11.165 1.00 0.00 H new ATOM 0 HA LEU B 42 72.392 -1.668 -12.589 1.00 0.00 H new ATOM 0 HB2 LEU B 42 71.657 -1.673 -9.626 1.00 0.00 H new ATOM 0 HB3 LEU B 42 72.274 -3.034 -10.541 1.00 0.00 H new ATOM 0 HG LEU B 42 73.811 -0.419 -10.264 1.00 0.00 H new ATOM 0 HD11 LEU B 42 75.133 -1.593 -8.500 1.00 0.00 H new ATOM 0 HD12 LEU B 42 73.427 -1.433 -8.018 1.00 0.00 H new ATOM 0 HD13 LEU B 42 74.039 -2.992 -8.620 1.00 0.00 H new ATOM 0 HD21 LEU B 42 75.746 -1.855 -10.888 1.00 0.00 H new ATOM 0 HD22 LEU B 42 74.661 -3.261 -11.004 1.00 0.00 H new ATOM 0 HD23 LEU B 42 74.481 -1.903 -12.140 1.00 0.00 H new ATOM 2325 N PRO B 43 69.800 -1.763 -13.151 1.00 0.00 N ATOM 2326 CA PRO B 43 68.366 -2.114 -13.369 1.00 0.00 C ATOM 2327 C PRO B 43 68.096 -3.626 -13.239 1.00 0.00 C ATOM 2328 O PRO B 43 67.875 -4.132 -12.155 1.00 0.00 O ATOM 2329 CB PRO B 43 68.138 -1.606 -14.805 1.00 0.00 C ATOM 2330 CG PRO B 43 69.518 -1.471 -15.480 1.00 0.00 C ATOM 2331 CD PRO B 43 70.597 -1.493 -14.379 1.00 0.00 C ATOM 0 HA PRO B 43 67.695 -1.676 -12.630 1.00 0.00 H new ATOM 0 HB2 PRO B 43 67.507 -2.300 -15.360 1.00 0.00 H new ATOM 0 HB3 PRO B 43 67.622 -0.646 -14.793 1.00 0.00 H new ATOM 0 HG2 PRO B 43 69.678 -2.287 -16.185 1.00 0.00 H new ATOM 0 HG3 PRO B 43 69.574 -0.543 -16.049 1.00 0.00 H new ATOM 0 HD2 PRO B 43 71.343 -2.268 -14.557 1.00 0.00 H new ATOM 0 HD3 PRO B 43 71.131 -0.545 -14.316 1.00 0.00 H new ATOM 2339 N SER B 44 68.105 -4.347 -14.329 1.00 0.00 N ATOM 2340 CA SER B 44 67.842 -5.815 -14.260 1.00 0.00 C ATOM 2341 C SER B 44 68.997 -6.508 -13.541 1.00 0.00 C ATOM 2342 O SER B 44 68.799 -7.407 -12.756 1.00 0.00 O ATOM 2343 CB SER B 44 67.712 -6.380 -15.674 1.00 0.00 C ATOM 2344 OG SER B 44 68.953 -6.240 -16.351 1.00 0.00 O ATOM 0 H SER B 44 68.283 -3.983 -15.265 1.00 0.00 H new ATOM 0 HA SER B 44 66.916 -5.990 -13.713 1.00 0.00 H new ATOM 0 HB2 SER B 44 67.423 -7.430 -15.633 1.00 0.00 H new ATOM 0 HB3 SER B 44 66.927 -5.854 -16.217 1.00 0.00 H new ATOM 0 HG SER B 44 68.874 -6.603 -17.258 1.00 0.00 H new ATOM 2350 N PHE B 45 70.199 -6.087 -13.807 1.00 0.00 N ATOM 2351 CA PHE B 45 71.394 -6.704 -13.154 1.00 0.00 C ATOM 2352 C PHE B 45 71.247 -6.666 -11.631 1.00 0.00 C ATOM 2353 O PHE B 45 72.058 -7.200 -10.901 1.00 0.00 O ATOM 2354 CB PHE B 45 72.616 -5.882 -13.526 1.00 0.00 C ATOM 2355 CG PHE B 45 72.915 -6.041 -14.999 1.00 0.00 C ATOM 2356 CD1 PHE B 45 73.758 -7.072 -15.436 1.00 0.00 C ATOM 2357 CD2 PHE B 45 72.347 -5.162 -15.930 1.00 0.00 C ATOM 2358 CE1 PHE B 45 74.033 -7.222 -16.801 1.00 0.00 C ATOM 2359 CE2 PHE B 45 72.624 -5.312 -17.296 1.00 0.00 C ATOM 2360 CZ PHE B 45 73.466 -6.342 -17.730 1.00 0.00 C ATOM 0 H PHE B 45 70.412 -5.331 -14.458 1.00 0.00 H new ATOM 0 HA PHE B 45 71.490 -7.738 -13.485 1.00 0.00 H new ATOM 0 HB2 PHE B 45 72.443 -4.831 -13.293 1.00 0.00 H new ATOM 0 HB3 PHE B 45 73.474 -6.203 -12.935 1.00 0.00 H new ATOM 0 HD1 PHE B 45 74.196 -7.751 -14.720 1.00 0.00 H new ATOM 0 HD2 PHE B 45 71.695 -4.368 -15.595 1.00 0.00 H new ATOM 0 HE1 PHE B 45 74.683 -8.017 -17.137 1.00 0.00 H new ATOM 0 HE2 PHE B 45 72.188 -4.633 -18.013 1.00 0.00 H new ATOM 0 HZ PHE B 45 73.678 -6.458 -18.783 1.00 0.00 H new ATOM 2370 N LEU B 46 70.226 -6.020 -11.156 1.00 0.00 N ATOM 2371 CA LEU B 46 69.999 -5.899 -9.675 1.00 0.00 C ATOM 2372 C LEU B 46 68.857 -6.822 -9.287 1.00 0.00 C ATOM 2373 O LEU B 46 69.006 -7.739 -8.503 1.00 0.00 O ATOM 2374 CB LEU B 46 69.610 -4.452 -9.360 1.00 0.00 C ATOM 2375 CG LEU B 46 69.560 -4.199 -7.844 1.00 0.00 C ATOM 2376 CD1 LEU B 46 70.980 -4.191 -7.247 1.00 0.00 C ATOM 2377 CD2 LEU B 46 68.893 -2.837 -7.598 1.00 0.00 C ATOM 0 H LEU B 46 69.522 -5.559 -11.732 1.00 0.00 H new ATOM 0 HA LEU B 46 70.899 -6.169 -9.123 1.00 0.00 H new ATOM 0 HB2 LEU B 46 70.328 -3.773 -9.820 1.00 0.00 H new ATOM 0 HB3 LEU B 46 68.637 -4.232 -9.799 1.00 0.00 H new ATOM 0 HG LEU B 46 68.991 -4.995 -7.364 1.00 0.00 H new ATOM 0 HD11 LEU B 46 70.922 -4.010 -6.174 1.00 0.00 H new ATOM 0 HD12 LEU B 46 71.456 -5.155 -7.428 1.00 0.00 H new ATOM 0 HD13 LEU B 46 71.568 -3.402 -7.717 1.00 0.00 H new ATOM 0 HD21 LEU B 46 68.849 -2.641 -6.527 1.00 0.00 H new ATOM 0 HD22 LEU B 46 69.473 -2.054 -8.086 1.00 0.00 H new ATOM 0 HD23 LEU B 46 67.882 -2.848 -8.006 1.00 0.00 H new ATOM 2389 N GLY B 47 67.725 -6.604 -9.884 1.00 0.00 N ATOM 2390 CA GLY B 47 66.551 -7.476 -9.629 1.00 0.00 C ATOM 2391 C GLY B 47 66.690 -8.624 -10.605 1.00 0.00 C ATOM 2392 O GLY B 47 65.739 -9.278 -10.983 1.00 0.00 O ATOM 0 H GLY B 47 67.560 -5.847 -10.548 1.00 0.00 H new ATOM 0 HA2 GLY B 47 66.542 -7.833 -8.599 1.00 0.00 H new ATOM 0 HA3 GLY B 47 65.618 -6.936 -9.787 1.00 0.00 H new ATOM 2396 N LYS B 48 67.901 -8.828 -11.041 1.00 0.00 N ATOM 2397 CA LYS B 48 68.190 -9.881 -12.033 1.00 0.00 C ATOM 2398 C LYS B 48 67.526 -11.196 -11.612 1.00 0.00 C ATOM 2399 O LYS B 48 66.868 -11.851 -12.394 1.00 0.00 O ATOM 2400 CB LYS B 48 69.701 -10.091 -12.088 1.00 0.00 C ATOM 2401 CG LYS B 48 70.059 -10.986 -13.267 1.00 0.00 C ATOM 2402 CD LYS B 48 71.576 -11.025 -13.397 1.00 0.00 C ATOM 2403 CE LYS B 48 71.975 -11.934 -14.563 1.00 0.00 C ATOM 2404 NZ LYS B 48 71.327 -11.452 -15.817 1.00 0.00 N ATOM 0 H LYS B 48 68.716 -8.293 -10.740 1.00 0.00 H new ATOM 0 HA LYS B 48 67.805 -9.579 -13.007 1.00 0.00 H new ATOM 0 HB2 LYS B 48 70.207 -9.130 -12.183 1.00 0.00 H new ATOM 0 HB3 LYS B 48 70.048 -10.543 -11.159 1.00 0.00 H new ATOM 0 HG2 LYS B 48 69.665 -11.991 -13.114 1.00 0.00 H new ATOM 0 HG3 LYS B 48 69.609 -10.604 -14.184 1.00 0.00 H new ATOM 0 HD2 LYS B 48 71.962 -10.019 -13.560 1.00 0.00 H new ATOM 0 HD3 LYS B 48 72.020 -11.390 -12.471 1.00 0.00 H new ATOM 0 HE2 LYS B 48 73.059 -11.938 -14.680 1.00 0.00 H new ATOM 0 HE3 LYS B 48 71.673 -12.961 -14.357 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 71.849 -11.817 -16.640 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 70.344 -11.791 -15.852 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 71.336 -10.412 -15.835 1.00 0.00 H new ATOM 2418 N ARG B 49 67.705 -11.587 -10.379 1.00 0.00 N ATOM 2419 CA ARG B 49 67.101 -12.863 -9.895 1.00 0.00 C ATOM 2420 C ARG B 49 65.615 -12.660 -9.605 1.00 0.00 C ATOM 2421 O ARG B 49 65.165 -11.559 -9.357 1.00 0.00 O ATOM 2422 CB ARG B 49 67.803 -13.307 -8.608 1.00 0.00 C ATOM 2423 CG ARG B 49 69.250 -13.705 -8.915 1.00 0.00 C ATOM 2424 CD ARG B 49 69.940 -14.147 -7.620 1.00 0.00 C ATOM 2425 NE ARG B 49 71.401 -14.325 -7.861 1.00 0.00 N ATOM 2426 CZ ARG B 49 72.225 -14.385 -6.849 1.00 0.00 C ATOM 2427 NH1 ARG B 49 71.770 -14.264 -5.632 1.00 0.00 N ATOM 2428 NH2 ARG B 49 73.504 -14.557 -7.052 1.00 0.00 N ATOM 0 H ARG B 49 68.246 -11.075 -9.682 1.00 0.00 H new ATOM 0 HA ARG B 49 67.221 -13.625 -10.665 1.00 0.00 H new ATOM 0 HB2 ARG B 49 67.786 -12.499 -7.877 1.00 0.00 H new ATOM 0 HB3 ARG B 49 67.271 -14.149 -8.165 1.00 0.00 H new ATOM 0 HG2 ARG B 49 69.270 -14.514 -9.645 1.00 0.00 H new ATOM 0 HG3 ARG B 49 69.785 -12.864 -9.357 1.00 0.00 H new ATOM 0 HD2 ARG B 49 69.779 -13.404 -6.839 1.00 0.00 H new ATOM 0 HD3 ARG B 49 69.504 -15.081 -7.265 1.00 0.00 H new ATOM 0 HE ARG B 49 71.756 -14.400 -8.814 1.00 0.00 H new ATOM 0 HH11 ARG B 49 70.773 -14.123 -5.472 1.00 0.00 H new ATOM 0 HH12 ARG B 49 72.412 -14.311 -4.841 1.00 0.00 H new ATOM 0 HH21 ARG B 49 73.862 -14.645 -8.003 1.00 0.00 H new ATOM 0 HH22 ARG B 49 74.144 -14.603 -6.259 1.00 0.00 H new ATOM 2442 N THR B 50 64.854 -13.720 -9.624 1.00 0.00 N ATOM 2443 CA THR B 50 63.400 -13.597 -9.337 1.00 0.00 C ATOM 2444 C THR B 50 63.227 -13.235 -7.864 1.00 0.00 C ATOM 2445 O THR B 50 62.178 -12.792 -7.438 1.00 0.00 O ATOM 2446 CB THR B 50 62.704 -14.930 -9.625 1.00 0.00 C ATOM 2447 OG1 THR B 50 62.782 -15.213 -11.014 1.00 0.00 O ATOM 2448 CG2 THR B 50 61.234 -14.851 -9.200 1.00 0.00 C ATOM 0 H THR B 50 65.178 -14.666 -9.826 1.00 0.00 H new ATOM 0 HA THR B 50 62.958 -12.825 -9.967 1.00 0.00 H new ATOM 0 HB THR B 50 63.197 -15.723 -9.063 1.00 0.00 H new ATOM 0 HG1 THR B 50 62.338 -16.067 -11.199 1.00 0.00 H new ATOM 0 HG21 THR B 50 60.744 -15.802 -9.407 1.00 0.00 H new ATOM 0 HG22 THR B 50 61.175 -14.637 -8.133 1.00 0.00 H new ATOM 0 HG23 THR B 50 60.736 -14.057 -9.757 1.00 0.00 H new ATOM 2456 N ASP B 51 64.258 -13.413 -7.083 1.00 0.00 N ATOM 2457 CA ASP B 51 64.166 -13.070 -5.639 1.00 0.00 C ATOM 2458 C ASP B 51 64.202 -11.550 -5.485 1.00 0.00 C ATOM 2459 O ASP B 51 64.893 -11.013 -4.643 1.00 0.00 O ATOM 2460 CB ASP B 51 65.341 -13.700 -4.886 1.00 0.00 C ATOM 2461 CG ASP B 51 65.143 -15.214 -4.805 1.00 0.00 C ATOM 2462 OD1 ASP B 51 64.021 -15.657 -4.991 1.00 0.00 O ATOM 2463 OD2 ASP B 51 66.117 -15.907 -4.560 1.00 0.00 O ATOM 0 H ASP B 51 65.160 -13.782 -7.385 1.00 0.00 H new ATOM 0 HA ASP B 51 63.234 -13.455 -5.225 1.00 0.00 H new ATOM 0 HB2 ASP B 51 66.277 -13.472 -5.395 1.00 0.00 H new ATOM 0 HB3 ASP B 51 65.412 -13.278 -3.884 1.00 0.00 H new ATOM 2468 N GLU B 52 63.459 -10.857 -6.303 1.00 0.00 N ATOM 2469 CA GLU B 52 63.432 -9.368 -6.226 1.00 0.00 C ATOM 2470 C GLU B 52 62.978 -8.932 -4.831 1.00 0.00 C ATOM 2471 O GLU B 52 63.281 -7.846 -4.378 1.00 0.00 O ATOM 2472 CB GLU B 52 62.450 -8.830 -7.274 1.00 0.00 C ATOM 2473 CG GLU B 52 61.026 -9.325 -6.974 1.00 0.00 C ATOM 2474 CD GLU B 52 60.065 -8.782 -8.033 1.00 0.00 C ATOM 2475 OE1 GLU B 52 60.465 -7.897 -8.769 1.00 0.00 O ATOM 2476 OE2 GLU B 52 58.945 -9.263 -8.090 1.00 0.00 O ATOM 0 H GLU B 52 62.865 -11.261 -7.027 1.00 0.00 H new ATOM 0 HA GLU B 52 64.430 -8.974 -6.418 1.00 0.00 H new ATOM 0 HB2 GLU B 52 62.471 -7.740 -7.276 1.00 0.00 H new ATOM 0 HB3 GLU B 52 62.754 -9.156 -8.269 1.00 0.00 H new ATOM 0 HG2 GLU B 52 61.001 -10.415 -6.970 1.00 0.00 H new ATOM 0 HG3 GLU B 52 60.716 -8.995 -5.982 1.00 0.00 H new ATOM 2483 N ALA B 53 62.247 -9.770 -4.155 1.00 0.00 N ATOM 2484 CA ALA B 53 61.758 -9.411 -2.791 1.00 0.00 C ATOM 2485 C ALA B 53 62.905 -8.820 -1.968 1.00 0.00 C ATOM 2486 O ALA B 53 62.714 -7.910 -1.193 1.00 0.00 O ATOM 2487 CB ALA B 53 61.227 -10.666 -2.097 1.00 0.00 C ATOM 0 H ALA B 53 61.964 -10.692 -4.487 1.00 0.00 H new ATOM 0 HA ALA B 53 60.960 -8.673 -2.876 1.00 0.00 H new ATOM 0 HB1 ALA B 53 60.869 -10.407 -1.101 1.00 0.00 H new ATOM 0 HB2 ALA B 53 60.406 -11.084 -2.680 1.00 0.00 H new ATOM 0 HB3 ALA B 53 62.026 -11.402 -2.015 1.00 0.00 H new ATOM 2493 N ALA B 54 64.092 -9.323 -2.132 1.00 0.00 N ATOM 2494 CA ALA B 54 65.242 -8.779 -1.355 1.00 0.00 C ATOM 2495 C ALA B 54 65.422 -7.300 -1.678 1.00 0.00 C ATOM 2496 O ALA B 54 65.687 -6.492 -0.814 1.00 0.00 O ATOM 2497 CB ALA B 54 66.505 -9.538 -1.731 1.00 0.00 C ATOM 0 H ALA B 54 64.319 -10.087 -2.769 1.00 0.00 H new ATOM 0 HA ALA B 54 65.049 -8.894 -0.288 1.00 0.00 H new ATOM 0 HB1 ALA B 54 67.349 -9.143 -1.165 1.00 0.00 H new ATOM 0 HB2 ALA B 54 66.376 -10.596 -1.500 1.00 0.00 H new ATOM 0 HB3 ALA B 54 66.697 -9.420 -2.798 1.00 0.00 H new ATOM 2503 N PHE B 55 65.263 -6.928 -2.910 1.00 0.00 N ATOM 2504 CA PHE B 55 65.409 -5.493 -3.258 1.00 0.00 C ATOM 2505 C PHE B 55 64.386 -4.718 -2.451 1.00 0.00 C ATOM 2506 O PHE B 55 64.650 -3.649 -1.939 1.00 0.00 O ATOM 2507 CB PHE B 55 65.107 -5.304 -4.738 1.00 0.00 C ATOM 2508 CG PHE B 55 65.091 -3.830 -5.076 1.00 0.00 C ATOM 2509 CD1 PHE B 55 66.268 -3.180 -5.460 1.00 0.00 C ATOM 2510 CD2 PHE B 55 63.889 -3.114 -4.998 1.00 0.00 C ATOM 2511 CE1 PHE B 55 66.244 -1.814 -5.767 1.00 0.00 C ATOM 2512 CE2 PHE B 55 63.865 -1.749 -5.305 1.00 0.00 C ATOM 2513 CZ PHE B 55 65.042 -1.099 -5.691 1.00 0.00 C ATOM 0 H PHE B 55 65.040 -7.549 -3.688 1.00 0.00 H new ATOM 0 HA PHE B 55 66.420 -5.148 -3.044 1.00 0.00 H new ATOM 0 HB2 PHE B 55 65.858 -5.816 -5.340 1.00 0.00 H new ATOM 0 HB3 PHE B 55 64.144 -5.752 -4.982 1.00 0.00 H new ATOM 0 HD1 PHE B 55 67.195 -3.731 -5.520 1.00 0.00 H new ATOM 0 HD2 PHE B 55 62.980 -3.616 -4.701 1.00 0.00 H new ATOM 0 HE1 PHE B 55 67.153 -1.311 -6.063 1.00 0.00 H new ATOM 0 HE2 PHE B 55 62.938 -1.198 -5.244 1.00 0.00 H new ATOM 0 HZ PHE B 55 65.024 -0.046 -5.930 1.00 0.00 H new ATOM 2523 N GLN B 56 63.219 -5.268 -2.326 1.00 0.00 N ATOM 2524 CA GLN B 56 62.168 -4.587 -1.539 1.00 0.00 C ATOM 2525 C GLN B 56 62.672 -4.433 -0.115 1.00 0.00 C ATOM 2526 O GLN B 56 62.376 -3.473 0.566 1.00 0.00 O ATOM 2527 CB GLN B 56 60.873 -5.406 -1.559 1.00 0.00 C ATOM 2528 CG GLN B 56 59.749 -4.615 -0.880 1.00 0.00 C ATOM 2529 CD GLN B 56 59.415 -3.378 -1.715 1.00 0.00 C ATOM 2530 OE1 GLN B 56 58.914 -3.490 -2.817 1.00 0.00 O ATOM 2531 NE2 GLN B 56 59.670 -2.193 -1.232 1.00 0.00 N ATOM 0 H GLN B 56 62.947 -6.162 -2.736 1.00 0.00 H new ATOM 0 HA GLN B 56 61.952 -3.609 -1.969 1.00 0.00 H new ATOM 0 HB2 GLN B 56 60.596 -5.640 -2.587 1.00 0.00 H new ATOM 0 HB3 GLN B 56 61.024 -6.355 -1.045 1.00 0.00 H new ATOM 0 HG2 GLN B 56 58.864 -5.242 -0.771 1.00 0.00 H new ATOM 0 HG3 GLN B 56 60.055 -4.317 0.123 1.00 0.00 H new ATOM 0 HE21 GLN B 56 60.090 -2.099 -0.307 1.00 0.00 H new ATOM 0 HE22 GLN B 56 59.449 -1.361 -1.779 1.00 0.00 H new ATOM 2540 N LYS B 57 63.442 -5.377 0.333 1.00 0.00 N ATOM 2541 CA LYS B 57 63.986 -5.290 1.717 1.00 0.00 C ATOM 2542 C LYS B 57 65.016 -4.177 1.742 1.00 0.00 C ATOM 2543 O LYS B 57 65.090 -3.393 2.666 1.00 0.00 O ATOM 2544 CB LYS B 57 64.652 -6.609 2.125 1.00 0.00 C ATOM 2545 CG LYS B 57 63.628 -7.742 2.073 1.00 0.00 C ATOM 2546 CD LYS B 57 64.301 -9.059 2.482 1.00 0.00 C ATOM 2547 CE LYS B 57 63.444 -10.241 2.022 1.00 0.00 C ATOM 2548 NZ LYS B 57 63.833 -11.462 2.784 1.00 0.00 N ATOM 0 H LYS B 57 63.720 -6.205 -0.194 1.00 0.00 H new ATOM 0 HA LYS B 57 63.175 -5.090 2.417 1.00 0.00 H new ATOM 0 HB2 LYS B 57 65.485 -6.828 1.457 1.00 0.00 H new ATOM 0 HB3 LYS B 57 65.063 -6.524 3.131 1.00 0.00 H new ATOM 0 HG2 LYS B 57 62.795 -7.524 2.741 1.00 0.00 H new ATOM 0 HG3 LYS B 57 63.216 -7.829 1.067 1.00 0.00 H new ATOM 0 HD2 LYS B 57 65.295 -9.124 2.039 1.00 0.00 H new ATOM 0 HD3 LYS B 57 64.432 -9.091 3.564 1.00 0.00 H new ATOM 0 HE2 LYS B 57 62.388 -10.022 2.180 1.00 0.00 H new ATOM 0 HE3 LYS B 57 63.579 -10.408 0.953 1.00 0.00 H new ATOM 0 HZ1 LYS B 57 63.251 -12.266 2.472 1.00 0.00 H new ATOM 0 HZ2 LYS B 57 64.837 -11.674 2.612 1.00 0.00 H new ATOM 0 HZ3 LYS B 57 63.683 -11.300 3.800 1.00 0.00 H new ATOM 2562 N LEU B 58 65.796 -4.091 0.704 1.00 0.00 N ATOM 2563 CA LEU B 58 66.807 -3.014 0.632 1.00 0.00 C ATOM 2564 C LEU B 58 66.023 -1.727 0.506 1.00 0.00 C ATOM 2565 O LEU B 58 66.309 -0.730 1.133 1.00 0.00 O ATOM 2566 CB LEU B 58 67.694 -3.223 -0.602 1.00 0.00 C ATOM 2567 CG LEU B 58 68.757 -2.115 -0.697 1.00 0.00 C ATOM 2568 CD1 LEU B 58 69.792 -2.268 0.428 1.00 0.00 C ATOM 2569 CD2 LEU B 58 69.456 -2.212 -2.061 1.00 0.00 C ATOM 0 H LEU B 58 65.774 -4.723 -0.097 1.00 0.00 H new ATOM 0 HA LEU B 58 67.457 -3.000 1.507 1.00 0.00 H new ATOM 0 HB2 LEU B 58 68.180 -4.197 -0.547 1.00 0.00 H new ATOM 0 HB3 LEU B 58 67.080 -3.224 -1.502 1.00 0.00 H new ATOM 0 HG LEU B 58 68.275 -1.143 -0.593 1.00 0.00 H new ATOM 0 HD11 LEU B 58 70.537 -1.477 0.347 1.00 0.00 H new ATOM 0 HD12 LEU B 58 69.292 -2.198 1.394 1.00 0.00 H new ATOM 0 HD13 LEU B 58 70.282 -3.238 0.342 1.00 0.00 H new ATOM 0 HD21 LEU B 58 70.212 -1.431 -2.139 1.00 0.00 H new ATOM 0 HD22 LEU B 58 69.932 -3.188 -2.157 1.00 0.00 H new ATOM 0 HD23 LEU B 58 68.721 -2.086 -2.856 1.00 0.00 H new ATOM 2581 N MET B 59 64.998 -1.771 -0.283 1.00 0.00 N ATOM 2582 CA MET B 59 64.140 -0.582 -0.436 1.00 0.00 C ATOM 2583 C MET B 59 63.449 -0.338 0.899 1.00 0.00 C ATOM 2584 O MET B 59 63.281 0.781 1.337 1.00 0.00 O ATOM 2585 CB MET B 59 63.093 -0.822 -1.526 1.00 0.00 C ATOM 2586 CG MET B 59 62.362 0.485 -1.867 1.00 0.00 C ATOM 2587 SD MET B 59 60.979 0.723 -0.721 1.00 0.00 S ATOM 2588 CE MET B 59 60.517 2.389 -1.259 1.00 0.00 C ATOM 0 H MET B 59 64.717 -2.584 -0.831 1.00 0.00 H new ATOM 0 HA MET B 59 64.738 0.282 -0.725 1.00 0.00 H new ATOM 0 HB2 MET B 59 63.574 -1.220 -2.419 1.00 0.00 H new ATOM 0 HB3 MET B 59 62.375 -1.570 -1.190 1.00 0.00 H new ATOM 0 HG2 MET B 59 63.051 1.327 -1.801 1.00 0.00 H new ATOM 0 HG3 MET B 59 61.996 0.452 -2.893 1.00 0.00 H new ATOM 0 HE1 MET B 59 59.667 2.738 -0.673 1.00 0.00 H new ATOM 0 HE2 MET B 59 61.360 3.065 -1.114 1.00 0.00 H new ATOM 0 HE3 MET B 59 60.245 2.368 -2.314 1.00 0.00 H new ATOM 2598 N SER B 60 63.049 -1.391 1.550 1.00 0.00 N ATOM 2599 CA SER B 60 62.369 -1.234 2.868 1.00 0.00 C ATOM 2600 C SER B 60 63.319 -0.537 3.837 1.00 0.00 C ATOM 2601 O SER B 60 62.898 0.114 4.770 1.00 0.00 O ATOM 2602 CB SER B 60 61.995 -2.602 3.432 1.00 0.00 C ATOM 2603 OG SER B 60 61.218 -2.430 4.613 1.00 0.00 O ATOM 0 H SER B 60 63.162 -2.353 1.230 1.00 0.00 H new ATOM 0 HA SER B 60 61.463 -0.642 2.737 1.00 0.00 H new ATOM 0 HB2 SER B 60 61.432 -3.171 2.692 1.00 0.00 H new ATOM 0 HB3 SER B 60 62.895 -3.174 3.656 1.00 0.00 H new ATOM 0 HG SER B 60 60.976 -3.308 4.976 1.00 0.00 H new ATOM 2609 N ASN B 61 64.595 -0.657 3.625 1.00 0.00 N ATOM 2610 CA ASN B 61 65.541 0.026 4.554 1.00 0.00 C ATOM 2611 C ASN B 61 65.353 1.522 4.372 1.00 0.00 C ATOM 2612 O ASN B 61 65.427 2.286 5.307 1.00 0.00 O ATOM 2613 CB ASN B 61 66.987 -0.373 4.250 1.00 0.00 C ATOM 2614 CG ASN B 61 67.203 -1.837 4.634 1.00 0.00 C ATOM 2615 OD1 ASN B 61 67.802 -2.588 3.890 1.00 0.00 O ATOM 2616 ND2 ASN B 61 66.737 -2.278 5.770 1.00 0.00 N ATOM 0 H ASN B 61 65.022 -1.187 2.865 1.00 0.00 H new ATOM 0 HA ASN B 61 65.337 -0.266 5.584 1.00 0.00 H new ATOM 0 HB2 ASN B 61 67.200 -0.228 3.191 1.00 0.00 H new ATOM 0 HB3 ASN B 61 67.676 0.265 4.804 1.00 0.00 H new ATOM 0 HD21 ASN B 61 66.875 -3.254 6.034 1.00 0.00 H new ATOM 0 HD22 ASN B 61 66.234 -1.647 6.394 1.00 0.00 H new ATOM 2623 N LEU B 62 65.064 1.954 3.179 1.00 0.00 N ATOM 2624 CA LEU B 62 64.823 3.408 2.979 1.00 0.00 C ATOM 2625 C LEU B 62 63.658 3.750 3.900 1.00 0.00 C ATOM 2626 O LEU B 62 63.592 4.804 4.500 1.00 0.00 O ATOM 2627 CB LEU B 62 64.428 3.679 1.520 1.00 0.00 C ATOM 2628 CG LEU B 62 65.348 2.913 0.563 1.00 0.00 C ATOM 2629 CD1 LEU B 62 64.930 3.204 -0.889 1.00 0.00 C ATOM 2630 CD2 LEU B 62 66.814 3.317 0.768 1.00 0.00 C ATOM 0 H LEU B 62 64.985 1.373 2.344 1.00 0.00 H new ATOM 0 HA LEU B 62 65.710 4.003 3.197 1.00 0.00 H new ATOM 0 HB2 LEU B 62 63.393 3.380 1.356 1.00 0.00 H new ATOM 0 HB3 LEU B 62 64.488 4.748 1.314 1.00 0.00 H new ATOM 0 HG LEU B 62 65.255 1.847 0.771 1.00 0.00 H new ATOM 0 HD11 LEU B 62 65.583 2.660 -1.572 1.00 0.00 H new ATOM 0 HD12 LEU B 62 63.899 2.885 -1.042 1.00 0.00 H new ATOM 0 HD13 LEU B 62 65.011 4.273 -1.084 1.00 0.00 H new ATOM 0 HD21 LEU B 62 67.445 2.759 0.077 1.00 0.00 H new ATOM 0 HD22 LEU B 62 66.927 4.385 0.581 1.00 0.00 H new ATOM 0 HD23 LEU B 62 67.113 3.095 1.792 1.00 0.00 H new ATOM 2642 N ASP B 63 62.761 2.815 4.040 1.00 0.00 N ATOM 2643 CA ASP B 63 61.606 3.005 4.944 1.00 0.00 C ATOM 2644 C ASP B 63 62.083 2.751 6.376 1.00 0.00 C ATOM 2645 O ASP B 63 61.313 2.799 7.314 1.00 0.00 O ATOM 2646 CB ASP B 63 60.499 2.010 4.582 1.00 0.00 C ATOM 2647 CG ASP B 63 59.188 2.439 5.241 1.00 0.00 C ATOM 2648 OD1 ASP B 63 59.246 3.203 6.190 1.00 0.00 O ATOM 2649 OD2 ASP B 63 58.148 1.996 4.784 1.00 0.00 O ATOM 0 H ASP B 63 62.784 1.917 3.557 1.00 0.00 H new ATOM 0 HA ASP B 63 61.210 4.016 4.850 1.00 0.00 H new ATOM 0 HB2 ASP B 63 60.376 1.965 3.500 1.00 0.00 H new ATOM 0 HB3 ASP B 63 60.774 1.009 4.913 1.00 0.00 H new ATOM 2654 N SER B 64 63.354 2.471 6.548 1.00 0.00 N ATOM 2655 CA SER B 64 63.872 2.206 7.922 1.00 0.00 C ATOM 2656 C SER B 64 63.528 3.408 8.803 1.00 0.00 C ATOM 2657 O SER B 64 63.102 4.435 8.313 1.00 0.00 O ATOM 2658 CB SER B 64 65.394 2.053 7.914 1.00 0.00 C ATOM 2659 OG SER B 64 65.846 1.894 9.253 1.00 0.00 O ATOM 0 H SER B 64 64.047 2.416 5.802 1.00 0.00 H new ATOM 0 HA SER B 64 63.421 1.286 8.295 1.00 0.00 H new ATOM 0 HB2 SER B 64 65.683 1.191 7.313 1.00 0.00 H new ATOM 0 HB3 SER B 64 65.859 2.928 7.460 1.00 0.00 H new ATOM 0 HG SER B 64 66.821 1.793 9.259 1.00 0.00 H new ATOM 2665 N ASN B 65 63.719 3.311 10.088 1.00 0.00 N ATOM 2666 CA ASN B 65 63.407 4.483 10.953 1.00 0.00 C ATOM 2667 C ASN B 65 64.251 5.669 10.479 1.00 0.00 C ATOM 2668 O ASN B 65 65.409 5.518 10.149 1.00 0.00 O ATOM 2669 CB ASN B 65 63.748 4.163 12.412 1.00 0.00 C ATOM 2670 CG ASN B 65 63.198 5.269 13.315 1.00 0.00 C ATOM 2671 OD1 ASN B 65 62.577 6.202 12.842 1.00 0.00 O ATOM 2672 ND2 ASN B 65 63.397 5.206 14.603 1.00 0.00 N ATOM 0 H ASN B 65 64.072 2.485 10.572 1.00 0.00 H new ATOM 0 HA ASN B 65 62.346 4.721 10.886 1.00 0.00 H new ATOM 0 HB2 ASN B 65 63.321 3.201 12.695 1.00 0.00 H new ATOM 0 HB3 ASN B 65 64.828 4.081 12.535 1.00 0.00 H new ATOM 0 HD21 ASN B 65 63.032 5.938 15.212 1.00 0.00 H new ATOM 0 HD22 ASN B 65 63.917 4.424 15.001 1.00 0.00 H new ATOM 2679 N ARG B 66 63.673 6.846 10.427 1.00 0.00 N ATOM 2680 CA ARG B 66 64.431 8.048 9.954 1.00 0.00 C ATOM 2681 C ARG B 66 65.273 7.670 8.725 1.00 0.00 C ATOM 2682 O ARG B 66 64.761 7.143 7.758 1.00 0.00 O ATOM 2683 CB ARG B 66 65.343 8.564 11.074 1.00 0.00 C ATOM 2684 CG ARG B 66 65.772 10.009 10.776 1.00 0.00 C ATOM 2685 CD ARG B 66 66.539 10.570 11.974 1.00 0.00 C ATOM 2686 NE ARG B 66 67.777 9.770 12.184 1.00 0.00 N ATOM 2687 CZ ARG B 66 68.719 10.218 12.968 1.00 0.00 C ATOM 2688 NH1 ARG B 66 68.571 11.364 13.575 1.00 0.00 N ATOM 2689 NH2 ARG B 66 69.807 9.521 13.146 1.00 0.00 N ATOM 0 H ARG B 66 62.705 7.026 10.693 1.00 0.00 H new ATOM 0 HA ARG B 66 63.728 8.835 9.682 1.00 0.00 H new ATOM 0 HB2 ARG B 66 64.820 8.520 12.029 1.00 0.00 H new ATOM 0 HB3 ARG B 66 66.222 7.925 11.162 1.00 0.00 H new ATOM 0 HG2 ARG B 66 66.398 10.037 9.884 1.00 0.00 H new ATOM 0 HG3 ARG B 66 64.896 10.625 10.570 1.00 0.00 H new ATOM 0 HD2 ARG B 66 66.793 11.616 11.800 1.00 0.00 H new ATOM 0 HD3 ARG B 66 65.915 10.538 12.867 1.00 0.00 H new ATOM 0 HE ARG B 66 67.889 8.871 11.715 1.00 0.00 H new ATOM 0 HH11 ARG B 66 67.720 11.908 13.436 1.00 0.00 H new ATOM 0 HH12 ARG B 66 69.307 11.715 14.188 1.00 0.00 H new ATOM 0 HH21 ARG B 66 69.922 8.625 12.672 1.00 0.00 H new ATOM 0 HH22 ARG B 66 70.543 9.872 13.759 1.00 0.00 H new ATOM 2703 N ASP B 67 66.554 7.932 8.752 1.00 0.00 N ATOM 2704 CA ASP B 67 67.417 7.582 7.585 1.00 0.00 C ATOM 2705 C ASP B 67 66.901 8.297 6.334 1.00 0.00 C ATOM 2706 O ASP B 67 66.880 7.740 5.253 1.00 0.00 O ATOM 2707 CB ASP B 67 67.389 6.066 7.358 1.00 0.00 C ATOM 2708 CG ASP B 67 68.535 5.666 6.426 1.00 0.00 C ATOM 2709 OD1 ASP B 67 69.049 6.538 5.745 1.00 0.00 O ATOM 2710 OD2 ASP B 67 68.878 4.496 6.410 1.00 0.00 O ATOM 0 H ASP B 67 67.040 8.374 9.533 1.00 0.00 H new ATOM 0 HA ASP B 67 68.441 7.897 7.787 1.00 0.00 H new ATOM 0 HB2 ASP B 67 67.482 5.544 8.310 1.00 0.00 H new ATOM 0 HB3 ASP B 67 66.434 5.771 6.924 1.00 0.00 H new ATOM 2715 N ASN B 68 66.487 9.528 6.470 1.00 0.00 N ATOM 2716 CA ASN B 68 65.974 10.283 5.291 1.00 0.00 C ATOM 2717 C ASN B 68 67.144 10.897 4.525 1.00 0.00 C ATOM 2718 O ASN B 68 66.966 11.514 3.493 1.00 0.00 O ATOM 2719 CB ASN B 68 65.033 11.391 5.765 1.00 0.00 C ATOM 2720 CG ASN B 68 65.795 12.366 6.664 1.00 0.00 C ATOM 2721 OD1 ASN B 68 66.793 12.010 7.259 1.00 0.00 O ATOM 2722 ND2 ASN B 68 65.367 13.592 6.786 1.00 0.00 N ATOM 0 H ASN B 68 66.482 10.045 7.350 1.00 0.00 H new ATOM 0 HA ASN B 68 65.432 9.603 4.634 1.00 0.00 H new ATOM 0 HB2 ASN B 68 64.618 11.921 4.907 1.00 0.00 H new ATOM 0 HB3 ASN B 68 64.193 10.960 6.310 1.00 0.00 H new ATOM 0 HD21 ASN B 68 65.870 14.251 7.380 1.00 0.00 H new ATOM 0 HD22 ASN B 68 64.529 13.892 6.287 1.00 0.00 H new ATOM 2729 N GLU B 69 68.339 10.741 5.031 1.00 0.00 N ATOM 2730 CA GLU B 69 69.544 11.321 4.354 1.00 0.00 C ATOM 2731 C GLU B 69 70.562 10.217 4.067 1.00 0.00 C ATOM 2732 O GLU B 69 70.664 9.252 4.792 1.00 0.00 O ATOM 2733 CB GLU B 69 70.179 12.349 5.284 1.00 0.00 C ATOM 2734 CG GLU B 69 71.251 13.128 4.531 1.00 0.00 C ATOM 2735 CD GLU B 69 71.865 14.172 5.462 1.00 0.00 C ATOM 2736 OE1 GLU B 69 71.350 14.335 6.556 1.00 0.00 O ATOM 2737 OE2 GLU B 69 72.833 14.797 5.064 1.00 0.00 O ATOM 0 H GLU B 69 68.537 10.232 5.893 1.00 0.00 H new ATOM 0 HA GLU B 69 69.245 11.788 3.416 1.00 0.00 H new ATOM 0 HB2 GLU B 69 69.418 13.031 5.662 1.00 0.00 H new ATOM 0 HB3 GLU B 69 70.617 11.850 6.148 1.00 0.00 H new ATOM 0 HG2 GLU B 69 72.023 12.449 4.168 1.00 0.00 H new ATOM 0 HG3 GLU B 69 70.817 13.614 3.657 1.00 0.00 H new ATOM 2744 N VAL B 70 71.326 10.368 3.018 1.00 0.00 N ATOM 2745 CA VAL B 70 72.366 9.352 2.663 1.00 0.00 C ATOM 2746 C VAL B 70 73.733 9.991 2.798 1.00 0.00 C ATOM 2747 O VAL B 70 74.180 10.727 1.941 1.00 0.00 O ATOM 2748 CB VAL B 70 72.174 8.925 1.209 1.00 0.00 C ATOM 2749 CG1 VAL B 70 72.960 7.651 0.938 1.00 0.00 C ATOM 2750 CG2 VAL B 70 70.697 8.670 0.937 1.00 0.00 C ATOM 0 H VAL B 70 71.274 11.163 2.381 1.00 0.00 H new ATOM 0 HA VAL B 70 72.280 8.488 3.321 1.00 0.00 H new ATOM 0 HB VAL B 70 72.533 9.721 0.556 1.00 0.00 H new ATOM 0 HG11 VAL B 70 72.820 7.351 -0.100 1.00 0.00 H new ATOM 0 HG12 VAL B 70 74.019 7.830 1.124 1.00 0.00 H new ATOM 0 HG13 VAL B 70 72.605 6.858 1.596 1.00 0.00 H new ATOM 0 HG21 VAL B 70 70.565 8.366 -0.101 1.00 0.00 H new ATOM 0 HG22 VAL B 70 70.337 7.879 1.595 1.00 0.00 H new ATOM 0 HG23 VAL B 70 70.130 9.582 1.122 1.00 0.00 H new ATOM 2760 N ASP B 71 74.414 9.683 3.846 1.00 0.00 N ATOM 2761 CA ASP B 71 75.775 10.233 4.020 1.00 0.00 C ATOM 2762 C ASP B 71 76.698 9.347 3.203 1.00 0.00 C ATOM 2763 O ASP B 71 76.300 8.289 2.754 1.00 0.00 O ATOM 2764 CB ASP B 71 76.167 10.178 5.498 1.00 0.00 C ATOM 2765 CG ASP B 71 75.339 11.195 6.285 1.00 0.00 C ATOM 2766 OD1 ASP B 71 75.026 12.234 5.727 1.00 0.00 O ATOM 2767 OD2 ASP B 71 75.034 10.918 7.433 1.00 0.00 O ATOM 0 H ASP B 71 74.090 9.072 4.596 1.00 0.00 H new ATOM 0 HA ASP B 71 75.834 11.272 3.695 1.00 0.00 H new ATOM 0 HB2 ASP B 71 76.001 9.175 5.892 1.00 0.00 H new ATOM 0 HB3 ASP B 71 77.230 10.393 5.611 1.00 0.00 H new ATOM 2772 N PHE B 72 77.917 9.731 2.998 1.00 0.00 N ATOM 2773 CA PHE B 72 78.807 8.856 2.210 1.00 0.00 C ATOM 2774 C PHE B 72 78.841 7.497 2.904 1.00 0.00 C ATOM 2775 O PHE B 72 78.881 6.459 2.274 1.00 0.00 O ATOM 2776 CB PHE B 72 80.206 9.460 2.161 1.00 0.00 C ATOM 2777 CG PHE B 72 81.027 8.695 1.165 1.00 0.00 C ATOM 2778 CD1 PHE B 72 81.026 9.086 -0.177 1.00 0.00 C ATOM 2779 CD2 PHE B 72 81.774 7.589 1.573 1.00 0.00 C ATOM 2780 CE1 PHE B 72 81.775 8.371 -1.112 1.00 0.00 C ATOM 2781 CE2 PHE B 72 82.524 6.871 0.638 1.00 0.00 C ATOM 2782 CZ PHE B 72 82.525 7.261 -0.706 1.00 0.00 C ATOM 0 H PHE B 72 78.331 10.600 3.336 1.00 0.00 H new ATOM 0 HA PHE B 72 78.447 8.751 1.187 1.00 0.00 H new ATOM 0 HB2 PHE B 72 80.154 10.512 1.879 1.00 0.00 H new ATOM 0 HB3 PHE B 72 80.671 9.417 3.146 1.00 0.00 H new ATOM 0 HD1 PHE B 72 80.446 9.941 -0.490 1.00 0.00 H new ATOM 0 HD2 PHE B 72 81.772 7.288 2.610 1.00 0.00 H new ATOM 0 HE1 PHE B 72 81.776 8.674 -2.149 1.00 0.00 H new ATOM 0 HE2 PHE B 72 83.103 6.015 0.952 1.00 0.00 H new ATOM 0 HZ PHE B 72 83.104 6.706 -1.429 1.00 0.00 H new ATOM 2792 N GLN B 73 78.813 7.508 4.208 1.00 0.00 N ATOM 2793 CA GLN B 73 78.832 6.234 4.970 1.00 0.00 C ATOM 2794 C GLN B 73 77.539 5.437 4.733 1.00 0.00 C ATOM 2795 O GLN B 73 77.575 4.233 4.616 1.00 0.00 O ATOM 2796 CB GLN B 73 78.986 6.536 6.465 1.00 0.00 C ATOM 2797 CG GLN B 73 79.010 5.225 7.256 1.00 0.00 C ATOM 2798 CD GLN B 73 79.321 5.521 8.723 1.00 0.00 C ATOM 2799 OE1 GLN B 73 79.682 6.627 9.068 1.00 0.00 O ATOM 2800 NE2 GLN B 73 79.204 4.568 9.606 1.00 0.00 N ATOM 0 H GLN B 73 78.778 8.352 4.780 1.00 0.00 H new ATOM 0 HA GLN B 73 79.674 5.634 4.626 1.00 0.00 H new ATOM 0 HB2 GLN B 73 79.905 7.095 6.640 1.00 0.00 H new ATOM 0 HB3 GLN B 73 78.162 7.163 6.806 1.00 0.00 H new ATOM 0 HG2 GLN B 73 78.048 4.719 7.172 1.00 0.00 H new ATOM 0 HG3 GLN B 73 79.761 4.552 6.842 1.00 0.00 H new ATOM 0 HE21 GLN B 73 78.901 3.638 9.316 1.00 0.00 H new ATOM 0 HE22 GLN B 73 79.416 4.752 10.587 1.00 0.00 H new ATOM 2809 N GLU B 74 76.387 6.067 4.673 1.00 0.00 N ATOM 2810 CA GLU B 74 75.151 5.272 4.460 1.00 0.00 C ATOM 2811 C GLU B 74 75.143 4.721 3.044 1.00 0.00 C ATOM 2812 O GLU B 74 74.686 3.624 2.797 1.00 0.00 O ATOM 2813 CB GLU B 74 73.921 6.148 4.685 1.00 0.00 C ATOM 2814 CG GLU B 74 73.817 6.491 6.168 1.00 0.00 C ATOM 2815 CD GLU B 74 72.567 7.334 6.409 1.00 0.00 C ATOM 2816 OE1 GLU B 74 71.703 7.326 5.551 1.00 0.00 O ATOM 2817 OE2 GLU B 74 72.490 7.962 7.453 1.00 0.00 O ATOM 0 H GLU B 74 76.258 7.075 4.761 1.00 0.00 H new ATOM 0 HA GLU B 74 75.127 4.445 5.170 1.00 0.00 H new ATOM 0 HB2 GLU B 74 73.995 7.060 4.092 1.00 0.00 H new ATOM 0 HB3 GLU B 74 73.022 5.626 4.356 1.00 0.00 H new ATOM 0 HG2 GLU B 74 73.773 5.578 6.761 1.00 0.00 H new ATOM 0 HG3 GLU B 74 74.704 7.037 6.489 1.00 0.00 H new ATOM 2824 N TYR B 75 75.642 5.473 2.111 1.00 0.00 N ATOM 2825 CA TYR B 75 75.656 4.989 0.711 1.00 0.00 C ATOM 2826 C TYR B 75 76.465 3.693 0.645 1.00 0.00 C ATOM 2827 O TYR B 75 76.097 2.744 -0.020 1.00 0.00 O ATOM 2828 CB TYR B 75 76.309 6.051 -0.172 1.00 0.00 C ATOM 2829 CG TYR B 75 76.396 5.552 -1.596 1.00 0.00 C ATOM 2830 CD1 TYR B 75 75.226 5.320 -2.330 1.00 0.00 C ATOM 2831 CD2 TYR B 75 77.648 5.323 -2.185 1.00 0.00 C ATOM 2832 CE1 TYR B 75 75.309 4.859 -3.649 1.00 0.00 C ATOM 2833 CE2 TYR B 75 77.728 4.864 -3.503 1.00 0.00 C ATOM 2834 CZ TYR B 75 76.560 4.632 -4.235 1.00 0.00 C ATOM 2835 OH TYR B 75 76.643 4.181 -5.537 1.00 0.00 O ATOM 0 H TYR B 75 76.040 6.401 2.257 1.00 0.00 H new ATOM 0 HA TYR B 75 74.640 4.802 0.363 1.00 0.00 H new ATOM 0 HB2 TYR B 75 75.730 6.974 -0.135 1.00 0.00 H new ATOM 0 HB3 TYR B 75 77.306 6.285 0.202 1.00 0.00 H new ATOM 0 HD1 TYR B 75 74.261 5.497 -1.879 1.00 0.00 H new ATOM 0 HD2 TYR B 75 78.551 5.501 -1.620 1.00 0.00 H new ATOM 0 HE1 TYR B 75 74.407 4.678 -4.215 1.00 0.00 H new ATOM 0 HE2 TYR B 75 78.693 4.689 -3.956 1.00 0.00 H new ATOM 0 HH TYR B 75 77.557 4.303 -5.868 1.00 0.00 H new ATOM 2845 N CYS B 76 77.556 3.645 1.356 1.00 0.00 N ATOM 2846 CA CYS B 76 78.395 2.422 1.379 1.00 0.00 C ATOM 2847 C CYS B 76 77.658 1.341 2.156 1.00 0.00 C ATOM 2848 O CYS B 76 77.681 0.182 1.795 1.00 0.00 O ATOM 2849 CB CYS B 76 79.747 2.726 2.044 1.00 0.00 C ATOM 2850 SG CYS B 76 79.597 2.660 3.850 1.00 0.00 S ATOM 0 H CYS B 76 77.904 4.414 1.929 1.00 0.00 H new ATOM 0 HA CYS B 76 78.582 2.080 0.361 1.00 0.00 H new ATOM 0 HB2 CYS B 76 80.494 2.006 1.709 1.00 0.00 H new ATOM 0 HB3 CYS B 76 80.096 3.712 1.738 1.00 0.00 H new ATOM 0 HG CYS B 76 78.630 3.440 4.234 1.00 0.00 H new ATOM 2856 N VAL B 77 76.985 1.705 3.218 1.00 0.00 N ATOM 2857 CA VAL B 77 76.248 0.674 3.979 1.00 0.00 C ATOM 2858 C VAL B 77 75.237 0.056 3.025 1.00 0.00 C ATOM 2859 O VAL B 77 75.032 -1.141 3.007 1.00 0.00 O ATOM 2860 CB VAL B 77 75.524 1.316 5.163 1.00 0.00 C ATOM 2861 CG1 VAL B 77 74.570 0.295 5.794 1.00 0.00 C ATOM 2862 CG2 VAL B 77 76.549 1.790 6.209 1.00 0.00 C ATOM 0 H VAL B 77 76.919 2.656 3.580 1.00 0.00 H new ATOM 0 HA VAL B 77 76.928 -0.082 4.370 1.00 0.00 H new ATOM 0 HB VAL B 77 74.952 2.176 4.813 1.00 0.00 H new ATOM 0 HG11 VAL B 77 74.054 0.753 6.638 1.00 0.00 H new ATOM 0 HG12 VAL B 77 73.839 -0.026 5.052 1.00 0.00 H new ATOM 0 HG13 VAL B 77 75.138 -0.568 6.141 1.00 0.00 H new ATOM 0 HG21 VAL B 77 76.026 2.246 7.050 1.00 0.00 H new ATOM 0 HG22 VAL B 77 77.129 0.938 6.562 1.00 0.00 H new ATOM 0 HG23 VAL B 77 77.218 2.522 5.757 1.00 0.00 H new ATOM 2872 N PHE B 78 74.619 0.865 2.207 1.00 0.00 N ATOM 2873 CA PHE B 78 73.652 0.305 1.235 1.00 0.00 C ATOM 2874 C PHE B 78 74.421 -0.536 0.216 1.00 0.00 C ATOM 2875 O PHE B 78 73.999 -1.612 -0.141 1.00 0.00 O ATOM 2876 CB PHE B 78 72.903 1.430 0.515 1.00 0.00 C ATOM 2877 CG PHE B 78 71.861 2.033 1.436 1.00 0.00 C ATOM 2878 CD1 PHE B 78 70.787 1.253 1.884 1.00 0.00 C ATOM 2879 CD2 PHE B 78 71.967 3.371 1.838 1.00 0.00 C ATOM 2880 CE1 PHE B 78 69.824 1.811 2.733 1.00 0.00 C ATOM 2881 CE2 PHE B 78 71.004 3.927 2.686 1.00 0.00 C ATOM 2882 CZ PHE B 78 69.932 3.148 3.134 1.00 0.00 C ATOM 0 H PHE B 78 74.743 1.877 2.173 1.00 0.00 H new ATOM 0 HA PHE B 78 72.922 -0.311 1.761 1.00 0.00 H new ATOM 0 HB2 PHE B 78 73.606 2.199 0.195 1.00 0.00 H new ATOM 0 HB3 PHE B 78 72.424 1.042 -0.384 1.00 0.00 H new ATOM 0 HD1 PHE B 78 70.702 0.222 1.575 1.00 0.00 H new ATOM 0 HD2 PHE B 78 72.794 3.974 1.492 1.00 0.00 H new ATOM 0 HE1 PHE B 78 68.997 1.209 3.079 1.00 0.00 H new ATOM 0 HE2 PHE B 78 71.088 4.958 2.995 1.00 0.00 H new ATOM 0 HZ PHE B 78 69.188 3.578 3.789 1.00 0.00 H new ATOM 2892 N LEU B 79 75.565 -0.083 -0.243 1.00 0.00 N ATOM 2893 CA LEU B 79 76.324 -0.930 -1.221 1.00 0.00 C ATOM 2894 C LEU B 79 76.874 -2.157 -0.500 1.00 0.00 C ATOM 2895 O LEU B 79 76.953 -3.236 -1.053 1.00 0.00 O ATOM 2896 CB LEU B 79 77.481 -0.153 -1.860 1.00 0.00 C ATOM 2897 CG LEU B 79 76.949 0.876 -2.871 1.00 0.00 C ATOM 2898 CD1 LEU B 79 78.128 1.723 -3.371 1.00 0.00 C ATOM 2899 CD2 LEU B 79 76.272 0.159 -4.068 1.00 0.00 C ATOM 0 H LEU B 79 75.996 0.807 0.007 1.00 0.00 H new ATOM 0 HA LEU B 79 75.640 -1.230 -2.015 1.00 0.00 H new ATOM 0 HB2 LEU B 79 78.057 0.354 -1.086 1.00 0.00 H new ATOM 0 HB3 LEU B 79 78.159 -0.845 -2.360 1.00 0.00 H new ATOM 0 HG LEU B 79 76.206 1.512 -2.389 1.00 0.00 H new ATOM 0 HD11 LEU B 79 77.768 2.459 -4.090 1.00 0.00 H new ATOM 0 HD12 LEU B 79 78.591 2.236 -2.528 1.00 0.00 H new ATOM 0 HD13 LEU B 79 78.863 1.076 -3.851 1.00 0.00 H new ATOM 0 HD21 LEU B 79 75.901 0.902 -4.774 1.00 0.00 H new ATOM 0 HD22 LEU B 79 76.998 -0.484 -4.565 1.00 0.00 H new ATOM 0 HD23 LEU B 79 75.440 -0.446 -3.707 1.00 0.00 H new ATOM 2911 N SER B 80 77.253 -1.994 0.732 1.00 0.00 N ATOM 2912 CA SER B 80 77.801 -3.140 1.507 1.00 0.00 C ATOM 2913 C SER B 80 76.684 -4.147 1.726 1.00 0.00 C ATOM 2914 O SER B 80 76.873 -5.344 1.632 1.00 0.00 O ATOM 2915 CB SER B 80 78.307 -2.649 2.860 1.00 0.00 C ATOM 2916 OG SER B 80 77.195 -2.317 3.681 1.00 0.00 O ATOM 0 H SER B 80 77.207 -1.111 1.241 1.00 0.00 H new ATOM 0 HA SER B 80 78.626 -3.599 0.962 1.00 0.00 H new ATOM 0 HB2 SER B 80 78.910 -3.421 3.338 1.00 0.00 H new ATOM 0 HB3 SER B 80 78.950 -1.779 2.728 1.00 0.00 H new ATOM 0 HG SER B 80 76.519 -1.854 3.144 1.00 0.00 H new ATOM 2922 N CYS B 81 75.513 -3.657 2.001 1.00 0.00 N ATOM 2923 CA CYS B 81 74.357 -4.555 2.213 1.00 0.00 C ATOM 2924 C CYS B 81 74.005 -5.206 0.882 1.00 0.00 C ATOM 2925 O CYS B 81 73.556 -6.333 0.832 1.00 0.00 O ATOM 2926 CB CYS B 81 73.163 -3.740 2.713 1.00 0.00 C ATOM 2927 SG CYS B 81 73.538 -3.050 4.344 1.00 0.00 S ATOM 0 H CYS B 81 75.308 -2.662 2.088 1.00 0.00 H new ATOM 0 HA CYS B 81 74.603 -5.318 2.952 1.00 0.00 H new ATOM 0 HB2 CYS B 81 72.938 -2.937 2.011 1.00 0.00 H new ATOM 0 HB3 CYS B 81 72.277 -4.372 2.769 1.00 0.00 H new ATOM 0 HG CYS B 81 74.375 -2.063 4.216 1.00 0.00 H new ATOM 2933 N ILE B 82 74.212 -4.505 -0.204 1.00 0.00 N ATOM 2934 CA ILE B 82 73.884 -5.106 -1.533 1.00 0.00 C ATOM 2935 C ILE B 82 74.856 -6.250 -1.822 1.00 0.00 C ATOM 2936 O ILE B 82 74.474 -7.286 -2.326 1.00 0.00 O ATOM 2937 CB ILE B 82 73.971 -4.036 -2.634 1.00 0.00 C ATOM 2938 CG1 ILE B 82 72.776 -3.075 -2.504 1.00 0.00 C ATOM 2939 CG2 ILE B 82 73.940 -4.698 -4.017 1.00 0.00 C ATOM 2940 CD1 ILE B 82 73.042 -1.769 -3.271 1.00 0.00 C ATOM 0 H ILE B 82 74.588 -3.557 -0.230 1.00 0.00 H new ATOM 0 HA ILE B 82 72.866 -5.496 -1.515 1.00 0.00 H new ATOM 0 HB ILE B 82 74.905 -3.485 -2.523 1.00 0.00 H new ATOM 0 HG12 ILE B 82 71.876 -3.552 -2.890 1.00 0.00 H new ATOM 0 HG13 ILE B 82 72.593 -2.854 -1.452 1.00 0.00 H new ATOM 0 HG21 ILE B 82 74.002 -3.931 -4.789 1.00 0.00 H new ATOM 0 HG22 ILE B 82 74.785 -5.379 -4.113 1.00 0.00 H new ATOM 0 HG23 ILE B 82 73.010 -5.255 -4.133 1.00 0.00 H new ATOM 0 HD11 ILE B 82 72.185 -1.104 -3.166 1.00 0.00 H new ATOM 0 HD12 ILE B 82 73.930 -1.283 -2.866 1.00 0.00 H new ATOM 0 HD13 ILE B 82 73.200 -1.992 -4.326 1.00 0.00 H new ATOM 2952 N ALA B 83 76.107 -6.079 -1.497 1.00 0.00 N ATOM 2953 CA ALA B 83 77.085 -7.171 -1.749 1.00 0.00 C ATOM 2954 C ALA B 83 76.672 -8.409 -0.956 1.00 0.00 C ATOM 2955 O ALA B 83 76.607 -9.500 -1.478 1.00 0.00 O ATOM 2956 CB ALA B 83 78.472 -6.733 -1.296 1.00 0.00 C ATOM 0 H ALA B 83 76.492 -5.236 -1.071 1.00 0.00 H new ATOM 0 HA ALA B 83 77.104 -7.399 -2.815 1.00 0.00 H new ATOM 0 HB1 ALA B 83 79.186 -7.535 -1.482 1.00 0.00 H new ATOM 0 HB2 ALA B 83 78.772 -5.844 -1.851 1.00 0.00 H new ATOM 0 HB3 ALA B 83 78.452 -6.505 -0.230 1.00 0.00 H new ATOM 2962 N MET B 84 76.387 -8.244 0.307 1.00 0.00 N ATOM 2963 CA MET B 84 75.973 -9.413 1.129 1.00 0.00 C ATOM 2964 C MET B 84 74.620 -9.892 0.638 1.00 0.00 C ATOM 2965 O MET B 84 74.344 -11.074 0.587 1.00 0.00 O ATOM 2966 CB MET B 84 75.889 -9.018 2.604 1.00 0.00 C ATOM 2967 CG MET B 84 77.299 -8.771 3.144 1.00 0.00 C ATOM 2968 SD MET B 84 77.209 -8.334 4.899 1.00 0.00 S ATOM 2969 CE MET B 84 76.355 -6.749 4.715 1.00 0.00 C ATOM 0 H MET B 84 76.423 -7.353 0.802 1.00 0.00 H new ATOM 0 HA MET B 84 76.707 -10.213 1.032 1.00 0.00 H new ATOM 0 HB2 MET B 84 75.282 -8.120 2.718 1.00 0.00 H new ATOM 0 HB3 MET B 84 75.401 -9.807 3.176 1.00 0.00 H new ATOM 0 HG2 MET B 84 77.911 -9.663 3.012 1.00 0.00 H new ATOM 0 HG3 MET B 84 77.779 -7.969 2.583 1.00 0.00 H new ATOM 0 HE1 MET B 84 76.551 -6.126 5.588 1.00 0.00 H new ATOM 0 HE2 MET B 84 76.716 -6.243 3.820 1.00 0.00 H new ATOM 0 HE3 MET B 84 75.282 -6.922 4.626 1.00 0.00 H new ATOM 2979 N MET B 85 73.780 -8.986 0.248 1.00 0.00 N ATOM 2980 CA MET B 85 72.458 -9.396 -0.270 1.00 0.00 C ATOM 2981 C MET B 85 72.704 -10.281 -1.481 1.00 0.00 C ATOM 2982 O MET B 85 71.924 -11.160 -1.794 1.00 0.00 O ATOM 2983 CB MET B 85 71.651 -8.166 -0.685 1.00 0.00 C ATOM 2984 CG MET B 85 70.224 -8.589 -1.042 1.00 0.00 C ATOM 2985 SD MET B 85 69.327 -7.178 -1.739 1.00 0.00 S ATOM 2986 CE MET B 85 69.866 -7.383 -3.454 1.00 0.00 C ATOM 0 H MET B 85 73.952 -7.981 0.266 1.00 0.00 H new ATOM 0 HA MET B 85 71.894 -9.929 0.496 1.00 0.00 H new ATOM 0 HB2 MET B 85 71.634 -7.438 0.126 1.00 0.00 H new ATOM 0 HB3 MET B 85 72.122 -7.680 -1.539 1.00 0.00 H new ATOM 0 HG2 MET B 85 70.246 -9.409 -1.760 1.00 0.00 H new ATOM 0 HG3 MET B 85 69.710 -8.956 -0.154 1.00 0.00 H new ATOM 0 HE1 MET B 85 69.277 -6.733 -4.101 1.00 0.00 H new ATOM 0 HE2 MET B 85 70.920 -7.120 -3.538 1.00 0.00 H new ATOM 0 HE3 MET B 85 69.726 -8.420 -3.758 1.00 0.00 H new ATOM 2996 N CYS B 86 73.799 -10.065 -2.167 1.00 0.00 N ATOM 2997 CA CYS B 86 74.095 -10.908 -3.347 1.00 0.00 C ATOM 2998 C CYS B 86 75.540 -10.700 -3.788 1.00 0.00 C ATOM 2999 O CYS B 86 75.817 -10.028 -4.761 1.00 0.00 O ATOM 3000 CB CYS B 86 73.143 -10.552 -4.491 1.00 0.00 C ATOM 3001 SG CYS B 86 73.108 -8.755 -4.705 1.00 0.00 S ATOM 0 H CYS B 86 74.491 -9.345 -1.957 1.00 0.00 H new ATOM 0 HA CYS B 86 73.955 -11.955 -3.080 1.00 0.00 H new ATOM 0 HB2 CYS B 86 73.469 -11.033 -5.413 1.00 0.00 H new ATOM 0 HB3 CYS B 86 72.141 -10.923 -4.274 1.00 0.00 H new ATOM 0 HG CYS B 86 73.795 -8.192 -3.756 1.00 0.00 H new ATOM 3007 N ASN B 87 76.454 -11.282 -3.077 1.00 0.00 N ATOM 3008 CA ASN B 87 77.891 -11.138 -3.439 1.00 0.00 C ATOM 3009 C ASN B 87 78.112 -11.689 -4.851 1.00 0.00 C ATOM 3010 O ASN B 87 78.857 -11.127 -5.622 1.00 0.00 O ATOM 3011 CB ASN B 87 78.748 -11.925 -2.448 1.00 0.00 C ATOM 3012 CG ASN B 87 78.703 -11.245 -1.076 1.00 0.00 C ATOM 3013 OD1 ASN B 87 78.357 -11.866 -0.090 1.00 0.00 O ATOM 3014 ND2 ASN B 87 79.041 -9.989 -0.968 1.00 0.00 N ATOM 0 H ASN B 87 76.271 -11.856 -2.254 1.00 0.00 H new ATOM 0 HA ASN B 87 78.173 -10.086 -3.406 1.00 0.00 H new ATOM 0 HB2 ASN B 87 78.383 -12.949 -2.370 1.00 0.00 H new ATOM 0 HB3 ASN B 87 79.777 -11.979 -2.804 1.00 0.00 H new ATOM 0 HD21 ASN B 87 79.015 -9.530 -0.057 1.00 0.00 H new ATOM 0 HD22 ASN B 87 79.332 -9.466 -1.794 1.00 0.00 H new ATOM 3021 N GLU B 88 77.466 -12.790 -5.174 1.00 0.00 N ATOM 3022 CA GLU B 88 77.601 -13.430 -6.528 1.00 0.00 C ATOM 3023 C GLU B 88 78.809 -14.370 -6.536 1.00 0.00 C ATOM 3024 O GLU B 88 79.012 -15.131 -7.461 1.00 0.00 O ATOM 3025 CB GLU B 88 77.774 -12.369 -7.629 1.00 0.00 C ATOM 3026 CG GLU B 88 77.434 -12.986 -8.985 1.00 0.00 C ATOM 3027 CD GLU B 88 77.604 -11.935 -10.085 1.00 0.00 C ATOM 3028 OE1 GLU B 88 77.782 -10.776 -9.749 1.00 0.00 O ATOM 3029 OE2 GLU B 88 77.553 -12.309 -11.245 1.00 0.00 O ATOM 0 H GLU B 88 76.836 -13.283 -4.541 1.00 0.00 H new ATOM 0 HA GLU B 88 76.689 -13.993 -6.730 1.00 0.00 H new ATOM 0 HB2 GLU B 88 77.125 -11.516 -7.432 1.00 0.00 H new ATOM 0 HB3 GLU B 88 78.798 -11.996 -7.633 1.00 0.00 H new ATOM 0 HG2 GLU B 88 78.083 -13.840 -9.180 1.00 0.00 H new ATOM 0 HG3 GLU B 88 76.410 -13.359 -8.980 1.00 0.00 H new ATOM 3036 N PHE B 89 79.612 -14.324 -5.511 1.00 0.00 N ATOM 3037 CA PHE B 89 80.815 -15.211 -5.447 1.00 0.00 C ATOM 3038 C PHE B 89 80.464 -16.522 -4.729 1.00 0.00 C ATOM 3039 O PHE B 89 79.313 -16.835 -4.502 1.00 0.00 O ATOM 3040 CB PHE B 89 81.942 -14.478 -4.697 1.00 0.00 C ATOM 3041 CG PHE B 89 82.708 -13.599 -5.662 1.00 0.00 C ATOM 3042 CD1 PHE B 89 82.182 -12.365 -6.060 1.00 0.00 C ATOM 3043 CD2 PHE B 89 83.945 -14.025 -6.164 1.00 0.00 C ATOM 3044 CE1 PHE B 89 82.892 -11.557 -6.956 1.00 0.00 C ATOM 3045 CE2 PHE B 89 84.654 -13.217 -7.059 1.00 0.00 C ATOM 3046 CZ PHE B 89 84.128 -11.984 -7.456 1.00 0.00 C ATOM 0 H PHE B 89 79.489 -13.707 -4.708 1.00 0.00 H new ATOM 0 HA PHE B 89 81.148 -15.449 -6.457 1.00 0.00 H new ATOM 0 HB2 PHE B 89 81.523 -13.873 -3.893 1.00 0.00 H new ATOM 0 HB3 PHE B 89 82.615 -15.201 -4.235 1.00 0.00 H new ATOM 0 HD1 PHE B 89 81.228 -12.036 -5.676 1.00 0.00 H new ATOM 0 HD2 PHE B 89 84.351 -14.978 -5.860 1.00 0.00 H new ATOM 0 HE1 PHE B 89 82.486 -10.604 -7.262 1.00 0.00 H new ATOM 0 HE2 PHE B 89 85.608 -13.546 -7.444 1.00 0.00 H new ATOM 0 HZ PHE B 89 84.675 -11.361 -8.148 1.00 0.00 H new ATOM 3056 N PHE B 90 81.463 -17.294 -4.388 1.00 0.00 N ATOM 3057 CA PHE B 90 81.223 -18.598 -3.702 1.00 0.00 C ATOM 3058 C PHE B 90 81.059 -18.364 -2.200 1.00 0.00 C ATOM 3059 O PHE B 90 81.003 -19.290 -1.417 1.00 0.00 O ATOM 3060 CB PHE B 90 82.425 -19.508 -3.944 1.00 0.00 C ATOM 3061 CG PHE B 90 82.811 -19.422 -5.398 1.00 0.00 C ATOM 3062 CD1 PHE B 90 82.135 -20.190 -6.349 1.00 0.00 C ATOM 3063 CD2 PHE B 90 83.837 -18.558 -5.795 1.00 0.00 C ATOM 3064 CE1 PHE B 90 82.486 -20.097 -7.699 1.00 0.00 C ATOM 3065 CE2 PHE B 90 84.187 -18.462 -7.143 1.00 0.00 C ATOM 3066 CZ PHE B 90 83.512 -19.232 -8.098 1.00 0.00 C ATOM 0 H PHE B 90 82.444 -17.074 -4.557 1.00 0.00 H new ATOM 0 HA PHE B 90 80.318 -19.062 -4.094 1.00 0.00 H new ATOM 0 HB2 PHE B 90 83.261 -19.206 -3.313 1.00 0.00 H new ATOM 0 HB3 PHE B 90 82.180 -20.536 -3.678 1.00 0.00 H new ATOM 0 HD1 PHE B 90 81.342 -20.855 -6.042 1.00 0.00 H new ATOM 0 HD2 PHE B 90 84.359 -17.965 -5.058 1.00 0.00 H new ATOM 0 HE1 PHE B 90 81.966 -20.693 -8.434 1.00 0.00 H new ATOM 0 HE2 PHE B 90 84.978 -17.794 -7.449 1.00 0.00 H new ATOM 0 HZ PHE B 90 83.782 -19.159 -9.141 1.00 0.00 H new ATOM 3076 N GLU B 91 80.985 -17.129 -1.798 1.00 0.00 N ATOM 3077 CA GLU B 91 80.830 -16.819 -0.346 1.00 0.00 C ATOM 3078 C GLU B 91 79.703 -17.677 0.237 1.00 0.00 C ATOM 3079 O GLU B 91 78.697 -17.915 -0.400 1.00 0.00 O ATOM 3080 CB GLU B 91 80.478 -15.336 -0.183 1.00 0.00 C ATOM 3081 CG GLU B 91 80.431 -14.964 1.304 1.00 0.00 C ATOM 3082 CD GLU B 91 81.837 -15.054 1.898 1.00 0.00 C ATOM 3083 OE1 GLU B 91 82.781 -15.127 1.128 1.00 0.00 O ATOM 3084 OE2 GLU B 91 81.947 -15.045 3.113 1.00 0.00 O ATOM 0 H GLU B 91 81.025 -16.315 -2.412 1.00 0.00 H new ATOM 0 HA GLU B 91 81.761 -17.035 0.179 1.00 0.00 H new ATOM 0 HB2 GLU B 91 81.217 -14.721 -0.696 1.00 0.00 H new ATOM 0 HB3 GLU B 91 79.514 -15.130 -0.648 1.00 0.00 H new ATOM 0 HG2 GLU B 91 80.038 -13.955 1.425 1.00 0.00 H new ATOM 0 HG3 GLU B 91 79.756 -15.635 1.836 1.00 0.00 H new ATOM 3091 N GLY B 92 79.874 -18.153 1.443 1.00 0.00 N ATOM 3092 CA GLY B 92 78.825 -19.005 2.071 1.00 0.00 C ATOM 3093 C GLY B 92 77.580 -18.168 2.363 1.00 0.00 C ATOM 3094 O GLY B 92 77.115 -17.416 1.528 1.00 0.00 O ATOM 0 H GLY B 92 80.698 -17.987 2.020 1.00 0.00 H new ATOM 0 HA2 GLY B 92 78.571 -19.832 1.408 1.00 0.00 H new ATOM 0 HA3 GLY B 92 79.204 -19.442 2.994 1.00 0.00 H new ATOM 3098 N PHE B 93 77.031 -18.292 3.543 1.00 0.00 N ATOM 3099 CA PHE B 93 75.814 -17.503 3.881 1.00 0.00 C ATOM 3100 C PHE B 93 76.219 -16.030 4.098 1.00 0.00 C ATOM 3101 O PHE B 93 77.234 -15.768 4.713 1.00 0.00 O ATOM 3102 CB PHE B 93 75.196 -18.048 5.176 1.00 0.00 C ATOM 3103 CG PHE B 93 74.666 -19.444 4.946 1.00 0.00 C ATOM 3104 CD1 PHE B 93 75.524 -20.546 5.053 1.00 0.00 C ATOM 3105 CD2 PHE B 93 73.316 -19.638 4.625 1.00 0.00 C ATOM 3106 CE1 PHE B 93 75.032 -21.840 4.838 1.00 0.00 C ATOM 3107 CE2 PHE B 93 72.826 -20.933 4.411 1.00 0.00 C ATOM 3108 CZ PHE B 93 73.684 -22.032 4.517 1.00 0.00 C ATOM 0 H PHE B 93 77.373 -18.904 4.284 1.00 0.00 H new ATOM 0 HA PHE B 93 75.089 -17.578 3.070 1.00 0.00 H new ATOM 0 HB2 PHE B 93 75.944 -18.060 5.969 1.00 0.00 H new ATOM 0 HB3 PHE B 93 74.390 -17.394 5.508 1.00 0.00 H new ATOM 0 HD1 PHE B 93 76.565 -20.398 5.301 1.00 0.00 H new ATOM 0 HD2 PHE B 93 72.653 -18.789 4.543 1.00 0.00 H new ATOM 0 HE1 PHE B 93 75.694 -22.690 4.920 1.00 0.00 H new ATOM 0 HE2 PHE B 93 71.785 -21.082 4.164 1.00 0.00 H new ATOM 0 HZ PHE B 93 73.306 -23.030 4.351 1.00 0.00 H new ATOM 3118 N PRO B 94 75.456 -15.064 3.617 1.00 0.00 N ATOM 3119 CA PRO B 94 75.828 -13.632 3.823 1.00 0.00 C ATOM 3120 C PRO B 94 75.595 -13.179 5.272 1.00 0.00 C ATOM 3121 O PRO B 94 74.487 -13.220 5.771 1.00 0.00 O ATOM 3122 CB PRO B 94 74.866 -12.916 2.862 1.00 0.00 C ATOM 3123 CG PRO B 94 73.693 -13.870 2.595 1.00 0.00 C ATOM 3124 CD PRO B 94 74.197 -15.299 2.845 1.00 0.00 C ATOM 0 HA PRO B 94 76.883 -13.429 3.638 1.00 0.00 H new ATOM 0 HB2 PRO B 94 74.510 -11.983 3.299 1.00 0.00 H new ATOM 0 HB3 PRO B 94 75.372 -12.660 1.931 1.00 0.00 H new ATOM 0 HG2 PRO B 94 72.853 -13.639 3.251 1.00 0.00 H new ATOM 0 HG3 PRO B 94 73.336 -13.763 1.571 1.00 0.00 H new ATOM 0 HD2 PRO B 94 73.478 -15.890 3.411 1.00 0.00 H new ATOM 0 HD3 PRO B 94 74.385 -15.832 1.913 1.00 0.00 H new ATOM 3132 N ASP B 95 76.623 -12.739 5.948 1.00 0.00 N ATOM 3133 CA ASP B 95 76.443 -12.278 7.357 1.00 0.00 C ATOM 3134 C ASP B 95 76.004 -10.813 7.355 1.00 0.00 C ATOM 3135 O ASP B 95 76.789 -9.919 7.096 1.00 0.00 O ATOM 3136 CB ASP B 95 77.767 -12.407 8.113 1.00 0.00 C ATOM 3137 CG ASP B 95 77.544 -12.075 9.589 1.00 0.00 C ATOM 3138 OD1 ASP B 95 77.304 -10.915 9.886 1.00 0.00 O ATOM 3139 OD2 ASP B 95 77.614 -12.985 10.400 1.00 0.00 O ATOM 0 H ASP B 95 77.576 -12.679 5.588 1.00 0.00 H new ATOM 0 HA ASP B 95 75.685 -12.891 7.846 1.00 0.00 H new ATOM 0 HB2 ASP B 95 78.159 -13.419 8.012 1.00 0.00 H new ATOM 0 HB3 ASP B 95 78.510 -11.733 7.686 1.00 0.00 H new ATOM 3144 N LYS B 96 74.755 -10.557 7.638 1.00 0.00 N ATOM 3145 CA LYS B 96 74.254 -9.150 7.652 1.00 0.00 C ATOM 3146 C LYS B 96 74.421 -8.561 9.058 1.00 0.00 C ATOM 3147 O LYS B 96 75.356 -7.833 9.327 1.00 0.00 O ATOM 3148 CB LYS B 96 72.778 -9.142 7.245 1.00 0.00 C ATOM 3149 CG LYS B 96 72.289 -7.702 7.082 1.00 0.00 C ATOM 3150 CD LYS B 96 70.816 -7.710 6.667 1.00 0.00 C ATOM 3151 CE LYS B 96 70.329 -6.274 6.468 1.00 0.00 C ATOM 3152 NZ LYS B 96 71.027 -5.671 5.296 1.00 0.00 N ATOM 0 H LYS B 96 74.056 -11.265 7.861 1.00 0.00 H new ATOM 0 HA LYS B 96 74.824 -8.544 6.948 1.00 0.00 H new ATOM 0 HB2 LYS B 96 72.647 -9.687 6.310 1.00 0.00 H new ATOM 0 HB3 LYS B 96 72.181 -9.654 8.000 1.00 0.00 H new ATOM 0 HG2 LYS B 96 72.412 -7.156 8.018 1.00 0.00 H new ATOM 0 HG3 LYS B 96 72.887 -7.186 6.331 1.00 0.00 H new ATOM 0 HD2 LYS B 96 70.691 -8.278 5.745 1.00 0.00 H new ATOM 0 HD3 LYS B 96 70.216 -8.205 7.430 1.00 0.00 H new ATOM 0 HE2 LYS B 96 69.251 -6.263 6.308 1.00 0.00 H new ATOM 0 HE3 LYS B 96 70.524 -5.685 7.364 1.00 0.00 H new ATOM 0 HZ1 LYS B 96 70.491 -4.845 4.960 1.00 0.00 H new ATOM 0 HZ2 LYS B 96 71.983 -5.373 5.577 1.00 0.00 H new ATOM 0 HZ3 LYS B 96 71.094 -6.374 4.533 1.00 0.00 H new ATOM 3166 N GLN B 97 73.527 -8.874 9.961 1.00 0.00 N ATOM 3167 CA GLN B 97 73.649 -8.333 11.349 1.00 0.00 C ATOM 3168 C GLN B 97 74.663 -9.188 12.132 1.00 0.00 C ATOM 3169 O GLN B 97 74.799 -10.366 11.866 1.00 0.00 O ATOM 3170 CB GLN B 97 72.281 -8.393 12.047 1.00 0.00 C ATOM 3171 CG GLN B 97 71.648 -9.783 11.868 1.00 0.00 C ATOM 3172 CD GLN B 97 70.930 -9.864 10.515 1.00 0.00 C ATOM 3173 OE1 GLN B 97 71.031 -10.856 9.822 1.00 0.00 O ATOM 3174 NE2 GLN B 97 70.206 -8.856 10.109 1.00 0.00 N ATOM 0 H GLN B 97 72.721 -9.478 9.799 1.00 0.00 H new ATOM 0 HA GLN B 97 73.988 -7.298 11.312 1.00 0.00 H new ATOM 0 HB2 GLN B 97 72.397 -8.173 13.108 1.00 0.00 H new ATOM 0 HB3 GLN B 97 71.621 -7.630 11.634 1.00 0.00 H new ATOM 0 HG2 GLN B 97 72.418 -10.552 11.927 1.00 0.00 H new ATOM 0 HG3 GLN B 97 70.942 -9.977 12.676 1.00 0.00 H new ATOM 0 HE21 GLN B 97 70.121 -8.022 10.691 1.00 0.00 H new ATOM 0 HE22 GLN B 97 69.726 -8.902 9.210 1.00 0.00 H new ATOM 3183 N PRO B 98 75.374 -8.625 13.091 1.00 0.00 N ATOM 3184 CA PRO B 98 76.361 -9.426 13.870 1.00 0.00 C ATOM 3185 C PRO B 98 75.698 -10.606 14.592 1.00 0.00 C ATOM 3186 O PRO B 98 74.858 -10.428 15.452 1.00 0.00 O ATOM 3187 CB PRO B 98 76.929 -8.393 14.868 1.00 0.00 C ATOM 3188 CG PRO B 98 76.094 -7.103 14.753 1.00 0.00 C ATOM 3189 CD PRO B 98 75.255 -7.185 13.467 1.00 0.00 C ATOM 0 HA PRO B 98 77.126 -9.886 13.244 1.00 0.00 H new ATOM 0 HB2 PRO B 98 76.887 -8.784 15.885 1.00 0.00 H new ATOM 0 HB3 PRO B 98 77.977 -8.188 14.648 1.00 0.00 H new ATOM 0 HG2 PRO B 98 75.446 -6.991 15.623 1.00 0.00 H new ATOM 0 HG3 PRO B 98 76.746 -6.230 14.726 1.00 0.00 H new ATOM 0 HD2 PRO B 98 74.218 -6.896 13.640 1.00 0.00 H new ATOM 0 HD3 PRO B 98 75.643 -6.529 12.688 1.00 0.00 H new ATOM 3197 N ARG B 99 76.071 -11.804 14.248 1.00 0.00 N ATOM 3198 CA ARG B 99 75.463 -12.988 14.910 1.00 0.00 C ATOM 3199 C ARG B 99 76.036 -13.128 16.322 1.00 0.00 C ATOM 3200 O ARG B 99 77.219 -12.962 16.541 1.00 0.00 O ATOM 3201 CB ARG B 99 75.789 -14.243 14.099 1.00 0.00 C ATOM 3202 CG ARG B 99 75.022 -14.198 12.776 1.00 0.00 C ATOM 3203 CD ARG B 99 75.339 -15.447 11.955 1.00 0.00 C ATOM 3204 NE ARG B 99 74.900 -16.659 12.702 1.00 0.00 N ATOM 3205 CZ ARG B 99 74.757 -17.793 12.073 1.00 0.00 C ATOM 3206 NH1 ARG B 99 74.976 -17.857 10.788 1.00 0.00 N ATOM 3207 NH2 ARG B 99 74.386 -18.859 12.726 1.00 0.00 N ATOM 0 H ARG B 99 76.771 -12.015 13.537 1.00 0.00 H new ATOM 0 HA ARG B 99 74.382 -12.863 14.967 1.00 0.00 H new ATOM 0 HB2 ARG B 99 76.861 -14.301 13.910 1.00 0.00 H new ATOM 0 HB3 ARG B 99 75.516 -15.136 14.662 1.00 0.00 H new ATOM 0 HG2 ARG B 99 73.951 -14.139 12.967 1.00 0.00 H new ATOM 0 HG3 ARG B 99 75.296 -13.304 12.216 1.00 0.00 H new ATOM 0 HD2 ARG B 99 74.834 -15.399 10.990 1.00 0.00 H new ATOM 0 HD3 ARG B 99 76.409 -15.500 11.752 1.00 0.00 H new ATOM 0 HE ARG B 99 74.712 -16.602 13.703 1.00 0.00 H new ATOM 0 HH11 ARG B 99 75.259 -17.021 10.277 1.00 0.00 H new ATOM 0 HH12 ARG B 99 74.865 -18.743 10.295 1.00 0.00 H new ATOM 0 HH21 ARG B 99 74.207 -18.806 13.729 1.00 0.00 H new ATOM 0 HH22 ARG B 99 74.274 -19.745 12.234 1.00 0.00 H new ATOM 3221 N LYS B 100 75.208 -13.436 17.283 1.00 0.00 N ATOM 3222 CA LYS B 100 75.712 -13.592 18.676 1.00 0.00 C ATOM 3223 C LYS B 100 76.565 -14.856 18.776 1.00 0.00 C ATOM 3224 O LYS B 100 76.305 -15.847 18.123 1.00 0.00 O ATOM 3225 CB LYS B 100 74.526 -13.695 19.637 1.00 0.00 C ATOM 3226 CG LYS B 100 73.721 -12.395 19.590 1.00 0.00 C ATOM 3227 CD LYS B 100 72.535 -12.493 20.550 1.00 0.00 C ATOM 3228 CE LYS B 100 71.735 -11.192 20.499 1.00 0.00 C ATOM 3229 NZ LYS B 100 72.535 -10.096 21.120 1.00 0.00 N ATOM 0 H LYS B 100 74.206 -13.586 17.164 1.00 0.00 H new ATOM 0 HA LYS B 100 76.320 -12.727 18.941 1.00 0.00 H new ATOM 0 HB2 LYS B 100 73.893 -14.538 19.362 1.00 0.00 H new ATOM 0 HB3 LYS B 100 74.880 -13.880 20.651 1.00 0.00 H new ATOM 0 HG2 LYS B 100 74.355 -11.552 19.864 1.00 0.00 H new ATOM 0 HG3 LYS B 100 73.367 -12.211 18.576 1.00 0.00 H new ATOM 0 HD2 LYS B 100 71.899 -13.335 20.276 1.00 0.00 H new ATOM 0 HD3 LYS B 100 72.888 -12.677 21.565 1.00 0.00 H new ATOM 0 HE2 LYS B 100 71.493 -10.941 19.466 1.00 0.00 H new ATOM 0 HE3 LYS B 100 70.789 -11.312 21.028 1.00 0.00 H new ATOM 0 HZ1 LYS B 100 71.907 -9.304 21.366 1.00 0.00 H new ATOM 0 HZ2 LYS B 100 72.999 -10.450 21.981 1.00 0.00 H new ATOM 0 HZ3 LYS B 100 73.257 -9.769 20.447 1.00 0.00 H new ATOM 3243 N LYS B 101 77.583 -14.830 19.597 1.00 0.00 N ATOM 3244 CA LYS B 101 78.465 -16.029 19.753 1.00 0.00 C ATOM 3245 C LYS B 101 78.034 -16.817 20.993 1.00 0.00 C ATOM 3246 O LYS B 101 77.008 -17.475 20.927 1.00 0.00 O ATOM 3247 CB LYS B 101 79.915 -15.568 19.920 1.00 0.00 C ATOM 3248 CG LYS B 101 80.399 -14.927 18.617 1.00 0.00 C ATOM 3249 CD LYS B 101 81.848 -14.465 18.779 1.00 0.00 C ATOM 3250 CE LYS B 101 82.333 -13.825 17.478 1.00 0.00 C ATOM 3251 NZ LYS B 101 83.820 -13.718 17.501 1.00 0.00 N ATOM 3252 OXT LYS B 101 78.738 -16.751 21.987 1.00 0.00 O ATOM 0 H LYS B 101 77.844 -14.027 20.169 1.00 0.00 H new ATOM 0 HA LYS B 101 78.382 -16.665 18.872 1.00 0.00 H new ATOM 0 HB2 LYS B 101 79.988 -14.853 20.739 1.00 0.00 H new ATOM 0 HB3 LYS B 101 80.550 -16.415 20.179 1.00 0.00 H new ATOM 0 HG2 LYS B 101 80.324 -15.643 17.798 1.00 0.00 H new ATOM 0 HG3 LYS B 101 79.763 -14.080 18.359 1.00 0.00 H new ATOM 0 HD2 LYS B 101 81.922 -13.749 19.598 1.00 0.00 H new ATOM 0 HD3 LYS B 101 82.483 -15.312 19.038 1.00 0.00 H new ATOM 0 HE2 LYS B 101 82.014 -14.424 16.625 1.00 0.00 H new ATOM 0 HE3 LYS B 101 81.888 -12.837 17.358 1.00 0.00 H new ATOM 0 HZ1 LYS B 101 84.150 -13.283 16.616 1.00 0.00 H new ATOM 0 HZ2 LYS B 101 84.113 -13.130 18.307 1.00 0.00 H new ATOM 0 HZ3 LYS B 101 84.235 -14.667 17.596 1.00 0.00 H new TER 3266 LYS B 101