USER MOD reduce.3.24.130724 H: found=0, std=0, add=1822, rem=0, adj=65 USER MOD reduce.3.24.130724 removed 1828 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 81 CYS SG : rot 79:sc= -0.0165 USER MOD Set 1.2: B 110 THR OG1 : rot 63:sc= 0.949 USER MOD Set 2.1: B 47 THR OG1 : rot 180:sc= -0.212 USER MOD Set 2.2: B 49 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: B 28 LYS NZ :NH3+ -113:sc= 1.64 (180deg=0.0466) USER MOD Set 3.2: B 29 ASN : amide:sc= 1.12 K(o=2.8,f=-7.9) USER MOD Set 4.1: B 23 MET CE :methyl 139:sc= -0.502 (180deg=-2.85!) USER MOD Set 4.2: B 61 HIS : no HD1:sc= -0.221 K(o=-0.72,f=-2.2) USER MOD Set 5.1: A 81 CYS SG : rot 80:sc= -0.0679 USER MOD Set 5.2: A 110 THR OG1 : rot 64:sc= 1.02 USER MOD Set 6.1: A 47 THR OG1 : rot 180:sc= -0.214 USER MOD Set 6.2: A 49 THR OG1 : rot 180:sc= 0 USER MOD Set 7.1: A 28 LYS NZ :NH3+ -121:sc= 1.76 (180deg=0.0779) USER MOD Set 7.2: A 29 ASN : amide:sc= 0.991 K(o=2.8,f=-7.1) USER MOD Set 8.1: A 23 MET CE :methyl 141:sc= -0.443 (180deg=-2.84!) USER MOD Set 8.2: A 61 HIS : no HD1:sc= -0.213 K(o=-0.66,f=-2.1) USER MOD Single : A 2 SER OG : rot 31:sc= 0.089 USER MOD Single : A 5 LYS NZ :NH3+ -161:sc= 1.03 (180deg=0.687) USER MOD Single : A 8 SER OG : rot 70:sc= 0.0235 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ -133:sc= 0.8 (180deg=0.218) USER MOD Single : A 18 LYS NZ :NH3+ -155:sc= 0.885 (180deg=0.453) USER MOD Single : A 22 CYS SG : rot 70:sc= 1.27 USER MOD Single : A 24 SER OG : rot 29:sc= -0.731 USER MOD Single : A 26 THR OG1 : rot 175:sc= 0.692 USER MOD Single : A 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 SER OG : rot 180:sc= -0.01 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 45 ASN : amide:sc= -0.127 K(o=-0.13,f=-2.3!) USER MOD Single : A 48 SER OG : rot -133:sc= 0.549 USER MOD Single : A 53 LYS NZ :NH3+ -175:sc=-0.00511 (180deg=-0.0515) USER MOD Single : A 57 TYR OH : rot 180:sc= -0.244 USER MOD Single : A 58 CYS SG : rot 69:sc= -0.0669 USER MOD Single : A 60 HIS : no HD1:sc= -0.107 K(o=-0.11,f=-0.73) USER MOD Single : A 62 HIS : +bothHN:sc= 0.448 K(o=0.45,f=-5.4!) USER MOD Single : A 63 GLN : amide:sc= -0.0197 X(o=-0.02,f=-0.02) USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 51:sc= 0.0489 USER MOD Single : A 76 TYR OH : rot -142:sc= 0.472 USER MOD Single : A 82 LYS NZ :NH3+ -151:sc= 0.188 (180deg=-0.277) USER MOD Single : A 85 GLN :FLIP amide:sc= -0.192 F(o=-1,f=-0.19) USER MOD Single : A 87 THR OG1 : rot -160:sc= -0.173 USER MOD Single : A 96 ASN : amide:sc= -0.311 K(o=-0.31,f=-1.3) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ -155:sc= 1.01 (180deg=0.603) USER MOD Single : A 107 THR OG1 : rot -160:sc= -0.147 USER MOD Single : A 108 CYS SG : rot 94:sc= -0.86 USER MOD Single : A 109 LYS NZ :NH3+ -145:sc= 0.228 (180deg=-0.471) USER MOD Single : A 113 ASN : amide:sc= -0.179 X(o=-0.18,f=-0.58) USER MOD Single : A 114 MET CE :methyl -137:sc= -0.376 (180deg=-2.99!) USER MOD Single : B 2 SER OG : rot 30:sc= 0.098 USER MOD Single : B 5 LYS NZ :NH3+ -159:sc= 1.11 (180deg=0.687) USER MOD Single : B 8 SER OG : rot 80:sc= 0.0263 USER MOD Single : B 9 SER OG : rot 180:sc=-0.00066 USER MOD Single : B 12 LYS NZ :NH3+ -144:sc= 0.818 (180deg=0.392) USER MOD Single : B 18 LYS NZ :NH3+ -154:sc= 0.814 (180deg=0.422) USER MOD Single : B 22 CYS SG : rot 64:sc= 1.25 USER MOD Single : B 24 SER OG : rot 28:sc= -0.763 USER MOD Single : B 26 THR OG1 : rot 175:sc= 0.716 USER MOD Single : B 30 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 37 SER OG : rot 180:sc= 0 USER MOD Single : B 39 SER OG : rot 180:sc= 0 USER MOD Single : B 45 ASN : amide:sc= -0.156 K(o=-0.16,f=-2.6!) USER MOD Single : B 48 SER OG : rot -136:sc= 0.527 USER MOD Single : B 53 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0371) USER MOD Single : B 57 TYR OH : rot 180:sc= -0.411 USER MOD Single : B 58 CYS SG : rot 72:sc= -0.0214 USER MOD Single : B 60 HIS : no HD1:sc= -0.155 K(o=-0.16,f=-0.81) USER MOD Single : B 62 HIS : +bothHN:sc= 0.255 K(o=0.26,f=-4.8!) USER MOD Single : B 63 GLN : amide:sc= -0.0297 X(o=-0.03,f=-0.03) USER MOD Single : B 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 68 SER OG : rot 52:sc= 0.105 USER MOD Single : B 76 TYR OH : rot -138:sc= 0.356 USER MOD Single : B 82 LYS NZ :NH3+ -163:sc= 0.383 (180deg=0.129) USER MOD Single : B 85 GLN : amide:sc= -0.331 X(o=-0.33,f=-0.4) USER MOD Single : B 87 THR OG1 : rot -166:sc= -0.378 USER MOD Single : B 96 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : B 97 TYR OH : rot 180:sc= 0 USER MOD Single : B 101 LYS NZ :NH3+ -166:sc= 0.392 (180deg=-0.00262) USER MOD Single : B 107 THR OG1 : rot -160:sc= -0.151 USER MOD Single : B 108 CYS SG : rot 93:sc= -1 USER MOD Single : B 109 LYS NZ :NH3+ -147:sc= 0.363 (180deg=-0.299) USER MOD Single : B 113 ASN : amide:sc= -0.137 X(o=-0.14,f=-0.49) USER MOD Single : B 114 MET CE :methyl -136:sc= -0.61 (180deg=-3.51!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -18.560 -13.714 -18.058 1.00 74.11 N ATOM 2 CA SER A 2 -19.575 -13.116 -17.174 1.00 45.24 C ATOM 3 C SER A 2 -18.982 -11.922 -16.415 1.00 13.44 C ATOM 4 O SER A 2 -17.797 -11.927 -16.050 1.00 52.11 O ATOM 5 CB SER A 2 -20.129 -14.171 -16.195 1.00 20.41 C ATOM 6 OG SER A 2 -20.650 -15.294 -16.896 1.00 54.31 O ATOM 0 HA SER A 2 -20.402 -12.756 -17.785 1.00 45.24 H new ATOM 0 HB2 SER A 2 -19.338 -14.495 -15.519 1.00 20.41 H new ATOM 0 HB3 SER A 2 -20.912 -13.726 -15.580 1.00 20.41 H new ATOM 0 HG SER A 2 -20.146 -15.424 -17.726 1.00 54.31 H new ATOM 14 N LEU A 3 -19.817 -10.897 -16.211 1.00 62.43 N ATOM 15 CA LEU A 3 -19.457 -9.694 -15.467 1.00 22.21 C ATOM 16 C LEU A 3 -19.760 -9.898 -13.967 1.00 1.20 C ATOM 17 O LEU A 3 -20.913 -10.161 -13.595 1.00 74.04 O ATOM 18 CB LEU A 3 -20.255 -8.485 -16.014 1.00 63.11 C ATOM 19 CG LEU A 3 -20.080 -8.156 -17.527 1.00 3.14 C ATOM 20 CD1 LEU A 3 -21.004 -6.991 -17.938 1.00 65.11 C ATOM 21 CD2 LEU A 3 -18.608 -7.850 -17.876 1.00 1.05 C ATOM 0 H LEU A 3 -20.774 -10.884 -16.565 1.00 62.43 H new ATOM 0 HA LEU A 3 -18.391 -9.499 -15.588 1.00 22.21 H new ATOM 0 HB2 LEU A 3 -21.314 -8.663 -15.825 1.00 63.11 H new ATOM 0 HB3 LEU A 3 -19.972 -7.603 -15.439 1.00 63.11 H new ATOM 0 HG LEU A 3 -20.369 -9.039 -18.096 1.00 3.14 H new ATOM 0 HD11 LEU A 3 -20.868 -6.775 -18.998 1.00 65.11 H new ATOM 0 HD12 LEU A 3 -22.042 -7.268 -17.754 1.00 65.11 H new ATOM 0 HD13 LEU A 3 -20.756 -6.106 -17.353 1.00 65.11 H new ATOM 0 HD21 LEU A 3 -18.525 -7.625 -18.939 1.00 1.05 H new ATOM 0 HD22 LEU A 3 -18.267 -6.992 -17.296 1.00 1.05 H new ATOM 0 HD23 LEU A 3 -17.990 -8.716 -17.639 1.00 1.05 H new ATOM 33 N VAL A 4 -18.719 -9.810 -13.122 1.00 55.24 N ATOM 34 CA VAL A 4 -18.880 -9.835 -11.652 1.00 75.14 C ATOM 35 C VAL A 4 -19.335 -8.451 -11.152 1.00 14.34 C ATOM 36 O VAL A 4 -18.723 -7.421 -11.463 1.00 3.03 O ATOM 37 CB VAL A 4 -17.576 -10.312 -10.893 1.00 10.12 C ATOM 38 CG1 VAL A 4 -17.423 -11.848 -10.967 1.00 70.43 C ATOM 39 CG2 VAL A 4 -16.313 -9.610 -11.444 1.00 4.52 C ATOM 0 H VAL A 4 -17.751 -9.720 -13.431 1.00 55.24 H new ATOM 0 HA VAL A 4 -19.648 -10.574 -11.424 1.00 75.14 H new ATOM 0 HB VAL A 4 -17.685 -10.029 -9.846 1.00 10.12 H new ATOM 0 HG11 VAL A 4 -16.519 -12.150 -10.438 1.00 70.43 H new ATOM 0 HG12 VAL A 4 -18.289 -12.323 -10.506 1.00 70.43 H new ATOM 0 HG13 VAL A 4 -17.353 -12.157 -12.010 1.00 70.43 H new ATOM 0 HG21 VAL A 4 -15.436 -9.961 -10.901 1.00 4.52 H new ATOM 0 HG22 VAL A 4 -16.201 -9.842 -12.503 1.00 4.52 H new ATOM 0 HG23 VAL A 4 -16.411 -8.532 -11.317 1.00 4.52 H new ATOM 49 N LYS A 5 -20.431 -8.459 -10.385 1.00 42.13 N ATOM 50 CA LYS A 5 -21.116 -7.253 -9.910 1.00 75.34 C ATOM 51 C LYS A 5 -20.385 -6.658 -8.688 1.00 64.24 C ATOM 52 O LYS A 5 -20.623 -7.068 -7.553 1.00 35.31 O ATOM 53 CB LYS A 5 -22.589 -7.619 -9.567 1.00 32.41 C ATOM 54 CG LYS A 5 -23.418 -8.152 -10.759 1.00 63.12 C ATOM 55 CD LYS A 5 -24.826 -8.636 -10.334 1.00 2.54 C ATOM 56 CE LYS A 5 -25.675 -9.123 -11.523 1.00 73.01 C ATOM 57 NZ LYS A 5 -26.074 -8.020 -12.432 1.00 13.23 N ATOM 0 H LYS A 5 -20.875 -9.322 -10.071 1.00 42.13 H new ATOM 0 HA LYS A 5 -21.110 -6.491 -10.690 1.00 75.34 H new ATOM 0 HB2 LYS A 5 -22.588 -8.371 -8.778 1.00 32.41 H new ATOM 0 HB3 LYS A 5 -23.084 -6.735 -9.164 1.00 32.41 H new ATOM 0 HG2 LYS A 5 -23.518 -7.366 -11.508 1.00 63.12 H new ATOM 0 HG3 LYS A 5 -22.882 -8.975 -11.231 1.00 63.12 H new ATOM 0 HD2 LYS A 5 -24.724 -9.445 -9.611 1.00 2.54 H new ATOM 0 HD3 LYS A 5 -25.348 -7.822 -9.830 1.00 2.54 H new ATOM 0 HE2 LYS A 5 -25.111 -9.866 -12.086 1.00 73.01 H new ATOM 0 HE3 LYS A 5 -26.569 -9.619 -11.146 1.00 73.01 H new ATOM 0 HZ1 LYS A 5 -26.883 -8.323 -13.012 1.00 13.23 H new ATOM 0 HZ2 LYS A 5 -26.343 -7.187 -11.870 1.00 13.23 H new ATOM 0 HZ3 LYS A 5 -25.276 -7.775 -13.052 1.00 13.23 H new ATOM 71 N LEU A 6 -19.452 -5.728 -8.940 1.00 70.30 N ATOM 72 CA LEU A 6 -18.698 -5.032 -7.876 1.00 23.31 C ATOM 73 C LEU A 6 -19.446 -3.768 -7.456 1.00 31.02 C ATOM 74 O LEU A 6 -19.273 -2.700 -8.054 1.00 62.43 O ATOM 75 CB LEU A 6 -17.245 -4.697 -8.340 1.00 62.42 C ATOM 76 CG LEU A 6 -16.177 -5.811 -8.109 1.00 75.04 C ATOM 77 CD1 LEU A 6 -16.546 -7.141 -8.788 1.00 24.35 C ATOM 78 CD2 LEU A 6 -14.790 -5.330 -8.556 1.00 52.52 C ATOM 0 H LEU A 6 -19.196 -5.435 -9.883 1.00 70.30 H new ATOM 0 HA LEU A 6 -18.618 -5.695 -7.015 1.00 23.31 H new ATOM 0 HB2 LEU A 6 -17.270 -4.461 -9.404 1.00 62.42 H new ATOM 0 HB3 LEU A 6 -16.918 -3.796 -7.821 1.00 62.42 H new ATOM 0 HG LEU A 6 -16.152 -6.009 -7.037 1.00 75.04 H new ATOM 0 HD11 LEU A 6 -15.767 -7.878 -8.593 1.00 24.35 H new ATOM 0 HD12 LEU A 6 -17.494 -7.502 -8.390 1.00 24.35 H new ATOM 0 HD13 LEU A 6 -16.639 -6.987 -9.863 1.00 24.35 H new ATOM 0 HD21 LEU A 6 -14.059 -6.121 -8.387 1.00 52.52 H new ATOM 0 HD22 LEU A 6 -14.816 -5.080 -9.617 1.00 52.52 H new ATOM 0 HD23 LEU A 6 -14.509 -4.447 -7.982 1.00 52.52 H new ATOM 90 N GLU A 7 -20.313 -3.915 -6.448 1.00 12.40 N ATOM 91 CA GLU A 7 -21.040 -2.789 -5.871 1.00 12.33 C ATOM 92 C GLU A 7 -20.101 -2.001 -4.934 1.00 71.33 C ATOM 93 O GLU A 7 -19.478 -2.579 -4.044 1.00 14.44 O ATOM 94 CB GLU A 7 -22.302 -3.273 -5.114 1.00 20.51 C ATOM 95 CG GLU A 7 -23.135 -2.115 -4.520 1.00 52.55 C ATOM 96 CD GLU A 7 -24.417 -2.570 -3.817 1.00 60.14 C ATOM 97 OE1 GLU A 7 -25.461 -2.674 -4.488 1.00 65.52 O ATOM 98 OE2 GLU A 7 -24.385 -2.827 -2.593 1.00 73.21 O ATOM 0 H GLU A 7 -20.527 -4.813 -6.015 1.00 12.40 H new ATOM 0 HA GLU A 7 -21.375 -2.132 -6.674 1.00 12.33 H new ATOM 0 HB2 GLU A 7 -22.927 -3.850 -5.795 1.00 20.51 H new ATOM 0 HB3 GLU A 7 -22.001 -3.945 -4.311 1.00 20.51 H new ATOM 0 HG2 GLU A 7 -22.519 -1.564 -3.810 1.00 52.55 H new ATOM 0 HG3 GLU A 7 -23.397 -1.422 -5.319 1.00 52.55 H new ATOM 105 N SER A 8 -19.999 -0.689 -5.176 1.00 12.02 N ATOM 106 CA SER A 8 -19.207 0.240 -4.357 1.00 33.42 C ATOM 107 C SER A 8 -19.966 0.619 -3.074 1.00 14.52 C ATOM 108 O SER A 8 -21.131 0.245 -2.898 1.00 23.04 O ATOM 109 CB SER A 8 -18.904 1.501 -5.205 1.00 63.32 C ATOM 110 OG SER A 8 -20.099 2.083 -5.711 1.00 42.21 O ATOM 0 H SER A 8 -20.471 -0.235 -5.958 1.00 12.02 H new ATOM 0 HA SER A 8 -18.274 -0.237 -4.056 1.00 33.42 H new ATOM 0 HB2 SER A 8 -18.371 2.231 -4.597 1.00 63.32 H new ATOM 0 HB3 SER A 8 -18.247 1.236 -6.033 1.00 63.32 H new ATOM 0 HG SER A 8 -20.606 2.483 -4.974 1.00 42.21 H new ATOM 116 N SER A 9 -19.297 1.376 -2.194 1.00 72.23 N ATOM 117 CA SER A 9 -19.912 1.938 -0.975 1.00 60.14 C ATOM 118 C SER A 9 -20.994 2.984 -1.325 1.00 22.41 C ATOM 119 O SER A 9 -21.879 3.268 -0.514 1.00 52.34 O ATOM 120 CB SER A 9 -18.818 2.553 -0.073 1.00 21.40 C ATOM 121 OG SER A 9 -18.073 3.544 -0.759 1.00 1.13 O ATOM 0 H SER A 9 -18.312 1.619 -2.304 1.00 72.23 H new ATOM 0 HA SER A 9 -20.404 1.132 -0.431 1.00 60.14 H new ATOM 0 HB2 SER A 9 -19.279 2.991 0.812 1.00 21.40 H new ATOM 0 HB3 SER A 9 -18.147 1.767 0.273 1.00 21.40 H new ATOM 0 HG SER A 9 -17.391 3.914 -0.160 1.00 1.13 H new ATOM 127 N ASP A 10 -20.913 3.539 -2.558 1.00 72.12 N ATOM 128 CA ASP A 10 -21.914 4.481 -3.105 1.00 52.12 C ATOM 129 C ASP A 10 -23.074 3.709 -3.810 1.00 2.23 C ATOM 130 O ASP A 10 -23.878 4.292 -4.551 1.00 30.22 O ATOM 131 CB ASP A 10 -21.195 5.475 -4.065 1.00 64.22 C ATOM 132 CG ASP A 10 -22.088 6.647 -4.534 1.00 34.41 C ATOM 133 OD1 ASP A 10 -22.574 7.408 -3.695 1.00 53.24 O ATOM 134 OD2 ASP A 10 -22.302 6.823 -5.739 1.00 35.34 O ATOM 0 H ASP A 10 -20.147 3.344 -3.203 1.00 72.12 H new ATOM 0 HA ASP A 10 -22.372 5.052 -2.297 1.00 52.12 H new ATOM 0 HB2 ASP A 10 -20.316 5.879 -3.563 1.00 64.22 H new ATOM 0 HB3 ASP A 10 -20.840 4.929 -4.939 1.00 64.22 H new ATOM 139 N GLU A 11 -23.134 2.373 -3.556 1.00 33.12 N ATOM 140 CA GLU A 11 -24.230 1.467 -3.992 1.00 44.32 C ATOM 141 C GLU A 11 -24.277 1.267 -5.526 1.00 33.12 C ATOM 142 O GLU A 11 -25.235 0.678 -6.043 1.00 5.44 O ATOM 143 CB GLU A 11 -25.609 1.957 -3.460 1.00 12.11 C ATOM 144 CG GLU A 11 -25.752 1.964 -1.926 1.00 1.13 C ATOM 145 CD GLU A 11 -27.106 2.535 -1.471 1.00 34.23 C ATOM 146 OE1 GLU A 11 -27.197 3.766 -1.238 1.00 3.50 O ATOM 147 OE2 GLU A 11 -28.092 1.767 -1.374 1.00 12.35 O ATOM 0 H GLU A 11 -22.406 1.887 -3.032 1.00 33.12 H new ATOM 0 HA GLU A 11 -24.010 0.493 -3.555 1.00 44.32 H new ATOM 0 HB2 GLU A 11 -25.786 2.967 -3.831 1.00 12.11 H new ATOM 0 HB3 GLU A 11 -26.389 1.322 -3.879 1.00 12.11 H new ATOM 0 HG2 GLU A 11 -25.643 0.947 -1.548 1.00 1.13 H new ATOM 0 HG3 GLU A 11 -24.946 2.554 -1.490 1.00 1.13 H new ATOM 154 N LYS A 12 -23.233 1.723 -6.239 1.00 34.11 N ATOM 155 CA LYS A 12 -23.168 1.640 -7.710 1.00 10.32 C ATOM 156 C LYS A 12 -22.504 0.322 -8.121 1.00 61.51 C ATOM 157 O LYS A 12 -21.368 0.048 -7.728 1.00 35.05 O ATOM 158 CB LYS A 12 -22.397 2.852 -8.290 1.00 4.44 C ATOM 159 CG LYS A 12 -23.001 4.223 -7.926 1.00 52.32 C ATOM 160 CD LYS A 12 -24.450 4.401 -8.425 1.00 60.15 C ATOM 161 CE LYS A 12 -25.039 5.768 -8.030 1.00 0.25 C ATOM 162 NZ LYS A 12 -25.079 5.963 -6.554 1.00 45.22 N ATOM 0 H LYS A 12 -22.413 2.158 -5.815 1.00 34.11 H new ATOM 0 HA LYS A 12 -24.180 1.665 -8.115 1.00 10.32 H new ATOM 0 HB2 LYS A 12 -21.367 2.816 -7.935 1.00 4.44 H new ATOM 0 HB3 LYS A 12 -22.363 2.760 -9.376 1.00 4.44 H new ATOM 0 HG2 LYS A 12 -22.979 4.347 -6.843 1.00 52.32 H new ATOM 0 HG3 LYS A 12 -22.378 5.011 -8.350 1.00 52.32 H new ATOM 0 HD2 LYS A 12 -24.474 4.297 -9.510 1.00 60.15 H new ATOM 0 HD3 LYS A 12 -25.074 3.607 -8.015 1.00 60.15 H new ATOM 0 HE2 LYS A 12 -24.444 6.561 -8.483 1.00 0.25 H new ATOM 0 HE3 LYS A 12 -26.048 5.856 -8.433 1.00 0.25 H new ATOM 0 HZ1 LYS A 12 -26.014 6.326 -6.277 1.00 45.22 H new ATOM 0 HZ2 LYS A 12 -24.905 5.054 -6.079 1.00 45.22 H new ATOM 0 HZ3 LYS A 12 -24.346 6.646 -6.274 1.00 45.22 H new ATOM 176 N VAL A 13 -23.230 -0.477 -8.916 1.00 75.44 N ATOM 177 CA VAL A 13 -22.829 -1.837 -9.291 1.00 4.21 C ATOM 178 C VAL A 13 -21.996 -1.808 -10.589 1.00 40.24 C ATOM 179 O VAL A 13 -22.548 -1.700 -11.689 1.00 22.10 O ATOM 180 CB VAL A 13 -24.100 -2.753 -9.465 1.00 22.35 C ATOM 181 CG1 VAL A 13 -23.702 -4.202 -9.813 1.00 55.34 C ATOM 182 CG2 VAL A 13 -24.999 -2.699 -8.201 1.00 33.51 C ATOM 0 H VAL A 13 -24.122 -0.192 -9.320 1.00 75.44 H new ATOM 0 HA VAL A 13 -22.212 -2.254 -8.495 1.00 4.21 H new ATOM 0 HB VAL A 13 -24.681 -2.366 -10.302 1.00 22.35 H new ATOM 0 HG11 VAL A 13 -24.600 -4.809 -9.927 1.00 55.34 H new ATOM 0 HG12 VAL A 13 -23.138 -4.210 -10.746 1.00 55.34 H new ATOM 0 HG13 VAL A 13 -23.086 -4.612 -9.013 1.00 55.34 H new ATOM 0 HG21 VAL A 13 -25.869 -3.339 -8.346 1.00 33.51 H new ATOM 0 HG22 VAL A 13 -24.433 -3.046 -7.337 1.00 33.51 H new ATOM 0 HG23 VAL A 13 -25.327 -1.673 -8.031 1.00 33.51 H new ATOM 192 N PHE A 14 -20.663 -1.861 -10.441 1.00 75.31 N ATOM 193 CA PHE A 14 -19.721 -1.898 -11.570 1.00 40.03 C ATOM 194 C PHE A 14 -19.438 -3.353 -11.950 1.00 5.32 C ATOM 195 O PHE A 14 -18.616 -4.034 -11.322 1.00 61.31 O ATOM 196 CB PHE A 14 -18.410 -1.163 -11.208 1.00 22.34 C ATOM 197 CG PHE A 14 -18.611 0.310 -10.907 1.00 14.12 C ATOM 198 CD1 PHE A 14 -18.644 1.245 -11.940 1.00 61.12 C ATOM 199 CD2 PHE A 14 -18.780 0.759 -9.604 1.00 21.33 C ATOM 200 CE1 PHE A 14 -18.842 2.579 -11.675 1.00 1.21 C ATOM 201 CE2 PHE A 14 -18.975 2.090 -9.342 1.00 20.43 C ATOM 202 CZ PHE A 14 -19.005 3.003 -10.378 1.00 11.41 C ATOM 0 H PHE A 14 -20.206 -1.879 -9.529 1.00 75.31 H new ATOM 0 HA PHE A 14 -20.166 -1.388 -12.424 1.00 40.03 H new ATOM 0 HB2 PHE A 14 -17.959 -1.646 -10.341 1.00 22.34 H new ATOM 0 HB3 PHE A 14 -17.705 -1.265 -12.033 1.00 22.34 H new ATOM 0 HD1 PHE A 14 -18.512 0.917 -12.961 1.00 61.12 H new ATOM 0 HD2 PHE A 14 -18.758 0.052 -8.788 1.00 21.33 H new ATOM 0 HE1 PHE A 14 -18.869 3.293 -12.485 1.00 1.21 H new ATOM 0 HE2 PHE A 14 -19.105 2.426 -8.324 1.00 20.43 H new ATOM 0 HZ PHE A 14 -19.157 4.052 -10.168 1.00 11.41 H new ATOM 212 N GLU A 15 -20.176 -3.825 -12.948 1.00 31.43 N ATOM 213 CA GLU A 15 -20.046 -5.177 -13.479 1.00 71.51 C ATOM 214 C GLU A 15 -18.828 -5.256 -14.419 1.00 73.35 C ATOM 215 O GLU A 15 -18.944 -5.039 -15.632 1.00 23.55 O ATOM 216 CB GLU A 15 -21.352 -5.566 -14.205 1.00 25.42 C ATOM 217 CG GLU A 15 -22.604 -5.511 -13.321 1.00 13.42 C ATOM 218 CD GLU A 15 -23.887 -5.843 -14.089 1.00 72.33 C ATOM 219 OE1 GLU A 15 -24.158 -7.045 -14.309 1.00 2.53 O ATOM 220 OE2 GLU A 15 -24.630 -4.909 -14.473 1.00 61.55 O ATOM 0 H GLU A 15 -20.892 -3.271 -13.418 1.00 31.43 H new ATOM 0 HA GLU A 15 -19.882 -5.885 -12.666 1.00 71.51 H new ATOM 0 HB2 GLU A 15 -21.493 -4.900 -15.057 1.00 25.42 H new ATOM 0 HB3 GLU A 15 -21.246 -6.575 -14.603 1.00 25.42 H new ATOM 0 HG2 GLU A 15 -22.490 -6.211 -12.493 1.00 13.42 H new ATOM 0 HG3 GLU A 15 -22.693 -4.515 -12.887 1.00 13.42 H new ATOM 227 N ILE A 16 -17.649 -5.489 -13.823 1.00 21.25 N ATOM 228 CA ILE A 16 -16.379 -5.659 -14.560 1.00 42.43 C ATOM 229 C ILE A 16 -16.218 -7.137 -14.980 1.00 63.24 C ATOM 230 O ILE A 16 -16.811 -8.029 -14.362 1.00 74.52 O ATOM 231 CB ILE A 16 -15.142 -5.200 -13.680 1.00 74.23 C ATOM 232 CG1 ILE A 16 -13.801 -5.270 -14.497 1.00 12.12 C ATOM 233 CG2 ILE A 16 -15.049 -6.015 -12.363 1.00 42.24 C ATOM 234 CD1 ILE A 16 -12.543 -4.963 -13.706 1.00 60.43 C ATOM 0 H ILE A 16 -17.545 -5.566 -12.811 1.00 21.25 H new ATOM 0 HA ILE A 16 -16.407 -5.030 -15.450 1.00 42.43 H new ATOM 0 HB ILE A 16 -15.304 -4.157 -13.406 1.00 74.23 H new ATOM 0 HG12 ILE A 16 -13.707 -6.268 -14.925 1.00 12.12 H new ATOM 0 HG13 ILE A 16 -13.866 -4.571 -15.331 1.00 12.12 H new ATOM 0 HG21 ILE A 16 -14.190 -5.675 -11.784 1.00 42.24 H new ATOM 0 HG22 ILE A 16 -15.959 -5.871 -11.781 1.00 42.24 H new ATOM 0 HG23 ILE A 16 -14.932 -7.073 -12.597 1.00 42.24 H new ATOM 0 HD11 ILE A 16 -11.674 -5.038 -14.360 1.00 60.43 H new ATOM 0 HD12 ILE A 16 -12.605 -3.953 -13.301 1.00 60.43 H new ATOM 0 HD13 ILE A 16 -12.444 -5.677 -12.888 1.00 60.43 H new ATOM 246 N GLU A 17 -15.422 -7.379 -16.040 1.00 25.22 N ATOM 247 CA GLU A 17 -15.077 -8.729 -16.505 1.00 62.00 C ATOM 248 C GLU A 17 -14.355 -9.496 -15.377 1.00 73.23 C ATOM 249 O GLU A 17 -13.442 -8.956 -14.727 1.00 71.24 O ATOM 250 CB GLU A 17 -14.196 -8.683 -17.792 1.00 72.33 C ATOM 251 CG GLU A 17 -14.837 -7.992 -19.031 1.00 72.15 C ATOM 252 CD GLU A 17 -14.825 -6.447 -18.987 1.00 63.41 C ATOM 253 OE1 GLU A 17 -15.779 -5.835 -18.464 1.00 41.44 O ATOM 254 OE2 GLU A 17 -13.854 -5.834 -19.474 1.00 34.34 O ATOM 0 H GLU A 17 -15.000 -6.637 -16.598 1.00 25.22 H new ATOM 0 HA GLU A 17 -15.999 -9.251 -16.762 1.00 62.00 H new ATOM 0 HB2 GLU A 17 -13.266 -8.168 -17.554 1.00 72.33 H new ATOM 0 HB3 GLU A 17 -13.933 -9.705 -18.066 1.00 72.33 H new ATOM 0 HG2 GLU A 17 -14.310 -8.321 -19.927 1.00 72.15 H new ATOM 0 HG3 GLU A 17 -15.868 -8.331 -19.126 1.00 72.15 H new ATOM 261 N LYS A 18 -14.779 -10.749 -15.175 1.00 45.41 N ATOM 262 CA LYS A 18 -14.388 -11.582 -14.028 1.00 22.53 C ATOM 263 C LYS A 18 -12.877 -11.876 -14.001 1.00 10.33 C ATOM 264 O LYS A 18 -12.253 -11.867 -12.928 1.00 3.01 O ATOM 265 CB LYS A 18 -15.226 -12.886 -14.067 1.00 3.13 C ATOM 266 CG LYS A 18 -15.009 -13.848 -12.886 1.00 51.01 C ATOM 267 CD LYS A 18 -16.047 -14.990 -12.866 1.00 35.23 C ATOM 268 CE LYS A 18 -15.819 -15.961 -11.707 1.00 61.42 C ATOM 269 NZ LYS A 18 -14.545 -16.718 -11.847 1.00 62.10 N ATOM 0 H LYS A 18 -15.416 -11.223 -15.816 1.00 45.41 H new ATOM 0 HA LYS A 18 -14.593 -11.037 -13.106 1.00 22.53 H new ATOM 0 HB2 LYS A 18 -16.282 -12.618 -14.105 1.00 3.13 H new ATOM 0 HB3 LYS A 18 -14.998 -13.416 -14.992 1.00 3.13 H new ATOM 0 HG2 LYS A 18 -14.006 -14.272 -12.944 1.00 51.01 H new ATOM 0 HG3 LYS A 18 -15.066 -13.291 -11.951 1.00 51.01 H new ATOM 0 HD2 LYS A 18 -17.049 -14.566 -12.791 1.00 35.23 H new ATOM 0 HD3 LYS A 18 -16.002 -15.536 -13.809 1.00 35.23 H new ATOM 0 HE2 LYS A 18 -15.809 -15.407 -10.768 1.00 61.42 H new ATOM 0 HE3 LYS A 18 -16.652 -16.662 -11.654 1.00 61.42 H new ATOM 0 HZ1 LYS A 18 -14.616 -17.616 -11.327 1.00 62.10 H new ATOM 0 HZ2 LYS A 18 -14.366 -16.913 -12.853 1.00 62.10 H new ATOM 0 HZ3 LYS A 18 -13.762 -16.154 -11.459 1.00 62.10 H new ATOM 283 N GLU A 19 -12.300 -12.104 -15.193 1.00 24.04 N ATOM 284 CA GLU A 19 -10.854 -12.375 -15.355 1.00 2.43 C ATOM 285 C GLU A 19 -9.994 -11.157 -14.938 1.00 62.00 C ATOM 286 O GLU A 19 -8.868 -11.313 -14.454 1.00 11.14 O ATOM 287 CB GLU A 19 -10.551 -12.789 -16.825 1.00 24.30 C ATOM 288 CG GLU A 19 -10.901 -11.726 -17.895 1.00 23.04 C ATOM 289 CD GLU A 19 -10.632 -12.202 -19.335 1.00 51.34 C ATOM 290 OE1 GLU A 19 -11.589 -12.359 -20.121 1.00 53.31 O ATOM 291 OE2 GLU A 19 -9.455 -12.448 -19.678 1.00 42.44 O ATOM 0 H GLU A 19 -12.818 -12.107 -16.072 1.00 24.04 H new ATOM 0 HA GLU A 19 -10.588 -13.199 -14.693 1.00 2.43 H new ATOM 0 HB2 GLU A 19 -9.491 -13.028 -16.907 1.00 24.30 H new ATOM 0 HB3 GLU A 19 -11.102 -13.702 -17.049 1.00 24.30 H new ATOM 0 HG2 GLU A 19 -11.953 -11.456 -17.799 1.00 23.04 H new ATOM 0 HG3 GLU A 19 -10.321 -10.823 -17.704 1.00 23.04 H new ATOM 298 N ILE A 20 -10.549 -9.945 -15.131 1.00 64.45 N ATOM 299 CA ILE A 20 -9.862 -8.675 -14.833 1.00 24.34 C ATOM 300 C ILE A 20 -9.957 -8.334 -13.326 1.00 41.12 C ATOM 301 O ILE A 20 -9.026 -7.763 -12.752 1.00 60.00 O ATOM 302 CB ILE A 20 -10.450 -7.498 -15.699 1.00 10.31 C ATOM 303 CG1 ILE A 20 -10.475 -7.884 -17.214 1.00 44.52 C ATOM 304 CG2 ILE A 20 -9.648 -6.199 -15.478 1.00 71.20 C ATOM 305 CD1 ILE A 20 -10.909 -6.775 -18.159 1.00 61.24 C ATOM 0 H ILE A 20 -11.492 -9.820 -15.500 1.00 64.45 H new ATOM 0 HA ILE A 20 -8.810 -8.799 -15.092 1.00 24.34 H new ATOM 0 HB ILE A 20 -11.476 -7.320 -15.376 1.00 10.31 H new ATOM 0 HG12 ILE A 20 -9.478 -8.217 -17.504 1.00 44.52 H new ATOM 0 HG13 ILE A 20 -11.145 -8.734 -17.345 1.00 44.52 H new ATOM 0 HG21 ILE A 20 -10.073 -5.401 -16.087 1.00 71.20 H new ATOM 0 HG22 ILE A 20 -9.695 -5.917 -14.426 1.00 71.20 H new ATOM 0 HG23 ILE A 20 -8.609 -6.360 -15.765 1.00 71.20 H new ATOM 0 HD11 ILE A 20 -10.893 -7.144 -19.185 1.00 61.24 H new ATOM 0 HD12 ILE A 20 -11.919 -6.455 -17.905 1.00 61.24 H new ATOM 0 HD13 ILE A 20 -10.227 -5.930 -18.066 1.00 61.24 H new ATOM 317 N ALA A 21 -11.090 -8.702 -12.696 1.00 13.05 N ATOM 318 CA ALA A 21 -11.311 -8.501 -11.243 1.00 54.23 C ATOM 319 C ALA A 21 -10.305 -9.310 -10.392 1.00 62.45 C ATOM 320 O ALA A 21 -9.959 -8.913 -9.271 1.00 33.03 O ATOM 321 CB ALA A 21 -12.752 -8.875 -10.880 1.00 23.13 C ATOM 0 H ALA A 21 -11.876 -9.145 -13.173 1.00 13.05 H new ATOM 0 HA ALA A 21 -11.147 -7.447 -11.019 1.00 54.23 H new ATOM 0 HB1 ALA A 21 -12.909 -8.725 -9.812 1.00 23.13 H new ATOM 0 HB2 ALA A 21 -13.443 -8.245 -11.440 1.00 23.13 H new ATOM 0 HB3 ALA A 21 -12.930 -9.921 -11.130 1.00 23.13 H new ATOM 327 N CYS A 22 -9.834 -10.430 -10.963 1.00 23.43 N ATOM 328 CA CYS A 22 -8.833 -11.310 -10.345 1.00 32.21 C ATOM 329 C CYS A 22 -7.446 -10.634 -10.207 1.00 21.02 C ATOM 330 O CYS A 22 -6.632 -11.074 -9.395 1.00 72.12 O ATOM 331 CB CYS A 22 -8.730 -12.604 -11.163 1.00 65.52 C ATOM 332 SG CYS A 22 -10.289 -13.502 -11.272 1.00 64.24 S ATOM 0 H CYS A 22 -10.143 -10.753 -11.880 1.00 23.43 H new ATOM 0 HA CYS A 22 -9.163 -11.535 -9.331 1.00 32.21 H new ATOM 0 HB2 CYS A 22 -8.386 -12.364 -12.169 1.00 65.52 H new ATOM 0 HB3 CYS A 22 -7.976 -13.251 -10.714 1.00 65.52 H new ATOM 0 HG CYS A 22 -11.117 -12.844 -12.028 1.00 64.24 H new ATOM 338 N MET A 23 -7.182 -9.594 -11.028 1.00 41.40 N ATOM 339 CA MET A 23 -5.910 -8.822 -10.981 1.00 12.42 C ATOM 340 C MET A 23 -5.731 -8.083 -9.645 1.00 10.12 C ATOM 341 O MET A 23 -4.610 -7.756 -9.253 1.00 62.20 O ATOM 342 CB MET A 23 -5.846 -7.808 -12.142 1.00 70.31 C ATOM 343 CG MET A 23 -5.777 -8.429 -13.539 1.00 61.22 C ATOM 344 SD MET A 23 -5.727 -7.175 -14.831 1.00 63.13 S ATOM 345 CE MET A 23 -4.311 -6.178 -14.334 1.00 63.25 C ATOM 0 H MET A 23 -7.835 -9.264 -11.738 1.00 41.40 H new ATOM 0 HA MET A 23 -5.099 -9.543 -11.080 1.00 12.42 H new ATOM 0 HB2 MET A 23 -6.723 -7.163 -12.090 1.00 70.31 H new ATOM 0 HB3 MET A 23 -4.973 -7.171 -12.000 1.00 70.31 H new ATOM 0 HG2 MET A 23 -4.892 -9.061 -13.612 1.00 61.22 H new ATOM 0 HG3 MET A 23 -6.642 -9.074 -13.693 1.00 61.22 H new ATOM 0 HE1 MET A 23 -3.747 -5.881 -15.218 1.00 63.25 H new ATOM 0 HE2 MET A 23 -4.659 -5.288 -13.809 1.00 63.25 H new ATOM 0 HE3 MET A 23 -3.669 -6.761 -13.674 1.00 63.25 H new ATOM 355 N SER A 24 -6.845 -7.781 -8.983 1.00 21.04 N ATOM 356 CA SER A 24 -6.840 -7.283 -7.607 1.00 0.53 C ATOM 357 C SER A 24 -6.685 -8.474 -6.658 1.00 71.10 C ATOM 358 O SER A 24 -7.416 -9.456 -6.796 1.00 55.04 O ATOM 359 CB SER A 24 -8.148 -6.532 -7.317 1.00 72.31 C ATOM 360 OG SER A 24 -8.263 -6.196 -5.943 1.00 1.24 O ATOM 0 H SER A 24 -7.778 -7.874 -9.384 1.00 21.04 H new ATOM 0 HA SER A 24 -6.011 -6.591 -7.462 1.00 0.53 H new ATOM 0 HB2 SER A 24 -8.188 -5.624 -7.919 1.00 72.31 H new ATOM 0 HB3 SER A 24 -8.996 -7.149 -7.614 1.00 72.31 H new ATOM 0 HG SER A 24 -7.369 -6.087 -5.557 1.00 1.24 H new ATOM 366 N VAL A 25 -5.733 -8.380 -5.706 1.00 34.04 N ATOM 367 CA VAL A 25 -5.465 -9.452 -4.731 1.00 21.34 C ATOM 368 C VAL A 25 -6.699 -9.680 -3.844 1.00 22.44 C ATOM 369 O VAL A 25 -7.191 -10.799 -3.747 1.00 64.54 O ATOM 370 CB VAL A 25 -4.212 -9.138 -3.826 1.00 2.23 C ATOM 371 CG1 VAL A 25 -3.915 -10.296 -2.837 1.00 42.25 C ATOM 372 CG2 VAL A 25 -2.975 -8.816 -4.691 1.00 11.52 C ATOM 0 H VAL A 25 -5.133 -7.563 -5.594 1.00 34.04 H new ATOM 0 HA VAL A 25 -5.244 -10.356 -5.299 1.00 21.34 H new ATOM 0 HB VAL A 25 -4.450 -8.256 -3.231 1.00 2.23 H new ATOM 0 HG11 VAL A 25 -3.045 -10.043 -2.231 1.00 42.25 H new ATOM 0 HG12 VAL A 25 -4.777 -10.450 -2.188 1.00 42.25 H new ATOM 0 HG13 VAL A 25 -3.714 -11.210 -3.396 1.00 42.25 H new ATOM 0 HG21 VAL A 25 -2.124 -8.603 -4.044 1.00 11.52 H new ATOM 0 HG22 VAL A 25 -2.743 -9.671 -5.326 1.00 11.52 H new ATOM 0 HG23 VAL A 25 -3.183 -7.947 -5.314 1.00 11.52 H new ATOM 382 N THR A 26 -7.206 -8.584 -3.253 1.00 43.14 N ATOM 383 CA THR A 26 -8.348 -8.622 -2.324 1.00 74.12 C ATOM 384 C THR A 26 -9.624 -9.174 -2.997 1.00 71.32 C ATOM 385 O THR A 26 -10.260 -10.063 -2.439 1.00 55.41 O ATOM 386 CB THR A 26 -8.611 -7.209 -1.712 1.00 44.03 C ATOM 387 OG1 THR A 26 -7.430 -6.773 -1.020 1.00 53.20 O ATOM 388 CG2 THR A 26 -9.808 -7.181 -0.740 1.00 12.52 C ATOM 0 H THR A 26 -6.835 -7.646 -3.406 1.00 43.14 H new ATOM 0 HA THR A 26 -8.086 -9.307 -1.517 1.00 74.12 H new ATOM 0 HB THR A 26 -8.857 -6.541 -2.537 1.00 44.03 H new ATOM 0 HG1 THR A 26 -7.557 -5.855 -0.703 1.00 53.20 H new ATOM 0 HG21 THR A 26 -9.937 -6.171 -0.350 1.00 12.52 H new ATOM 0 HG22 THR A 26 -10.712 -7.484 -1.268 1.00 12.52 H new ATOM 0 HG23 THR A 26 -9.622 -7.868 0.086 1.00 12.52 H new ATOM 396 N ILE A 27 -9.957 -8.673 -4.210 1.00 52.24 N ATOM 397 CA ILE A 27 -11.173 -9.104 -4.946 1.00 23.15 C ATOM 398 C ILE A 27 -11.072 -10.596 -5.335 1.00 11.02 C ATOM 399 O ILE A 27 -12.039 -11.342 -5.179 1.00 4.22 O ATOM 400 CB ILE A 27 -11.429 -8.227 -6.231 1.00 42.21 C ATOM 401 CG1 ILE A 27 -11.599 -6.723 -5.844 1.00 42.11 C ATOM 402 CG2 ILE A 27 -12.662 -8.731 -7.031 1.00 54.31 C ATOM 403 CD1 ILE A 27 -11.648 -5.766 -7.025 1.00 11.45 C ATOM 0 H ILE A 27 -9.403 -7.971 -4.700 1.00 52.24 H new ATOM 0 HA ILE A 27 -12.021 -8.964 -4.275 1.00 23.15 H new ATOM 0 HB ILE A 27 -10.556 -8.324 -6.877 1.00 42.21 H new ATOM 0 HG12 ILE A 27 -12.516 -6.612 -5.265 1.00 42.11 H new ATOM 0 HG13 ILE A 27 -10.774 -6.434 -5.193 1.00 42.11 H new ATOM 0 HG21 ILE A 27 -12.807 -8.102 -7.910 1.00 54.31 H new ATOM 0 HG22 ILE A 27 -12.495 -9.761 -7.345 1.00 54.31 H new ATOM 0 HG23 ILE A 27 -13.549 -8.683 -6.400 1.00 54.31 H new ATOM 0 HD11 ILE A 27 -11.768 -4.745 -6.662 1.00 11.45 H new ATOM 0 HD12 ILE A 27 -10.721 -5.842 -7.594 1.00 11.45 H new ATOM 0 HD13 ILE A 27 -12.490 -6.023 -7.667 1.00 11.45 H new ATOM 415 N LYS A 28 -9.876 -11.013 -5.806 1.00 35.15 N ATOM 416 CA LYS A 28 -9.584 -12.422 -6.162 1.00 33.34 C ATOM 417 C LYS A 28 -9.793 -13.334 -4.937 1.00 42.13 C ATOM 418 O LYS A 28 -10.488 -14.349 -5.016 1.00 65.11 O ATOM 419 CB LYS A 28 -8.125 -12.549 -6.677 1.00 22.33 C ATOM 420 CG LYS A 28 -7.712 -13.967 -7.142 1.00 74.31 C ATOM 421 CD LYS A 28 -6.210 -14.066 -7.508 1.00 14.12 C ATOM 422 CE LYS A 28 -5.279 -13.747 -6.318 1.00 63.34 C ATOM 423 NZ LYS A 28 -5.506 -14.651 -5.157 1.00 24.23 N ATOM 0 H LYS A 28 -9.086 -10.384 -5.950 1.00 35.15 H new ATOM 0 HA LYS A 28 -10.267 -12.734 -6.953 1.00 33.34 H new ATOM 0 HB2 LYS A 28 -7.988 -11.857 -7.508 1.00 22.33 H new ATOM 0 HB3 LYS A 28 -7.448 -12.232 -5.884 1.00 22.33 H new ATOM 0 HG2 LYS A 28 -7.936 -14.683 -6.352 1.00 74.31 H new ATOM 0 HG3 LYS A 28 -8.311 -14.249 -8.008 1.00 74.31 H new ATOM 0 HD2 LYS A 28 -5.995 -15.071 -7.871 1.00 14.12 H new ATOM 0 HD3 LYS A 28 -5.994 -13.378 -8.326 1.00 14.12 H new ATOM 0 HE2 LYS A 28 -4.241 -13.829 -6.641 1.00 63.34 H new ATOM 0 HE3 LYS A 28 -5.435 -12.714 -6.006 1.00 63.34 H new ATOM 0 HZ1 LYS A 28 -5.770 -14.087 -4.324 1.00 24.23 H new ATOM 0 HZ2 LYS A 28 -6.272 -15.317 -5.381 1.00 24.23 H new ATOM 0 HZ3 LYS A 28 -4.635 -15.181 -4.954 1.00 24.23 H new ATOM 437 N ASN A 29 -9.224 -12.899 -3.799 1.00 42.32 N ATOM 438 CA ASN A 29 -9.278 -13.620 -2.513 1.00 12.34 C ATOM 439 C ASN A 29 -10.705 -13.658 -1.956 1.00 3.31 C ATOM 440 O ASN A 29 -11.062 -14.601 -1.252 1.00 1.54 O ATOM 441 CB ASN A 29 -8.310 -12.962 -1.479 1.00 41.22 C ATOM 442 CG ASN A 29 -6.819 -13.192 -1.780 1.00 25.33 C ATOM 443 OD1 ASN A 29 -6.414 -13.392 -2.926 1.00 62.21 O ATOM 444 ND2 ASN A 29 -5.983 -13.144 -0.753 1.00 53.55 N ATOM 0 H ASN A 29 -8.705 -12.023 -3.745 1.00 42.32 H new ATOM 0 HA ASN A 29 -8.959 -14.647 -2.692 1.00 12.34 H new ATOM 0 HB2 ASN A 29 -8.502 -11.890 -1.449 1.00 41.22 H new ATOM 0 HB3 ASN A 29 -8.534 -13.354 -0.487 1.00 41.22 H new ATOM 0 HD21 ASN A 29 -4.983 -13.274 -0.903 1.00 53.55 H new ATOM 0 HD22 ASN A 29 -6.340 -12.977 0.188 1.00 53.55 H new ATOM 451 N MET A 30 -11.510 -12.617 -2.260 1.00 32.02 N ATOM 452 CA MET A 30 -12.938 -12.566 -1.881 1.00 32.03 C ATOM 453 C MET A 30 -13.704 -13.671 -2.622 1.00 31.44 C ATOM 454 O MET A 30 -14.412 -14.461 -2.001 1.00 53.53 O ATOM 455 CB MET A 30 -13.577 -11.177 -2.189 1.00 51.14 C ATOM 456 CG MET A 30 -13.163 -10.039 -1.240 1.00 72.00 C ATOM 457 SD MET A 30 -13.665 -10.335 0.470 1.00 72.23 S ATOM 458 CE MET A 30 -13.069 -8.849 1.289 1.00 43.41 C ATOM 0 H MET A 30 -11.191 -11.794 -2.771 1.00 32.02 H new ATOM 0 HA MET A 30 -13.004 -12.723 -0.804 1.00 32.03 H new ATOM 0 HB2 MET A 30 -13.314 -10.892 -3.208 1.00 51.14 H new ATOM 0 HB3 MET A 30 -14.662 -11.279 -2.156 1.00 51.14 H new ATOM 0 HG2 MET A 30 -12.081 -9.915 -1.280 1.00 72.00 H new ATOM 0 HG3 MET A 30 -13.604 -9.104 -1.587 1.00 72.00 H new ATOM 0 HE1 MET A 30 -13.311 -8.897 2.351 1.00 43.41 H new ATOM 0 HE2 MET A 30 -11.989 -8.774 1.166 1.00 43.41 H new ATOM 0 HE3 MET A 30 -13.546 -7.974 0.847 1.00 43.41 H new ATOM 468 N ILE A 31 -13.507 -13.727 -3.962 1.00 1.11 N ATOM 469 CA ILE A 31 -14.158 -14.719 -4.846 1.00 1.41 C ATOM 470 C ILE A 31 -13.798 -16.155 -4.396 1.00 60.55 C ATOM 471 O ILE A 31 -14.675 -17.004 -4.265 1.00 2.31 O ATOM 472 CB ILE A 31 -13.755 -14.497 -6.368 1.00 41.00 C ATOM 473 CG1 ILE A 31 -14.159 -13.059 -6.845 1.00 70.22 C ATOM 474 CG2 ILE A 31 -14.394 -15.571 -7.289 1.00 31.03 C ATOM 475 CD1 ILE A 31 -13.706 -12.692 -8.256 1.00 2.45 C ATOM 0 H ILE A 31 -12.891 -13.084 -4.459 1.00 1.11 H new ATOM 0 HA ILE A 31 -15.236 -14.582 -4.766 1.00 1.41 H new ATOM 0 HB ILE A 31 -12.672 -14.598 -6.438 1.00 41.00 H new ATOM 0 HG12 ILE A 31 -15.244 -12.968 -6.794 1.00 70.22 H new ATOM 0 HG13 ILE A 31 -13.744 -12.332 -6.147 1.00 70.22 H new ATOM 0 HG21 ILE A 31 -14.097 -15.388 -8.322 1.00 31.03 H new ATOM 0 HG22 ILE A 31 -14.055 -16.561 -6.984 1.00 31.03 H new ATOM 0 HG23 ILE A 31 -15.480 -15.519 -7.209 1.00 31.03 H new ATOM 0 HD11 ILE A 31 -14.034 -11.679 -8.492 1.00 2.45 H new ATOM 0 HD12 ILE A 31 -12.619 -12.744 -8.314 1.00 2.45 H new ATOM 0 HD13 ILE A 31 -14.142 -13.390 -8.971 1.00 2.45 H new ATOM 487 N GLU A 32 -12.503 -16.380 -4.101 1.00 0.10 N ATOM 488 CA GLU A 32 -11.977 -17.700 -3.677 1.00 41.33 C ATOM 489 C GLU A 32 -12.527 -18.121 -2.294 1.00 3.42 C ATOM 490 O GLU A 32 -12.905 -19.277 -2.104 1.00 2.33 O ATOM 491 CB GLU A 32 -10.425 -17.680 -3.657 1.00 3.05 C ATOM 492 CG GLU A 32 -9.777 -17.443 -5.037 1.00 32.25 C ATOM 493 CD GLU A 32 -8.248 -17.341 -4.964 1.00 0.44 C ATOM 494 OE1 GLU A 32 -7.542 -18.329 -5.282 1.00 70.23 O ATOM 495 OE2 GLU A 32 -7.736 -16.275 -4.563 1.00 44.45 O ATOM 0 H GLU A 32 -11.789 -15.654 -4.149 1.00 0.10 H new ATOM 0 HA GLU A 32 -12.316 -18.438 -4.404 1.00 41.33 H new ATOM 0 HB2 GLU A 32 -10.092 -16.900 -2.973 1.00 3.05 H new ATOM 0 HB3 GLU A 32 -10.066 -18.628 -3.258 1.00 3.05 H new ATOM 0 HG2 GLU A 32 -10.051 -18.258 -5.707 1.00 32.25 H new ATOM 0 HG3 GLU A 32 -10.178 -16.526 -5.469 1.00 32.25 H new ATOM 502 N ASP A 33 -12.583 -17.158 -1.349 1.00 52.41 N ATOM 503 CA ASP A 33 -13.027 -17.399 0.051 1.00 32.51 C ATOM 504 C ASP A 33 -14.519 -17.776 0.093 1.00 71.43 C ATOM 505 O ASP A 33 -14.930 -18.673 0.835 1.00 2.01 O ATOM 506 CB ASP A 33 -12.775 -16.134 0.922 1.00 41.30 C ATOM 507 CG ASP A 33 -13.087 -16.347 2.424 1.00 30.15 C ATOM 508 OD1 ASP A 33 -14.236 -16.119 2.859 1.00 1.34 O ATOM 509 OD2 ASP A 33 -12.178 -16.738 3.182 1.00 72.30 O ATOM 0 H ASP A 33 -12.322 -16.189 -1.530 1.00 52.41 H new ATOM 0 HA ASP A 33 -12.448 -18.230 0.454 1.00 32.51 H new ATOM 0 HB2 ASP A 33 -11.734 -15.830 0.815 1.00 41.30 H new ATOM 0 HB3 ASP A 33 -13.387 -15.315 0.544 1.00 41.30 H new ATOM 514 N ILE A 34 -15.310 -17.064 -0.719 1.00 44.33 N ATOM 515 CA ILE A 34 -16.756 -17.312 -0.892 1.00 20.34 C ATOM 516 C ILE A 34 -16.992 -18.631 -1.679 1.00 63.43 C ATOM 517 O ILE A 34 -18.050 -19.263 -1.560 1.00 24.20 O ATOM 518 CB ILE A 34 -17.423 -16.064 -1.615 1.00 34.30 C ATOM 519 CG1 ILE A 34 -17.259 -14.775 -0.735 1.00 62.42 C ATOM 520 CG2 ILE A 34 -18.913 -16.306 -1.950 1.00 23.20 C ATOM 521 CD1 ILE A 34 -17.748 -13.487 -1.387 1.00 32.23 C ATOM 0 H ILE A 34 -14.964 -16.288 -1.284 1.00 44.33 H new ATOM 0 HA ILE A 34 -17.227 -17.433 0.084 1.00 20.34 H new ATOM 0 HB ILE A 34 -16.902 -15.921 -2.562 1.00 34.30 H new ATOM 0 HG12 ILE A 34 -17.800 -14.920 0.200 1.00 62.42 H new ATOM 0 HG13 ILE A 34 -16.206 -14.659 -0.479 1.00 62.42 H new ATOM 0 HG21 ILE A 34 -19.323 -15.424 -2.443 1.00 23.20 H new ATOM 0 HG22 ILE A 34 -19.002 -17.167 -2.613 1.00 23.20 H new ATOM 0 HG23 ILE A 34 -19.466 -16.498 -1.031 1.00 23.20 H new ATOM 0 HD11 ILE A 34 -17.594 -12.652 -0.704 1.00 32.23 H new ATOM 0 HD12 ILE A 34 -17.191 -13.311 -2.307 1.00 32.23 H new ATOM 0 HD13 ILE A 34 -18.810 -13.576 -1.617 1.00 32.23 H new ATOM 533 N GLY A 35 -15.972 -19.059 -2.448 1.00 41.33 N ATOM 534 CA GLY A 35 -16.055 -20.278 -3.267 1.00 42.20 C ATOM 535 C GLY A 35 -16.658 -20.013 -4.639 1.00 61.43 C ATOM 536 O GLY A 35 -17.110 -20.949 -5.313 1.00 3.01 O ATOM 0 H GLY A 35 -15.078 -18.574 -2.517 1.00 41.33 H new ATOM 0 HA2 GLY A 35 -15.058 -20.701 -3.387 1.00 42.20 H new ATOM 0 HA3 GLY A 35 -16.657 -21.023 -2.746 1.00 42.20 H new ATOM 540 N GLU A 36 -16.669 -18.714 -5.016 1.00 63.11 N ATOM 541 CA GLU A 36 -17.177 -18.181 -6.283 1.00 71.50 C ATOM 542 C GLU A 36 -18.715 -18.159 -6.284 1.00 43.52 C ATOM 543 O GLU A 36 -19.365 -19.202 -6.197 1.00 51.41 O ATOM 544 CB GLU A 36 -16.602 -18.931 -7.520 1.00 1.53 C ATOM 545 CG GLU A 36 -17.024 -18.328 -8.872 1.00 75.04 C ATOM 546 CD GLU A 36 -16.454 -19.093 -10.074 1.00 52.45 C ATOM 547 OE1 GLU A 36 -17.227 -19.734 -10.822 1.00 24.31 O ATOM 548 OE2 GLU A 36 -15.221 -19.051 -10.276 1.00 40.13 O ATOM 0 H GLU A 36 -16.304 -17.980 -4.409 1.00 63.11 H new ATOM 0 HA GLU A 36 -16.826 -17.153 -6.369 1.00 71.50 H new ATOM 0 HB2 GLU A 36 -15.514 -18.931 -7.458 1.00 1.53 H new ATOM 0 HB3 GLU A 36 -16.923 -19.972 -7.482 1.00 1.53 H new ATOM 0 HG2 GLU A 36 -18.112 -18.320 -8.936 1.00 75.04 H new ATOM 0 HG3 GLU A 36 -16.694 -17.290 -8.919 1.00 75.04 H new ATOM 555 N SER A 37 -19.282 -16.948 -6.368 1.00 53.54 N ATOM 556 CA SER A 37 -20.731 -16.716 -6.376 1.00 24.34 C ATOM 557 C SER A 37 -21.053 -15.533 -7.302 1.00 21.34 C ATOM 558 O SER A 37 -20.225 -14.625 -7.471 1.00 32.52 O ATOM 559 CB SER A 37 -21.230 -16.440 -4.936 1.00 33.24 C ATOM 560 OG SER A 37 -21.020 -17.567 -4.096 1.00 44.34 O ATOM 0 H SER A 37 -18.737 -16.088 -6.433 1.00 53.54 H new ATOM 0 HA SER A 37 -21.243 -17.603 -6.749 1.00 24.34 H new ATOM 0 HB2 SER A 37 -20.708 -15.575 -4.527 1.00 33.24 H new ATOM 0 HB3 SER A 37 -22.291 -16.191 -4.957 1.00 33.24 H new ATOM 0 HG SER A 37 -21.342 -17.366 -3.192 1.00 44.34 H new ATOM 566 N ASP A 38 -22.255 -15.564 -7.904 1.00 20.12 N ATOM 567 CA ASP A 38 -22.751 -14.485 -8.782 1.00 63.22 C ATOM 568 C ASP A 38 -23.339 -13.318 -7.952 1.00 43.44 C ATOM 569 O ASP A 38 -23.769 -12.304 -8.519 1.00 71.33 O ATOM 570 CB ASP A 38 -23.810 -15.046 -9.777 1.00 53.00 C ATOM 571 CG ASP A 38 -25.063 -15.624 -9.088 1.00 52.24 C ATOM 572 OD1 ASP A 38 -26.073 -14.894 -8.935 1.00 4.52 O ATOM 573 OD2 ASP A 38 -25.042 -16.816 -8.707 1.00 63.00 O ATOM 0 H ASP A 38 -22.911 -16.337 -7.797 1.00 20.12 H new ATOM 0 HA ASP A 38 -21.910 -14.093 -9.354 1.00 63.22 H new ATOM 0 HB2 ASP A 38 -24.114 -14.250 -10.457 1.00 53.00 H new ATOM 0 HB3 ASP A 38 -23.348 -15.825 -10.384 1.00 53.00 H new ATOM 578 N SER A 39 -23.370 -13.497 -6.613 1.00 21.02 N ATOM 579 CA SER A 39 -23.802 -12.477 -5.641 1.00 75.12 C ATOM 580 C SER A 39 -23.042 -11.141 -5.846 1.00 32.21 C ATOM 581 O SER A 39 -21.811 -11.162 -5.983 1.00 32.20 O ATOM 582 CB SER A 39 -23.569 -13.012 -4.207 1.00 71.41 C ATOM 583 OG SER A 39 -24.234 -14.250 -4.026 1.00 33.34 O ATOM 0 H SER A 39 -23.089 -14.373 -6.172 1.00 21.02 H new ATOM 0 HA SER A 39 -24.863 -12.277 -5.794 1.00 75.12 H new ATOM 0 HB2 SER A 39 -22.501 -13.136 -4.028 1.00 71.41 H new ATOM 0 HB3 SER A 39 -23.932 -12.287 -3.478 1.00 71.41 H new ATOM 0 HG SER A 39 -24.076 -14.576 -3.116 1.00 33.34 H new ATOM 589 N PRO A 40 -23.764 -9.971 -5.909 1.00 33.31 N ATOM 590 CA PRO A 40 -23.123 -8.644 -6.033 1.00 4.24 C ATOM 591 C PRO A 40 -22.179 -8.362 -4.848 1.00 61.43 C ATOM 592 O PRO A 40 -22.641 -8.163 -3.725 1.00 31.02 O ATOM 593 CB PRO A 40 -24.324 -7.652 -6.083 1.00 43.33 C ATOM 594 CG PRO A 40 -25.500 -8.492 -6.489 1.00 51.10 C ATOM 595 CD PRO A 40 -25.248 -9.852 -5.879 1.00 0.34 C ATOM 0 HA PRO A 40 -22.488 -8.560 -6.915 1.00 4.24 H new ATOM 0 HB2 PRO A 40 -24.490 -7.182 -5.113 1.00 43.33 H new ATOM 0 HB3 PRO A 40 -24.145 -6.850 -6.799 1.00 43.33 H new ATOM 0 HG2 PRO A 40 -26.434 -8.064 -6.124 1.00 51.10 H new ATOM 0 HG3 PRO A 40 -25.581 -8.557 -7.574 1.00 51.10 H new ATOM 0 HD2 PRO A 40 -25.636 -9.915 -4.862 1.00 0.34 H new ATOM 0 HD3 PRO A 40 -25.727 -10.645 -6.453 1.00 0.34 H new ATOM 603 N ILE A 41 -20.859 -8.422 -5.119 1.00 75.32 N ATOM 604 CA ILE A 41 -19.801 -8.219 -4.117 1.00 62.22 C ATOM 605 C ILE A 41 -19.814 -6.754 -3.617 1.00 52.23 C ATOM 606 O ILE A 41 -19.498 -5.843 -4.393 1.00 72.11 O ATOM 607 CB ILE A 41 -18.374 -8.581 -4.708 1.00 15.11 C ATOM 608 CG1 ILE A 41 -18.357 -10.037 -5.289 1.00 32.40 C ATOM 609 CG2 ILE A 41 -17.252 -8.396 -3.646 1.00 33.24 C ATOM 610 CD1 ILE A 41 -18.681 -11.146 -4.287 1.00 13.23 C ATOM 0 H ILE A 41 -20.497 -8.615 -6.053 1.00 75.32 H new ATOM 0 HA ILE A 41 -19.999 -8.886 -3.278 1.00 62.22 H new ATOM 0 HB ILE A 41 -18.174 -7.887 -5.525 1.00 15.11 H new ATOM 0 HG12 ILE A 41 -19.073 -10.091 -6.109 1.00 32.40 H new ATOM 0 HG13 ILE A 41 -17.371 -10.230 -5.713 1.00 32.40 H new ATOM 0 HG21 ILE A 41 -16.288 -8.653 -4.086 1.00 33.24 H new ATOM 0 HG22 ILE A 41 -17.234 -7.358 -3.313 1.00 33.24 H new ATOM 0 HG23 ILE A 41 -17.447 -9.047 -2.794 1.00 33.24 H new ATOM 0 HD11 ILE A 41 -18.643 -12.113 -4.789 1.00 13.23 H new ATOM 0 HD12 ILE A 41 -17.952 -11.129 -3.477 1.00 13.23 H new ATOM 0 HD13 ILE A 41 -19.680 -10.988 -3.880 1.00 13.23 H new ATOM 622 N PRO A 42 -20.222 -6.500 -2.331 1.00 61.44 N ATOM 623 CA PRO A 42 -20.240 -5.142 -1.766 1.00 44.23 C ATOM 624 C PRO A 42 -18.853 -4.739 -1.210 1.00 32.15 C ATOM 625 O PRO A 42 -18.198 -5.516 -0.501 1.00 75.50 O ATOM 626 CB PRO A 42 -21.311 -5.256 -0.656 1.00 52.10 C ATOM 627 CG PRO A 42 -21.212 -6.672 -0.158 1.00 33.34 C ATOM 628 CD PRO A 42 -20.688 -7.507 -1.325 1.00 31.31 C ATOM 0 HA PRO A 42 -20.468 -4.366 -2.496 1.00 44.23 H new ATOM 0 HB2 PRO A 42 -21.124 -4.542 0.146 1.00 52.10 H new ATOM 0 HB3 PRO A 42 -22.307 -5.044 -1.046 1.00 52.10 H new ATOM 0 HG2 PRO A 42 -20.540 -6.736 0.698 1.00 33.34 H new ATOM 0 HG3 PRO A 42 -22.185 -7.036 0.173 1.00 33.34 H new ATOM 0 HD2 PRO A 42 -19.874 -8.160 -1.011 1.00 31.31 H new ATOM 0 HD3 PRO A 42 -21.469 -8.147 -1.737 1.00 31.31 H new ATOM 636 N LEU A 43 -18.408 -3.524 -1.558 1.00 30.41 N ATOM 637 CA LEU A 43 -17.128 -2.963 -1.103 1.00 52.35 C ATOM 638 C LEU A 43 -17.417 -1.681 -0.286 1.00 23.01 C ATOM 639 O LEU A 43 -17.496 -0.582 -0.854 1.00 35.44 O ATOM 640 CB LEU A 43 -16.190 -2.690 -2.322 1.00 64.33 C ATOM 641 CG LEU A 43 -15.788 -3.947 -3.173 1.00 73.12 C ATOM 642 CD1 LEU A 43 -14.934 -3.554 -4.401 1.00 40.14 C ATOM 643 CD2 LEU A 43 -15.070 -5.009 -2.305 1.00 33.12 C ATOM 0 H LEU A 43 -18.931 -2.897 -2.169 1.00 30.41 H new ATOM 0 HA LEU A 43 -16.606 -3.673 -0.461 1.00 52.35 H new ATOM 0 HB2 LEU A 43 -16.680 -1.972 -2.979 1.00 64.33 H new ATOM 0 HB3 LEU A 43 -15.279 -2.217 -1.956 1.00 64.33 H new ATOM 0 HG LEU A 43 -16.709 -4.394 -3.547 1.00 73.12 H new ATOM 0 HD11 LEU A 43 -14.675 -4.450 -4.966 1.00 40.14 H new ATOM 0 HD12 LEU A 43 -15.502 -2.876 -5.037 1.00 40.14 H new ATOM 0 HD13 LEU A 43 -14.022 -3.059 -4.067 1.00 40.14 H new ATOM 0 HD21 LEU A 43 -14.805 -5.866 -2.924 1.00 33.12 H new ATOM 0 HD22 LEU A 43 -14.165 -4.578 -1.876 1.00 33.12 H new ATOM 0 HD23 LEU A 43 -15.733 -5.332 -1.503 1.00 33.12 H new ATOM 655 N PRO A 44 -17.620 -1.812 1.071 1.00 31.55 N ATOM 656 CA PRO A 44 -18.028 -0.687 1.952 1.00 34.23 C ATOM 657 C PRO A 44 -16.829 0.198 2.370 1.00 30.43 C ATOM 658 O PRO A 44 -16.584 0.421 3.565 1.00 54.44 O ATOM 659 CB PRO A 44 -18.665 -1.437 3.151 1.00 72.13 C ATOM 660 CG PRO A 44 -17.861 -2.699 3.276 1.00 44.30 C ATOM 661 CD PRO A 44 -17.464 -3.078 1.856 1.00 32.22 C ATOM 0 HA PRO A 44 -18.705 0.022 1.475 1.00 34.23 H new ATOM 0 HB2 PRO A 44 -18.614 -0.842 4.063 1.00 72.13 H new ATOM 0 HB3 PRO A 44 -19.718 -1.654 2.970 1.00 72.13 H new ATOM 0 HG2 PRO A 44 -16.981 -2.542 3.900 1.00 44.30 H new ATOM 0 HG3 PRO A 44 -18.446 -3.491 3.743 1.00 44.30 H new ATOM 0 HD2 PRO A 44 -16.439 -3.446 1.816 1.00 32.22 H new ATOM 0 HD3 PRO A 44 -18.102 -3.869 1.463 1.00 32.22 H new ATOM 669 N ASN A 45 -16.124 0.741 1.369 1.00 65.40 N ATOM 670 CA ASN A 45 -14.901 1.537 1.568 1.00 30.34 C ATOM 671 C ASN A 45 -14.666 2.388 0.316 1.00 62.51 C ATOM 672 O ASN A 45 -14.706 3.624 0.371 1.00 42.15 O ATOM 673 CB ASN A 45 -13.684 0.602 1.845 1.00 3.42 C ATOM 674 CG ASN A 45 -12.373 1.321 2.227 1.00 2.52 C ATOM 675 OD1 ASN A 45 -12.108 2.456 1.840 1.00 63.14 O ATOM 676 ND2 ASN A 45 -11.529 0.646 2.984 1.00 74.23 N ATOM 0 H ASN A 45 -16.387 0.641 0.389 1.00 65.40 H new ATOM 0 HA ASN A 45 -15.016 2.190 2.433 1.00 30.34 H new ATOM 0 HB2 ASN A 45 -13.950 -0.085 2.649 1.00 3.42 H new ATOM 0 HB3 ASN A 45 -13.502 -0.003 0.957 1.00 3.42 H new ATOM 0 HD21 ASN A 45 -10.640 1.066 3.257 1.00 74.23 H new ATOM 0 HD22 ASN A 45 -11.765 -0.296 3.297 1.00 74.23 H new ATOM 683 N VAL A 46 -14.453 1.703 -0.821 1.00 61.32 N ATOM 684 CA VAL A 46 -14.161 2.359 -2.101 1.00 64.22 C ATOM 685 C VAL A 46 -15.470 2.895 -2.733 1.00 32.25 C ATOM 686 O VAL A 46 -16.446 2.152 -2.908 1.00 34.14 O ATOM 687 CB VAL A 46 -13.381 1.387 -3.075 1.00 21.02 C ATOM 688 CG1 VAL A 46 -14.176 0.107 -3.408 1.00 40.41 C ATOM 689 CG2 VAL A 46 -12.928 2.115 -4.360 1.00 75.21 C ATOM 0 H VAL A 46 -14.479 0.685 -0.876 1.00 61.32 H new ATOM 0 HA VAL A 46 -13.505 3.211 -1.921 1.00 64.22 H new ATOM 0 HB VAL A 46 -12.489 1.067 -2.536 1.00 21.02 H new ATOM 0 HG11 VAL A 46 -13.590 -0.521 -4.080 1.00 40.41 H new ATOM 0 HG12 VAL A 46 -14.385 -0.441 -2.489 1.00 40.41 H new ATOM 0 HG13 VAL A 46 -15.115 0.377 -3.891 1.00 40.41 H new ATOM 0 HG21 VAL A 46 -12.395 1.416 -5.005 1.00 75.21 H new ATOM 0 HG22 VAL A 46 -13.801 2.502 -4.886 1.00 75.21 H new ATOM 0 HG23 VAL A 46 -12.268 2.941 -4.097 1.00 75.21 H new ATOM 699 N THR A 47 -15.488 4.206 -3.028 1.00 52.11 N ATOM 700 CA THR A 47 -16.659 4.908 -3.585 1.00 40.14 C ATOM 701 C THR A 47 -16.814 4.603 -5.088 1.00 61.34 C ATOM 702 O THR A 47 -15.960 3.934 -5.675 1.00 74.44 O ATOM 703 CB THR A 47 -16.525 6.445 -3.349 1.00 3.01 C ATOM 704 OG1 THR A 47 -15.334 6.922 -3.991 1.00 25.32 O ATOM 705 CG2 THR A 47 -16.477 6.799 -1.849 1.00 24.53 C ATOM 0 H THR A 47 -14.682 4.815 -2.885 1.00 52.11 H new ATOM 0 HA THR A 47 -17.553 4.552 -3.073 1.00 40.14 H new ATOM 0 HB THR A 47 -17.406 6.925 -3.774 1.00 3.01 H new ATOM 0 HG1 THR A 47 -15.248 7.887 -3.846 1.00 25.32 H new ATOM 0 HG21 THR A 47 -16.383 7.879 -1.733 1.00 24.53 H new ATOM 0 HG22 THR A 47 -17.393 6.460 -1.366 1.00 24.53 H new ATOM 0 HG23 THR A 47 -15.620 6.309 -1.387 1.00 24.53 H new ATOM 713 N SER A 48 -17.907 5.102 -5.698 1.00 23.32 N ATOM 714 CA SER A 48 -18.239 4.814 -7.104 1.00 30.51 C ATOM 715 C SER A 48 -17.196 5.391 -8.069 1.00 50.45 C ATOM 716 O SER A 48 -16.734 4.693 -8.964 1.00 21.14 O ATOM 717 CB SER A 48 -19.641 5.346 -7.447 1.00 43.42 C ATOM 718 OG SER A 48 -19.747 6.742 -7.220 1.00 2.13 O ATOM 0 H SER A 48 -18.579 5.712 -5.232 1.00 23.32 H new ATOM 0 HA SER A 48 -18.232 3.731 -7.225 1.00 30.51 H new ATOM 0 HB2 SER A 48 -19.866 5.130 -8.491 1.00 43.42 H new ATOM 0 HB3 SER A 48 -20.385 4.823 -6.846 1.00 43.42 H new ATOM 0 HG SER A 48 -20.571 6.931 -6.725 1.00 2.13 H new ATOM 724 N THR A 49 -16.822 6.659 -7.845 1.00 15.23 N ATOM 725 CA THR A 49 -15.857 7.383 -8.688 1.00 5.33 C ATOM 726 C THR A 49 -14.481 6.695 -8.676 1.00 51.23 C ATOM 727 O THR A 49 -13.852 6.519 -9.722 1.00 71.31 O ATOM 728 CB THR A 49 -15.706 8.858 -8.200 1.00 44.14 C ATOM 729 OG1 THR A 49 -15.375 8.864 -6.805 1.00 45.33 O ATOM 730 CG2 THR A 49 -16.992 9.676 -8.424 1.00 73.31 C ATOM 0 H THR A 49 -17.182 7.215 -7.069 1.00 15.23 H new ATOM 0 HA THR A 49 -16.240 7.376 -9.708 1.00 5.33 H new ATOM 0 HB THR A 49 -14.911 9.323 -8.784 1.00 44.14 H new ATOM 0 HG1 THR A 49 -15.278 9.789 -6.496 1.00 45.33 H new ATOM 0 HG21 THR A 49 -16.841 10.696 -8.070 1.00 73.31 H new ATOM 0 HG22 THR A 49 -17.232 9.693 -9.487 1.00 73.31 H new ATOM 0 HG23 THR A 49 -17.814 9.219 -7.874 1.00 73.31 H new ATOM 738 N ILE A 50 -14.046 6.285 -7.477 1.00 2.12 N ATOM 739 CA ILE A 50 -12.725 5.688 -7.266 1.00 15.25 C ATOM 740 C ILE A 50 -12.685 4.258 -7.835 1.00 12.11 C ATOM 741 O ILE A 50 -11.741 3.906 -8.542 1.00 32.13 O ATOM 742 CB ILE A 50 -12.345 5.719 -5.739 1.00 73.33 C ATOM 743 CG1 ILE A 50 -12.369 7.189 -5.206 1.00 42.25 C ATOM 744 CG2 ILE A 50 -10.972 5.065 -5.474 1.00 71.50 C ATOM 745 CD1 ILE A 50 -11.445 8.153 -5.943 1.00 4.30 C ATOM 0 H ILE A 50 -14.603 6.359 -6.626 1.00 2.12 H new ATOM 0 HA ILE A 50 -11.980 6.277 -7.802 1.00 15.25 H new ATOM 0 HB ILE A 50 -13.090 5.134 -5.200 1.00 73.33 H new ATOM 0 HG12 ILE A 50 -13.390 7.567 -5.269 1.00 42.25 H new ATOM 0 HG13 ILE A 50 -12.096 7.182 -4.151 1.00 42.25 H new ATOM 0 HG21 ILE A 50 -10.748 5.108 -4.408 1.00 71.50 H new ATOM 0 HG22 ILE A 50 -10.996 4.025 -5.798 1.00 71.50 H new ATOM 0 HG23 ILE A 50 -10.201 5.600 -6.028 1.00 71.50 H new ATOM 0 HD11 ILE A 50 -11.530 9.147 -5.503 1.00 4.30 H new ATOM 0 HD12 ILE A 50 -10.415 7.806 -5.859 1.00 4.30 H new ATOM 0 HD13 ILE A 50 -11.728 8.196 -6.995 1.00 4.30 H new ATOM 757 N LEU A 51 -13.746 3.466 -7.562 1.00 31.40 N ATOM 758 CA LEU A 51 -13.859 2.073 -8.053 1.00 62.44 C ATOM 759 C LEU A 51 -13.960 2.037 -9.593 1.00 4.20 C ATOM 760 O LEU A 51 -13.427 1.126 -10.226 1.00 35.34 O ATOM 761 CB LEU A 51 -15.075 1.341 -7.402 1.00 23.25 C ATOM 762 CG LEU A 51 -15.184 -0.197 -7.687 1.00 50.12 C ATOM 763 CD1 LEU A 51 -13.928 -0.956 -7.190 1.00 41.21 C ATOM 764 CD2 LEU A 51 -16.474 -0.798 -7.081 1.00 3.33 C ATOM 0 H LEU A 51 -14.541 3.770 -7.001 1.00 31.40 H new ATOM 0 HA LEU A 51 -12.953 1.544 -7.759 1.00 62.44 H new ATOM 0 HB2 LEU A 51 -15.027 1.488 -6.323 1.00 23.25 H new ATOM 0 HB3 LEU A 51 -15.990 1.820 -7.749 1.00 23.25 H new ATOM 0 HG LEU A 51 -15.240 -0.321 -8.768 1.00 50.12 H new ATOM 0 HD11 LEU A 51 -14.037 -2.019 -7.403 1.00 41.21 H new ATOM 0 HD12 LEU A 51 -13.045 -0.572 -7.701 1.00 41.21 H new ATOM 0 HD13 LEU A 51 -13.817 -0.811 -6.115 1.00 41.21 H new ATOM 0 HD21 LEU A 51 -16.515 -1.865 -7.299 1.00 3.33 H new ATOM 0 HD22 LEU A 51 -16.473 -0.648 -6.001 1.00 3.33 H new ATOM 0 HD23 LEU A 51 -17.344 -0.305 -7.515 1.00 3.33 H new ATOM 776 N GLU A 52 -14.617 3.061 -10.172 1.00 15.12 N ATOM 777 CA GLU A 52 -14.730 3.251 -11.635 1.00 5.34 C ATOM 778 C GLU A 52 -13.324 3.325 -12.261 1.00 52.44 C ATOM 779 O GLU A 52 -13.016 2.589 -13.208 1.00 54.34 O ATOM 780 CB GLU A 52 -15.563 4.542 -11.916 1.00 54.33 C ATOM 781 CG GLU A 52 -15.855 4.879 -13.407 1.00 45.44 C ATOM 782 CD GLU A 52 -14.727 5.646 -14.148 1.00 41.21 C ATOM 783 OE1 GLU A 52 -14.020 5.051 -14.996 1.00 63.11 O ATOM 784 OE2 GLU A 52 -14.556 6.853 -13.886 1.00 55.42 O ATOM 0 H GLU A 52 -15.089 3.787 -9.634 1.00 15.12 H new ATOM 0 HA GLU A 52 -15.246 2.406 -12.091 1.00 5.34 H new ATOM 0 HB2 GLU A 52 -16.516 4.451 -11.395 1.00 54.33 H new ATOM 0 HB3 GLU A 52 -15.038 5.388 -11.473 1.00 54.33 H new ATOM 0 HG2 GLU A 52 -16.050 3.949 -13.941 1.00 45.44 H new ATOM 0 HG3 GLU A 52 -16.768 5.473 -13.456 1.00 45.44 H new ATOM 791 N LYS A 53 -12.480 4.197 -11.669 1.00 2.12 N ATOM 792 CA LYS A 53 -11.092 4.418 -12.108 1.00 65.25 C ATOM 793 C LYS A 53 -10.257 3.130 -11.988 1.00 44.11 C ATOM 794 O LYS A 53 -9.547 2.749 -12.924 1.00 71.51 O ATOM 795 CB LYS A 53 -10.424 5.524 -11.250 1.00 74.34 C ATOM 796 CG LYS A 53 -11.085 6.912 -11.314 1.00 73.41 C ATOM 797 CD LYS A 53 -10.330 7.944 -10.447 1.00 30.42 C ATOM 798 CE LYS A 53 -11.022 9.304 -10.393 1.00 32.23 C ATOM 799 NZ LYS A 53 -11.242 9.876 -11.751 1.00 52.14 N ATOM 0 H LYS A 53 -12.748 4.769 -10.868 1.00 2.12 H new ATOM 0 HA LYS A 53 -11.126 4.726 -13.153 1.00 65.25 H new ATOM 0 HB2 LYS A 53 -10.414 5.195 -10.211 1.00 74.34 H new ATOM 0 HB3 LYS A 53 -9.385 5.623 -11.563 1.00 74.34 H new ATOM 0 HG2 LYS A 53 -11.112 7.255 -12.348 1.00 73.41 H new ATOM 0 HG3 LYS A 53 -12.119 6.839 -10.976 1.00 73.41 H new ATOM 0 HD2 LYS A 53 -10.230 7.554 -9.434 1.00 30.42 H new ATOM 0 HD3 LYS A 53 -9.322 8.072 -10.841 1.00 30.42 H new ATOM 0 HE2 LYS A 53 -11.980 9.203 -9.883 1.00 32.23 H new ATOM 0 HE3 LYS A 53 -10.419 9.994 -9.803 1.00 32.23 H new ATOM 0 HZ1 LYS A 53 -11.636 10.834 -11.664 1.00 52.14 H new ATOM 0 HZ2 LYS A 53 -10.336 9.919 -12.261 1.00 52.14 H new ATOM 0 HZ3 LYS A 53 -11.907 9.274 -12.277 1.00 52.14 H new ATOM 813 N VAL A 54 -10.362 2.484 -10.809 1.00 63.32 N ATOM 814 CA VAL A 54 -9.572 1.294 -10.456 1.00 71.23 C ATOM 815 C VAL A 54 -9.811 0.153 -11.464 1.00 71.34 C ATOM 816 O VAL A 54 -8.855 -0.406 -12.009 1.00 23.31 O ATOM 817 CB VAL A 54 -9.891 0.821 -8.977 1.00 33.31 C ATOM 818 CG1 VAL A 54 -9.277 -0.561 -8.669 1.00 13.15 C ATOM 819 CG2 VAL A 54 -9.401 1.869 -7.943 1.00 52.30 C ATOM 0 H VAL A 54 -11.003 2.778 -10.072 1.00 63.32 H new ATOM 0 HA VAL A 54 -8.517 1.566 -10.502 1.00 71.23 H new ATOM 0 HB VAL A 54 -10.974 0.728 -8.898 1.00 33.31 H new ATOM 0 HG11 VAL A 54 -9.520 -0.847 -7.646 1.00 13.15 H new ATOM 0 HG12 VAL A 54 -9.683 -1.301 -9.359 1.00 13.15 H new ATOM 0 HG13 VAL A 54 -8.194 -0.512 -8.785 1.00 13.15 H new ATOM 0 HG21 VAL A 54 -9.631 1.522 -6.936 1.00 52.30 H new ATOM 0 HG22 VAL A 54 -8.324 2.003 -8.043 1.00 52.30 H new ATOM 0 HG23 VAL A 54 -9.903 2.820 -8.123 1.00 52.30 H new ATOM 829 N LEU A 55 -11.094 -0.129 -11.741 1.00 41.22 N ATOM 830 CA LEU A 55 -11.504 -1.244 -12.617 1.00 44.13 C ATOM 831 C LEU A 55 -11.170 -0.968 -14.097 1.00 33.11 C ATOM 832 O LEU A 55 -10.912 -1.905 -14.869 1.00 3.12 O ATOM 833 CB LEU A 55 -13.019 -1.535 -12.438 1.00 53.44 C ATOM 834 CG LEU A 55 -13.469 -1.942 -10.994 1.00 74.53 C ATOM 835 CD1 LEU A 55 -14.967 -2.303 -10.963 1.00 64.32 C ATOM 836 CD2 LEU A 55 -12.594 -3.082 -10.416 1.00 1.03 C ATOM 0 H LEU A 55 -11.877 0.407 -11.366 1.00 41.22 H new ATOM 0 HA LEU A 55 -10.936 -2.126 -12.321 1.00 44.13 H new ATOM 0 HB2 LEU A 55 -13.578 -0.648 -12.736 1.00 53.44 H new ATOM 0 HB3 LEU A 55 -13.300 -2.334 -13.124 1.00 53.44 H new ATOM 0 HG LEU A 55 -13.323 -1.075 -10.349 1.00 74.53 H new ATOM 0 HD11 LEU A 55 -15.253 -2.582 -9.949 1.00 64.32 H new ATOM 0 HD12 LEU A 55 -15.555 -1.443 -11.283 1.00 64.32 H new ATOM 0 HD13 LEU A 55 -15.154 -3.140 -11.636 1.00 64.32 H new ATOM 0 HD21 LEU A 55 -12.940 -3.334 -9.413 1.00 1.03 H new ATOM 0 HD22 LEU A 55 -12.670 -3.960 -11.057 1.00 1.03 H new ATOM 0 HD23 LEU A 55 -11.555 -2.756 -10.370 1.00 1.03 H new ATOM 848 N ASP A 56 -11.170 0.328 -14.472 1.00 1.11 N ATOM 849 CA ASP A 56 -10.841 0.773 -15.841 1.00 71.41 C ATOM 850 C ASP A 56 -9.321 0.604 -16.086 1.00 50.22 C ATOM 851 O ASP A 56 -8.893 0.171 -17.162 1.00 73.31 O ATOM 852 CB ASP A 56 -11.278 2.261 -16.044 1.00 1.12 C ATOM 853 CG ASP A 56 -11.525 2.654 -17.519 1.00 3.02 C ATOM 854 OD1 ASP A 56 -12.595 3.229 -17.833 1.00 53.13 O ATOM 855 OD2 ASP A 56 -10.672 2.377 -18.387 1.00 15.23 O ATOM 0 H ASP A 56 -11.397 1.093 -13.836 1.00 1.11 H new ATOM 0 HA ASP A 56 -11.382 0.162 -16.563 1.00 71.41 H new ATOM 0 HB2 ASP A 56 -12.190 2.441 -15.474 1.00 1.12 H new ATOM 0 HB3 ASP A 56 -10.509 2.913 -15.630 1.00 1.12 H new ATOM 860 N TYR A 57 -8.519 0.931 -15.054 1.00 2.22 N ATOM 861 CA TYR A 57 -7.046 0.811 -15.101 1.00 13.50 C ATOM 862 C TYR A 57 -6.615 -0.661 -15.072 1.00 75.50 C ATOM 863 O TYR A 57 -5.637 -1.040 -15.735 1.00 61.40 O ATOM 864 CB TYR A 57 -6.400 1.582 -13.926 1.00 13.12 C ATOM 865 CG TYR A 57 -4.857 1.577 -13.932 1.00 71.41 C ATOM 866 CD1 TYR A 57 -4.125 0.749 -13.070 1.00 12.02 C ATOM 867 CD2 TYR A 57 -4.135 2.387 -14.817 1.00 51.33 C ATOM 868 CE1 TYR A 57 -2.743 0.734 -13.087 1.00 12.42 C ATOM 869 CE2 TYR A 57 -2.752 2.375 -14.831 1.00 33.21 C ATOM 870 CZ TYR A 57 -2.062 1.547 -13.967 1.00 53.20 C ATOM 871 OH TYR A 57 -0.684 1.524 -13.986 1.00 21.21 O ATOM 0 H TYR A 57 -8.872 1.285 -14.165 1.00 2.22 H new ATOM 0 HA TYR A 57 -6.702 1.250 -16.038 1.00 13.50 H new ATOM 0 HB2 TYR A 57 -6.748 2.615 -13.950 1.00 13.12 H new ATOM 0 HB3 TYR A 57 -6.749 1.150 -12.988 1.00 13.12 H new ATOM 0 HD1 TYR A 57 -4.652 0.109 -12.378 1.00 12.02 H new ATOM 0 HD2 TYR A 57 -4.667 3.032 -15.500 1.00 51.33 H new ATOM 0 HE1 TYR A 57 -2.199 0.088 -12.414 1.00 12.42 H new ATOM 0 HE2 TYR A 57 -2.212 3.012 -15.516 1.00 33.21 H new ATOM 0 HH TYR A 57 -0.356 2.153 -14.662 1.00 21.21 H new ATOM 881 N CYS A 58 -7.345 -1.478 -14.287 1.00 0.33 N ATOM 882 CA CYS A 58 -7.130 -2.930 -14.229 1.00 33.04 C ATOM 883 C CYS A 58 -7.367 -3.545 -15.620 1.00 21.12 C ATOM 884 O CYS A 58 -6.619 -4.427 -16.044 1.00 33.22 O ATOM 885 CB CYS A 58 -8.048 -3.583 -13.170 1.00 43.32 C ATOM 886 SG CYS A 58 -7.693 -3.077 -11.469 1.00 40.21 S ATOM 0 H CYS A 58 -8.095 -1.148 -13.680 1.00 0.33 H new ATOM 0 HA CYS A 58 -6.099 -3.122 -13.931 1.00 33.04 H new ATOM 0 HB2 CYS A 58 -9.084 -3.337 -13.402 1.00 43.32 H new ATOM 0 HB3 CYS A 58 -7.954 -4.667 -13.242 1.00 43.32 H new ATOM 0 HG CYS A 58 -8.009 -1.826 -11.313 1.00 40.21 H new ATOM 892 N ARG A 59 -8.405 -3.038 -16.333 1.00 43.24 N ATOM 893 CA ARG A 59 -8.701 -3.447 -17.717 1.00 23.43 C ATOM 894 C ARG A 59 -7.533 -3.102 -18.650 1.00 41.11 C ATOM 895 O ARG A 59 -7.089 -3.950 -19.413 1.00 12.43 O ATOM 896 CB ARG A 59 -10.006 -2.791 -18.228 1.00 60.03 C ATOM 897 CG ARG A 59 -10.305 -3.071 -19.721 1.00 50.51 C ATOM 898 CD ARG A 59 -11.626 -2.460 -20.191 1.00 33.34 C ATOM 899 NE ARG A 59 -12.777 -3.052 -19.493 1.00 10.51 N ATOM 900 CZ ARG A 59 -13.736 -2.379 -18.851 1.00 10.15 C ATOM 901 NH1 ARG A 59 -13.715 -1.049 -18.786 1.00 55.42 N ATOM 902 NH2 ARG A 59 -14.721 -3.052 -18.280 1.00 24.21 N ATOM 0 H ARG A 59 -9.051 -2.341 -15.963 1.00 43.24 H new ATOM 0 HA ARG A 59 -8.840 -4.528 -17.718 1.00 23.43 H new ATOM 0 HB2 ARG A 59 -10.841 -3.150 -17.627 1.00 60.03 H new ATOM 0 HB3 ARG A 59 -9.943 -1.713 -18.076 1.00 60.03 H new ATOM 0 HG2 ARG A 59 -9.491 -2.675 -20.329 1.00 50.51 H new ATOM 0 HG3 ARG A 59 -10.331 -4.148 -19.885 1.00 50.51 H new ATOM 0 HD2 ARG A 59 -11.611 -1.384 -20.020 1.00 33.34 H new ATOM 0 HD3 ARG A 59 -11.735 -2.610 -21.265 1.00 33.34 H new ATOM 0 HE ARG A 59 -12.850 -4.069 -19.500 1.00 10.51 H new ATOM 0 HH11 ARG A 59 -12.959 -0.529 -19.231 1.00 55.42 H new ATOM 0 HH12 ARG A 59 -14.455 -0.551 -18.292 1.00 55.42 H new ATOM 0 HH21 ARG A 59 -14.741 -4.070 -18.334 1.00 24.21 H new ATOM 0 HH22 ARG A 59 -15.461 -2.553 -17.786 1.00 24.21 H new ATOM 916 N HIS A 60 -7.037 -1.856 -18.550 1.00 73.24 N ATOM 917 CA HIS A 60 -5.905 -1.357 -19.362 1.00 45.13 C ATOM 918 C HIS A 60 -4.669 -2.268 -19.234 1.00 31.32 C ATOM 919 O HIS A 60 -4.063 -2.667 -20.237 1.00 73.14 O ATOM 920 CB HIS A 60 -5.562 0.091 -18.927 1.00 12.05 C ATOM 921 CG HIS A 60 -4.282 0.639 -19.508 1.00 52.12 C ATOM 922 ND1 HIS A 60 -4.178 1.108 -20.793 1.00 44.45 N ATOM 923 CD2 HIS A 60 -3.050 0.778 -18.964 1.00 5.41 C ATOM 924 CE1 HIS A 60 -2.942 1.507 -21.013 1.00 13.21 C ATOM 925 NE2 HIS A 60 -2.236 1.317 -19.918 1.00 32.23 N ATOM 0 H HIS A 60 -7.409 -1.162 -17.902 1.00 73.24 H new ATOM 0 HA HIS A 60 -6.202 -1.363 -20.411 1.00 45.13 H new ATOM 0 HB2 HIS A 60 -6.385 0.746 -19.214 1.00 12.05 H new ATOM 0 HB3 HIS A 60 -5.494 0.122 -17.840 1.00 12.05 H new ATOM 0 HD2 HIS A 60 -2.763 0.511 -17.958 1.00 5.41 H new ATOM 0 HE1 HIS A 60 -2.570 1.921 -21.938 1.00 13.21 H new ATOM 0 HE2 HIS A 60 -1.247 1.536 -19.802 1.00 32.23 H new ATOM 934 N HIS A 61 -4.324 -2.590 -17.979 1.00 55.45 N ATOM 935 CA HIS A 61 -3.160 -3.422 -17.652 1.00 35.42 C ATOM 936 C HIS A 61 -3.441 -4.913 -17.966 1.00 54.51 C ATOM 937 O HIS A 61 -2.516 -5.714 -18.038 1.00 54.25 O ATOM 938 CB HIS A 61 -2.787 -3.228 -16.155 1.00 21.32 C ATOM 939 CG HIS A 61 -1.431 -3.774 -15.763 1.00 13.31 C ATOM 940 ND1 HIS A 61 -1.158 -5.124 -15.653 1.00 43.32 N ATOM 941 CD2 HIS A 61 -0.265 -3.141 -15.472 1.00 73.13 C ATOM 942 CE1 HIS A 61 0.103 -5.295 -15.313 1.00 71.31 C ATOM 943 NE2 HIS A 61 0.665 -4.112 -15.199 1.00 52.42 N ATOM 0 H HIS A 61 -4.847 -2.279 -17.160 1.00 55.45 H new ATOM 0 HA HIS A 61 -2.317 -3.111 -18.269 1.00 35.42 H new ATOM 0 HB2 HIS A 61 -2.815 -2.163 -15.923 1.00 21.32 H new ATOM 0 HB3 HIS A 61 -3.548 -3.708 -15.540 1.00 21.32 H new ATOM 0 HD2 HIS A 61 -0.101 -2.074 -15.458 1.00 73.13 H new ATOM 0 HE1 HIS A 61 0.592 -6.245 -15.155 1.00 71.31 H new ATOM 0 HE2 HIS A 61 1.639 -3.943 -14.947 1.00 52.42 H new ATOM 952 N HIS A 62 -4.727 -5.282 -18.122 1.00 31.50 N ATOM 953 CA HIS A 62 -5.126 -6.654 -18.498 1.00 24.20 C ATOM 954 C HIS A 62 -4.986 -6.849 -20.015 1.00 23.11 C ATOM 955 O HIS A 62 -4.551 -7.905 -20.470 1.00 44.25 O ATOM 956 CB HIS A 62 -6.585 -6.937 -18.055 1.00 3.35 C ATOM 957 CG HIS A 62 -6.980 -8.390 -18.111 1.00 63.42 C ATOM 958 ND1 HIS A 62 -6.953 -9.215 -17.006 1.00 65.42 N ATOM 959 CD2 HIS A 62 -7.423 -9.158 -19.131 1.00 65.11 C ATOM 960 CE1 HIS A 62 -7.353 -10.419 -17.352 1.00 65.33 C ATOM 961 NE2 HIS A 62 -7.644 -10.407 -18.630 1.00 40.44 N ATOM 0 H HIS A 62 -5.513 -4.645 -17.993 1.00 31.50 H new ATOM 0 HA HIS A 62 -4.467 -7.358 -17.989 1.00 24.20 H new ATOM 0 HB2 HIS A 62 -6.719 -6.575 -17.036 1.00 3.35 H new ATOM 0 HB3 HIS A 62 -7.262 -6.364 -18.688 1.00 3.35 H new ATOM 0 HD1 HIS A 62 -6.668 -8.935 -16.068 1.00 65.42 H new ATOM 0 HD2 HIS A 62 -7.574 -8.842 -20.153 1.00 65.11 H new ATOM 0 HE1 HIS A 62 -7.429 -11.273 -16.695 1.00 65.33 H new ATOM 0 HE2 HIS A 62 -7.983 -11.206 -19.166 1.00 40.44 H new ATOM 970 N GLN A 63 -5.375 -5.810 -20.780 1.00 43.35 N ATOM 971 CA GLN A 63 -5.335 -5.826 -22.257 1.00 1.22 C ATOM 972 C GLN A 63 -3.891 -5.657 -22.751 1.00 50.22 C ATOM 973 O GLN A 63 -3.531 -6.121 -23.839 1.00 64.25 O ATOM 974 CB GLN A 63 -6.246 -4.706 -22.842 1.00 10.43 C ATOM 975 CG GLN A 63 -7.720 -4.749 -22.378 1.00 51.52 C ATOM 976 CD GLN A 63 -8.409 -6.099 -22.603 1.00 34.21 C ATOM 977 OE1 GLN A 63 -8.389 -6.979 -21.736 1.00 62.22 O ATOM 978 NE2 GLN A 63 -9.032 -6.268 -23.757 1.00 32.13 N ATOM 0 H GLN A 63 -5.726 -4.935 -20.391 1.00 43.35 H new ATOM 0 HA GLN A 63 -5.711 -6.788 -22.603 1.00 1.22 H new ATOM 0 HB2 GLN A 63 -5.824 -3.738 -22.571 1.00 10.43 H new ATOM 0 HB3 GLN A 63 -6.222 -4.771 -23.930 1.00 10.43 H new ATOM 0 HG2 GLN A 63 -7.763 -4.504 -21.317 1.00 51.52 H new ATOM 0 HG3 GLN A 63 -8.278 -3.976 -22.906 1.00 51.52 H new ATOM 0 HE21 GLN A 63 -9.030 -5.521 -24.452 1.00 32.13 H new ATOM 0 HE22 GLN A 63 -9.515 -7.145 -23.952 1.00 32.13 H new ATOM 987 N HIS A 64 -3.068 -4.975 -21.935 1.00 34.35 N ATOM 988 CA HIS A 64 -1.623 -4.821 -22.166 1.00 72.33 C ATOM 989 C HIS A 64 -0.869 -5.329 -20.909 1.00 10.45 C ATOM 990 O HIS A 64 -0.407 -4.523 -20.089 1.00 73.20 O ATOM 991 CB HIS A 64 -1.275 -3.334 -22.497 1.00 24.12 C ATOM 992 CG HIS A 64 -1.959 -2.795 -23.740 1.00 54.14 C ATOM 993 ND1 HIS A 64 -1.331 -2.689 -24.968 1.00 4.30 N ATOM 994 CD2 HIS A 64 -3.221 -2.330 -23.938 1.00 10.21 C ATOM 995 CE1 HIS A 64 -2.171 -2.190 -25.852 1.00 1.11 C ATOM 996 NE2 HIS A 64 -3.322 -1.966 -25.257 1.00 62.21 N ATOM 0 H HIS A 64 -3.393 -4.510 -21.087 1.00 34.35 H new ATOM 0 HA HIS A 64 -1.312 -5.413 -23.027 1.00 72.33 H new ATOM 0 HB2 HIS A 64 -1.550 -2.711 -21.646 1.00 24.12 H new ATOM 0 HB3 HIS A 64 -0.196 -3.245 -22.623 1.00 24.12 H new ATOM 0 HD2 HIS A 64 -4.001 -2.260 -23.194 1.00 10.21 H new ATOM 0 HE1 HIS A 64 -1.951 -1.997 -26.892 1.00 1.11 H new ATOM 0 HE2 HIS A 64 -4.155 -1.583 -25.704 1.00 62.21 H new ATOM 1005 N PRO A 65 -0.780 -6.693 -20.704 1.00 15.25 N ATOM 1006 CA PRO A 65 -0.145 -7.300 -19.513 1.00 71.34 C ATOM 1007 C PRO A 65 1.326 -7.692 -19.754 1.00 63.14 C ATOM 1008 O PRO A 65 1.850 -8.593 -19.085 1.00 14.20 O ATOM 1009 CB PRO A 65 -1.047 -8.536 -19.299 1.00 55.51 C ATOM 1010 CG PRO A 65 -1.403 -8.997 -20.693 1.00 0.23 C ATOM 1011 CD PRO A 65 -1.288 -7.774 -21.605 1.00 23.04 C ATOM 0 HA PRO A 65 -0.084 -6.629 -18.656 1.00 71.34 H new ATOM 0 HB2 PRO A 65 -0.525 -9.316 -18.745 1.00 55.51 H new ATOM 0 HB3 PRO A 65 -1.939 -8.281 -18.726 1.00 55.51 H new ATOM 0 HG2 PRO A 65 -0.730 -9.789 -21.022 1.00 0.23 H new ATOM 0 HG3 PRO A 65 -2.413 -9.405 -20.719 1.00 0.23 H new ATOM 0 HD2 PRO A 65 -0.603 -7.957 -22.433 1.00 23.04 H new ATOM 0 HD3 PRO A 65 -2.252 -7.510 -22.041 1.00 23.04 H new ATOM 1019 N GLY A 66 1.976 -6.999 -20.714 1.00 62.42 N ATOM 1020 CA GLY A 66 3.383 -7.235 -21.034 1.00 53.02 C ATOM 1021 C GLY A 66 4.307 -6.835 -19.890 1.00 74.11 C ATOM 1022 O GLY A 66 4.959 -7.696 -19.280 1.00 34.10 O ATOM 0 H GLY A 66 1.538 -6.270 -21.278 1.00 62.42 H new ATOM 0 HA2 GLY A 66 3.529 -8.290 -21.265 1.00 53.02 H new ATOM 0 HA3 GLY A 66 3.650 -6.672 -21.929 1.00 53.02 H new ATOM 1026 N GLY A 67 4.364 -5.514 -19.611 1.00 4.25 N ATOM 1027 CA GLY A 67 5.160 -4.966 -18.500 1.00 34.03 C ATOM 1028 C GLY A 67 6.676 -5.015 -18.724 1.00 62.34 C ATOM 1029 O GLY A 67 7.440 -4.555 -17.868 1.00 2.43 O ATOM 0 H GLY A 67 3.862 -4.806 -20.147 1.00 4.25 H new ATOM 0 HA2 GLY A 67 4.863 -3.931 -18.332 1.00 34.03 H new ATOM 0 HA3 GLY A 67 4.921 -5.518 -17.591 1.00 34.03 H new ATOM 1033 N SER A 68 7.105 -5.564 -19.875 1.00 52.42 N ATOM 1034 CA SER A 68 8.522 -5.726 -20.230 1.00 44.32 C ATOM 1035 C SER A 68 9.061 -4.410 -20.826 1.00 42.13 C ATOM 1036 O SER A 68 9.249 -4.274 -22.045 1.00 53.50 O ATOM 1037 CB SER A 68 8.663 -6.925 -21.208 1.00 34.12 C ATOM 1038 OG SER A 68 7.733 -6.828 -22.282 1.00 32.20 O ATOM 0 H SER A 68 6.468 -5.911 -20.592 1.00 52.42 H new ATOM 0 HA SER A 68 9.120 -5.945 -19.346 1.00 44.32 H new ATOM 0 HB2 SER A 68 9.678 -6.956 -21.604 1.00 34.12 H new ATOM 0 HB3 SER A 68 8.503 -7.858 -20.668 1.00 34.12 H new ATOM 0 HG SER A 68 7.792 -5.937 -22.686 1.00 32.20 H new ATOM 1044 N GLY A 69 9.230 -3.416 -19.938 1.00 32.10 N ATOM 1045 CA GLY A 69 9.624 -2.065 -20.312 1.00 74.04 C ATOM 1046 C GLY A 69 8.424 -1.187 -20.691 1.00 13.04 C ATOM 1047 O GLY A 69 8.316 -0.054 -20.217 1.00 53.23 O ATOM 0 H GLY A 69 9.094 -3.538 -18.935 1.00 32.10 H new ATOM 0 HA2 GLY A 69 10.160 -1.604 -19.483 1.00 74.04 H new ATOM 0 HA3 GLY A 69 10.316 -2.111 -21.153 1.00 74.04 H new ATOM 1051 N LEU A 70 7.532 -1.734 -21.566 1.00 65.53 N ATOM 1052 CA LEU A 70 6.363 -1.040 -22.181 1.00 43.03 C ATOM 1053 C LEU A 70 6.718 0.340 -22.773 1.00 75.23 C ATOM 1054 O LEU A 70 5.840 1.189 -22.955 1.00 15.01 O ATOM 1055 CB LEU A 70 5.084 -1.038 -21.246 1.00 63.12 C ATOM 1056 CG LEU A 70 5.171 -0.428 -19.783 1.00 42.41 C ATOM 1057 CD1 LEU A 70 5.231 1.121 -19.770 1.00 31.42 C ATOM 1058 CD2 LEU A 70 4.003 -0.932 -18.893 1.00 14.52 C ATOM 0 H LEU A 70 7.610 -2.704 -21.873 1.00 65.53 H new ATOM 0 HA LEU A 70 6.075 -1.641 -23.044 1.00 43.03 H new ATOM 0 HB2 LEU A 70 4.297 -0.501 -21.775 1.00 63.12 H new ATOM 0 HB3 LEU A 70 4.753 -2.072 -21.147 1.00 63.12 H new ATOM 0 HG LEU A 70 6.113 -0.784 -19.366 1.00 42.41 H new ATOM 0 HD11 LEU A 70 5.289 1.474 -18.740 1.00 31.42 H new ATOM 0 HD12 LEU A 70 6.111 1.456 -20.319 1.00 31.42 H new ATOM 0 HD13 LEU A 70 4.335 1.524 -20.242 1.00 31.42 H new ATOM 0 HD21 LEU A 70 4.090 -0.497 -17.897 1.00 14.52 H new ATOM 0 HD22 LEU A 70 3.053 -0.635 -19.337 1.00 14.52 H new ATOM 0 HD23 LEU A 70 4.045 -2.019 -18.819 1.00 14.52 H new ATOM 1070 N ASP A 71 8.008 0.481 -23.173 1.00 60.34 N ATOM 1071 CA ASP A 71 8.605 1.728 -23.686 1.00 74.25 C ATOM 1072 C ASP A 71 8.592 2.827 -22.603 1.00 11.31 C ATOM 1073 O ASP A 71 9.581 3.017 -21.887 1.00 60.42 O ATOM 1074 CB ASP A 71 7.934 2.205 -25.019 1.00 45.14 C ATOM 1075 CG ASP A 71 8.222 1.299 -26.229 1.00 52.54 C ATOM 1076 OD1 ASP A 71 7.871 0.104 -26.182 1.00 13.31 O ATOM 1077 OD2 ASP A 71 8.781 1.785 -27.236 1.00 43.13 O ATOM 0 H ASP A 71 8.673 -0.292 -23.144 1.00 60.34 H new ATOM 0 HA ASP A 71 9.646 1.516 -23.932 1.00 74.25 H new ATOM 0 HB2 ASP A 71 6.856 2.261 -24.870 1.00 45.14 H new ATOM 0 HB3 ASP A 71 8.278 3.214 -25.245 1.00 45.14 H new ATOM 1082 N ASP A 72 7.450 3.507 -22.473 1.00 61.21 N ATOM 1083 CA ASP A 72 7.237 4.612 -21.539 1.00 0.05 C ATOM 1084 C ASP A 72 5.766 4.584 -21.124 1.00 73.15 C ATOM 1085 O ASP A 72 4.943 3.926 -21.787 1.00 43.34 O ATOM 1086 CB ASP A 72 7.584 5.984 -22.197 1.00 3.21 C ATOM 1087 CG ASP A 72 9.094 6.273 -22.293 1.00 13.54 C ATOM 1088 OD1 ASP A 72 9.714 5.962 -23.337 1.00 52.54 O ATOM 1089 OD2 ASP A 72 9.664 6.823 -21.325 1.00 44.44 O ATOM 0 H ASP A 72 6.624 3.296 -23.033 1.00 61.21 H new ATOM 0 HA ASP A 72 7.889 4.497 -20.673 1.00 0.05 H new ATOM 0 HB2 ASP A 72 7.155 6.013 -23.199 1.00 3.21 H new ATOM 0 HB3 ASP A 72 7.109 6.780 -21.624 1.00 3.21 H new ATOM 1094 N ILE A 73 5.443 5.287 -20.037 1.00 54.05 N ATOM 1095 CA ILE A 73 4.063 5.414 -19.545 1.00 54.33 C ATOM 1096 C ILE A 73 3.150 6.044 -20.637 1.00 22.53 C ATOM 1097 O ILE A 73 3.404 7.178 -21.052 1.00 45.44 O ATOM 1098 CB ILE A 73 4.045 6.282 -18.232 1.00 43.35 C ATOM 1099 CG1 ILE A 73 4.809 5.560 -17.073 1.00 61.23 C ATOM 1100 CG2 ILE A 73 2.607 6.648 -17.805 1.00 40.21 C ATOM 1101 CD1 ILE A 73 4.222 4.213 -16.654 1.00 41.15 C ATOM 0 H ILE A 73 6.129 5.786 -19.470 1.00 54.05 H new ATOM 0 HA ILE A 73 3.675 4.422 -19.315 1.00 54.33 H new ATOM 0 HB ILE A 73 4.564 7.215 -18.452 1.00 43.35 H new ATOM 0 HG12 ILE A 73 5.844 5.409 -17.379 1.00 61.23 H new ATOM 0 HG13 ILE A 73 4.826 6.218 -16.204 1.00 61.23 H new ATOM 0 HG21 ILE A 73 2.639 7.247 -16.895 1.00 40.21 H new ATOM 0 HG22 ILE A 73 2.126 7.219 -18.599 1.00 40.21 H new ATOM 0 HG23 ILE A 73 2.039 5.736 -17.619 1.00 40.21 H new ATOM 0 HD11 ILE A 73 4.820 3.791 -15.846 1.00 41.15 H new ATOM 0 HD12 ILE A 73 3.197 4.354 -16.312 1.00 41.15 H new ATOM 0 HD13 ILE A 73 4.230 3.532 -17.505 1.00 41.15 H new ATOM 1113 N PRO A 74 2.116 5.293 -21.155 1.00 10.24 N ATOM 1114 CA PRO A 74 1.161 5.814 -22.174 1.00 32.52 C ATOM 1115 C PRO A 74 0.371 7.065 -21.683 1.00 62.02 C ATOM 1116 O PRO A 74 0.190 7.241 -20.465 1.00 2.00 O ATOM 1117 CB PRO A 74 0.204 4.605 -22.428 1.00 33.42 C ATOM 1118 CG PRO A 74 0.982 3.401 -21.988 1.00 11.33 C ATOM 1119 CD PRO A 74 1.807 3.873 -20.811 1.00 41.24 C ATOM 0 HA PRO A 74 1.675 6.158 -23.072 1.00 32.52 H new ATOM 0 HB2 PRO A 74 -0.721 4.707 -21.861 1.00 33.42 H new ATOM 0 HB3 PRO A 74 -0.073 4.534 -23.480 1.00 33.42 H new ATOM 0 HG2 PRO A 74 0.318 2.585 -21.702 1.00 11.33 H new ATOM 0 HG3 PRO A 74 1.618 3.028 -22.791 1.00 11.33 H new ATOM 0 HD2 PRO A 74 1.253 3.797 -19.875 1.00 41.24 H new ATOM 0 HD3 PRO A 74 2.715 3.281 -20.693 1.00 41.24 H new ATOM 1127 N PRO A 75 -0.104 7.945 -22.634 1.00 43.14 N ATOM 1128 CA PRO A 75 -0.915 9.157 -22.314 1.00 72.24 C ATOM 1129 C PRO A 75 -2.118 8.860 -21.398 1.00 40.03 C ATOM 1130 O PRO A 75 -2.427 9.655 -20.513 1.00 54.21 O ATOM 1131 CB PRO A 75 -1.373 9.655 -23.709 1.00 2.02 C ATOM 1132 CG PRO A 75 -0.290 9.199 -24.637 1.00 32.11 C ATOM 1133 CD PRO A 75 0.155 7.854 -24.100 1.00 52.12 C ATOM 0 HA PRO A 75 -0.340 9.894 -21.753 1.00 72.24 H new ATOM 0 HB2 PRO A 75 -2.339 9.232 -23.986 1.00 2.02 H new ATOM 0 HB3 PRO A 75 -1.483 10.739 -23.728 1.00 2.02 H new ATOM 0 HG2 PRO A 75 -0.658 9.112 -25.659 1.00 32.11 H new ATOM 0 HG3 PRO A 75 0.537 9.909 -24.655 1.00 32.11 H new ATOM 0 HD2 PRO A 75 -0.407 7.038 -24.554 1.00 52.12 H new ATOM 0 HD3 PRO A 75 1.209 7.670 -24.308 1.00 52.12 H new ATOM 1141 N TYR A 76 -2.765 7.692 -21.624 1.00 62.43 N ATOM 1142 CA TYR A 76 -3.902 7.214 -20.802 1.00 25.41 C ATOM 1143 C TYR A 76 -3.550 7.192 -19.303 1.00 51.41 C ATOM 1144 O TYR A 76 -4.299 7.711 -18.484 1.00 45.15 O ATOM 1145 CB TYR A 76 -4.358 5.788 -21.256 1.00 70.52 C ATOM 1146 CG TYR A 76 -5.357 5.102 -20.291 1.00 52.43 C ATOM 1147 CD1 TYR A 76 -4.910 4.228 -19.288 1.00 10.24 C ATOM 1148 CD2 TYR A 76 -6.731 5.362 -20.352 1.00 73.22 C ATOM 1149 CE1 TYR A 76 -5.782 3.653 -18.392 1.00 11.04 C ATOM 1150 CE2 TYR A 76 -7.609 4.771 -19.456 1.00 30.55 C ATOM 1151 CZ TYR A 76 -7.124 3.921 -18.476 1.00 53.33 C ATOM 1152 OH TYR A 76 -7.982 3.349 -17.565 1.00 72.44 O ATOM 0 H TYR A 76 -2.514 7.055 -22.380 1.00 62.43 H new ATOM 0 HA TYR A 76 -4.722 7.916 -20.952 1.00 25.41 H new ATOM 0 HB2 TYR A 76 -4.816 5.862 -22.242 1.00 70.52 H new ATOM 0 HB3 TYR A 76 -3.478 5.154 -21.361 1.00 70.52 H new ATOM 0 HD1 TYR A 76 -3.856 4.001 -19.218 1.00 10.24 H new ATOM 0 HD2 TYR A 76 -7.113 6.032 -21.108 1.00 73.22 H new ATOM 0 HE1 TYR A 76 -5.410 2.992 -17.624 1.00 11.04 H new ATOM 0 HE2 TYR A 76 -8.668 4.973 -19.522 1.00 30.55 H new ATOM 0 HH TYR A 76 -8.814 3.093 -18.015 1.00 72.44 H new ATOM 1162 N ASP A 77 -2.411 6.563 -18.981 1.00 12.31 N ATOM 1163 CA ASP A 77 -1.985 6.289 -17.589 1.00 21.22 C ATOM 1164 C ASP A 77 -1.634 7.586 -16.857 1.00 71.25 C ATOM 1165 O ASP A 77 -1.845 7.705 -15.644 1.00 74.21 O ATOM 1166 CB ASP A 77 -0.772 5.327 -17.590 1.00 22.25 C ATOM 1167 CG ASP A 77 -1.064 3.986 -18.274 1.00 51.32 C ATOM 1168 OD1 ASP A 77 -1.001 2.920 -17.621 1.00 54.40 O ATOM 1169 OD2 ASP A 77 -1.368 3.996 -19.487 1.00 52.43 O ATOM 0 H ASP A 77 -1.750 6.225 -19.680 1.00 12.31 H new ATOM 0 HA ASP A 77 -2.814 5.819 -17.061 1.00 21.22 H new ATOM 0 HB2 ASP A 77 0.066 5.810 -18.094 1.00 22.25 H new ATOM 0 HB3 ASP A 77 -0.462 5.143 -16.561 1.00 22.25 H new ATOM 1174 N ARG A 78 -1.090 8.553 -17.621 1.00 41.34 N ATOM 1175 CA ARG A 78 -0.823 9.912 -17.127 1.00 54.21 C ATOM 1176 C ARG A 78 -2.140 10.607 -16.770 1.00 24.42 C ATOM 1177 O ARG A 78 -2.289 11.145 -15.672 1.00 0.53 O ATOM 1178 CB ARG A 78 -0.035 10.736 -18.184 1.00 5.22 C ATOM 1179 CG ARG A 78 1.388 10.205 -18.435 1.00 23.32 C ATOM 1180 CD ARG A 78 2.177 11.052 -19.447 1.00 63.32 C ATOM 1181 NE ARG A 78 3.594 10.636 -19.553 1.00 41.22 N ATOM 1182 CZ ARG A 78 4.624 11.217 -18.902 1.00 11.54 C ATOM 1183 NH1 ARG A 78 4.421 12.243 -18.077 1.00 0.11 N ATOM 1184 NH2 ARG A 78 5.858 10.762 -19.065 1.00 50.22 N ATOM 0 H ARG A 78 -0.825 8.411 -18.596 1.00 41.34 H new ATOM 0 HA ARG A 78 -0.209 9.844 -16.229 1.00 54.21 H new ATOM 0 HB2 ARG A 78 -0.588 10.731 -19.123 1.00 5.22 H new ATOM 0 HB3 ARG A 78 0.025 11.773 -17.855 1.00 5.22 H new ATOM 0 HG2 ARG A 78 1.931 10.178 -17.491 1.00 23.32 H new ATOM 0 HG3 ARG A 78 1.328 9.179 -18.797 1.00 23.32 H new ATOM 0 HD2 ARG A 78 1.705 10.975 -20.426 1.00 63.32 H new ATOM 0 HD3 ARG A 78 2.131 12.100 -19.153 1.00 63.32 H new ATOM 0 HE ARG A 78 3.809 9.849 -20.166 1.00 41.22 H new ATOM 0 HH11 ARG A 78 3.477 12.600 -17.930 1.00 0.11 H new ATOM 0 HH12 ARG A 78 5.210 12.671 -17.592 1.00 0.11 H new ATOM 0 HH21 ARG A 78 6.032 9.970 -19.684 1.00 50.22 H new ATOM 0 HH22 ARG A 78 6.634 11.204 -18.571 1.00 50.22 H new ATOM 1198 N ASP A 79 -3.102 10.542 -17.706 1.00 23.22 N ATOM 1199 CA ASP A 79 -4.426 11.172 -17.547 1.00 24.33 C ATOM 1200 C ASP A 79 -5.284 10.462 -16.482 1.00 64.22 C ATOM 1201 O ASP A 79 -6.196 11.071 -15.915 1.00 44.32 O ATOM 1202 CB ASP A 79 -5.162 11.267 -18.916 1.00 64.41 C ATOM 1203 CG ASP A 79 -4.604 12.403 -19.804 1.00 20.50 C ATOM 1204 OD1 ASP A 79 -5.056 13.565 -19.651 1.00 40.25 O ATOM 1205 OD2 ASP A 79 -3.695 12.161 -20.620 1.00 11.44 O ATOM 0 H ASP A 79 -2.985 10.052 -18.593 1.00 23.22 H new ATOM 0 HA ASP A 79 -4.264 12.187 -17.184 1.00 24.33 H new ATOM 0 HB2 ASP A 79 -5.068 10.317 -19.443 1.00 64.41 H new ATOM 0 HB3 ASP A 79 -6.225 11.432 -18.744 1.00 64.41 H new ATOM 1210 N PHE A 80 -4.973 9.175 -16.224 1.00 64.32 N ATOM 1211 CA PHE A 80 -5.570 8.392 -15.126 1.00 63.53 C ATOM 1212 C PHE A 80 -5.158 9.001 -13.775 1.00 12.22 C ATOM 1213 O PHE A 80 -5.979 9.131 -12.861 1.00 72.23 O ATOM 1214 CB PHE A 80 -5.122 6.895 -15.217 1.00 53.12 C ATOM 1215 CG PHE A 80 -5.492 6.053 -13.997 1.00 5.43 C ATOM 1216 CD1 PHE A 80 -6.810 5.659 -13.780 1.00 23.32 C ATOM 1217 CD2 PHE A 80 -4.527 5.682 -13.048 1.00 2.21 C ATOM 1218 CE1 PHE A 80 -7.150 4.926 -12.664 1.00 32.35 C ATOM 1219 CE2 PHE A 80 -4.876 4.944 -11.934 1.00 2.45 C ATOM 1220 CZ PHE A 80 -6.189 4.568 -11.741 1.00 1.24 C ATOM 0 H PHE A 80 -4.296 8.648 -16.776 1.00 64.32 H new ATOM 0 HA PHE A 80 -6.656 8.425 -15.212 1.00 63.53 H new ATOM 0 HB2 PHE A 80 -5.571 6.447 -16.103 1.00 53.12 H new ATOM 0 HB3 PHE A 80 -4.041 6.859 -15.355 1.00 53.12 H new ATOM 0 HD1 PHE A 80 -7.573 5.931 -14.494 1.00 23.32 H new ATOM 0 HD2 PHE A 80 -3.498 5.977 -13.191 1.00 2.21 H new ATOM 0 HE1 PHE A 80 -8.177 4.629 -12.510 1.00 32.35 H new ATOM 0 HE2 PHE A 80 -4.122 4.662 -11.215 1.00 2.45 H new ATOM 0 HZ PHE A 80 -6.464 3.994 -10.869 1.00 1.24 H new ATOM 1230 N CYS A 81 -3.874 9.369 -13.688 1.00 24.01 N ATOM 1231 CA CYS A 81 -3.273 9.932 -12.477 1.00 23.35 C ATOM 1232 C CYS A 81 -3.615 11.434 -12.305 1.00 72.22 C ATOM 1233 O CYS A 81 -3.469 11.979 -11.202 1.00 72.14 O ATOM 1234 CB CYS A 81 -1.749 9.711 -12.535 1.00 54.33 C ATOM 1235 SG CYS A 81 -1.268 7.974 -12.648 1.00 12.41 S ATOM 0 H CYS A 81 -3.218 9.283 -14.465 1.00 24.01 H new ATOM 0 HA CYS A 81 -3.686 9.422 -11.607 1.00 23.35 H new ATOM 0 HB2 CYS A 81 -1.346 10.247 -13.395 1.00 54.33 H new ATOM 0 HB3 CYS A 81 -1.294 10.147 -11.646 1.00 54.33 H new ATOM 0 HG CYS A 81 -1.398 7.567 -13.876 1.00 12.41 H new ATOM 1241 N LYS A 82 -4.064 12.100 -13.402 1.00 60.44 N ATOM 1242 CA LYS A 82 -4.529 13.506 -13.358 1.00 71.10 C ATOM 1243 C LYS A 82 -5.938 13.560 -12.737 1.00 43.31 C ATOM 1244 O LYS A 82 -6.950 13.553 -13.445 1.00 51.02 O ATOM 1245 CB LYS A 82 -4.552 14.142 -14.776 1.00 31.12 C ATOM 1246 CG LYS A 82 -3.180 14.246 -15.463 1.00 34.11 C ATOM 1247 CD LYS A 82 -3.303 14.732 -16.928 1.00 61.43 C ATOM 1248 CE LYS A 82 -2.008 14.558 -17.733 1.00 30.21 C ATOM 1249 NZ LYS A 82 -2.216 14.880 -19.174 1.00 55.51 N ATOM 0 H LYS A 82 -4.112 11.680 -14.330 1.00 60.44 H new ATOM 0 HA LYS A 82 -3.831 14.078 -12.747 1.00 71.10 H new ATOM 0 HB2 LYS A 82 -5.216 13.555 -15.411 1.00 31.12 H new ATOM 0 HB3 LYS A 82 -4.982 15.141 -14.703 1.00 31.12 H new ATOM 0 HG2 LYS A 82 -2.546 14.934 -14.904 1.00 34.11 H new ATOM 0 HG3 LYS A 82 -2.689 13.273 -15.443 1.00 34.11 H new ATOM 0 HD2 LYS A 82 -4.106 14.183 -17.420 1.00 61.43 H new ATOM 0 HD3 LYS A 82 -3.587 15.784 -16.932 1.00 61.43 H new ATOM 0 HE2 LYS A 82 -1.233 15.205 -17.322 1.00 30.21 H new ATOM 0 HE3 LYS A 82 -1.652 13.532 -17.635 1.00 30.21 H new ATOM 0 HZ1 LYS A 82 -1.554 14.324 -19.753 1.00 55.51 H new ATOM 0 HZ2 LYS A 82 -3.193 14.647 -19.444 1.00 55.51 H new ATOM 0 HZ3 LYS A 82 -2.046 15.894 -19.331 1.00 55.51 H new ATOM 1263 N VAL A 83 -5.983 13.544 -11.405 1.00 4.00 N ATOM 1264 CA VAL A 83 -7.233 13.560 -10.620 1.00 25.14 C ATOM 1265 C VAL A 83 -7.191 14.713 -9.599 1.00 11.51 C ATOM 1266 O VAL A 83 -6.175 15.411 -9.483 1.00 0.40 O ATOM 1267 CB VAL A 83 -7.451 12.181 -9.880 1.00 61.13 C ATOM 1268 CG1 VAL A 83 -7.710 11.033 -10.885 1.00 3.12 C ATOM 1269 CG2 VAL A 83 -6.250 11.842 -8.969 1.00 24.41 C ATOM 0 H VAL A 83 -5.144 13.519 -10.826 1.00 4.00 H new ATOM 0 HA VAL A 83 -8.070 13.714 -11.301 1.00 25.14 H new ATOM 0 HB VAL A 83 -8.337 12.286 -9.254 1.00 61.13 H new ATOM 0 HG11 VAL A 83 -7.856 10.099 -10.341 1.00 3.12 H new ATOM 0 HG12 VAL A 83 -8.603 11.256 -11.469 1.00 3.12 H new ATOM 0 HG13 VAL A 83 -6.854 10.934 -11.553 1.00 3.12 H new ATOM 0 HG21 VAL A 83 -6.428 10.888 -8.473 1.00 24.41 H new ATOM 0 HG22 VAL A 83 -5.344 11.774 -9.571 1.00 24.41 H new ATOM 0 HG23 VAL A 83 -6.130 12.624 -8.219 1.00 24.41 H new ATOM 1279 N ASP A 84 -8.306 14.904 -8.875 1.00 11.22 N ATOM 1280 CA ASP A 84 -8.403 15.895 -7.787 1.00 31.15 C ATOM 1281 C ASP A 84 -7.450 15.482 -6.636 1.00 71.44 C ATOM 1282 O ASP A 84 -7.180 14.286 -6.467 1.00 41.34 O ATOM 1283 CB ASP A 84 -9.890 15.991 -7.345 1.00 63.14 C ATOM 1284 CG ASP A 84 -10.128 16.780 -6.053 1.00 33.53 C ATOM 1285 OD1 ASP A 84 -10.608 16.184 -5.063 1.00 71.31 O ATOM 1286 OD2 ASP A 84 -9.832 17.993 -6.016 1.00 31.34 O ATOM 0 H ASP A 84 -9.166 14.377 -9.026 1.00 11.22 H new ATOM 0 HA ASP A 84 -8.090 16.887 -8.114 1.00 31.15 H new ATOM 0 HB2 ASP A 84 -10.464 16.454 -8.148 1.00 63.14 H new ATOM 0 HB3 ASP A 84 -10.281 14.982 -7.215 1.00 63.14 H new ATOM 1291 N GLN A 85 -6.945 16.468 -5.866 1.00 72.22 N ATOM 1292 CA GLN A 85 -5.789 16.275 -4.953 1.00 31.11 C ATOM 1293 C GLN A 85 -6.087 15.214 -3.837 1.00 11.35 C ATOM 1294 O GLN A 85 -5.305 14.270 -3.702 1.00 14.20 O ATOM 1295 CB GLN A 85 -5.290 17.663 -4.386 1.00 14.21 C ATOM 1296 CG GLN A 85 -3.774 17.752 -4.045 1.00 15.32 C ATOM 1297 CD GLN A 85 -3.310 16.941 -2.820 1.00 41.41 C ATOM 1298 OE1 GLN A 85 -4.136 16.854 -1.784 1.00 65.41 O flip ATOM 1299 NE2 GLN A 85 -2.190 16.434 -2.788 1.00 1.25 N flip ATOM 0 H GLN A 85 -7.321 17.416 -5.856 1.00 72.22 H new ATOM 0 HA GLN A 85 -4.964 15.856 -5.529 1.00 31.11 H new ATOM 0 HB2 GLN A 85 -5.525 18.437 -5.116 1.00 14.21 H new ATOM 0 HB3 GLN A 85 -5.859 17.892 -3.485 1.00 14.21 H new ATOM 0 HG2 GLN A 85 -3.206 17.418 -4.913 1.00 15.32 H new ATOM 0 HG3 GLN A 85 -3.519 18.799 -3.881 1.00 15.32 H new ATOM 0 HE21 GLN A 85 -1.571 16.513 -3.595 1.00 1.25 H new ATOM 0 HE22 GLN A 85 -1.880 15.935 -1.954 1.00 1.25 H new ATOM 1308 N PRO A 86 -7.203 15.314 -3.020 1.00 71.14 N ATOM 1309 CA PRO A 86 -7.578 14.221 -2.079 1.00 32.33 C ATOM 1310 C PRO A 86 -8.011 12.930 -2.796 1.00 52.12 C ATOM 1311 O PRO A 86 -7.786 11.840 -2.269 1.00 61.15 O ATOM 1312 CB PRO A 86 -8.714 14.825 -1.221 1.00 34.31 C ATOM 1313 CG PRO A 86 -9.278 15.933 -2.053 1.00 63.43 C ATOM 1314 CD PRO A 86 -8.115 16.483 -2.857 1.00 25.31 C ATOM 0 HA PRO A 86 -6.728 13.904 -1.475 1.00 32.33 H new ATOM 0 HB2 PRO A 86 -9.474 14.079 -0.990 1.00 34.31 H new ATOM 0 HB3 PRO A 86 -8.335 15.199 -0.270 1.00 34.31 H new ATOM 0 HG2 PRO A 86 -10.067 15.566 -2.709 1.00 63.43 H new ATOM 0 HG3 PRO A 86 -9.720 16.707 -1.425 1.00 63.43 H new ATOM 0 HD2 PRO A 86 -8.444 16.870 -3.821 1.00 25.31 H new ATOM 0 HD3 PRO A 86 -7.622 17.304 -2.336 1.00 25.31 H new ATOM 1322 N THR A 87 -8.599 13.069 -4.006 1.00 24.34 N ATOM 1323 CA THR A 87 -9.040 11.933 -4.846 1.00 12.12 C ATOM 1324 C THR A 87 -7.844 11.023 -5.241 1.00 44.11 C ATOM 1325 O THR A 87 -8.003 9.805 -5.396 1.00 11.24 O ATOM 1326 CB THR A 87 -9.788 12.465 -6.117 1.00 25.21 C ATOM 1327 OG1 THR A 87 -10.955 13.203 -5.705 1.00 72.00 O ATOM 1328 CG2 THR A 87 -10.215 11.354 -7.086 1.00 3.25 C ATOM 0 H THR A 87 -8.782 13.979 -4.429 1.00 24.34 H new ATOM 0 HA THR A 87 -9.731 11.323 -4.264 1.00 12.12 H new ATOM 0 HB THR A 87 -9.083 13.100 -6.654 1.00 25.21 H new ATOM 0 HG1 THR A 87 -11.585 13.264 -6.454 1.00 72.00 H new ATOM 0 HG21 THR A 87 -10.726 11.794 -7.942 1.00 3.25 H new ATOM 0 HG22 THR A 87 -9.334 10.812 -7.429 1.00 3.25 H new ATOM 0 HG23 THR A 87 -10.888 10.665 -6.576 1.00 3.25 H new ATOM 1336 N LEU A 88 -6.653 11.642 -5.380 1.00 42.43 N ATOM 1337 CA LEU A 88 -5.384 10.933 -5.650 1.00 42.40 C ATOM 1338 C LEU A 88 -5.088 9.955 -4.496 1.00 2.21 C ATOM 1339 O LEU A 88 -4.710 8.807 -4.718 1.00 13.45 O ATOM 1340 CB LEU A 88 -4.241 11.989 -5.849 1.00 35.01 C ATOM 1341 CG LEU A 88 -2.891 11.511 -6.513 1.00 50.24 C ATOM 1342 CD1 LEU A 88 -2.083 12.713 -7.058 1.00 13.03 C ATOM 1343 CD2 LEU A 88 -2.019 10.686 -5.541 1.00 40.01 C ATOM 0 H LEU A 88 -6.544 12.654 -5.308 1.00 42.43 H new ATOM 0 HA LEU A 88 -5.455 10.344 -6.564 1.00 42.40 H new ATOM 0 HB2 LEU A 88 -4.641 12.802 -6.455 1.00 35.01 H new ATOM 0 HB3 LEU A 88 -4.001 12.408 -4.872 1.00 35.01 H new ATOM 0 HG LEU A 88 -3.167 10.862 -7.344 1.00 50.24 H new ATOM 0 HD11 LEU A 88 -1.158 12.355 -7.510 1.00 13.03 H new ATOM 0 HD12 LEU A 88 -2.674 13.238 -7.808 1.00 13.03 H new ATOM 0 HD13 LEU A 88 -1.847 13.394 -6.240 1.00 13.03 H new ATOM 0 HD21 LEU A 88 -1.102 10.381 -6.045 1.00 40.01 H new ATOM 0 HD22 LEU A 88 -1.770 11.293 -4.671 1.00 40.01 H new ATOM 0 HD23 LEU A 88 -2.569 9.801 -5.221 1.00 40.01 H new ATOM 1355 N PHE A 89 -5.301 10.431 -3.266 1.00 70.14 N ATOM 1356 CA PHE A 89 -5.073 9.647 -2.044 1.00 2.34 C ATOM 1357 C PHE A 89 -6.164 8.603 -1.832 1.00 32.23 C ATOM 1358 O PHE A 89 -5.891 7.556 -1.277 1.00 4.14 O ATOM 1359 CB PHE A 89 -4.957 10.579 -0.828 1.00 14.41 C ATOM 1360 CG PHE A 89 -3.683 11.410 -0.851 1.00 60.33 C ATOM 1361 CD1 PHE A 89 -2.632 11.114 0.003 1.00 51.24 C ATOM 1362 CD2 PHE A 89 -3.536 12.483 -1.732 1.00 64.13 C ATOM 1363 CE1 PHE A 89 -1.489 11.870 -0.013 1.00 12.45 C ATOM 1364 CE2 PHE A 89 -2.387 13.241 -1.742 1.00 44.31 C ATOM 1365 CZ PHE A 89 -1.366 12.934 -0.876 1.00 55.32 C ATOM 0 H PHE A 89 -5.639 11.377 -3.087 1.00 70.14 H new ATOM 0 HA PHE A 89 -4.133 9.108 -2.161 1.00 2.34 H new ATOM 0 HB2 PHE A 89 -5.820 11.244 -0.800 1.00 14.41 H new ATOM 0 HB3 PHE A 89 -4.983 9.985 0.085 1.00 14.41 H new ATOM 0 HD1 PHE A 89 -2.714 10.281 0.686 1.00 51.24 H new ATOM 0 HD2 PHE A 89 -4.336 12.722 -2.417 1.00 64.13 H new ATOM 0 HE1 PHE A 89 -0.678 11.628 0.658 1.00 12.45 H new ATOM 0 HE2 PHE A 89 -2.289 14.071 -2.426 1.00 44.31 H new ATOM 0 HZ PHE A 89 -0.465 13.529 -0.873 1.00 55.32 H new ATOM 1375 N GLU A 90 -7.390 8.900 -2.280 1.00 20.44 N ATOM 1376 CA GLU A 90 -8.507 7.934 -2.258 1.00 11.51 C ATOM 1377 C GLU A 90 -8.195 6.732 -3.176 1.00 3.32 C ATOM 1378 O GLU A 90 -8.619 5.606 -2.906 1.00 62.41 O ATOM 1379 CB GLU A 90 -9.816 8.625 -2.699 1.00 63.22 C ATOM 1380 CG GLU A 90 -10.238 9.818 -1.826 1.00 20.21 C ATOM 1381 CD GLU A 90 -10.671 9.429 -0.398 1.00 15.23 C ATOM 1382 OE1 GLU A 90 -11.756 8.825 -0.250 1.00 51.21 O ATOM 1383 OE2 GLU A 90 -9.960 9.762 0.579 1.00 54.10 O ATOM 0 H GLU A 90 -7.640 9.810 -2.667 1.00 20.44 H new ATOM 0 HA GLU A 90 -8.633 7.566 -1.240 1.00 11.51 H new ATOM 0 HB2 GLU A 90 -9.702 8.967 -3.728 1.00 63.22 H new ATOM 0 HB3 GLU A 90 -10.619 7.888 -2.696 1.00 63.22 H new ATOM 0 HG2 GLU A 90 -9.407 10.521 -1.764 1.00 20.21 H new ATOM 0 HG3 GLU A 90 -11.061 10.339 -2.315 1.00 20.21 H new ATOM 1390 N LEU A 91 -7.441 7.009 -4.265 1.00 62.22 N ATOM 1391 CA LEU A 91 -6.903 5.979 -5.176 1.00 24.02 C ATOM 1392 C LEU A 91 -5.761 5.177 -4.505 1.00 33.12 C ATOM 1393 O LEU A 91 -5.639 3.982 -4.739 1.00 64.01 O ATOM 1394 CB LEU A 91 -6.408 6.637 -6.502 1.00 21.23 C ATOM 1395 CG LEU A 91 -7.502 7.142 -7.490 1.00 71.34 C ATOM 1396 CD1 LEU A 91 -6.866 7.874 -8.699 1.00 34.34 C ATOM 1397 CD2 LEU A 91 -8.392 5.969 -7.950 1.00 1.13 C ATOM 0 H LEU A 91 -7.189 7.960 -4.535 1.00 62.22 H new ATOM 0 HA LEU A 91 -7.706 5.280 -5.410 1.00 24.02 H new ATOM 0 HB2 LEU A 91 -5.769 7.481 -6.244 1.00 21.23 H new ATOM 0 HB3 LEU A 91 -5.784 5.914 -7.027 1.00 21.23 H new ATOM 0 HG LEU A 91 -8.132 7.862 -6.968 1.00 71.34 H new ATOM 0 HD11 LEU A 91 -7.652 8.216 -9.372 1.00 34.34 H new ATOM 0 HD12 LEU A 91 -6.293 8.731 -8.345 1.00 34.34 H new ATOM 0 HD13 LEU A 91 -6.204 7.191 -9.231 1.00 34.34 H new ATOM 0 HD21 LEU A 91 -9.151 6.337 -8.640 1.00 1.13 H new ATOM 0 HD22 LEU A 91 -7.778 5.221 -8.452 1.00 1.13 H new ATOM 0 HD23 LEU A 91 -8.876 5.518 -7.084 1.00 1.13 H new ATOM 1409 N ILE A 92 -4.921 5.860 -3.685 1.00 43.32 N ATOM 1410 CA ILE A 92 -3.857 5.208 -2.874 1.00 2.20 C ATOM 1411 C ILE A 92 -4.494 4.252 -1.834 1.00 64.42 C ATOM 1412 O ILE A 92 -4.047 3.114 -1.658 1.00 73.24 O ATOM 1413 CB ILE A 92 -2.941 6.282 -2.141 1.00 12.20 C ATOM 1414 CG1 ILE A 92 -2.189 7.177 -3.181 1.00 75.23 C ATOM 1415 CG2 ILE A 92 -1.942 5.620 -1.151 1.00 64.52 C ATOM 1416 CD1 ILE A 92 -1.319 8.276 -2.583 1.00 4.34 C ATOM 0 H ILE A 92 -4.961 6.872 -3.567 1.00 43.32 H new ATOM 0 HA ILE A 92 -3.223 4.636 -3.551 1.00 2.20 H new ATOM 0 HB ILE A 92 -3.601 6.920 -1.552 1.00 12.20 H new ATOM 0 HG12 ILE A 92 -1.562 6.537 -3.801 1.00 75.23 H new ATOM 0 HG13 ILE A 92 -2.925 7.637 -3.840 1.00 75.23 H new ATOM 0 HG21 ILE A 92 -1.338 6.391 -0.674 1.00 64.52 H new ATOM 0 HG22 ILE A 92 -2.495 5.070 -0.390 1.00 64.52 H new ATOM 0 HG23 ILE A 92 -1.292 4.934 -1.694 1.00 64.52 H new ATOM 0 HD11 ILE A 92 -0.842 8.839 -3.385 1.00 4.34 H new ATOM 0 HD12 ILE A 92 -1.938 8.947 -1.988 1.00 4.34 H new ATOM 0 HD13 ILE A 92 -0.554 7.829 -1.948 1.00 4.34 H new ATOM 1428 N LEU A 93 -5.580 4.732 -1.193 1.00 12.53 N ATOM 1429 CA LEU A 93 -6.297 3.996 -0.133 1.00 64.31 C ATOM 1430 C LEU A 93 -7.035 2.781 -0.720 1.00 23.32 C ATOM 1431 O LEU A 93 -7.082 1.729 -0.088 1.00 53.13 O ATOM 1432 CB LEU A 93 -7.293 4.935 0.621 1.00 42.52 C ATOM 1433 CG LEU A 93 -6.660 6.152 1.372 1.00 54.42 C ATOM 1434 CD1 LEU A 93 -7.733 6.986 2.111 1.00 50.34 C ATOM 1435 CD2 LEU A 93 -5.528 5.704 2.316 1.00 4.23 C ATOM 0 H LEU A 93 -5.985 5.645 -1.398 1.00 12.53 H new ATOM 0 HA LEU A 93 -5.561 3.636 0.586 1.00 64.31 H new ATOM 0 HB2 LEU A 93 -8.017 5.316 -0.099 1.00 42.52 H new ATOM 0 HB3 LEU A 93 -7.847 4.337 1.344 1.00 42.52 H new ATOM 0 HG LEU A 93 -6.213 6.804 0.621 1.00 54.42 H new ATOM 0 HD11 LEU A 93 -7.256 7.823 2.621 1.00 50.34 H new ATOM 0 HD12 LEU A 93 -8.458 7.366 1.391 1.00 50.34 H new ATOM 0 HD13 LEU A 93 -8.242 6.358 2.842 1.00 50.34 H new ATOM 0 HD21 LEU A 93 -5.110 6.574 2.822 1.00 4.23 H new ATOM 0 HD22 LEU A 93 -5.925 5.010 3.057 1.00 4.23 H new ATOM 0 HD23 LEU A 93 -4.747 5.210 1.738 1.00 4.23 H new ATOM 1447 N ALA A 94 -7.598 2.953 -1.933 1.00 70.14 N ATOM 1448 CA ALA A 94 -8.318 1.886 -2.658 1.00 63.00 C ATOM 1449 C ALA A 94 -7.353 0.861 -3.256 1.00 20.33 C ATOM 1450 O ALA A 94 -7.690 -0.314 -3.380 1.00 23.43 O ATOM 1451 CB ALA A 94 -9.195 2.491 -3.758 1.00 13.32 C ATOM 0 H ALA A 94 -7.566 3.838 -2.439 1.00 70.14 H new ATOM 0 HA ALA A 94 -8.952 1.366 -1.939 1.00 63.00 H new ATOM 0 HB1 ALA A 94 -9.720 1.694 -4.284 1.00 13.32 H new ATOM 0 HB2 ALA A 94 -9.921 3.171 -3.312 1.00 13.32 H new ATOM 0 HB3 ALA A 94 -8.569 3.040 -4.462 1.00 13.32 H new ATOM 1457 N ALA A 95 -6.160 1.326 -3.650 1.00 75.20 N ATOM 1458 CA ALA A 95 -5.102 0.463 -4.200 1.00 55.43 C ATOM 1459 C ALA A 95 -4.438 -0.373 -3.092 1.00 2.44 C ATOM 1460 O ALA A 95 -3.903 -1.439 -3.366 1.00 60.31 O ATOM 1461 CB ALA A 95 -4.070 1.298 -4.954 1.00 74.02 C ATOM 0 H ALA A 95 -5.900 2.311 -3.597 1.00 75.20 H new ATOM 0 HA ALA A 95 -5.559 -0.231 -4.906 1.00 55.43 H new ATOM 0 HB1 ALA A 95 -3.295 0.644 -5.354 1.00 74.02 H new ATOM 0 HB2 ALA A 95 -4.558 1.826 -5.773 1.00 74.02 H new ATOM 0 HB3 ALA A 95 -3.619 2.021 -4.274 1.00 74.02 H new ATOM 1467 N ASN A 96 -4.434 0.166 -1.854 1.00 34.32 N ATOM 1468 CA ASN A 96 -4.005 -0.568 -0.638 1.00 11.42 C ATOM 1469 C ASN A 96 -5.136 -1.513 -0.153 1.00 24.01 C ATOM 1470 O ASN A 96 -4.877 -2.633 0.302 1.00 23.25 O ATOM 1471 CB ASN A 96 -3.608 0.459 0.470 1.00 55.31 C ATOM 1472 CG ASN A 96 -3.098 -0.173 1.778 1.00 44.02 C ATOM 1473 OD1 ASN A 96 -2.555 -1.279 1.791 1.00 5.25 O ATOM 1474 ND2 ASN A 96 -3.235 0.542 2.889 1.00 23.12 N ATOM 0 H ASN A 96 -4.728 1.124 -1.666 1.00 34.32 H new ATOM 0 HA ASN A 96 -3.137 -1.185 -0.868 1.00 11.42 H new ATOM 0 HB2 ASN A 96 -2.835 1.119 0.075 1.00 55.31 H new ATOM 0 HB3 ASN A 96 -4.473 1.082 0.696 1.00 55.31 H new ATOM 0 HD21 ASN A 96 -2.887 0.178 3.776 1.00 23.12 H new ATOM 0 HD22 ASN A 96 -3.688 1.455 2.855 1.00 23.12 H new ATOM 1481 N TYR A 97 -6.392 -1.041 -0.293 1.00 61.13 N ATOM 1482 CA TYR A 97 -7.622 -1.791 0.080 1.00 41.41 C ATOM 1483 C TYR A 97 -7.804 -3.033 -0.807 1.00 43.21 C ATOM 1484 O TYR A 97 -8.258 -4.078 -0.339 1.00 65.23 O ATOM 1485 CB TYR A 97 -8.864 -0.849 -0.031 1.00 45.11 C ATOM 1486 CG TYR A 97 -10.251 -1.511 0.139 1.00 61.13 C ATOM 1487 CD1 TYR A 97 -11.199 -1.495 -0.896 1.00 71.42 C ATOM 1488 CD2 TYR A 97 -10.615 -2.141 1.331 1.00 22.43 C ATOM 1489 CE1 TYR A 97 -12.446 -2.079 -0.745 1.00 11.12 C ATOM 1490 CE2 TYR A 97 -11.862 -2.727 1.481 1.00 25.04 C ATOM 1491 CZ TYR A 97 -12.772 -2.694 0.444 1.00 14.41 C ATOM 1492 OH TYR A 97 -14.017 -3.269 0.603 1.00 33.44 O ATOM 0 H TYR A 97 -6.589 -0.115 -0.673 1.00 61.13 H new ATOM 0 HA TYR A 97 -7.523 -2.133 1.110 1.00 41.41 H new ATOM 0 HB2 TYR A 97 -8.766 -0.065 0.720 1.00 45.11 H new ATOM 0 HB3 TYR A 97 -8.836 -0.361 -1.005 1.00 45.11 H new ATOM 0 HD1 TYR A 97 -10.950 -1.016 -1.832 1.00 71.42 H new ATOM 0 HD2 TYR A 97 -9.912 -2.172 2.151 1.00 22.43 H new ATOM 0 HE1 TYR A 97 -13.159 -2.052 -1.555 1.00 11.12 H new ATOM 0 HE2 TYR A 97 -12.122 -3.210 2.411 1.00 25.04 H new ATOM 0 HH TYR A 97 -14.085 -3.660 1.499 1.00 33.44 H new ATOM 1502 N LEU A 98 -7.466 -2.886 -2.096 1.00 23.34 N ATOM 1503 CA LEU A 98 -7.583 -3.958 -3.103 1.00 52.55 C ATOM 1504 C LEU A 98 -6.213 -4.620 -3.372 1.00 73.11 C ATOM 1505 O LEU A 98 -6.136 -5.652 -4.054 1.00 74.14 O ATOM 1506 CB LEU A 98 -8.226 -3.379 -4.397 1.00 52.23 C ATOM 1507 CG LEU A 98 -9.691 -2.840 -4.237 1.00 75.45 C ATOM 1508 CD1 LEU A 98 -10.248 -2.296 -5.572 1.00 61.21 C ATOM 1509 CD2 LEU A 98 -10.623 -3.923 -3.642 1.00 51.14 C ATOM 0 H LEU A 98 -7.100 -2.013 -2.475 1.00 23.34 H new ATOM 0 HA LEU A 98 -8.233 -4.746 -2.723 1.00 52.55 H new ATOM 0 HB2 LEU A 98 -7.597 -2.568 -4.764 1.00 52.23 H new ATOM 0 HB3 LEU A 98 -8.224 -4.155 -5.162 1.00 52.23 H new ATOM 0 HG LEU A 98 -9.656 -2.006 -3.536 1.00 75.45 H new ATOM 0 HD11 LEU A 98 -11.264 -1.932 -5.421 1.00 61.21 H new ATOM 0 HD12 LEU A 98 -9.618 -1.479 -5.923 1.00 61.21 H new ATOM 0 HD13 LEU A 98 -10.255 -3.093 -6.315 1.00 61.21 H new ATOM 0 HD21 LEU A 98 -11.631 -3.521 -3.543 1.00 51.14 H new ATOM 0 HD22 LEU A 98 -10.642 -4.790 -4.303 1.00 51.14 H new ATOM 0 HD23 LEU A 98 -10.253 -4.222 -2.661 1.00 51.14 H new ATOM 1521 N ASP A 99 -5.152 -4.000 -2.818 1.00 14.00 N ATOM 1522 CA ASP A 99 -3.763 -4.511 -2.823 1.00 52.14 C ATOM 1523 C ASP A 99 -3.212 -4.714 -4.265 1.00 61.24 C ATOM 1524 O ASP A 99 -2.442 -5.643 -4.550 1.00 44.52 O ATOM 1525 CB ASP A 99 -3.651 -5.796 -1.942 1.00 71.11 C ATOM 1526 CG ASP A 99 -2.201 -6.203 -1.614 1.00 60.24 C ATOM 1527 OD1 ASP A 99 -1.337 -5.306 -1.492 1.00 31.11 O ATOM 1528 OD2 ASP A 99 -1.919 -7.407 -1.432 1.00 61.42 O ATOM 0 H ASP A 99 -5.239 -3.103 -2.340 1.00 14.00 H new ATOM 0 HA ASP A 99 -3.122 -3.752 -2.375 1.00 52.14 H new ATOM 0 HB2 ASP A 99 -4.192 -5.634 -1.010 1.00 71.11 H new ATOM 0 HB3 ASP A 99 -4.142 -6.622 -2.457 1.00 71.11 H new ATOM 1533 N ILE A 100 -3.594 -3.794 -5.162 1.00 23.35 N ATOM 1534 CA ILE A 100 -3.133 -3.792 -6.560 1.00 13.30 C ATOM 1535 C ILE A 100 -1.761 -3.098 -6.629 1.00 20.42 C ATOM 1536 O ILE A 100 -1.690 -1.872 -6.524 1.00 63.11 O ATOM 1537 CB ILE A 100 -4.164 -3.065 -7.507 1.00 11.00 C ATOM 1538 CG1 ILE A 100 -5.585 -3.675 -7.317 1.00 62.43 C ATOM 1539 CG2 ILE A 100 -3.713 -3.143 -8.991 1.00 64.43 C ATOM 1540 CD1 ILE A 100 -6.685 -2.999 -8.109 1.00 33.34 C ATOM 0 H ILE A 100 -4.232 -3.029 -4.940 1.00 23.35 H new ATOM 0 HA ILE A 100 -3.048 -4.823 -6.905 1.00 13.30 H new ATOM 0 HB ILE A 100 -4.201 -2.010 -7.234 1.00 11.00 H new ATOM 0 HG12 ILE A 100 -5.552 -4.728 -7.596 1.00 62.43 H new ATOM 0 HG13 ILE A 100 -5.843 -3.634 -6.259 1.00 62.43 H new ATOM 0 HG21 ILE A 100 -4.443 -2.634 -9.620 1.00 64.43 H new ATOM 0 HG22 ILE A 100 -2.741 -2.663 -9.101 1.00 64.43 H new ATOM 0 HG23 ILE A 100 -3.639 -4.187 -9.294 1.00 64.43 H new ATOM 0 HD11 ILE A 100 -7.635 -3.495 -7.910 1.00 33.34 H new ATOM 0 HD12 ILE A 100 -6.754 -1.952 -7.815 1.00 33.34 H new ATOM 0 HD13 ILE A 100 -6.459 -3.063 -9.173 1.00 33.34 H new ATOM 1552 N LYS A 101 -0.690 -3.904 -6.795 1.00 1.41 N ATOM 1553 CA LYS A 101 0.713 -3.419 -6.775 1.00 64.22 C ATOM 1554 C LYS A 101 0.993 -2.342 -7.876 1.00 15.12 C ATOM 1555 O LYS A 101 1.573 -1.305 -7.537 1.00 70.24 O ATOM 1556 CB LYS A 101 1.729 -4.602 -6.902 1.00 22.14 C ATOM 1557 CG LYS A 101 1.505 -5.773 -5.920 1.00 72.13 C ATOM 1558 CD LYS A 101 1.558 -5.358 -4.432 1.00 52.13 C ATOM 1559 CE LYS A 101 1.385 -6.562 -3.490 1.00 52.42 C ATOM 1560 NZ LYS A 101 1.344 -6.143 -2.067 1.00 12.43 N ATOM 0 H LYS A 101 -0.770 -4.909 -6.947 1.00 1.41 H new ATOM 0 HA LYS A 101 0.855 -2.940 -5.806 1.00 64.22 H new ATOM 0 HB2 LYS A 101 1.685 -4.990 -7.920 1.00 22.14 H new ATOM 0 HB3 LYS A 101 2.736 -4.212 -6.753 1.00 22.14 H new ATOM 0 HG2 LYS A 101 0.536 -6.228 -6.126 1.00 72.13 H new ATOM 0 HG3 LYS A 101 2.261 -6.537 -6.102 1.00 72.13 H new ATOM 0 HD2 LYS A 101 2.511 -4.870 -4.226 1.00 52.13 H new ATOM 0 HD3 LYS A 101 0.775 -4.626 -4.232 1.00 52.13 H new ATOM 0 HE2 LYS A 101 0.465 -7.091 -3.740 1.00 52.42 H new ATOM 0 HE3 LYS A 101 2.207 -7.262 -3.640 1.00 52.42 H new ATOM 0 HZ1 LYS A 101 1.648 -6.933 -1.463 1.00 12.43 H new ATOM 0 HZ2 LYS A 101 1.981 -5.334 -1.925 1.00 12.43 H new ATOM 0 HZ3 LYS A 101 0.373 -5.868 -1.814 1.00 12.43 H new ATOM 1574 N PRO A 102 0.601 -2.554 -9.205 1.00 64.02 N ATOM 1575 CA PRO A 102 0.809 -1.531 -10.271 1.00 75.03 C ATOM 1576 C PRO A 102 0.151 -0.180 -9.934 1.00 14.53 C ATOM 1577 O PRO A 102 0.805 0.856 -9.973 1.00 11.23 O ATOM 1578 CB PRO A 102 0.168 -2.164 -11.538 1.00 13.53 C ATOM 1579 CG PRO A 102 0.201 -3.638 -11.276 1.00 74.24 C ATOM 1580 CD PRO A 102 -0.021 -3.785 -9.787 1.00 34.44 C ATOM 0 HA PRO A 102 1.866 -1.298 -10.399 1.00 75.03 H new ATOM 0 HB2 PRO A 102 -0.852 -1.810 -11.686 1.00 13.53 H new ATOM 0 HB3 PRO A 102 0.728 -1.908 -12.437 1.00 13.53 H new ATOM 0 HG2 PRO A 102 -0.574 -4.155 -11.842 1.00 74.24 H new ATOM 0 HG3 PRO A 102 1.156 -4.069 -11.576 1.00 74.24 H new ATOM 0 HD2 PRO A 102 -1.082 -3.848 -9.546 1.00 34.44 H new ATOM 0 HD3 PRO A 102 0.448 -4.690 -9.401 1.00 34.44 H new ATOM 1588 N LEU A 103 -1.147 -0.227 -9.561 1.00 53.51 N ATOM 1589 CA LEU A 103 -1.953 0.984 -9.302 1.00 73.33 C ATOM 1590 C LEU A 103 -1.400 1.741 -8.076 1.00 41.40 C ATOM 1591 O LEU A 103 -1.243 2.963 -8.123 1.00 4.51 O ATOM 1592 CB LEU A 103 -3.460 0.603 -9.124 1.00 2.24 C ATOM 1593 CG LEU A 103 -4.530 1.708 -9.472 1.00 24.12 C ATOM 1594 CD1 LEU A 103 -5.928 1.079 -9.638 1.00 22.12 C ATOM 1595 CD2 LEU A 103 -4.576 2.861 -8.437 1.00 73.24 C ATOM 0 H LEU A 103 -1.661 -1.099 -9.432 1.00 53.51 H new ATOM 0 HA LEU A 103 -1.884 1.654 -10.159 1.00 73.33 H new ATOM 0 HB2 LEU A 103 -3.663 -0.270 -9.744 1.00 2.24 H new ATOM 0 HB3 LEU A 103 -3.612 0.301 -8.088 1.00 2.24 H new ATOM 0 HG LEU A 103 -4.218 2.150 -10.418 1.00 24.12 H new ATOM 0 HD11 LEU A 103 -6.651 1.858 -9.878 1.00 22.12 H new ATOM 0 HD12 LEU A 103 -5.904 0.346 -10.444 1.00 22.12 H new ATOM 0 HD13 LEU A 103 -6.218 0.588 -8.709 1.00 22.12 H new ATOM 0 HD21 LEU A 103 -5.332 3.587 -8.735 1.00 73.24 H new ATOM 0 HD22 LEU A 103 -4.826 2.459 -7.455 1.00 73.24 H new ATOM 0 HD23 LEU A 103 -3.602 3.349 -8.392 1.00 73.24 H new ATOM 1607 N LEU A 104 -1.070 0.990 -7.006 1.00 52.31 N ATOM 1608 CA LEU A 104 -0.563 1.563 -5.742 1.00 34.24 C ATOM 1609 C LEU A 104 0.776 2.274 -5.969 1.00 4.45 C ATOM 1610 O LEU A 104 0.989 3.376 -5.463 1.00 0.43 O ATOM 1611 CB LEU A 104 -0.424 0.448 -4.660 1.00 54.14 C ATOM 1612 CG LEU A 104 0.006 0.899 -3.224 1.00 35.44 C ATOM 1613 CD1 LEU A 104 -0.959 1.960 -2.644 1.00 21.33 C ATOM 1614 CD2 LEU A 104 0.123 -0.321 -2.282 1.00 53.22 C ATOM 0 H LEU A 104 -1.147 -0.027 -6.993 1.00 52.31 H new ATOM 0 HA LEU A 104 -1.280 2.302 -5.383 1.00 34.24 H new ATOM 0 HB2 LEU A 104 -1.381 -0.068 -4.580 1.00 54.14 H new ATOM 0 HB3 LEU A 104 0.303 -0.282 -5.017 1.00 54.14 H new ATOM 0 HG LEU A 104 0.988 1.366 -3.304 1.00 35.44 H new ATOM 0 HD11 LEU A 104 -0.627 2.247 -1.646 1.00 21.33 H new ATOM 0 HD12 LEU A 104 -0.966 2.837 -3.291 1.00 21.33 H new ATOM 0 HD13 LEU A 104 -1.965 1.544 -2.586 1.00 21.33 H new ATOM 0 HD21 LEU A 104 0.423 0.014 -1.289 1.00 53.22 H new ATOM 0 HD22 LEU A 104 -0.841 -0.826 -2.219 1.00 53.22 H new ATOM 0 HD23 LEU A 104 0.870 -1.012 -2.673 1.00 53.22 H new ATOM 1626 N ASP A 105 1.650 1.645 -6.779 1.00 22.42 N ATOM 1627 CA ASP A 105 2.982 2.187 -7.092 1.00 3.12 C ATOM 1628 C ASP A 105 2.849 3.477 -7.926 1.00 41.01 C ATOM 1629 O ASP A 105 3.357 4.522 -7.533 1.00 3.20 O ATOM 1630 CB ASP A 105 3.843 1.137 -7.850 1.00 53.52 C ATOM 1631 CG ASP A 105 5.297 1.611 -8.075 1.00 13.13 C ATOM 1632 OD1 ASP A 105 6.173 1.317 -7.227 1.00 24.42 O ATOM 1633 OD2 ASP A 105 5.576 2.287 -9.093 1.00 44.10 O ATOM 0 H ASP A 105 1.452 0.752 -7.231 1.00 22.42 H new ATOM 0 HA ASP A 105 3.485 2.425 -6.155 1.00 3.12 H new ATOM 0 HB2 ASP A 105 3.852 0.204 -7.286 1.00 53.52 H new ATOM 0 HB3 ASP A 105 3.382 0.922 -8.814 1.00 53.52 H new ATOM 1638 N VAL A 106 2.096 3.391 -9.041 1.00 2.35 N ATOM 1639 CA VAL A 106 1.922 4.501 -10.004 1.00 34.40 C ATOM 1640 C VAL A 106 1.322 5.757 -9.326 1.00 75.23 C ATOM 1641 O VAL A 106 1.853 6.861 -9.484 1.00 13.13 O ATOM 1642 CB VAL A 106 1.036 4.044 -11.237 1.00 32.33 C ATOM 1643 CG1 VAL A 106 0.615 5.229 -12.144 1.00 31.34 C ATOM 1644 CG2 VAL A 106 1.772 2.963 -12.072 1.00 70.34 C ATOM 0 H VAL A 106 1.588 2.546 -9.302 1.00 2.35 H new ATOM 0 HA VAL A 106 2.910 4.772 -10.375 1.00 34.40 H new ATOM 0 HB VAL A 106 0.123 3.617 -10.823 1.00 32.33 H new ATOM 0 HG11 VAL A 106 0.011 4.857 -12.971 1.00 31.34 H new ATOM 0 HG12 VAL A 106 0.033 5.944 -11.562 1.00 31.34 H new ATOM 0 HG13 VAL A 106 1.505 5.720 -12.537 1.00 31.34 H new ATOM 0 HG21 VAL A 106 1.146 2.664 -12.913 1.00 70.34 H new ATOM 0 HG22 VAL A 106 2.712 3.369 -12.446 1.00 70.34 H new ATOM 0 HG23 VAL A 106 1.976 2.095 -11.445 1.00 70.34 H new ATOM 1654 N THR A 107 0.252 5.567 -8.537 1.00 23.23 N ATOM 1655 CA THR A 107 -0.481 6.680 -7.900 1.00 72.41 C ATOM 1656 C THR A 107 0.336 7.318 -6.742 1.00 4.52 C ATOM 1657 O THR A 107 0.362 8.553 -6.600 1.00 10.45 O ATOM 1658 CB THR A 107 -1.881 6.194 -7.402 1.00 20.42 C ATOM 1659 OG1 THR A 107 -2.577 5.569 -8.494 1.00 31.20 O ATOM 1660 CG2 THR A 107 -2.751 7.341 -6.869 1.00 73.34 C ATOM 0 H THR A 107 -0.129 4.646 -8.322 1.00 23.23 H new ATOM 0 HA THR A 107 -0.631 7.456 -8.651 1.00 72.41 H new ATOM 0 HB THR A 107 -1.707 5.496 -6.583 1.00 20.42 H new ATOM 0 HG1 THR A 107 -3.538 5.549 -8.301 1.00 31.20 H new ATOM 0 HG21 THR A 107 -3.711 6.946 -6.537 1.00 73.34 H new ATOM 0 HG22 THR A 107 -2.247 7.821 -6.030 1.00 73.34 H new ATOM 0 HG23 THR A 107 -2.914 8.072 -7.661 1.00 73.34 H new ATOM 1668 N CYS A 108 1.025 6.470 -5.943 1.00 72.42 N ATOM 1669 CA CYS A 108 1.917 6.946 -4.856 1.00 40.15 C ATOM 1670 C CYS A 108 3.150 7.675 -5.428 1.00 32.20 C ATOM 1671 O CYS A 108 3.681 8.587 -4.795 1.00 43.53 O ATOM 1672 CB CYS A 108 2.361 5.784 -3.940 1.00 44.51 C ATOM 1673 SG CYS A 108 1.004 5.007 -3.035 1.00 25.10 S ATOM 0 H CYS A 108 0.981 5.455 -6.029 1.00 72.42 H new ATOM 0 HA CYS A 108 1.345 7.653 -4.255 1.00 40.15 H new ATOM 0 HB2 CYS A 108 2.861 5.028 -4.545 1.00 44.51 H new ATOM 0 HB3 CYS A 108 3.095 6.157 -3.226 1.00 44.51 H new ATOM 0 HG CYS A 108 0.565 3.984 -3.706 1.00 25.10 H new ATOM 1679 N LYS A 109 3.591 7.253 -6.633 1.00 60.04 N ATOM 1680 CA LYS A 109 4.700 7.903 -7.363 1.00 23.34 C ATOM 1681 C LYS A 109 4.250 9.264 -7.906 1.00 42.42 C ATOM 1682 O LYS A 109 5.012 10.215 -7.850 1.00 1.23 O ATOM 1683 CB LYS A 109 5.258 6.988 -8.517 1.00 21.33 C ATOM 1684 CG LYS A 109 6.533 6.179 -8.158 1.00 21.12 C ATOM 1685 CD LYS A 109 6.370 5.280 -6.913 1.00 45.24 C ATOM 1686 CE LYS A 109 7.640 4.478 -6.592 1.00 12.12 C ATOM 1687 NZ LYS A 109 8.028 3.573 -7.709 1.00 60.35 N ATOM 0 H LYS A 109 3.189 6.455 -7.125 1.00 60.04 H new ATOM 0 HA LYS A 109 5.518 8.060 -6.660 1.00 23.34 H new ATOM 0 HB2 LYS A 109 4.476 6.290 -8.816 1.00 21.33 H new ATOM 0 HB3 LYS A 109 5.475 7.614 -9.383 1.00 21.33 H new ATOM 0 HG2 LYS A 109 6.810 5.558 -9.010 1.00 21.12 H new ATOM 0 HG3 LYS A 109 7.357 6.873 -7.989 1.00 21.12 H new ATOM 0 HD2 LYS A 109 6.109 5.899 -6.054 1.00 45.24 H new ATOM 0 HD3 LYS A 109 5.541 4.591 -7.073 1.00 45.24 H new ATOM 0 HE2 LYS A 109 8.459 5.166 -6.382 1.00 12.12 H new ATOM 0 HE3 LYS A 109 7.478 3.890 -5.689 1.00 12.12 H new ATOM 0 HZ1 LYS A 109 8.435 2.698 -7.321 1.00 60.35 H new ATOM 0 HZ2 LYS A 109 7.188 3.342 -8.277 1.00 60.35 H new ATOM 0 HZ3 LYS A 109 8.732 4.046 -8.310 1.00 60.35 H new ATOM 1701 N THR A 110 2.997 9.347 -8.397 1.00 44.41 N ATOM 1702 CA THR A 110 2.435 10.585 -8.976 1.00 13.02 C ATOM 1703 C THR A 110 2.490 11.757 -7.966 1.00 53.21 C ATOM 1704 O THR A 110 2.964 12.854 -8.299 1.00 24.21 O ATOM 1705 CB THR A 110 0.967 10.352 -9.459 1.00 74.02 C ATOM 1706 OG1 THR A 110 0.956 9.341 -10.479 1.00 24.23 O ATOM 1707 CG2 THR A 110 0.315 11.633 -10.015 1.00 42.51 C ATOM 0 H THR A 110 2.348 8.561 -8.404 1.00 44.41 H new ATOM 0 HA THR A 110 3.048 10.854 -9.836 1.00 13.02 H new ATOM 0 HB THR A 110 0.388 10.037 -8.591 1.00 74.02 H new ATOM 0 HG1 THR A 110 1.259 8.490 -10.099 1.00 24.23 H new ATOM 0 HG21 THR A 110 -0.703 11.413 -10.336 1.00 42.51 H new ATOM 0 HG22 THR A 110 0.294 12.397 -9.238 1.00 42.51 H new ATOM 0 HG23 THR A 110 0.893 11.996 -10.865 1.00 42.51 H new ATOM 1715 N VAL A 111 2.040 11.497 -6.724 1.00 34.42 N ATOM 1716 CA VAL A 111 2.078 12.506 -5.649 1.00 2.34 C ATOM 1717 C VAL A 111 3.521 12.735 -5.148 1.00 34.42 C ATOM 1718 O VAL A 111 3.896 13.871 -4.821 1.00 61.25 O ATOM 1719 CB VAL A 111 1.124 12.134 -4.452 1.00 61.24 C ATOM 1720 CG1 VAL A 111 1.481 10.774 -3.811 1.00 63.25 C ATOM 1721 CG2 VAL A 111 1.078 13.268 -3.400 1.00 72.10 C ATOM 0 H VAL A 111 1.647 10.599 -6.441 1.00 34.42 H new ATOM 0 HA VAL A 111 1.712 13.439 -6.078 1.00 2.34 H new ATOM 0 HB VAL A 111 0.122 12.024 -4.867 1.00 61.24 H new ATOM 0 HG11 VAL A 111 0.793 10.566 -2.992 1.00 63.25 H new ATOM 0 HG12 VAL A 111 1.401 9.986 -4.560 1.00 63.25 H new ATOM 0 HG13 VAL A 111 2.501 10.809 -3.428 1.00 63.25 H new ATOM 0 HG21 VAL A 111 0.412 12.982 -2.586 1.00 72.10 H new ATOM 0 HG22 VAL A 111 2.080 13.439 -3.006 1.00 72.10 H new ATOM 0 HG23 VAL A 111 0.710 14.182 -3.866 1.00 72.10 H new ATOM 1731 N ALA A 112 4.328 11.650 -5.128 1.00 53.42 N ATOM 1732 CA ALA A 112 5.726 11.696 -4.674 1.00 60.42 C ATOM 1733 C ALA A 112 6.557 12.652 -5.544 1.00 24.42 C ATOM 1734 O ALA A 112 7.212 13.534 -5.016 1.00 1.01 O ATOM 1735 CB ALA A 112 6.340 10.289 -4.664 1.00 1.22 C ATOM 0 H ALA A 112 4.024 10.723 -5.426 1.00 53.42 H new ATOM 0 HA ALA A 112 5.738 12.079 -3.653 1.00 60.42 H new ATOM 0 HB1 ALA A 112 7.374 10.346 -4.325 1.00 1.22 H new ATOM 0 HB2 ALA A 112 5.772 9.649 -3.989 1.00 1.22 H new ATOM 0 HB3 ALA A 112 6.310 9.872 -5.671 1.00 1.22 H new ATOM 1741 N ASN A 113 6.432 12.517 -6.881 1.00 62.15 N ATOM 1742 CA ASN A 113 7.266 13.255 -7.875 1.00 72.00 C ATOM 1743 C ASN A 113 7.119 14.784 -7.745 1.00 62.35 C ATOM 1744 O ASN A 113 8.051 15.532 -8.072 1.00 42.12 O ATOM 1745 CB ASN A 113 6.902 12.826 -9.328 1.00 21.43 C ATOM 1746 CG ASN A 113 7.127 11.341 -9.610 1.00 74.40 C ATOM 1747 OD1 ASN A 113 8.007 10.706 -9.025 1.00 24.00 O ATOM 1748 ND2 ASN A 113 6.329 10.770 -10.505 1.00 54.34 N ATOM 0 H ASN A 113 5.750 11.893 -7.311 1.00 62.15 H new ATOM 0 HA ASN A 113 8.303 12.995 -7.662 1.00 72.00 H new ATOM 0 HB2 ASN A 113 5.856 13.067 -9.516 1.00 21.43 H new ATOM 0 HB3 ASN A 113 7.495 13.413 -10.029 1.00 21.43 H new ATOM 0 HD21 ASN A 113 6.435 9.780 -10.725 1.00 54.34 H new ATOM 0 HD22 ASN A 113 5.610 11.322 -10.973 1.00 54.34 H new ATOM 1755 N MET A 114 5.945 15.229 -7.268 1.00 21.24 N ATOM 1756 CA MET A 114 5.647 16.663 -7.060 1.00 14.15 C ATOM 1757 C MET A 114 6.534 17.239 -5.932 1.00 2.23 C ATOM 1758 O MET A 114 7.106 18.326 -6.061 1.00 13.20 O ATOM 1759 CB MET A 114 4.145 16.867 -6.703 1.00 34.54 C ATOM 1760 CG MET A 114 3.151 16.226 -7.687 1.00 71.34 C ATOM 1761 SD MET A 114 1.429 16.696 -7.363 1.00 24.31 S ATOM 1762 CE MET A 114 1.193 16.219 -5.646 1.00 72.20 C ATOM 0 H MET A 114 5.175 14.610 -7.015 1.00 21.24 H new ATOM 0 HA MET A 114 5.862 17.192 -7.989 1.00 14.15 H new ATOM 0 HB2 MET A 114 3.964 16.458 -5.709 1.00 34.54 H new ATOM 0 HB3 MET A 114 3.942 17.937 -6.649 1.00 34.54 H new ATOM 0 HG2 MET A 114 3.416 16.517 -8.703 1.00 71.34 H new ATOM 0 HG3 MET A 114 3.242 15.141 -7.632 1.00 71.34 H new ATOM 0 HE1 MET A 114 0.224 15.733 -5.533 1.00 72.20 H new ATOM 0 HE2 MET A 114 1.982 15.528 -5.349 1.00 72.20 H new ATOM 0 HE3 MET A 114 1.230 17.106 -5.014 1.00 72.20 H new ATOM 1772 N ILE A 115 6.652 16.467 -4.842 1.00 12.53 N ATOM 1773 CA ILE A 115 7.359 16.878 -3.607 1.00 74.45 C ATOM 1774 C ILE A 115 8.776 16.251 -3.517 1.00 73.51 C ATOM 1775 O ILE A 115 9.532 16.541 -2.582 1.00 4.12 O ATOM 1776 CB ILE A 115 6.503 16.479 -2.341 1.00 42.23 C ATOM 1777 CG1 ILE A 115 6.332 14.930 -2.275 1.00 11.34 C ATOM 1778 CG2 ILE A 115 5.117 17.192 -2.349 1.00 74.01 C ATOM 1779 CD1 ILE A 115 5.573 14.410 -1.077 1.00 53.30 C ATOM 0 H ILE A 115 6.257 15.528 -4.786 1.00 12.53 H new ATOM 0 HA ILE A 115 7.482 17.961 -3.637 1.00 74.45 H new ATOM 0 HB ILE A 115 7.036 16.809 -1.449 1.00 42.23 H new ATOM 0 HG12 ILE A 115 5.820 14.600 -3.179 1.00 11.34 H new ATOM 0 HG13 ILE A 115 7.321 14.472 -2.283 1.00 11.34 H new ATOM 0 HG21 ILE A 115 4.551 16.897 -1.465 1.00 74.01 H new ATOM 0 HG22 ILE A 115 5.263 18.272 -2.343 1.00 74.01 H new ATOM 0 HG23 ILE A 115 4.566 16.906 -3.245 1.00 74.01 H new ATOM 0 HD11 ILE A 115 5.512 13.323 -1.129 1.00 53.30 H new ATOM 0 HD12 ILE A 115 6.092 14.701 -0.163 1.00 53.30 H new ATOM 0 HD13 ILE A 115 4.567 14.830 -1.073 1.00 53.30 H new ATOM 1791 N ARG A 116 9.133 15.402 -4.502 1.00 43.10 N ATOM 1792 CA ARG A 116 10.444 14.711 -4.567 1.00 24.32 C ATOM 1793 C ARG A 116 11.374 15.526 -5.506 1.00 32.21 C ATOM 1794 O ARG A 116 12.110 14.963 -6.306 1.00 41.11 O ATOM 1795 CB ARG A 116 10.220 13.231 -5.068 1.00 15.41 C ATOM 1796 CG ARG A 116 11.201 12.145 -4.539 1.00 62.13 C ATOM 1797 CD ARG A 116 12.605 12.186 -5.175 1.00 12.24 C ATOM 1798 NE ARG A 116 13.503 11.161 -4.641 1.00 3.20 N ATOM 1799 CZ ARG A 116 14.839 11.195 -4.714 1.00 34.34 C ATOM 1800 NH1 ARG A 116 15.480 12.219 -5.285 1.00 61.23 N ATOM 1801 NH2 ARG A 116 15.541 10.213 -4.199 1.00 70.14 N ATOM 0 H ARG A 116 8.517 15.173 -5.282 1.00 43.10 H new ATOM 0 HA ARG A 116 10.920 14.652 -3.588 1.00 24.32 H new ATOM 0 HB2 ARG A 116 9.207 12.932 -4.797 1.00 15.41 H new ATOM 0 HB3 ARG A 116 10.272 13.231 -6.157 1.00 15.41 H new ATOM 0 HG2 ARG A 116 11.302 12.259 -3.460 1.00 62.13 H new ATOM 0 HG3 ARG A 116 10.764 11.162 -4.716 1.00 62.13 H new ATOM 0 HD2 ARG A 116 12.514 12.056 -6.253 1.00 12.24 H new ATOM 0 HD3 ARG A 116 13.045 13.169 -5.009 1.00 12.24 H new ATOM 0 HE ARG A 116 13.078 10.358 -4.177 1.00 3.20 H new ATOM 0 HH11 ARG A 116 14.950 12.997 -5.677 1.00 61.23 H new ATOM 0 HH12 ARG A 116 16.499 12.222 -5.329 1.00 61.23 H new ATOM 0 HH21 ARG A 116 15.068 9.431 -3.747 1.00 70.14 H new ATOM 0 HH22 ARG A 116 16.559 10.232 -4.251 1.00 70.14 H new ATOM 1815 N GLY A 117 11.312 16.869 -5.377 1.00 50.14 N ATOM 1816 CA GLY A 117 12.135 17.829 -6.138 1.00 10.14 C ATOM 1817 C GLY A 117 13.635 17.461 -6.311 1.00 31.10 C ATOM 1818 O GLY A 117 14.241 17.872 -7.311 1.00 33.43 O ATOM 1819 OXT GLY A 117 14.206 16.760 -5.454 1.00 37.94 O ATOM 0 H GLY A 117 10.673 17.324 -4.725 1.00 50.14 H new ATOM 0 HA2 GLY A 117 11.695 17.948 -7.128 1.00 10.14 H new ATOM 0 HA3 GLY A 117 12.075 18.799 -5.644 1.00 10.14 H new TER 1823 GLY A 117 ATOM 1824 N SER B 2 17.903 -13.829 18.405 1.00 3.53 N ATOM 1825 CA SER B 2 18.980 -13.202 17.618 1.00 71.13 C ATOM 1826 C SER B 2 18.446 -11.995 16.836 1.00 44.11 C ATOM 1827 O SER B 2 17.312 -12.008 16.336 1.00 53.32 O ATOM 1828 CB SER B 2 19.620 -14.229 16.664 1.00 33.14 C ATOM 1829 OG SER B 2 20.082 -15.363 17.384 1.00 65.50 O ATOM 0 HA SER B 2 19.748 -12.849 18.306 1.00 71.13 H new ATOM 0 HB2 SER B 2 18.892 -14.540 15.915 1.00 33.14 H new ATOM 0 HB3 SER B 2 20.451 -13.768 16.130 1.00 33.14 H new ATOM 0 HG SER B 2 19.519 -15.501 18.174 1.00 65.50 H new ATOM 1837 N LEU B 3 19.281 -10.954 16.752 1.00 34.40 N ATOM 1838 CA LEU B 3 18.975 -9.723 16.027 1.00 41.32 C ATOM 1839 C LEU B 3 19.421 -9.857 14.560 1.00 2.21 C ATOM 1840 O LEU B 3 20.611 -10.069 14.291 1.00 55.34 O ATOM 1841 CB LEU B 3 19.708 -8.533 16.695 1.00 45.42 C ATOM 1842 CG LEU B 3 19.381 -8.264 18.193 1.00 32.14 C ATOM 1843 CD1 LEU B 3 20.236 -7.103 18.735 1.00 53.53 C ATOM 1844 CD2 LEU B 3 17.880 -7.998 18.400 1.00 34.22 C ATOM 0 H LEU B 3 20.201 -10.946 17.193 1.00 34.40 H new ATOM 0 HA LEU B 3 17.900 -9.545 16.055 1.00 41.32 H new ATOM 0 HB2 LEU B 3 20.781 -8.701 16.606 1.00 45.42 H new ATOM 0 HB3 LEU B 3 19.478 -7.630 16.129 1.00 45.42 H new ATOM 0 HG LEU B 3 19.632 -9.161 18.759 1.00 32.14 H new ATOM 0 HD11 LEU B 3 19.993 -6.931 19.783 1.00 53.53 H new ATOM 0 HD12 LEU B 3 21.292 -7.356 18.645 1.00 53.53 H new ATOM 0 HD13 LEU B 3 20.029 -6.200 18.161 1.00 53.53 H new ATOM 0 HD21 LEU B 3 17.685 -7.814 19.457 1.00 34.22 H new ATOM 0 HD22 LEU B 3 17.582 -7.126 17.819 1.00 34.22 H new ATOM 0 HD23 LEU B 3 17.308 -8.866 18.072 1.00 34.22 H new ATOM 1856 N VAL B 4 18.461 -9.759 13.625 1.00 64.42 N ATOM 1857 CA VAL B 4 18.753 -9.724 12.176 1.00 52.22 C ATOM 1858 C VAL B 4 19.224 -8.313 11.769 1.00 43.13 C ATOM 1859 O VAL B 4 18.559 -7.308 12.053 1.00 33.22 O ATOM 1860 CB VAL B 4 17.529 -10.190 11.287 1.00 44.43 C ATOM 1861 CG1 VAL B 4 17.398 -11.730 11.292 1.00 54.44 C ATOM 1862 CG2 VAL B 4 16.210 -9.526 11.748 1.00 23.42 C ATOM 0 H VAL B 4 17.467 -9.702 13.846 1.00 64.42 H new ATOM 0 HA VAL B 4 19.553 -10.441 11.990 1.00 52.22 H new ATOM 0 HB VAL B 4 17.724 -9.867 10.264 1.00 44.43 H new ATOM 0 HG11 VAL B 4 16.550 -12.025 10.674 1.00 54.44 H new ATOM 0 HG12 VAL B 4 18.310 -12.174 10.893 1.00 54.44 H new ATOM 0 HG13 VAL B 4 17.242 -12.079 12.313 1.00 54.44 H new ATOM 0 HG21 VAL B 4 15.390 -9.868 11.116 1.00 23.42 H new ATOM 0 HG22 VAL B 4 16.008 -9.799 12.784 1.00 23.42 H new ATOM 0 HG23 VAL B 4 16.301 -8.443 11.669 1.00 23.42 H new ATOM 1872 N LYS B 5 20.390 -8.272 11.119 1.00 24.41 N ATOM 1873 CA LYS B 5 21.085 -7.037 10.745 1.00 53.31 C ATOM 1874 C LYS B 5 20.450 -6.413 9.486 1.00 32.12 C ATOM 1875 O LYS B 5 20.791 -6.776 8.364 1.00 22.25 O ATOM 1876 CB LYS B 5 22.587 -7.362 10.514 1.00 41.24 C ATOM 1877 CG LYS B 5 23.325 -7.915 11.754 1.00 74.11 C ATOM 1878 CD LYS B 5 24.770 -8.369 11.437 1.00 41.02 C ATOM 1879 CE LYS B 5 25.517 -8.876 12.683 1.00 70.33 C ATOM 1880 NZ LYS B 5 25.834 -7.779 13.633 1.00 61.15 N ATOM 0 H LYS B 5 20.888 -9.115 10.832 1.00 24.41 H new ATOM 0 HA LYS B 5 20.994 -6.305 11.548 1.00 53.31 H new ATOM 0 HB2 LYS B 5 22.668 -8.089 9.706 1.00 41.24 H new ATOM 0 HB3 LYS B 5 23.094 -6.457 10.180 1.00 41.24 H new ATOM 0 HG2 LYS B 5 23.351 -7.148 12.528 1.00 74.11 H new ATOM 0 HG3 LYS B 5 22.765 -8.758 12.159 1.00 74.11 H new ATOM 0 HD2 LYS B 5 24.742 -9.160 10.687 1.00 41.02 H new ATOM 0 HD3 LYS B 5 25.321 -7.536 11.001 1.00 41.02 H new ATOM 0 HE2 LYS B 5 24.910 -9.627 13.188 1.00 70.33 H new ATOM 0 HE3 LYS B 5 26.441 -9.367 12.376 1.00 70.33 H new ATOM 0 HZ1 LYS B 5 26.615 -8.072 14.254 1.00 61.15 H new ATOM 0 HZ2 LYS B 5 26.114 -6.930 13.102 1.00 61.15 H new ATOM 0 HZ3 LYS B 5 24.995 -7.566 14.210 1.00 61.15 H new ATOM 1894 N LEU B 6 19.483 -5.507 9.689 1.00 31.34 N ATOM 1895 CA LEU B 6 18.817 -4.785 8.587 1.00 10.21 C ATOM 1896 C LEU B 6 19.580 -3.499 8.282 1.00 21.43 C ATOM 1897 O LEU B 6 19.342 -2.458 8.904 1.00 43.13 O ATOM 1898 CB LEU B 6 17.324 -4.484 8.929 1.00 73.51 C ATOM 1899 CG LEU B 6 16.304 -5.601 8.556 1.00 64.04 C ATOM 1900 CD1 LEU B 6 16.635 -6.952 9.214 1.00 43.01 C ATOM 1901 CD2 LEU B 6 14.872 -5.163 8.888 1.00 64.51 C ATOM 0 H LEU B 6 19.139 -5.253 10.615 1.00 31.34 H new ATOM 0 HA LEU B 6 18.823 -5.418 7.700 1.00 10.21 H new ATOM 0 HB2 LEU B 6 17.248 -4.291 9.999 1.00 73.51 H new ATOM 0 HB3 LEU B 6 17.032 -3.566 8.418 1.00 73.51 H new ATOM 0 HG LEU B 6 16.382 -5.753 7.479 1.00 64.04 H new ATOM 0 HD11 LEU B 6 15.891 -7.692 8.919 1.00 43.01 H new ATOM 0 HD12 LEU B 6 17.623 -7.281 8.892 1.00 43.01 H new ATOM 0 HD13 LEU B 6 16.626 -6.841 10.298 1.00 43.01 H new ATOM 0 HD21 LEU B 6 14.177 -5.958 8.619 1.00 64.51 H new ATOM 0 HD22 LEU B 6 14.793 -4.957 9.955 1.00 64.51 H new ATOM 0 HD23 LEU B 6 14.627 -4.262 8.326 1.00 64.51 H new ATOM 1913 N GLU B 7 20.534 -3.597 7.353 1.00 75.22 N ATOM 1914 CA GLU B 7 21.292 -2.441 6.884 1.00 33.42 C ATOM 1915 C GLU B 7 20.435 -1.632 5.891 1.00 51.11 C ATOM 1916 O GLU B 7 19.896 -2.186 4.929 1.00 1.44 O ATOM 1917 CB GLU B 7 22.622 -2.888 6.235 1.00 45.54 C ATOM 1918 CG GLU B 7 23.492 -1.712 5.741 1.00 71.12 C ATOM 1919 CD GLU B 7 24.817 -2.167 5.131 1.00 64.20 C ATOM 1920 OE1 GLU B 7 25.827 -2.241 5.857 1.00 4.04 O ATOM 1921 OE2 GLU B 7 24.848 -2.469 3.921 1.00 52.33 O ATOM 0 H GLU B 7 20.800 -4.476 6.909 1.00 75.22 H new ATOM 0 HA GLU B 7 21.538 -1.805 7.734 1.00 33.42 H new ATOM 0 HB2 GLU B 7 23.191 -3.472 6.958 1.00 45.54 H new ATOM 0 HB3 GLU B 7 22.404 -3.546 5.394 1.00 45.54 H new ATOM 0 HG2 GLU B 7 22.934 -1.140 4.999 1.00 71.12 H new ATOM 0 HG3 GLU B 7 23.694 -1.040 6.575 1.00 71.12 H new ATOM 1928 N SER B 8 20.296 -0.329 6.164 1.00 2.44 N ATOM 1929 CA SER B 8 19.570 0.615 5.308 1.00 40.52 C ATOM 1930 C SER B 8 20.441 1.048 4.110 1.00 33.42 C ATOM 1931 O SER B 8 21.618 0.678 4.015 1.00 61.41 O ATOM 1932 CB SER B 8 19.165 1.840 6.164 1.00 63.23 C ATOM 1933 OG SER B 8 20.294 2.428 6.796 1.00 62.23 O ATOM 0 H SER B 8 20.691 0.105 6.998 1.00 2.44 H new ATOM 0 HA SER B 8 18.678 0.136 4.905 1.00 40.52 H new ATOM 0 HB2 SER B 8 18.673 2.580 5.533 1.00 63.23 H new ATOM 0 HB3 SER B 8 18.441 1.534 6.920 1.00 63.23 H new ATOM 0 HG SER B 8 20.770 2.995 6.154 1.00 62.23 H new ATOM 1939 N SER B 9 19.840 1.842 3.212 1.00 62.01 N ATOM 1940 CA SER B 9 20.545 2.465 2.075 1.00 21.42 C ATOM 1941 C SER B 9 21.565 3.521 2.552 1.00 1.01 C ATOM 1942 O SER B 9 22.510 3.859 1.828 1.00 45.25 O ATOM 1943 CB SER B 9 19.513 3.087 1.111 1.00 3.33 C ATOM 1944 OG SER B 9 18.660 3.997 1.780 1.00 71.02 O ATOM 0 H SER B 9 18.847 2.073 3.251 1.00 62.01 H new ATOM 0 HA SER B 9 21.108 1.694 1.548 1.00 21.42 H new ATOM 0 HB2 SER B 9 20.033 3.601 0.303 1.00 3.33 H new ATOM 0 HB3 SER B 9 18.917 2.296 0.655 1.00 3.33 H new ATOM 0 HG SER B 9 18.019 4.374 1.142 1.00 71.02 H new ATOM 1950 N ASP B 10 21.361 4.023 3.787 1.00 50.23 N ATOM 1951 CA ASP B 10 22.286 4.960 4.462 1.00 11.50 C ATOM 1952 C ASP B 10 23.394 4.179 5.241 1.00 63.25 C ATOM 1953 O ASP B 10 24.112 4.749 6.075 1.00 20.44 O ATOM 1954 CB ASP B 10 21.445 5.883 5.392 1.00 34.31 C ATOM 1955 CG ASP B 10 22.245 7.046 6.022 1.00 32.33 C ATOM 1956 OD1 ASP B 10 22.442 7.078 7.239 1.00 52.15 O ATOM 1957 OD2 ASP B 10 22.693 7.929 5.298 1.00 44.54 O ATOM 0 H ASP B 10 20.543 3.788 4.350 1.00 50.23 H new ATOM 0 HA ASP B 10 22.808 5.577 3.731 1.00 11.50 H new ATOM 0 HB2 ASP B 10 20.614 6.296 4.820 1.00 34.31 H new ATOM 0 HB3 ASP B 10 21.013 5.279 6.190 1.00 34.31 H new ATOM 1962 N GLU B 11 23.505 2.852 4.946 1.00 5.24 N ATOM 1963 CA GLU B 11 24.578 1.948 5.451 1.00 73.12 C ATOM 1964 C GLU B 11 24.485 1.688 6.973 1.00 4.44 C ATOM 1965 O GLU B 11 25.406 1.108 7.557 1.00 40.41 O ATOM 1966 CB GLU B 11 25.991 2.487 5.066 1.00 5.13 C ATOM 1967 CG GLU B 11 26.256 2.561 3.550 1.00 1.42 C ATOM 1968 CD GLU B 11 27.611 3.210 3.215 1.00 50.53 C ATOM 1969 OE1 GLU B 11 27.658 4.447 3.007 1.00 63.24 O ATOM 1970 OE2 GLU B 11 28.638 2.502 3.178 1.00 64.43 O ATOM 0 H GLU B 11 22.839 2.373 4.340 1.00 5.24 H new ATOM 0 HA GLU B 11 24.424 0.986 4.962 1.00 73.12 H new ATOM 0 HB2 GLU B 11 26.115 3.482 5.493 1.00 5.13 H new ATOM 0 HB3 GLU B 11 26.747 1.848 5.523 1.00 5.13 H new ATOM 0 HG2 GLU B 11 26.226 1.555 3.130 1.00 1.42 H new ATOM 0 HG3 GLU B 11 25.458 3.129 3.073 1.00 1.42 H new ATOM 1977 N LYS B 12 23.370 2.093 7.603 1.00 63.03 N ATOM 1978 CA LYS B 12 23.175 1.947 9.058 1.00 52.01 C ATOM 1979 C LYS B 12 22.502 0.603 9.360 1.00 20.34 C ATOM 1980 O LYS B 12 21.408 0.325 8.863 1.00 3.44 O ATOM 1981 CB LYS B 12 22.329 3.125 9.613 1.00 13.13 C ATOM 1982 CG LYS B 12 22.938 4.522 9.368 1.00 34.25 C ATOM 1983 CD LYS B 12 24.333 4.698 10.005 1.00 32.11 C ATOM 1984 CE LYS B 12 24.946 6.079 9.719 1.00 72.35 C ATOM 1985 NZ LYS B 12 25.124 6.328 8.263 1.00 60.32 N ATOM 0 H LYS B 12 22.582 2.528 7.123 1.00 63.03 H new ATOM 0 HA LYS B 12 24.147 1.969 9.551 1.00 52.01 H new ATOM 0 HB2 LYS B 12 21.339 3.090 9.159 1.00 13.13 H new ATOM 0 HB3 LYS B 12 22.193 2.985 10.685 1.00 13.13 H new ATOM 0 HG2 LYS B 12 23.011 4.696 8.294 1.00 34.25 H new ATOM 0 HG3 LYS B 12 22.265 5.280 9.768 1.00 34.25 H new ATOM 0 HD2 LYS B 12 24.256 4.555 11.083 1.00 32.11 H new ATOM 0 HD3 LYS B 12 25.001 3.923 9.628 1.00 32.11 H new ATOM 0 HE2 LYS B 12 24.305 6.853 10.142 1.00 72.35 H new ATOM 0 HE3 LYS B 12 25.911 6.156 10.219 1.00 72.35 H new ATOM 0 HZ1 LYS B 12 25.996 6.872 8.108 1.00 60.32 H new ATOM 0 HZ2 LYS B 12 25.189 5.420 7.761 1.00 60.32 H new ATOM 0 HZ3 LYS B 12 24.311 6.866 7.901 1.00 60.32 H new ATOM 1999 N VAL B 13 23.168 -0.213 10.188 1.00 31.42 N ATOM 2000 CA VAL B 13 22.758 -1.589 10.489 1.00 44.12 C ATOM 2001 C VAL B 13 21.809 -1.619 11.707 1.00 41.34 C ATOM 2002 O VAL B 13 22.256 -1.553 12.860 1.00 41.03 O ATOM 2003 CB VAL B 13 24.026 -2.488 10.750 1.00 24.34 C ATOM 2004 CG1 VAL B 13 23.634 -3.958 11.006 1.00 74.31 C ATOM 2005 CG2 VAL B 13 25.037 -2.366 9.582 1.00 15.44 C ATOM 0 H VAL B 13 24.019 0.070 10.674 1.00 31.42 H new ATOM 0 HA VAL B 13 22.219 -1.988 9.630 1.00 44.12 H new ATOM 0 HB VAL B 13 24.513 -2.123 11.654 1.00 24.34 H new ATOM 0 HG11 VAL B 13 24.533 -4.549 11.182 1.00 74.31 H new ATOM 0 HG12 VAL B 13 22.985 -4.015 11.880 1.00 74.31 H new ATOM 0 HG13 VAL B 13 23.106 -4.351 10.137 1.00 74.31 H new ATOM 0 HG21 VAL B 13 25.904 -2.995 9.784 1.00 15.44 H new ATOM 0 HG22 VAL B 13 24.563 -2.689 8.655 1.00 15.44 H new ATOM 0 HG23 VAL B 13 25.356 -1.328 9.484 1.00 15.44 H new ATOM 2015 N PHE B 14 20.497 -1.678 11.435 1.00 73.34 N ATOM 2016 CA PHE B 14 19.455 -1.764 12.472 1.00 44.42 C ATOM 2017 C PHE B 14 19.167 -3.234 12.776 1.00 55.25 C ATOM 2018 O PHE B 14 18.431 -3.906 12.044 1.00 21.34 O ATOM 2019 CB PHE B 14 18.170 -1.032 12.014 1.00 33.12 C ATOM 2020 CG PHE B 14 18.374 0.455 11.795 1.00 23.03 C ATOM 2021 CD1 PHE B 14 18.301 1.346 12.866 1.00 50.53 C ATOM 2022 CD2 PHE B 14 18.662 0.960 10.532 1.00 14.33 C ATOM 2023 CE1 PHE B 14 18.514 2.695 12.677 1.00 30.03 C ATOM 2024 CE2 PHE B 14 18.869 2.302 10.344 1.00 51.45 C ATOM 2025 CZ PHE B 14 18.797 3.173 11.417 1.00 4.35 C ATOM 0 H PHE B 14 20.126 -1.667 10.485 1.00 73.34 H new ATOM 0 HA PHE B 14 19.808 -1.276 13.381 1.00 44.42 H new ATOM 0 HB2 PHE B 14 17.813 -1.483 11.088 1.00 33.12 H new ATOM 0 HB3 PHE B 14 17.390 -1.179 12.761 1.00 33.12 H new ATOM 0 HD1 PHE B 14 18.075 0.975 13.855 1.00 50.53 H new ATOM 0 HD2 PHE B 14 18.723 0.287 9.689 1.00 14.33 H new ATOM 0 HE1 PHE B 14 18.459 3.375 13.515 1.00 30.03 H new ATOM 0 HE2 PHE B 14 19.089 2.680 9.357 1.00 51.45 H new ATOM 0 HZ PHE B 14 18.963 4.229 11.266 1.00 4.35 H new ATOM 2035 N GLU B 15 19.804 -3.733 13.831 1.00 43.01 N ATOM 2036 CA GLU B 15 19.662 -5.119 14.274 1.00 70.31 C ATOM 2037 C GLU B 15 18.366 -5.275 15.093 1.00 41.14 C ATOM 2038 O GLU B 15 18.371 -5.143 16.322 1.00 44.34 O ATOM 2039 CB GLU B 15 20.907 -5.523 15.093 1.00 70.14 C ATOM 2040 CG GLU B 15 22.228 -5.415 14.326 1.00 44.21 C ATOM 2041 CD GLU B 15 23.446 -5.744 15.193 1.00 54.14 C ATOM 2042 OE1 GLU B 15 23.751 -6.939 15.374 1.00 72.15 O ATOM 2043 OE2 GLU B 15 24.104 -4.808 15.690 1.00 44.34 O ATOM 0 H GLU B 15 20.439 -3.183 14.409 1.00 43.01 H new ATOM 0 HA GLU B 15 19.591 -5.783 13.413 1.00 70.31 H new ATOM 0 HB2 GLU B 15 20.963 -4.893 15.981 1.00 70.14 H new ATOM 0 HB3 GLU B 15 20.783 -6.550 15.438 1.00 70.14 H new ATOM 0 HG2 GLU B 15 22.203 -6.091 13.471 1.00 44.21 H new ATOM 0 HG3 GLU B 15 22.332 -4.405 13.930 1.00 44.21 H new ATOM 2050 N ILE B 16 17.250 -5.486 14.379 1.00 3.51 N ATOM 2051 CA ILE B 16 15.921 -5.704 14.989 1.00 5.52 C ATOM 2052 C ILE B 16 15.748 -7.198 15.334 1.00 32.32 C ATOM 2053 O ILE B 16 16.414 -8.056 14.744 1.00 31.22 O ATOM 2054 CB ILE B 16 14.762 -5.225 14.020 1.00 34.14 C ATOM 2055 CG1 ILE B 16 13.354 -5.345 14.708 1.00 13.25 C ATOM 2056 CG2 ILE B 16 14.803 -5.990 12.672 1.00 53.23 C ATOM 2057 CD1 ILE B 16 12.167 -5.026 13.820 1.00 3.45 C ATOM 0 H ILE B 16 17.239 -5.511 13.359 1.00 3.51 H new ATOM 0 HA ILE B 16 15.858 -5.112 15.902 1.00 5.52 H new ATOM 0 HB ILE B 16 14.929 -4.170 13.803 1.00 34.14 H new ATOM 0 HG12 ILE B 16 13.239 -6.360 15.088 1.00 13.25 H new ATOM 0 HG13 ILE B 16 13.331 -4.678 15.570 1.00 13.25 H new ATOM 0 HG21 ILE B 16 13.996 -5.639 12.030 1.00 53.23 H new ATOM 0 HG22 ILE B 16 15.760 -5.812 12.182 1.00 53.23 H new ATOM 0 HG23 ILE B 16 14.682 -7.058 12.856 1.00 53.23 H new ATOM 0 HD11 ILE B 16 11.245 -5.139 14.390 1.00 3.45 H new ATOM 0 HD12 ILE B 16 12.247 -4.000 13.460 1.00 3.45 H new ATOM 0 HD13 ILE B 16 12.154 -5.709 12.971 1.00 3.45 H new ATOM 2069 N GLU B 17 14.866 -7.488 16.308 1.00 31.02 N ATOM 2070 CA GLU B 17 14.503 -8.855 16.692 1.00 5.55 C ATOM 2071 C GLU B 17 13.891 -9.591 15.483 1.00 54.10 C ATOM 2072 O GLU B 17 13.018 -9.047 14.784 1.00 11.02 O ATOM 2073 CB GLU B 17 13.520 -8.856 17.900 1.00 74.25 C ATOM 2074 CG GLU B 17 14.051 -8.192 19.208 1.00 72.04 C ATOM 2075 CD GLU B 17 14.046 -6.645 19.199 1.00 62.15 C ATOM 2076 OE1 GLU B 17 15.065 -6.017 18.826 1.00 15.04 O ATOM 2077 OE2 GLU B 17 13.017 -6.047 19.561 1.00 75.11 O ATOM 0 H GLU B 17 14.384 -6.772 16.852 1.00 31.02 H new ATOM 0 HA GLU B 17 15.405 -9.381 17.005 1.00 5.55 H new ATOM 0 HB2 GLU B 17 12.606 -8.344 17.600 1.00 74.25 H new ATOM 0 HB3 GLU B 17 13.249 -9.888 18.123 1.00 74.25 H new ATOM 0 HG2 GLU B 17 13.446 -8.538 20.046 1.00 72.04 H new ATOM 0 HG3 GLU B 17 15.070 -8.537 19.386 1.00 72.04 H new ATOM 2084 N LYS B 18 14.362 -10.825 15.266 1.00 2.42 N ATOM 2085 CA LYS B 18 14.086 -11.622 14.059 1.00 2.45 C ATOM 2086 C LYS B 18 12.589 -11.930 13.886 1.00 21.42 C ATOM 2087 O LYS B 18 12.064 -11.880 12.764 1.00 64.13 O ATOM 2088 CB LYS B 18 14.936 -12.912 14.119 1.00 70.34 C ATOM 2089 CG LYS B 18 14.833 -13.834 12.888 1.00 64.40 C ATOM 2090 CD LYS B 18 15.907 -14.945 12.909 1.00 14.41 C ATOM 2091 CE LYS B 18 15.811 -15.875 11.698 1.00 61.15 C ATOM 2092 NZ LYS B 18 14.551 -16.667 11.686 1.00 64.22 N ATOM 0 H LYS B 18 14.958 -11.310 15.937 1.00 2.42 H new ATOM 0 HA LYS B 18 14.364 -11.041 13.180 1.00 2.45 H new ATOM 0 HB2 LYS B 18 15.981 -12.632 14.255 1.00 70.34 H new ATOM 0 HB3 LYS B 18 14.641 -13.480 15.002 1.00 70.34 H new ATOM 0 HG2 LYS B 18 13.842 -14.287 12.856 1.00 64.40 H new ATOM 0 HG3 LYS B 18 14.942 -13.241 11.980 1.00 64.40 H new ATOM 0 HD2 LYS B 18 16.897 -14.489 12.935 1.00 14.41 H new ATOM 0 HD3 LYS B 18 15.802 -15.531 13.822 1.00 14.41 H new ATOM 0 HE2 LYS B 18 15.874 -15.284 10.784 1.00 61.15 H new ATOM 0 HE3 LYS B 18 16.663 -16.554 11.697 1.00 61.15 H new ATOM 0 HZ1 LYS B 18 14.700 -17.549 11.155 1.00 64.22 H new ATOM 0 HZ2 LYS B 18 14.274 -16.893 12.663 1.00 64.22 H new ATOM 0 HZ3 LYS B 18 13.797 -16.113 11.232 1.00 64.22 H new ATOM 2106 N GLU B 19 11.914 -12.219 15.011 1.00 34.22 N ATOM 2107 CA GLU B 19 10.465 -12.511 15.037 1.00 31.44 C ATOM 2108 C GLU B 19 9.623 -11.292 14.589 1.00 41.23 C ATOM 2109 O GLU B 19 8.545 -11.446 14.004 1.00 71.13 O ATOM 2110 CB GLU B 19 10.048 -12.966 16.463 1.00 20.13 C ATOM 2111 CG GLU B 19 10.316 -11.928 17.580 1.00 11.23 C ATOM 2112 CD GLU B 19 9.987 -12.450 18.986 1.00 61.35 C ATOM 2113 OE1 GLU B 19 10.914 -12.683 19.791 1.00 10.35 O ATOM 2114 OE2 GLU B 19 8.789 -12.651 19.284 1.00 61.44 O ATOM 0 H GLU B 19 12.355 -12.258 15.930 1.00 34.22 H new ATOM 0 HA GLU B 19 10.270 -13.315 14.328 1.00 31.44 H new ATOM 0 HB2 GLU B 19 8.985 -13.205 16.456 1.00 20.13 H new ATOM 0 HB3 GLU B 19 10.580 -13.886 16.706 1.00 20.13 H new ATOM 0 HG2 GLU B 19 11.364 -11.631 17.546 1.00 11.23 H new ATOM 0 HG3 GLU B 19 9.725 -11.033 17.385 1.00 11.23 H new ATOM 2121 N ILE B 20 10.137 -10.082 14.875 1.00 70.50 N ATOM 2122 CA ILE B 20 9.459 -8.813 14.566 1.00 21.51 C ATOM 2123 C ILE B 20 9.684 -8.412 13.087 1.00 53.14 C ATOM 2124 O ILE B 20 8.804 -7.830 12.451 1.00 72.31 O ATOM 2125 CB ILE B 20 9.945 -7.666 15.531 1.00 75.40 C ATOM 2126 CG1 ILE B 20 9.837 -8.118 17.029 1.00 32.12 C ATOM 2127 CG2 ILE B 20 9.147 -6.371 15.289 1.00 72.14 C ATOM 2128 CD1 ILE B 20 10.167 -7.048 18.062 1.00 21.22 C ATOM 0 H ILE B 20 11.041 -9.958 15.330 1.00 70.50 H new ATOM 0 HA ILE B 20 8.390 -8.959 14.721 1.00 21.51 H new ATOM 0 HB ILE B 20 10.993 -7.461 15.314 1.00 75.40 H new ATOM 0 HG12 ILE B 20 8.823 -8.473 17.211 1.00 32.12 H new ATOM 0 HG13 ILE B 20 10.504 -8.966 17.184 1.00 32.12 H new ATOM 0 HG21 ILE B 20 9.500 -5.594 15.967 1.00 72.14 H new ATOM 0 HG22 ILE B 20 9.287 -6.045 14.258 1.00 72.14 H new ATOM 0 HG23 ILE B 20 8.088 -6.557 15.470 1.00 72.14 H new ATOM 0 HD11 ILE B 20 10.061 -7.464 19.064 1.00 21.22 H new ATOM 0 HD12 ILE B 20 11.192 -6.706 17.917 1.00 21.22 H new ATOM 0 HD13 ILE B 20 9.484 -6.206 17.945 1.00 21.22 H new ATOM 2140 N ALA B 21 10.874 -8.749 12.547 1.00 14.43 N ATOM 2141 CA ALA B 21 11.219 -8.493 11.125 1.00 65.50 C ATOM 2142 C ALA B 21 10.306 -9.284 10.160 1.00 50.41 C ATOM 2143 O ALA B 21 10.054 -8.851 9.027 1.00 25.11 O ATOM 2144 CB ALA B 21 12.695 -8.829 10.877 1.00 13.24 C ATOM 0 H ALA B 21 11.619 -9.202 13.075 1.00 14.43 H new ATOM 0 HA ALA B 21 11.055 -7.434 10.924 1.00 65.50 H new ATOM 0 HB1 ALA B 21 12.941 -8.639 9.832 1.00 13.24 H new ATOM 0 HB2 ALA B 21 13.322 -8.207 11.516 1.00 13.24 H new ATOM 0 HB3 ALA B 21 12.872 -9.880 11.106 1.00 13.24 H new ATOM 2150 N CYS B 22 9.803 -10.432 10.648 1.00 55.30 N ATOM 2151 CA CYS B 22 8.884 -11.311 9.908 1.00 11.21 C ATOM 2152 C CYS B 22 7.503 -10.654 9.657 1.00 41.14 C ATOM 2153 O CYS B 22 6.780 -11.070 8.746 1.00 4.04 O ATOM 2154 CB CYS B 22 8.720 -12.632 10.680 1.00 22.23 C ATOM 2155 SG CYS B 22 10.279 -13.498 10.978 1.00 3.43 S ATOM 0 H CYS B 22 10.027 -10.779 11.581 1.00 55.30 H new ATOM 0 HA CYS B 22 9.319 -11.501 8.927 1.00 11.21 H new ATOM 0 HB2 CYS B 22 8.240 -12.426 11.637 1.00 22.23 H new ATOM 0 HB3 CYS B 22 8.051 -13.288 10.123 1.00 22.23 H new ATOM 0 HG CYS B 22 11.035 -12.777 11.751 1.00 3.43 H new ATOM 2161 N MET B 23 7.135 -9.652 10.487 1.00 50.30 N ATOM 2162 CA MET B 23 5.857 -8.905 10.348 1.00 5.22 C ATOM 2163 C MET B 23 5.778 -8.147 9.009 1.00 40.40 C ATOM 2164 O MET B 23 4.687 -7.912 8.476 1.00 51.30 O ATOM 2165 CB MET B 23 5.679 -7.909 11.515 1.00 21.41 C ATOM 2166 CG MET B 23 5.524 -8.555 12.893 1.00 22.11 C ATOM 2167 SD MET B 23 5.367 -7.323 14.199 1.00 64.44 S ATOM 2168 CE MET B 23 3.948 -6.364 13.643 1.00 22.30 C ATOM 0 H MET B 23 7.709 -9.337 11.269 1.00 50.30 H new ATOM 0 HA MET B 23 5.053 -9.641 10.371 1.00 5.22 H new ATOM 0 HB2 MET B 23 6.540 -7.240 11.538 1.00 21.41 H new ATOM 0 HB3 MET B 23 4.802 -7.293 11.318 1.00 21.41 H new ATOM 0 HG2 MET B 23 4.645 -9.200 12.895 1.00 22.11 H new ATOM 0 HG3 MET B 23 6.386 -9.190 13.095 1.00 22.11 H new ATOM 0 HE1 MET B 23 3.311 -6.129 14.496 1.00 22.30 H new ATOM 0 HE2 MET B 23 4.293 -5.439 13.181 1.00 22.30 H new ATOM 0 HE3 MET B 23 3.380 -6.943 12.915 1.00 22.30 H new ATOM 2178 N SER B 24 6.942 -7.745 8.499 1.00 51.21 N ATOM 2179 CA SER B 24 7.067 -7.198 7.149 1.00 35.04 C ATOM 2180 C SER B 24 7.032 -8.354 6.149 1.00 10.11 C ATOM 2181 O SER B 24 7.774 -9.324 6.316 1.00 25.11 O ATOM 2182 CB SER B 24 8.385 -6.419 7.016 1.00 51.43 C ATOM 2183 OG SER B 24 8.622 -6.023 5.673 1.00 54.02 O ATOM 0 H SER B 24 7.824 -7.789 9.010 1.00 51.21 H new ATOM 0 HA SER B 24 6.243 -6.513 6.948 1.00 35.04 H new ATOM 0 HB2 SER B 24 8.354 -5.537 7.656 1.00 51.43 H new ATOM 0 HB3 SER B 24 9.212 -7.038 7.365 1.00 51.43 H new ATOM 0 HG SER B 24 7.766 -5.910 5.209 1.00 54.02 H new ATOM 2189 N VAL B 25 6.167 -8.242 5.121 1.00 34.20 N ATOM 2190 CA VAL B 25 6.003 -9.284 4.095 1.00 33.22 C ATOM 2191 C VAL B 25 7.311 -9.455 3.299 1.00 52.34 C ATOM 2192 O VAL B 25 7.819 -10.564 3.176 1.00 50.24 O ATOM 2193 CB VAL B 25 4.813 -8.961 3.112 1.00 63.24 C ATOM 2194 CG1 VAL B 25 4.626 -10.089 2.066 1.00 13.34 C ATOM 2195 CG2 VAL B 25 3.500 -8.698 3.892 1.00 72.13 C ATOM 0 H VAL B 25 5.566 -7.430 4.981 1.00 34.20 H new ATOM 0 HA VAL B 25 5.764 -10.215 4.609 1.00 33.22 H new ATOM 0 HB VAL B 25 5.068 -8.049 2.572 1.00 63.24 H new ATOM 0 HG11 VAL B 25 3.798 -9.837 1.403 1.00 13.34 H new ATOM 0 HG12 VAL B 25 5.539 -10.198 1.481 1.00 13.34 H new ATOM 0 HG13 VAL B 25 4.409 -11.027 2.577 1.00 13.34 H new ATOM 0 HG21 VAL B 25 2.697 -8.478 3.189 1.00 72.13 H new ATOM 0 HG22 VAL B 25 3.240 -9.582 4.475 1.00 72.13 H new ATOM 0 HG23 VAL B 25 3.638 -7.849 4.562 1.00 72.13 H new ATOM 2205 N THR B 26 7.857 -8.327 2.809 1.00 24.33 N ATOM 2206 CA THR B 26 9.079 -8.310 1.986 1.00 4.51 C ATOM 2207 C THR B 26 10.301 -8.872 2.748 1.00 31.33 C ATOM 2208 O THR B 26 10.995 -9.735 2.220 1.00 13.35 O ATOM 2209 CB THR B 26 9.371 -6.871 1.458 1.00 72.53 C ATOM 2210 OG1 THR B 26 8.247 -6.425 0.681 1.00 51.13 O ATOM 2211 CG2 THR B 26 10.651 -6.783 0.600 1.00 41.21 C ATOM 0 H THR B 26 7.462 -7.401 2.973 1.00 24.33 H new ATOM 0 HA THR B 26 8.902 -8.965 1.133 1.00 4.51 H new ATOM 0 HB THR B 26 9.531 -6.234 2.328 1.00 72.53 H new ATOM 0 HG1 THR B 26 8.387 -5.495 0.407 1.00 51.13 H new ATOM 0 HG21 THR B 26 10.795 -5.756 0.265 1.00 41.21 H new ATOM 0 HG22 THR B 26 11.510 -7.094 1.195 1.00 41.21 H new ATOM 0 HG23 THR B 26 10.554 -7.437 -0.267 1.00 41.21 H new ATOM 2219 N ILE B 27 10.520 -8.407 3.999 1.00 22.50 N ATOM 2220 CA ILE B 27 11.671 -8.847 4.826 1.00 45.20 C ATOM 2221 C ILE B 27 11.561 -10.353 5.148 1.00 13.20 C ATOM 2222 O ILE B 27 12.551 -11.080 5.060 1.00 23.34 O ATOM 2223 CB ILE B 27 11.793 -8.015 6.158 1.00 13.02 C ATOM 2224 CG1 ILE B 27 11.969 -6.495 5.846 1.00 23.52 C ATOM 2225 CG2 ILE B 27 12.959 -8.533 7.050 1.00 15.53 C ATOM 2226 CD1 ILE B 27 11.889 -5.585 7.061 1.00 61.11 C ATOM 0 H ILE B 27 9.915 -7.727 4.460 1.00 22.50 H new ATOM 0 HA ILE B 27 12.574 -8.670 4.243 1.00 45.20 H new ATOM 0 HB ILE B 27 10.866 -8.148 6.716 1.00 13.02 H new ATOM 0 HG12 ILE B 27 12.934 -6.347 5.361 1.00 23.52 H new ATOM 0 HG13 ILE B 27 11.203 -6.193 5.132 1.00 23.52 H new ATOM 0 HG21 ILE B 27 13.014 -7.936 7.960 1.00 15.53 H new ATOM 0 HG22 ILE B 27 12.782 -9.576 7.311 1.00 15.53 H new ATOM 0 HG23 ILE B 27 13.899 -8.450 6.505 1.00 15.53 H new ATOM 0 HD11 ILE B 27 12.022 -4.549 6.749 1.00 61.11 H new ATOM 0 HD12 ILE B 27 10.915 -5.698 7.537 1.00 61.11 H new ATOM 0 HD13 ILE B 27 12.673 -5.854 7.769 1.00 61.11 H new ATOM 2238 N LYS B 28 10.332 -10.803 5.488 1.00 62.44 N ATOM 2239 CA LYS B 28 10.034 -12.225 5.763 1.00 1.25 C ATOM 2240 C LYS B 28 10.369 -13.089 4.531 1.00 64.15 C ATOM 2241 O LYS B 28 11.068 -14.099 4.643 1.00 52.13 O ATOM 2242 CB LYS B 28 8.539 -12.393 6.140 1.00 55.32 C ATOM 2243 CG LYS B 28 8.110 -13.834 6.509 1.00 24.40 C ATOM 2244 CD LYS B 28 6.587 -13.972 6.733 1.00 22.44 C ATOM 2245 CE LYS B 28 5.763 -13.598 5.486 1.00 43.31 C ATOM 2246 NZ LYS B 28 6.120 -14.419 4.299 1.00 41.41 N ATOM 0 H LYS B 28 9.521 -10.191 5.579 1.00 62.44 H new ATOM 0 HA LYS B 28 10.649 -12.555 6.600 1.00 1.25 H new ATOM 0 HB2 LYS B 28 8.318 -11.738 6.983 1.00 55.32 H new ATOM 0 HB3 LYS B 28 7.929 -12.053 5.303 1.00 55.32 H new ATOM 0 HG2 LYS B 28 8.418 -14.514 5.714 1.00 24.40 H new ATOM 0 HG3 LYS B 28 8.634 -14.143 7.413 1.00 24.40 H new ATOM 0 HD2 LYS B 28 6.358 -14.999 7.019 1.00 22.44 H new ATOM 0 HD3 LYS B 28 6.288 -13.335 7.565 1.00 22.44 H new ATOM 0 HE2 LYS B 28 4.703 -13.723 5.705 1.00 43.31 H new ATOM 0 HE3 LYS B 28 5.918 -12.544 5.255 1.00 43.31 H new ATOM 0 HZ1 LYS B 28 6.570 -13.815 3.582 1.00 41.41 H new ATOM 0 HZ2 LYS B 28 6.781 -15.170 4.583 1.00 41.41 H new ATOM 0 HZ3 LYS B 28 5.260 -14.847 3.901 1.00 41.41 H new ATOM 2260 N ASN B 29 9.900 -12.625 3.356 1.00 60.23 N ATOM 2261 CA ASN B 29 10.091 -13.306 2.059 1.00 24.03 C ATOM 2262 C ASN B 29 11.567 -13.307 1.642 1.00 63.04 C ATOM 2263 O ASN B 29 12.008 -14.227 0.957 1.00 73.44 O ATOM 2264 CB ASN B 29 9.217 -12.639 0.953 1.00 43.51 C ATOM 2265 CG ASN B 29 7.709 -12.908 1.092 1.00 43.03 C ATOM 2266 OD1 ASN B 29 7.194 -13.143 2.183 1.00 15.41 O ATOM 2267 ND2 ASN B 29 6.984 -12.851 -0.016 1.00 62.33 N ATOM 0 H ASN B 29 9.371 -11.756 3.279 1.00 60.23 H new ATOM 0 HA ASN B 29 9.773 -14.342 2.179 1.00 24.03 H new ATOM 0 HB2 ASN B 29 9.386 -11.562 0.973 1.00 43.51 H new ATOM 0 HB3 ASN B 29 9.550 -12.996 -0.022 1.00 43.51 H new ATOM 0 HD21 ASN B 29 5.976 -13.004 0.025 1.00 62.33 H new ATOM 0 HD22 ASN B 29 7.434 -12.654 -0.910 1.00 62.33 H new ATOM 2274 N MET B 30 12.319 -12.263 2.055 1.00 30.13 N ATOM 2275 CA MET B 30 13.775 -12.179 1.819 1.00 33.25 C ATOM 2276 C MET B 30 14.488 -13.298 2.593 1.00 52.41 C ATOM 2277 O MET B 30 15.265 -14.056 2.014 1.00 12.33 O ATOM 2278 CB MET B 30 14.353 -10.792 2.234 1.00 41.13 C ATOM 2279 CG MET B 30 14.012 -9.636 1.280 1.00 64.32 C ATOM 2280 SD MET B 30 14.695 -9.878 -0.375 1.00 2.04 S ATOM 2281 CE MET B 30 14.163 -8.383 -1.211 1.00 4.12 C ATOM 0 H MET B 30 11.937 -11.462 2.557 1.00 30.13 H new ATOM 0 HA MET B 30 13.948 -12.299 0.750 1.00 33.25 H new ATOM 0 HB2 MET B 30 13.983 -10.544 3.229 1.00 41.13 H new ATOM 0 HB3 MET B 30 15.437 -10.874 2.308 1.00 41.13 H new ATOM 0 HG2 MET B 30 12.929 -9.534 1.211 1.00 64.32 H new ATOM 0 HG3 MET B 30 14.394 -8.703 1.694 1.00 64.32 H new ATOM 0 HE1 MET B 30 14.515 -8.398 -2.242 1.00 4.12 H new ATOM 0 HE2 MET B 30 13.074 -8.328 -1.200 1.00 4.12 H new ATOM 0 HE3 MET B 30 14.576 -7.514 -0.699 1.00 4.12 H new ATOM 2291 N ILE B 31 14.167 -13.408 3.905 1.00 34.23 N ATOM 2292 CA ILE B 31 14.750 -14.423 4.809 1.00 30.20 C ATOM 2293 C ILE B 31 14.450 -15.844 4.281 1.00 64.42 C ATOM 2294 O ILE B 31 15.344 -16.683 4.202 1.00 14.03 O ATOM 2295 CB ILE B 31 14.208 -14.259 6.291 1.00 43.21 C ATOM 2296 CG1 ILE B 31 14.549 -12.835 6.855 1.00 74.43 C ATOM 2297 CG2 ILE B 31 14.766 -15.364 7.233 1.00 14.51 C ATOM 2298 CD1 ILE B 31 13.961 -12.521 8.228 1.00 34.14 C ATOM 0 H ILE B 31 13.495 -12.793 4.365 1.00 34.23 H new ATOM 0 HA ILE B 31 15.829 -14.272 4.831 1.00 30.20 H new ATOM 0 HB ILE B 31 13.124 -14.370 6.255 1.00 43.21 H new ATOM 0 HG12 ILE B 31 15.633 -12.734 6.910 1.00 74.43 H new ATOM 0 HG13 ILE B 31 14.195 -12.087 6.146 1.00 74.43 H new ATOM 0 HG21 ILE B 31 14.372 -15.218 8.239 1.00 14.51 H new ATOM 0 HG22 ILE B 31 14.463 -16.344 6.864 1.00 14.51 H new ATOM 0 HG23 ILE B 31 15.854 -15.306 7.258 1.00 14.51 H new ATOM 0 HD11 ILE B 31 14.254 -11.515 8.528 1.00 34.14 H new ATOM 0 HD12 ILE B 31 12.874 -12.583 8.181 1.00 34.14 H new ATOM 0 HD13 ILE B 31 14.334 -13.240 8.957 1.00 34.14 H new ATOM 2310 N GLU B 32 13.190 -16.068 3.858 1.00 44.24 N ATOM 2311 CA GLU B 32 12.724 -17.376 3.345 1.00 45.55 C ATOM 2312 C GLU B 32 13.413 -17.743 2.011 1.00 34.11 C ATOM 2313 O GLU B 32 13.821 -18.890 1.818 1.00 11.11 O ATOM 2314 CB GLU B 32 11.183 -17.368 3.169 1.00 44.44 C ATOM 2315 CG GLU B 32 10.402 -17.186 4.483 1.00 61.11 C ATOM 2316 CD GLU B 32 8.886 -17.087 4.275 1.00 62.14 C ATOM 2317 OE1 GLU B 32 8.155 -18.062 4.568 1.00 62.42 O ATOM 2318 OE2 GLU B 32 8.415 -16.031 3.799 1.00 61.40 O ATOM 0 H GLU B 32 12.466 -15.350 3.861 1.00 44.24 H new ATOM 0 HA GLU B 32 12.995 -18.135 4.079 1.00 45.55 H new ATOM 0 HB2 GLU B 32 10.910 -16.566 2.483 1.00 44.44 H new ATOM 0 HB3 GLU B 32 10.876 -18.304 2.703 1.00 44.44 H new ATOM 0 HG2 GLU B 32 10.617 -18.024 5.145 1.00 61.11 H new ATOM 0 HG3 GLU B 32 10.753 -16.285 4.985 1.00 61.11 H new ATOM 2325 N ASP B 33 13.556 -16.743 1.117 1.00 21.41 N ATOM 2326 CA ASP B 33 14.123 -16.929 -0.245 1.00 70.30 C ATOM 2327 C ASP B 33 15.620 -17.282 -0.169 1.00 54.25 C ATOM 2328 O ASP B 33 16.110 -18.152 -0.895 1.00 71.30 O ATOM 2329 CB ASP B 33 13.931 -15.647 -1.097 1.00 22.30 C ATOM 2330 CG ASP B 33 14.314 -15.841 -2.579 1.00 64.02 C ATOM 2331 OD1 ASP B 33 15.479 -15.574 -2.954 1.00 51.12 O ATOM 2332 OD2 ASP B 33 13.440 -16.260 -3.375 1.00 54.23 O ATOM 0 H ASP B 33 13.283 -15.780 1.314 1.00 21.41 H new ATOM 0 HA ASP B 33 13.590 -17.753 -0.720 1.00 70.30 H new ATOM 0 HB2 ASP B 33 12.890 -15.330 -1.036 1.00 22.30 H new ATOM 0 HB3 ASP B 33 14.534 -14.844 -0.674 1.00 22.30 H new ATOM 2337 N ILE B 34 16.323 -16.578 0.727 1.00 25.22 N ATOM 2338 CA ILE B 34 17.752 -16.812 1.020 1.00 40.34 C ATOM 2339 C ILE B 34 17.940 -18.163 1.764 1.00 5.25 C ATOM 2340 O ILE B 34 19.010 -18.782 1.699 1.00 2.21 O ATOM 2341 CB ILE B 34 18.335 -15.589 1.849 1.00 50.32 C ATOM 2342 CG1 ILE B 34 18.215 -14.266 1.013 1.00 74.33 C ATOM 2343 CG2 ILE B 34 19.799 -15.821 2.299 1.00 24.35 C ATOM 2344 CD1 ILE B 34 18.618 -13.000 1.756 1.00 23.43 C ATOM 0 H ILE B 34 15.916 -15.821 1.277 1.00 25.22 H new ATOM 0 HA ILE B 34 18.310 -16.880 0.086 1.00 40.34 H new ATOM 0 HB ILE B 34 17.739 -15.498 2.757 1.00 50.32 H new ATOM 0 HG12 ILE B 34 18.835 -14.359 0.121 1.00 74.33 H new ATOM 0 HG13 ILE B 34 17.184 -14.159 0.675 1.00 74.33 H new ATOM 0 HG21 ILE B 34 20.148 -14.955 2.861 1.00 24.35 H new ATOM 0 HG22 ILE B 34 19.849 -16.708 2.930 1.00 24.35 H new ATOM 0 HG23 ILE B 34 20.431 -15.963 1.422 1.00 24.35 H new ATOM 0 HD11 ILE B 34 18.502 -12.139 1.098 1.00 23.43 H new ATOM 0 HD12 ILE B 34 17.983 -12.875 2.633 1.00 23.43 H new ATOM 0 HD13 ILE B 34 19.659 -13.078 2.070 1.00 23.43 H new ATOM 2356 N GLY B 35 16.864 -18.632 2.428 1.00 64.44 N ATOM 2357 CA GLY B 35 16.894 -19.882 3.200 1.00 3.13 C ATOM 2358 C GLY B 35 17.377 -19.667 4.626 1.00 23.50 C ATOM 2359 O GLY B 35 17.799 -20.621 5.289 1.00 71.45 O ATOM 0 H GLY B 35 15.961 -18.158 2.442 1.00 64.44 H new ATOM 0 HA2 GLY B 35 15.896 -20.319 3.219 1.00 3.13 H new ATOM 0 HA3 GLY B 35 17.547 -20.599 2.702 1.00 3.13 H new ATOM 2363 N GLU B 36 17.314 -18.388 5.061 1.00 64.35 N ATOM 2364 CA GLU B 36 17.695 -17.903 6.392 1.00 70.11 C ATOM 2365 C GLU B 36 19.227 -17.856 6.548 1.00 2.10 C ATOM 2366 O GLU B 36 19.900 -18.890 6.525 1.00 13.45 O ATOM 2367 CB GLU B 36 17.025 -18.709 7.540 1.00 2.04 C ATOM 2368 CG GLU B 36 17.303 -18.142 8.946 1.00 63.40 C ATOM 2369 CD GLU B 36 16.623 -18.943 10.063 1.00 55.32 C ATOM 2370 OE1 GLU B 36 17.328 -19.531 10.916 1.00 74.21 O ATOM 2371 OE2 GLU B 36 15.373 -18.977 10.098 1.00 1.53 O ATOM 0 H GLU B 36 16.979 -17.636 4.459 1.00 64.35 H new ATOM 0 HA GLU B 36 17.317 -16.884 6.476 1.00 70.11 H new ATOM 0 HB2 GLU B 36 15.948 -18.731 7.374 1.00 2.04 H new ATOM 0 HB3 GLU B 36 17.375 -19.740 7.499 1.00 2.04 H new ATOM 0 HG2 GLU B 36 18.379 -18.129 9.120 1.00 63.40 H new ATOM 0 HG3 GLU B 36 16.961 -17.108 8.988 1.00 63.40 H new ATOM 2378 N SER B 37 19.761 -16.636 6.706 1.00 30.53 N ATOM 2379 CA SER B 37 21.199 -16.376 6.868 1.00 4.20 C ATOM 2380 C SER B 37 21.404 -15.223 7.857 1.00 14.02 C ATOM 2381 O SER B 37 20.544 -14.336 7.975 1.00 51.53 O ATOM 2382 CB SER B 37 21.838 -16.039 5.497 1.00 21.02 C ATOM 2383 OG SER B 37 21.747 -17.143 4.612 1.00 64.03 O ATOM 0 H SER B 37 19.196 -15.787 6.725 1.00 30.53 H new ATOM 0 HA SER B 37 21.685 -17.269 7.262 1.00 4.20 H new ATOM 0 HB2 SER B 37 21.337 -15.175 5.060 1.00 21.02 H new ATOM 0 HB3 SER B 37 22.884 -15.764 5.636 1.00 21.02 H new ATOM 0 HG SER B 37 22.155 -16.908 3.753 1.00 64.03 H new ATOM 2389 N ASP B 38 22.547 -15.247 8.560 1.00 23.54 N ATOM 2390 CA ASP B 38 22.943 -14.190 9.512 1.00 13.01 C ATOM 2391 C ASP B 38 23.565 -12.982 8.774 1.00 64.32 C ATOM 2392 O ASP B 38 23.886 -11.969 9.404 1.00 0.15 O ATOM 2393 CB ASP B 38 23.933 -14.760 10.568 1.00 43.14 C ATOM 2394 CG ASP B 38 25.260 -15.276 9.967 1.00 53.32 C ATOM 2395 OD1 ASP B 38 26.247 -14.510 9.910 1.00 60.00 O ATOM 2396 OD2 ASP B 38 25.321 -16.455 9.555 1.00 52.11 O ATOM 0 H ASP B 38 23.228 -16.003 8.486 1.00 23.54 H new ATOM 0 HA ASP B 38 22.048 -13.840 10.027 1.00 13.01 H new ATOM 0 HB2 ASP B 38 24.155 -13.984 11.300 1.00 43.14 H new ATOM 0 HB3 ASP B 38 23.447 -15.575 11.105 1.00 43.14 H new ATOM 2401 N SER B 39 23.744 -13.122 7.439 1.00 61.24 N ATOM 2402 CA SER B 39 24.250 -12.061 6.552 1.00 45.25 C ATOM 2403 C SER B 39 23.448 -10.743 6.728 1.00 64.31 C ATOM 2404 O SER B 39 22.210 -10.788 6.739 1.00 11.35 O ATOM 2405 CB SER B 39 24.154 -12.533 5.084 1.00 41.24 C ATOM 2406 OG SER B 39 24.836 -13.761 4.901 1.00 14.44 O ATOM 0 H SER B 39 23.536 -13.990 6.946 1.00 61.24 H new ATOM 0 HA SER B 39 25.289 -11.861 6.816 1.00 45.25 H new ATOM 0 HB2 SER B 39 23.107 -12.649 4.803 1.00 41.24 H new ATOM 0 HB3 SER B 39 24.579 -11.775 4.426 1.00 41.24 H new ATOM 0 HG SER B 39 24.760 -14.041 3.965 1.00 14.44 H new ATOM 2412 N PRO B 40 24.136 -9.566 6.904 1.00 43.13 N ATOM 2413 CA PRO B 40 23.461 -8.253 7.020 1.00 71.22 C ATOM 2414 C PRO B 40 22.626 -7.928 5.766 1.00 44.44 C ATOM 2415 O PRO B 40 23.186 -7.646 4.705 1.00 30.31 O ATOM 2416 CB PRO B 40 24.632 -7.248 7.215 1.00 2.30 C ATOM 2417 CG PRO B 40 25.783 -8.084 7.696 1.00 10.42 C ATOM 2418 CD PRO B 40 25.613 -9.426 7.019 1.00 14.44 C ATOM 0 HA PRO B 40 22.746 -8.221 7.842 1.00 71.22 H new ATOM 0 HB2 PRO B 40 24.876 -6.740 6.282 1.00 2.30 H new ATOM 0 HB3 PRO B 40 24.374 -6.477 7.940 1.00 2.30 H new ATOM 0 HG2 PRO B 40 26.737 -7.628 7.432 1.00 10.42 H new ATOM 0 HG3 PRO B 40 25.768 -8.186 8.781 1.00 10.42 H new ATOM 0 HD2 PRO B 40 26.097 -9.448 6.042 1.00 14.44 H new ATOM 0 HD3 PRO B 40 26.049 -10.232 7.609 1.00 14.44 H new ATOM 2426 N ILE B 41 21.288 -8.025 5.911 1.00 74.12 N ATOM 2427 CA ILE B 41 20.322 -7.803 4.824 1.00 65.44 C ATOM 2428 C ILE B 41 20.349 -6.319 4.383 1.00 40.43 C ATOM 2429 O ILE B 41 19.929 -5.446 5.155 1.00 13.11 O ATOM 2430 CB ILE B 41 18.855 -8.214 5.265 1.00 72.14 C ATOM 2431 CG1 ILE B 41 18.815 -9.692 5.788 1.00 23.03 C ATOM 2432 CG2 ILE B 41 17.832 -8.008 4.115 1.00 44.30 C ATOM 2433 CD1 ILE B 41 19.252 -10.756 4.780 1.00 14.15 C ATOM 0 H ILE B 41 20.846 -8.263 6.799 1.00 74.12 H new ATOM 0 HA ILE B 41 20.610 -8.433 3.983 1.00 65.44 H new ATOM 0 HB ILE B 41 18.567 -7.555 6.084 1.00 72.14 H new ATOM 0 HG12 ILE B 41 19.454 -9.766 6.668 1.00 23.03 H new ATOM 0 HG13 ILE B 41 17.799 -9.918 6.112 1.00 23.03 H new ATOM 0 HG21 ILE B 41 16.839 -8.300 4.455 1.00 44.30 H new ATOM 0 HG22 ILE B 41 17.821 -6.958 3.822 1.00 44.30 H new ATOM 0 HG23 ILE B 41 18.118 -8.621 3.260 1.00 44.30 H new ATOM 0 HD11 ILE B 41 19.188 -11.742 5.241 1.00 14.15 H new ATOM 0 HD12 ILE B 41 18.600 -10.720 3.907 1.00 14.15 H new ATOM 0 HD13 ILE B 41 20.280 -10.566 4.473 1.00 14.15 H new ATOM 2445 N PRO B 42 20.876 -6.006 3.154 1.00 35.55 N ATOM 2446 CA PRO B 42 20.927 -4.626 2.649 1.00 72.41 C ATOM 2447 C PRO B 42 19.593 -4.226 1.970 1.00 44.20 C ATOM 2448 O PRO B 42 19.031 -4.989 1.169 1.00 13.14 O ATOM 2449 CB PRO B 42 22.110 -4.677 1.654 1.00 53.12 C ATOM 2450 CG PRO B 42 22.090 -6.075 1.094 1.00 24.40 C ATOM 2451 CD PRO B 42 21.454 -6.965 2.161 1.00 55.51 C ATOM 0 HA PRO B 42 21.065 -3.875 3.427 1.00 72.41 H new ATOM 0 HB2 PRO B 42 21.994 -3.934 0.865 1.00 53.12 H new ATOM 0 HB3 PRO B 42 23.055 -4.466 2.154 1.00 53.12 H new ATOM 0 HG2 PRO B 42 21.518 -6.113 0.167 1.00 24.40 H new ATOM 0 HG3 PRO B 42 23.099 -6.413 0.859 1.00 24.40 H new ATOM 0 HD2 PRO B 42 20.683 -7.607 1.734 1.00 55.51 H new ATOM 0 HD3 PRO B 42 22.193 -7.619 2.624 1.00 55.51 H new ATOM 2459 N LEU B 43 19.081 -3.041 2.323 1.00 1.22 N ATOM 2460 CA LEU B 43 17.838 -2.488 1.764 1.00 62.42 C ATOM 2461 C LEU B 43 18.171 -1.170 1.020 1.00 21.03 C ATOM 2462 O LEU B 43 18.172 -0.093 1.632 1.00 40.12 O ATOM 2463 CB LEU B 43 16.782 -2.277 2.898 1.00 24.44 C ATOM 2464 CG LEU B 43 16.327 -3.568 3.668 1.00 64.52 C ATOM 2465 CD1 LEU B 43 15.358 -3.234 4.829 1.00 52.33 C ATOM 2466 CD2 LEU B 43 15.711 -4.612 2.704 1.00 63.33 C ATOM 0 H LEU B 43 19.521 -2.431 3.012 1.00 1.22 H new ATOM 0 HA LEU B 43 17.398 -3.184 1.050 1.00 62.42 H new ATOM 0 HB2 LEU B 43 17.192 -1.573 3.622 1.00 24.44 H new ATOM 0 HB3 LEU B 43 15.900 -1.809 2.462 1.00 24.44 H new ATOM 0 HG LEU B 43 17.220 -4.010 4.110 1.00 64.52 H new ATOM 0 HD11 LEU B 43 15.067 -4.154 5.336 1.00 52.33 H new ATOM 0 HD12 LEU B 43 15.854 -2.570 5.537 1.00 52.33 H new ATOM 0 HD13 LEU B 43 14.470 -2.742 4.432 1.00 52.33 H new ATOM 0 HD21 LEU B 43 15.406 -5.493 3.268 1.00 63.33 H new ATOM 0 HD22 LEU B 43 14.842 -4.181 2.208 1.00 63.33 H new ATOM 0 HD23 LEU B 43 16.451 -4.898 1.956 1.00 63.33 H new ATOM 2478 N PRO B 44 18.500 -1.244 -0.318 1.00 0.53 N ATOM 2479 CA PRO B 44 18.962 -0.079 -1.121 1.00 15.53 C ATOM 2480 C PRO B 44 17.792 0.804 -1.614 1.00 71.23 C ATOM 2481 O PRO B 44 17.646 1.074 -2.816 1.00 21.32 O ATOM 2482 CB PRO B 44 19.716 -0.772 -2.283 1.00 64.05 C ATOM 2483 CG PRO B 44 18.957 -2.042 -2.517 1.00 60.25 C ATOM 2484 CD PRO B 44 18.445 -2.482 -1.155 1.00 52.11 C ATOM 0 HA PRO B 44 19.579 0.622 -0.558 1.00 15.53 H new ATOM 0 HB2 PRO B 44 19.729 -0.147 -3.176 1.00 64.05 H new ATOM 0 HB3 PRO B 44 20.754 -0.973 -2.019 1.00 64.05 H new ATOM 0 HG2 PRO B 44 18.132 -1.881 -3.211 1.00 60.25 H new ATOM 0 HG3 PRO B 44 19.599 -2.805 -2.957 1.00 60.25 H new ATOM 0 HD2 PRO B 44 17.430 -2.873 -1.220 1.00 52.11 H new ATOM 0 HD3 PRO B 44 19.065 -3.274 -0.734 1.00 52.11 H new ATOM 2492 N ASN B 45 16.997 1.295 -0.658 1.00 12.31 N ATOM 2493 CA ASN B 45 15.776 2.068 -0.928 1.00 72.41 C ATOM 2494 C ASN B 45 15.425 2.868 0.329 1.00 4.35 C ATOM 2495 O ASN B 45 15.463 4.105 0.324 1.00 20.41 O ATOM 2496 CB ASN B 45 14.615 1.109 -1.345 1.00 72.34 C ATOM 2497 CG ASN B 45 13.294 1.795 -1.755 1.00 72.31 C ATOM 2498 OD1 ASN B 45 12.922 2.851 -1.254 1.00 22.43 O ATOM 2499 ND2 ASN B 45 12.562 1.179 -2.667 1.00 71.43 N ATOM 0 H ASN B 45 17.183 1.167 0.337 1.00 12.31 H new ATOM 0 HA ASN B 45 15.935 2.760 -1.755 1.00 72.41 H new ATOM 0 HB2 ASN B 45 14.957 0.495 -2.178 1.00 72.34 H new ATOM 0 HB3 ASN B 45 14.410 0.434 -0.514 1.00 72.34 H new ATOM 0 HD21 ASN B 45 11.673 1.581 -2.964 1.00 71.43 H new ATOM 0 HD22 ASN B 45 12.886 0.301 -3.074 1.00 71.43 H new ATOM 2506 N VAL B 46 15.117 2.144 1.415 1.00 65.24 N ATOM 2507 CA VAL B 46 14.703 2.754 2.685 1.00 40.20 C ATOM 2508 C VAL B 46 15.942 3.286 3.452 1.00 44.13 C ATOM 2509 O VAL B 46 16.908 2.548 3.690 1.00 40.31 O ATOM 2510 CB VAL B 46 13.852 1.738 3.550 1.00 61.30 C ATOM 2511 CG1 VAL B 46 14.636 0.458 3.905 1.00 3.32 C ATOM 2512 CG2 VAL B 46 13.274 2.415 4.809 1.00 22.35 C ATOM 0 H VAL B 46 15.148 1.125 1.437 1.00 65.24 H new ATOM 0 HA VAL B 46 14.056 3.606 2.475 1.00 40.20 H new ATOM 0 HB VAL B 46 13.015 1.425 2.926 1.00 61.30 H new ATOM 0 HG11 VAL B 46 14.004 -0.203 4.499 1.00 3.32 H new ATOM 0 HG12 VAL B 46 14.934 -0.052 2.989 1.00 3.32 H new ATOM 0 HG13 VAL B 46 15.524 0.723 4.479 1.00 3.32 H new ATOM 0 HG21 VAL B 46 12.695 1.689 5.380 1.00 22.35 H new ATOM 0 HG22 VAL B 46 14.089 2.794 5.425 1.00 22.35 H new ATOM 0 HG23 VAL B 46 12.628 3.242 4.513 1.00 22.35 H new ATOM 2522 N THR B 47 15.914 4.588 3.794 1.00 34.12 N ATOM 2523 CA THR B 47 17.018 5.281 4.495 1.00 4.21 C ATOM 2524 C THR B 47 17.034 4.920 5.986 1.00 24.30 C ATOM 2525 O THR B 47 16.134 4.221 6.466 1.00 3.44 O ATOM 2526 CB THR B 47 16.882 6.824 4.320 1.00 43.51 C ATOM 2527 OG1 THR B 47 15.631 7.252 4.869 1.00 33.12 O ATOM 2528 CG2 THR B 47 16.965 7.241 2.843 1.00 33.23 C ATOM 0 H THR B 47 15.120 5.195 3.591 1.00 34.12 H new ATOM 0 HA THR B 47 17.959 4.953 4.053 1.00 4.21 H new ATOM 0 HB THR B 47 17.710 7.298 4.846 1.00 43.51 H new ATOM 0 HG1 THR B 47 15.542 8.222 4.763 1.00 33.12 H new ATOM 0 HG21 THR B 47 16.866 8.324 2.764 1.00 33.23 H new ATOM 0 HG22 THR B 47 17.927 6.934 2.432 1.00 33.23 H new ATOM 0 HG23 THR B 47 16.161 6.762 2.284 1.00 33.23 H new ATOM 2536 N SER B 48 18.055 5.408 6.713 1.00 34.04 N ATOM 2537 CA SER B 48 18.258 5.075 8.133 1.00 30.24 C ATOM 2538 C SER B 48 17.123 5.613 9.015 1.00 1.11 C ATOM 2539 O SER B 48 16.595 4.879 9.846 1.00 43.11 O ATOM 2540 CB SER B 48 19.620 5.596 8.624 1.00 22.41 C ATOM 2541 OG SER B 48 19.748 6.992 8.449 1.00 74.20 O ATOM 0 H SER B 48 18.759 6.041 6.334 1.00 34.04 H new ATOM 0 HA SER B 48 18.249 3.988 8.217 1.00 30.24 H new ATOM 0 HB2 SER B 48 19.743 5.350 9.679 1.00 22.41 H new ATOM 0 HB3 SER B 48 20.419 5.088 8.083 1.00 22.41 H new ATOM 0 HG SER B 48 20.637 7.197 8.090 1.00 74.20 H new ATOM 2547 N THR B 49 16.747 6.883 8.795 1.00 3.22 N ATOM 2548 CA THR B 49 15.694 7.565 9.567 1.00 64.43 C ATOM 2549 C THR B 49 14.340 6.851 9.412 1.00 72.21 C ATOM 2550 O THR B 49 13.628 6.628 10.395 1.00 1.42 O ATOM 2551 CB THR B 49 15.553 9.054 9.106 1.00 14.43 C ATOM 2552 OG1 THR B 49 15.385 9.105 7.679 1.00 2.11 O ATOM 2553 CG2 THR B 49 16.774 9.901 9.508 1.00 54.44 C ATOM 0 H THR B 49 17.167 7.469 8.073 1.00 3.22 H new ATOM 0 HA THR B 49 15.986 7.537 10.617 1.00 64.43 H new ATOM 0 HB THR B 49 14.678 9.471 9.605 1.00 14.43 H new ATOM 0 HG1 THR B 49 15.295 10.038 7.393 1.00 2.11 H new ATOM 0 HG21 THR B 49 16.633 10.927 9.168 1.00 54.44 H new ATOM 0 HG22 THR B 49 16.883 9.890 10.592 1.00 54.44 H new ATOM 0 HG23 THR B 49 17.671 9.487 9.049 1.00 54.44 H new ATOM 2561 N ILE B 50 14.023 6.471 8.167 1.00 55.20 N ATOM 2562 CA ILE B 50 12.736 5.865 7.817 1.00 51.44 C ATOM 2563 C ILE B 50 12.670 4.414 8.326 1.00 32.30 C ATOM 2564 O ILE B 50 11.672 4.020 8.930 1.00 13.22 O ATOM 2565 CB ILE B 50 12.492 5.945 6.264 1.00 64.32 C ATOM 2566 CG1 ILE B 50 12.539 7.431 5.786 1.00 20.43 C ATOM 2567 CG2 ILE B 50 11.162 5.279 5.851 1.00 11.53 C ATOM 2568 CD1 ILE B 50 11.536 8.358 6.465 1.00 52.20 C ATOM 0 H ILE B 50 14.655 6.576 7.374 1.00 55.20 H new ATOM 0 HA ILE B 50 11.939 6.425 8.305 1.00 51.44 H new ATOM 0 HB ILE B 50 13.293 5.390 5.775 1.00 64.32 H new ATOM 0 HG12 ILE B 50 13.543 7.820 5.955 1.00 20.43 H new ATOM 0 HG13 ILE B 50 12.365 7.457 4.710 1.00 20.43 H new ATOM 0 HG21 ILE B 50 11.035 5.358 4.771 1.00 11.53 H new ATOM 0 HG22 ILE B 50 11.177 4.228 6.139 1.00 11.53 H new ATOM 0 HG23 ILE B 50 10.333 5.780 6.351 1.00 11.53 H new ATOM 0 HD11 ILE B 50 11.646 9.367 6.067 1.00 52.20 H new ATOM 0 HD12 ILE B 50 10.524 8.001 6.275 1.00 52.20 H new ATOM 0 HD13 ILE B 50 11.721 8.370 7.539 1.00 52.20 H new ATOM 2580 N LEU B 51 13.764 3.647 8.117 1.00 22.24 N ATOM 2581 CA LEU B 51 13.859 2.237 8.562 1.00 52.40 C ATOM 2582 C LEU B 51 13.821 2.146 10.100 1.00 30.11 C ATOM 2583 O LEU B 51 13.253 1.203 10.652 1.00 31.21 O ATOM 2584 CB LEU B 51 15.141 1.553 8.000 1.00 64.15 C ATOM 2585 CG LEU B 51 15.253 0.006 8.242 1.00 62.24 C ATOM 2586 CD1 LEU B 51 14.063 -0.754 7.606 1.00 14.42 C ATOM 2587 CD2 LEU B 51 16.605 -0.551 7.739 1.00 15.11 C ATOM 0 H LEU B 51 14.600 3.984 7.639 1.00 22.24 H new ATOM 0 HA LEU B 51 12.995 1.703 8.166 1.00 52.40 H new ATOM 0 HB2 LEU B 51 15.188 1.738 6.927 1.00 64.15 H new ATOM 0 HB3 LEU B 51 16.012 2.035 8.445 1.00 64.15 H new ATOM 0 HG LEU B 51 15.211 -0.157 9.319 1.00 62.24 H new ATOM 0 HD11 LEU B 51 14.172 -1.822 7.792 1.00 14.42 H new ATOM 0 HD12 LEU B 51 13.130 -0.402 8.046 1.00 14.42 H new ATOM 0 HD13 LEU B 51 14.048 -0.573 6.531 1.00 14.42 H new ATOM 0 HD21 LEU B 51 16.647 -1.625 7.923 1.00 15.11 H new ATOM 0 HD22 LEU B 51 16.701 -0.362 6.670 1.00 15.11 H new ATOM 0 HD23 LEU B 51 17.421 -0.060 8.269 1.00 15.11 H new ATOM 2599 N GLU B 52 14.405 3.162 10.768 1.00 24.14 N ATOM 2600 CA GLU B 52 14.380 3.304 12.237 1.00 1.00 C ATOM 2601 C GLU B 52 12.917 3.331 12.723 1.00 63.22 C ATOM 2602 O GLU B 52 12.526 2.536 13.587 1.00 71.10 O ATOM 2603 CB GLU B 52 15.165 4.596 12.635 1.00 41.35 C ATOM 2604 CG GLU B 52 15.358 4.864 14.152 1.00 22.12 C ATOM 2605 CD GLU B 52 14.143 5.503 14.853 1.00 23.35 C ATOM 2606 OE1 GLU B 52 13.464 4.816 15.647 1.00 35.10 O ATOM 2607 OE2 GLU B 52 13.865 6.692 14.592 1.00 54.20 O ATOM 0 H GLU B 52 14.911 3.913 10.298 1.00 24.14 H new ATOM 0 HA GLU B 52 14.867 2.456 12.719 1.00 1.00 H new ATOM 0 HB2 GLU B 52 16.150 4.550 12.171 1.00 41.35 H new ATOM 0 HB3 GLU B 52 14.649 5.453 12.203 1.00 41.35 H new ATOM 0 HG2 GLU B 52 15.591 3.921 14.647 1.00 22.12 H new ATOM 0 HG3 GLU B 52 16.221 5.516 14.285 1.00 22.12 H new ATOM 2614 N LYS B 53 12.119 4.215 12.096 1.00 61.51 N ATOM 2615 CA LYS B 53 10.691 4.394 12.417 1.00 15.45 C ATOM 2616 C LYS B 53 9.900 3.095 12.189 1.00 3.34 C ATOM 2617 O LYS B 53 9.137 2.663 13.059 1.00 64.23 O ATOM 2618 CB LYS B 53 10.078 5.515 11.539 1.00 72.40 C ATOM 2619 CG LYS B 53 10.707 6.906 11.710 1.00 24.42 C ATOM 2620 CD LYS B 53 10.020 7.959 10.811 1.00 73.14 C ATOM 2621 CE LYS B 53 10.683 9.336 10.876 1.00 30.44 C ATOM 2622 NZ LYS B 53 10.758 9.864 12.269 1.00 32.45 N ATOM 0 H LYS B 53 12.448 4.827 11.350 1.00 61.51 H new ATOM 0 HA LYS B 53 10.625 4.668 13.470 1.00 15.45 H new ATOM 0 HB2 LYS B 53 10.165 5.222 10.493 1.00 72.40 H new ATOM 0 HB3 LYS B 53 9.014 5.587 11.762 1.00 72.40 H new ATOM 0 HG2 LYS B 53 10.632 7.213 12.753 1.00 24.42 H new ATOM 0 HG3 LYS B 53 11.769 6.858 11.468 1.00 24.42 H new ATOM 0 HD2 LYS B 53 10.029 7.607 9.779 1.00 73.14 H new ATOM 0 HD3 LYS B 53 8.975 8.052 11.106 1.00 73.14 H new ATOM 0 HE2 LYS B 53 11.688 9.273 10.459 1.00 30.44 H new ATOM 0 HE3 LYS B 53 10.124 10.035 10.254 1.00 30.44 H new ATOM 0 HZ1 LYS B 53 11.137 10.833 12.253 1.00 32.45 H new ATOM 0 HZ2 LYS B 53 9.807 9.871 12.689 1.00 32.45 H new ATOM 0 HZ3 LYS B 53 11.383 9.257 12.837 1.00 32.45 H new ATOM 2636 N VAL B 54 10.117 2.494 11.001 1.00 34.03 N ATOM 2637 CA VAL B 54 9.385 1.308 10.539 1.00 31.12 C ATOM 2638 C VAL B 54 9.552 0.133 11.526 1.00 73.31 C ATOM 2639 O VAL B 54 8.561 -0.452 11.968 1.00 52.04 O ATOM 2640 CB VAL B 54 9.844 0.895 9.080 1.00 62.24 C ATOM 2641 CG1 VAL B 54 9.284 -0.484 8.671 1.00 12.51 C ATOM 2642 CG2 VAL B 54 9.432 1.973 8.041 1.00 20.45 C ATOM 0 H VAL B 54 10.813 2.825 10.333 1.00 34.03 H new ATOM 0 HA VAL B 54 8.326 1.561 10.500 1.00 31.12 H new ATOM 0 HB VAL B 54 10.931 0.822 9.096 1.00 62.24 H new ATOM 0 HG11 VAL B 54 9.622 -0.730 7.664 1.00 12.51 H new ATOM 0 HG12 VAL B 54 9.639 -1.242 9.369 1.00 12.51 H new ATOM 0 HG13 VAL B 54 8.195 -0.455 8.691 1.00 12.51 H new ATOM 0 HG21 VAL B 54 9.759 1.665 7.048 1.00 20.45 H new ATOM 0 HG22 VAL B 54 8.348 2.088 8.047 1.00 20.45 H new ATOM 0 HG23 VAL B 54 9.899 2.924 8.298 1.00 20.45 H new ATOM 2652 N LEU B 55 10.810 -0.146 11.903 1.00 12.35 N ATOM 2653 CA LEU B 55 11.160 -1.288 12.772 1.00 62.42 C ATOM 2654 C LEU B 55 10.687 -1.077 14.224 1.00 53.12 C ATOM 2655 O LEU B 55 10.382 -2.045 14.935 1.00 11.34 O ATOM 2656 CB LEU B 55 12.689 -1.545 12.724 1.00 61.41 C ATOM 2657 CG LEU B 55 13.277 -1.888 11.314 1.00 65.31 C ATOM 2658 CD1 LEU B 55 14.779 -2.223 11.404 1.00 42.31 C ATOM 2659 CD2 LEU B 55 12.479 -3.017 10.616 1.00 43.11 C ATOM 0 H LEU B 55 11.615 0.411 11.616 1.00 12.35 H new ATOM 0 HA LEU B 55 10.639 -2.166 12.391 1.00 62.42 H new ATOM 0 HB2 LEU B 55 13.199 -0.660 13.104 1.00 61.41 H new ATOM 0 HB3 LEU B 55 12.922 -2.365 13.404 1.00 61.41 H new ATOM 0 HG LEU B 55 13.175 -0.999 10.692 1.00 65.31 H new ATOM 0 HD11 LEU B 55 15.160 -2.457 10.410 1.00 42.31 H new ATOM 0 HD12 LEU B 55 15.319 -1.366 11.807 1.00 42.31 H new ATOM 0 HD13 LEU B 55 14.921 -3.083 12.059 1.00 42.31 H new ATOM 0 HD21 LEU B 55 12.919 -3.224 9.641 1.00 43.11 H new ATOM 0 HD22 LEU B 55 12.512 -3.918 11.228 1.00 43.11 H new ATOM 0 HD23 LEU B 55 11.443 -2.704 10.487 1.00 43.11 H new ATOM 2671 N ASP B 56 10.625 0.201 14.642 1.00 11.11 N ATOM 2672 CA ASP B 56 10.170 0.594 15.991 1.00 74.13 C ATOM 2673 C ASP B 56 8.638 0.400 16.102 1.00 24.30 C ATOM 2674 O ASP B 56 8.128 -0.057 17.128 1.00 2.43 O ATOM 2675 CB ASP B 56 10.562 2.078 16.271 1.00 1.13 C ATOM 2676 CG ASP B 56 10.683 2.439 17.767 1.00 61.13 C ATOM 2677 OD1 ASP B 56 11.672 3.109 18.146 1.00 72.11 O ATOM 2678 OD2 ASP B 56 9.813 2.056 18.579 1.00 62.00 O ATOM 0 H ASP B 56 10.889 0.992 14.054 1.00 11.11 H new ATOM 0 HA ASP B 56 10.654 -0.036 16.737 1.00 74.13 H new ATOM 0 HB2 ASP B 56 11.513 2.287 15.782 1.00 1.13 H new ATOM 0 HB3 ASP B 56 9.818 2.729 15.812 1.00 1.13 H new ATOM 2683 N TYR B 57 7.925 0.748 15.014 1.00 53.33 N ATOM 2684 CA TYR B 57 6.458 0.603 14.923 1.00 33.23 C ATOM 2685 C TYR B 57 6.058 -0.873 14.793 1.00 43.24 C ATOM 2686 O TYR B 57 5.029 -1.290 15.343 1.00 23.45 O ATOM 2687 CB TYR B 57 5.913 1.413 13.725 1.00 1.51 C ATOM 2688 CG TYR B 57 4.380 1.394 13.587 1.00 74.35 C ATOM 2689 CD1 TYR B 57 3.739 0.599 12.628 1.00 34.32 C ATOM 2690 CD2 TYR B 57 3.575 2.171 14.425 1.00 30.14 C ATOM 2691 CE1 TYR B 57 2.364 0.586 12.509 1.00 0.42 C ATOM 2692 CE2 TYR B 57 2.197 2.158 14.307 1.00 24.20 C ATOM 2693 CZ TYR B 57 1.596 1.366 13.351 1.00 41.10 C ATOM 2694 OH TYR B 57 0.224 1.356 13.231 1.00 25.41 O ATOM 0 H TYR B 57 8.349 1.138 14.172 1.00 53.33 H new ATOM 0 HA TYR B 57 6.021 0.994 15.842 1.00 33.23 H new ATOM 0 HB2 TYR B 57 6.244 2.447 13.821 1.00 1.51 H new ATOM 0 HB3 TYR B 57 6.353 1.022 12.808 1.00 1.51 H new ATOM 0 HD1 TYR B 57 4.333 -0.016 11.968 1.00 34.32 H new ATOM 0 HD2 TYR B 57 4.037 2.792 15.178 1.00 30.14 H new ATOM 0 HE1 TYR B 57 1.891 -0.032 11.760 1.00 0.42 H new ATOM 0 HE2 TYR B 57 1.592 2.767 14.963 1.00 24.20 H new ATOM 0 HH TYR B 57 -0.167 1.958 13.898 1.00 25.41 H new ATOM 2704 N CYS B 58 6.871 -1.646 14.047 1.00 34.02 N ATOM 2705 CA CYS B 58 6.691 -3.095 13.917 1.00 44.53 C ATOM 2706 C CYS B 58 6.816 -3.759 15.301 1.00 54.10 C ATOM 2707 O CYS B 58 6.048 -4.664 15.625 1.00 72.55 O ATOM 2708 CB CYS B 58 7.714 -3.690 12.922 1.00 34.33 C ATOM 2709 SG CYS B 58 7.504 -3.122 11.216 1.00 61.43 S ATOM 0 H CYS B 58 7.666 -1.281 13.522 1.00 34.02 H new ATOM 0 HA CYS B 58 5.695 -3.294 13.521 1.00 44.53 H new ATOM 0 HB2 CYS B 58 8.720 -3.436 13.257 1.00 34.33 H new ATOM 0 HB3 CYS B 58 7.636 -4.777 12.944 1.00 34.33 H new ATOM 0 HG CYS B 58 7.888 -1.884 11.121 1.00 61.43 H new ATOM 2715 N ARG B 59 7.780 -3.268 16.120 1.00 33.33 N ATOM 2716 CA ARG B 59 7.954 -3.725 17.509 1.00 32.12 C ATOM 2717 C ARG B 59 6.702 -3.428 18.342 1.00 20.05 C ATOM 2718 O ARG B 59 6.203 -4.307 19.032 1.00 1.02 O ATOM 2719 CB ARG B 59 9.198 -3.078 18.169 1.00 52.54 C ATOM 2720 CG ARG B 59 9.363 -3.422 19.674 1.00 45.40 C ATOM 2721 CD ARG B 59 10.612 -2.795 20.301 1.00 40.35 C ATOM 2722 NE ARG B 59 11.837 -3.333 19.700 1.00 2.15 N ATOM 2723 CZ ARG B 59 12.827 -2.619 19.158 1.00 41.21 C ATOM 2724 NH1 ARG B 59 12.771 -1.291 19.114 1.00 74.12 N ATOM 2725 NH2 ARG B 59 13.867 -3.256 18.655 1.00 20.15 N ATOM 0 H ARG B 59 8.448 -2.552 15.834 1.00 33.33 H new ATOM 0 HA ARG B 59 8.109 -4.804 17.479 1.00 32.12 H new ATOM 0 HB2 ARG B 59 10.091 -3.401 17.633 1.00 52.54 H new ATOM 0 HB3 ARG B 59 9.134 -1.995 18.059 1.00 52.54 H new ATOM 0 HG2 ARG B 59 8.481 -3.081 20.217 1.00 45.40 H new ATOM 0 HG3 ARG B 59 9.410 -4.505 19.790 1.00 45.40 H new ATOM 0 HD2 ARG B 59 10.584 -1.713 20.169 1.00 40.35 H new ATOM 0 HD3 ARG B 59 10.617 -2.985 21.374 1.00 40.35 H new ATOM 0 HE ARG B 59 11.943 -4.347 19.696 1.00 2.15 H new ATOM 0 HH11 ARG B 59 11.963 -0.802 19.498 1.00 74.12 H new ATOM 0 HH12 ARG B 59 13.536 -0.762 18.696 1.00 74.12 H new ATOM 0 HH21 ARG B 59 13.904 -4.275 18.685 1.00 20.15 H new ATOM 0 HH22 ARG B 59 14.634 -2.730 18.236 1.00 20.15 H new ATOM 2739 N HIS B 60 6.199 -2.187 18.237 1.00 72.22 N ATOM 2740 CA HIS B 60 4.996 -1.728 18.961 1.00 42.02 C ATOM 2741 C HIS B 60 3.787 -2.650 18.695 1.00 61.25 C ATOM 2742 O HIS B 60 3.108 -3.099 19.631 1.00 22.12 O ATOM 2743 CB HIS B 60 4.674 -0.268 18.548 1.00 72.34 C ATOM 2744 CG HIS B 60 3.347 0.244 19.040 1.00 21.20 C ATOM 2745 ND1 HIS B 60 3.127 0.667 20.329 1.00 45.15 N ATOM 2746 CD2 HIS B 60 2.169 0.390 18.400 1.00 63.22 C ATOM 2747 CE1 HIS B 60 1.873 1.043 20.455 1.00 42.12 C ATOM 2748 NE2 HIS B 60 1.269 0.885 19.298 1.00 10.24 N ATOM 0 H HIS B 60 6.616 -1.468 17.645 1.00 72.22 H new ATOM 0 HA HIS B 60 5.199 -1.766 20.031 1.00 42.02 H new ATOM 0 HB2 HIS B 60 5.462 0.384 18.924 1.00 72.34 H new ATOM 0 HB3 HIS B 60 4.695 -0.199 17.460 1.00 72.34 H new ATOM 0 HD2 HIS B 60 1.973 0.157 17.364 1.00 63.22 H new ATOM 0 HE1 HIS B 60 1.416 1.419 21.358 1.00 42.12 H new ATOM 0 HE2 HIS B 60 0.290 1.097 19.104 1.00 10.24 H new ATOM 2757 N HIS B 61 3.557 -2.933 17.406 1.00 24.00 N ATOM 2758 CA HIS B 61 2.441 -3.771 16.952 1.00 53.11 C ATOM 2759 C HIS B 61 2.717 -5.269 17.241 1.00 13.55 C ATOM 2760 O HIS B 61 1.801 -6.083 17.203 1.00 74.43 O ATOM 2761 CB HIS B 61 2.202 -3.527 15.438 1.00 45.03 C ATOM 2762 CG HIS B 61 0.899 -4.086 14.912 1.00 62.42 C ATOM 2763 ND1 HIS B 61 0.675 -5.429 14.716 1.00 34.12 N ATOM 2764 CD2 HIS B 61 -0.250 -3.470 14.555 1.00 15.43 C ATOM 2765 CE1 HIS B 61 -0.546 -5.613 14.267 1.00 62.04 C ATOM 2766 NE2 HIS B 61 -1.129 -4.441 14.162 1.00 15.11 N ATOM 0 H HIS B 61 4.142 -2.585 16.646 1.00 24.00 H new ATOM 0 HA HIS B 61 1.541 -3.498 17.503 1.00 53.11 H new ATOM 0 HB2 HIS B 61 2.226 -2.454 15.247 1.00 45.03 H new ATOM 0 HB3 HIS B 61 3.025 -3.969 14.877 1.00 45.03 H new ATOM 0 HD2 HIS B 61 -0.439 -2.407 14.576 1.00 15.43 H new ATOM 0 HE1 HIS B 61 -0.994 -6.566 14.025 1.00 62.04 H new ATOM 0 HE2 HIS B 61 -2.083 -4.281 13.839 1.00 15.11 H new ATOM 2775 N HIS B 62 3.988 -5.627 17.507 1.00 25.54 N ATOM 2776 CA HIS B 62 4.377 -7.009 17.869 1.00 64.00 C ATOM 2777 C HIS B 62 4.126 -7.265 19.366 1.00 13.42 C ATOM 2778 O HIS B 62 3.717 -8.362 19.762 1.00 20.11 O ATOM 2779 CB HIS B 62 5.872 -7.253 17.531 1.00 4.40 C ATOM 2780 CG HIS B 62 6.288 -8.701 17.565 1.00 41.11 C ATOM 2781 ND1 HIS B 62 6.376 -9.473 16.430 1.00 71.44 N ATOM 2782 CD2 HIS B 62 6.646 -9.513 18.591 1.00 54.14 C ATOM 2783 CE1 HIS B 62 6.762 -10.686 16.753 1.00 54.03 C ATOM 2784 NE2 HIS B 62 6.933 -10.737 18.053 1.00 1.13 N ATOM 0 H HIS B 62 4.771 -4.974 17.478 1.00 25.54 H new ATOM 0 HA HIS B 62 3.767 -7.702 17.290 1.00 64.00 H new ATOM 0 HB2 HIS B 62 6.078 -6.851 16.539 1.00 4.40 H new ATOM 0 HB3 HIS B 62 6.488 -6.694 18.236 1.00 4.40 H new ATOM 0 HD1 HIS B 62 6.173 -9.153 15.483 1.00 71.44 H new ATOM 0 HD2 HIS B 62 6.695 -9.244 19.636 1.00 54.14 H new ATOM 0 HE1 HIS B 62 6.913 -11.504 16.064 1.00 54.03 H new ATOM 0 HE2 HIS B 62 7.232 -11.558 18.578 1.00 1.13 H new ATOM 2793 N GLN B 63 4.405 -6.236 20.189 1.00 4.10 N ATOM 2794 CA GLN B 63 4.237 -6.297 21.653 1.00 21.12 C ATOM 2795 C GLN B 63 2.749 -6.179 22.021 1.00 64.44 C ATOM 2796 O GLN B 63 2.311 -6.682 23.059 1.00 33.02 O ATOM 2797 CB GLN B 63 5.060 -5.176 22.356 1.00 42.42 C ATOM 2798 CG GLN B 63 6.570 -5.150 22.022 1.00 10.31 C ATOM 2799 CD GLN B 63 7.274 -6.492 22.217 1.00 70.24 C ATOM 2800 OE1 GLN B 63 7.378 -7.299 21.288 1.00 61.23 O ATOM 2801 NE2 GLN B 63 7.754 -6.746 23.426 1.00 13.03 N ATOM 0 H GLN B 63 4.754 -5.337 19.856 1.00 4.10 H new ATOM 0 HA GLN B 63 4.612 -7.260 22.000 1.00 21.12 H new ATOM 0 HB2 GLN B 63 4.630 -4.211 22.088 1.00 42.42 H new ATOM 0 HB3 GLN B 63 4.946 -5.287 23.434 1.00 42.42 H new ATOM 0 HG2 GLN B 63 6.697 -4.832 20.987 1.00 10.31 H new ATOM 0 HG3 GLN B 63 7.057 -4.402 22.648 1.00 10.31 H new ATOM 0 HE21 GLN B 63 7.651 -6.057 24.171 1.00 13.03 H new ATOM 0 HE22 GLN B 63 8.227 -7.631 23.612 1.00 13.03 H new ATOM 2810 N HIS B 64 1.987 -5.492 21.152 1.00 21.40 N ATOM 2811 CA HIS B 64 0.522 -5.379 21.253 1.00 63.51 C ATOM 2812 C HIS B 64 -0.099 -5.845 19.910 1.00 2.34 C ATOM 2813 O HIS B 64 -0.482 -5.012 19.073 1.00 11.42 O ATOM 2814 CB HIS B 64 0.106 -3.918 21.605 1.00 24.02 C ATOM 2815 CG HIS B 64 0.656 -3.405 22.919 1.00 50.13 C ATOM 2816 ND1 HIS B 64 -0.080 -3.374 24.086 1.00 14.11 N ATOM 2817 CD2 HIS B 64 1.881 -2.912 23.246 1.00 75.11 C ATOM 2818 CE1 HIS B 64 0.663 -2.889 25.061 1.00 20.21 C ATOM 2819 NE2 HIS B 64 1.852 -2.603 24.580 1.00 21.34 N ATOM 0 H HIS B 64 2.376 -4.994 20.351 1.00 21.40 H new ATOM 0 HA HIS B 64 0.150 -6.014 22.057 1.00 63.51 H new ATOM 0 HB2 HIS B 64 0.438 -3.257 20.804 1.00 24.02 H new ATOM 0 HB3 HIS B 64 -0.982 -3.861 21.635 1.00 24.02 H new ATOM 0 HD2 HIS B 64 2.720 -2.787 22.578 1.00 75.11 H new ATOM 0 HE1 HIS B 64 0.347 -2.750 26.084 1.00 20.21 H new ATOM 0 HE2 HIS B 64 2.629 -2.213 25.114 1.00 21.34 H new ATOM 2828 N PRO B 65 -0.157 -7.200 19.654 1.00 14.45 N ATOM 2829 CA PRO B 65 -0.671 -7.770 18.391 1.00 0.31 C ATOM 2830 C PRO B 65 -2.148 -8.201 18.492 1.00 42.00 C ATOM 2831 O PRO B 65 -2.585 -9.117 17.780 1.00 1.23 O ATOM 2832 CB PRO B 65 0.278 -8.974 18.216 1.00 11.21 C ATOM 2833 CG PRO B 65 0.508 -9.488 19.616 1.00 54.33 C ATOM 2834 CD PRO B 65 0.279 -8.304 20.561 1.00 40.13 C ATOM 0 HA PRO B 65 -0.676 -7.071 17.555 1.00 0.31 H new ATOM 0 HB2 PRO B 65 -0.167 -9.740 17.581 1.00 11.21 H new ATOM 0 HB3 PRO B 65 1.214 -8.675 17.745 1.00 11.21 H new ATOM 0 HG2 PRO B 65 -0.176 -10.305 19.846 1.00 54.33 H new ATOM 0 HG3 PRO B 65 1.520 -9.879 19.724 1.00 54.33 H new ATOM 0 HD2 PRO B 65 -0.481 -8.531 21.309 1.00 40.13 H new ATOM 0 HD3 PRO B 65 1.189 -8.042 21.101 1.00 40.13 H new ATOM 2842 N GLY B 66 -2.904 -7.517 19.377 1.00 2.20 N ATOM 2843 CA GLY B 66 -4.324 -7.793 19.569 1.00 43.44 C ATOM 2844 C GLY B 66 -5.146 -7.387 18.352 1.00 71.20 C ATOM 2845 O GLY B 66 -5.723 -8.244 17.667 1.00 23.14 O ATOM 0 H GLY B 66 -2.542 -6.768 19.967 1.00 2.20 H new ATOM 0 HA2 GLY B 66 -4.465 -8.856 19.765 1.00 43.44 H new ATOM 0 HA3 GLY B 66 -4.684 -7.256 20.447 1.00 43.44 H new ATOM 2849 N GLY B 67 -5.196 -6.062 18.098 1.00 42.13 N ATOM 2850 CA GLY B 67 -5.904 -5.491 16.940 1.00 63.44 C ATOM 2851 C GLY B 67 -7.432 -5.565 17.032 1.00 40.41 C ATOM 2852 O GLY B 67 -8.128 -5.078 16.134 1.00 3.42 O ATOM 0 H GLY B 67 -4.747 -5.363 18.690 1.00 42.13 H new ATOM 0 HA2 GLY B 67 -5.609 -4.448 16.828 1.00 63.44 H new ATOM 0 HA3 GLY B 67 -5.581 -6.012 16.039 1.00 63.44 H new ATOM 2856 N SER B 68 -7.947 -6.162 18.123 1.00 43.53 N ATOM 2857 CA SER B 68 -9.381 -6.339 18.365 1.00 72.51 C ATOM 2858 C SER B 68 -9.959 -5.043 18.964 1.00 12.43 C ATOM 2859 O SER B 68 -10.183 -4.934 20.179 1.00 3.40 O ATOM 2860 CB SER B 68 -9.588 -7.562 19.295 1.00 14.32 C ATOM 2861 OG SER B 68 -8.757 -7.481 20.446 1.00 5.02 O ATOM 0 H SER B 68 -7.364 -6.539 18.870 1.00 43.53 H new ATOM 0 HA SER B 68 -9.913 -6.535 17.434 1.00 72.51 H new ATOM 0 HB2 SER B 68 -10.633 -7.616 19.601 1.00 14.32 H new ATOM 0 HB3 SER B 68 -9.368 -8.479 18.748 1.00 14.32 H new ATOM 0 HG SER B 68 -8.874 -6.607 20.873 1.00 5.02 H new ATOM 2867 N GLY B 69 -10.100 -4.031 18.095 1.00 41.24 N ATOM 2868 CA GLY B 69 -10.561 -2.704 18.485 1.00 1.41 C ATOM 2869 C GLY B 69 -9.425 -1.810 18.995 1.00 50.44 C ATOM 2870 O GLY B 69 -9.319 -0.651 18.581 1.00 14.31 O ATOM 0 H GLY B 69 -9.895 -4.117 17.100 1.00 41.24 H new ATOM 0 HA2 GLY B 69 -11.040 -2.225 17.631 1.00 1.41 H new ATOM 0 HA3 GLY B 69 -11.319 -2.801 19.263 1.00 1.41 H new ATOM 2874 N LEU B 70 -8.590 -2.376 19.920 1.00 70.04 N ATOM 2875 CA LEU B 70 -7.501 -1.689 20.670 1.00 13.53 C ATOM 2876 C LEU B 70 -7.937 -0.337 21.279 1.00 30.51 C ATOM 2877 O LEU B 70 -7.093 0.517 21.585 1.00 21.25 O ATOM 2878 CB LEU B 70 -6.139 -1.634 19.857 1.00 23.32 C ATOM 2879 CG LEU B 70 -6.098 -0.974 18.417 1.00 4.45 C ATOM 2880 CD1 LEU B 70 -6.184 0.573 18.454 1.00 72.33 C ATOM 2881 CD2 LEU B 70 -4.844 -1.431 17.628 1.00 35.14 C ATOM 0 H LEU B 70 -8.664 -3.362 20.170 1.00 70.04 H new ATOM 0 HA LEU B 70 -7.285 -2.314 21.537 1.00 13.53 H new ATOM 0 HB2 LEU B 70 -5.414 -1.105 20.476 1.00 23.32 H new ATOM 0 HB3 LEU B 70 -5.783 -2.659 19.753 1.00 23.32 H new ATOM 0 HG LEU B 70 -6.990 -1.326 17.898 1.00 4.45 H new ATOM 0 HD11 LEU B 70 -6.151 0.964 17.437 1.00 72.33 H new ATOM 0 HD12 LEU B 70 -7.118 0.874 18.928 1.00 72.33 H new ATOM 0 HD13 LEU B 70 -5.344 0.971 19.023 1.00 72.33 H new ATOM 0 HD21 LEU B 70 -4.843 -0.962 16.644 1.00 35.14 H new ATOM 0 HD22 LEU B 70 -3.946 -1.138 18.171 1.00 35.14 H new ATOM 0 HD23 LEU B 70 -4.861 -2.515 17.514 1.00 35.14 H new ATOM 2893 N ASP B 71 -9.265 -0.234 21.552 1.00 55.03 N ATOM 2894 CA ASP B 71 -9.939 0.980 22.052 1.00 13.22 C ATOM 2895 C ASP B 71 -9.836 2.118 21.019 1.00 22.12 C ATOM 2896 O ASP B 71 -10.750 2.315 20.208 1.00 54.54 O ATOM 2897 CB ASP B 71 -9.410 1.418 23.462 1.00 55.13 C ATOM 2898 CG ASP B 71 -9.764 0.446 24.598 1.00 60.43 C ATOM 2899 OD1 ASP B 71 -9.407 -0.745 24.497 1.00 52.14 O ATOM 2900 OD2 ASP B 71 -10.372 0.868 25.605 1.00 2.13 O ATOM 0 H ASP B 71 -9.907 -1.017 21.425 1.00 55.03 H new ATOM 0 HA ASP B 71 -10.994 0.741 22.187 1.00 13.22 H new ATOM 0 HB2 ASP B 71 -8.326 1.524 23.414 1.00 55.13 H new ATOM 0 HB3 ASP B 71 -9.816 2.401 23.701 1.00 55.13 H new ATOM 2905 N ASP B 72 -8.694 2.820 21.029 1.00 35.22 N ATOM 2906 CA ASP B 72 -8.406 3.956 20.157 1.00 11.53 C ATOM 2907 C ASP B 72 -6.906 3.959 19.877 1.00 4.31 C ATOM 2908 O ASP B 72 -6.137 3.281 20.581 1.00 40.23 O ATOM 2909 CB ASP B 72 -8.831 5.300 20.820 1.00 70.12 C ATOM 2910 CG ASP B 72 -10.350 5.554 20.786 1.00 41.13 C ATOM 2911 OD1 ASP B 72 -11.046 5.263 21.786 1.00 42.34 O ATOM 2912 OD2 ASP B 72 -10.855 6.040 19.746 1.00 11.51 O ATOM 0 H ASP B 72 -7.926 2.603 21.664 1.00 35.22 H new ATOM 0 HA ASP B 72 -8.972 3.860 19.231 1.00 11.53 H new ATOM 0 HB2 ASP B 72 -8.494 5.306 21.856 1.00 70.12 H new ATOM 0 HB3 ASP B 72 -8.323 6.121 20.314 1.00 70.12 H new ATOM 2917 N ILE B 73 -6.505 4.719 18.857 1.00 10.34 N ATOM 2918 CA ILE B 73 -5.097 4.884 18.487 1.00 24.33 C ATOM 2919 C ILE B 73 -4.296 5.490 19.671 1.00 42.11 C ATOM 2920 O ILE B 73 -4.594 6.616 20.096 1.00 35.34 O ATOM 2921 CB ILE B 73 -4.981 5.796 17.210 1.00 22.12 C ATOM 2922 CG1 ILE B 73 -5.624 5.099 15.964 1.00 44.33 C ATOM 2923 CG2 ILE B 73 -3.517 6.200 16.926 1.00 44.40 C ATOM 2924 CD1 ILE B 73 -4.971 3.779 15.554 1.00 34.04 C ATOM 0 H ILE B 73 -7.149 5.240 18.262 1.00 10.34 H new ATOM 0 HA ILE B 73 -4.674 3.907 18.255 1.00 24.33 H new ATOM 0 HB ILE B 73 -5.537 6.712 17.412 1.00 22.12 H new ATOM 0 HG12 ILE B 73 -6.678 4.916 16.172 1.00 44.33 H new ATOM 0 HG13 ILE B 73 -5.581 5.786 15.119 1.00 44.33 H new ATOM 0 HG21 ILE B 73 -3.479 6.829 16.037 1.00 44.40 H new ATOM 0 HG22 ILE B 73 -3.120 6.752 17.778 1.00 44.40 H new ATOM 0 HG23 ILE B 73 -2.918 5.304 16.763 1.00 44.40 H new ATOM 0 HD11 ILE B 73 -5.486 3.374 14.683 1.00 34.04 H new ATOM 0 HD12 ILE B 73 -3.923 3.952 15.309 1.00 34.04 H new ATOM 0 HD13 ILE B 73 -5.038 3.069 16.378 1.00 34.04 H new ATOM 2936 N PRO B 74 -3.302 4.731 20.247 1.00 71.23 N ATOM 2937 CA PRO B 74 -2.450 5.218 21.364 1.00 33.43 C ATOM 2938 C PRO B 74 -1.657 6.504 21.004 1.00 62.22 C ATOM 2939 O PRO B 74 -1.371 6.739 19.816 1.00 42.15 O ATOM 2940 CB PRO B 74 -1.494 4.018 21.636 1.00 54.42 C ATOM 2941 CG PRO B 74 -2.208 2.822 21.090 1.00 51.25 C ATOM 2942 CD PRO B 74 -2.943 3.328 19.874 1.00 3.14 C ATOM 0 HA PRO B 74 -3.042 5.508 22.232 1.00 33.43 H new ATOM 0 HB2 PRO B 74 -0.531 4.161 21.145 1.00 54.42 H new ATOM 0 HB3 PRO B 74 -1.295 3.906 22.702 1.00 54.42 H new ATOM 0 HG2 PRO B 74 -1.507 2.030 20.826 1.00 51.25 H new ATOM 0 HG3 PRO B 74 -2.898 2.405 21.824 1.00 51.25 H new ATOM 0 HD2 PRO B 74 -2.316 3.297 18.983 1.00 3.14 H new ATOM 0 HD3 PRO B 74 -3.829 2.729 19.661 1.00 3.14 H new ATOM 2950 N PRO B 75 -1.310 7.362 22.025 1.00 63.13 N ATOM 2951 CA PRO B 75 -0.489 8.585 21.827 1.00 25.22 C ATOM 2952 C PRO B 75 0.797 8.330 21.012 1.00 1.43 C ATOM 2953 O PRO B 75 1.152 9.145 20.163 1.00 15.22 O ATOM 2954 CB PRO B 75 -0.164 9.033 23.274 1.00 40.11 C ATOM 2955 CG PRO B 75 -1.331 8.551 24.079 1.00 24.02 C ATOM 2956 CD PRO B 75 -1.729 7.227 23.454 1.00 70.03 C ATOM 0 HA PRO B 75 -1.018 9.339 21.245 1.00 25.22 H new ATOM 0 HB2 PRO B 75 0.770 8.596 23.626 1.00 40.11 H new ATOM 0 HB3 PRO B 75 -0.054 10.115 23.341 1.00 40.11 H new ATOM 0 HG2 PRO B 75 -1.061 8.426 25.127 1.00 24.02 H new ATOM 0 HG3 PRO B 75 -2.154 9.265 24.045 1.00 24.02 H new ATOM 0 HD2 PRO B 75 -1.228 6.390 23.940 1.00 70.03 H new ATOM 0 HD3 PRO B 75 -2.801 7.051 23.541 1.00 70.03 H new ATOM 2964 N TYR B 76 1.461 7.171 21.271 1.00 63.05 N ATOM 2965 CA TYR B 76 2.681 6.745 20.539 1.00 1.14 C ATOM 2966 C TYR B 76 2.469 6.771 19.011 1.00 35.45 C ATOM 2967 O TYR B 76 3.276 7.344 18.285 1.00 20.42 O ATOM 2968 CB TYR B 76 3.131 5.312 20.983 1.00 13.11 C ATOM 2969 CG TYR B 76 4.240 4.690 20.095 1.00 3.42 C ATOM 2970 CD1 TYR B 76 3.916 3.849 19.019 1.00 54.43 C ATOM 2971 CD2 TYR B 76 5.591 4.982 20.301 1.00 14.52 C ATOM 2972 CE1 TYR B 76 4.889 3.332 18.190 1.00 12.32 C ATOM 2973 CE2 TYR B 76 6.569 4.450 19.474 1.00 0.22 C ATOM 2974 CZ TYR B 76 6.210 3.630 18.419 1.00 73.41 C ATOM 2975 OH TYR B 76 7.177 3.120 17.581 1.00 34.42 O ATOM 0 H TYR B 76 1.166 6.510 21.990 1.00 63.05 H new ATOM 0 HA TYR B 76 3.466 7.459 20.789 1.00 1.14 H new ATOM 0 HB2 TYR B 76 3.488 5.358 22.012 1.00 13.11 H new ATOM 0 HB3 TYR B 76 2.263 4.652 20.976 1.00 13.11 H new ATOM 0 HD1 TYR B 76 2.881 3.601 18.836 1.00 54.43 H new ATOM 0 HD2 TYR B 76 5.877 5.631 21.115 1.00 14.52 H new ATOM 0 HE1 TYR B 76 4.613 2.695 17.363 1.00 12.32 H new ATOM 0 HE2 TYR B 76 7.610 4.676 19.653 1.00 0.22 H new ATOM 0 HH TYR B 76 7.943 2.818 18.112 1.00 34.42 H new ATOM 2985 N ASP B 77 1.381 6.129 18.560 1.00 4.45 N ATOM 2986 CA ASP B 77 1.089 5.907 17.124 1.00 62.32 C ATOM 2987 C ASP B 77 0.785 7.227 16.409 1.00 42.45 C ATOM 2988 O ASP B 77 1.097 7.393 15.225 1.00 12.55 O ATOM 2989 CB ASP B 77 -0.105 4.932 16.971 1.00 54.23 C ATOM 2990 CG ASP B 77 0.141 3.562 17.619 1.00 14.41 C ATOM 2991 OD1 ASP B 77 0.144 2.526 16.917 1.00 22.22 O ATOM 2992 OD2 ASP B 77 0.340 3.521 18.849 1.00 53.22 O ATOM 0 H ASP B 77 0.670 5.744 19.181 1.00 4.45 H new ATOM 0 HA ASP B 77 1.974 5.469 16.662 1.00 62.32 H new ATOM 0 HB2 ASP B 77 -0.992 5.383 17.416 1.00 54.23 H new ATOM 0 HB3 ASP B 77 -0.317 4.792 15.911 1.00 54.23 H new ATOM 2997 N ARG B 78 0.165 8.160 17.157 1.00 14.24 N ATOM 2998 CA ARG B 78 -0.085 9.532 16.690 1.00 13.34 C ATOM 2999 C ARG B 78 1.246 10.264 16.478 1.00 22.00 C ATOM 3000 O ARG B 78 1.475 10.849 15.418 1.00 15.24 O ATOM 3001 CB ARG B 78 -0.975 10.302 17.705 1.00 52.11 C ATOM 3002 CG ARG B 78 -2.404 9.745 17.814 1.00 24.42 C ATOM 3003 CD ARG B 78 -3.288 10.542 18.793 1.00 50.40 C ATOM 3004 NE ARG B 78 -4.700 10.104 18.764 1.00 41.14 N ATOM 3005 CZ ARG B 78 -5.673 10.673 18.021 1.00 35.11 C ATOM 3006 NH1 ARG B 78 -5.412 11.708 17.223 1.00 21.21 N ATOM 3007 NH2 ARG B 78 -6.908 10.196 18.075 1.00 24.34 N ATOM 0 H ARG B 78 -0.176 7.981 18.102 1.00 14.24 H new ATOM 0 HA ARG B 78 -0.616 9.486 15.739 1.00 13.34 H new ATOM 0 HB2 ARG B 78 -0.504 10.268 18.688 1.00 52.11 H new ATOM 0 HB3 ARG B 78 -1.024 11.350 17.411 1.00 52.11 H new ATOM 0 HG2 ARG B 78 -2.867 9.752 16.827 1.00 24.42 H new ATOM 0 HG3 ARG B 78 -2.359 8.705 18.138 1.00 24.42 H new ATOM 0 HD2 ARG B 78 -2.897 10.430 19.804 1.00 50.40 H new ATOM 0 HD3 ARG B 78 -3.234 11.602 18.546 1.00 50.40 H new ATOM 0 HE ARG B 78 -4.959 9.311 19.351 1.00 41.14 H new ATOM 0 HH11 ARG B 78 -4.465 12.082 17.167 1.00 21.21 H new ATOM 0 HH12 ARG B 78 -6.159 12.126 16.669 1.00 21.21 H new ATOM 0 HH21 ARG B 78 -7.122 9.401 18.677 1.00 24.34 H new ATOM 0 HH22 ARG B 78 -7.645 10.624 17.515 1.00 24.34 H new ATOM 3021 N ASP B 79 2.130 10.172 17.490 1.00 33.44 N ATOM 3022 CA ASP B 79 3.453 10.830 17.472 1.00 45.25 C ATOM 3023 C ASP B 79 4.410 10.170 16.460 1.00 33.41 C ATOM 3024 O ASP B 79 5.357 10.809 15.990 1.00 70.22 O ATOM 3025 CB ASP B 79 4.071 10.870 18.895 1.00 31.34 C ATOM 3026 CG ASP B 79 3.381 11.903 19.806 1.00 11.25 C ATOM 3027 OD1 ASP B 79 3.706 13.105 19.714 1.00 63.14 O ATOM 3028 OD2 ASP B 79 2.503 11.527 20.600 1.00 5.21 O ATOM 0 H ASP B 79 1.949 9.641 18.342 1.00 33.44 H new ATOM 0 HA ASP B 79 3.303 11.858 17.142 1.00 45.25 H new ATOM 0 HB2 ASP B 79 3.996 9.882 19.349 1.00 31.34 H new ATOM 0 HB3 ASP B 79 5.132 11.107 18.821 1.00 31.34 H new ATOM 3033 N PHE B 80 4.144 8.891 16.136 1.00 50.43 N ATOM 3034 CA PHE B 80 4.844 8.157 15.066 1.00 63.44 C ATOM 3035 C PHE B 80 4.538 8.809 13.705 1.00 61.44 C ATOM 3036 O PHE B 80 5.428 8.978 12.866 1.00 14.10 O ATOM 3037 CB PHE B 80 4.420 6.651 15.068 1.00 61.43 C ATOM 3038 CG PHE B 80 4.914 5.858 13.856 1.00 61.13 C ATOM 3039 CD1 PHE B 80 6.253 5.490 13.745 1.00 31.25 C ATOM 3040 CD2 PHE B 80 4.048 5.510 12.812 1.00 3.41 C ATOM 3041 CE1 PHE B 80 6.707 4.808 12.638 1.00 41.44 C ATOM 3042 CE2 PHE B 80 4.509 4.821 11.706 1.00 41.03 C ATOM 3043 CZ PHE B 80 5.840 4.472 11.620 1.00 31.33 C ATOM 0 H PHE B 80 3.434 8.335 16.612 1.00 50.43 H new ATOM 0 HA PHE B 80 5.918 8.204 15.244 1.00 63.44 H new ATOM 0 HB2 PHE B 80 4.799 6.180 15.975 1.00 61.43 H new ATOM 0 HB3 PHE B 80 3.332 6.592 15.108 1.00 61.43 H new ATOM 0 HD1 PHE B 80 6.943 5.743 14.536 1.00 31.25 H new ATOM 0 HD2 PHE B 80 3.005 5.784 12.872 1.00 3.41 H new ATOM 0 HE1 PHE B 80 7.749 4.534 12.567 1.00 41.44 H new ATOM 0 HE2 PHE B 80 3.828 4.557 10.911 1.00 41.03 H new ATOM 0 HZ PHE B 80 6.203 3.936 10.756 1.00 31.33 H new ATOM 3053 N CYS B 81 3.262 9.171 13.521 1.00 23.35 N ATOM 3054 CA CYS B 81 2.759 9.783 12.285 1.00 55.34 C ATOM 3055 C CYS B 81 3.078 11.295 12.219 1.00 42.12 C ATOM 3056 O CYS B 81 2.976 11.906 11.144 1.00 23.22 O ATOM 3057 CB CYS B 81 1.240 9.531 12.195 1.00 21.33 C ATOM 3058 SG CYS B 81 0.794 7.781 12.203 1.00 55.21 S ATOM 0 H CYS B 81 2.543 9.046 14.233 1.00 23.35 H new ATOM 0 HA CYS B 81 3.261 9.326 11.432 1.00 55.34 H new ATOM 0 HB2 CYS B 81 0.748 10.026 13.032 1.00 21.33 H new ATOM 0 HB3 CYS B 81 0.858 9.990 11.283 1.00 21.33 H new ATOM 0 HG CYS B 81 0.842 7.327 13.420 1.00 55.21 H new ATOM 3064 N LYS B 82 3.452 11.902 13.373 1.00 53.34 N ATOM 3065 CA LYS B 82 3.913 13.305 13.427 1.00 52.32 C ATOM 3066 C LYS B 82 5.369 13.383 12.939 1.00 34.22 C ATOM 3067 O LYS B 82 6.317 13.323 13.733 1.00 25.33 O ATOM 3068 CB LYS B 82 3.787 13.890 14.856 1.00 4.11 C ATOM 3069 CG LYS B 82 2.347 13.953 15.401 1.00 13.24 C ATOM 3070 CD LYS B 82 2.314 14.399 16.881 1.00 14.31 C ATOM 3071 CE LYS B 82 0.951 14.186 17.553 1.00 63.34 C ATOM 3072 NZ LYS B 82 1.026 14.464 19.014 1.00 50.41 N ATOM 0 H LYS B 82 3.442 11.436 14.280 1.00 53.34 H new ATOM 0 HA LYS B 82 3.277 13.903 12.774 1.00 52.32 H new ATOM 0 HB2 LYS B 82 4.392 13.289 15.535 1.00 4.11 H new ATOM 0 HB3 LYS B 82 4.207 14.896 14.861 1.00 4.11 H new ATOM 0 HG2 LYS B 82 1.760 14.647 14.799 1.00 13.24 H new ATOM 0 HG3 LYS B 82 1.879 12.973 15.306 1.00 13.24 H new ATOM 0 HD2 LYS B 82 3.074 13.848 17.435 1.00 14.31 H new ATOM 0 HD3 LYS B 82 2.579 15.455 16.940 1.00 14.31 H new ATOM 0 HE2 LYS B 82 0.209 14.838 17.093 1.00 63.34 H new ATOM 0 HE3 LYS B 82 0.618 13.161 17.391 1.00 63.34 H new ATOM 0 HZ1 LYS B 82 0.200 14.048 19.489 1.00 50.41 H new ATOM 0 HZ2 LYS B 82 1.896 14.047 19.403 1.00 50.41 H new ATOM 0 HZ3 LYS B 82 1.034 15.492 19.172 1.00 50.41 H new ATOM 3086 N VAL B 83 5.524 13.444 11.615 1.00 1.41 N ATOM 3087 CA VAL B 83 6.832 13.521 10.937 1.00 13.42 C ATOM 3088 C VAL B 83 6.845 14.708 9.953 1.00 23.24 C ATOM 3089 O VAL B 83 5.817 15.373 9.754 1.00 31.33 O ATOM 3090 CB VAL B 83 7.146 12.175 10.168 1.00 71.11 C ATOM 3091 CG1 VAL B 83 7.346 10.992 11.146 1.00 11.21 C ATOM 3092 CG2 VAL B 83 6.041 11.852 9.139 1.00 51.12 C ATOM 0 H VAL B 83 4.735 13.442 10.968 1.00 1.41 H new ATOM 0 HA VAL B 83 7.604 13.672 11.692 1.00 13.42 H new ATOM 0 HB VAL B 83 8.082 12.321 9.629 1.00 71.11 H new ATOM 0 HG11 VAL B 83 7.560 10.085 10.581 1.00 11.21 H new ATOM 0 HG12 VAL B 83 8.180 11.209 11.813 1.00 11.21 H new ATOM 0 HG13 VAL B 83 6.439 10.848 11.733 1.00 11.21 H new ATOM 0 HG21 VAL B 83 6.283 10.922 8.625 1.00 51.12 H new ATOM 0 HG22 VAL B 83 5.086 11.745 9.653 1.00 51.12 H new ATOM 0 HG23 VAL B 83 5.973 12.661 8.412 1.00 51.12 H new ATOM 3102 N ASP B 84 8.013 14.950 9.337 1.00 41.20 N ATOM 3103 CA ASP B 84 8.188 15.977 8.295 1.00 24.32 C ATOM 3104 C ASP B 84 7.341 15.593 7.050 1.00 52.41 C ATOM 3105 O ASP B 84 7.098 14.404 6.820 1.00 23.20 O ATOM 3106 CB ASP B 84 9.708 16.113 7.990 1.00 63.52 C ATOM 3107 CG ASP B 84 10.037 16.976 6.765 1.00 72.24 C ATOM 3108 OD1 ASP B 84 10.630 16.455 5.797 1.00 2.25 O ATOM 3109 OD2 ASP B 84 9.690 18.183 6.758 1.00 43.31 O ATOM 0 H ASP B 84 8.868 14.436 9.548 1.00 41.20 H new ATOM 0 HA ASP B 84 7.832 16.953 8.625 1.00 24.32 H new ATOM 0 HB2 ASP B 84 10.204 16.539 8.862 1.00 63.52 H new ATOM 0 HB3 ASP B 84 10.126 15.118 7.840 1.00 63.52 H new ATOM 3114 N GLN B 85 6.888 16.602 6.276 1.00 11.03 N ATOM 3115 CA GLN B 85 5.822 16.430 5.253 1.00 33.03 C ATOM 3116 C GLN B 85 6.234 15.415 4.133 1.00 41.43 C ATOM 3117 O GLN B 85 5.491 14.455 3.909 1.00 41.02 O ATOM 3118 CB GLN B 85 5.358 17.833 4.692 1.00 15.51 C ATOM 3119 CG GLN B 85 3.891 17.914 4.187 1.00 15.12 C ATOM 3120 CD GLN B 85 3.566 17.123 2.904 1.00 64.23 C ATOM 3121 OE1 GLN B 85 2.456 16.612 2.743 1.00 54.23 O ATOM 3122 NE2 GLN B 85 4.501 17.055 1.953 1.00 23.21 N ATOM 0 H GLN B 85 7.245 17.555 6.338 1.00 11.03 H new ATOM 0 HA GLN B 85 4.954 15.981 5.736 1.00 33.03 H new ATOM 0 HB2 GLN B 85 5.493 18.578 5.476 1.00 15.51 H new ATOM 0 HB3 GLN B 85 6.020 18.111 3.871 1.00 15.51 H new ATOM 0 HG2 GLN B 85 3.235 17.560 4.983 1.00 15.12 H new ATOM 0 HG3 GLN B 85 3.646 18.962 4.014 1.00 15.12 H new ATOM 0 HE21 GLN B 85 5.414 17.484 2.104 1.00 23.21 H new ATOM 0 HE22 GLN B 85 4.302 16.574 1.076 1.00 23.21 H new ATOM 3131 N PRO B 86 7.404 15.572 3.405 1.00 45.54 N ATOM 3132 CA PRO B 86 7.867 14.524 2.453 1.00 50.14 C ATOM 3133 C PRO B 86 8.279 13.211 3.166 1.00 73.03 C ATOM 3134 O PRO B 86 8.130 12.136 2.588 1.00 60.02 O ATOM 3135 CB PRO B 86 9.054 15.183 1.711 1.00 63.05 C ATOM 3136 CG PRO B 86 9.541 16.252 2.642 1.00 62.10 C ATOM 3137 CD PRO B 86 8.312 16.758 3.367 1.00 1.00 C ATOM 0 HA PRO B 86 7.074 14.214 1.773 1.00 50.14 H new ATOM 0 HB2 PRO B 86 9.839 14.457 1.497 1.00 63.05 H new ATOM 0 HB3 PRO B 86 8.739 15.603 0.756 1.00 63.05 H new ATOM 0 HG2 PRO B 86 10.274 15.855 3.344 1.00 62.10 H new ATOM 0 HG3 PRO B 86 10.030 17.056 2.092 1.00 62.10 H new ATOM 0 HD2 PRO B 86 8.555 17.107 4.370 1.00 1.00 H new ATOM 0 HD3 PRO B 86 7.854 17.595 2.841 1.00 1.00 H new ATOM 3145 N THR B 87 8.763 13.318 4.432 1.00 63.50 N ATOM 3146 CA THR B 87 9.158 12.156 5.274 1.00 72.13 C ATOM 3147 C THR B 87 7.958 11.207 5.527 1.00 75.32 C ATOM 3148 O THR B 87 8.131 9.984 5.646 1.00 32.31 O ATOM 3149 CB THR B 87 9.763 12.655 6.632 1.00 13.30 C ATOM 3150 OG1 THR B 87 10.926 13.456 6.364 1.00 3.35 O ATOM 3151 CG2 THR B 87 10.151 11.518 7.592 1.00 73.10 C ATOM 0 H THR B 87 8.891 14.216 4.899 1.00 63.50 H new ATOM 0 HA THR B 87 9.918 11.590 4.735 1.00 72.13 H new ATOM 0 HB THR B 87 8.982 13.233 7.127 1.00 13.30 H new ATOM 0 HG1 THR B 87 11.432 13.585 7.193 1.00 3.35 H new ATOM 0 HG21 THR B 87 10.562 11.940 8.509 1.00 73.10 H new ATOM 0 HG22 THR B 87 9.268 10.925 7.829 1.00 73.10 H new ATOM 0 HG23 THR B 87 10.899 10.882 7.119 1.00 73.10 H new ATOM 3159 N LEU B 88 6.746 11.793 5.580 1.00 42.25 N ATOM 3160 CA LEU B 88 5.474 11.055 5.712 1.00 20.21 C ATOM 3161 C LEU B 88 5.296 10.121 4.499 1.00 74.31 C ATOM 3162 O LEU B 88 4.926 8.956 4.641 1.00 14.11 O ATOM 3163 CB LEU B 88 4.299 12.087 5.852 1.00 65.41 C ATOM 3164 CG LEU B 88 2.908 11.562 6.377 1.00 30.43 C ATOM 3165 CD1 LEU B 88 2.026 12.727 6.884 1.00 34.21 C ATOM 3166 CD2 LEU B 88 2.147 10.756 5.304 1.00 31.45 C ATOM 0 H LEU B 88 6.621 12.804 5.532 1.00 42.25 H new ATOM 0 HA LEU B 88 5.477 10.430 6.605 1.00 20.21 H new ATOM 0 HB2 LEU B 88 4.630 12.881 6.522 1.00 65.41 H new ATOM 0 HB3 LEU B 88 4.136 12.542 4.875 1.00 65.41 H new ATOM 0 HG LEU B 88 3.123 10.892 7.209 1.00 30.43 H new ATOM 0 HD11 LEU B 88 1.073 12.334 7.240 1.00 34.21 H new ATOM 0 HD12 LEU B 88 2.535 13.240 7.700 1.00 34.21 H new ATOM 0 HD13 LEU B 88 1.848 13.429 6.070 1.00 34.21 H new ATOM 0 HD21 LEU B 88 1.195 10.415 5.712 1.00 31.45 H new ATOM 0 HD22 LEU B 88 1.964 11.389 4.435 1.00 31.45 H new ATOM 0 HD23 LEU B 88 2.743 9.894 5.006 1.00 31.45 H new ATOM 3178 N PHE B 89 5.605 10.652 3.312 1.00 51.31 N ATOM 3179 CA PHE B 89 5.509 9.911 2.044 1.00 32.21 C ATOM 3180 C PHE B 89 6.634 8.890 1.905 1.00 41.40 C ATOM 3181 O PHE B 89 6.442 7.862 1.282 1.00 45.53 O ATOM 3182 CB PHE B 89 5.504 10.887 0.853 1.00 34.50 C ATOM 3183 CG PHE B 89 4.223 11.704 0.765 1.00 34.34 C ATOM 3184 CD1 PHE B 89 3.257 11.403 -0.191 1.00 3.01 C ATOM 3185 CD2 PHE B 89 3.983 12.771 1.637 1.00 14.32 C ATOM 3186 CE1 PHE B 89 2.107 12.143 -0.276 1.00 33.33 C ATOM 3187 CE2 PHE B 89 2.822 13.510 1.547 1.00 33.14 C ATOM 3188 CZ PHE B 89 1.887 13.194 0.586 1.00 4.50 C ATOM 0 H PHE B 89 5.931 11.612 3.200 1.00 51.31 H new ATOM 0 HA PHE B 89 4.568 9.360 2.048 1.00 32.21 H new ATOM 0 HB2 PHE B 89 6.355 11.563 0.939 1.00 34.50 H new ATOM 0 HB3 PHE B 89 5.635 10.325 -0.072 1.00 34.50 H new ATOM 0 HD1 PHE B 89 3.415 10.579 -0.871 1.00 3.01 H new ATOM 0 HD2 PHE B 89 4.716 13.019 2.390 1.00 14.32 H new ATOM 0 HE1 PHE B 89 1.368 11.900 -1.025 1.00 33.33 H new ATOM 0 HE2 PHE B 89 2.647 14.332 2.226 1.00 33.14 H new ATOM 0 HZ PHE B 89 0.978 13.773 0.508 1.00 4.50 H new ATOM 3198 N GLU B 90 7.802 9.189 2.483 1.00 40.24 N ATOM 3199 CA GLU B 90 8.936 8.249 2.531 1.00 34.23 C ATOM 3200 C GLU B 90 8.571 7.004 3.368 1.00 71.51 C ATOM 3201 O GLU B 90 9.043 5.896 3.091 1.00 15.54 O ATOM 3202 CB GLU B 90 10.180 8.951 3.116 1.00 64.03 C ATOM 3203 CG GLU B 90 10.652 10.176 2.314 1.00 21.25 C ATOM 3204 CD GLU B 90 11.205 9.822 0.922 1.00 44.41 C ATOM 3205 OE1 GLU B 90 12.314 9.246 0.854 1.00 64.33 O ATOM 3206 OE2 GLU B 90 10.549 10.122 -0.103 1.00 53.41 O ATOM 0 H GLU B 90 7.992 10.086 2.931 1.00 40.24 H new ATOM 0 HA GLU B 90 9.164 7.922 1.517 1.00 34.23 H new ATOM 0 HB2 GLU B 90 9.960 9.263 4.137 1.00 64.03 H new ATOM 0 HB3 GLU B 90 10.997 8.231 3.171 1.00 64.03 H new ATOM 0 HG2 GLU B 90 9.818 10.869 2.200 1.00 21.25 H new ATOM 0 HG3 GLU B 90 11.424 10.697 2.881 1.00 21.25 H new ATOM 3213 N LEU B 91 7.717 7.223 4.392 1.00 2.34 N ATOM 3214 CA LEU B 91 7.121 6.150 5.209 1.00 63.31 C ATOM 3215 C LEU B 91 6.064 5.354 4.404 1.00 5.23 C ATOM 3216 O LEU B 91 5.955 4.146 4.575 1.00 51.05 O ATOM 3217 CB LEU B 91 6.495 6.746 6.505 1.00 73.22 C ATOM 3218 CG LEU B 91 7.486 7.231 7.605 1.00 44.42 C ATOM 3219 CD1 LEU B 91 6.730 7.906 8.777 1.00 24.31 C ATOM 3220 CD2 LEU B 91 8.353 6.056 8.100 1.00 52.13 C ATOM 0 H LEU B 91 7.422 8.157 4.675 1.00 2.34 H new ATOM 0 HA LEU B 91 7.913 5.456 5.491 1.00 63.31 H new ATOM 0 HB2 LEU B 91 5.864 7.588 6.221 1.00 73.22 H new ATOM 0 HB3 LEU B 91 5.842 5.992 6.945 1.00 73.22 H new ATOM 0 HG LEU B 91 8.146 7.981 7.168 1.00 44.42 H new ATOM 0 HD11 LEU B 91 7.446 8.235 9.530 1.00 24.31 H new ATOM 0 HD12 LEU B 91 6.175 8.767 8.404 1.00 24.31 H new ATOM 0 HD13 LEU B 91 6.037 7.192 9.222 1.00 24.31 H new ATOM 0 HD21 LEU B 91 9.041 6.410 8.868 1.00 52.13 H new ATOM 0 HD22 LEU B 91 7.711 5.280 8.517 1.00 52.13 H new ATOM 0 HD23 LEU B 91 8.921 5.646 7.265 1.00 52.13 H new ATOM 3232 N ILE B 92 5.286 6.053 3.538 1.00 43.11 N ATOM 3233 CA ILE B 92 4.313 5.416 2.610 1.00 5.12 C ATOM 3234 C ILE B 92 5.061 4.510 1.597 1.00 25.12 C ATOM 3235 O ILE B 92 4.660 3.367 1.350 1.00 34.11 O ATOM 3236 CB ILE B 92 3.447 6.500 1.836 1.00 50.55 C ATOM 3237 CG1 ILE B 92 2.587 7.344 2.837 1.00 72.51 C ATOM 3238 CG2 ILE B 92 2.553 5.861 0.738 1.00 51.23 C ATOM 3239 CD1 ILE B 92 1.756 8.454 2.199 1.00 32.01 C ATOM 0 H ILE B 92 5.314 7.070 3.463 1.00 43.11 H new ATOM 0 HA ILE B 92 3.631 4.809 3.206 1.00 5.12 H new ATOM 0 HB ILE B 92 4.145 7.168 1.331 1.00 50.55 H new ATOM 0 HG12 ILE B 92 1.917 6.672 3.373 1.00 72.51 H new ATOM 0 HG13 ILE B 92 3.252 7.789 3.578 1.00 72.51 H new ATOM 0 HG21 ILE B 92 1.980 6.641 0.236 1.00 51.23 H new ATOM 0 HG22 ILE B 92 3.181 5.347 0.010 1.00 51.23 H new ATOM 0 HG23 ILE B 92 1.870 5.146 1.196 1.00 51.23 H new ATOM 0 HD11 ILE B 92 1.197 8.980 2.973 1.00 32.01 H new ATOM 0 HD12 ILE B 92 2.416 9.155 1.688 1.00 32.01 H new ATOM 0 HD13 ILE B 92 1.061 8.021 1.480 1.00 32.01 H new ATOM 3251 N LEU B 93 6.185 5.034 1.062 1.00 74.11 N ATOM 3252 CA LEU B 93 7.007 4.348 0.046 1.00 70.41 C ATOM 3253 C LEU B 93 7.719 3.128 0.658 1.00 42.22 C ATOM 3254 O LEU B 93 7.852 2.101 0.001 1.00 32.44 O ATOM 3255 CB LEU B 93 8.044 5.330 -0.585 1.00 74.23 C ATOM 3256 CG LEU B 93 7.456 6.555 -1.368 1.00 44.13 C ATOM 3257 CD1 LEU B 93 8.581 7.447 -1.947 1.00 65.03 C ATOM 3258 CD2 LEU B 93 6.461 6.112 -2.465 1.00 12.42 C ATOM 0 H LEU B 93 6.548 5.950 1.326 1.00 74.11 H new ATOM 0 HA LEU B 93 6.345 3.998 -0.746 1.00 70.41 H new ATOM 0 HB2 LEU B 93 8.684 5.709 0.211 1.00 74.23 H new ATOM 0 HB3 LEU B 93 8.681 4.764 -1.264 1.00 74.23 H new ATOM 0 HG LEU B 93 6.895 7.157 -0.653 1.00 44.13 H new ATOM 0 HD11 LEU B 93 8.140 8.287 -2.484 1.00 65.03 H new ATOM 0 HD12 LEU B 93 9.203 7.822 -1.134 1.00 65.03 H new ATOM 0 HD13 LEU B 93 9.194 6.861 -2.632 1.00 65.03 H new ATOM 0 HD21 LEU B 93 6.077 6.990 -2.984 1.00 12.42 H new ATOM 0 HD22 LEU B 93 6.970 5.463 -3.178 1.00 12.42 H new ATOM 0 HD23 LEU B 93 5.633 5.569 -2.008 1.00 12.42 H new ATOM 3270 N ALA B 94 8.163 3.266 1.927 1.00 10.42 N ATOM 3271 CA ALA B 94 8.836 2.183 2.676 1.00 12.05 C ATOM 3272 C ALA B 94 7.839 1.118 3.145 1.00 52.40 C ATOM 3273 O ALA B 94 8.187 -0.054 3.255 1.00 34.12 O ATOM 3274 CB ALA B 94 9.598 2.755 3.875 1.00 0.20 C ATOM 0 H ALA B 94 8.065 4.130 2.460 1.00 10.42 H new ATOM 0 HA ALA B 94 9.543 1.705 1.998 1.00 12.05 H new ATOM 0 HB1 ALA B 94 10.087 1.945 4.415 1.00 0.20 H new ATOM 0 HB2 ALA B 94 10.349 3.463 3.525 1.00 0.20 H new ATOM 0 HB3 ALA B 94 8.901 3.265 4.540 1.00 0.20 H new ATOM 3280 N ALA B 95 6.605 1.549 3.445 1.00 2.14 N ATOM 3281 CA ALA B 95 5.520 0.648 3.869 1.00 51.14 C ATOM 3282 C ALA B 95 4.970 -0.157 2.680 1.00 23.12 C ATOM 3283 O ALA B 95 4.438 -1.245 2.870 1.00 72.23 O ATOM 3284 CB ALA B 95 4.411 1.438 4.559 1.00 51.44 C ATOM 0 H ALA B 95 6.330 2.530 3.401 1.00 2.14 H new ATOM 0 HA ALA B 95 5.929 -0.065 4.585 1.00 51.14 H new ATOM 0 HB1 ALA B 95 3.617 0.758 4.866 1.00 51.44 H new ATOM 0 HB2 ALA B 95 4.816 1.943 5.436 1.00 51.44 H new ATOM 0 HB3 ALA B 95 4.008 2.178 3.868 1.00 51.44 H new ATOM 3290 N ASN B 96 5.055 0.429 1.464 1.00 22.24 N ATOM 3291 CA ASN B 96 4.756 -0.271 0.193 1.00 51.51 C ATOM 3292 C ASN B 96 5.951 -1.173 -0.216 1.00 41.35 C ATOM 3293 O ASN B 96 5.762 -2.278 -0.725 1.00 22.45 O ATOM 3294 CB ASN B 96 4.428 0.780 -0.914 1.00 54.35 C ATOM 3295 CG ASN B 96 4.031 0.183 -2.279 1.00 71.34 C ATOM 3296 OD1 ASN B 96 3.525 -0.937 -2.371 1.00 54.10 O ATOM 3297 ND2 ASN B 96 4.217 0.951 -3.349 1.00 1.11 N ATOM 0 H ASN B 96 5.333 1.402 1.336 1.00 22.24 H new ATOM 0 HA ASN B 96 3.887 -0.915 0.324 1.00 51.51 H new ATOM 0 HB2 ASN B 96 3.616 1.416 -0.562 1.00 54.35 H new ATOM 0 HB3 ASN B 96 5.298 1.422 -1.054 1.00 54.35 H new ATOM 0 HD21 ASN B 96 3.939 0.616 -4.272 1.00 1.11 H new ATOM 0 HD22 ASN B 96 4.638 1.874 -3.247 1.00 1.11 H new ATOM 3304 N TYR B 97 7.181 -0.681 0.049 1.00 64.51 N ATOM 3305 CA TYR B 97 8.451 -1.405 -0.235 1.00 11.11 C ATOM 3306 C TYR B 97 8.570 -2.679 0.622 1.00 33.53 C ATOM 3307 O TYR B 97 9.075 -3.701 0.157 1.00 42.42 O ATOM 3308 CB TYR B 97 9.664 -0.456 0.026 1.00 62.03 C ATOM 3309 CG TYR B 97 11.069 -1.096 -0.044 1.00 53.22 C ATOM 3310 CD1 TYR B 97 11.923 -1.106 1.070 1.00 12.41 C ATOM 3311 CD2 TYR B 97 11.545 -1.676 -1.224 1.00 32.30 C ATOM 3312 CE1 TYR B 97 13.187 -1.669 1.006 1.00 53.00 C ATOM 3313 CE2 TYR B 97 12.807 -2.242 -1.285 1.00 21.40 C ATOM 3314 CZ TYR B 97 13.624 -2.236 -0.172 1.00 64.45 C ATOM 3315 OH TYR B 97 14.887 -2.789 -0.243 1.00 45.02 O ATOM 0 H TYR B 97 7.327 0.237 0.469 1.00 64.51 H new ATOM 0 HA TYR B 97 8.450 -1.710 -1.281 1.00 11.11 H new ATOM 0 HB2 TYR B 97 9.623 0.357 -0.699 1.00 62.03 H new ATOM 0 HB3 TYR B 97 9.541 -0.010 1.013 1.00 62.03 H new ATOM 0 HD1 TYR B 97 11.587 -0.665 1.997 1.00 12.41 H new ATOM 0 HD2 TYR B 97 10.917 -1.683 -2.103 1.00 32.30 H new ATOM 0 HE1 TYR B 97 13.828 -1.664 1.876 1.00 53.00 H new ATOM 0 HE2 TYR B 97 13.153 -2.689 -2.205 1.00 21.40 H new ATOM 0 HH TYR B 97 15.038 -3.146 -1.143 1.00 45.02 H new ATOM 3325 N LEU B 98 8.118 -2.584 1.879 1.00 71.00 N ATOM 3326 CA LEU B 98 8.160 -3.691 2.852 1.00 22.43 C ATOM 3327 C LEU B 98 6.782 -4.380 2.971 1.00 15.44 C ATOM 3328 O LEU B 98 6.660 -5.431 3.619 1.00 50.32 O ATOM 3329 CB LEU B 98 8.675 -3.157 4.220 1.00 1.32 C ATOM 3330 CG LEU B 98 10.138 -2.591 4.213 1.00 52.13 C ATOM 3331 CD1 LEU B 98 10.564 -2.087 5.609 1.00 2.31 C ATOM 3332 CD2 LEU B 98 11.140 -3.635 3.667 1.00 31.42 C ATOM 0 H LEU B 98 7.708 -1.729 2.256 1.00 71.00 H new ATOM 0 HA LEU B 98 8.855 -4.455 2.503 1.00 22.43 H new ATOM 0 HB2 LEU B 98 8.001 -2.371 4.561 1.00 1.32 H new ATOM 0 HB3 LEU B 98 8.619 -3.964 4.950 1.00 1.32 H new ATOM 0 HG LEU B 98 10.149 -1.733 3.541 1.00 52.13 H new ATOM 0 HD11 LEU B 98 11.583 -1.703 5.562 1.00 2.31 H new ATOM 0 HD12 LEU B 98 9.891 -1.292 5.930 1.00 2.31 H new ATOM 0 HD13 LEU B 98 10.519 -2.910 6.322 1.00 2.31 H new ATOM 0 HD21 LEU B 98 12.145 -3.213 3.675 1.00 31.42 H new ATOM 0 HD22 LEU B 98 11.115 -4.526 4.295 1.00 31.42 H new ATOM 0 HD23 LEU B 98 10.867 -3.903 2.646 1.00 31.42 H new ATOM 3344 N ASP B 99 5.766 -3.760 2.336 1.00 63.32 N ATOM 3345 CA ASP B 99 4.392 -4.298 2.181 1.00 53.10 C ATOM 3346 C ASP B 99 3.708 -4.562 3.554 1.00 53.20 C ATOM 3347 O ASP B 99 2.913 -5.497 3.721 1.00 2.32 O ATOM 3348 CB ASP B 99 4.403 -5.555 1.250 1.00 31.23 C ATOM 3349 CG ASP B 99 3.014 -5.973 0.719 1.00 63.43 C ATOM 3350 OD1 ASP B 99 2.179 -5.080 0.438 1.00 22.42 O ATOM 3351 OD2 ASP B 99 2.768 -7.188 0.515 1.00 64.41 O ATOM 0 H ASP B 99 5.879 -2.844 1.903 1.00 63.32 H new ATOM 0 HA ASP B 99 3.779 -3.539 1.695 1.00 53.10 H new ATOM 0 HB2 ASP B 99 5.057 -5.357 0.401 1.00 31.23 H new ATOM 0 HB3 ASP B 99 4.836 -6.393 1.797 1.00 31.23 H new ATOM 3356 N ILE B 100 4.004 -3.679 4.526 1.00 11.12 N ATOM 3357 CA ILE B 100 3.422 -3.737 5.879 1.00 4.23 C ATOM 3358 C ILE B 100 2.038 -3.067 5.852 1.00 50.32 C ATOM 3359 O ILE B 100 1.953 -1.840 5.773 1.00 51.20 O ATOM 3360 CB ILE B 100 4.348 -3.026 6.939 1.00 42.23 C ATOM 3361 CG1 ILE B 100 5.792 -3.605 6.865 1.00 3.03 C ATOM 3362 CG2 ILE B 100 3.765 -3.160 8.374 1.00 44.25 C ATOM 3363 CD1 ILE B 100 6.798 -2.939 7.781 1.00 74.14 C ATOM 0 H ILE B 100 4.654 -2.904 4.395 1.00 11.12 H new ATOM 0 HA ILE B 100 3.329 -4.782 6.176 1.00 4.23 H new ATOM 0 HB ILE B 100 4.389 -1.963 6.701 1.00 42.23 H new ATOM 0 HG12 ILE B 100 5.754 -4.668 7.104 1.00 3.03 H new ATOM 0 HG13 ILE B 100 6.148 -3.522 5.838 1.00 3.03 H new ATOM 0 HG21 ILE B 100 4.425 -2.660 9.083 1.00 44.25 H new ATOM 0 HG22 ILE B 100 2.778 -2.699 8.410 1.00 44.25 H new ATOM 0 HG23 ILE B 100 3.683 -4.215 8.636 1.00 44.25 H new ATOM 0 HD11 ILE B 100 7.772 -3.412 7.657 1.00 74.14 H new ATOM 0 HD12 ILE B 100 6.874 -1.881 7.530 1.00 74.14 H new ATOM 0 HD13 ILE B 100 6.473 -3.044 8.816 1.00 74.14 H new ATOM 3375 N LYS B 101 0.973 -3.894 5.908 1.00 62.12 N ATOM 3376 CA LYS B 101 -0.431 -3.435 5.782 1.00 53.23 C ATOM 3377 C LYS B 101 -0.828 -2.394 6.882 1.00 70.12 C ATOM 3378 O LYS B 101 -1.381 -1.348 6.524 1.00 11.22 O ATOM 3379 CB LYS B 101 -1.430 -4.641 5.791 1.00 71.53 C ATOM 3380 CG LYS B 101 -1.092 -5.778 4.804 1.00 3.51 C ATOM 3381 CD LYS B 101 -1.004 -5.314 3.331 1.00 34.11 C ATOM 3382 CE LYS B 101 -0.693 -6.479 2.376 1.00 43.24 C ATOM 3383 NZ LYS B 101 -0.489 -6.002 0.992 1.00 2.11 N ATOM 0 H LYS B 101 1.060 -4.901 6.042 1.00 62.12 H new ATOM 0 HA LYS B 101 -0.499 -2.931 4.818 1.00 53.23 H new ATOM 0 HB2 LYS B 101 -1.467 -5.055 6.799 1.00 71.53 H new ATOM 0 HB3 LYS B 101 -2.428 -4.268 5.563 1.00 71.53 H new ATOM 0 HG2 LYS B 101 -0.142 -6.227 5.092 1.00 3.51 H new ATOM 0 HG3 LYS B 101 -1.850 -6.557 4.886 1.00 3.51 H new ATOM 0 HD2 LYS B 101 -1.946 -4.849 3.041 1.00 34.11 H new ATOM 0 HD3 LYS B 101 -0.230 -4.552 3.237 1.00 34.11 H new ATOM 0 HE2 LYS B 101 0.200 -7.003 2.717 1.00 43.24 H new ATOM 0 HE3 LYS B 101 -1.512 -7.198 2.398 1.00 43.24 H new ATOM 0 HZ1 LYS B 101 -0.518 -6.810 0.338 1.00 2.11 H new ATOM 0 HZ2 LYS B 101 -1.241 -5.328 0.743 1.00 2.11 H new ATOM 0 HZ3 LYS B 101 0.436 -5.531 0.920 1.00 2.11 H new ATOM 3397 N PRO B 102 -0.560 -2.649 8.233 1.00 33.34 N ATOM 3398 CA PRO B 102 -0.887 -1.669 9.310 1.00 21.43 C ATOM 3399 C PRO B 102 -0.227 -0.295 9.084 1.00 1.21 C ATOM 3400 O PRO B 102 -0.904 0.729 9.100 1.00 75.12 O ATOM 3401 CB PRO B 102 -0.352 -2.337 10.609 1.00 60.02 C ATOM 3402 CG PRO B 102 -0.336 -3.802 10.296 1.00 60.40 C ATOM 3403 CD PRO B 102 0.024 -3.894 8.829 1.00 60.53 C ATOM 0 HA PRO B 102 -1.956 -1.459 9.346 1.00 21.43 H new ATOM 0 HB2 PRO B 102 0.644 -1.974 10.861 1.00 60.02 H new ATOM 0 HB3 PRO B 102 -0.996 -2.120 11.461 1.00 60.02 H new ATOM 0 HG2 PRO B 102 0.392 -4.328 10.913 1.00 60.40 H new ATOM 0 HG3 PRO B 102 -1.307 -4.256 10.492 1.00 60.40 H new ATOM 0 HD2 PRO B 102 1.104 -3.937 8.685 1.00 60.53 H new ATOM 0 HD3 PRO B 102 -0.395 -4.790 8.371 1.00 60.53 H new ATOM 3411 N LEU B 103 1.099 -0.307 8.830 1.00 62.21 N ATOM 3412 CA LEU B 103 1.903 0.926 8.691 1.00 22.34 C ATOM 3413 C LEU B 103 1.451 1.719 7.448 1.00 24.41 C ATOM 3414 O LEU B 103 1.264 2.935 7.526 1.00 3.34 O ATOM 3415 CB LEU B 103 3.427 0.574 8.633 1.00 61.23 C ATOM 3416 CG LEU B 103 4.442 1.680 9.115 1.00 75.20 C ATOM 3417 CD1 LEU B 103 5.829 1.064 9.386 1.00 72.30 C ATOM 3418 CD2 LEU B 103 4.564 2.870 8.128 1.00 62.31 C ATOM 0 H LEU B 103 1.639 -1.165 8.716 1.00 62.21 H new ATOM 0 HA LEU B 103 1.744 1.560 9.563 1.00 22.34 H new ATOM 0 HB2 LEU B 103 3.590 -0.320 9.235 1.00 61.23 H new ATOM 0 HB3 LEU B 103 3.675 0.314 7.604 1.00 61.23 H new ATOM 0 HG LEU B 103 4.037 2.084 10.043 1.00 75.20 H new ATOM 0 HD11 LEU B 103 6.515 1.844 9.718 1.00 72.30 H new ATOM 0 HD12 LEU B 103 5.744 0.302 10.161 1.00 72.30 H new ATOM 0 HD13 LEU B 103 6.211 0.610 8.471 1.00 72.30 H new ATOM 0 HD21 LEU B 103 5.278 3.595 8.519 1.00 62.31 H new ATOM 0 HD22 LEU B 103 4.909 2.506 7.160 1.00 62.31 H new ATOM 0 HD23 LEU B 103 3.591 3.346 8.010 1.00 62.31 H new ATOM 3430 N LEU B 104 1.236 1.005 6.328 1.00 74.10 N ATOM 3431 CA LEU B 104 0.842 1.616 5.043 1.00 2.25 C ATOM 3432 C LEU B 104 -0.529 2.296 5.164 1.00 51.45 C ATOM 3433 O LEU B 104 -0.711 3.413 4.682 1.00 54.23 O ATOM 3434 CB LEU B 104 0.839 0.542 3.914 1.00 21.51 C ATOM 3435 CG LEU B 104 0.543 1.041 2.460 1.00 43.13 C ATOM 3436 CD1 LEU B 104 1.531 2.146 2.017 1.00 1.35 C ATOM 3437 CD2 LEU B 104 0.555 -0.143 1.468 1.00 43.12 C ATOM 0 H LEU B 104 1.330 -0.010 6.287 1.00 74.10 H new ATOM 0 HA LEU B 104 1.572 2.383 4.782 1.00 2.25 H new ATOM 0 HB2 LEU B 104 1.812 0.050 3.912 1.00 21.51 H new ATOM 0 HB3 LEU B 104 0.099 -0.216 4.169 1.00 21.51 H new ATOM 0 HG LEU B 104 -0.453 1.483 2.460 1.00 43.13 H new ATOM 0 HD11 LEU B 104 1.290 2.464 1.003 1.00 1.35 H new ATOM 0 HD12 LEU B 104 1.451 2.998 2.693 1.00 1.35 H new ATOM 0 HD13 LEU B 104 2.549 1.756 2.043 1.00 1.35 H new ATOM 0 HD21 LEU B 104 0.347 0.223 0.462 1.00 43.12 H new ATOM 0 HD22 LEU B 104 1.534 -0.622 1.485 1.00 43.12 H new ATOM 0 HD23 LEU B 104 -0.208 -0.866 1.756 1.00 43.12 H new ATOM 3449 N ASP B 105 -1.464 1.625 5.864 1.00 25.24 N ATOM 3450 CA ASP B 105 -2.826 2.142 6.070 1.00 5.34 C ATOM 3451 C ASP B 105 -2.792 3.393 6.965 1.00 2.42 C ATOM 3452 O ASP B 105 -3.294 4.441 6.575 1.00 34.42 O ATOM 3453 CB ASP B 105 -3.741 1.050 6.692 1.00 33.30 C ATOM 3454 CG ASP B 105 -5.221 1.491 6.772 1.00 70.32 C ATOM 3455 OD1 ASP B 105 -5.993 1.214 5.826 1.00 43.34 O ATOM 3456 OD2 ASP B 105 -5.623 2.135 7.771 1.00 51.11 O ATOM 0 H ASP B 105 -1.296 0.717 6.298 1.00 25.24 H new ATOM 0 HA ASP B 105 -3.240 2.419 5.100 1.00 5.34 H new ATOM 0 HB2 ASP B 105 -3.669 0.139 6.098 1.00 33.30 H new ATOM 0 HB3 ASP B 105 -3.383 0.808 7.693 1.00 33.30 H new ATOM 3461 N VAL B 106 -2.134 3.275 8.137 1.00 43.22 N ATOM 3462 CA VAL B 106 -2.064 4.349 9.155 1.00 73.32 C ATOM 3463 C VAL B 106 -1.433 5.641 8.583 1.00 51.45 C ATOM 3464 O VAL B 106 -1.999 6.727 8.736 1.00 65.13 O ATOM 3465 CB VAL B 106 -1.285 3.860 10.448 1.00 11.30 C ATOM 3466 CG1 VAL B 106 -0.976 5.019 11.430 1.00 54.33 C ATOM 3467 CG2 VAL B 106 -2.074 2.741 11.175 1.00 41.13 C ATOM 0 H VAL B 106 -1.633 2.428 8.407 1.00 43.22 H new ATOM 0 HA VAL B 106 -3.087 4.587 9.446 1.00 73.32 H new ATOM 0 HB VAL B 106 -0.330 3.462 10.105 1.00 11.30 H new ATOM 0 HG11 VAL B 106 -0.442 4.629 12.297 1.00 54.33 H new ATOM 0 HG12 VAL B 106 -0.359 5.765 10.929 1.00 54.33 H new ATOM 0 HG13 VAL B 106 -1.909 5.479 11.755 1.00 54.33 H new ATOM 0 HG21 VAL B 106 -1.521 2.421 12.058 1.00 41.13 H new ATOM 0 HG22 VAL B 106 -3.050 3.121 11.476 1.00 41.13 H new ATOM 0 HG23 VAL B 106 -2.206 1.893 10.503 1.00 41.13 H new ATOM 3477 N THR B 107 -0.293 5.501 7.892 1.00 11.15 N ATOM 3478 CA THR B 107 0.473 6.650 7.370 1.00 74.50 C ATOM 3479 C THR B 107 -0.250 7.324 6.173 1.00 3.24 C ATOM 3480 O THR B 107 -0.291 8.561 6.080 1.00 1.03 O ATOM 3481 CB THR B 107 1.919 6.203 6.979 1.00 22.45 C ATOM 3482 OG1 THR B 107 2.527 5.543 8.102 1.00 1.31 O ATOM 3483 CG2 THR B 107 2.810 7.383 6.566 1.00 24.23 C ATOM 0 H THR B 107 0.125 4.596 7.678 1.00 11.15 H new ATOM 0 HA THR B 107 0.544 7.397 8.161 1.00 74.50 H new ATOM 0 HB THR B 107 1.831 5.534 6.123 1.00 22.45 H new ATOM 0 HG1 THR B 107 3.501 5.544 7.994 1.00 1.31 H new ATOM 0 HG21 THR B 107 3.802 7.016 6.305 1.00 24.23 H new ATOM 0 HG22 THR B 107 2.371 7.886 5.705 1.00 24.23 H new ATOM 0 HG23 THR B 107 2.890 8.086 7.395 1.00 24.23 H new ATOM 3491 N CYS B 108 -0.846 6.498 5.283 1.00 31.01 N ATOM 3492 CA CYS B 108 -1.647 7.000 4.140 1.00 51.50 C ATOM 3493 C CYS B 108 -2.947 7.683 4.626 1.00 54.10 C ATOM 3494 O CYS B 108 -3.435 8.610 3.984 1.00 55.12 O ATOM 3495 CB CYS B 108 -1.971 5.868 3.143 1.00 21.35 C ATOM 3496 SG CYS B 108 -0.518 5.152 2.343 1.00 64.21 S ATOM 0 H CYS B 108 -0.788 5.481 5.333 1.00 31.01 H new ATOM 0 HA CYS B 108 -1.044 7.745 3.622 1.00 51.50 H new ATOM 0 HB2 CYS B 108 -2.509 5.079 3.668 1.00 21.35 H new ATOM 0 HB3 CYS B 108 -2.641 6.255 2.376 1.00 21.35 H new ATOM 0 HG CYS B 108 -0.116 4.117 3.019 1.00 64.21 H new ATOM 3502 N LYS B 109 -3.487 7.207 5.771 1.00 60.02 N ATOM 3503 CA LYS B 109 -4.669 7.817 6.423 1.00 52.44 C ATOM 3504 C LYS B 109 -4.293 9.165 7.052 1.00 4.03 C ATOM 3505 O LYS B 109 -5.070 10.102 6.970 1.00 73.40 O ATOM 3506 CB LYS B 109 -5.316 6.858 7.495 1.00 43.33 C ATOM 3507 CG LYS B 109 -6.554 6.059 7.006 1.00 4.13 C ATOM 3508 CD LYS B 109 -6.267 5.189 5.767 1.00 1.20 C ATOM 3509 CE LYS B 109 -7.495 4.396 5.291 1.00 34.21 C ATOM 3510 NZ LYS B 109 -7.985 3.447 6.322 1.00 1.30 N ATOM 0 H LYS B 109 -3.119 6.395 6.266 1.00 60.02 H new ATOM 0 HA LYS B 109 -5.421 7.985 5.652 1.00 52.44 H new ATOM 0 HB2 LYS B 109 -4.557 6.151 7.832 1.00 43.33 H new ATOM 0 HB3 LYS B 109 -5.606 7.452 8.362 1.00 43.33 H new ATOM 0 HG2 LYS B 109 -6.909 5.421 7.815 1.00 4.13 H new ATOM 0 HG3 LYS B 109 -7.359 6.756 6.773 1.00 4.13 H new ATOM 0 HD2 LYS B 109 -5.917 5.827 4.956 1.00 1.20 H new ATOM 0 HD3 LYS B 109 -5.460 4.494 5.997 1.00 1.20 H new ATOM 0 HE2 LYS B 109 -8.294 5.090 5.029 1.00 34.21 H new ATOM 0 HE3 LYS B 109 -7.241 3.846 4.385 1.00 34.21 H new ATOM 0 HZ1 LYS B 109 -8.377 2.603 5.858 1.00 1.30 H new ATOM 0 HZ2 LYS B 109 -7.196 3.168 6.940 1.00 1.30 H new ATOM 0 HZ3 LYS B 109 -8.725 3.905 6.891 1.00 1.30 H new ATOM 3524 N THR B 110 -3.086 9.252 7.650 1.00 13.30 N ATOM 3525 CA THR B 110 -2.605 10.480 8.327 1.00 4.53 C ATOM 3526 C THR B 110 -2.603 11.687 7.365 1.00 43.55 C ATOM 3527 O THR B 110 -3.128 12.761 7.697 1.00 72.54 O ATOM 3528 CB THR B 110 -1.177 10.256 8.927 1.00 32.32 C ATOM 3529 OG1 THR B 110 -1.234 9.204 9.904 1.00 62.34 O ATOM 3530 CG2 THR B 110 -0.598 11.529 9.583 1.00 41.44 C ATOM 0 H THR B 110 -2.420 8.480 7.679 1.00 13.30 H new ATOM 0 HA THR B 110 -3.294 10.702 9.142 1.00 4.53 H new ATOM 0 HB THR B 110 -0.517 9.987 8.102 1.00 32.32 H new ATOM 0 HG1 THR B 110 -1.501 8.368 9.469 1.00 62.34 H new ATOM 0 HG21 THR B 110 0.393 11.314 9.982 1.00 41.44 H new ATOM 0 HG22 THR B 110 -0.526 12.321 8.838 1.00 41.44 H new ATOM 0 HG23 THR B 110 -1.253 11.851 10.393 1.00 41.44 H new ATOM 3538 N VAL B 111 -2.044 11.478 6.160 1.00 53.12 N ATOM 3539 CA VAL B 111 -1.992 12.520 5.121 1.00 1.21 C ATOM 3540 C VAL B 111 -3.381 12.737 4.478 1.00 3.52 C ATOM 3541 O VAL B 111 -3.738 13.875 4.135 1.00 61.45 O ATOM 3542 CB VAL B 111 -0.908 12.196 4.030 1.00 33.15 C ATOM 3543 CG1 VAL B 111 -1.171 10.842 3.334 1.00 50.50 C ATOM 3544 CG2 VAL B 111 -0.763 13.350 3.009 1.00 65.54 C ATOM 0 H VAL B 111 -1.620 10.593 5.882 1.00 53.12 H new ATOM 0 HA VAL B 111 -1.698 13.450 5.607 1.00 1.21 H new ATOM 0 HB VAL B 111 0.046 12.102 4.548 1.00 33.15 H new ATOM 0 HG11 VAL B 111 -0.397 10.660 2.588 1.00 50.50 H new ATOM 0 HG12 VAL B 111 -1.156 10.043 4.075 1.00 50.50 H new ATOM 0 HG13 VAL B 111 -2.146 10.867 2.847 1.00 50.50 H new ATOM 0 HG21 VAL B 111 -0.005 13.089 2.271 1.00 65.54 H new ATOM 0 HG22 VAL B 111 -1.717 13.514 2.507 1.00 65.54 H new ATOM 0 HG23 VAL B 111 -0.465 14.261 3.529 1.00 65.54 H new ATOM 3554 N ALA B 112 -4.167 11.642 4.354 1.00 4.44 N ATOM 3555 CA ALA B 112 -5.517 11.684 3.772 1.00 44.15 C ATOM 3556 C ALA B 112 -6.448 12.591 4.599 1.00 73.40 C ATOM 3557 O ALA B 112 -7.079 13.479 4.045 1.00 23.24 O ATOM 3558 CB ALA B 112 -6.099 10.270 3.647 1.00 10.44 C ATOM 0 H ALA B 112 -3.879 10.711 4.655 1.00 4.44 H new ATOM 0 HA ALA B 112 -5.440 12.109 2.771 1.00 44.15 H new ATOM 0 HB1 ALA B 112 -7.098 10.325 3.214 1.00 10.44 H new ATOM 0 HB2 ALA B 112 -5.457 9.668 3.004 1.00 10.44 H new ATOM 0 HB3 ALA B 112 -6.156 9.811 4.634 1.00 10.44 H new ATOM 3564 N ASN B 113 -6.436 12.407 5.938 1.00 24.32 N ATOM 3565 CA ASN B 113 -7.365 13.096 6.882 1.00 75.35 C ATOM 3566 C ASN B 113 -7.238 14.633 6.810 1.00 35.21 C ATOM 3567 O ASN B 113 -8.209 15.356 7.079 1.00 63.14 O ATOM 3568 CB ASN B 113 -7.117 12.624 8.350 1.00 71.42 C ATOM 3569 CG ASN B 113 -7.374 11.129 8.574 1.00 73.30 C ATOM 3570 OD1 ASN B 113 -8.209 10.512 7.908 1.00 41.15 O ATOM 3571 ND2 ASN B 113 -6.650 10.525 9.513 1.00 4.44 N ATOM 0 H ASN B 113 -5.783 11.776 6.403 1.00 24.32 H new ATOM 0 HA ASN B 113 -8.376 12.825 6.577 1.00 75.35 H new ATOM 0 HB2 ASN B 113 -6.087 12.851 8.625 1.00 71.42 H new ATOM 0 HB3 ASN B 113 -7.759 13.197 9.019 1.00 71.42 H new ATOM 0 HD21 ASN B 113 -6.779 9.530 9.695 1.00 4.44 H new ATOM 0 HD22 ASN B 113 -5.966 11.057 10.050 1.00 4.44 H new ATOM 3578 N MET B 114 -6.037 15.113 6.442 1.00 33.42 N ATOM 3579 CA MET B 114 -5.740 16.552 6.321 1.00 75.43 C ATOM 3580 C MET B 114 -6.534 17.168 5.155 1.00 53.13 C ATOM 3581 O MET B 114 -7.129 18.240 5.285 1.00 53.45 O ATOM 3582 CB MET B 114 -4.216 16.774 6.093 1.00 53.12 C ATOM 3583 CG MET B 114 -3.306 16.115 7.143 1.00 33.31 C ATOM 3584 SD MET B 114 -1.569 16.611 6.990 1.00 41.51 S ATOM 3585 CE MET B 114 -1.166 16.195 5.285 1.00 53.11 C ATOM 0 H MET B 114 -5.243 14.513 6.220 1.00 33.42 H new ATOM 0 HA MET B 114 -6.035 17.041 7.249 1.00 75.43 H new ATOM 0 HB2 MET B 114 -3.950 16.389 5.109 1.00 53.12 H new ATOM 0 HB3 MET B 114 -4.017 17.846 6.081 1.00 53.12 H new ATOM 0 HG2 MET B 114 -3.665 16.373 8.139 1.00 33.31 H new ATOM 0 HG3 MET B 114 -3.378 15.031 7.049 1.00 33.31 H new ATOM 0 HE1 MET B 114 -0.192 15.708 5.250 1.00 53.11 H new ATOM 0 HE2 MET B 114 -1.924 15.521 4.886 1.00 53.11 H new ATOM 0 HE3 MET B 114 -1.138 17.105 4.685 1.00 53.11 H new ATOM 3595 N ILE B 115 -6.544 16.444 4.026 1.00 63.11 N ATOM 3596 CA ILE B 115 -7.117 16.923 2.746 1.00 31.42 C ATOM 3597 C ILE B 115 -8.522 16.333 2.470 1.00 24.12 C ATOM 3598 O ILE B 115 -9.198 16.755 1.528 1.00 52.11 O ATOM 3599 CB ILE B 115 -6.142 16.556 1.563 1.00 63.52 C ATOM 3600 CG1 ILE B 115 -5.944 15.013 1.501 1.00 23.24 C ATOM 3601 CG2 ILE B 115 -4.778 17.282 1.706 1.00 54.42 C ATOM 3602 CD1 ILE B 115 -5.030 14.527 0.416 1.00 45.15 C ATOM 0 H ILE B 115 -6.154 15.503 3.968 1.00 63.11 H new ATOM 0 HA ILE B 115 -7.230 18.005 2.821 1.00 31.42 H new ATOM 0 HB ILE B 115 -6.593 16.894 0.630 1.00 63.52 H new ATOM 0 HG12 ILE B 115 -5.554 14.675 2.461 1.00 23.24 H new ATOM 0 HG13 ILE B 115 -6.919 14.543 1.370 1.00 23.24 H new ATOM 0 HG21 ILE B 115 -4.130 17.006 0.874 1.00 54.42 H new ATOM 0 HG22 ILE B 115 -4.937 18.360 1.700 1.00 54.42 H new ATOM 0 HG23 ILE B 115 -4.307 16.990 2.645 1.00 54.42 H new ATOM 0 HD11 ILE B 115 -4.960 13.440 0.459 1.00 45.15 H new ATOM 0 HD12 ILE B 115 -5.426 14.827 -0.554 1.00 45.15 H new ATOM 0 HD13 ILE B 115 -4.039 14.960 0.554 1.00 45.15 H new ATOM 3614 N ARG B 116 -8.962 15.373 3.302 1.00 61.32 N ATOM 3615 CA ARG B 116 -10.236 14.646 3.102 1.00 33.32 C ATOM 3616 C ARG B 116 -11.420 15.491 3.632 1.00 11.40 C ATOM 3617 O ARG B 116 -12.561 15.159 3.362 1.00 33.00 O ATOM 3618 CB ARG B 116 -10.116 13.219 3.767 1.00 40.25 C ATOM 3619 CG ARG B 116 -10.980 12.068 3.162 1.00 14.42 C ATOM 3620 CD ARG B 116 -12.430 12.039 3.669 1.00 23.40 C ATOM 3621 NE ARG B 116 -13.240 11.006 3.009 1.00 54.25 N ATOM 3622 CZ ARG B 116 -14.577 11.006 2.950 1.00 14.22 C ATOM 3623 NH1 ARG B 116 -15.286 11.990 3.504 1.00 32.25 N ATOM 3624 NH2 ARG B 116 -15.199 10.008 2.355 1.00 40.42 N ATOM 0 H ARG B 116 -8.448 15.077 4.132 1.00 61.32 H new ATOM 0 HA ARG B 116 -10.439 14.489 2.043 1.00 33.32 H new ATOM 0 HB2 ARG B 116 -9.070 12.914 3.723 1.00 40.25 H new ATOM 0 HB3 ARG B 116 -10.375 13.316 4.821 1.00 40.25 H new ATOM 0 HG2 ARG B 116 -10.988 12.166 2.076 1.00 14.42 H new ATOM 0 HG3 ARG B 116 -10.507 11.113 3.392 1.00 14.42 H new ATOM 0 HD2 ARG B 116 -12.431 11.864 4.745 1.00 23.40 H new ATOM 0 HD3 ARG B 116 -12.888 13.014 3.504 1.00 23.40 H new ATOM 0 HE ARG B 116 -12.747 10.232 2.563 1.00 54.25 H new ATOM 0 HH11 ARG B 116 -14.810 12.756 3.981 1.00 32.25 H new ATOM 0 HH12 ARG B 116 -16.305 11.977 3.451 1.00 32.25 H new ATOM 0 HH21 ARG B 116 -14.662 9.244 1.944 1.00 40.42 H new ATOM 0 HH22 ARG B 116 -16.218 9.999 2.305 1.00 40.42 H new ATOM 3638 N GLY B 117 -11.099 16.607 4.341 1.00 10.41 N ATOM 3639 CA GLY B 117 -12.061 17.625 4.850 1.00 2.43 C ATOM 3640 C GLY B 117 -13.484 17.163 5.253 1.00 55.52 C ATOM 3641 O GLY B 117 -14.434 17.959 5.140 1.00 53.24 O ATOM 3642 OXT GLY B 117 -13.660 16.019 5.706 1.00 37.94 O ATOM 0 H GLY B 117 -10.133 16.831 4.582 1.00 10.41 H new ATOM 0 HA2 GLY B 117 -11.609 18.102 5.720 1.00 2.43 H new ATOM 0 HA3 GLY B 117 -12.167 18.393 4.084 1.00 2.43 H new TER 3646 GLY B 117