USER MOD reduce.3.24.130724 H: found=0, std=0, add=1160, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1162 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 40 GLN : amide:sc= 0.34 K(o=0.55,f=-3.3!) USER MOD Set 1.2: A 144 SER OG : rot 180:sc= 0.354 USER MOD Set 1.3: A 148 GLN : amide:sc= 0.258 K(o=0.55,f=-0.57) USER MOD Set 1.4: A 151 LYS NZ :NH3+ 145:sc= -0.407 (180deg=-2.08!) USER MOD Set 2.1: A 126 THR OG1 : rot 119:sc= 0.045 USER MOD Set 2.2: A 128 SER OG : rot 180:sc= 0.00544 USER MOD Set 3.1: A 120 SER OG : rot 21:sc= -1.14! USER MOD Set 3.2: A 122 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 106 THR OG1 : rot 180:sc= -0.743 USER MOD Set 4.2: A 108 ASN : amide:sc= -0.114 X(o=-0.85,f=-0.74) USER MOD Set 4.3: A 121 THR OG1 : rot 103:sc= 0.00598 USER MOD Set 5.1: A 53 LYS NZ :NH3+ -153:sc= 1.24 (180deg=0) USER MOD Set 5.2: A 76 GLN : amide:sc= 0.716 K(o=2,f=-13!) USER MOD Set 6.1: A 66 MET CE :methyl -129:sc= -0.0432 (180deg=-0.224) USER MOD Set 6.2: A 68 SER OG : rot 180:sc=-0.00947 USER MOD Set 7.1: A 15 THR OG1 : rot 180:sc= 0.301 USER MOD Set 7.2: A 117 THR OG1 : rot -91:sc= 0.316 USER MOD Set 8.1: A 13 THR OG1 : rot 159:sc= 0.233 USER MOD Set 8.2: A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ -117:sc= -0.164 (180deg=-1.97!) USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ -126:sc= 0.667 (180deg=-0.224) USER MOD Single : A 8 ASN : amide:sc= 0.207 X(o=0.21,f=-0.096) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= -0.959 USER MOD Single : A 21 ASN : amide:sc= -0.0466 K(o=-0.047,f=-3.3!) USER MOD Single : A 22 LYS NZ :NH3+ -129:sc= 0.603 (180deg=0) USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 84:sc= 0.878 USER MOD Single : A 29 LYS NZ :NH3+ -176:sc= 0.4 (180deg=0.375) USER MOD Single : A 35 GLN :FLIP amide:sc= -0.0343 F(o=-2.3!,f=-0.034) USER MOD Single : A 38 HIS : +bothHN:sc= 0.653 K(o=0.65,f=-2.7) USER MOD Single : A 43 SER OG : rot 180:sc= -0.0784 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.139 K(o=-0.14,f=-3.9!) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot -141:sc= 0.00285 USER MOD Single : A 62 GLN : amide:sc= -0.71 X(o=-0.71,f=-0.22) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 TYR OH : rot 117:sc= 0.766 USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 TYR OH : rot -150:sc= 0.269 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 THR OG1 : rot -44:sc= 0.462 USER MOD Single : A 92 SER OG : rot 94:sc= 0.126 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -130:sc= -0.484 (180deg=-1.77!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 100 MET CE :methyl -159:sc= -0.119 (180deg=-0.633) USER MOD Single : A 103 MET CE :methyl 150:sc= -0.37 (180deg=-2.21!) USER MOD Single : A 104 HIS : no HE2:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot 100:sc= -0.251 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 GLN : amide:sc=0.000624 X(o=0.00062,f=0) USER MOD Single : A 132 GLN :FLIP amide:sc= 0 F(o=-0.68,f=0) USER MOD Single : A 136 MET CE :methyl 163:sc= -0.0837 (180deg=-0.492) USER MOD Single : A 140 THR OG1 : rot 86:sc= 0.0108 USER MOD Single : A 142 MET CE :methyl 149:sc= -2.53! (180deg=-2.84!) USER MOD Single : A 143 ASN : amide:sc= 0.652 K(o=0.65,f=-0.37) USER MOD Single : A 145 THR OG1 : rot 73:sc= 0.0622 USER MOD Single : A 147 ASN :FLIP amide:sc= -0.123 F(o=-1.4,f=-0.12) USER MOD Single : A 154 ASN : amide:sc= -0.0504 X(o=-0.05,f=0) USER MOD Single : A 155 GLN :FLIP amide:sc= 0.742 F(o=-0.011,f=0.74) USER MOD ----------------------------------------------------------------- ATOM 34 N ILE A 3 3.188 -15.660 -4.098 1.00 35.45 N ATOM 35 CA ILE A 3 4.162 -14.662 -3.589 1.00 30.13 C ATOM 36 C ILE A 3 5.626 -15.147 -3.787 1.00 61.43 C ATOM 37 O ILE A 3 6.099 -16.053 -3.089 1.00 30.32 O ATOM 38 CB ILE A 3 3.926 -14.236 -2.079 1.00 0.01 C ATOM 39 CG1 ILE A 3 2.488 -13.633 -1.855 1.00 73.04 C ATOM 40 CG2 ILE A 3 5.011 -13.228 -1.603 1.00 41.50 C ATOM 41 CD1 ILE A 3 1.363 -14.631 -1.642 1.00 64.33 C ATOM 0 HA ILE A 3 3.991 -13.769 -4.190 1.00 30.13 H new ATOM 0 HB ILE A 3 4.005 -15.143 -1.480 1.00 0.01 H new ATOM 0 HG12 ILE A 3 2.526 -12.971 -0.990 1.00 73.04 H new ATOM 0 HG13 ILE A 3 2.238 -13.016 -2.718 1.00 73.04 H new ATOM 0 HG21 ILE A 3 4.823 -12.954 -0.565 1.00 41.50 H new ATOM 0 HG22 ILE A 3 5.996 -13.688 -1.684 1.00 41.50 H new ATOM 0 HG23 ILE A 3 4.975 -12.334 -2.226 1.00 41.50 H new ATOM 0 HD11 ILE A 3 0.424 -14.096 -1.499 1.00 64.33 H new ATOM 0 HD12 ILE A 3 1.282 -15.280 -2.514 1.00 64.33 H new ATOM 0 HD13 ILE A 3 1.574 -15.235 -0.759 1.00 64.33 H new ATOM 53 N GLU A 4 6.344 -14.509 -4.721 1.00 70.44 N ATOM 54 CA GLU A 4 7.720 -14.907 -5.085 1.00 30.02 C ATOM 55 C GLU A 4 8.756 -14.094 -4.267 1.00 65.32 C ATOM 56 O GLU A 4 8.506 -12.946 -3.903 1.00 44.32 O ATOM 57 CB GLU A 4 7.934 -14.708 -6.618 1.00 4.33 C ATOM 58 CG GLU A 4 9.329 -15.109 -7.157 1.00 55.23 C ATOM 59 CD GLU A 4 9.645 -16.606 -6.992 1.00 1.21 C ATOM 60 OE1 GLU A 4 9.222 -17.410 -7.854 1.00 4.52 O ATOM 61 OE2 GLU A 4 10.300 -16.992 -5.997 1.00 23.21 O ATOM 0 H GLU A 4 5.995 -13.707 -5.245 1.00 70.44 H new ATOM 0 HA GLU A 4 7.864 -15.961 -4.847 1.00 30.02 H new ATOM 0 HB2 GLU A 4 7.179 -15.287 -7.150 1.00 4.33 H new ATOM 0 HB3 GLU A 4 7.760 -13.659 -6.858 1.00 4.33 H new ATOM 0 HG2 GLU A 4 9.390 -14.847 -8.213 1.00 55.23 H new ATOM 0 HG3 GLU A 4 10.091 -14.526 -6.639 1.00 55.23 H new ATOM 68 N LYS A 5 9.914 -14.709 -3.960 1.00 14.12 N ATOM 69 CA LYS A 5 10.985 -14.069 -3.154 1.00 4.12 C ATOM 70 C LYS A 5 12.260 -13.817 -4.001 1.00 44.13 C ATOM 71 O LYS A 5 12.638 -14.645 -4.836 1.00 23.05 O ATOM 72 CB LYS A 5 11.315 -14.944 -1.919 1.00 62.04 C ATOM 73 CG LYS A 5 10.105 -15.274 -1.007 1.00 53.42 C ATOM 74 CD LYS A 5 9.343 -14.010 -0.533 1.00 63.13 C ATOM 75 CE LYS A 5 8.301 -14.304 0.559 1.00 13.52 C ATOM 76 NZ LYS A 5 7.261 -15.276 0.124 1.00 40.51 N ATOM 0 H LYS A 5 10.138 -15.658 -4.259 1.00 14.12 H new ATOM 0 HA LYS A 5 10.620 -13.100 -2.815 1.00 4.12 H new ATOM 0 HB2 LYS A 5 11.757 -15.879 -2.263 1.00 62.04 H new ATOM 0 HB3 LYS A 5 12.072 -14.434 -1.323 1.00 62.04 H new ATOM 0 HG2 LYS A 5 9.417 -15.925 -1.546 1.00 53.42 H new ATOM 0 HG3 LYS A 5 10.454 -15.829 -0.136 1.00 53.42 H new ATOM 0 HD2 LYS A 5 10.060 -13.282 -0.155 1.00 63.13 H new ATOM 0 HD3 LYS A 5 8.845 -13.552 -1.388 1.00 63.13 H new ATOM 0 HE2 LYS A 5 8.808 -14.694 1.442 1.00 13.52 H new ATOM 0 HE3 LYS A 5 7.819 -13.372 0.854 1.00 13.52 H new ATOM 0 HZ1 LYS A 5 6.330 -14.813 0.128 1.00 40.51 H new ATOM 0 HZ2 LYS A 5 7.478 -15.610 -0.837 1.00 40.51 H new ATOM 0 HZ3 LYS A 5 7.248 -16.086 0.777 1.00 40.51 H new ATOM 90 N LYS A 6 12.906 -12.654 -3.771 1.00 61.31 N ATOM 91 CA LYS A 6 14.102 -12.189 -4.534 1.00 41.04 C ATOM 92 C LYS A 6 15.294 -11.896 -3.560 1.00 70.31 C ATOM 93 O LYS A 6 15.327 -12.426 -2.439 1.00 71.53 O ATOM 94 CB LYS A 6 13.696 -10.905 -5.320 1.00 50.42 C ATOM 95 CG LYS A 6 12.424 -11.041 -6.204 1.00 41.53 C ATOM 96 CD LYS A 6 12.658 -11.800 -7.530 1.00 42.14 C ATOM 97 CE LYS A 6 13.550 -11.016 -8.508 1.00 13.31 C ATOM 98 NZ LYS A 6 13.664 -11.687 -9.830 1.00 31.01 N ATOM 0 H LYS A 6 12.615 -11.999 -3.045 1.00 61.31 H new ATOM 0 HA LYS A 6 14.434 -12.961 -5.228 1.00 41.04 H new ATOM 0 HB2 LYS A 6 13.537 -10.097 -4.606 1.00 50.42 H new ATOM 0 HB3 LYS A 6 14.530 -10.609 -5.956 1.00 50.42 H new ATOM 0 HG2 LYS A 6 11.651 -11.556 -5.634 1.00 41.53 H new ATOM 0 HG3 LYS A 6 12.043 -10.045 -6.430 1.00 41.53 H new ATOM 0 HD2 LYS A 6 13.119 -12.764 -7.316 1.00 42.14 H new ATOM 0 HD3 LYS A 6 11.697 -12.003 -8.003 1.00 42.14 H new ATOM 0 HE2 LYS A 6 13.142 -10.015 -8.645 1.00 13.31 H new ATOM 0 HE3 LYS A 6 14.544 -10.899 -8.076 1.00 13.31 H new ATOM 0 HZ1 LYS A 6 14.274 -11.122 -10.455 1.00 31.01 H new ATOM 0 HZ2 LYS A 6 14.078 -12.633 -9.705 1.00 31.01 H new ATOM 0 HZ3 LYS A 6 12.720 -11.776 -10.257 1.00 31.01 H new ATOM 112 N LYS A 7 16.284 -11.073 -4.004 1.00 30.10 N ATOM 113 CA LYS A 7 17.385 -10.575 -3.132 1.00 3.10 C ATOM 114 C LYS A 7 16.851 -9.587 -2.051 1.00 72.03 C ATOM 115 O LYS A 7 16.555 -9.984 -0.918 1.00 61.41 O ATOM 116 CB LYS A 7 18.513 -9.906 -3.982 1.00 41.24 C ATOM 117 CG LYS A 7 19.470 -10.878 -4.713 1.00 10.11 C ATOM 118 CD LYS A 7 20.555 -10.123 -5.532 1.00 71.22 C ATOM 119 CE LYS A 7 21.743 -11.019 -5.929 1.00 50.32 C ATOM 120 NZ LYS A 7 22.512 -11.478 -4.742 1.00 4.20 N ATOM 0 H LYS A 7 16.341 -10.739 -4.966 1.00 30.10 H new ATOM 0 HA LYS A 7 17.811 -11.436 -2.617 1.00 3.10 H new ATOM 0 HB2 LYS A 7 18.047 -9.258 -4.724 1.00 41.24 H new ATOM 0 HB3 LYS A 7 19.105 -9.267 -3.327 1.00 41.24 H new ATOM 0 HG2 LYS A 7 19.954 -11.528 -3.983 1.00 10.11 H new ATOM 0 HG3 LYS A 7 18.894 -11.520 -5.380 1.00 10.11 H new ATOM 0 HD2 LYS A 7 20.101 -9.711 -6.433 1.00 71.22 H new ATOM 0 HD3 LYS A 7 20.923 -9.280 -4.947 1.00 71.22 H new ATOM 0 HE2 LYS A 7 21.376 -11.884 -6.481 1.00 50.32 H new ATOM 0 HE3 LYS A 7 22.404 -10.470 -6.600 1.00 50.32 H new ATOM 0 HZ1 LYS A 7 23.516 -11.235 -4.863 1.00 4.20 H new ATOM 0 HZ2 LYS A 7 22.144 -11.012 -3.888 1.00 4.20 H new ATOM 0 HZ3 LYS A 7 22.415 -12.509 -4.643 1.00 4.20 H new ATOM 134 N ASN A 8 16.708 -8.301 -2.423 1.00 22.32 N ATOM 135 CA ASN A 8 16.217 -7.230 -1.518 1.00 60.50 C ATOM 136 C ASN A 8 14.777 -6.833 -1.898 1.00 75.13 C ATOM 137 O ASN A 8 14.374 -5.682 -1.785 1.00 41.03 O ATOM 138 CB ASN A 8 17.190 -6.020 -1.573 1.00 72.33 C ATOM 139 CG ASN A 8 17.343 -5.420 -2.966 1.00 53.04 C ATOM 140 OD1 ASN A 8 18.150 -5.875 -3.766 1.00 73.22 O ATOM 141 ND2 ASN A 8 16.566 -4.397 -3.271 1.00 31.32 N ATOM 0 H ASN A 8 16.929 -7.969 -3.362 1.00 22.32 H new ATOM 0 HA ASN A 8 16.191 -7.594 -0.491 1.00 60.50 H new ATOM 0 HB2 ASN A 8 16.834 -5.248 -0.891 1.00 72.33 H new ATOM 0 HB3 ASN A 8 18.169 -6.336 -1.213 1.00 72.33 H new ATOM 0 HD21 ASN A 8 16.629 -3.965 -4.193 1.00 31.32 H new ATOM 0 HD22 ASN A 8 15.902 -4.038 -2.585 1.00 31.32 H new ATOM 148 N LYS A 9 13.997 -7.839 -2.313 1.00 72.44 N ATOM 149 CA LYS A 9 12.654 -7.638 -2.883 1.00 20.35 C ATOM 150 C LYS A 9 11.723 -8.852 -2.607 1.00 22.31 C ATOM 151 O LYS A 9 12.172 -10.002 -2.570 1.00 21.34 O ATOM 152 CB LYS A 9 12.815 -7.365 -4.405 1.00 73.50 C ATOM 153 CG LYS A 9 11.527 -7.431 -5.252 1.00 3.52 C ATOM 154 CD LYS A 9 11.821 -7.248 -6.759 1.00 40.21 C ATOM 155 CE LYS A 9 10.643 -7.662 -7.640 1.00 4.12 C ATOM 156 NZ LYS A 9 10.890 -7.402 -9.077 1.00 21.24 N ATOM 0 H LYS A 9 14.278 -8.818 -2.264 1.00 72.44 H new ATOM 0 HA LYS A 9 12.174 -6.784 -2.406 1.00 20.35 H new ATOM 0 HB2 LYS A 9 13.256 -6.376 -4.530 1.00 73.50 H new ATOM 0 HB3 LYS A 9 13.527 -8.085 -4.808 1.00 73.50 H new ATOM 0 HG2 LYS A 9 11.035 -8.390 -5.091 1.00 3.52 H new ATOM 0 HG3 LYS A 9 10.834 -6.658 -4.920 1.00 3.52 H new ATOM 0 HD2 LYS A 9 12.067 -6.204 -6.954 1.00 40.21 H new ATOM 0 HD3 LYS A 9 12.697 -7.837 -7.029 1.00 40.21 H new ATOM 0 HE2 LYS A 9 10.441 -8.723 -7.496 1.00 4.12 H new ATOM 0 HE3 LYS A 9 9.750 -7.122 -7.325 1.00 4.12 H new ATOM 0 HZ1 LYS A 9 10.062 -7.700 -9.631 1.00 21.24 H new ATOM 0 HZ2 LYS A 9 11.056 -6.386 -9.222 1.00 21.24 H new ATOM 0 HZ3 LYS A 9 11.726 -7.937 -9.388 1.00 21.24 H new ATOM 170 N ILE A 10 10.427 -8.565 -2.389 1.00 75.33 N ATOM 171 CA ILE A 10 9.346 -9.571 -2.297 1.00 20.23 C ATOM 172 C ILE A 10 8.215 -9.203 -3.299 1.00 45.45 C ATOM 173 O ILE A 10 7.721 -8.072 -3.301 1.00 74.25 O ATOM 174 CB ILE A 10 8.778 -9.659 -0.824 1.00 73.31 C ATOM 175 CG1 ILE A 10 9.891 -10.165 0.158 1.00 5.03 C ATOM 176 CG2 ILE A 10 7.511 -10.555 -0.738 1.00 23.24 C ATOM 177 CD1 ILE A 10 9.475 -10.262 1.615 1.00 74.55 C ATOM 0 H ILE A 10 10.092 -7.609 -2.269 1.00 75.33 H new ATOM 0 HA ILE A 10 9.751 -10.550 -2.553 1.00 20.23 H new ATOM 0 HB ILE A 10 8.476 -8.655 -0.526 1.00 73.31 H new ATOM 0 HG12 ILE A 10 10.225 -11.148 -0.174 1.00 5.03 H new ATOM 0 HG13 ILE A 10 10.748 -9.495 0.086 1.00 5.03 H new ATOM 0 HG21 ILE A 10 7.156 -10.586 0.292 1.00 23.24 H new ATOM 0 HG22 ILE A 10 6.731 -10.144 -1.378 1.00 23.24 H new ATOM 0 HG23 ILE A 10 7.756 -11.565 -1.068 1.00 23.24 H new ATOM 0 HD11 ILE A 10 10.315 -10.621 2.210 1.00 74.55 H new ATOM 0 HD12 ILE A 10 9.171 -9.278 1.973 1.00 74.55 H new ATOM 0 HD13 ILE A 10 8.640 -10.957 1.710 1.00 74.55 H new ATOM 189 N ILE A 11 7.846 -10.160 -4.166 1.00 21.40 N ATOM 190 CA ILE A 11 6.762 -9.997 -5.163 1.00 74.14 C ATOM 191 C ILE A 11 5.423 -10.504 -4.577 1.00 62.42 C ATOM 192 O ILE A 11 5.224 -11.717 -4.453 1.00 74.01 O ATOM 193 CB ILE A 11 7.079 -10.814 -6.480 1.00 22.22 C ATOM 194 CG1 ILE A 11 8.518 -10.508 -6.997 1.00 62.32 C ATOM 195 CG2 ILE A 11 6.020 -10.536 -7.583 1.00 35.43 C ATOM 196 CD1 ILE A 11 8.947 -11.305 -8.223 1.00 21.44 C ATOM 0 H ILE A 11 8.291 -11.077 -4.199 1.00 21.40 H new ATOM 0 HA ILE A 11 6.688 -8.937 -5.406 1.00 74.14 H new ATOM 0 HB ILE A 11 7.030 -11.874 -6.232 1.00 22.22 H new ATOM 0 HG12 ILE A 11 8.585 -9.446 -7.232 1.00 62.32 H new ATOM 0 HG13 ILE A 11 9.226 -10.702 -6.191 1.00 62.32 H new ATOM 0 HG21 ILE A 11 6.265 -11.112 -8.476 1.00 35.43 H new ATOM 0 HG22 ILE A 11 5.034 -10.828 -7.222 1.00 35.43 H new ATOM 0 HG23 ILE A 11 6.018 -9.473 -7.826 1.00 35.43 H new ATOM 0 HD11 ILE A 11 9.961 -11.021 -8.505 1.00 21.44 H new ATOM 0 HD12 ILE A 11 8.919 -12.370 -7.993 1.00 21.44 H new ATOM 0 HD13 ILE A 11 8.268 -11.095 -9.050 1.00 21.44 H new ATOM 208 N PHE A 12 4.515 -9.582 -4.232 1.00 75.53 N ATOM 209 CA PHE A 12 3.172 -9.928 -3.711 1.00 15.12 C ATOM 210 C PHE A 12 2.113 -9.770 -4.824 1.00 11.23 C ATOM 211 O PHE A 12 2.210 -8.861 -5.635 1.00 24.31 O ATOM 212 CB PHE A 12 2.810 -9.017 -2.506 1.00 1.32 C ATOM 213 CG PHE A 12 1.548 -9.460 -1.757 1.00 44.12 C ATOM 214 CD1 PHE A 12 1.604 -10.491 -0.825 1.00 64.33 C ATOM 215 CD2 PHE A 12 0.312 -8.877 -2.010 1.00 31.40 C ATOM 216 CE1 PHE A 12 0.472 -10.921 -0.164 1.00 0.12 C ATOM 217 CE2 PHE A 12 -0.813 -9.312 -1.355 1.00 34.14 C ATOM 218 CZ PHE A 12 -0.738 -10.331 -0.432 1.00 3.54 C ATOM 0 H PHE A 12 4.682 -8.578 -4.303 1.00 75.53 H new ATOM 0 HA PHE A 12 3.186 -10.966 -3.377 1.00 15.12 H new ATOM 0 HB2 PHE A 12 3.648 -9.000 -1.810 1.00 1.32 H new ATOM 0 HB3 PHE A 12 2.671 -7.996 -2.862 1.00 1.32 H new ATOM 0 HD1 PHE A 12 2.552 -10.964 -0.615 1.00 64.33 H new ATOM 0 HD2 PHE A 12 0.236 -8.074 -2.729 1.00 31.40 H new ATOM 0 HE1 PHE A 12 0.538 -11.719 0.561 1.00 0.12 H new ATOM 0 HE2 PHE A 12 -1.766 -8.850 -1.566 1.00 34.14 H new ATOM 0 HZ PHE A 12 -1.629 -10.665 0.080 1.00 3.54 H new ATOM 228 N THR A 13 1.116 -10.674 -4.867 1.00 4.43 N ATOM 229 CA THR A 13 -0.061 -10.548 -5.777 1.00 12.31 C ATOM 230 C THR A 13 -1.361 -11.028 -5.079 1.00 44.45 C ATOM 231 O THR A 13 -1.351 -12.021 -4.332 1.00 22.21 O ATOM 232 CB THR A 13 0.163 -11.302 -7.133 1.00 24.33 C ATOM 233 OG1 THR A 13 -1.020 -11.246 -7.941 1.00 3.34 O ATOM 234 CG2 THR A 13 0.584 -12.764 -6.933 1.00 1.22 C ATOM 0 H THR A 13 1.094 -11.509 -4.281 1.00 4.43 H new ATOM 0 HA THR A 13 -0.174 -9.490 -6.012 1.00 12.31 H new ATOM 0 HB THR A 13 0.981 -10.792 -7.642 1.00 24.33 H new ATOM 0 HG1 THR A 13 -0.784 -11.407 -8.878 1.00 3.34 H new ATOM 0 HG21 THR A 13 0.725 -13.238 -7.904 1.00 1.22 H new ATOM 0 HG22 THR A 13 1.518 -12.800 -6.372 1.00 1.22 H new ATOM 0 HG23 THR A 13 -0.192 -13.294 -6.380 1.00 1.22 H new ATOM 242 N ARG A 14 -2.477 -10.322 -5.345 1.00 55.32 N ATOM 243 CA ARG A 14 -3.767 -10.507 -4.632 1.00 73.34 C ATOM 244 C ARG A 14 -4.959 -10.152 -5.556 1.00 42.13 C ATOM 245 O ARG A 14 -4.970 -9.085 -6.181 1.00 62.53 O ATOM 246 CB ARG A 14 -3.768 -9.613 -3.360 1.00 32.05 C ATOM 247 CG ARG A 14 -5.068 -9.592 -2.520 1.00 2.03 C ATOM 248 CD ARG A 14 -5.455 -10.950 -1.895 1.00 22.14 C ATOM 249 NE ARG A 14 -6.544 -10.810 -0.895 1.00 41.31 N ATOM 250 CZ ARG A 14 -7.806 -10.510 -1.161 1.00 13.51 C ATOM 251 NH1 ARG A 14 -8.225 -10.338 -2.369 1.00 3.02 N ATOM 252 NH2 ARG A 14 -8.661 -10.388 -0.199 1.00 25.03 N ATOM 0 H ARG A 14 -2.514 -9.601 -6.065 1.00 55.32 H new ATOM 0 HA ARG A 14 -3.878 -11.552 -4.342 1.00 73.34 H new ATOM 0 HB2 ARG A 14 -2.952 -9.940 -2.715 1.00 32.05 H new ATOM 0 HB3 ARG A 14 -3.544 -8.590 -3.664 1.00 32.05 H new ATOM 0 HG2 ARG A 14 -4.956 -8.859 -1.721 1.00 2.03 H new ATOM 0 HG3 ARG A 14 -5.888 -9.252 -3.153 1.00 2.03 H new ATOM 0 HD2 ARG A 14 -5.771 -11.635 -2.682 1.00 22.14 H new ATOM 0 HD3 ARG A 14 -4.580 -11.393 -1.419 1.00 22.14 H new ATOM 0 HE ARG A 14 -6.298 -10.958 0.084 1.00 41.31 H new ATOM 0 HH11 ARG A 14 -7.578 -10.432 -3.152 1.00 3.02 H new ATOM 0 HH12 ARG A 14 -9.204 -10.108 -2.541 1.00 3.02 H new ATOM 0 HH21 ARG A 14 -8.364 -10.523 0.767 1.00 25.03 H new ATOM 0 HH22 ARG A 14 -9.633 -10.157 -0.406 1.00 25.03 H new ATOM 266 N THR A 15 -5.964 -11.054 -5.626 1.00 35.42 N ATOM 267 CA THR A 15 -7.152 -10.865 -6.491 1.00 44.42 C ATOM 268 C THR A 15 -8.350 -10.302 -5.683 1.00 21.12 C ATOM 269 O THR A 15 -8.955 -11.022 -4.882 1.00 24.41 O ATOM 270 CB THR A 15 -7.576 -12.214 -7.176 1.00 71.05 C ATOM 271 OG1 THR A 15 -6.432 -12.816 -7.811 1.00 52.04 O ATOM 272 CG2 THR A 15 -8.677 -12.014 -8.234 1.00 2.14 C ATOM 0 H THR A 15 -5.976 -11.923 -5.092 1.00 35.42 H new ATOM 0 HA THR A 15 -6.875 -10.146 -7.262 1.00 44.42 H new ATOM 0 HB THR A 15 -7.972 -12.860 -6.392 1.00 71.05 H new ATOM 0 HG1 THR A 15 -6.699 -13.658 -8.236 1.00 52.04 H new ATOM 0 HG21 THR A 15 -8.934 -12.976 -8.678 1.00 2.14 H new ATOM 0 HG22 THR A 15 -9.561 -11.584 -7.763 1.00 2.14 H new ATOM 0 HG23 THR A 15 -8.316 -11.341 -9.012 1.00 2.14 H new ATOM 280 N PHE A 16 -8.687 -9.019 -5.916 1.00 34.24 N ATOM 281 CA PHE A 16 -9.843 -8.334 -5.283 1.00 73.24 C ATOM 282 C PHE A 16 -11.091 -8.401 -6.183 1.00 30.34 C ATOM 283 O PHE A 16 -10.992 -8.392 -7.417 1.00 2.44 O ATOM 284 CB PHE A 16 -9.513 -6.845 -4.993 1.00 12.51 C ATOM 285 CG PHE A 16 -8.390 -6.642 -3.980 1.00 2.11 C ATOM 286 CD1 PHE A 16 -8.629 -6.827 -2.617 1.00 74.35 C ATOM 287 CD2 PHE A 16 -7.107 -6.270 -4.386 1.00 71.11 C ATOM 288 CE1 PHE A 16 -7.621 -6.647 -1.695 1.00 21.21 C ATOM 289 CE2 PHE A 16 -6.102 -6.089 -3.460 1.00 63.23 C ATOM 290 CZ PHE A 16 -6.360 -6.276 -2.116 1.00 22.43 C ATOM 0 H PHE A 16 -8.163 -8.419 -6.553 1.00 34.24 H new ATOM 0 HA PHE A 16 -10.048 -8.851 -4.346 1.00 73.24 H new ATOM 0 HB2 PHE A 16 -9.238 -6.356 -5.928 1.00 12.51 H new ATOM 0 HB3 PHE A 16 -10.412 -6.349 -4.627 1.00 12.51 H new ATOM 0 HD1 PHE A 16 -9.615 -7.114 -2.282 1.00 74.35 H new ATOM 0 HD2 PHE A 16 -6.900 -6.123 -5.436 1.00 71.11 H new ATOM 0 HE1 PHE A 16 -7.818 -6.796 -0.644 1.00 21.21 H new ATOM 0 HE2 PHE A 16 -5.113 -5.801 -3.785 1.00 63.23 H new ATOM 0 HZ PHE A 16 -5.572 -6.131 -1.392 1.00 22.43 H new ATOM 300 N SER A 17 -12.270 -8.436 -5.543 1.00 61.43 N ATOM 301 CA SER A 17 -13.572 -8.465 -6.241 1.00 35.30 C ATOM 302 C SER A 17 -14.142 -7.031 -6.329 1.00 2.45 C ATOM 303 O SER A 17 -14.797 -6.569 -5.392 1.00 25.11 O ATOM 304 CB SER A 17 -14.541 -9.391 -5.459 1.00 54.24 C ATOM 305 OG SER A 17 -13.927 -10.631 -5.146 1.00 41.20 O ATOM 0 H SER A 17 -12.351 -8.445 -4.526 1.00 61.43 H new ATOM 0 HA SER A 17 -13.449 -8.851 -7.253 1.00 35.30 H new ATOM 0 HB2 SER A 17 -14.858 -8.897 -4.540 1.00 54.24 H new ATOM 0 HB3 SER A 17 -15.438 -9.566 -6.052 1.00 54.24 H new ATOM 0 HG SER A 17 -14.559 -11.194 -4.652 1.00 41.20 H new ATOM 311 N ALA A 18 -13.881 -6.338 -7.463 1.00 15.33 N ATOM 312 CA ALA A 18 -14.261 -4.909 -7.658 1.00 12.41 C ATOM 313 C ALA A 18 -13.849 -4.384 -9.064 1.00 14.50 C ATOM 314 O ALA A 18 -12.997 -4.992 -9.727 1.00 0.31 O ATOM 315 CB ALA A 18 -13.615 -4.015 -6.568 1.00 61.14 C ATOM 0 H ALA A 18 -13.404 -6.746 -8.267 1.00 15.33 H new ATOM 0 HA ALA A 18 -15.347 -4.858 -7.577 1.00 12.41 H new ATOM 0 HB1 ALA A 18 -13.906 -2.977 -6.730 1.00 61.14 H new ATOM 0 HB2 ALA A 18 -13.955 -4.338 -5.584 1.00 61.14 H new ATOM 0 HB3 ALA A 18 -12.530 -4.101 -6.623 1.00 61.14 H new ATOM 321 N PRO A 19 -14.472 -3.251 -9.551 1.00 45.32 N ATOM 322 CA PRO A 19 -13.966 -2.486 -10.734 1.00 0.24 C ATOM 323 C PRO A 19 -12.554 -1.865 -10.494 1.00 11.41 C ATOM 324 O PRO A 19 -12.278 -1.320 -9.419 1.00 22.44 O ATOM 325 CB PRO A 19 -15.044 -1.382 -10.934 1.00 14.54 C ATOM 326 CG PRO A 19 -15.699 -1.262 -9.594 1.00 61.35 C ATOM 327 CD PRO A 19 -15.747 -2.665 -9.049 1.00 11.34 C ATOM 0 HA PRO A 19 -13.831 -3.124 -11.607 1.00 0.24 H new ATOM 0 HB2 PRO A 19 -14.595 -0.438 -11.244 1.00 14.54 H new ATOM 0 HB3 PRO A 19 -15.762 -1.662 -11.705 1.00 14.54 H new ATOM 0 HG2 PRO A 19 -15.132 -0.604 -8.936 1.00 61.35 H new ATOM 0 HG3 PRO A 19 -16.700 -0.839 -9.682 1.00 61.35 H new ATOM 0 HD2 PRO A 19 -15.797 -2.676 -7.960 1.00 11.34 H new ATOM 0 HD3 PRO A 19 -16.616 -3.212 -9.414 1.00 11.34 H new ATOM 335 N ILE A 20 -11.697 -1.922 -11.538 1.00 42.44 N ATOM 336 CA ILE A 20 -10.267 -1.500 -11.492 1.00 24.02 C ATOM 337 C ILE A 20 -10.067 -0.022 -11.037 1.00 30.32 C ATOM 338 O ILE A 20 -9.048 0.310 -10.424 1.00 75.42 O ATOM 339 CB ILE A 20 -9.588 -1.749 -12.902 1.00 44.13 C ATOM 340 CG1 ILE A 20 -8.041 -1.498 -12.876 1.00 54.20 C ATOM 341 CG2 ILE A 20 -10.265 -0.898 -14.005 1.00 75.11 C ATOM 342 CD1 ILE A 20 -7.254 -2.383 -11.918 1.00 63.13 C ATOM 0 H ILE A 20 -11.979 -2.268 -12.455 1.00 42.44 H new ATOM 0 HA ILE A 20 -9.782 -2.113 -10.733 1.00 24.02 H new ATOM 0 HB ILE A 20 -9.736 -2.803 -13.138 1.00 44.13 H new ATOM 0 HG12 ILE A 20 -7.649 -1.642 -13.883 1.00 54.20 H new ATOM 0 HG13 ILE A 20 -7.863 -0.456 -12.611 1.00 54.20 H new ATOM 0 HG21 ILE A 20 -9.779 -1.089 -14.962 1.00 75.11 H new ATOM 0 HG22 ILE A 20 -11.320 -1.165 -14.074 1.00 75.11 H new ATOM 0 HG23 ILE A 20 -10.174 0.159 -13.756 1.00 75.11 H new ATOM 0 HD11 ILE A 20 -6.195 -2.130 -11.976 1.00 63.13 H new ATOM 0 HD12 ILE A 20 -7.610 -2.224 -10.900 1.00 63.13 H new ATOM 0 HD13 ILE A 20 -7.393 -3.429 -12.192 1.00 63.13 H new ATOM 354 N ASN A 21 -11.071 0.831 -11.308 1.00 12.24 N ATOM 355 CA ASN A 21 -11.038 2.273 -10.972 1.00 24.22 C ATOM 356 C ASN A 21 -10.924 2.508 -9.448 1.00 41.21 C ATOM 357 O ASN A 21 -10.006 3.189 -8.997 1.00 54.14 O ATOM 358 CB ASN A 21 -12.294 2.989 -11.534 1.00 11.15 C ATOM 359 CG ASN A 21 -12.340 3.030 -13.062 1.00 55.45 C ATOM 360 OD1 ASN A 21 -11.836 2.145 -13.746 1.00 43.13 O ATOM 361 ND2 ASN A 21 -12.945 4.064 -13.612 1.00 1.35 N ATOM 0 H ASN A 21 -11.934 0.542 -11.768 1.00 12.24 H new ATOM 0 HA ASN A 21 -10.148 2.696 -11.437 1.00 24.22 H new ATOM 0 HB2 ASN A 21 -13.186 2.483 -11.165 1.00 11.15 H new ATOM 0 HB3 ASN A 21 -12.324 4.009 -11.150 1.00 11.15 H new ATOM 0 HD21 ASN A 21 -13.002 4.141 -14.628 1.00 1.35 H new ATOM 0 HD22 ASN A 21 -13.357 4.787 -13.022 1.00 1.35 H new ATOM 368 N LYS A 22 -11.839 1.909 -8.661 1.00 24.13 N ATOM 369 CA LYS A 22 -11.854 2.084 -7.181 1.00 71.24 C ATOM 370 C LYS A 22 -10.706 1.310 -6.491 1.00 1.42 C ATOM 371 O LYS A 22 -10.237 1.714 -5.422 1.00 31.32 O ATOM 372 CB LYS A 22 -13.214 1.670 -6.560 1.00 33.55 C ATOM 373 CG LYS A 22 -13.671 0.223 -6.865 1.00 21.14 C ATOM 374 CD LYS A 22 -14.770 -0.270 -5.898 1.00 23.52 C ATOM 375 CE LYS A 22 -16.045 0.597 -5.918 1.00 24.32 C ATOM 376 NZ LYS A 22 -17.020 0.162 -4.883 1.00 25.12 N ATOM 0 H LYS A 22 -12.577 1.301 -9.016 1.00 24.13 H new ATOM 0 HA LYS A 22 -11.704 3.149 -7.004 1.00 71.24 H new ATOM 0 HB2 LYS A 22 -13.153 1.793 -5.479 1.00 33.55 H new ATOM 0 HB3 LYS A 22 -13.981 2.358 -6.916 1.00 33.55 H new ATOM 0 HG2 LYS A 22 -14.043 0.172 -7.888 1.00 21.14 H new ATOM 0 HG3 LYS A 22 -12.812 -0.446 -6.804 1.00 21.14 H new ATOM 0 HD2 LYS A 22 -15.034 -1.296 -6.155 1.00 23.52 H new ATOM 0 HD3 LYS A 22 -14.369 -0.288 -4.885 1.00 23.52 H new ATOM 0 HE2 LYS A 22 -15.778 1.641 -5.752 1.00 24.32 H new ATOM 0 HE3 LYS A 22 -16.509 0.540 -6.903 1.00 24.32 H new ATOM 0 HZ1 LYS A 22 -17.954 0.026 -5.321 1.00 25.12 H new ATOM 0 HZ2 LYS A 22 -16.702 -0.734 -4.461 1.00 25.12 H new ATOM 0 HZ3 LYS A 22 -17.087 0.889 -4.142 1.00 25.12 H new ATOM 390 N VAL A 23 -10.274 0.193 -7.113 1.00 35.34 N ATOM 391 CA VAL A 23 -9.107 -0.605 -6.646 1.00 65.20 C ATOM 392 C VAL A 23 -7.817 0.251 -6.693 1.00 2.22 C ATOM 393 O VAL A 23 -6.971 0.206 -5.793 1.00 44.32 O ATOM 394 CB VAL A 23 -8.949 -1.907 -7.521 1.00 31.02 C ATOM 395 CG1 VAL A 23 -7.691 -2.729 -7.134 1.00 34.40 C ATOM 396 CG2 VAL A 23 -10.222 -2.780 -7.421 1.00 20.45 C ATOM 0 H VAL A 23 -10.718 -0.185 -7.950 1.00 35.34 H new ATOM 0 HA VAL A 23 -9.279 -0.907 -5.613 1.00 65.20 H new ATOM 0 HB VAL A 23 -8.815 -1.588 -8.555 1.00 31.02 H new ATOM 0 HG11 VAL A 23 -7.627 -3.615 -7.765 1.00 34.40 H new ATOM 0 HG12 VAL A 23 -6.799 -2.118 -7.275 1.00 34.40 H new ATOM 0 HG13 VAL A 23 -7.761 -3.032 -6.089 1.00 34.40 H new ATOM 0 HG21 VAL A 23 -10.098 -3.675 -8.030 1.00 20.45 H new ATOM 0 HG22 VAL A 23 -10.385 -3.068 -6.382 1.00 20.45 H new ATOM 0 HG23 VAL A 23 -11.081 -2.213 -7.780 1.00 20.45 H new ATOM 406 N PHE A 24 -7.717 1.041 -7.764 1.00 60.22 N ATOM 407 CA PHE A 24 -6.680 2.068 -7.950 1.00 61.13 C ATOM 408 C PHE A 24 -6.826 3.220 -6.921 1.00 23.24 C ATOM 409 O PHE A 24 -5.873 3.540 -6.204 1.00 41.10 O ATOM 410 CB PHE A 24 -6.799 2.598 -9.394 1.00 13.03 C ATOM 411 CG PHE A 24 -5.955 3.824 -9.733 1.00 74.01 C ATOM 412 CD1 PHE A 24 -4.563 3.743 -9.783 1.00 22.11 C ATOM 413 CD2 PHE A 24 -6.561 5.047 -10.035 1.00 3.40 C ATOM 414 CE1 PHE A 24 -3.808 4.847 -10.127 1.00 35.34 C ATOM 415 CE2 PHE A 24 -5.807 6.141 -10.385 1.00 2.43 C ATOM 416 CZ PHE A 24 -4.432 6.044 -10.427 1.00 63.23 C ATOM 0 H PHE A 24 -8.369 0.986 -8.547 1.00 60.22 H new ATOM 0 HA PHE A 24 -5.695 1.632 -7.785 1.00 61.13 H new ATOM 0 HB2 PHE A 24 -6.526 1.794 -10.078 1.00 13.03 H new ATOM 0 HB3 PHE A 24 -7.845 2.838 -9.586 1.00 13.03 H new ATOM 0 HD1 PHE A 24 -4.072 2.809 -9.551 1.00 22.11 H new ATOM 0 HD2 PHE A 24 -7.637 5.133 -9.993 1.00 3.40 H new ATOM 0 HE1 PHE A 24 -2.731 4.776 -10.162 1.00 35.34 H new ATOM 0 HE2 PHE A 24 -6.291 7.076 -10.627 1.00 2.43 H new ATOM 0 HZ PHE A 24 -3.840 6.907 -10.695 1.00 63.23 H new ATOM 426 N ASP A 25 -8.036 3.818 -6.850 1.00 63.35 N ATOM 427 CA ASP A 25 -8.342 4.964 -5.947 1.00 11.51 C ATOM 428 C ASP A 25 -8.204 4.606 -4.445 1.00 54.34 C ATOM 429 O ASP A 25 -8.196 5.495 -3.595 1.00 52.31 O ATOM 430 CB ASP A 25 -9.767 5.505 -6.224 1.00 22.14 C ATOM 431 CG ASP A 25 -9.955 6.060 -7.648 1.00 3.10 C ATOM 432 OD1 ASP A 25 -9.055 6.761 -8.153 1.00 32.21 O ATOM 433 OD2 ASP A 25 -11.015 5.823 -8.256 1.00 73.20 O ATOM 0 H ASP A 25 -8.833 3.524 -7.415 1.00 63.35 H new ATOM 0 HA ASP A 25 -7.602 5.734 -6.165 1.00 11.51 H new ATOM 0 HB2 ASP A 25 -10.488 4.705 -6.058 1.00 22.14 H new ATOM 0 HB3 ASP A 25 -9.993 6.292 -5.505 1.00 22.14 H new ATOM 438 N ALA A 26 -8.136 3.303 -4.133 1.00 11.11 N ATOM 439 CA ALA A 26 -7.833 2.805 -2.774 1.00 31.10 C ATOM 440 C ALA A 26 -6.422 3.239 -2.311 1.00 64.31 C ATOM 441 O ALA A 26 -6.215 3.597 -1.153 1.00 54.34 O ATOM 442 CB ALA A 26 -7.968 1.281 -2.750 1.00 62.31 C ATOM 0 H ALA A 26 -8.289 2.560 -4.815 1.00 11.11 H new ATOM 0 HA ALA A 26 -8.548 3.242 -2.077 1.00 31.10 H new ATOM 0 HB1 ALA A 26 -7.745 0.912 -1.749 1.00 62.31 H new ATOM 0 HB2 ALA A 26 -8.986 1.002 -3.021 1.00 62.31 H new ATOM 0 HB3 ALA A 26 -7.269 0.843 -3.462 1.00 62.31 H new ATOM 448 N TYR A 27 -5.477 3.221 -3.254 1.00 61.11 N ATOM 449 CA TYR A 27 -4.074 3.620 -3.022 1.00 72.25 C ATOM 450 C TYR A 27 -3.888 5.121 -3.300 1.00 13.31 C ATOM 451 O TYR A 27 -3.083 5.797 -2.663 1.00 64.12 O ATOM 452 CB TYR A 27 -3.151 2.800 -3.960 1.00 75.02 C ATOM 453 CG TYR A 27 -3.187 1.285 -3.686 1.00 53.41 C ATOM 454 CD1 TYR A 27 -2.341 0.697 -2.743 1.00 43.13 C ATOM 455 CD2 TYR A 27 -4.091 0.448 -4.356 1.00 44.41 C ATOM 456 CE1 TYR A 27 -2.394 -0.661 -2.481 1.00 73.14 C ATOM 457 CE2 TYR A 27 -4.146 -0.907 -4.091 1.00 63.01 C ATOM 458 CZ TYR A 27 -3.296 -1.456 -3.156 1.00 20.32 C ATOM 459 OH TYR A 27 -3.350 -2.807 -2.891 1.00 53.53 O ATOM 0 H TYR A 27 -5.660 2.927 -4.213 1.00 61.11 H new ATOM 0 HA TYR A 27 -3.816 3.425 -1.981 1.00 72.25 H new ATOM 0 HB2 TYR A 27 -3.444 2.981 -4.994 1.00 75.02 H new ATOM 0 HB3 TYR A 27 -2.127 3.157 -3.852 1.00 75.02 H new ATOM 0 HD1 TYR A 27 -1.633 1.313 -2.209 1.00 43.13 H new ATOM 0 HD2 TYR A 27 -4.757 0.871 -5.093 1.00 44.41 H new ATOM 0 HE1 TYR A 27 -1.730 -1.097 -1.749 1.00 73.14 H new ATOM 0 HE2 TYR A 27 -4.853 -1.533 -4.615 1.00 63.01 H new ATOM 0 HH TYR A 27 -4.039 -3.223 -3.450 1.00 53.53 H new ATOM 469 N THR A 28 -4.675 5.615 -4.256 1.00 2.12 N ATOM 470 CA THR A 28 -4.454 6.916 -4.910 1.00 64.12 C ATOM 471 C THR A 28 -5.276 8.072 -4.268 1.00 63.21 C ATOM 472 O THR A 28 -4.919 9.252 -4.388 1.00 72.33 O ATOM 473 CB THR A 28 -4.798 6.761 -6.428 1.00 75.15 C ATOM 474 OG1 THR A 28 -4.092 5.625 -6.958 1.00 55.32 O ATOM 475 CG2 THR A 28 -4.415 7.981 -7.253 1.00 22.32 C ATOM 0 H THR A 28 -5.496 5.121 -4.606 1.00 2.12 H new ATOM 0 HA THR A 28 -3.409 7.195 -4.777 1.00 64.12 H new ATOM 0 HB THR A 28 -5.879 6.636 -6.495 1.00 75.15 H new ATOM 0 HG1 THR A 28 -4.598 4.808 -6.768 1.00 55.32 H new ATOM 0 HG21 THR A 28 -4.679 7.812 -8.297 1.00 22.32 H new ATOM 0 HG22 THR A 28 -4.950 8.855 -6.881 1.00 22.32 H new ATOM 0 HG23 THR A 28 -3.341 8.152 -7.173 1.00 22.32 H new ATOM 483 N LYS A 29 -6.387 7.733 -3.594 1.00 52.11 N ATOM 484 CA LYS A 29 -7.270 8.717 -2.895 1.00 51.23 C ATOM 485 C LYS A 29 -7.372 8.348 -1.397 1.00 12.43 C ATOM 486 O LYS A 29 -7.618 7.181 -1.060 1.00 63.33 O ATOM 487 CB LYS A 29 -8.703 8.768 -3.541 1.00 72.52 C ATOM 488 CG LYS A 29 -8.865 9.652 -4.812 1.00 35.25 C ATOM 489 CD LYS A 29 -7.992 9.207 -6.008 1.00 4.23 C ATOM 490 CE LYS A 29 -8.254 10.017 -7.290 1.00 44.21 C ATOM 491 NZ LYS A 29 -9.595 9.734 -7.857 1.00 10.22 N ATOM 0 H LYS A 29 -6.710 6.769 -3.511 1.00 52.11 H new ATOM 0 HA LYS A 29 -6.827 9.707 -2.999 1.00 51.23 H new ATOM 0 HB2 LYS A 29 -8.999 7.750 -3.795 1.00 72.52 H new ATOM 0 HB3 LYS A 29 -9.404 9.125 -2.786 1.00 72.52 H new ATOM 0 HG2 LYS A 29 -9.911 9.642 -5.117 1.00 35.25 H new ATOM 0 HG3 LYS A 29 -8.616 10.683 -4.558 1.00 35.25 H new ATOM 0 HD2 LYS A 29 -6.941 9.301 -5.736 1.00 4.23 H new ATOM 0 HD3 LYS A 29 -8.176 8.152 -6.210 1.00 4.23 H new ATOM 0 HE2 LYS A 29 -8.169 11.081 -7.071 1.00 44.21 H new ATOM 0 HE3 LYS A 29 -7.489 9.782 -8.031 1.00 44.21 H new ATOM 0 HZ1 LYS A 29 -9.707 10.246 -8.755 1.00 10.22 H new ATOM 0 HZ2 LYS A 29 -9.692 8.712 -8.027 1.00 10.22 H new ATOM 0 HZ3 LYS A 29 -10.328 10.045 -7.187 1.00 10.22 H new ATOM 505 N ARG A 30 -7.205 9.350 -0.496 1.00 0.32 N ATOM 506 CA ARG A 30 -7.222 9.107 0.972 1.00 44.13 C ATOM 507 C ARG A 30 -8.618 8.752 1.496 1.00 24.42 C ATOM 508 O ARG A 30 -8.731 8.071 2.512 1.00 72.22 O ATOM 509 CB ARG A 30 -6.665 10.301 1.784 1.00 42.52 C ATOM 510 CG ARG A 30 -7.503 11.599 1.729 1.00 63.50 C ATOM 511 CD ARG A 30 -6.967 12.689 2.673 1.00 22.44 C ATOM 512 NE ARG A 30 -7.848 13.869 2.711 1.00 63.31 N ATOM 513 CZ ARG A 30 -7.988 14.686 3.737 1.00 74.11 C ATOM 514 NH1 ARG A 30 -7.339 14.499 4.847 1.00 72.32 N ATOM 515 NH2 ARG A 30 -8.788 15.691 3.635 1.00 41.43 N ATOM 0 H ARG A 30 -7.058 10.325 -0.756 1.00 0.32 H new ATOM 0 HA ARG A 30 -6.565 8.250 1.118 1.00 44.13 H new ATOM 0 HB2 ARG A 30 -6.571 9.995 2.826 1.00 42.52 H new ATOM 0 HB3 ARG A 30 -5.660 10.524 1.425 1.00 42.52 H new ATOM 0 HG2 ARG A 30 -7.510 11.979 0.708 1.00 63.50 H new ATOM 0 HG3 ARG A 30 -8.536 11.372 1.992 1.00 63.50 H new ATOM 0 HD2 ARG A 30 -6.866 12.280 3.678 1.00 22.44 H new ATOM 0 HD3 ARG A 30 -5.971 12.991 2.350 1.00 22.44 H new ATOM 0 HE ARG A 30 -8.395 14.071 1.874 1.00 63.31 H new ATOM 0 HH11 ARG A 30 -6.704 13.706 4.939 1.00 72.32 H new ATOM 0 HH12 ARG A 30 -7.464 15.145 5.626 1.00 72.32 H new ATOM 0 HH21 ARG A 30 -9.303 15.847 2.769 1.00 41.43 H new ATOM 0 HH22 ARG A 30 -8.906 16.331 4.421 1.00 41.43 H new ATOM 529 N GLU A 31 -9.666 9.208 0.780 1.00 73.05 N ATOM 530 CA GLU A 31 -11.080 8.903 1.113 1.00 53.52 C ATOM 531 C GLU A 31 -11.341 7.380 1.238 1.00 45.32 C ATOM 532 O GLU A 31 -12.295 6.958 1.889 1.00 43.21 O ATOM 533 CB GLU A 31 -12.016 9.515 0.042 1.00 14.13 C ATOM 534 CG GLU A 31 -11.810 8.945 -1.379 1.00 64.13 C ATOM 535 CD GLU A 31 -12.770 9.542 -2.413 1.00 22.33 C ATOM 536 OE1 GLU A 31 -13.913 9.042 -2.538 1.00 54.11 O ATOM 537 OE2 GLU A 31 -12.402 10.534 -3.086 1.00 40.20 O ATOM 0 H GLU A 31 -9.560 9.798 -0.045 1.00 73.05 H new ATOM 0 HA GLU A 31 -11.289 9.348 2.086 1.00 53.52 H new ATOM 0 HB2 GLU A 31 -13.051 9.348 0.342 1.00 14.13 H new ATOM 0 HB3 GLU A 31 -11.862 10.594 0.015 1.00 14.13 H new ATOM 0 HG2 GLU A 31 -10.784 9.134 -1.694 1.00 64.13 H new ATOM 0 HG3 GLU A 31 -11.942 7.863 -1.352 1.00 64.13 H new ATOM 544 N LEU A 32 -10.484 6.578 0.577 1.00 5.54 N ATOM 545 CA LEU A 32 -10.506 5.107 0.661 1.00 1.52 C ATOM 546 C LEU A 32 -9.273 4.569 1.436 1.00 21.42 C ATOM 547 O LEU A 32 -9.378 3.573 2.152 1.00 21.24 O ATOM 548 CB LEU A 32 -10.540 4.500 -0.761 1.00 54.23 C ATOM 549 CG LEU A 32 -11.675 5.009 -1.703 1.00 75.41 C ATOM 550 CD1 LEU A 32 -11.534 4.385 -3.101 1.00 35.43 C ATOM 551 CD2 LEU A 32 -13.082 4.752 -1.112 1.00 64.10 C ATOM 0 H LEU A 32 -9.751 6.937 -0.035 1.00 5.54 H new ATOM 0 HA LEU A 32 -11.403 4.812 1.205 1.00 1.52 H new ATOM 0 HB2 LEU A 32 -9.582 4.699 -1.241 1.00 54.23 H new ATOM 0 HB3 LEU A 32 -10.631 3.418 -0.669 1.00 54.23 H new ATOM 0 HG LEU A 32 -11.567 6.090 -1.795 1.00 75.41 H new ATOM 0 HD11 LEU A 32 -12.334 4.751 -3.745 1.00 35.43 H new ATOM 0 HD12 LEU A 32 -10.570 4.661 -3.527 1.00 35.43 H new ATOM 0 HD13 LEU A 32 -11.599 3.300 -3.023 1.00 35.43 H new ATOM 0 HD21 LEU A 32 -13.840 5.123 -1.802 1.00 64.10 H new ATOM 0 HD22 LEU A 32 -13.223 3.682 -0.959 1.00 64.10 H new ATOM 0 HD23 LEU A 32 -13.176 5.270 -0.158 1.00 64.10 H new ATOM 563 N PHE A 33 -8.111 5.246 1.276 1.00 42.43 N ATOM 564 CA PHE A 33 -6.803 4.792 1.825 1.00 60.13 C ATOM 565 C PHE A 33 -6.844 4.565 3.356 1.00 3.43 C ATOM 566 O PHE A 33 -6.430 3.511 3.837 1.00 24.30 O ATOM 567 CB PHE A 33 -5.689 5.802 1.458 1.00 24.35 C ATOM 568 CG PHE A 33 -4.256 5.344 1.772 1.00 42.24 C ATOM 569 CD1 PHE A 33 -3.559 4.521 0.884 1.00 63.34 C ATOM 570 CD2 PHE A 33 -3.598 5.755 2.940 1.00 44.55 C ATOM 571 CE1 PHE A 33 -2.260 4.127 1.147 1.00 53.11 C ATOM 572 CE2 PHE A 33 -2.299 5.359 3.202 1.00 13.51 C ATOM 573 CZ PHE A 33 -1.630 4.545 2.305 1.00 61.32 C ATOM 0 H PHE A 33 -8.050 6.125 0.762 1.00 42.43 H new ATOM 0 HA PHE A 33 -6.583 3.827 1.369 1.00 60.13 H new ATOM 0 HB2 PHE A 33 -5.757 6.021 0.392 1.00 24.35 H new ATOM 0 HB3 PHE A 33 -5.879 6.735 1.988 1.00 24.35 H new ATOM 0 HD1 PHE A 33 -4.042 4.187 -0.022 1.00 63.34 H new ATOM 0 HD2 PHE A 33 -4.113 6.390 3.645 1.00 44.55 H new ATOM 0 HE1 PHE A 33 -1.737 3.492 0.447 1.00 53.11 H new ATOM 0 HE2 PHE A 33 -1.807 5.685 4.106 1.00 13.51 H new ATOM 0 HZ PHE A 33 -0.616 4.236 2.509 1.00 61.32 H new ATOM 583 N GLU A 34 -7.347 5.557 4.113 1.00 3.22 N ATOM 584 CA GLU A 34 -7.460 5.444 5.591 1.00 71.23 C ATOM 585 C GLU A 34 -8.513 4.396 6.055 1.00 45.25 C ATOM 586 O GLU A 34 -8.493 3.976 7.219 1.00 41.13 O ATOM 587 CB GLU A 34 -7.701 6.840 6.260 1.00 0.31 C ATOM 588 CG GLU A 34 -8.802 7.739 5.646 1.00 11.03 C ATOM 589 CD GLU A 34 -10.239 7.214 5.761 1.00 70.32 C ATOM 590 OE1 GLU A 34 -10.682 6.914 6.891 1.00 30.23 O ATOM 591 OE2 GLU A 34 -10.942 7.137 4.733 1.00 62.41 O ATOM 0 H GLU A 34 -7.682 6.443 3.735 1.00 3.22 H new ATOM 0 HA GLU A 34 -6.496 5.069 5.935 1.00 71.23 H new ATOM 0 HB2 GLU A 34 -7.947 6.674 7.309 1.00 0.31 H new ATOM 0 HB3 GLU A 34 -6.762 7.393 6.236 1.00 0.31 H new ATOM 0 HG2 GLU A 34 -8.754 8.717 6.125 1.00 11.03 H new ATOM 0 HG3 GLU A 34 -8.574 7.889 4.591 1.00 11.03 H new ATOM 598 N GLN A 35 -9.428 3.982 5.153 1.00 51.02 N ATOM 599 CA GLN A 35 -10.444 2.941 5.461 1.00 40.55 C ATOM 600 C GLN A 35 -9.836 1.513 5.512 1.00 70.04 C ATOM 601 O GLN A 35 -10.388 0.631 6.189 1.00 30.05 O ATOM 602 CB GLN A 35 -11.619 2.972 4.437 1.00 43.53 C ATOM 603 CG GLN A 35 -12.482 4.250 4.492 1.00 60.10 C ATOM 604 CD GLN A 35 -13.739 4.178 3.614 1.00 3.44 C ATOM 605 OE1 GLN A 35 -13.644 4.601 2.369 1.00 5.02 O flip ATOM 606 NE2 GLN A 35 -14.797 3.744 4.056 1.00 11.34 N flip ATOM 0 H GLN A 35 -9.488 4.350 4.204 1.00 51.02 H new ATOM 0 HA GLN A 35 -10.827 3.179 6.453 1.00 40.55 H new ATOM 0 HB2 GLN A 35 -11.211 2.867 3.432 1.00 43.53 H new ATOM 0 HB3 GLN A 35 -12.260 2.108 4.612 1.00 43.53 H new ATOM 0 HG2 GLN A 35 -12.780 4.434 5.524 1.00 60.10 H new ATOM 0 HG3 GLN A 35 -11.877 5.101 4.178 1.00 60.10 H new ATOM 0 HE21 GLN A 35 -14.852 3.421 5.022 1.00 11.34 H new ATOM 0 HE22 GLN A 35 -15.622 3.706 3.458 1.00 11.34 H new ATOM 615 N TRP A 36 -8.709 1.277 4.804 1.00 62.41 N ATOM 616 CA TRP A 36 -8.085 -0.077 4.725 1.00 61.42 C ATOM 617 C TRP A 36 -6.655 -0.118 5.329 1.00 11.13 C ATOM 618 O TRP A 36 -6.308 -1.065 6.049 1.00 22.44 O ATOM 619 CB TRP A 36 -8.077 -0.596 3.254 1.00 73.11 C ATOM 620 CG TRP A 36 -7.061 0.054 2.326 1.00 42.14 C ATOM 621 CD1 TRP A 36 -7.207 1.197 1.601 1.00 11.12 C ATOM 622 CD2 TRP A 36 -5.737 -0.427 2.037 1.00 3.35 C ATOM 623 NE1 TRP A 36 -6.061 1.461 0.898 1.00 15.22 N ATOM 624 CE2 TRP A 36 -5.148 0.480 1.149 1.00 11.12 C ATOM 625 CE3 TRP A 36 -5.000 -1.543 2.459 1.00 23.32 C ATOM 626 CZ2 TRP A 36 -3.854 0.316 0.671 1.00 52.44 C ATOM 627 CZ3 TRP A 36 -3.715 -1.706 1.989 1.00 72.34 C ATOM 628 CH2 TRP A 36 -3.153 -0.783 1.101 1.00 52.11 C ATOM 0 H TRP A 36 -8.211 1.996 4.280 1.00 62.41 H new ATOM 0 HA TRP A 36 -8.701 -0.741 5.332 1.00 61.42 H new ATOM 0 HB2 TRP A 36 -7.892 -1.670 3.269 1.00 73.11 H new ATOM 0 HB3 TRP A 36 -9.071 -0.450 2.832 1.00 73.11 H new ATOM 0 HD1 TRP A 36 -8.098 1.808 1.583 1.00 11.12 H new ATOM 0 HE1 TRP A 36 -5.914 2.263 0.285 1.00 15.22 H new ATOM 0 HE3 TRP A 36 -5.432 -2.262 3.140 1.00 23.32 H new ATOM 0 HZ2 TRP A 36 -3.416 1.027 -0.014 1.00 52.44 H new ATOM 0 HZ3 TRP A 36 -3.134 -2.558 2.311 1.00 72.34 H new ATOM 0 HH2 TRP A 36 -2.145 -0.938 0.746 1.00 52.11 H new ATOM 639 N PHE A 37 -5.825 0.907 5.017 1.00 52.41 N ATOM 640 CA PHE A 37 -4.390 0.932 5.385 1.00 51.44 C ATOM 641 C PHE A 37 -4.209 1.310 6.875 1.00 4.44 C ATOM 642 O PHE A 37 -3.985 2.475 7.222 1.00 65.24 O ATOM 643 CB PHE A 37 -3.594 1.890 4.450 1.00 45.40 C ATOM 644 CG PHE A 37 -2.064 1.779 4.588 1.00 3.23 C ATOM 645 CD1 PHE A 37 -1.347 0.844 3.839 1.00 14.14 C ATOM 646 CD2 PHE A 37 -1.348 2.599 5.467 1.00 40.23 C ATOM 647 CE1 PHE A 37 0.027 0.734 3.961 1.00 41.52 C ATOM 648 CE2 PHE A 37 0.025 2.485 5.588 1.00 75.43 C ATOM 649 CZ PHE A 37 0.712 1.554 4.834 1.00 65.01 C ATOM 0 H PHE A 37 -6.130 1.735 4.506 1.00 52.41 H new ATOM 0 HA PHE A 37 -3.985 -0.071 5.249 1.00 51.44 H new ATOM 0 HB2 PHE A 37 -3.870 1.683 3.416 1.00 45.40 H new ATOM 0 HB3 PHE A 37 -3.893 2.917 4.661 1.00 45.40 H new ATOM 0 HD1 PHE A 37 -1.873 0.196 3.153 1.00 14.14 H new ATOM 0 HD2 PHE A 37 -1.875 3.332 6.060 1.00 40.23 H new ATOM 0 HE1 PHE A 37 0.564 0.005 3.372 1.00 41.52 H new ATOM 0 HE2 PHE A 37 0.561 3.125 6.273 1.00 75.43 H new ATOM 0 HZ PHE A 37 1.784 1.468 4.928 1.00 65.01 H new ATOM 659 N HIS A 38 -4.374 0.302 7.734 1.00 35.33 N ATOM 660 CA HIS A 38 -4.182 0.407 9.188 1.00 31.33 C ATOM 661 C HIS A 38 -4.118 -1.016 9.800 1.00 25.14 C ATOM 662 O HIS A 38 -4.915 -1.883 9.411 1.00 44.43 O ATOM 663 CB HIS A 38 -5.307 1.261 9.861 1.00 35.12 C ATOM 664 CG HIS A 38 -6.724 0.845 9.536 1.00 5.45 C ATOM 665 ND1 HIS A 38 -7.488 0.051 10.359 1.00 13.42 N ATOM 666 CD2 HIS A 38 -7.515 1.147 8.481 1.00 35.32 C ATOM 667 CE1 HIS A 38 -8.678 -0.121 9.825 1.00 23.50 C ATOM 668 NE2 HIS A 38 -8.723 0.533 8.687 1.00 45.42 N ATOM 0 H HIS A 38 -4.651 -0.633 7.434 1.00 35.33 H new ATOM 0 HA HIS A 38 -3.241 0.923 9.379 1.00 31.33 H new ATOM 0 HB2 HIS A 38 -5.173 1.218 10.942 1.00 35.12 H new ATOM 0 HB3 HIS A 38 -5.175 2.302 9.564 1.00 35.12 H new ATOM 0 HD1 HIS A 38 -7.179 -0.344 11.247 1.00 13.42 H new ATOM 0 HD2 HIS A 38 -7.245 1.759 7.633 1.00 35.32 H new ATOM 0 HE1 HIS A 38 -9.483 -0.702 10.251 1.00 23.50 H new ATOM 0 HE2 HIS A 38 -9.526 0.577 8.059 1.00 45.42 H new ATOM 677 N PRO A 39 -3.155 -1.294 10.744 1.00 31.54 N ATOM 678 CA PRO A 39 -3.084 -2.600 11.462 1.00 4.32 C ATOM 679 C PRO A 39 -4.353 -2.888 12.311 1.00 31.23 C ATOM 680 O PRO A 39 -5.139 -1.976 12.605 1.00 15.55 O ATOM 681 CB PRO A 39 -1.807 -2.463 12.343 1.00 10.42 C ATOM 682 CG PRO A 39 -1.589 -0.987 12.472 1.00 22.43 C ATOM 683 CD PRO A 39 -2.050 -0.389 11.162 1.00 2.31 C ATOM 0 HA PRO A 39 -3.036 -3.446 10.776 1.00 4.32 H new ATOM 0 HB2 PRO A 39 -1.947 -2.929 13.318 1.00 10.42 H new ATOM 0 HB3 PRO A 39 -0.951 -2.950 11.877 1.00 10.42 H new ATOM 0 HG2 PRO A 39 -2.155 -0.579 13.309 1.00 22.43 H new ATOM 0 HG3 PRO A 39 -0.539 -0.761 12.657 1.00 22.43 H new ATOM 0 HD2 PRO A 39 -2.396 0.637 11.288 1.00 2.31 H new ATOM 0 HD3 PRO A 39 -1.247 -0.367 10.425 1.00 2.31 H new ATOM 691 N GLN A 40 -4.540 -4.163 12.693 1.00 71.41 N ATOM 692 CA GLN A 40 -5.779 -4.635 13.347 1.00 72.12 C ATOM 693 C GLN A 40 -5.962 -4.012 14.762 1.00 12.41 C ATOM 694 O GLN A 40 -5.007 -3.962 15.552 1.00 10.15 O ATOM 695 CB GLN A 40 -5.786 -6.192 13.391 1.00 53.42 C ATOM 696 CG GLN A 40 -5.561 -6.879 12.011 1.00 70.10 C ATOM 697 CD GLN A 40 -6.699 -6.697 10.981 1.00 52.21 C ATOM 698 OE1 GLN A 40 -7.446 -5.729 10.988 1.00 54.11 O ATOM 699 NE2 GLN A 40 -6.813 -7.620 10.053 1.00 74.23 N ATOM 0 H GLN A 40 -3.842 -4.895 12.559 1.00 71.41 H new ATOM 0 HA GLN A 40 -6.633 -4.301 12.757 1.00 72.12 H new ATOM 0 HB2 GLN A 40 -5.010 -6.527 14.080 1.00 53.42 H new ATOM 0 HB3 GLN A 40 -6.740 -6.527 13.798 1.00 53.42 H new ATOM 0 HG2 GLN A 40 -4.638 -6.492 11.579 1.00 70.10 H new ATOM 0 HG3 GLN A 40 -5.412 -7.946 12.176 1.00 70.10 H new ATOM 0 HE21 GLN A 40 -6.186 -8.424 10.054 1.00 74.23 H new ATOM 0 HE22 GLN A 40 -7.529 -7.532 9.331 1.00 74.23 H new ATOM 708 N ASP A 41 -7.196 -3.510 15.029 1.00 31.41 N ATOM 709 CA ASP A 41 -7.576 -2.778 16.278 1.00 73.03 C ATOM 710 C ASP A 41 -6.886 -1.366 16.372 1.00 11.32 C ATOM 711 O ASP A 41 -6.957 -0.680 17.397 1.00 13.22 O ATOM 712 CB ASP A 41 -7.313 -3.680 17.534 1.00 50.45 C ATOM 713 CG ASP A 41 -7.777 -3.085 18.875 1.00 14.45 C ATOM 714 OD1 ASP A 41 -8.998 -2.880 19.052 1.00 25.42 O ATOM 715 OD2 ASP A 41 -6.932 -2.832 19.764 1.00 71.45 O ATOM 0 H ASP A 41 -7.972 -3.601 14.374 1.00 31.41 H new ATOM 0 HA ASP A 41 -8.645 -2.570 16.246 1.00 73.03 H new ATOM 0 HB2 ASP A 41 -7.814 -4.637 17.386 1.00 50.45 H new ATOM 0 HB3 ASP A 41 -6.245 -3.886 17.596 1.00 50.45 H new ATOM 720 N ALA A 42 -6.266 -0.915 15.261 1.00 43.12 N ATOM 721 CA ALA A 42 -5.612 0.415 15.160 1.00 62.45 C ATOM 722 C ALA A 42 -6.195 1.234 13.978 1.00 53.11 C ATOM 723 O ALA A 42 -6.512 0.680 12.927 1.00 73.11 O ATOM 724 CB ALA A 42 -4.093 0.247 15.013 1.00 64.21 C ATOM 0 H ALA A 42 -6.203 -1.463 14.403 1.00 43.12 H new ATOM 0 HA ALA A 42 -5.813 0.969 16.077 1.00 62.45 H new ATOM 0 HB1 ALA A 42 -3.624 1.228 14.940 1.00 64.21 H new ATOM 0 HB2 ALA A 42 -3.699 -0.280 15.882 1.00 64.21 H new ATOM 0 HB3 ALA A 42 -3.876 -0.327 14.112 1.00 64.21 H new ATOM 730 N SER A 43 -6.328 2.558 14.176 1.00 4.32 N ATOM 731 CA SER A 43 -6.844 3.516 13.156 1.00 11.51 C ATOM 732 C SER A 43 -5.676 4.294 12.490 1.00 12.20 C ATOM 733 O SER A 43 -4.504 4.018 12.765 1.00 60.54 O ATOM 734 CB SER A 43 -7.849 4.491 13.829 1.00 30.01 C ATOM 735 OG SER A 43 -8.458 5.370 12.887 1.00 62.34 O ATOM 0 H SER A 43 -6.080 3.008 15.057 1.00 4.32 H new ATOM 0 HA SER A 43 -7.358 2.962 12.371 1.00 11.51 H new ATOM 0 HB2 SER A 43 -8.622 3.918 14.341 1.00 30.01 H new ATOM 0 HB3 SER A 43 -7.331 5.077 14.588 1.00 30.01 H new ATOM 0 HG SER A 43 -9.084 5.965 13.351 1.00 62.34 H new ATOM 741 N VAL A 44 -6.000 5.234 11.575 1.00 42.32 N ATOM 742 CA VAL A 44 -4.995 6.102 10.904 1.00 3.40 C ATOM 743 C VAL A 44 -5.580 7.507 10.561 1.00 24.45 C ATOM 744 O VAL A 44 -6.630 7.620 9.919 1.00 23.23 O ATOM 745 CB VAL A 44 -4.411 5.406 9.610 1.00 3.11 C ATOM 746 CG1 VAL A 44 -5.536 4.925 8.661 1.00 61.31 C ATOM 747 CG2 VAL A 44 -3.394 6.324 8.865 1.00 55.44 C ATOM 0 H VAL A 44 -6.959 5.415 11.279 1.00 42.32 H new ATOM 0 HA VAL A 44 -4.177 6.250 11.609 1.00 3.40 H new ATOM 0 HB VAL A 44 -3.866 4.523 9.944 1.00 3.11 H new ATOM 0 HG11 VAL A 44 -5.095 4.452 7.784 1.00 61.31 H new ATOM 0 HG12 VAL A 44 -6.168 4.206 9.181 1.00 61.31 H new ATOM 0 HG13 VAL A 44 -6.138 5.778 8.349 1.00 61.31 H new ATOM 0 HG21 VAL A 44 -3.017 5.808 7.982 1.00 55.44 H new ATOM 0 HG22 VAL A 44 -3.890 7.246 8.562 1.00 55.44 H new ATOM 0 HG23 VAL A 44 -2.563 6.561 9.529 1.00 55.44 H new ATOM 757 N THR A 45 -4.890 8.573 11.027 1.00 24.41 N ATOM 758 CA THR A 45 -5.211 9.982 10.688 1.00 63.53 C ATOM 759 C THR A 45 -4.319 10.469 9.522 1.00 70.14 C ATOM 760 O THR A 45 -3.106 10.630 9.696 1.00 23.21 O ATOM 761 CB THR A 45 -4.998 10.927 11.927 1.00 15.32 C ATOM 762 OG1 THR A 45 -5.827 10.490 13.016 1.00 71.11 O ATOM 763 CG2 THR A 45 -5.313 12.408 11.607 1.00 75.14 C ATOM 0 H THR A 45 -4.090 8.481 11.653 1.00 24.41 H new ATOM 0 HA THR A 45 -6.259 10.020 10.392 1.00 63.53 H new ATOM 0 HB THR A 45 -3.944 10.867 12.199 1.00 15.32 H new ATOM 0 HG1 THR A 45 -5.691 11.079 13.787 1.00 71.11 H new ATOM 0 HG21 THR A 45 -5.149 13.015 12.497 1.00 75.14 H new ATOM 0 HG22 THR A 45 -4.660 12.754 10.806 1.00 75.14 H new ATOM 0 HG23 THR A 45 -6.352 12.499 11.292 1.00 75.14 H new ATOM 771 N VAL A 46 -4.913 10.677 8.333 1.00 60.30 N ATOM 772 CA VAL A 46 -4.191 11.232 7.164 1.00 13.32 C ATOM 773 C VAL A 46 -4.280 12.781 7.163 1.00 51.40 C ATOM 774 O VAL A 46 -5.358 13.351 6.941 1.00 12.04 O ATOM 775 CB VAL A 46 -4.738 10.652 5.802 1.00 63.14 C ATOM 776 CG1 VAL A 46 -3.936 11.195 4.593 1.00 54.05 C ATOM 777 CG2 VAL A 46 -4.737 9.102 5.810 1.00 41.45 C ATOM 0 H VAL A 46 -5.895 10.469 8.152 1.00 60.30 H new ATOM 0 HA VAL A 46 -3.147 10.932 7.252 1.00 13.32 H new ATOM 0 HB VAL A 46 -5.770 10.988 5.697 1.00 63.14 H new ATOM 0 HG11 VAL A 46 -4.339 10.776 3.671 1.00 54.05 H new ATOM 0 HG12 VAL A 46 -4.015 12.282 4.562 1.00 54.05 H new ATOM 0 HG13 VAL A 46 -2.889 10.910 4.694 1.00 54.05 H new ATOM 0 HG21 VAL A 46 -5.119 8.733 4.858 1.00 41.45 H new ATOM 0 HG22 VAL A 46 -3.720 8.740 5.958 1.00 41.45 H new ATOM 0 HG23 VAL A 46 -5.371 8.742 6.620 1.00 41.45 H new ATOM 787 N TYR A 47 -3.132 13.439 7.414 1.00 63.24 N ATOM 788 CA TYR A 47 -3.026 14.917 7.480 1.00 53.34 C ATOM 789 C TYR A 47 -2.964 15.528 6.063 1.00 3.25 C ATOM 790 O TYR A 47 -3.666 16.497 5.748 1.00 55.02 O ATOM 791 CB TYR A 47 -1.758 15.326 8.272 1.00 60.10 C ATOM 792 CG TYR A 47 -1.692 14.774 9.707 1.00 33.14 C ATOM 793 CD1 TYR A 47 -1.157 13.510 9.964 1.00 33.25 C ATOM 794 CD2 TYR A 47 -2.154 15.516 10.800 1.00 32.32 C ATOM 795 CE1 TYR A 47 -1.080 13.011 11.245 1.00 24.42 C ATOM 796 CE2 TYR A 47 -2.079 15.014 12.089 1.00 34.02 C ATOM 797 CZ TYR A 47 -1.542 13.760 12.305 1.00 52.52 C ATOM 798 OH TYR A 47 -1.453 13.256 13.590 1.00 52.33 O ATOM 0 H TYR A 47 -2.246 12.962 7.578 1.00 63.24 H new ATOM 0 HA TYR A 47 -3.912 15.297 7.988 1.00 53.34 H new ATOM 0 HB2 TYR A 47 -0.879 14.985 7.725 1.00 60.10 H new ATOM 0 HB3 TYR A 47 -1.706 16.414 8.313 1.00 60.10 H new ATOM 0 HD1 TYR A 47 -0.796 12.911 9.141 1.00 33.25 H new ATOM 0 HD2 TYR A 47 -2.576 16.496 10.636 1.00 32.32 H new ATOM 0 HE1 TYR A 47 -0.657 12.032 11.419 1.00 24.42 H new ATOM 0 HE2 TYR A 47 -2.439 15.601 12.921 1.00 34.02 H new ATOM 0 HH TYR A 47 -1.821 13.907 14.223 1.00 52.33 H new ATOM 808 N ASP A 48 -2.097 14.940 5.221 1.00 22.32 N ATOM 809 CA ASP A 48 -1.875 15.371 3.827 1.00 61.34 C ATOM 810 C ASP A 48 -1.827 14.139 2.908 1.00 44.03 C ATOM 811 O ASP A 48 -1.380 13.063 3.326 1.00 43.44 O ATOM 812 CB ASP A 48 -0.557 16.183 3.704 1.00 71.41 C ATOM 813 CG ASP A 48 -0.588 17.494 4.509 1.00 44.23 C ATOM 814 OD1 ASP A 48 -1.200 18.477 4.032 1.00 40.52 O ATOM 815 OD2 ASP A 48 -0.039 17.540 5.633 1.00 64.44 O ATOM 0 H ASP A 48 -1.523 14.142 5.491 1.00 22.32 H new ATOM 0 HA ASP A 48 -2.700 16.016 3.524 1.00 61.34 H new ATOM 0 HB2 ASP A 48 0.276 15.570 4.048 1.00 71.41 H new ATOM 0 HB3 ASP A 48 -0.372 16.411 2.654 1.00 71.41 H new ATOM 820 N PHE A 49 -2.295 14.300 1.662 1.00 44.11 N ATOM 821 CA PHE A 49 -2.331 13.204 0.678 1.00 71.22 C ATOM 822 C PHE A 49 -2.378 13.768 -0.758 1.00 15.14 C ATOM 823 O PHE A 49 -3.235 14.595 -1.089 1.00 2.22 O ATOM 824 CB PHE A 49 -3.555 12.284 0.940 1.00 34.02 C ATOM 825 CG PHE A 49 -3.430 10.861 0.378 1.00 13.11 C ATOM 826 CD1 PHE A 49 -3.621 10.596 -0.976 1.00 41.01 C ATOM 827 CD2 PHE A 49 -3.159 9.783 1.224 1.00 51.30 C ATOM 828 CE1 PHE A 49 -3.526 9.310 -1.462 1.00 72.40 C ATOM 829 CE2 PHE A 49 -3.070 8.502 0.731 1.00 12.02 C ATOM 830 CZ PHE A 49 -3.258 8.264 -0.609 1.00 60.15 C ATOM 0 H PHE A 49 -2.657 15.185 1.308 1.00 44.11 H new ATOM 0 HA PHE A 49 -1.422 12.612 0.785 1.00 71.22 H new ATOM 0 HB2 PHE A 49 -3.719 12.220 2.016 1.00 34.02 H new ATOM 0 HB3 PHE A 49 -4.441 12.752 0.510 1.00 34.02 H new ATOM 0 HD1 PHE A 49 -3.846 11.407 -1.652 1.00 41.01 H new ATOM 0 HD2 PHE A 49 -3.017 9.958 2.280 1.00 51.30 H new ATOM 0 HE1 PHE A 49 -3.662 9.122 -2.517 1.00 72.40 H new ATOM 0 HE2 PHE A 49 -2.852 7.682 1.399 1.00 12.02 H new ATOM 0 HZ PHE A 49 -3.195 7.256 -0.993 1.00 60.15 H new ATOM 840 N ASN A 50 -1.445 13.296 -1.589 1.00 11.30 N ATOM 841 CA ASN A 50 -1.388 13.578 -3.031 1.00 61.11 C ATOM 842 C ASN A 50 -0.779 12.338 -3.714 1.00 52.44 C ATOM 843 O ASN A 50 0.290 11.863 -3.308 1.00 62.30 O ATOM 844 CB ASN A 50 -0.535 14.858 -3.301 1.00 63.14 C ATOM 845 CG ASN A 50 -0.527 15.332 -4.769 1.00 23.14 C ATOM 846 OD1 ASN A 50 -0.633 14.554 -5.711 1.00 1.14 O ATOM 847 ND2 ASN A 50 -0.379 16.620 -4.974 1.00 74.44 N ATOM 0 H ASN A 50 -0.687 12.691 -1.272 1.00 11.30 H new ATOM 0 HA ASN A 50 -2.382 13.773 -3.433 1.00 61.11 H new ATOM 0 HB2 ASN A 50 -0.911 15.667 -2.675 1.00 63.14 H new ATOM 0 HB3 ASN A 50 0.492 14.665 -2.990 1.00 63.14 H new ATOM 0 HD21 ASN A 50 -0.351 16.985 -5.926 1.00 74.44 H new ATOM 0 HD22 ASN A 50 -0.292 17.256 -4.181 1.00 74.44 H new ATOM 854 N ALA A 51 -1.467 11.802 -4.729 1.00 51.42 N ATOM 855 CA ALA A 51 -1.017 10.594 -5.445 1.00 65.31 C ATOM 856 C ALA A 51 -1.228 10.731 -6.963 1.00 1.11 C ATOM 857 O ALA A 51 -2.181 10.190 -7.528 1.00 22.34 O ATOM 858 CB ALA A 51 -1.727 9.355 -4.879 1.00 32.12 C ATOM 0 H ALA A 51 -2.345 12.187 -5.078 1.00 51.42 H new ATOM 0 HA ALA A 51 0.055 10.474 -5.288 1.00 65.31 H new ATOM 0 HB1 ALA A 51 -1.390 8.467 -5.413 1.00 32.12 H new ATOM 0 HB2 ALA A 51 -1.492 9.253 -3.820 1.00 32.12 H new ATOM 0 HB3 ALA A 51 -2.804 9.465 -5.002 1.00 32.12 H new ATOM 864 N THR A 52 -0.341 11.507 -7.613 1.00 55.00 N ATOM 865 CA THR A 52 -0.355 11.685 -9.083 1.00 54.42 C ATOM 866 C THR A 52 0.984 12.264 -9.610 1.00 3.43 C ATOM 867 O THR A 52 1.305 13.431 -9.368 1.00 3.14 O ATOM 868 CB THR A 52 -1.577 12.560 -9.572 1.00 51.11 C ATOM 869 OG1 THR A 52 -1.455 12.858 -10.975 1.00 30.55 O ATOM 870 CG2 THR A 52 -1.747 13.864 -8.764 1.00 43.13 C ATOM 0 H THR A 52 0.401 12.025 -7.142 1.00 55.00 H new ATOM 0 HA THR A 52 -0.478 10.689 -9.507 1.00 54.42 H new ATOM 0 HB THR A 52 -2.473 11.963 -9.402 1.00 51.11 H new ATOM 0 HG1 THR A 52 -2.220 13.399 -11.262 1.00 30.55 H new ATOM 0 HG21 THR A 52 -2.602 14.421 -9.147 1.00 43.13 H new ATOM 0 HG22 THR A 52 -1.912 13.622 -7.714 1.00 43.13 H new ATOM 0 HG23 THR A 52 -0.847 14.471 -8.859 1.00 43.13 H new ATOM 878 N LYS A 53 1.790 11.391 -10.271 1.00 63.33 N ATOM 879 CA LYS A 53 2.971 11.795 -11.092 1.00 13.14 C ATOM 880 C LYS A 53 4.072 12.570 -10.300 1.00 65.43 C ATOM 881 O LYS A 53 4.850 13.325 -10.888 1.00 2.31 O ATOM 882 CB LYS A 53 2.477 12.622 -12.324 1.00 33.43 C ATOM 883 CG LYS A 53 1.694 11.815 -13.390 1.00 40.34 C ATOM 884 CD LYS A 53 2.597 10.832 -14.168 1.00 54.23 C ATOM 885 CE LYS A 53 3.699 11.548 -14.982 1.00 2.20 C ATOM 886 NZ LYS A 53 4.644 10.592 -15.608 1.00 52.12 N ATOM 0 H LYS A 53 1.641 10.382 -10.251 1.00 63.33 H new ATOM 0 HA LYS A 53 3.459 10.877 -11.419 1.00 13.14 H new ATOM 0 HB2 LYS A 53 1.842 13.432 -11.966 1.00 33.43 H new ATOM 0 HB3 LYS A 53 3.341 13.082 -12.803 1.00 33.43 H new ATOM 0 HG2 LYS A 53 0.892 11.260 -12.904 1.00 40.34 H new ATOM 0 HG3 LYS A 53 1.225 12.505 -14.091 1.00 40.34 H new ATOM 0 HD2 LYS A 53 3.062 10.140 -13.466 1.00 54.23 H new ATOM 0 HD3 LYS A 53 1.982 10.237 -14.843 1.00 54.23 H new ATOM 0 HE2 LYS A 53 3.237 12.159 -15.757 1.00 2.20 H new ATOM 0 HE3 LYS A 53 4.249 12.225 -14.328 1.00 2.20 H new ATOM 0 HZ1 LYS A 53 5.568 11.052 -15.738 1.00 52.12 H new ATOM 0 HZ2 LYS A 53 4.755 9.760 -14.993 1.00 52.12 H new ATOM 0 HZ3 LYS A 53 4.273 10.292 -16.532 1.00 52.12 H new ATOM 900 N GLY A 54 4.159 12.332 -8.981 1.00 42.25 N ATOM 901 CA GLY A 54 5.118 13.042 -8.103 1.00 34.15 C ATOM 902 C GLY A 54 4.445 13.630 -6.858 1.00 20.44 C ATOM 903 O GLY A 54 4.769 14.746 -6.431 1.00 52.14 O ATOM 0 H GLY A 54 3.577 11.652 -8.493 1.00 42.25 H new ATOM 0 HA2 GLY A 54 5.905 12.353 -7.796 1.00 34.15 H new ATOM 0 HA3 GLY A 54 5.598 13.843 -8.666 1.00 34.15 H new ATOM 907 N GLY A 55 3.500 12.869 -6.275 1.00 62.22 N ATOM 908 CA GLY A 55 2.734 13.304 -5.093 1.00 42.50 C ATOM 909 C GLY A 55 3.369 12.929 -3.748 1.00 2.42 C ATOM 910 O GLY A 55 4.397 12.255 -3.697 1.00 55.40 O ATOM 0 H GLY A 55 3.247 11.939 -6.609 1.00 62.22 H new ATOM 0 HA2 GLY A 55 2.612 14.386 -5.133 1.00 42.50 H new ATOM 0 HA3 GLY A 55 1.736 12.869 -5.143 1.00 42.50 H new ATOM 914 N SER A 56 2.717 13.352 -2.651 1.00 22.30 N ATOM 915 CA SER A 56 3.226 13.179 -1.263 1.00 34.52 C ATOM 916 C SER A 56 2.055 12.932 -0.291 1.00 52.33 C ATOM 917 O SER A 56 1.059 13.660 -0.327 1.00 21.34 O ATOM 918 CB SER A 56 4.008 14.440 -0.815 1.00 4.04 C ATOM 919 OG SER A 56 5.153 14.666 -1.625 1.00 54.23 O ATOM 0 H SER A 56 1.816 13.828 -2.694 1.00 22.30 H new ATOM 0 HA SER A 56 3.894 12.318 -1.248 1.00 34.52 H new ATOM 0 HB2 SER A 56 3.353 15.310 -0.861 1.00 4.04 H new ATOM 0 HB3 SER A 56 4.315 14.327 0.225 1.00 4.04 H new ATOM 0 HG SER A 56 5.620 15.469 -1.314 1.00 54.23 H new ATOM 925 N ALA A 57 2.183 11.928 0.596 1.00 31.52 N ATOM 926 CA ALA A 57 1.104 11.547 1.543 1.00 72.33 C ATOM 927 C ALA A 57 1.636 11.402 2.989 1.00 13.25 C ATOM 928 O ALA A 57 2.293 10.416 3.305 1.00 64.13 O ATOM 929 CB ALA A 57 0.446 10.234 1.069 1.00 72.50 C ATOM 0 H ALA A 57 3.026 11.360 0.681 1.00 31.52 H new ATOM 0 HA ALA A 57 0.359 12.343 1.555 1.00 72.33 H new ATOM 0 HB1 ALA A 57 -0.346 9.953 1.763 1.00 72.50 H new ATOM 0 HB2 ALA A 57 0.023 10.377 0.075 1.00 72.50 H new ATOM 0 HB3 ALA A 57 1.195 9.443 1.034 1.00 72.50 H new ATOM 935 N PHE A 58 1.330 12.389 3.861 1.00 22.32 N ATOM 936 CA PHE A 58 1.718 12.363 5.298 1.00 62.11 C ATOM 937 C PHE A 58 0.532 11.879 6.169 1.00 75.44 C ATOM 938 O PHE A 58 -0.542 12.493 6.173 1.00 73.32 O ATOM 939 CB PHE A 58 2.199 13.771 5.766 1.00 25.11 C ATOM 940 CG PHE A 58 2.591 13.857 7.253 1.00 14.11 C ATOM 941 CD1 PHE A 58 3.608 13.055 7.777 1.00 52.14 C ATOM 942 CD2 PHE A 58 1.950 14.746 8.121 1.00 31.34 C ATOM 943 CE1 PHE A 58 3.969 13.136 9.110 1.00 12.33 C ATOM 944 CE2 PHE A 58 2.313 14.824 9.453 1.00 53.23 C ATOM 945 CZ PHE A 58 3.321 14.022 9.947 1.00 2.31 C ATOM 0 H PHE A 58 0.809 13.225 3.594 1.00 22.32 H new ATOM 0 HA PHE A 58 2.545 11.663 5.417 1.00 62.11 H new ATOM 0 HB2 PHE A 58 3.056 14.067 5.161 1.00 25.11 H new ATOM 0 HB3 PHE A 58 1.407 14.494 5.571 1.00 25.11 H new ATOM 0 HD1 PHE A 58 4.121 12.359 7.130 1.00 52.14 H new ATOM 0 HD2 PHE A 58 1.161 15.380 7.746 1.00 31.34 H new ATOM 0 HE1 PHE A 58 4.757 12.506 9.496 1.00 12.33 H new ATOM 0 HE2 PHE A 58 1.805 15.515 10.109 1.00 53.23 H new ATOM 0 HZ PHE A 58 3.603 14.087 10.988 1.00 2.31 H new ATOM 955 N TYR A 59 0.745 10.783 6.915 1.00 63.23 N ATOM 956 CA TYR A 59 -0.283 10.185 7.795 1.00 13.33 C ATOM 957 C TYR A 59 0.344 9.590 9.076 1.00 74.10 C ATOM 958 O TYR A 59 1.569 9.445 9.183 1.00 12.11 O ATOM 959 CB TYR A 59 -1.112 9.122 7.008 1.00 60.42 C ATOM 960 CG TYR A 59 -0.283 8.067 6.247 1.00 15.44 C ATOM 961 CD1 TYR A 59 0.144 8.293 4.929 1.00 12.00 C ATOM 962 CD2 TYR A 59 0.075 6.853 6.840 1.00 41.44 C ATOM 963 CE1 TYR A 59 0.888 7.353 4.242 1.00 43.12 C ATOM 964 CE2 TYR A 59 0.818 5.913 6.154 1.00 12.31 C ATOM 965 CZ TYR A 59 1.224 6.166 4.858 1.00 73.43 C ATOM 966 OH TYR A 59 1.962 5.225 4.174 1.00 1.12 O ATOM 0 H TYR A 59 1.634 10.283 6.928 1.00 63.23 H new ATOM 0 HA TYR A 59 -0.962 10.974 8.117 1.00 13.33 H new ATOM 0 HB2 TYR A 59 -1.769 8.607 7.709 1.00 60.42 H new ATOM 0 HB3 TYR A 59 -1.752 9.641 6.294 1.00 60.42 H new ATOM 0 HD1 TYR A 59 -0.115 9.221 4.442 1.00 12.00 H new ATOM 0 HD2 TYR A 59 -0.235 6.646 7.854 1.00 41.44 H new ATOM 0 HE1 TYR A 59 1.205 7.547 3.228 1.00 43.12 H new ATOM 0 HE2 TYR A 59 1.082 4.980 6.630 1.00 12.31 H new ATOM 0 HH TYR A 59 1.628 4.329 4.388 1.00 1.12 H new ATOM 976 N ALA A 60 -0.524 9.253 10.049 1.00 31.02 N ATOM 977 CA ALA A 60 -0.114 8.697 11.353 1.00 51.34 C ATOM 978 C ALA A 60 -1.010 7.515 11.762 1.00 64.00 C ATOM 979 O ALA A 60 -2.235 7.641 11.808 1.00 65.44 O ATOM 980 CB ALA A 60 -0.158 9.781 12.439 1.00 52.54 C ATOM 0 H ALA A 60 -1.534 9.359 9.952 1.00 31.02 H new ATOM 0 HA ALA A 60 0.909 8.335 11.250 1.00 51.34 H new ATOM 0 HB1 ALA A 60 0.147 9.352 13.393 1.00 52.54 H new ATOM 0 HB2 ALA A 60 0.520 10.592 12.172 1.00 52.54 H new ATOM 0 HB3 ALA A 60 -1.173 10.170 12.524 1.00 52.54 H new ATOM 986 N ILE A 61 -0.379 6.379 12.082 1.00 21.11 N ATOM 987 CA ILE A 61 -1.070 5.178 12.583 1.00 13.50 C ATOM 988 C ILE A 61 -1.423 5.353 14.083 1.00 70.00 C ATOM 989 O ILE A 61 -0.531 5.380 14.940 1.00 11.12 O ATOM 990 CB ILE A 61 -0.166 3.900 12.382 1.00 61.31 C ATOM 991 CG1 ILE A 61 0.166 3.681 10.861 1.00 35.44 C ATOM 992 CG2 ILE A 61 -0.805 2.631 13.009 1.00 21.54 C ATOM 993 CD1 ILE A 61 -1.039 3.422 9.958 1.00 31.22 C ATOM 0 H ILE A 61 0.631 6.263 12.001 1.00 21.11 H new ATOM 0 HA ILE A 61 -1.992 5.044 12.017 1.00 13.50 H new ATOM 0 HB ILE A 61 0.771 4.078 12.911 1.00 61.31 H new ATOM 0 HG12 ILE A 61 0.693 4.560 10.491 1.00 35.44 H new ATOM 0 HG13 ILE A 61 0.852 2.838 10.774 1.00 35.44 H new ATOM 0 HG21 ILE A 61 -0.149 1.776 12.847 1.00 21.54 H new ATOM 0 HG22 ILE A 61 -0.944 2.784 14.079 1.00 21.54 H new ATOM 0 HG23 ILE A 61 -1.771 2.441 12.541 1.00 21.54 H new ATOM 0 HD11 ILE A 61 -0.701 3.285 8.931 1.00 31.22 H new ATOM 0 HD12 ILE A 61 -1.558 2.524 10.293 1.00 31.22 H new ATOM 0 HD13 ILE A 61 -1.719 4.273 10.006 1.00 31.22 H new ATOM 1005 N GLN A 62 -2.726 5.508 14.371 1.00 2.31 N ATOM 1006 CA GLN A 62 -3.240 5.624 15.749 1.00 51.13 C ATOM 1007 C GLN A 62 -3.401 4.205 16.363 1.00 52.42 C ATOM 1008 O GLN A 62 -4.381 3.512 16.091 1.00 11.44 O ATOM 1009 CB GLN A 62 -4.614 6.368 15.754 1.00 14.45 C ATOM 1010 CG GLN A 62 -4.710 7.627 14.865 1.00 51.12 C ATOM 1011 CD GLN A 62 -3.722 8.735 15.226 1.00 11.23 C ATOM 1012 OE1 GLN A 62 -3.994 9.585 16.064 1.00 44.14 O ATOM 1013 NE2 GLN A 62 -2.574 8.749 14.586 1.00 12.31 N ATOM 0 H GLN A 62 -3.453 5.557 13.657 1.00 2.31 H new ATOM 0 HA GLN A 62 -2.532 6.199 16.347 1.00 51.13 H new ATOM 0 HB2 GLN A 62 -5.385 5.666 15.438 1.00 14.45 H new ATOM 0 HB3 GLN A 62 -4.845 6.654 16.780 1.00 14.45 H new ATOM 0 HG2 GLN A 62 -4.547 7.337 13.827 1.00 51.12 H new ATOM 0 HG3 GLN A 62 -5.723 8.025 14.929 1.00 51.12 H new ATOM 0 HE21 GLN A 62 -2.368 8.031 13.892 1.00 12.31 H new ATOM 0 HE22 GLN A 62 -1.889 9.478 14.784 1.00 12.31 H new ATOM 1022 N ALA A 63 -2.425 3.783 17.171 1.00 70.21 N ATOM 1023 CA ALA A 63 -2.435 2.454 17.841 1.00 75.52 C ATOM 1024 C ALA A 63 -2.670 2.619 19.372 1.00 32.01 C ATOM 1025 O ALA A 63 -2.270 3.644 19.936 1.00 41.33 O ATOM 1026 CB ALA A 63 -1.121 1.708 17.537 1.00 1.32 C ATOM 0 H ALA A 63 -1.600 4.343 17.387 1.00 70.21 H new ATOM 0 HA ALA A 63 -3.258 1.856 17.451 1.00 75.52 H new ATOM 0 HB1 ALA A 63 -1.132 0.736 18.029 1.00 1.32 H new ATOM 0 HB2 ALA A 63 -1.022 1.569 16.460 1.00 1.32 H new ATOM 0 HB3 ALA A 63 -0.278 2.292 17.906 1.00 1.32 H new ATOM 1032 N PRO A 64 -3.322 1.613 20.066 1.00 73.24 N ATOM 1033 CA PRO A 64 -3.745 1.732 21.503 1.00 43.41 C ATOM 1034 C PRO A 64 -2.656 2.225 22.515 1.00 22.21 C ATOM 1035 O PRO A 64 -2.997 2.832 23.538 1.00 73.15 O ATOM 1036 CB PRO A 64 -4.218 0.295 21.849 1.00 74.14 C ATOM 1037 CG PRO A 64 -4.676 -0.279 20.541 1.00 10.33 C ATOM 1038 CD PRO A 64 -3.745 0.297 19.495 1.00 62.34 C ATOM 0 HA PRO A 64 -4.502 2.510 21.601 1.00 43.41 H new ATOM 0 HB2 PRO A 64 -3.409 -0.296 22.279 1.00 74.14 H new ATOM 0 HB3 PRO A 64 -5.026 0.309 22.580 1.00 74.14 H new ATOM 0 HG2 PRO A 64 -4.627 -1.368 20.552 1.00 10.33 H new ATOM 0 HG3 PRO A 64 -5.712 -0.009 20.335 1.00 10.33 H new ATOM 0 HD2 PRO A 64 -2.889 -0.355 19.321 1.00 62.34 H new ATOM 0 HD3 PRO A 64 -4.250 0.422 18.537 1.00 62.34 H new ATOM 1046 N GLN A 65 -1.358 1.973 22.230 1.00 72.02 N ATOM 1047 CA GLN A 65 -0.237 2.396 23.128 1.00 40.03 C ATOM 1048 C GLN A 65 0.813 3.299 22.424 1.00 43.44 C ATOM 1049 O GLN A 65 1.742 3.784 23.081 1.00 51.22 O ATOM 1050 CB GLN A 65 0.465 1.149 23.738 1.00 43.11 C ATOM 1051 CG GLN A 65 1.157 0.221 22.715 1.00 73.44 C ATOM 1052 CD GLN A 65 1.957 -0.908 23.376 1.00 55.40 C ATOM 1053 OE1 GLN A 65 3.151 -0.777 23.633 1.00 33.43 O ATOM 1054 NE2 GLN A 65 1.305 -2.015 23.686 1.00 63.40 N ATOM 0 H GLN A 65 -1.052 1.481 21.390 1.00 72.02 H new ATOM 0 HA GLN A 65 -0.689 2.997 23.917 1.00 40.03 H new ATOM 0 HB2 GLN A 65 1.209 1.487 24.460 1.00 43.11 H new ATOM 0 HB3 GLN A 65 -0.274 0.569 24.290 1.00 43.11 H new ATOM 0 HG2 GLN A 65 0.403 -0.212 22.057 1.00 73.44 H new ATOM 0 HG3 GLN A 65 1.824 0.813 22.089 1.00 73.44 H new ATOM 0 HE21 GLN A 65 0.313 -2.102 23.463 1.00 63.40 H new ATOM 0 HE22 GLN A 65 1.793 -2.782 24.148 1.00 63.40 H new ATOM 1063 N MET A 66 0.666 3.534 21.105 1.00 32.54 N ATOM 1064 CA MET A 66 1.688 4.270 20.306 1.00 62.14 C ATOM 1065 C MET A 66 1.070 4.929 19.050 1.00 65.21 C ATOM 1066 O MET A 66 0.122 4.416 18.477 1.00 55.45 O ATOM 1067 CB MET A 66 2.843 3.304 19.901 1.00 73.21 C ATOM 1068 CG MET A 66 2.397 2.072 19.093 1.00 33.25 C ATOM 1069 SD MET A 66 3.756 0.946 18.699 1.00 15.13 S ATOM 1070 CE MET A 66 4.772 1.947 17.615 1.00 10.01 C ATOM 0 H MET A 66 -0.144 3.230 20.565 1.00 32.54 H new ATOM 0 HA MET A 66 2.088 5.069 20.930 1.00 62.14 H new ATOM 0 HB2 MET A 66 3.575 3.860 19.315 1.00 73.21 H new ATOM 0 HB3 MET A 66 3.349 2.965 20.805 1.00 73.21 H new ATOM 0 HG2 MET A 66 1.638 1.531 19.658 1.00 33.25 H new ATOM 0 HG3 MET A 66 1.929 2.404 18.166 1.00 33.25 H new ATOM 0 HE1 MET A 66 4.989 1.390 16.703 1.00 10.01 H new ATOM 0 HE2 MET A 66 4.240 2.864 17.362 1.00 10.01 H new ATOM 0 HE3 MET A 66 5.706 2.196 18.119 1.00 10.01 H new ATOM 1080 N ILE A 67 1.612 6.087 18.634 1.00 23.44 N ATOM 1081 CA ILE A 67 1.212 6.760 17.375 1.00 2.42 C ATOM 1082 C ILE A 67 2.462 6.954 16.483 1.00 50.24 C ATOM 1083 O ILE A 67 3.328 7.784 16.785 1.00 63.13 O ATOM 1084 CB ILE A 67 0.490 8.143 17.643 1.00 65.04 C ATOM 1085 CG1 ILE A 67 -0.817 7.935 18.491 1.00 64.13 C ATOM 1086 CG2 ILE A 67 0.172 8.877 16.310 1.00 4.35 C ATOM 1087 CD1 ILE A 67 -1.571 9.213 18.843 1.00 42.53 C ATOM 0 H ILE A 67 2.335 6.584 19.154 1.00 23.44 H new ATOM 0 HA ILE A 67 0.490 6.126 16.861 1.00 2.42 H new ATOM 0 HB ILE A 67 1.172 8.771 18.216 1.00 65.04 H new ATOM 0 HG12 ILE A 67 -1.488 7.276 17.940 1.00 64.13 H new ATOM 0 HG13 ILE A 67 -0.554 7.421 19.415 1.00 64.13 H new ATOM 0 HG21 ILE A 67 -0.324 9.824 16.525 1.00 4.35 H new ATOM 0 HG22 ILE A 67 1.099 9.067 15.769 1.00 4.35 H new ATOM 0 HG23 ILE A 67 -0.483 8.255 15.699 1.00 4.35 H new ATOM 0 HD11 ILE A 67 -2.456 8.964 19.428 1.00 42.53 H new ATOM 0 HD12 ILE A 67 -0.924 9.869 19.426 1.00 42.53 H new ATOM 0 HD13 ILE A 67 -1.873 9.721 17.927 1.00 42.53 H new ATOM 1099 N SER A 68 2.553 6.167 15.394 1.00 53.44 N ATOM 1100 CA SER A 68 3.703 6.212 14.450 1.00 12.53 C ATOM 1101 C SER A 68 3.377 7.077 13.225 1.00 51.20 C ATOM 1102 O SER A 68 2.220 7.211 12.853 1.00 23.22 O ATOM 1103 CB SER A 68 4.085 4.785 13.985 1.00 13.23 C ATOM 1104 OG SER A 68 4.428 3.952 15.078 1.00 71.31 O ATOM 0 H SER A 68 1.840 5.484 15.139 1.00 53.44 H new ATOM 0 HA SER A 68 4.546 6.655 14.980 1.00 12.53 H new ATOM 0 HB2 SER A 68 3.250 4.344 13.440 1.00 13.23 H new ATOM 0 HB3 SER A 68 4.925 4.841 13.292 1.00 13.23 H new ATOM 0 HG SER A 68 4.662 3.059 14.748 1.00 71.31 H new ATOM 1110 N TYR A 69 4.416 7.659 12.601 1.00 2.32 N ATOM 1111 CA TYR A 69 4.262 8.568 11.439 1.00 55.04 C ATOM 1112 C TYR A 69 4.987 7.982 10.208 1.00 51.31 C ATOM 1113 O TYR A 69 6.163 7.614 10.290 1.00 11.13 O ATOM 1114 CB TYR A 69 4.802 9.984 11.802 1.00 15.51 C ATOM 1115 CG TYR A 69 4.006 10.660 12.937 1.00 74.52 C ATOM 1116 CD1 TYR A 69 4.178 10.263 14.268 1.00 73.34 C ATOM 1117 CD2 TYR A 69 3.052 11.648 12.677 1.00 63.41 C ATOM 1118 CE1 TYR A 69 3.442 10.824 15.286 1.00 21.33 C ATOM 1119 CE2 TYR A 69 2.307 12.212 13.697 1.00 60.43 C ATOM 1120 CZ TYR A 69 2.502 11.794 14.997 1.00 44.54 C ATOM 1121 OH TYR A 69 1.745 12.348 16.012 1.00 1.22 O ATOM 0 H TYR A 69 5.386 7.517 12.883 1.00 2.32 H new ATOM 0 HA TYR A 69 3.206 8.664 11.187 1.00 55.04 H new ATOM 0 HB2 TYR A 69 5.848 9.903 12.098 1.00 15.51 H new ATOM 0 HB3 TYR A 69 4.769 10.617 10.916 1.00 15.51 H new ATOM 0 HD1 TYR A 69 4.905 9.499 14.501 1.00 73.34 H new ATOM 0 HD2 TYR A 69 2.894 11.977 11.661 1.00 63.41 H new ATOM 0 HE1 TYR A 69 3.598 10.507 16.307 1.00 21.33 H new ATOM 0 HE2 TYR A 69 1.576 12.976 13.477 1.00 60.43 H new ATOM 0 HH TYR A 69 1.133 13.015 15.637 1.00 1.22 H new ATOM 1131 N THR A 70 4.274 7.910 9.069 1.00 23.01 N ATOM 1132 CA THR A 70 4.782 7.293 7.818 1.00 24.35 C ATOM 1133 C THR A 70 4.330 8.136 6.603 1.00 63.51 C ATOM 1134 O THR A 70 3.209 8.661 6.587 1.00 72.43 O ATOM 1135 CB THR A 70 4.268 5.811 7.663 1.00 21.33 C ATOM 1136 OG1 THR A 70 4.571 5.056 8.851 1.00 71.32 O ATOM 1137 CG2 THR A 70 4.883 5.092 6.438 1.00 71.23 C ATOM 0 H THR A 70 3.326 8.277 8.984 1.00 23.01 H new ATOM 0 HA THR A 70 5.871 7.270 7.865 1.00 24.35 H new ATOM 0 HB THR A 70 3.190 5.867 7.511 1.00 21.33 H new ATOM 0 HG1 THR A 70 4.247 4.137 8.746 1.00 71.32 H new ATOM 0 HG21 THR A 70 4.494 4.075 6.380 1.00 71.23 H new ATOM 0 HG22 THR A 70 4.621 5.633 5.529 1.00 71.23 H new ATOM 0 HG23 THR A 70 5.968 5.060 6.541 1.00 71.23 H new ATOM 1145 N ILE A 71 5.219 8.288 5.600 1.00 72.35 N ATOM 1146 CA ILE A 71 4.950 9.092 4.388 1.00 2.21 C ATOM 1147 C ILE A 71 5.129 8.232 3.112 1.00 73.34 C ATOM 1148 O ILE A 71 6.183 7.623 2.917 1.00 53.13 O ATOM 1149 CB ILE A 71 5.908 10.346 4.297 1.00 54.24 C ATOM 1150 CG1 ILE A 71 5.851 11.185 5.613 1.00 44.12 C ATOM 1151 CG2 ILE A 71 5.564 11.227 3.066 1.00 61.01 C ATOM 1152 CD1 ILE A 71 6.796 12.376 5.675 1.00 50.32 C ATOM 0 H ILE A 71 6.144 7.857 5.607 1.00 72.35 H new ATOM 0 HA ILE A 71 3.920 9.440 4.459 1.00 2.21 H new ATOM 0 HB ILE A 71 6.927 9.979 4.171 1.00 54.24 H new ATOM 0 HG12 ILE A 71 4.831 11.546 5.749 1.00 44.12 H new ATOM 0 HG13 ILE A 71 6.071 10.526 6.453 1.00 44.12 H new ATOM 0 HG21 ILE A 71 6.240 12.082 3.030 1.00 61.01 H new ATOM 0 HG22 ILE A 71 5.674 10.639 2.155 1.00 61.01 H new ATOM 0 HG23 ILE A 71 4.536 11.580 3.147 1.00 61.01 H new ATOM 0 HD11 ILE A 71 6.675 12.887 6.630 1.00 50.32 H new ATOM 0 HD12 ILE A 71 7.825 12.030 5.577 1.00 50.32 H new ATOM 0 HD13 ILE A 71 6.566 13.065 4.862 1.00 50.32 H new ATOM 1164 N ALA A 72 4.095 8.194 2.253 1.00 62.55 N ATOM 1165 CA ALA A 72 4.183 7.570 0.918 1.00 1.14 C ATOM 1166 C ALA A 72 4.333 8.667 -0.167 1.00 43.01 C ATOM 1167 O ALA A 72 3.436 9.495 -0.349 1.00 11.04 O ATOM 1168 CB ALA A 72 2.933 6.705 0.669 1.00 11.55 C ATOM 0 H ALA A 72 3.179 8.592 2.462 1.00 62.55 H new ATOM 0 HA ALA A 72 5.061 6.925 0.870 1.00 1.14 H new ATOM 0 HB1 ALA A 72 2.999 6.245 -0.317 1.00 11.55 H new ATOM 0 HB2 ALA A 72 2.872 5.926 1.429 1.00 11.55 H new ATOM 0 HB3 ALA A 72 2.042 7.331 0.718 1.00 11.55 H new ATOM 1174 N GLU A 73 5.476 8.671 -0.874 1.00 15.51 N ATOM 1175 CA GLU A 73 5.737 9.615 -1.986 1.00 11.23 C ATOM 1176 C GLU A 73 5.399 8.934 -3.326 1.00 12.04 C ATOM 1177 O GLU A 73 6.152 8.072 -3.782 1.00 40.24 O ATOM 1178 CB GLU A 73 7.243 10.002 -1.967 1.00 63.45 C ATOM 1179 CG GLU A 73 7.730 10.706 -0.682 1.00 74.33 C ATOM 1180 CD GLU A 73 7.346 12.191 -0.600 1.00 42.42 C ATOM 1181 OE1 GLU A 73 7.904 12.997 -1.379 1.00 51.41 O ATOM 1182 OE2 GLU A 73 6.519 12.568 0.248 1.00 32.54 O ATOM 0 H GLU A 73 6.245 8.025 -0.696 1.00 15.51 H new ATOM 0 HA GLU A 73 5.121 10.507 -1.871 1.00 11.23 H new ATOM 0 HB2 GLU A 73 7.835 9.098 -2.112 1.00 63.45 H new ATOM 0 HB3 GLU A 73 7.444 10.654 -2.817 1.00 63.45 H new ATOM 0 HG2 GLU A 73 7.318 10.186 0.183 1.00 74.33 H new ATOM 0 HG3 GLU A 73 8.815 10.618 -0.620 1.00 74.33 H new ATOM 1189 N TYR A 74 4.311 9.357 -3.990 1.00 35.43 N ATOM 1190 CA TYR A 74 3.836 8.691 -5.224 1.00 10.32 C ATOM 1191 C TYR A 74 4.568 9.248 -6.458 1.00 24.24 C ATOM 1192 O TYR A 74 4.094 10.176 -7.108 1.00 60.31 O ATOM 1193 CB TYR A 74 2.297 8.821 -5.348 1.00 3.43 C ATOM 1194 CG TYR A 74 1.522 8.034 -4.272 1.00 14.51 C ATOM 1195 CD1 TYR A 74 1.339 8.551 -2.982 1.00 21.13 C ATOM 1196 CD2 TYR A 74 0.984 6.770 -4.544 1.00 54.14 C ATOM 1197 CE1 TYR A 74 0.652 7.842 -2.015 1.00 52.33 C ATOM 1198 CE2 TYR A 74 0.294 6.061 -3.577 1.00 11.03 C ATOM 1199 CZ TYR A 74 0.134 6.598 -2.315 1.00 30.34 C ATOM 1200 OH TYR A 74 -0.541 5.879 -1.349 1.00 31.33 O ATOM 0 H TYR A 74 3.743 10.153 -3.699 1.00 35.43 H new ATOM 0 HA TYR A 74 4.070 7.628 -5.167 1.00 10.32 H new ATOM 0 HB2 TYR A 74 2.023 9.874 -5.283 1.00 3.43 H new ATOM 0 HB3 TYR A 74 1.990 8.472 -6.334 1.00 3.43 H new ATOM 0 HD1 TYR A 74 1.743 9.523 -2.739 1.00 21.13 H new ATOM 0 HD2 TYR A 74 1.110 6.341 -5.527 1.00 54.14 H new ATOM 0 HE1 TYR A 74 0.521 8.260 -1.028 1.00 52.33 H new ATOM 0 HE2 TYR A 74 -0.118 5.090 -3.809 1.00 11.03 H new ATOM 0 HH TYR A 74 -1.470 5.745 -1.631 1.00 31.33 H new ATOM 1210 N LEU A 75 5.712 8.621 -6.779 1.00 12.43 N ATOM 1211 CA LEU A 75 6.675 9.119 -7.783 1.00 22.32 C ATOM 1212 C LEU A 75 6.111 9.044 -9.225 1.00 33.11 C ATOM 1213 O LEU A 75 6.297 9.968 -10.024 1.00 2.14 O ATOM 1214 CB LEU A 75 7.998 8.311 -7.655 1.00 35.23 C ATOM 1215 CG LEU A 75 9.202 8.784 -8.536 1.00 41.43 C ATOM 1216 CD1 LEU A 75 9.548 10.270 -8.279 1.00 51.22 C ATOM 1217 CD2 LEU A 75 10.436 7.881 -8.302 1.00 13.24 C ATOM 0 H LEU A 75 6.000 7.744 -6.345 1.00 12.43 H new ATOM 0 HA LEU A 75 6.867 10.174 -7.587 1.00 22.32 H new ATOM 0 HB2 LEU A 75 8.311 8.335 -6.611 1.00 35.23 H new ATOM 0 HB3 LEU A 75 7.786 7.270 -7.900 1.00 35.23 H new ATOM 0 HG LEU A 75 8.903 8.696 -9.580 1.00 41.43 H new ATOM 0 HD11 LEU A 75 10.389 10.562 -8.908 1.00 51.22 H new ATOM 0 HD12 LEU A 75 8.684 10.891 -8.516 1.00 51.22 H new ATOM 0 HD13 LEU A 75 9.815 10.405 -7.231 1.00 51.22 H new ATOM 0 HD21 LEU A 75 11.262 8.226 -8.923 1.00 13.24 H new ATOM 0 HD22 LEU A 75 10.727 7.927 -7.253 1.00 13.24 H new ATOM 0 HD23 LEU A 75 10.189 6.852 -8.565 1.00 13.24 H new ATOM 1229 N GLN A 76 5.403 7.946 -9.532 1.00 30.31 N ATOM 1230 CA GLN A 76 4.803 7.700 -10.866 1.00 74.33 C ATOM 1231 C GLN A 76 3.378 7.121 -10.729 1.00 52.35 C ATOM 1232 O GLN A 76 3.168 6.122 -10.045 1.00 64.40 O ATOM 1233 CB GLN A 76 5.720 6.737 -11.687 1.00 11.24 C ATOM 1234 CG GLN A 76 5.130 6.182 -13.013 1.00 60.12 C ATOM 1235 CD GLN A 76 4.894 7.217 -14.126 1.00 11.42 C ATOM 1236 OE1 GLN A 76 4.624 8.381 -13.882 1.00 14.20 O ATOM 1237 NE2 GLN A 76 4.962 6.784 -15.369 1.00 10.24 N ATOM 0 H GLN A 76 5.226 7.196 -8.863 1.00 30.31 H new ATOM 0 HA GLN A 76 4.724 8.648 -11.398 1.00 74.33 H new ATOM 0 HB2 GLN A 76 6.646 7.263 -11.919 1.00 11.24 H new ATOM 0 HB3 GLN A 76 5.984 5.892 -11.051 1.00 11.24 H new ATOM 0 HG2 GLN A 76 5.802 5.414 -13.394 1.00 60.12 H new ATOM 0 HG3 GLN A 76 4.181 5.693 -12.790 1.00 60.12 H new ATOM 0 HE21 GLN A 76 5.189 5.808 -15.557 1.00 10.24 H new ATOM 0 HE22 GLN A 76 4.788 7.425 -16.143 1.00 10.24 H new ATOM 1246 N VAL A 77 2.396 7.777 -11.366 1.00 44.21 N ATOM 1247 CA VAL A 77 0.997 7.284 -11.435 1.00 61.33 C ATOM 1248 C VAL A 77 0.535 7.259 -12.913 1.00 61.34 C ATOM 1249 O VAL A 77 0.498 8.300 -13.578 1.00 22.40 O ATOM 1250 CB VAL A 77 0.045 8.169 -10.538 1.00 22.22 C ATOM 1251 CG1 VAL A 77 -1.448 7.864 -10.791 1.00 41.24 C ATOM 1252 CG2 VAL A 77 0.388 7.993 -9.030 1.00 52.03 C ATOM 0 H VAL A 77 2.541 8.663 -11.849 1.00 44.21 H new ATOM 0 HA VAL A 77 0.949 6.269 -11.041 1.00 61.33 H new ATOM 0 HB VAL A 77 0.216 9.208 -10.821 1.00 22.22 H new ATOM 0 HG11 VAL A 77 -2.062 8.497 -10.151 1.00 41.24 H new ATOM 0 HG12 VAL A 77 -1.688 8.062 -11.836 1.00 41.24 H new ATOM 0 HG13 VAL A 77 -1.649 6.817 -10.565 1.00 41.24 H new ATOM 0 HG21 VAL A 77 -0.280 8.612 -8.430 1.00 52.03 H new ATOM 0 HG22 VAL A 77 0.265 6.947 -8.748 1.00 52.03 H new ATOM 0 HG23 VAL A 77 1.420 8.297 -8.854 1.00 52.03 H new ATOM 1262 N ASP A 78 0.191 6.055 -13.415 1.00 20.44 N ATOM 1263 CA ASP A 78 -0.086 5.823 -14.850 1.00 24.11 C ATOM 1264 C ASP A 78 -1.293 4.865 -15.029 1.00 73.00 C ATOM 1265 O ASP A 78 -1.157 3.652 -14.837 1.00 33.45 O ATOM 1266 CB ASP A 78 1.203 5.265 -15.525 1.00 24.11 C ATOM 1267 CG ASP A 78 1.081 5.106 -17.043 1.00 61.15 C ATOM 1268 OD1 ASP A 78 1.076 6.137 -17.753 1.00 32.23 O ATOM 1269 OD2 ASP A 78 1.000 3.957 -17.541 1.00 51.00 O ATOM 0 H ASP A 78 0.097 5.218 -12.840 1.00 20.44 H new ATOM 0 HA ASP A 78 -0.357 6.762 -15.333 1.00 24.11 H new ATOM 0 HB2 ASP A 78 2.036 5.932 -15.304 1.00 24.11 H new ATOM 0 HB3 ASP A 78 1.444 4.297 -15.085 1.00 24.11 H new ATOM 1274 N ALA A 79 -2.480 5.446 -15.361 1.00 30.54 N ATOM 1275 CA ALA A 79 -3.768 4.707 -15.548 1.00 40.32 C ATOM 1276 C ALA A 79 -4.292 4.061 -14.223 1.00 32.31 C ATOM 1277 O ALA A 79 -3.562 4.009 -13.226 1.00 12.00 O ATOM 1278 CB ALA A 79 -3.630 3.657 -16.687 1.00 32.33 C ATOM 0 H ALA A 79 -2.573 6.451 -15.508 1.00 30.54 H new ATOM 0 HA ALA A 79 -4.522 5.437 -15.842 1.00 40.32 H new ATOM 0 HB1 ALA A 79 -4.575 3.128 -16.811 1.00 32.33 H new ATOM 0 HB2 ALA A 79 -3.372 4.162 -17.618 1.00 32.33 H new ATOM 0 HB3 ALA A 79 -2.846 2.944 -16.432 1.00 32.33 H new ATOM 1284 N PRO A 80 -5.574 3.541 -14.171 1.00 4.22 N ATOM 1285 CA PRO A 80 -6.033 2.670 -13.042 1.00 44.54 C ATOM 1286 C PRO A 80 -5.262 1.315 -12.909 1.00 73.32 C ATOM 1287 O PRO A 80 -5.525 0.539 -11.987 1.00 30.43 O ATOM 1288 CB PRO A 80 -7.553 2.447 -13.331 1.00 14.52 C ATOM 1289 CG PRO A 80 -7.719 2.762 -14.789 1.00 61.13 C ATOM 1290 CD PRO A 80 -6.697 3.833 -15.107 1.00 43.24 C ATOM 0 HA PRO A 80 -5.838 3.150 -12.083 1.00 44.54 H new ATOM 0 HB2 PRO A 80 -7.851 1.422 -13.112 1.00 14.52 H new ATOM 0 HB3 PRO A 80 -8.172 3.097 -12.713 1.00 14.52 H new ATOM 0 HG2 PRO A 80 -7.556 1.874 -15.400 1.00 61.13 H new ATOM 0 HG3 PRO A 80 -8.729 3.113 -14.999 1.00 61.13 H new ATOM 0 HD2 PRO A 80 -6.375 3.782 -16.147 1.00 43.24 H new ATOM 0 HD3 PRO A 80 -7.102 4.832 -14.947 1.00 43.24 H new ATOM 1298 N TYR A 81 -4.301 1.063 -13.819 1.00 64.02 N ATOM 1299 CA TYR A 81 -3.587 -0.222 -13.940 1.00 72.24 C ATOM 1300 C TYR A 81 -2.138 -0.188 -13.368 1.00 2.03 C ATOM 1301 O TYR A 81 -1.530 -1.252 -13.189 1.00 4.23 O ATOM 1302 CB TYR A 81 -3.572 -0.623 -15.438 1.00 52.22 C ATOM 1303 CG TYR A 81 -4.976 -0.848 -16.027 1.00 22.15 C ATOM 1304 CD1 TYR A 81 -5.607 -2.093 -15.939 1.00 62.31 C ATOM 1305 CD2 TYR A 81 -5.678 0.191 -16.642 1.00 73.13 C ATOM 1306 CE1 TYR A 81 -6.878 -2.289 -16.440 1.00 54.10 C ATOM 1307 CE2 TYR A 81 -6.947 -0.009 -17.144 1.00 34.15 C ATOM 1308 CZ TYR A 81 -7.540 -1.247 -17.040 1.00 10.42 C ATOM 1309 OH TYR A 81 -8.806 -1.439 -17.537 1.00 44.31 O ATOM 0 H TYR A 81 -3.995 1.757 -14.501 1.00 64.02 H new ATOM 0 HA TYR A 81 -4.117 -0.960 -13.338 1.00 72.24 H new ATOM 0 HB2 TYR A 81 -3.067 0.156 -16.010 1.00 52.22 H new ATOM 0 HB3 TYR A 81 -2.987 -1.535 -15.556 1.00 52.22 H new ATOM 0 HD1 TYR A 81 -5.090 -2.917 -15.470 1.00 62.31 H new ATOM 0 HD2 TYR A 81 -5.220 1.166 -16.726 1.00 73.13 H new ATOM 0 HE1 TYR A 81 -7.349 -3.257 -16.360 1.00 54.10 H new ATOM 0 HE2 TYR A 81 -7.475 0.805 -17.618 1.00 34.15 H new ATOM 0 HH TYR A 81 -9.134 -0.603 -17.928 1.00 44.31 H new ATOM 1319 N TYR A 82 -1.575 1.014 -13.091 1.00 65.22 N ATOM 1320 CA TYR A 82 -0.182 1.129 -12.566 1.00 34.21 C ATOM 1321 C TYR A 82 -0.050 2.244 -11.496 1.00 64.41 C ATOM 1322 O TYR A 82 -0.400 3.409 -11.732 1.00 4.51 O ATOM 1323 CB TYR A 82 0.822 1.372 -13.729 1.00 60.13 C ATOM 1324 CG TYR A 82 2.303 1.395 -13.295 1.00 5.31 C ATOM 1325 CD1 TYR A 82 2.964 0.211 -12.955 1.00 4.23 C ATOM 1326 CD2 TYR A 82 3.035 2.589 -13.221 1.00 73.31 C ATOM 1327 CE1 TYR A 82 4.292 0.217 -12.568 1.00 35.03 C ATOM 1328 CE2 TYR A 82 4.362 2.593 -12.831 1.00 41.13 C ATOM 1329 CZ TYR A 82 4.984 1.410 -12.506 1.00 33.01 C ATOM 1330 OH TYR A 82 6.311 1.413 -12.134 1.00 42.24 O ATOM 0 H TYR A 82 -2.051 1.907 -13.218 1.00 65.22 H new ATOM 0 HA TYR A 82 0.058 0.183 -12.081 1.00 34.21 H new ATOM 0 HB2 TYR A 82 0.687 0.592 -14.479 1.00 60.13 H new ATOM 0 HB3 TYR A 82 0.581 2.321 -14.209 1.00 60.13 H new ATOM 0 HD1 TYR A 82 2.428 -0.726 -12.995 1.00 4.23 H new ATOM 0 HD2 TYR A 82 2.554 3.522 -13.473 1.00 73.31 H new ATOM 0 HE1 TYR A 82 4.786 -0.709 -12.315 1.00 35.03 H new ATOM 0 HE2 TYR A 82 4.909 3.523 -12.782 1.00 41.13 H new ATOM 0 HH TYR A 82 6.523 2.259 -11.687 1.00 42.24 H new ATOM 1340 N ILE A 83 0.477 1.851 -10.320 1.00 71.23 N ATOM 1341 CA ILE A 83 0.810 2.761 -9.201 1.00 63.55 C ATOM 1342 C ILE A 83 2.325 2.628 -8.885 1.00 11.31 C ATOM 1343 O ILE A 83 2.895 1.546 -9.031 1.00 5.03 O ATOM 1344 CB ILE A 83 -0.010 2.434 -7.874 1.00 64.33 C ATOM 1345 CG1 ILE A 83 -1.567 2.346 -8.114 1.00 32.40 C ATOM 1346 CG2 ILE A 83 0.314 3.463 -6.751 1.00 52.35 C ATOM 1347 CD1 ILE A 83 -2.072 1.018 -8.682 1.00 53.03 C ATOM 0 H ILE A 83 0.688 0.874 -10.115 1.00 71.23 H new ATOM 0 HA ILE A 83 0.547 3.772 -9.514 1.00 63.55 H new ATOM 0 HB ILE A 83 0.313 1.444 -7.552 1.00 64.33 H new ATOM 0 HG12 ILE A 83 -2.074 2.532 -7.167 1.00 32.40 H new ATOM 0 HG13 ILE A 83 -1.858 3.146 -8.794 1.00 32.40 H new ATOM 0 HG21 ILE A 83 -0.258 3.218 -5.856 1.00 52.35 H new ATOM 0 HG22 ILE A 83 1.379 3.428 -6.521 1.00 52.35 H new ATOM 0 HG23 ILE A 83 0.048 4.465 -7.088 1.00 52.35 H new ATOM 0 HD11 ILE A 83 -3.154 1.064 -8.808 1.00 53.03 H new ATOM 0 HD12 ILE A 83 -1.602 0.833 -9.648 1.00 53.03 H new ATOM 0 HD13 ILE A 83 -1.821 0.210 -7.995 1.00 53.03 H new ATOM 1359 N GLU A 84 2.971 3.730 -8.474 1.00 15.32 N ATOM 1360 CA GLU A 84 4.354 3.711 -7.936 1.00 12.33 C ATOM 1361 C GLU A 84 4.493 4.711 -6.770 1.00 14.33 C ATOM 1362 O GLU A 84 4.153 5.889 -6.924 1.00 30.44 O ATOM 1363 CB GLU A 84 5.381 4.044 -9.055 1.00 35.34 C ATOM 1364 CG GLU A 84 6.843 4.220 -8.568 1.00 72.11 C ATOM 1365 CD GLU A 84 7.872 4.388 -9.706 1.00 61.11 C ATOM 1366 OE1 GLU A 84 7.743 3.710 -10.747 1.00 65.42 O ATOM 1367 OE2 GLU A 84 8.851 5.142 -9.536 1.00 14.41 O ATOM 0 H GLU A 84 2.556 4.662 -8.502 1.00 15.32 H new ATOM 0 HA GLU A 84 4.562 2.708 -7.562 1.00 12.33 H new ATOM 0 HB2 GLU A 84 5.355 3.249 -9.800 1.00 35.34 H new ATOM 0 HB3 GLU A 84 5.067 4.960 -9.555 1.00 35.34 H new ATOM 0 HG2 GLU A 84 6.894 5.091 -7.915 1.00 72.11 H new ATOM 0 HG3 GLU A 84 7.121 3.354 -7.967 1.00 72.11 H new ATOM 1374 N TYR A 85 4.998 4.236 -5.607 1.00 24.41 N ATOM 1375 CA TYR A 85 5.342 5.113 -4.468 1.00 33.23 C ATOM 1376 C TYR A 85 6.606 4.635 -3.711 1.00 24.41 C ATOM 1377 O TYR A 85 7.070 3.500 -3.869 1.00 22.24 O ATOM 1378 CB TYR A 85 4.143 5.290 -3.489 1.00 22.45 C ATOM 1379 CG TYR A 85 3.657 4.022 -2.755 1.00 34.02 C ATOM 1380 CD1 TYR A 85 2.657 3.209 -3.298 1.00 64.02 C ATOM 1381 CD2 TYR A 85 4.177 3.659 -1.505 1.00 54.20 C ATOM 1382 CE1 TYR A 85 2.201 2.090 -2.626 1.00 23.35 C ATOM 1383 CE2 TYR A 85 3.721 2.541 -0.831 1.00 24.55 C ATOM 1384 CZ TYR A 85 2.733 1.760 -1.395 1.00 31.41 C ATOM 1385 OH TYR A 85 2.273 0.642 -0.728 1.00 1.54 O ATOM 0 H TYR A 85 5.176 3.246 -5.435 1.00 24.41 H new ATOM 0 HA TYR A 85 5.572 6.088 -4.897 1.00 33.23 H new ATOM 0 HB2 TYR A 85 4.421 6.032 -2.740 1.00 22.45 H new ATOM 0 HB3 TYR A 85 3.304 5.702 -4.049 1.00 22.45 H new ATOM 0 HD1 TYR A 85 2.233 3.460 -4.259 1.00 64.02 H new ATOM 0 HD2 TYR A 85 4.951 4.266 -1.058 1.00 54.20 H new ATOM 0 HE1 TYR A 85 1.429 1.474 -3.064 1.00 23.35 H new ATOM 0 HE2 TYR A 85 4.136 2.280 0.132 1.00 24.55 H new ATOM 0 HH TYR A 85 2.750 0.549 0.123 1.00 1.54 H new ATOM 1395 N LEU A 86 7.132 5.542 -2.878 1.00 35.02 N ATOM 1396 CA LEU A 86 8.319 5.329 -2.037 1.00 14.45 C ATOM 1397 C LEU A 86 7.901 5.402 -0.554 1.00 62.40 C ATOM 1398 O LEU A 86 7.304 6.396 -0.131 1.00 54.31 O ATOM 1399 CB LEU A 86 9.362 6.434 -2.344 1.00 1.24 C ATOM 1400 CG LEU A 86 9.877 6.516 -3.816 1.00 72.55 C ATOM 1401 CD1 LEU A 86 10.727 7.786 -4.037 1.00 44.11 C ATOM 1402 CD2 LEU A 86 10.670 5.249 -4.198 1.00 0.34 C ATOM 0 H LEU A 86 6.732 6.473 -2.767 1.00 35.02 H new ATOM 0 HA LEU A 86 8.757 4.352 -2.244 1.00 14.45 H new ATOM 0 HB2 LEU A 86 8.926 7.398 -2.081 1.00 1.24 H new ATOM 0 HB3 LEU A 86 10.221 6.284 -1.690 1.00 1.24 H new ATOM 0 HG LEU A 86 9.007 6.577 -4.470 1.00 72.55 H new ATOM 0 HD11 LEU A 86 11.072 7.817 -5.070 1.00 44.11 H new ATOM 0 HD12 LEU A 86 10.123 8.669 -3.829 1.00 44.11 H new ATOM 0 HD13 LEU A 86 11.587 7.769 -3.367 1.00 44.11 H new ATOM 0 HD21 LEU A 86 11.017 5.333 -5.228 1.00 0.34 H new ATOM 0 HD22 LEU A 86 11.528 5.143 -3.534 1.00 0.34 H new ATOM 0 HD23 LEU A 86 10.027 4.374 -4.102 1.00 0.34 H new ATOM 1414 N ASP A 87 8.224 4.368 0.229 1.00 54.12 N ATOM 1415 CA ASP A 87 7.866 4.316 1.654 1.00 65.22 C ATOM 1416 C ASP A 87 9.006 4.927 2.506 1.00 51.12 C ATOM 1417 O ASP A 87 10.073 4.327 2.670 1.00 31.41 O ATOM 1418 CB ASP A 87 7.588 2.845 2.056 1.00 45.14 C ATOM 1419 CG ASP A 87 7.184 2.680 3.531 1.00 41.23 C ATOM 1420 OD1 ASP A 87 6.019 2.975 3.873 1.00 4.34 O ATOM 1421 OD2 ASP A 87 8.022 2.250 4.352 1.00 74.45 O ATOM 0 H ASP A 87 8.736 3.550 -0.101 1.00 54.12 H new ATOM 0 HA ASP A 87 6.964 4.901 1.834 1.00 65.22 H new ATOM 0 HB2 ASP A 87 6.795 2.447 1.423 1.00 45.14 H new ATOM 0 HB3 ASP A 87 8.480 2.249 1.862 1.00 45.14 H new ATOM 1426 N TYR A 88 8.772 6.148 2.999 1.00 21.13 N ATOM 1427 CA TYR A 88 9.663 6.829 3.956 1.00 15.23 C ATOM 1428 C TYR A 88 9.068 6.713 5.372 1.00 15.54 C ATOM 1429 O TYR A 88 7.889 7.018 5.577 1.00 32.15 O ATOM 1430 CB TYR A 88 9.824 8.339 3.594 1.00 51.45 C ATOM 1431 CG TYR A 88 10.618 8.629 2.306 1.00 54.42 C ATOM 1432 CD1 TYR A 88 10.027 8.512 1.049 1.00 21.44 C ATOM 1433 CD2 TYR A 88 11.960 9.039 2.354 1.00 74.52 C ATOM 1434 CE1 TYR A 88 10.735 8.792 -0.106 1.00 63.11 C ATOM 1435 CE2 TYR A 88 12.667 9.323 1.197 1.00 12.53 C ATOM 1436 CZ TYR A 88 12.047 9.196 -0.029 1.00 60.10 C ATOM 1437 OH TYR A 88 12.742 9.478 -1.187 1.00 30.23 O ATOM 0 H TYR A 88 7.952 6.700 2.745 1.00 21.13 H new ATOM 0 HA TYR A 88 10.643 6.354 3.914 1.00 15.23 H new ATOM 0 HB2 TYR A 88 8.832 8.779 3.496 1.00 51.45 H new ATOM 0 HB3 TYR A 88 10.316 8.844 4.425 1.00 51.45 H new ATOM 0 HD1 TYR A 88 8.997 8.197 0.975 1.00 21.44 H new ATOM 0 HD2 TYR A 88 12.451 9.135 3.311 1.00 74.52 H new ATOM 0 HE1 TYR A 88 10.257 8.693 -1.069 1.00 63.11 H new ATOM 0 HE2 TYR A 88 13.697 9.642 1.254 1.00 12.53 H new ATOM 0 HH TYR A 88 13.656 9.751 -0.962 1.00 30.23 H new ATOM 1447 N PHE A 89 9.872 6.262 6.342 1.00 14.01 N ATOM 1448 CA PHE A 89 9.530 6.426 7.764 1.00 43.44 C ATOM 1449 C PHE A 89 9.697 7.911 8.139 1.00 64.54 C ATOM 1450 O PHE A 89 10.739 8.508 7.858 1.00 13.40 O ATOM 1451 CB PHE A 89 10.426 5.529 8.659 1.00 0.23 C ATOM 1452 CG PHE A 89 10.153 5.628 10.163 1.00 4.14 C ATOM 1453 CD1 PHE A 89 8.848 5.575 10.664 1.00 11.32 C ATOM 1454 CD2 PHE A 89 11.196 5.800 11.069 1.00 54.22 C ATOM 1455 CE1 PHE A 89 8.602 5.685 12.021 1.00 0.15 C ATOM 1456 CE2 PHE A 89 10.949 5.916 12.425 1.00 52.15 C ATOM 1457 CZ PHE A 89 9.651 5.862 12.900 1.00 62.12 C ATOM 0 H PHE A 89 10.757 5.784 6.173 1.00 14.01 H new ATOM 0 HA PHE A 89 8.498 6.117 7.928 1.00 43.44 H new ATOM 0 HB2 PHE A 89 10.297 4.492 8.350 1.00 0.23 H new ATOM 0 HB3 PHE A 89 11.469 5.789 8.477 1.00 0.23 H new ATOM 0 HD1 PHE A 89 8.021 5.446 9.982 1.00 11.32 H new ATOM 0 HD2 PHE A 89 12.213 5.843 10.708 1.00 54.22 H new ATOM 0 HE1 PHE A 89 7.589 5.632 12.392 1.00 0.15 H new ATOM 0 HE2 PHE A 89 11.770 6.049 13.114 1.00 52.15 H new ATOM 0 HZ PHE A 89 9.459 5.958 13.958 1.00 62.12 H new ATOM 1467 N ALA A 90 8.664 8.508 8.744 1.00 4.31 N ATOM 1468 CA ALA A 90 8.699 9.925 9.146 1.00 73.24 C ATOM 1469 C ALA A 90 9.194 10.066 10.597 1.00 1.10 C ATOM 1470 O ALA A 90 8.851 9.265 11.469 1.00 22.04 O ATOM 1471 CB ALA A 90 7.315 10.569 8.984 1.00 20.02 C ATOM 0 H ALA A 90 7.790 8.033 8.968 1.00 4.31 H new ATOM 0 HA ALA A 90 9.398 10.447 8.493 1.00 73.24 H new ATOM 0 HB1 ALA A 90 7.363 11.615 9.286 1.00 20.02 H new ATOM 0 HB2 ALA A 90 7.004 10.506 7.941 1.00 20.02 H new ATOM 0 HB3 ALA A 90 6.594 10.043 9.610 1.00 20.02 H new ATOM 1477 N THR A 91 9.983 11.120 10.839 1.00 52.11 N ATOM 1478 CA THR A 91 10.518 11.466 12.180 1.00 42.14 C ATOM 1479 C THR A 91 9.507 12.321 13.011 1.00 40.40 C ATOM 1480 O THR A 91 9.881 12.973 13.991 1.00 45.30 O ATOM 1481 CB THR A 91 11.878 12.227 12.006 1.00 33.20 C ATOM 1482 OG1 THR A 91 12.537 12.402 13.270 1.00 3.20 O ATOM 1483 CG2 THR A 91 11.699 13.595 11.307 1.00 74.30 C ATOM 0 H THR A 91 10.276 11.769 10.108 1.00 52.11 H new ATOM 0 HA THR A 91 10.679 10.543 12.737 1.00 42.14 H new ATOM 0 HB THR A 91 12.503 11.606 11.364 1.00 33.20 H new ATOM 0 HG1 THR A 91 11.884 12.686 13.943 1.00 3.20 H new ATOM 0 HG21 THR A 91 12.669 14.083 11.210 1.00 74.30 H new ATOM 0 HG22 THR A 91 11.268 13.444 10.317 1.00 74.30 H new ATOM 0 HG23 THR A 91 11.035 14.223 11.901 1.00 74.30 H new ATOM 1491 N SER A 92 8.224 12.316 12.561 1.00 21.22 N ATOM 1492 CA SER A 92 7.069 13.049 13.173 1.00 32.30 C ATOM 1493 C SER A 92 7.048 14.553 12.794 1.00 15.44 C ATOM 1494 O SER A 92 5.987 15.178 12.802 1.00 3.35 O ATOM 1495 CB SER A 92 6.979 12.862 14.715 1.00 5.40 C ATOM 1496 OG SER A 92 5.808 13.455 15.271 1.00 1.41 O ATOM 0 H SER A 92 7.950 11.785 11.734 1.00 21.22 H new ATOM 0 HA SER A 92 6.179 12.590 12.742 1.00 32.30 H new ATOM 0 HB2 SER A 92 6.989 11.798 14.950 1.00 5.40 H new ATOM 0 HB3 SER A 92 7.861 13.300 15.183 1.00 5.40 H new ATOM 0 HG SER A 92 5.096 12.784 15.326 1.00 1.41 H new ATOM 1502 N LYS A 93 8.226 15.125 12.454 1.00 33.31 N ATOM 1503 CA LYS A 93 8.358 16.532 11.984 1.00 51.33 C ATOM 1504 C LYS A 93 7.826 16.732 10.537 1.00 1.32 C ATOM 1505 O LYS A 93 7.759 17.863 10.051 1.00 70.11 O ATOM 1506 CB LYS A 93 9.843 16.971 12.082 1.00 72.01 C ATOM 1507 CG LYS A 93 10.395 16.970 13.530 1.00 0.33 C ATOM 1508 CD LYS A 93 11.875 17.414 13.615 1.00 42.21 C ATOM 1509 CE LYS A 93 12.371 17.550 15.072 1.00 34.32 C ATOM 1510 NZ LYS A 93 13.800 17.956 15.142 1.00 73.51 N ATOM 0 H LYS A 93 9.115 14.627 12.496 1.00 33.31 H new ATOM 0 HA LYS A 93 7.742 17.157 12.631 1.00 51.33 H new ATOM 0 HB2 LYS A 93 10.451 16.305 11.470 1.00 72.01 H new ATOM 0 HB3 LYS A 93 9.946 17.972 11.663 1.00 72.01 H new ATOM 0 HG2 LYS A 93 9.787 17.633 14.145 1.00 0.33 H new ATOM 0 HG3 LYS A 93 10.298 15.969 13.949 1.00 0.33 H new ATOM 0 HD2 LYS A 93 12.498 16.691 13.089 1.00 42.21 H new ATOM 0 HD3 LYS A 93 11.994 18.369 13.104 1.00 42.21 H new ATOM 0 HE2 LYS A 93 11.760 18.285 15.595 1.00 34.32 H new ATOM 0 HE3 LYS A 93 12.239 16.600 15.589 1.00 34.32 H new ATOM 0 HZ1 LYS A 93 14.090 18.035 16.138 1.00 73.51 H new ATOM 0 HZ2 LYS A 93 14.387 17.242 14.666 1.00 73.51 H new ATOM 0 HZ3 LYS A 93 13.923 18.875 14.672 1.00 73.51 H new ATOM 1524 N GLY A 94 7.474 15.623 9.855 1.00 64.05 N ATOM 1525 CA GLY A 94 6.839 15.679 8.526 1.00 62.01 C ATOM 1526 C GLY A 94 7.814 15.655 7.342 1.00 14.33 C ATOM 1527 O GLY A 94 7.405 15.885 6.200 1.00 1.01 O ATOM 0 H GLY A 94 7.620 14.676 10.206 1.00 64.05 H new ATOM 0 HA2 GLY A 94 6.154 14.836 8.431 1.00 62.01 H new ATOM 0 HA3 GLY A 94 6.238 16.586 8.465 1.00 62.01 H new ATOM 1531 N GLU A 95 9.106 15.371 7.607 1.00 22.20 N ATOM 1532 CA GLU A 95 10.145 15.281 6.551 1.00 55.45 C ATOM 1533 C GLU A 95 10.461 13.799 6.213 1.00 63.15 C ATOM 1534 O GLU A 95 9.890 13.236 5.280 1.00 20.43 O ATOM 1535 CB GLU A 95 11.447 16.016 6.990 1.00 14.14 C ATOM 1536 CG GLU A 95 11.329 17.523 7.269 1.00 21.23 C ATOM 1537 CD GLU A 95 12.707 18.165 7.519 1.00 15.55 C ATOM 1538 OE1 GLU A 95 13.526 18.199 6.569 1.00 41.12 O ATOM 1539 OE2 GLU A 95 12.995 18.581 8.660 1.00 71.31 O ATOM 0 H GLU A 95 9.460 15.199 8.548 1.00 22.20 H new ATOM 0 HA GLU A 95 9.754 15.768 5.657 1.00 55.45 H new ATOM 0 HB2 GLU A 95 11.824 15.532 7.891 1.00 14.14 H new ATOM 0 HB3 GLU A 95 12.198 15.872 6.213 1.00 14.14 H new ATOM 0 HG2 GLU A 95 10.847 18.013 6.423 1.00 21.23 H new ATOM 0 HG3 GLU A 95 10.690 17.684 8.137 1.00 21.23 H new ATOM 1546 N LYS A 96 11.371 13.188 7.003 1.00 62.30 N ATOM 1547 CA LYS A 96 11.851 11.795 6.823 1.00 44.21 C ATOM 1548 C LYS A 96 12.750 11.420 8.027 1.00 23.53 C ATOM 1549 O LYS A 96 13.211 12.312 8.749 1.00 52.35 O ATOM 1550 CB LYS A 96 12.640 11.605 5.469 1.00 1.54 C ATOM 1551 CG LYS A 96 14.120 12.109 5.435 1.00 14.54 C ATOM 1552 CD LYS A 96 14.302 13.647 5.595 1.00 55.11 C ATOM 1553 CE LYS A 96 13.745 14.462 4.413 1.00 63.05 C ATOM 1554 NZ LYS A 96 14.043 15.914 4.549 1.00 44.14 N ATOM 0 H LYS A 96 11.802 13.656 7.800 1.00 62.30 H new ATOM 0 HA LYS A 96 10.984 11.136 6.776 1.00 44.21 H new ATOM 0 HB2 LYS A 96 12.637 10.544 5.221 1.00 1.54 H new ATOM 0 HB3 LYS A 96 12.089 12.118 4.681 1.00 1.54 H new ATOM 0 HG2 LYS A 96 14.675 11.609 6.229 1.00 14.54 H new ATOM 0 HG3 LYS A 96 14.569 11.803 4.490 1.00 14.54 H new ATOM 0 HD2 LYS A 96 13.808 13.969 6.512 1.00 55.11 H new ATOM 0 HD3 LYS A 96 15.363 13.869 5.710 1.00 55.11 H new ATOM 0 HE2 LYS A 96 14.173 14.090 3.482 1.00 63.05 H new ATOM 0 HE3 LYS A 96 12.667 14.317 4.349 1.00 63.05 H new ATOM 0 HZ1 LYS A 96 13.171 16.462 4.408 1.00 44.14 H new ATOM 0 HZ2 LYS A 96 14.421 16.103 5.499 1.00 44.14 H new ATOM 0 HZ3 LYS A 96 14.746 16.192 3.835 1.00 44.14 H new ATOM 1568 N ASP A 97 13.000 10.120 8.249 1.00 44.52 N ATOM 1569 CA ASP A 97 13.874 9.655 9.353 1.00 51.40 C ATOM 1570 C ASP A 97 15.187 9.056 8.791 1.00 60.31 C ATOM 1571 O ASP A 97 15.170 8.333 7.786 1.00 55.45 O ATOM 1572 CB ASP A 97 13.131 8.622 10.233 1.00 74.02 C ATOM 1573 CG ASP A 97 13.812 8.416 11.599 1.00 2.11 C ATOM 1574 OD1 ASP A 97 13.521 9.185 12.544 1.00 44.44 O ATOM 1575 OD2 ASP A 97 14.665 7.515 11.725 1.00 22.21 O ATOM 0 H ASP A 97 12.612 9.367 7.681 1.00 44.52 H new ATOM 0 HA ASP A 97 14.131 10.512 9.976 1.00 51.40 H new ATOM 0 HB2 ASP A 97 12.104 8.953 10.388 1.00 74.02 H new ATOM 0 HB3 ASP A 97 13.083 7.669 9.707 1.00 74.02 H new ATOM 1580 N THR A 98 16.308 9.346 9.481 1.00 65.24 N ATOM 1581 CA THR A 98 17.680 8.934 9.063 1.00 15.30 C ATOM 1582 C THR A 98 17.865 7.386 9.026 1.00 1.11 C ATOM 1583 O THR A 98 18.752 6.878 8.325 1.00 11.13 O ATOM 1584 CB THR A 98 18.748 9.579 10.019 1.00 21.35 C ATOM 1585 OG1 THR A 98 18.512 10.998 10.116 1.00 54.00 O ATOM 1586 CG2 THR A 98 20.202 9.353 9.550 1.00 34.31 C ATOM 0 H THR A 98 16.296 9.877 10.352 1.00 65.24 H new ATOM 0 HA THR A 98 17.823 9.295 8.044 1.00 15.30 H new ATOM 0 HB THR A 98 18.635 9.089 10.986 1.00 21.35 H new ATOM 0 HG1 THR A 98 19.177 11.400 10.713 1.00 54.00 H new ATOM 0 HG21 THR A 98 20.889 9.823 10.254 1.00 34.31 H new ATOM 0 HG22 THR A 98 20.407 8.283 9.503 1.00 34.31 H new ATOM 0 HG23 THR A 98 20.338 9.792 8.562 1.00 34.31 H new ATOM 1594 N SER A 99 17.001 6.651 9.761 1.00 13.43 N ATOM 1595 CA SER A 99 17.063 5.167 9.851 1.00 33.31 C ATOM 1596 C SER A 99 16.906 4.469 8.477 1.00 13.15 C ATOM 1597 O SER A 99 17.596 3.483 8.197 1.00 1.32 O ATOM 1598 CB SER A 99 15.980 4.627 10.817 1.00 64.05 C ATOM 1599 OG SER A 99 16.041 3.211 10.944 1.00 22.43 O ATOM 0 H SER A 99 16.244 7.062 10.307 1.00 13.43 H new ATOM 0 HA SER A 99 18.057 4.933 10.233 1.00 33.31 H new ATOM 0 HB2 SER A 99 16.107 5.085 11.798 1.00 64.05 H new ATOM 0 HB3 SER A 99 14.994 4.917 10.455 1.00 64.05 H new ATOM 0 HG SER A 99 15.344 2.908 11.562 1.00 22.43 H new ATOM 1605 N MET A 100 16.014 4.993 7.608 1.00 75.12 N ATOM 1606 CA MET A 100 15.706 4.344 6.305 1.00 75.01 C ATOM 1607 C MET A 100 15.388 5.374 5.179 1.00 75.30 C ATOM 1608 O MET A 100 14.881 6.468 5.461 1.00 74.53 O ATOM 1609 CB MET A 100 14.523 3.346 6.477 1.00 74.43 C ATOM 1610 CG MET A 100 13.195 3.973 6.902 1.00 54.42 C ATOM 1611 SD MET A 100 11.827 2.792 6.858 1.00 21.11 S ATOM 1612 CE MET A 100 11.704 2.432 5.098 1.00 32.13 C ATOM 0 H MET A 100 15.497 5.855 7.779 1.00 75.12 H new ATOM 0 HA MET A 100 16.601 3.805 5.993 1.00 75.01 H new ATOM 0 HB2 MET A 100 14.372 2.821 5.534 1.00 74.43 H new ATOM 0 HB3 MET A 100 14.806 2.597 7.217 1.00 74.43 H new ATOM 0 HG2 MET A 100 13.292 4.374 7.911 1.00 54.42 H new ATOM 0 HG3 MET A 100 12.967 4.813 6.246 1.00 54.42 H new ATOM 0 HE1 MET A 100 10.713 2.037 4.876 1.00 32.13 H new ATOM 0 HE2 MET A 100 11.867 3.346 4.527 1.00 32.13 H new ATOM 0 HE3 MET A 100 12.458 1.694 4.824 1.00 32.13 H new ATOM 1622 N PRO A 101 15.692 5.034 3.873 1.00 15.10 N ATOM 1623 CA PRO A 101 15.304 5.862 2.699 1.00 43.24 C ATOM 1624 C PRO A 101 13.908 5.470 2.114 1.00 40.12 C ATOM 1625 O PRO A 101 13.076 4.887 2.818 1.00 43.25 O ATOM 1626 CB PRO A 101 16.453 5.539 1.716 1.00 30.11 C ATOM 1627 CG PRO A 101 16.745 4.082 1.956 1.00 4.31 C ATOM 1628 CD PRO A 101 16.469 3.832 3.435 1.00 60.22 C ATOM 0 HA PRO A 101 15.188 6.921 2.929 1.00 43.24 H new ATOM 0 HB2 PRO A 101 16.156 5.721 0.683 1.00 30.11 H new ATOM 0 HB3 PRO A 101 17.329 6.158 1.910 1.00 30.11 H new ATOM 0 HG2 PRO A 101 16.115 3.450 1.330 1.00 4.31 H new ATOM 0 HG3 PRO A 101 17.780 3.846 1.708 1.00 4.31 H new ATOM 0 HD2 PRO A 101 15.900 2.914 3.584 1.00 60.22 H new ATOM 0 HD3 PRO A 101 17.395 3.729 4.001 1.00 60.22 H new ATOM 1636 N GLY A 102 13.666 5.813 0.826 1.00 20.14 N ATOM 1637 CA GLY A 102 12.411 5.465 0.142 1.00 50.44 C ATOM 1638 C GLY A 102 12.362 4.015 -0.365 1.00 4.14 C ATOM 1639 O GLY A 102 13.029 3.671 -1.347 1.00 74.25 O ATOM 0 H GLY A 102 14.327 6.330 0.246 1.00 20.14 H new ATOM 0 HA2 GLY A 102 11.578 5.629 0.826 1.00 50.44 H new ATOM 0 HA3 GLY A 102 12.269 6.140 -0.702 1.00 50.44 H new ATOM 1643 N MET A 103 11.570 3.171 0.317 1.00 23.54 N ATOM 1644 CA MET A 103 11.317 1.766 -0.079 1.00 4.12 C ATOM 1645 C MET A 103 10.395 1.716 -1.342 1.00 54.52 C ATOM 1646 O MET A 103 9.215 2.068 -1.281 1.00 53.10 O ATOM 1647 CB MET A 103 10.698 1.020 1.140 1.00 13.51 C ATOM 1648 CG MET A 103 10.222 -0.412 0.887 1.00 31.02 C ATOM 1649 SD MET A 103 9.647 -1.228 2.393 1.00 11.02 S ATOM 1650 CE MET A 103 8.932 -2.734 1.733 1.00 34.11 C ATOM 0 H MET A 103 11.080 3.443 1.169 1.00 23.54 H new ATOM 0 HA MET A 103 12.246 1.268 -0.355 1.00 4.12 H new ATOM 0 HB2 MET A 103 11.438 0.998 1.940 1.00 13.51 H new ATOM 0 HB3 MET A 103 9.852 1.603 1.504 1.00 13.51 H new ATOM 0 HG2 MET A 103 9.415 -0.399 0.154 1.00 31.02 H new ATOM 0 HG3 MET A 103 11.037 -0.991 0.453 1.00 31.02 H new ATOM 0 HE1 MET A 103 9.024 -3.533 2.468 1.00 34.11 H new ATOM 0 HE2 MET A 103 7.879 -2.568 1.508 1.00 34.11 H new ATOM 0 HE3 MET A 103 9.458 -3.017 0.821 1.00 34.11 H new ATOM 1660 N HIS A 104 10.955 1.268 -2.484 1.00 35.11 N ATOM 1661 CA HIS A 104 10.318 1.417 -3.823 1.00 52.11 C ATOM 1662 C HIS A 104 9.267 0.309 -4.120 1.00 62.24 C ATOM 1663 O HIS A 104 9.622 -0.821 -4.474 1.00 41.33 O ATOM 1664 CB HIS A 104 11.428 1.436 -4.911 1.00 63.32 C ATOM 1665 CG HIS A 104 10.945 1.702 -6.318 1.00 11.53 C ATOM 1666 ND1 HIS A 104 11.228 0.869 -7.373 1.00 41.33 N ATOM 1667 CD2 HIS A 104 10.248 2.740 -6.848 1.00 75.11 C ATOM 1668 CE1 HIS A 104 10.741 1.377 -8.479 1.00 21.40 C ATOM 1669 NE2 HIS A 104 10.140 2.512 -8.194 1.00 64.04 N ATOM 0 H HIS A 104 11.858 0.794 -2.512 1.00 35.11 H new ATOM 0 HA HIS A 104 9.769 2.359 -3.832 1.00 52.11 H new ATOM 0 HB2 HIS A 104 12.162 2.197 -4.646 1.00 63.32 H new ATOM 0 HB3 HIS A 104 11.945 0.477 -4.897 1.00 63.32 H new ATOM 0 HD1 HIS A 104 11.739 -0.011 -7.306 1.00 41.33 H new ATOM 0 HD2 HIS A 104 9.852 3.588 -6.308 1.00 75.11 H new ATOM 0 HE1 HIS A 104 10.820 0.936 -9.462 1.00 21.40 H new ATOM 1678 N ILE A 105 7.972 0.645 -3.954 1.00 60.22 N ATOM 1679 CA ILE A 105 6.837 -0.257 -4.294 1.00 21.24 C ATOM 1680 C ILE A 105 6.167 0.208 -5.619 1.00 53.44 C ATOM 1681 O ILE A 105 5.751 1.362 -5.736 1.00 41.13 O ATOM 1682 CB ILE A 105 5.762 -0.343 -3.113 1.00 74.44 C ATOM 1683 CG1 ILE A 105 6.217 -1.294 -1.956 1.00 4.02 C ATOM 1684 CG2 ILE A 105 4.380 -0.827 -3.620 1.00 33.03 C ATOM 1685 CD1 ILE A 105 7.558 -1.006 -1.339 1.00 52.20 C ATOM 0 H ILE A 105 7.676 1.547 -3.581 1.00 60.22 H new ATOM 0 HA ILE A 105 7.239 -1.261 -4.430 1.00 21.24 H new ATOM 0 HB ILE A 105 5.679 0.674 -2.730 1.00 74.44 H new ATOM 0 HG12 ILE A 105 5.464 -1.258 -1.169 1.00 4.02 H new ATOM 0 HG13 ILE A 105 6.229 -2.315 -2.338 1.00 4.02 H new ATOM 0 HG21 ILE A 105 3.681 -0.871 -2.785 1.00 33.03 H new ATOM 0 HG22 ILE A 105 4.005 -0.133 -4.372 1.00 33.03 H new ATOM 0 HG23 ILE A 105 4.481 -1.819 -4.061 1.00 33.03 H new ATOM 0 HD11 ILE A 105 7.759 -1.732 -0.551 1.00 52.20 H new ATOM 0 HD12 ILE A 105 8.332 -1.075 -2.103 1.00 52.20 H new ATOM 0 HD13 ILE A 105 7.555 -0.002 -0.915 1.00 52.20 H new ATOM 1697 N THR A 106 6.091 -0.701 -6.617 1.00 41.15 N ATOM 1698 CA THR A 106 5.343 -0.467 -7.883 1.00 21.44 C ATOM 1699 C THR A 106 4.286 -1.566 -8.083 1.00 10.54 C ATOM 1700 O THR A 106 4.623 -2.732 -8.245 1.00 64.13 O ATOM 1701 CB THR A 106 6.281 -0.439 -9.140 1.00 3.50 C ATOM 1702 OG1 THR A 106 6.989 -1.681 -9.277 1.00 43.23 O ATOM 1703 CG2 THR A 106 7.289 0.700 -9.061 1.00 53.21 C ATOM 0 H THR A 106 6.542 -1.615 -6.573 1.00 41.15 H new ATOM 0 HA THR A 106 4.870 0.511 -7.790 1.00 21.44 H new ATOM 0 HB THR A 106 5.642 -0.284 -10.009 1.00 3.50 H new ATOM 0 HG1 THR A 106 7.567 -1.643 -10.068 1.00 43.23 H new ATOM 0 HG21 THR A 106 7.922 0.688 -9.948 1.00 53.21 H new ATOM 0 HG22 THR A 106 6.760 1.651 -9.005 1.00 53.21 H new ATOM 0 HG23 THR A 106 7.908 0.577 -8.172 1.00 53.21 H new ATOM 1711 N LEU A 107 3.005 -1.182 -8.102 1.00 42.12 N ATOM 1712 CA LEU A 107 1.891 -2.139 -8.190 1.00 10.33 C ATOM 1713 C LEU A 107 1.362 -2.189 -9.642 1.00 41.30 C ATOM 1714 O LEU A 107 0.997 -1.164 -10.223 1.00 41.02 O ATOM 1715 CB LEU A 107 0.766 -1.763 -7.190 1.00 5.23 C ATOM 1716 CG LEU A 107 1.216 -1.430 -5.715 1.00 13.01 C ATOM 1717 CD1 LEU A 107 1.564 0.063 -5.551 1.00 54.44 C ATOM 1718 CD2 LEU A 107 0.155 -1.870 -4.684 1.00 51.25 C ATOM 0 H LEU A 107 2.710 -0.207 -8.057 1.00 42.12 H new ATOM 0 HA LEU A 107 2.249 -3.132 -7.919 1.00 10.33 H new ATOM 0 HB2 LEU A 107 0.232 -0.900 -7.587 1.00 5.23 H new ATOM 0 HB3 LEU A 107 0.054 -2.588 -7.151 1.00 5.23 H new ATOM 0 HG LEU A 107 2.122 -2.003 -5.520 1.00 13.01 H new ATOM 0 HD11 LEU A 107 1.869 0.255 -4.522 1.00 54.44 H new ATOM 0 HD12 LEU A 107 2.379 0.323 -6.226 1.00 54.44 H new ATOM 0 HD13 LEU A 107 0.689 0.669 -5.788 1.00 54.44 H new ATOM 0 HD21 LEU A 107 0.500 -1.624 -3.680 1.00 51.25 H new ATOM 0 HD22 LEU A 107 -0.783 -1.351 -4.883 1.00 51.25 H new ATOM 0 HD23 LEU A 107 -0.003 -2.946 -4.761 1.00 51.25 H new ATOM 1730 N ASN A 108 1.322 -3.406 -10.202 1.00 5.44 N ATOM 1731 CA ASN A 108 1.127 -3.655 -11.648 1.00 55.15 C ATOM 1732 C ASN A 108 -0.183 -4.432 -11.884 1.00 42.33 C ATOM 1733 O ASN A 108 -0.568 -5.266 -11.064 1.00 3.24 O ATOM 1734 CB ASN A 108 2.329 -4.480 -12.188 1.00 42.34 C ATOM 1735 CG ASN A 108 3.689 -3.804 -11.955 1.00 25.43 C ATOM 1736 OD1 ASN A 108 4.331 -3.994 -10.924 1.00 23.24 O ATOM 1737 ND2 ASN A 108 4.143 -3.019 -12.908 1.00 71.30 N ATOM 0 H ASN A 108 1.425 -4.263 -9.659 1.00 5.44 H new ATOM 0 HA ASN A 108 1.067 -2.701 -12.172 1.00 55.15 H new ATOM 0 HB2 ASN A 108 2.332 -5.459 -11.709 1.00 42.34 H new ATOM 0 HB3 ASN A 108 2.194 -4.648 -13.256 1.00 42.34 H new ATOM 0 HD21 ASN A 108 5.044 -2.554 -12.800 1.00 71.30 H new ATOM 0 HD22 ASN A 108 3.594 -2.875 -13.755 1.00 71.30 H new ATOM 1744 N PHE A 109 -0.862 -4.150 -13.007 1.00 5.24 N ATOM 1745 CA PHE A 109 -2.102 -4.865 -13.390 1.00 64.51 C ATOM 1746 C PHE A 109 -1.823 -6.325 -13.824 1.00 44.34 C ATOM 1747 O PHE A 109 -0.803 -6.618 -14.457 1.00 54.42 O ATOM 1748 CB PHE A 109 -2.864 -4.106 -14.506 1.00 21.21 C ATOM 1749 CG PHE A 109 -2.170 -4.034 -15.880 1.00 72.33 C ATOM 1750 CD1 PHE A 109 -0.997 -3.295 -16.059 1.00 15.31 C ATOM 1751 CD2 PHE A 109 -2.706 -4.691 -16.993 1.00 1.22 C ATOM 1752 CE1 PHE A 109 -0.384 -3.221 -17.296 1.00 42.34 C ATOM 1753 CE2 PHE A 109 -2.089 -4.615 -18.229 1.00 23.32 C ATOM 1754 CZ PHE A 109 -0.928 -3.882 -18.379 1.00 10.43 C ATOM 0 H PHE A 109 -0.577 -3.431 -13.671 1.00 5.24 H new ATOM 0 HA PHE A 109 -2.732 -4.900 -12.501 1.00 64.51 H new ATOM 0 HB2 PHE A 109 -3.837 -4.579 -14.639 1.00 21.21 H new ATOM 0 HB3 PHE A 109 -3.049 -3.088 -14.162 1.00 21.21 H new ATOM 0 HD1 PHE A 109 -0.563 -2.774 -15.218 1.00 15.31 H new ATOM 0 HD2 PHE A 109 -3.614 -5.266 -16.886 1.00 1.22 H new ATOM 0 HE1 PHE A 109 0.522 -2.645 -17.415 1.00 42.34 H new ATOM 0 HE2 PHE A 109 -2.516 -5.129 -19.077 1.00 23.32 H new ATOM 0 HZ PHE A 109 -0.446 -3.826 -19.344 1.00 10.43 H new ATOM 1764 N GLU A 110 -2.756 -7.216 -13.468 1.00 30.51 N ATOM 1765 CA GLU A 110 -2.694 -8.659 -13.789 1.00 3.01 C ATOM 1766 C GLU A 110 -4.130 -9.269 -13.697 1.00 65.31 C ATOM 1767 O GLU A 110 -4.313 -10.462 -13.453 1.00 3.01 O ATOM 1768 CB GLU A 110 -1.690 -9.339 -12.801 1.00 11.21 C ATOM 1769 CG GLU A 110 -1.270 -10.781 -13.150 1.00 64.12 C ATOM 1770 CD GLU A 110 -0.263 -11.362 -12.142 1.00 3.13 C ATOM 1771 OE1 GLU A 110 -0.668 -11.669 -11.000 1.00 32.40 O ATOM 1772 OE2 GLU A 110 0.932 -11.504 -12.479 1.00 63.23 O ATOM 0 H GLU A 110 -3.590 -6.958 -12.941 1.00 30.51 H new ATOM 0 HA GLU A 110 -2.337 -8.827 -14.805 1.00 3.01 H new ATOM 0 HB2 GLU A 110 -0.792 -8.723 -12.746 1.00 11.21 H new ATOM 0 HB3 GLU A 110 -2.136 -9.342 -11.806 1.00 11.21 H new ATOM 0 HG2 GLU A 110 -2.155 -11.416 -13.181 1.00 64.12 H new ATOM 0 HG3 GLU A 110 -0.831 -10.797 -14.147 1.00 64.12 H new ATOM 1832 N GLY A 114 -12.395 -9.542 -14.644 1.00 50.31 N ATOM 1833 CA GLY A 114 -13.233 -8.558 -13.921 1.00 51.52 C ATOM 1834 C GLY A 114 -12.790 -8.422 -12.467 1.00 12.23 C ATOM 1835 O GLY A 114 -12.780 -7.324 -11.896 1.00 51.04 O ATOM 0 HA2 GLY A 114 -13.170 -7.589 -14.416 1.00 51.52 H new ATOM 0 HA3 GLY A 114 -14.277 -8.868 -13.959 1.00 51.52 H new ATOM 1839 N LYS A 115 -12.463 -9.574 -11.853 1.00 51.41 N ATOM 1840 CA LYS A 115 -11.734 -9.619 -10.577 1.00 72.14 C ATOM 1841 C LYS A 115 -10.290 -9.118 -10.794 1.00 3.41 C ATOM 1842 O LYS A 115 -9.485 -9.770 -11.479 1.00 53.42 O ATOM 1843 CB LYS A 115 -11.747 -11.057 -9.969 1.00 21.53 C ATOM 1844 CG LYS A 115 -12.975 -11.367 -9.083 1.00 43.53 C ATOM 1845 CD LYS A 115 -12.978 -12.810 -8.511 1.00 50.51 C ATOM 1846 CE LYS A 115 -14.022 -12.990 -7.391 1.00 21.22 C ATOM 1847 NZ LYS A 115 -14.168 -14.404 -6.957 1.00 54.03 N ATOM 0 H LYS A 115 -12.696 -10.494 -12.227 1.00 51.41 H new ATOM 0 HA LYS A 115 -12.232 -8.965 -9.862 1.00 72.14 H new ATOM 0 HB2 LYS A 115 -11.709 -11.782 -10.782 1.00 21.53 H new ATOM 0 HB3 LYS A 115 -10.843 -11.195 -9.376 1.00 21.53 H new ATOM 0 HG2 LYS A 115 -13.005 -10.657 -8.256 1.00 43.53 H new ATOM 0 HG3 LYS A 115 -13.882 -11.215 -9.667 1.00 43.53 H new ATOM 0 HD2 LYS A 115 -13.184 -13.517 -9.315 1.00 50.51 H new ATOM 0 HD3 LYS A 115 -11.987 -13.048 -8.124 1.00 50.51 H new ATOM 0 HE2 LYS A 115 -13.737 -12.380 -6.534 1.00 21.22 H new ATOM 0 HE3 LYS A 115 -14.987 -12.620 -7.738 1.00 21.22 H new ATOM 0 HZ1 LYS A 115 -14.882 -14.464 -6.203 1.00 54.03 H new ATOM 0 HZ2 LYS A 115 -14.468 -14.986 -7.765 1.00 54.03 H new ATOM 0 HZ3 LYS A 115 -13.256 -14.753 -6.598 1.00 54.03 H new ATOM 1861 N THR A 116 -10.004 -7.938 -10.235 1.00 73.05 N ATOM 1862 CA THR A 116 -8.696 -7.274 -10.364 1.00 14.12 C ATOM 1863 C THR A 116 -7.604 -8.039 -9.605 1.00 24.44 C ATOM 1864 O THR A 116 -7.835 -8.514 -8.506 1.00 41.11 O ATOM 1865 CB THR A 116 -8.760 -5.814 -9.822 1.00 13.11 C ATOM 1866 OG1 THR A 116 -9.079 -5.820 -8.415 1.00 43.42 O ATOM 1867 CG2 THR A 116 -9.810 -4.983 -10.575 1.00 14.40 C ATOM 0 H THR A 116 -10.675 -7.411 -9.676 1.00 73.05 H new ATOM 0 HA THR A 116 -8.448 -7.259 -11.425 1.00 14.12 H new ATOM 0 HB THR A 116 -7.781 -5.361 -9.978 1.00 13.11 H new ATOM 0 HG1 THR A 116 -8.259 -5.698 -7.893 1.00 43.42 H new ATOM 0 HG21 THR A 116 -9.829 -3.970 -10.173 1.00 14.40 H new ATOM 0 HG22 THR A 116 -9.555 -4.948 -11.634 1.00 14.40 H new ATOM 0 HG23 THR A 116 -10.792 -5.441 -10.453 1.00 14.40 H new ATOM 1875 N THR A 117 -6.419 -8.138 -10.201 1.00 74.33 N ATOM 1876 CA THR A 117 -5.251 -8.783 -9.580 1.00 23.32 C ATOM 1877 C THR A 117 -4.073 -7.823 -9.727 1.00 24.53 C ATOM 1878 O THR A 117 -3.621 -7.560 -10.841 1.00 2.31 O ATOM 1879 CB THR A 117 -4.908 -10.165 -10.234 1.00 22.43 C ATOM 1880 OG1 THR A 117 -6.071 -11.009 -10.258 1.00 13.52 O ATOM 1881 CG2 THR A 117 -3.774 -10.889 -9.488 1.00 21.50 C ATOM 0 H THR A 117 -6.234 -7.772 -11.135 1.00 74.33 H new ATOM 0 HA THR A 117 -5.471 -8.990 -8.533 1.00 23.32 H new ATOM 0 HB THR A 117 -4.574 -9.963 -11.252 1.00 22.43 H new ATOM 0 HG1 THR A 117 -6.101 -11.548 -9.440 1.00 13.52 H new ATOM 0 HG21 THR A 117 -3.569 -11.842 -9.975 1.00 21.50 H new ATOM 0 HG22 THR A 117 -2.876 -10.272 -9.505 1.00 21.50 H new ATOM 0 HG23 THR A 117 -4.073 -11.066 -8.455 1.00 21.50 H new ATOM 1889 N VAL A 118 -3.631 -7.239 -8.613 1.00 44.43 N ATOM 1890 CA VAL A 118 -2.601 -6.185 -8.627 1.00 14.45 C ATOM 1891 C VAL A 118 -1.324 -6.664 -7.897 1.00 73.34 C ATOM 1892 O VAL A 118 -1.302 -6.827 -6.670 1.00 73.21 O ATOM 1893 CB VAL A 118 -3.185 -4.843 -8.033 1.00 2.41 C ATOM 1894 CG1 VAL A 118 -2.095 -3.768 -7.821 1.00 23.52 C ATOM 1895 CG2 VAL A 118 -4.297 -4.284 -8.961 1.00 53.41 C ATOM 0 H VAL A 118 -3.969 -7.476 -7.680 1.00 44.43 H new ATOM 0 HA VAL A 118 -2.309 -5.975 -9.656 1.00 14.45 H new ATOM 0 HB VAL A 118 -3.604 -5.084 -7.056 1.00 2.41 H new ATOM 0 HG11 VAL A 118 -2.549 -2.866 -7.411 1.00 23.52 H new ATOM 0 HG12 VAL A 118 -1.344 -4.144 -7.127 1.00 23.52 H new ATOM 0 HG13 VAL A 118 -1.623 -3.535 -8.776 1.00 23.52 H new ATOM 0 HG21 VAL A 118 -4.691 -3.359 -8.540 1.00 53.41 H new ATOM 0 HG22 VAL A 118 -3.881 -4.085 -9.949 1.00 53.41 H new ATOM 0 HG23 VAL A 118 -5.101 -5.015 -9.047 1.00 53.41 H new ATOM 1905 N THR A 119 -0.287 -6.930 -8.706 1.00 42.45 N ATOM 1906 CA THR A 119 1.018 -7.438 -8.249 1.00 55.14 C ATOM 1907 C THR A 119 1.921 -6.296 -7.717 1.00 61.41 C ATOM 1908 O THR A 119 2.455 -5.501 -8.497 1.00 51.41 O ATOM 1909 CB THR A 119 1.743 -8.198 -9.416 1.00 44.53 C ATOM 1910 OG1 THR A 119 0.899 -9.264 -9.881 1.00 73.03 O ATOM 1911 CG2 THR A 119 3.111 -8.777 -8.991 1.00 12.24 C ATOM 0 H THR A 119 -0.332 -6.796 -9.716 1.00 42.45 H new ATOM 0 HA THR A 119 0.835 -8.130 -7.427 1.00 55.14 H new ATOM 0 HB THR A 119 1.930 -7.475 -10.210 1.00 44.53 H new ATOM 0 HG1 THR A 119 1.347 -9.741 -10.611 1.00 73.03 H new ATOM 0 HG21 THR A 119 3.567 -9.291 -9.837 1.00 12.24 H new ATOM 0 HG22 THR A 119 3.763 -7.967 -8.664 1.00 12.24 H new ATOM 0 HG23 THR A 119 2.969 -9.482 -8.171 1.00 12.24 H new ATOM 1919 N SER A 120 2.074 -6.220 -6.379 1.00 53.43 N ATOM 1920 CA SER A 120 2.941 -5.216 -5.726 1.00 11.24 C ATOM 1921 C SER A 120 4.426 -5.671 -5.738 1.00 22.44 C ATOM 1922 O SER A 120 4.807 -6.653 -5.091 1.00 72.33 O ATOM 1923 CB SER A 120 2.466 -4.929 -4.271 1.00 71.33 C ATOM 1924 OG SER A 120 2.829 -5.952 -3.360 1.00 24.51 O ATOM 0 H SER A 120 1.605 -6.847 -5.725 1.00 53.43 H new ATOM 0 HA SER A 120 2.865 -4.290 -6.296 1.00 11.24 H new ATOM 0 HB2 SER A 120 2.891 -3.983 -3.935 1.00 71.33 H new ATOM 0 HB3 SER A 120 1.382 -4.812 -4.265 1.00 71.33 H new ATOM 0 HG SER A 120 3.572 -6.472 -3.731 1.00 24.51 H new ATOM 1930 N THR A 121 5.240 -4.967 -6.528 1.00 13.13 N ATOM 1931 CA THR A 121 6.707 -5.121 -6.535 1.00 4.22 C ATOM 1932 C THR A 121 7.297 -4.364 -5.323 1.00 62.12 C ATOM 1933 O THR A 121 7.502 -3.149 -5.381 1.00 31.11 O ATOM 1934 CB THR A 121 7.293 -4.542 -7.872 1.00 42.03 C ATOM 1935 OG1 THR A 121 6.691 -5.207 -8.997 1.00 21.21 O ATOM 1936 CG2 THR A 121 8.823 -4.652 -7.970 1.00 11.30 C ATOM 0 H THR A 121 4.902 -4.267 -7.188 1.00 13.13 H new ATOM 0 HA THR A 121 6.970 -6.177 -6.466 1.00 4.22 H new ATOM 0 HB THR A 121 7.053 -3.479 -7.879 1.00 42.03 H new ATOM 0 HG1 THR A 121 6.012 -4.624 -9.397 1.00 21.21 H new ATOM 0 HG21 THR A 121 9.158 -4.233 -8.919 1.00 11.30 H new ATOM 0 HG22 THR A 121 9.281 -4.101 -7.148 1.00 11.30 H new ATOM 0 HG23 THR A 121 9.117 -5.700 -7.913 1.00 11.30 H new ATOM 1944 N SER A 122 7.549 -5.090 -4.221 1.00 54.54 N ATOM 1945 CA SER A 122 8.008 -4.485 -2.949 1.00 1.24 C ATOM 1946 C SER A 122 9.537 -4.589 -2.821 1.00 75.21 C ATOM 1947 O SER A 122 10.066 -5.662 -2.539 1.00 62.43 O ATOM 1948 CB SER A 122 7.315 -5.175 -1.744 1.00 25.40 C ATOM 1949 OG SER A 122 5.900 -5.078 -1.831 1.00 5.41 O ATOM 0 H SER A 122 7.443 -6.104 -4.181 1.00 54.54 H new ATOM 0 HA SER A 122 7.735 -3.430 -2.950 1.00 1.24 H new ATOM 0 HB2 SER A 122 7.607 -6.224 -1.707 1.00 25.40 H new ATOM 0 HB3 SER A 122 7.656 -4.716 -0.816 1.00 25.40 H new ATOM 0 HG SER A 122 5.493 -5.524 -1.059 1.00 5.41 H new ATOM 1955 N THR A 123 10.249 -3.466 -3.032 1.00 61.41 N ATOM 1956 CA THR A 123 11.731 -3.444 -2.999 1.00 14.13 C ATOM 1957 C THR A 123 12.244 -2.906 -1.639 1.00 51.41 C ATOM 1958 O THR A 123 12.226 -1.695 -1.383 1.00 42.10 O ATOM 1959 CB THR A 123 12.327 -2.594 -4.181 1.00 40.40 C ATOM 1960 OG1 THR A 123 11.771 -3.037 -5.434 1.00 4.22 O ATOM 1961 CG2 THR A 123 13.864 -2.689 -4.253 1.00 64.33 C ATOM 0 H THR A 123 9.825 -2.559 -3.228 1.00 61.41 H new ATOM 0 HA THR A 123 12.072 -4.472 -3.121 1.00 14.13 H new ATOM 0 HB THR A 123 12.061 -1.554 -3.992 1.00 40.40 H new ATOM 0 HG1 THR A 123 12.145 -2.502 -6.165 1.00 4.22 H new ATOM 0 HG21 THR A 123 14.227 -2.085 -5.085 1.00 64.33 H new ATOM 0 HG22 THR A 123 14.295 -2.321 -3.322 1.00 64.33 H new ATOM 0 HG23 THR A 123 14.158 -3.728 -4.403 1.00 64.33 H new ATOM 1969 N PHE A 124 12.673 -3.843 -0.776 1.00 60.30 N ATOM 1970 CA PHE A 124 13.303 -3.558 0.539 1.00 31.22 C ATOM 1971 C PHE A 124 14.747 -2.982 0.353 1.00 50.00 C ATOM 1972 O PHE A 124 15.364 -3.191 -0.698 1.00 35.33 O ATOM 1973 CB PHE A 124 13.333 -4.866 1.395 1.00 72.21 C ATOM 1974 CG PHE A 124 11.950 -5.405 1.781 1.00 20.44 C ATOM 1975 CD1 PHE A 124 11.113 -5.993 0.827 1.00 40.11 C ATOM 1976 CD2 PHE A 124 11.496 -5.339 3.100 1.00 73.31 C ATOM 1977 CE1 PHE A 124 9.875 -6.489 1.178 1.00 12.13 C ATOM 1978 CE2 PHE A 124 10.254 -5.837 3.451 1.00 55.04 C ATOM 1979 CZ PHE A 124 9.445 -6.413 2.489 1.00 52.21 C ATOM 0 H PHE A 124 12.593 -4.841 -0.970 1.00 60.30 H new ATOM 0 HA PHE A 124 12.713 -2.804 1.060 1.00 31.22 H new ATOM 0 HB2 PHE A 124 13.867 -5.637 0.839 1.00 72.21 H new ATOM 0 HB3 PHE A 124 13.902 -4.677 2.305 1.00 72.21 H new ATOM 0 HD1 PHE A 124 11.441 -6.060 -0.200 1.00 40.11 H new ATOM 0 HD2 PHE A 124 12.124 -4.893 3.857 1.00 73.31 H new ATOM 0 HE1 PHE A 124 9.241 -6.937 0.427 1.00 12.13 H new ATOM 0 HE2 PHE A 124 9.917 -5.776 4.475 1.00 55.04 H new ATOM 0 HZ PHE A 124 8.476 -6.804 2.762 1.00 52.21 H new ATOM 1989 N PRO A 125 15.313 -2.245 1.376 1.00 74.53 N ATOM 1990 CA PRO A 125 16.642 -1.571 1.244 1.00 63.14 C ATOM 1991 C PRO A 125 17.838 -2.565 1.143 1.00 0.53 C ATOM 1992 O PRO A 125 18.766 -2.359 0.349 1.00 51.00 O ATOM 1993 CB PRO A 125 16.717 -0.695 2.527 1.00 11.30 C ATOM 1994 CG PRO A 125 15.844 -1.402 3.524 1.00 15.24 C ATOM 1995 CD PRO A 125 14.710 -2.006 2.719 1.00 0.24 C ATOM 0 HA PRO A 125 16.721 -0.999 0.320 1.00 63.14 H new ATOM 0 HB2 PRO A 125 17.742 -0.610 2.889 1.00 11.30 H new ATOM 0 HB3 PRO A 125 16.361 0.317 2.337 1.00 11.30 H new ATOM 0 HG2 PRO A 125 16.401 -2.173 4.055 1.00 15.24 H new ATOM 0 HG3 PRO A 125 15.465 -0.708 4.275 1.00 15.24 H new ATOM 0 HD2 PRO A 125 14.351 -2.933 3.167 1.00 0.24 H new ATOM 0 HD3 PRO A 125 13.857 -1.330 2.660 1.00 0.24 H new ATOM 2003 N THR A 126 17.805 -3.642 1.957 1.00 31.41 N ATOM 2004 CA THR A 126 18.875 -4.677 1.990 1.00 3.41 C ATOM 2005 C THR A 126 18.293 -6.086 1.769 1.00 70.10 C ATOM 2006 O THR A 126 17.093 -6.322 1.994 1.00 51.54 O ATOM 2007 CB THR A 126 19.677 -4.667 3.339 1.00 30.12 C ATOM 2008 OG1 THR A 126 18.828 -5.039 4.437 1.00 1.34 O ATOM 2009 CG2 THR A 126 20.309 -3.295 3.626 1.00 73.41 C ATOM 0 H THR A 126 17.042 -3.823 2.609 1.00 31.41 H new ATOM 0 HA THR A 126 19.559 -4.428 1.179 1.00 3.41 H new ATOM 0 HB THR A 126 20.480 -5.396 3.233 1.00 30.12 H new ATOM 0 HG1 THR A 126 19.177 -5.851 4.860 1.00 1.34 H new ATOM 0 HG21 THR A 126 20.854 -3.335 4.569 1.00 73.41 H new ATOM 0 HG22 THR A 126 20.996 -3.035 2.821 1.00 73.41 H new ATOM 0 HG23 THR A 126 19.526 -2.540 3.692 1.00 73.41 H new ATOM 2017 N GLU A 127 19.165 -7.017 1.330 1.00 11.34 N ATOM 2018 CA GLU A 127 18.797 -8.426 1.057 1.00 4.30 C ATOM 2019 C GLU A 127 18.316 -9.144 2.340 1.00 44.43 C ATOM 2020 O GLU A 127 17.396 -9.965 2.303 1.00 72.20 O ATOM 2021 CB GLU A 127 20.007 -9.181 0.446 1.00 54.52 C ATOM 2022 CG GLU A 127 20.541 -8.581 -0.871 1.00 44.50 C ATOM 2023 CD GLU A 127 21.786 -9.319 -1.403 1.00 51.25 C ATOM 2024 OE1 GLU A 127 21.637 -10.312 -2.143 1.00 13.02 O ATOM 2025 OE2 GLU A 127 22.921 -8.913 -1.069 1.00 23.32 O ATOM 0 H GLU A 127 20.149 -6.814 1.153 1.00 11.34 H new ATOM 0 HA GLU A 127 17.972 -8.426 0.344 1.00 4.30 H new ATOM 0 HB2 GLU A 127 20.815 -9.196 1.177 1.00 54.52 H new ATOM 0 HB3 GLU A 127 19.719 -10.217 0.267 1.00 54.52 H new ATOM 0 HG2 GLU A 127 19.755 -8.614 -1.625 1.00 44.50 H new ATOM 0 HG3 GLU A 127 20.787 -7.531 -0.713 1.00 44.50 H new ATOM 2032 N SER A 128 18.951 -8.790 3.469 1.00 75.32 N ATOM 2033 CA SER A 128 18.651 -9.363 4.800 1.00 63.35 C ATOM 2034 C SER A 128 17.354 -8.777 5.410 1.00 44.34 C ATOM 2035 O SER A 128 16.712 -9.437 6.219 1.00 62.44 O ATOM 2036 CB SER A 128 19.841 -9.127 5.754 1.00 41.13 C ATOM 2037 OG SER A 128 20.077 -7.738 5.952 1.00 44.00 O ATOM 0 H SER A 128 19.695 -8.092 3.488 1.00 75.32 H new ATOM 0 HA SER A 128 18.492 -10.433 4.669 1.00 63.35 H new ATOM 0 HB2 SER A 128 19.641 -9.604 6.713 1.00 41.13 H new ATOM 0 HB3 SER A 128 20.736 -9.596 5.345 1.00 41.13 H new ATOM 0 HG SER A 128 20.835 -7.619 6.562 1.00 44.00 H new ATOM 2043 N ALA A 129 16.992 -7.534 5.024 1.00 45.32 N ATOM 2044 CA ALA A 129 15.715 -6.887 5.446 1.00 50.45 C ATOM 2045 C ALA A 129 14.496 -7.552 4.766 1.00 50.01 C ATOM 2046 O ALA A 129 13.476 -7.817 5.414 1.00 73.01 O ATOM 2047 CB ALA A 129 15.745 -5.382 5.130 1.00 64.32 C ATOM 0 H ALA A 129 17.566 -6.949 4.417 1.00 45.32 H new ATOM 0 HA ALA A 129 15.614 -7.020 6.523 1.00 50.45 H new ATOM 0 HB1 ALA A 129 14.806 -4.926 5.444 1.00 64.32 H new ATOM 0 HB2 ALA A 129 16.572 -4.915 5.664 1.00 64.32 H new ATOM 0 HB3 ALA A 129 15.878 -5.238 4.058 1.00 64.32 H new ATOM 2053 N ALA A 130 14.620 -7.807 3.449 1.00 55.23 N ATOM 2054 CA ALA A 130 13.600 -8.552 2.676 1.00 54.11 C ATOM 2055 C ALA A 130 13.485 -10.005 3.166 1.00 32.11 C ATOM 2056 O ALA A 130 12.383 -10.523 3.345 1.00 64.33 O ATOM 2057 CB ALA A 130 13.938 -8.513 1.187 1.00 20.13 C ATOM 0 H ALA A 130 15.421 -7.507 2.893 1.00 55.23 H new ATOM 0 HA ALA A 130 12.634 -8.071 2.831 1.00 54.11 H new ATOM 0 HB1 ALA A 130 13.182 -9.064 0.628 1.00 20.13 H new ATOM 0 HB2 ALA A 130 13.960 -7.478 0.846 1.00 20.13 H new ATOM 0 HB3 ALA A 130 14.914 -8.969 1.023 1.00 20.13 H new ATOM 2063 N GLN A 131 14.653 -10.629 3.389 1.00 64.44 N ATOM 2064 CA GLN A 131 14.768 -11.985 3.989 1.00 14.01 C ATOM 2065 C GLN A 131 14.087 -12.061 5.372 1.00 71.22 C ATOM 2066 O GLN A 131 13.375 -13.020 5.668 1.00 50.04 O ATOM 2067 CB GLN A 131 16.257 -12.397 4.129 1.00 21.14 C ATOM 2068 CG GLN A 131 16.503 -13.744 4.853 1.00 2.42 C ATOM 2069 CD GLN A 131 15.990 -14.962 4.074 1.00 44.20 C ATOM 2070 OE1 GLN A 131 16.694 -15.545 3.255 1.00 24.12 O ATOM 2071 NE2 GLN A 131 14.765 -15.367 4.339 1.00 70.41 N ATOM 0 H GLN A 131 15.555 -10.211 3.159 1.00 64.44 H new ATOM 0 HA GLN A 131 14.258 -12.674 3.316 1.00 14.01 H new ATOM 0 HB2 GLN A 131 16.697 -12.452 3.133 1.00 21.14 H new ATOM 0 HB3 GLN A 131 16.786 -11.611 4.668 1.00 21.14 H new ATOM 0 HG2 GLN A 131 17.572 -13.861 5.032 1.00 2.42 H new ATOM 0 HG3 GLN A 131 16.018 -13.716 5.829 1.00 2.42 H new ATOM 0 HE21 GLN A 131 14.199 -14.866 5.024 1.00 70.41 H new ATOM 0 HE22 GLN A 131 14.382 -16.182 3.859 1.00 70.41 H new ATOM 2080 N GLN A 132 14.316 -11.035 6.198 1.00 52.14 N ATOM 2081 CA GLN A 132 13.741 -10.936 7.553 1.00 5.43 C ATOM 2082 C GLN A 132 12.186 -10.956 7.507 1.00 71.04 C ATOM 2083 O GLN A 132 11.524 -11.534 8.380 1.00 14.02 O ATOM 2084 CB GLN A 132 14.275 -9.645 8.235 1.00 42.54 C ATOM 2085 CG GLN A 132 13.762 -9.378 9.664 1.00 74.20 C ATOM 2086 CD GLN A 132 14.436 -8.186 10.370 1.00 74.41 C ATOM 2087 OE1 GLN A 132 15.711 -7.938 10.100 1.00 43.32 O flip ATOM 2088 NE2 GLN A 132 13.818 -7.502 11.179 1.00 55.45 N flip ATOM 0 H GLN A 132 14.908 -10.243 5.948 1.00 52.14 H new ATOM 0 HA GLN A 132 14.048 -11.801 8.140 1.00 5.43 H new ATOM 0 HB2 GLN A 132 15.363 -9.696 8.264 1.00 42.54 H new ATOM 0 HB3 GLN A 132 14.012 -8.792 7.610 1.00 42.54 H new ATOM 0 HG2 GLN A 132 12.687 -9.200 9.624 1.00 74.20 H new ATOM 0 HG3 GLN A 132 13.915 -10.274 10.265 1.00 74.20 H new ATOM 0 HE21 GLN A 132 12.838 -7.705 11.376 1.00 55.45 H new ATOM 0 HE22 GLN A 132 14.284 -6.730 11.655 1.00 55.45 H new ATOM 2097 N ALA A 133 11.623 -10.337 6.451 1.00 4.32 N ATOM 2098 CA ALA A 133 10.176 -10.379 6.153 1.00 32.24 C ATOM 2099 C ALA A 133 9.715 -11.792 5.681 1.00 60.30 C ATOM 2100 O ALA A 133 8.609 -12.234 6.020 1.00 4.04 O ATOM 2101 CB ALA A 133 9.831 -9.307 5.113 1.00 2.20 C ATOM 0 H ALA A 133 12.160 -9.791 5.777 1.00 4.32 H new ATOM 0 HA ALA A 133 9.634 -10.168 7.075 1.00 32.24 H new ATOM 0 HB1 ALA A 133 8.763 -9.341 4.896 1.00 2.20 H new ATOM 0 HB2 ALA A 133 10.091 -8.323 5.504 1.00 2.20 H new ATOM 0 HB3 ALA A 133 10.393 -9.493 4.198 1.00 2.20 H new ATOM 2107 N ILE A 134 10.578 -12.495 4.913 1.00 52.44 N ATOM 2108 CA ILE A 134 10.308 -13.889 4.452 1.00 61.33 C ATOM 2109 C ILE A 134 10.162 -14.854 5.658 1.00 34.02 C ATOM 2110 O ILE A 134 9.180 -15.599 5.755 1.00 14.21 O ATOM 2111 CB ILE A 134 11.451 -14.428 3.502 1.00 4.00 C ATOM 2112 CG1 ILE A 134 11.676 -13.462 2.299 1.00 11.42 C ATOM 2113 CG2 ILE A 134 11.150 -15.870 3.007 1.00 73.42 C ATOM 2114 CD1 ILE A 134 12.826 -13.836 1.370 1.00 3.42 C ATOM 0 H ILE A 134 11.473 -12.123 4.595 1.00 52.44 H new ATOM 0 HA ILE A 134 9.373 -13.855 3.892 1.00 61.33 H new ATOM 0 HB ILE A 134 12.371 -14.467 4.085 1.00 4.00 H new ATOM 0 HG12 ILE A 134 10.758 -13.417 1.714 1.00 11.42 H new ATOM 0 HG13 ILE A 134 11.856 -12.460 2.688 1.00 11.42 H new ATOM 0 HG21 ILE A 134 11.957 -16.207 2.357 1.00 73.42 H new ATOM 0 HG22 ILE A 134 11.070 -16.539 3.863 1.00 73.42 H new ATOM 0 HG23 ILE A 134 10.211 -15.876 2.453 1.00 73.42 H new ATOM 0 HD11 ILE A 134 12.899 -13.102 0.567 1.00 3.42 H new ATOM 0 HD12 ILE A 134 13.759 -13.851 1.934 1.00 3.42 H new ATOM 0 HD13 ILE A 134 12.644 -14.823 0.944 1.00 3.42 H new ATOM 2126 N ASP A 135 11.142 -14.800 6.584 1.00 23.22 N ATOM 2127 CA ASP A 135 11.151 -15.631 7.816 1.00 61.25 C ATOM 2128 C ASP A 135 9.996 -15.259 8.777 1.00 22.25 C ATOM 2129 O ASP A 135 9.560 -16.082 9.588 1.00 54.52 O ATOM 2130 CB ASP A 135 12.498 -15.489 8.555 1.00 13.33 C ATOM 2131 CG ASP A 135 13.703 -15.895 7.700 1.00 50.23 C ATOM 2132 OD1 ASP A 135 13.800 -17.083 7.327 1.00 20.03 O ATOM 2133 OD2 ASP A 135 14.550 -15.032 7.394 1.00 42.32 O ATOM 0 H ASP A 135 11.950 -14.182 6.503 1.00 23.22 H new ATOM 0 HA ASP A 135 11.011 -16.665 7.502 1.00 61.25 H new ATOM 0 HB2 ASP A 135 12.621 -14.455 8.876 1.00 13.33 H new ATOM 0 HB3 ASP A 135 12.477 -16.102 9.456 1.00 13.33 H new ATOM 2138 N MET A 136 9.523 -14.004 8.677 1.00 71.43 N ATOM 2139 CA MET A 136 8.357 -13.510 9.440 1.00 41.11 C ATOM 2140 C MET A 136 7.043 -14.174 8.955 1.00 21.44 C ATOM 2141 O MET A 136 6.105 -14.371 9.740 1.00 42.11 O ATOM 2142 CB MET A 136 8.258 -11.966 9.283 1.00 42.34 C ATOM 2143 CG MET A 136 7.162 -11.288 10.122 1.00 21.42 C ATOM 2144 SD MET A 136 7.411 -11.505 11.899 1.00 61.41 S ATOM 2145 CE MET A 136 9.012 -10.725 12.148 1.00 55.43 C ATOM 0 H MET A 136 9.937 -13.301 8.065 1.00 71.43 H new ATOM 0 HA MET A 136 8.495 -13.770 10.489 1.00 41.11 H new ATOM 0 HB2 MET A 136 9.220 -11.528 9.550 1.00 42.34 H new ATOM 0 HB3 MET A 136 8.083 -11.735 8.232 1.00 42.34 H new ATOM 0 HG2 MET A 136 7.139 -10.223 9.890 1.00 21.42 H new ATOM 0 HG3 MET A 136 6.191 -11.697 9.843 1.00 21.42 H new ATOM 0 HE1 MET A 136 9.153 -10.515 13.208 1.00 55.43 H new ATOM 0 HE2 MET A 136 9.800 -11.394 11.802 1.00 55.43 H new ATOM 0 HE3 MET A 136 9.054 -9.793 11.585 1.00 55.43 H new ATOM 2155 N GLY A 137 7.004 -14.547 7.662 1.00 33.14 N ATOM 2156 CA GLY A 137 5.755 -14.943 7.008 1.00 0.31 C ATOM 2157 C GLY A 137 4.882 -13.725 6.734 1.00 1.14 C ATOM 2158 O GLY A 137 3.702 -13.695 7.096 1.00 63.35 O ATOM 0 H GLY A 137 7.824 -14.580 7.056 1.00 33.14 H new ATOM 0 HA2 GLY A 137 5.975 -15.457 6.072 1.00 0.31 H new ATOM 0 HA3 GLY A 137 5.216 -15.649 7.640 1.00 0.31 H new ATOM 2162 N VAL A 138 5.497 -12.708 6.092 1.00 34.02 N ATOM 2163 CA VAL A 138 4.876 -11.386 5.832 1.00 64.32 C ATOM 2164 C VAL A 138 3.582 -11.484 4.965 1.00 31.12 C ATOM 2165 O VAL A 138 2.745 -10.580 4.994 1.00 65.11 O ATOM 2166 CB VAL A 138 5.937 -10.415 5.180 1.00 70.25 C ATOM 2167 CG1 VAL A 138 6.441 -10.946 3.816 1.00 50.04 C ATOM 2168 CG2 VAL A 138 5.415 -8.958 5.060 1.00 52.42 C ATOM 0 H VAL A 138 6.450 -12.780 5.735 1.00 34.02 H new ATOM 0 HA VAL A 138 4.560 -10.976 6.791 1.00 64.32 H new ATOM 0 HB VAL A 138 6.788 -10.391 5.860 1.00 70.25 H new ATOM 0 HG11 VAL A 138 7.169 -10.249 3.401 1.00 50.04 H new ATOM 0 HG12 VAL A 138 6.910 -11.920 3.955 1.00 50.04 H new ATOM 0 HG13 VAL A 138 5.600 -11.043 3.130 1.00 50.04 H new ATOM 0 HG21 VAL A 138 6.183 -8.333 4.606 1.00 52.42 H new ATOM 0 HG22 VAL A 138 4.520 -8.942 4.438 1.00 52.42 H new ATOM 0 HG23 VAL A 138 5.175 -8.575 6.052 1.00 52.42 H new ATOM 2178 N GLU A 139 3.427 -12.608 4.231 1.00 33.44 N ATOM 2179 CA GLU A 139 2.184 -12.946 3.482 1.00 52.02 C ATOM 2180 C GLU A 139 0.942 -12.866 4.397 1.00 2.34 C ATOM 2181 O GLU A 139 -0.060 -12.244 4.043 1.00 42.22 O ATOM 2182 CB GLU A 139 2.267 -14.380 2.873 1.00 34.05 C ATOM 2183 CG GLU A 139 3.289 -14.575 1.736 1.00 55.14 C ATOM 2184 CD GLU A 139 4.761 -14.409 2.156 1.00 71.25 C ATOM 2185 OE1 GLU A 139 5.305 -15.315 2.823 1.00 73.03 O ATOM 2186 OE2 GLU A 139 5.376 -13.374 1.834 1.00 43.40 O ATOM 0 H GLU A 139 4.159 -13.312 4.137 1.00 33.44 H new ATOM 0 HA GLU A 139 2.089 -12.216 2.678 1.00 52.02 H new ATOM 0 HB2 GLU A 139 2.507 -15.080 3.674 1.00 34.05 H new ATOM 0 HB3 GLU A 139 1.280 -14.651 2.498 1.00 34.05 H new ATOM 0 HG2 GLU A 139 3.156 -15.571 1.314 1.00 55.14 H new ATOM 0 HG3 GLU A 139 3.069 -13.861 0.942 1.00 55.14 H new ATOM 2193 N THR A 140 1.063 -13.484 5.588 1.00 51.04 N ATOM 2194 CA THR A 140 -0.007 -13.536 6.611 1.00 70.33 C ATOM 2195 C THR A 140 -0.466 -12.111 7.023 1.00 23.03 C ATOM 2196 O THR A 140 -1.667 -11.830 7.099 1.00 41.32 O ATOM 2197 CB THR A 140 0.484 -14.315 7.885 1.00 41.44 C ATOM 2198 OG1 THR A 140 1.125 -15.541 7.489 1.00 74.45 O ATOM 2199 CG2 THR A 140 -0.663 -14.644 8.863 1.00 23.20 C ATOM 0 H THR A 140 1.915 -13.967 5.873 1.00 51.04 H new ATOM 0 HA THR A 140 -0.854 -14.060 6.169 1.00 70.33 H new ATOM 0 HB THR A 140 1.185 -13.661 8.404 1.00 41.44 H new ATOM 0 HG1 THR A 140 2.068 -15.367 7.288 1.00 74.45 H new ATOM 0 HG21 THR A 140 -0.265 -15.182 9.723 1.00 23.20 H new ATOM 0 HG22 THR A 140 -1.132 -13.719 9.199 1.00 23.20 H new ATOM 0 HG23 THR A 140 -1.404 -15.264 8.359 1.00 23.20 H new ATOM 2207 N GLY A 141 0.522 -11.217 7.248 1.00 41.41 N ATOM 2208 CA GLY A 141 0.263 -9.823 7.647 1.00 22.01 C ATOM 2209 C GLY A 141 -0.262 -8.930 6.512 1.00 14.12 C ATOM 2210 O GLY A 141 -1.101 -8.049 6.747 1.00 42.25 O ATOM 0 H GLY A 141 1.513 -11.443 7.158 1.00 41.41 H new ATOM 0 HA2 GLY A 141 -0.461 -9.819 8.462 1.00 22.01 H new ATOM 0 HA3 GLY A 141 1.185 -9.391 8.037 1.00 22.01 H new ATOM 2214 N MET A 142 0.229 -9.155 5.277 1.00 45.24 N ATOM 2215 CA MET A 142 -0.172 -8.355 4.096 1.00 30.11 C ATOM 2216 C MET A 142 -1.624 -8.669 3.674 1.00 42.21 C ATOM 2217 O MET A 142 -2.433 -7.752 3.521 1.00 45.24 O ATOM 2218 CB MET A 142 0.824 -8.548 2.916 1.00 22.01 C ATOM 2219 CG MET A 142 2.172 -7.822 3.116 1.00 1.43 C ATOM 2220 SD MET A 142 3.266 -7.898 1.676 1.00 73.50 S ATOM 2221 CE MET A 142 3.762 -9.620 1.659 1.00 73.34 C ATOM 0 H MET A 142 0.907 -9.887 5.068 1.00 45.24 H new ATOM 0 HA MET A 142 -0.136 -7.303 4.380 1.00 30.11 H new ATOM 0 HB2 MET A 142 1.012 -9.613 2.781 1.00 22.01 H new ATOM 0 HB3 MET A 142 0.360 -8.187 1.998 1.00 22.01 H new ATOM 0 HG2 MET A 142 1.978 -6.777 3.358 1.00 1.43 H new ATOM 0 HG3 MET A 142 2.685 -8.258 3.973 1.00 1.43 H new ATOM 0 HE1 MET A 142 3.940 -9.937 0.631 1.00 73.34 H new ATOM 0 HE2 MET A 142 4.676 -9.741 2.240 1.00 73.34 H new ATOM 0 HE3 MET A 142 2.972 -10.231 2.095 1.00 73.34 H new ATOM 2231 N ASN A 143 -1.956 -9.971 3.531 1.00 65.44 N ATOM 2232 CA ASN A 143 -3.348 -10.420 3.265 1.00 31.32 C ATOM 2233 C ASN A 143 -4.314 -9.979 4.398 1.00 61.10 C ATOM 2234 O ASN A 143 -5.459 -9.623 4.121 1.00 22.21 O ATOM 2235 CB ASN A 143 -3.432 -11.959 3.052 1.00 40.31 C ATOM 2236 CG ASN A 143 -2.864 -12.400 1.697 1.00 34.51 C ATOM 2237 OD1 ASN A 143 -3.547 -12.342 0.678 1.00 13.14 O ATOM 2238 ND2 ASN A 143 -1.635 -12.875 1.673 1.00 31.51 N ATOM 0 H ASN A 143 -1.281 -10.733 3.595 1.00 65.44 H new ATOM 0 HA ASN A 143 -3.660 -9.936 2.339 1.00 31.32 H new ATOM 0 HB2 ASN A 143 -2.888 -12.463 3.851 1.00 40.31 H new ATOM 0 HB3 ASN A 143 -4.472 -12.276 3.126 1.00 40.31 H new ATOM 0 HD21 ASN A 143 -1.232 -13.204 0.795 1.00 31.51 H new ATOM 0 HD22 ASN A 143 -1.086 -12.914 2.532 1.00 31.51 H new ATOM 2245 N SER A 144 -3.820 -9.980 5.659 1.00 72.14 N ATOM 2246 CA SER A 144 -4.592 -9.515 6.849 1.00 35.52 C ATOM 2247 C SER A 144 -5.105 -8.058 6.680 1.00 44.44 C ATOM 2248 O SER A 144 -6.301 -7.785 6.870 1.00 41.25 O ATOM 2249 CB SER A 144 -3.729 -9.615 8.129 1.00 23.24 C ATOM 2250 OG SER A 144 -4.414 -9.128 9.274 1.00 41.41 O ATOM 0 H SER A 144 -2.879 -10.301 5.886 1.00 72.14 H new ATOM 0 HA SER A 144 -5.459 -10.169 6.940 1.00 35.52 H new ATOM 0 HB2 SER A 144 -3.443 -10.654 8.293 1.00 23.24 H new ATOM 0 HB3 SER A 144 -2.808 -9.049 7.990 1.00 23.24 H new ATOM 0 HG SER A 144 -3.836 -9.210 10.061 1.00 41.41 H new ATOM 2256 N THR A 145 -4.187 -7.145 6.303 1.00 72.41 N ATOM 2257 CA THR A 145 -4.514 -5.719 6.034 1.00 43.44 C ATOM 2258 C THR A 145 -5.390 -5.574 4.756 1.00 14.33 C ATOM 2259 O THR A 145 -6.238 -4.688 4.663 1.00 60.32 O ATOM 2260 CB THR A 145 -3.206 -4.854 5.883 1.00 34.43 C ATOM 2261 OG1 THR A 145 -2.347 -5.064 7.021 1.00 74.05 O ATOM 2262 CG2 THR A 145 -3.501 -3.338 5.749 1.00 1.10 C ATOM 0 H THR A 145 -3.200 -7.368 6.175 1.00 72.41 H new ATOM 0 HA THR A 145 -5.080 -5.351 6.890 1.00 43.44 H new ATOM 0 HB THR A 145 -2.718 -5.180 4.964 1.00 34.43 H new ATOM 0 HG1 THR A 145 -1.940 -5.954 6.964 1.00 74.05 H new ATOM 0 HG21 THR A 145 -2.563 -2.792 5.648 1.00 1.10 H new ATOM 0 HG22 THR A 145 -4.119 -3.164 4.868 1.00 1.10 H new ATOM 0 HG23 THR A 145 -4.029 -2.990 6.637 1.00 1.10 H new ATOM 2270 N LEU A 146 -5.177 -6.477 3.781 1.00 11.43 N ATOM 2271 CA LEU A 146 -5.941 -6.501 2.512 1.00 74.40 C ATOM 2272 C LEU A 146 -7.371 -7.074 2.663 1.00 51.34 C ATOM 2273 O LEU A 146 -8.195 -6.864 1.775 1.00 43.42 O ATOM 2274 CB LEU A 146 -5.156 -7.224 1.395 1.00 20.33 C ATOM 2275 CG LEU A 146 -3.823 -6.528 0.952 1.00 0.43 C ATOM 2276 CD1 LEU A 146 -3.191 -7.254 -0.232 1.00 42.42 C ATOM 2277 CD2 LEU A 146 -4.028 -5.032 0.627 1.00 45.52 C ATOM 0 H LEU A 146 -4.472 -7.211 3.847 1.00 11.43 H new ATOM 0 HA LEU A 146 -6.068 -5.459 2.219 1.00 74.40 H new ATOM 0 HB2 LEU A 146 -4.924 -8.234 1.733 1.00 20.33 H new ATOM 0 HB3 LEU A 146 -5.803 -7.320 0.523 1.00 20.33 H new ATOM 0 HG LEU A 146 -3.139 -6.587 1.798 1.00 0.43 H new ATOM 0 HD11 LEU A 146 -2.268 -6.749 -0.518 1.00 42.42 H new ATOM 0 HD12 LEU A 146 -2.970 -8.284 0.049 1.00 42.42 H new ATOM 0 HD13 LEU A 146 -3.883 -7.248 -1.074 1.00 42.42 H new ATOM 0 HD21 LEU A 146 -3.078 -4.592 0.325 1.00 45.52 H new ATOM 0 HD22 LEU A 146 -4.749 -4.931 -0.184 1.00 45.52 H new ATOM 0 HD23 LEU A 146 -4.402 -4.516 1.511 1.00 45.52 H new ATOM 2289 N ASN A 147 -7.656 -7.849 3.740 1.00 43.51 N ATOM 2290 CA ASN A 147 -9.061 -8.230 4.086 1.00 14.33 C ATOM 2291 C ASN A 147 -9.913 -6.964 4.387 1.00 24.24 C ATOM 2292 O ASN A 147 -11.114 -6.932 4.097 1.00 2.10 O ATOM 2293 CB ASN A 147 -9.135 -9.225 5.283 1.00 12.21 C ATOM 2294 CG ASN A 147 -8.676 -10.647 4.928 1.00 34.20 C ATOM 2295 OD1 ASN A 147 -7.460 -11.004 5.281 1.00 64.52 O flip ATOM 2296 ND2 ASN A 147 -9.429 -11.436 4.364 1.00 40.20 N flip ATOM 0 H ASN A 147 -6.951 -8.219 4.377 1.00 43.51 H new ATOM 0 HA ASN A 147 -9.471 -8.742 3.216 1.00 14.33 H new ATOM 0 HB2 ASN A 147 -8.519 -8.846 6.099 1.00 12.21 H new ATOM 0 HB3 ASN A 147 -10.161 -9.264 5.650 1.00 12.21 H new ATOM 0 HD21 ASN A 147 -10.369 -11.142 4.097 1.00 40.20 H new ATOM 0 HD22 ASN A 147 -9.115 -12.385 4.162 1.00 40.20 H new ATOM 2303 N GLN A 148 -9.266 -5.922 4.958 1.00 22.33 N ATOM 2304 CA GLN A 148 -9.883 -4.582 5.128 1.00 13.13 C ATOM 2305 C GLN A 148 -10.192 -3.939 3.751 1.00 42.33 C ATOM 2306 O GLN A 148 -11.276 -3.389 3.540 1.00 20.10 O ATOM 2307 CB GLN A 148 -8.954 -3.636 5.943 1.00 15.33 C ATOM 2308 CG GLN A 148 -8.594 -4.120 7.367 1.00 62.23 C ATOM 2309 CD GLN A 148 -9.804 -4.271 8.298 1.00 33.31 C ATOM 2310 OE1 GLN A 148 -10.813 -3.582 8.162 1.00 64.34 O ATOM 2311 NE2 GLN A 148 -9.708 -5.158 9.265 1.00 43.03 N ATOM 0 H GLN A 148 -8.311 -5.983 5.311 1.00 22.33 H new ATOM 0 HA GLN A 148 -10.815 -4.720 5.677 1.00 13.13 H new ATOM 0 HB2 GLN A 148 -8.030 -3.492 5.383 1.00 15.33 H new ATOM 0 HB3 GLN A 148 -9.435 -2.661 6.020 1.00 15.33 H new ATOM 0 HG2 GLN A 148 -8.082 -5.079 7.295 1.00 62.23 H new ATOM 0 HG3 GLN A 148 -7.891 -3.416 7.812 1.00 62.23 H new ATOM 0 HE21 GLN A 148 -8.862 -5.719 9.360 1.00 43.03 H new ATOM 0 HE22 GLN A 148 -10.480 -5.284 9.920 1.00 43.03 H new ATOM 2320 N LEU A 149 -9.221 -4.047 2.819 1.00 3.25 N ATOM 2321 CA LEU A 149 -9.329 -3.485 1.457 1.00 31.14 C ATOM 2322 C LEU A 149 -10.407 -4.215 0.617 1.00 3.43 C ATOM 2323 O LEU A 149 -11.118 -3.588 -0.162 1.00 45.20 O ATOM 2324 CB LEU A 149 -7.935 -3.520 0.756 1.00 42.25 C ATOM 2325 CG LEU A 149 -7.847 -2.886 -0.674 1.00 42.53 C ATOM 2326 CD1 LEU A 149 -8.500 -1.499 -0.717 1.00 13.04 C ATOM 2327 CD2 LEU A 149 -6.386 -2.796 -1.176 1.00 3.24 C ATOM 0 H LEU A 149 -8.338 -4.528 2.991 1.00 3.25 H new ATOM 0 HA LEU A 149 -9.650 -2.447 1.539 1.00 31.14 H new ATOM 0 HB2 LEU A 149 -7.219 -3.009 1.399 1.00 42.25 H new ATOM 0 HB3 LEU A 149 -7.616 -4.560 0.687 1.00 42.25 H new ATOM 0 HG LEU A 149 -8.397 -3.550 -1.341 1.00 42.53 H new ATOM 0 HD11 LEU A 149 -8.420 -1.090 -1.724 1.00 13.04 H new ATOM 0 HD12 LEU A 149 -9.551 -1.583 -0.442 1.00 13.04 H new ATOM 0 HD13 LEU A 149 -7.993 -0.836 -0.015 1.00 13.04 H new ATOM 0 HD21 LEU A 149 -6.370 -2.351 -2.171 1.00 3.24 H new ATOM 0 HD22 LEU A 149 -5.804 -2.178 -0.492 1.00 3.24 H new ATOM 0 HD23 LEU A 149 -5.954 -3.796 -1.219 1.00 3.24 H new ATOM 2339 N GLU A 150 -10.539 -5.531 0.824 1.00 14.15 N ATOM 2340 CA GLU A 150 -11.557 -6.363 0.144 1.00 40.24 C ATOM 2341 C GLU A 150 -12.993 -5.900 0.523 1.00 31.21 C ATOM 2342 O GLU A 150 -13.859 -5.734 -0.342 1.00 73.54 O ATOM 2343 CB GLU A 150 -11.342 -7.857 0.518 1.00 41.32 C ATOM 2344 CG GLU A 150 -12.250 -8.865 -0.222 1.00 4.13 C ATOM 2345 CD GLU A 150 -12.012 -8.912 -1.747 1.00 32.21 C ATOM 2346 OE1 GLU A 150 -11.009 -9.522 -2.173 1.00 35.12 O ATOM 2347 OE2 GLU A 150 -12.814 -8.336 -2.517 1.00 23.14 O ATOM 0 H GLU A 150 -9.946 -6.056 1.467 1.00 14.15 H new ATOM 0 HA GLU A 150 -11.446 -6.248 -0.934 1.00 40.24 H new ATOM 0 HB2 GLU A 150 -10.302 -8.117 0.319 1.00 41.32 H new ATOM 0 HB3 GLU A 150 -11.500 -7.971 1.590 1.00 41.32 H new ATOM 0 HG2 GLU A 150 -12.087 -9.860 0.193 1.00 4.13 H new ATOM 0 HG3 GLU A 150 -13.292 -8.608 -0.034 1.00 4.13 H new ATOM 2354 N LYS A 151 -13.210 -5.662 1.832 1.00 52.33 N ATOM 2355 CA LYS A 151 -14.497 -5.135 2.362 1.00 60.32 C ATOM 2356 C LYS A 151 -14.775 -3.696 1.877 1.00 50.25 C ATOM 2357 O LYS A 151 -15.922 -3.344 1.600 1.00 74.30 O ATOM 2358 CB LYS A 151 -14.505 -5.175 3.912 1.00 1.05 C ATOM 2359 CG LYS A 151 -14.362 -6.586 4.515 1.00 23.31 C ATOM 2360 CD LYS A 151 -14.394 -6.609 6.067 1.00 3.32 C ATOM 2361 CE LYS A 151 -13.210 -5.875 6.750 1.00 25.21 C ATOM 2362 NZ LYS A 151 -13.366 -4.392 6.789 1.00 63.33 N ATOM 0 H LYS A 151 -12.507 -5.826 2.553 1.00 52.33 H new ATOM 0 HA LYS A 151 -15.289 -5.778 1.978 1.00 60.32 H new ATOM 0 HB2 LYS A 151 -13.692 -4.551 4.283 1.00 1.05 H new ATOM 0 HB3 LYS A 151 -15.435 -4.733 4.270 1.00 1.05 H new ATOM 0 HG2 LYS A 151 -15.165 -7.217 4.135 1.00 23.31 H new ATOM 0 HG3 LYS A 151 -13.424 -7.024 4.173 1.00 23.31 H new ATOM 0 HD2 LYS A 151 -15.327 -6.158 6.404 1.00 3.32 H new ATOM 0 HD3 LYS A 151 -14.402 -7.646 6.402 1.00 3.32 H new ATOM 0 HE2 LYS A 151 -13.103 -6.247 7.769 1.00 25.21 H new ATOM 0 HE3 LYS A 151 -12.289 -6.121 6.222 1.00 25.21 H new ATOM 0 HZ1 LYS A 151 -12.957 -4.023 7.671 1.00 63.33 H new ATOM 0 HZ2 LYS A 151 -12.874 -3.970 5.976 1.00 63.33 H new ATOM 0 HZ3 LYS A 151 -14.376 -4.148 6.747 1.00 63.33 H new ATOM 2376 N LEU A 152 -13.709 -2.882 1.797 1.00 73.33 N ATOM 2377 CA LEU A 152 -13.768 -1.487 1.299 1.00 30.24 C ATOM 2378 C LEU A 152 -14.272 -1.414 -0.168 1.00 72.22 C ATOM 2379 O LEU A 152 -15.183 -0.642 -0.489 1.00 34.24 O ATOM 2380 CB LEU A 152 -12.358 -0.828 1.423 1.00 11.31 C ATOM 2381 CG LEU A 152 -12.127 0.496 0.616 1.00 2.55 C ATOM 2382 CD1 LEU A 152 -13.133 1.596 0.996 1.00 35.22 C ATOM 2383 CD2 LEU A 152 -10.686 0.999 0.773 1.00 62.01 C ATOM 0 H LEU A 152 -12.772 -3.171 2.077 1.00 73.33 H new ATOM 0 HA LEU A 152 -14.484 -0.940 1.912 1.00 30.24 H new ATOM 0 HB2 LEU A 152 -12.170 -0.622 2.477 1.00 11.31 H new ATOM 0 HB3 LEU A 152 -11.613 -1.556 1.103 1.00 11.31 H new ATOM 0 HG LEU A 152 -12.294 0.255 -0.434 1.00 2.55 H new ATOM 0 HD11 LEU A 152 -12.931 2.492 0.410 1.00 35.22 H new ATOM 0 HD12 LEU A 152 -14.146 1.249 0.791 1.00 35.22 H new ATOM 0 HD13 LEU A 152 -13.036 1.827 2.057 1.00 35.22 H new ATOM 0 HD21 LEU A 152 -10.557 1.918 0.202 1.00 62.01 H new ATOM 0 HD22 LEU A 152 -10.481 1.194 1.826 1.00 62.01 H new ATOM 0 HD23 LEU A 152 -9.994 0.242 0.403 1.00 62.01 H new ATOM 2395 N LEU A 153 -13.667 -2.217 -1.042 1.00 14.01 N ATOM 2396 CA LEU A 153 -13.952 -2.198 -2.492 1.00 53.24 C ATOM 2397 C LEU A 153 -15.322 -2.829 -2.823 1.00 44.11 C ATOM 2398 O LEU A 153 -15.978 -2.447 -3.802 1.00 12.34 O ATOM 2399 CB LEU A 153 -12.793 -2.894 -3.227 1.00 14.41 C ATOM 2400 CG LEU A 153 -11.399 -2.228 -2.994 1.00 24.21 C ATOM 2401 CD1 LEU A 153 -10.258 -3.059 -3.598 1.00 3.52 C ATOM 2402 CD2 LEU A 153 -11.375 -0.769 -3.504 1.00 21.42 C ATOM 0 H LEU A 153 -12.962 -2.904 -0.773 1.00 14.01 H new ATOM 0 HA LEU A 153 -14.022 -1.165 -2.834 1.00 53.24 H new ATOM 0 HB2 LEU A 153 -12.745 -3.934 -2.905 1.00 14.41 H new ATOM 0 HB3 LEU A 153 -13.007 -2.901 -4.296 1.00 14.41 H new ATOM 0 HG LEU A 153 -11.234 -2.199 -1.917 1.00 24.21 H new ATOM 0 HD11 LEU A 153 -9.307 -2.560 -3.413 1.00 3.52 H new ATOM 0 HD12 LEU A 153 -10.245 -4.047 -3.138 1.00 3.52 H new ATOM 0 HD13 LEU A 153 -10.411 -3.161 -4.672 1.00 3.52 H new ATOM 0 HD21 LEU A 153 -10.390 -0.337 -3.326 1.00 21.42 H new ATOM 0 HD22 LEU A 153 -11.590 -0.753 -4.573 1.00 21.42 H new ATOM 0 HD23 LEU A 153 -12.128 -0.186 -2.974 1.00 21.42 H new ATOM 2414 N ASN A 154 -15.744 -3.805 -2.004 1.00 20.21 N ATOM 2415 CA ASN A 154 -17.131 -4.333 -2.021 1.00 34.22 C ATOM 2416 C ASN A 154 -18.116 -3.450 -1.200 1.00 24.14 C ATOM 2417 O ASN A 154 -19.315 -3.751 -1.156 1.00 15.22 O ATOM 2418 CB ASN A 154 -17.135 -5.794 -1.537 1.00 1.13 C ATOM 2419 CG ASN A 154 -16.565 -6.738 -2.587 1.00 13.40 C ATOM 2420 OD1 ASN A 154 -17.295 -7.322 -3.383 1.00 11.43 O ATOM 2421 ND2 ASN A 154 -15.266 -6.855 -2.640 1.00 72.10 N ATOM 0 H ASN A 154 -15.143 -4.253 -1.312 1.00 20.21 H new ATOM 0 HA ASN A 154 -17.492 -4.301 -3.049 1.00 34.22 H new ATOM 0 HB2 ASN A 154 -16.551 -5.875 -0.620 1.00 1.13 H new ATOM 0 HB3 ASN A 154 -18.154 -6.094 -1.294 1.00 1.13 H new ATOM 0 HD21 ASN A 154 -14.836 -7.442 -3.354 1.00 72.10 H new ATOM 0 HD22 ASN A 154 -14.681 -6.359 -1.967 1.00 72.10 H new ATOM 2428 N GLN A 155 -17.584 -2.376 -0.567 1.00 10.33 N ATOM 2429 CA GLN A 155 -18.337 -1.405 0.274 1.00 61.02 C ATOM 2430 C GLN A 155 -18.986 -2.083 1.504 1.00 52.32 C ATOM 2431 O GLN A 155 -18.433 -2.054 2.610 1.00 24.53 O ATOM 2432 CB GLN A 155 -19.374 -0.596 -0.570 1.00 73.33 C ATOM 2433 CG GLN A 155 -18.746 0.418 -1.549 1.00 52.41 C ATOM 2434 CD GLN A 155 -18.147 1.646 -0.846 1.00 64.23 C ATOM 2435 OE1 GLN A 155 -18.943 2.680 -0.660 1.00 24.53 O flip ATOM 2436 NE2 GLN A 155 -16.980 1.668 -0.474 1.00 63.14 N flip ATOM 0 H GLN A 155 -16.591 -2.152 -0.627 1.00 10.33 H new ATOM 0 HA GLN A 155 -17.614 -0.688 0.662 1.00 61.02 H new ATOM 0 HB2 GLN A 155 -19.989 -1.296 -1.136 1.00 73.33 H new ATOM 0 HB3 GLN A 155 -20.040 -0.063 0.109 1.00 73.33 H new ATOM 0 HG2 GLN A 155 -17.966 -0.079 -2.126 1.00 52.41 H new ATOM 0 HG3 GLN A 155 -19.506 0.748 -2.258 1.00 52.41 H new ATOM 0 HE21 GLN A 155 -16.380 0.857 -0.627 1.00 63.14 H new ATOM 0 HE22 GLN A 155 -16.608 2.497 -0.011 1.00 63.14 H new