USER MOD reduce.3.24.130724 H: found=0, std=0, add=1350, rem=0, adj=54 USER MOD reduce.3.24.130724 removed 1339 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 117 ASN :FLIP amide:sc= -0.0056 F(o=-3.7!,f=-0.042) USER MOD Set 1.2: A 120 HIS :FLIP no HD1:sc= -0.0366 X(o=-0.23,f=-0.042) USER MOD Set 2.1: A 99 ASN :FLIP amide:sc= -0.561 F(o=-0.54,f=0.7) USER MOD Set 2.2: A 100 THR OG1 : rot 61:sc= 1.26 USER MOD Set 3.1: A 86 SER OG : rot 180:sc= 0.00695 USER MOD Set 3.2: A 87 SER OG : rot 180:sc= 0.0808 USER MOD Set 4.1: A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 39 HIS : no HE2:sc= -1.52 X(o=-1.5,f=-2) USER MOD Set 5.1: A 33 THR OG1 : rot 77:sc= 2.06 USER MOD Set 5.2: A 71 SER OG : rot -120:sc= 1.06 USER MOD Set 5.3: B1007 TYR OH : rot -114:sc= -1.53! USER MOD Set 6.1: A 27 SER OG : rot 180:sc= 0.845 USER MOD Set 6.2: A 31 LYS NZ :NH3+ 139:sc= 0.939 (180deg=0) USER MOD Single : A 1 MET CE :methyl -164:sc= 0 (180deg=-0.274) USER MOD Single : A 2 GLN : amide:sc= -0.305 X(o=-0.31,f=-0.0017) USER MOD Single : A 3 GLN : amide:sc= -0.133 X(o=-0.13,f=-0.23) USER MOD Single : A 8 GLN : amide:sc= -0.115 X(o=-0.12,f=-0.0074) USER MOD Single : A 9 ASN : amide:sc= -0.839 X(o=-0.84,f=-0.92) USER MOD Single : A 13 THR OG1 : rot 74:sc= 0.843 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -116:sc= 0.334 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 167:sc= 1.04 (180deg=0.897) USER MOD Single : A 22 SER OG : rot 180:sc= -0.255 USER MOD Single : A 25 SER OG : rot -36:sc= 0.448 USER MOD Single : A 30 LYS NZ :NH3+ -140:sc= 0.0487 (180deg=-0.746) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 TYR OH : rot 120:sc= -1.55 USER MOD Single : A 44 SER OG : rot 180:sc= -0.831 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 80:sc= -0.137 USER MOD Single : A 54 SER OG : rot -97:sc= -1.11! USER MOD Single : A 57 CYS SG : rot 143:sc= 0.109 USER MOD Single : A 60 SER OG : rot 180:sc= 0.0217 USER MOD Single : A 61 HIS : no HD1:sc= -7.09! C(o=-7.1!,f=-10!) USER MOD Single : A 62 LYS NZ :NH3+ -132:sc= -0.983 (180deg=-2.34!) USER MOD Single : A 65 SER OG : rot -132:sc= -1.07 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 TYR OH : rot 180:sc= -2.21! USER MOD Single : A 80 THR OG1 : rot 62:sc= 0.694 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 ASN : amide:sc= -0.22 X(o=-0.22,f=-0.088) USER MOD Single : A 84 SER OG : rot 180:sc= 0.134 USER MOD Single : A 85 ASN : amide:sc= -0.547 K(o=-0.55,f=-4.3!) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -1.33 K(o=-1.3,f=-3.7!) USER MOD Single : A 90 LYS NZ :NH3+ 154:sc= -0.188 (180deg=-1.17) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 CYS SG : rot 180:sc= -0.637 USER MOD Single : A 96 HIS :FLIP no HE2:sc= -4.34 F(o=-5.1,f=-4.3) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 SER OG : rot -83:sc= 1.13 USER MOD Single : A 115 LYS NZ :NH3+ 143:sc= -0.572 (180deg=-1.66!) USER MOD Single : A 116 SER OG : rot 88:sc= 0.496 USER MOD Single : A 118 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.0088) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 MET CE :methyl 153:sc= 0 (180deg=-0.349) USER MOD Single : A 134 SER OG : rot 180:sc= -0.0643 USER MOD Single : A 138 GLN : amide:sc= -2.18 K(o=-2.2,f=-3) USER MOD Single : A 139 LYS NZ :NH3+ 158:sc= 1.58 (180deg=1.36) USER MOD Single : A 140 SER OG : rot -91:sc= 0.0257 USER MOD Single : A 141 TYR OH : rot 180:sc= 0 USER MOD Single : A 143 ASN : amide:sc= -0.364 X(o=-0.36,f=-0.012) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 CYS SG : rot 180:sc= 0 USER MOD Single : A 152 MET CE :methyl 139:sc= -3.77! (180deg=-5.41!) USER MOD Single : A 156 HIS : no HE2:sc= 0.00424 X(o=0.0042,f=-0.25) USER MOD Single : A 157 HIS : no HD1:sc= -0.329 X(o=-0.33,f=-0.38) USER MOD Single : A 158 HIS : no HD1:sc= -0.0594 X(o=-0.059,f=-0.45) USER MOD Single : A 159 HIS : no HD1:sc= -0.447 X(o=-0.45,f=-0.27) USER MOD Single : A 160 HIS : no HD1:sc= -0.0135 X(o=-0.013,f=-0.013) USER MOD Single : A 161 HIS : no HD1:sc= -0.344 X(o=-0.34,f=-0.048) USER MOD Single : B1008 ASN : amide:sc= -2.37 K(o=-2.4,f=-16!) USER MOD Single : B1010 TYR OH : rot 180:sc= 0 USER MOD Single : B1011 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.102 1.463 -6.697 1.00 44.23 N ATOM 2 CA MET A 1 -0.972 0.888 -5.977 1.00 2.14 C ATOM 3 C MET A 1 -1.135 -0.621 -5.825 1.00 62.02 C ATOM 4 O MET A 1 -0.236 -1.388 -6.169 1.00 73.34 O ATOM 5 CB MET A 1 -0.834 1.539 -4.599 1.00 23.42 C ATOM 6 CG MET A 1 -0.089 2.864 -4.624 1.00 75.23 C ATOM 7 SD MET A 1 1.691 2.665 -4.418 1.00 73.34 S ATOM 8 CE MET A 1 2.037 3.944 -3.214 1.00 45.42 C ATOM 0 H1 MET A 1 -1.969 2.490 -6.788 1.00 44.23 H new ATOM 0 H2 MET A 1 -2.164 1.036 -7.643 1.00 44.23 H new ATOM 0 H3 MET A 1 -2.980 1.273 -6.173 1.00 44.23 H new ATOM 0 HA MET A 1 -0.068 1.081 -6.555 1.00 2.14 H new ATOM 0 HB2 MET A 1 -1.828 1.698 -4.180 1.00 23.42 H new ATOM 0 HB3 MET A 1 -0.314 0.852 -3.932 1.00 23.42 H new ATOM 0 HG2 MET A 1 -0.287 3.370 -5.569 1.00 75.23 H new ATOM 0 HG3 MET A 1 -0.473 3.507 -3.832 1.00 75.23 H new ATOM 0 HE1 MET A 1 3.109 4.142 -3.192 1.00 45.42 H new ATOM 0 HE2 MET A 1 1.505 4.855 -3.488 1.00 45.42 H new ATOM 0 HE3 MET A 1 1.709 3.614 -2.228 1.00 45.42 H new ATOM 18 N GLN A 2 -2.286 -1.039 -5.308 1.00 41.44 N ATOM 19 CA GLN A 2 -2.565 -2.456 -5.111 1.00 64.11 C ATOM 20 C GLN A 2 -4.046 -2.754 -5.318 1.00 40.40 C ATOM 21 O GLN A 2 -4.906 -2.129 -4.698 1.00 40.42 O ATOM 22 CB GLN A 2 -2.136 -2.891 -3.709 1.00 22.53 C ATOM 23 CG GLN A 2 -0.744 -2.416 -3.323 1.00 72.51 C ATOM 24 CD GLN A 2 -0.402 -2.725 -1.879 1.00 2.42 C ATOM 25 OE1 GLN A 2 0.651 -3.292 -1.586 1.00 2.42 O ATOM 26 NE2 GLN A 2 -1.292 -2.351 -0.967 1.00 23.54 N ATOM 0 H GLN A 2 -3.040 -0.416 -5.018 1.00 41.44 H new ATOM 0 HA GLN A 2 -1.994 -3.019 -5.849 1.00 64.11 H new ATOM 0 HB2 GLN A 2 -2.855 -2.510 -2.984 1.00 22.53 H new ATOM 0 HB3 GLN A 2 -2.169 -3.979 -3.649 1.00 22.53 H new ATOM 0 HG2 GLN A 2 -0.009 -2.888 -3.975 1.00 72.51 H new ATOM 0 HG3 GLN A 2 -0.672 -1.341 -3.487 1.00 72.51 H new ATOM 0 HE21 GLN A 2 -2.152 -1.884 -1.255 1.00 23.54 H new ATOM 0 HE22 GLN A 2 -1.116 -2.531 0.021 1.00 23.54 H new ATOM 35 N GLN A 3 -4.336 -3.711 -6.193 1.00 64.12 N ATOM 36 CA GLN A 3 -5.714 -4.090 -6.482 1.00 43.10 C ATOM 37 C GLN A 3 -6.307 -4.901 -5.335 1.00 13.43 C ATOM 38 O GLN A 3 -7.522 -4.913 -5.134 1.00 21.30 O ATOM 39 CB GLN A 3 -5.782 -4.896 -7.780 1.00 41.14 C ATOM 40 CG GLN A 3 -7.199 -5.131 -8.277 1.00 33.23 C ATOM 41 CD GLN A 3 -8.031 -3.864 -8.291 1.00 44.50 C ATOM 42 OE1 GLN A 3 -7.884 -3.021 -9.177 1.00 73.45 O ATOM 43 NE2 GLN A 3 -8.910 -3.721 -7.306 1.00 51.25 N ATOM 0 H GLN A 3 -3.635 -4.238 -6.714 1.00 64.12 H new ATOM 0 HA GLN A 3 -6.299 -3.177 -6.598 1.00 43.10 H new ATOM 0 HB2 GLN A 3 -5.217 -4.374 -8.552 1.00 41.14 H new ATOM 0 HB3 GLN A 3 -5.296 -5.859 -7.626 1.00 41.14 H new ATOM 0 HG2 GLN A 3 -7.162 -5.548 -9.283 1.00 33.23 H new ATOM 0 HG3 GLN A 3 -7.684 -5.873 -7.642 1.00 33.23 H new ATOM 0 HE21 GLN A 3 -8.999 -4.445 -6.593 1.00 51.25 H new ATOM 0 HE22 GLN A 3 -9.496 -2.888 -7.263 1.00 51.25 H new ATOM 52 N ASP A 4 -5.443 -5.576 -4.585 1.00 72.13 N ATOM 53 CA ASP A 4 -5.882 -6.389 -3.457 1.00 61.30 C ATOM 54 C ASP A 4 -6.482 -5.517 -2.359 1.00 54.33 C ATOM 55 O ASP A 4 -7.150 -6.015 -1.452 1.00 43.52 O ATOM 56 CB ASP A 4 -4.711 -7.199 -2.899 1.00 23.14 C ATOM 57 CG ASP A 4 -5.165 -8.456 -2.182 1.00 50.34 C ATOM 58 OD1 ASP A 4 -6.373 -8.565 -1.884 1.00 21.21 O ATOM 59 OD2 ASP A 4 -4.313 -9.330 -1.921 1.00 61.12 O ATOM 0 H ASP A 4 -4.435 -5.576 -4.738 1.00 72.13 H new ATOM 0 HA ASP A 4 -6.651 -7.074 -3.813 1.00 61.30 H new ATOM 0 HB2 ASP A 4 -4.040 -7.471 -3.714 1.00 23.14 H new ATOM 0 HB3 ASP A 4 -4.139 -6.578 -2.210 1.00 23.14 H new ATOM 64 N ASP A 5 -6.240 -4.214 -2.448 1.00 11.44 N ATOM 65 CA ASP A 5 -6.757 -3.271 -1.462 1.00 22.21 C ATOM 66 C ASP A 5 -7.166 -1.960 -2.126 1.00 22.11 C ATOM 67 O ASP A 5 -6.474 -0.949 -2.005 1.00 64.21 O ATOM 68 CB ASP A 5 -5.708 -3.004 -0.381 1.00 70.51 C ATOM 69 CG ASP A 5 -5.481 -4.207 0.514 1.00 4.32 C ATOM 70 OD1 ASP A 5 -6.285 -4.413 1.447 1.00 1.43 O ATOM 71 OD2 ASP A 5 -4.499 -4.942 0.281 1.00 22.11 O ATOM 0 H ASP A 5 -5.689 -3.786 -3.192 1.00 11.44 H new ATOM 0 HA ASP A 5 -7.639 -3.714 -1.000 1.00 22.21 H new ATOM 0 HB2 ASP A 5 -4.767 -2.723 -0.853 1.00 70.51 H new ATOM 0 HB3 ASP A 5 -6.025 -2.157 0.227 1.00 70.51 H new ATOM 76 N ASP A 6 -8.293 -1.985 -2.828 1.00 35.03 N ATOM 77 CA ASP A 6 -8.795 -0.798 -3.511 1.00 60.52 C ATOM 78 C ASP A 6 -9.913 -0.140 -2.708 1.00 63.42 C ATOM 79 O ASP A 6 -10.083 -0.416 -1.520 1.00 41.33 O ATOM 80 CB ASP A 6 -9.300 -1.164 -4.908 1.00 14.32 C ATOM 81 CG ASP A 6 -8.955 -0.111 -5.942 1.00 44.23 C ATOM 82 OD1 ASP A 6 -8.797 1.068 -5.560 1.00 73.12 O ATOM 83 OD2 ASP A 6 -8.841 -0.466 -7.134 1.00 45.40 O ATOM 0 H ASP A 6 -8.877 -2.814 -2.939 1.00 35.03 H new ATOM 0 HA ASP A 6 -7.974 -0.087 -3.604 1.00 60.52 H new ATOM 0 HB2 ASP A 6 -8.869 -2.119 -5.208 1.00 14.32 H new ATOM 0 HB3 ASP A 6 -10.381 -1.298 -4.877 1.00 14.32 H new ATOM 88 N PHE A 7 -10.672 0.731 -3.364 1.00 45.23 N ATOM 89 CA PHE A 7 -11.772 1.431 -2.711 1.00 61.51 C ATOM 90 C PHE A 7 -12.628 0.461 -1.902 1.00 14.02 C ATOM 91 O PHE A 7 -13.234 0.840 -0.900 1.00 11.40 O ATOM 92 CB PHE A 7 -12.637 2.148 -3.750 1.00 24.31 C ATOM 93 CG PHE A 7 -13.387 3.325 -3.195 1.00 61.15 C ATOM 94 CD1 PHE A 7 -12.723 4.320 -2.497 1.00 44.21 C ATOM 95 CD2 PHE A 7 -14.757 3.436 -3.372 1.00 63.33 C ATOM 96 CE1 PHE A 7 -13.410 5.405 -1.986 1.00 10.00 C ATOM 97 CE2 PHE A 7 -15.449 4.518 -2.864 1.00 13.31 C ATOM 98 CZ PHE A 7 -14.775 5.503 -2.169 1.00 14.52 C ATOM 0 H PHE A 7 -10.546 0.969 -4.348 1.00 45.23 H new ATOM 0 HA PHE A 7 -11.348 2.169 -2.031 1.00 61.51 H new ATOM 0 HB2 PHE A 7 -12.002 2.485 -4.569 1.00 24.31 H new ATOM 0 HB3 PHE A 7 -13.350 1.438 -4.170 1.00 24.31 H new ATOM 0 HD1 PHE A 7 -11.655 4.247 -2.350 1.00 44.21 H new ATOM 0 HD2 PHE A 7 -15.289 2.668 -3.913 1.00 63.33 H new ATOM 0 HE1 PHE A 7 -12.880 6.175 -1.445 1.00 10.00 H new ATOM 0 HE2 PHE A 7 -16.516 4.594 -3.010 1.00 13.31 H new ATOM 0 HZ PHE A 7 -15.315 6.349 -1.769 1.00 14.52 H new ATOM 108 N GLN A 8 -12.673 -0.791 -2.345 1.00 73.21 N ATOM 109 CA GLN A 8 -13.456 -1.815 -1.663 1.00 54.30 C ATOM 110 C GLN A 8 -13.155 -1.825 -0.168 1.00 42.21 C ATOM 111 O GLN A 8 -14.051 -1.654 0.657 1.00 52.22 O ATOM 112 CB GLN A 8 -13.168 -3.192 -2.263 1.00 4.10 C ATOM 113 CG GLN A 8 -13.542 -4.345 -1.346 1.00 62.43 C ATOM 114 CD GLN A 8 -14.130 -5.522 -2.099 1.00 61.35 C ATOM 115 OE1 GLN A 8 -13.603 -6.634 -2.046 1.00 74.11 O ATOM 116 NE2 GLN A 8 -15.228 -5.284 -2.807 1.00 40.40 N ATOM 0 H GLN A 8 -12.177 -1.121 -3.173 1.00 73.21 H new ATOM 0 HA GLN A 8 -14.512 -1.581 -1.801 1.00 54.30 H new ATOM 0 HB2 GLN A 8 -13.715 -3.292 -3.201 1.00 4.10 H new ATOM 0 HB3 GLN A 8 -12.107 -3.260 -2.504 1.00 4.10 H new ATOM 0 HG2 GLN A 8 -12.657 -4.673 -0.801 1.00 62.43 H new ATOM 0 HG3 GLN A 8 -14.261 -3.996 -0.605 1.00 62.43 H new ATOM 0 HE21 GLN A 8 -15.631 -4.347 -2.823 1.00 40.40 H new ATOM 0 HE22 GLN A 8 -15.668 -6.038 -3.335 1.00 40.40 H new ATOM 125 N ASN A 9 -11.886 -2.027 0.173 1.00 13.13 N ATOM 126 CA ASN A 9 -11.467 -2.060 1.570 1.00 64.34 C ATOM 127 C ASN A 9 -11.922 -0.803 2.305 1.00 70.42 C ATOM 128 O ASN A 9 -12.538 -0.882 3.368 1.00 4.11 O ATOM 129 CB ASN A 9 -9.946 -2.197 1.663 1.00 5.45 C ATOM 130 CG ASN A 9 -9.487 -3.638 1.557 1.00 24.12 C ATOM 131 OD1 ASN A 9 -8.741 -4.128 2.406 1.00 73.12 O ATOM 132 ND2 ASN A 9 -9.931 -4.325 0.511 1.00 42.31 N ATOM 0 H ASN A 9 -11.131 -2.170 -0.498 1.00 13.13 H new ATOM 0 HA ASN A 9 -11.933 -2.924 2.044 1.00 64.34 H new ATOM 0 HB2 ASN A 9 -9.482 -1.612 0.869 1.00 5.45 H new ATOM 0 HB3 ASN A 9 -9.604 -1.778 2.609 1.00 5.45 H new ATOM 0 HD21 ASN A 9 -9.655 -5.299 0.386 1.00 42.31 H new ATOM 0 HD22 ASN A 9 -10.548 -3.879 -0.168 1.00 42.31 H new ATOM 139 N PHE A 10 -11.616 0.355 1.730 1.00 3.14 N ATOM 140 CA PHE A 10 -11.993 1.629 2.331 1.00 40.43 C ATOM 141 C PHE A 10 -13.500 1.696 2.564 1.00 45.04 C ATOM 142 O PHE A 10 -13.964 1.691 3.704 1.00 43.12 O ATOM 143 CB PHE A 10 -11.552 2.789 1.436 1.00 52.45 C ATOM 144 CG PHE A 10 -11.467 4.104 2.157 1.00 43.13 C ATOM 145 CD1 PHE A 10 -10.608 4.265 3.232 1.00 20.22 C ATOM 146 CD2 PHE A 10 -12.245 5.179 1.759 1.00 44.41 C ATOM 147 CE1 PHE A 10 -10.528 5.473 3.898 1.00 51.30 C ATOM 148 CE2 PHE A 10 -12.169 6.391 2.421 1.00 63.43 C ATOM 149 CZ PHE A 10 -11.308 6.538 3.491 1.00 74.10 C ATOM 0 H PHE A 10 -11.108 0.438 0.849 1.00 3.14 H new ATOM 0 HA PHE A 10 -11.490 1.711 3.295 1.00 40.43 H new ATOM 0 HB2 PHE A 10 -10.578 2.556 1.006 1.00 52.45 H new ATOM 0 HB3 PHE A 10 -12.252 2.883 0.606 1.00 52.45 H new ATOM 0 HD1 PHE A 10 -9.994 3.437 3.553 1.00 20.22 H new ATOM 0 HD2 PHE A 10 -12.919 5.069 0.922 1.00 44.41 H new ATOM 0 HE1 PHE A 10 -9.856 5.584 4.736 1.00 51.30 H new ATOM 0 HE2 PHE A 10 -12.782 7.221 2.102 1.00 63.43 H new ATOM 0 HZ PHE A 10 -11.245 7.484 4.008 1.00 74.10 H new ATOM 159 N VAL A 11 -14.259 1.759 1.474 1.00 24.11 N ATOM 160 CA VAL A 11 -15.713 1.826 1.558 1.00 4.13 C ATOM 161 C VAL A 11 -16.258 0.762 2.504 1.00 11.33 C ATOM 162 O VAL A 11 -17.128 1.038 3.330 1.00 51.34 O ATOM 163 CB VAL A 11 -16.364 1.649 0.174 1.00 63.23 C ATOM 164 CG1 VAL A 11 -17.530 0.675 0.253 1.00 41.44 C ATOM 165 CG2 VAL A 11 -16.816 2.992 -0.378 1.00 13.33 C ATOM 0 H VAL A 11 -13.891 1.765 0.523 1.00 24.11 H new ATOM 0 HA VAL A 11 -15.963 2.814 1.945 1.00 4.13 H new ATOM 0 HB VAL A 11 -15.621 1.234 -0.507 1.00 63.23 H new ATOM 0 HG11 VAL A 11 -17.978 0.563 -0.734 1.00 41.44 H new ATOM 0 HG12 VAL A 11 -17.172 -0.294 0.602 1.00 41.44 H new ATOM 0 HG13 VAL A 11 -18.277 1.057 0.949 1.00 41.44 H new ATOM 0 HG21 VAL A 11 -17.274 2.848 -1.357 1.00 13.33 H new ATOM 0 HG22 VAL A 11 -17.543 3.438 0.300 1.00 13.33 H new ATOM 0 HG23 VAL A 11 -15.956 3.654 -0.474 1.00 13.33 H new ATOM 175 N ALA A 12 -15.740 -0.455 2.379 1.00 72.25 N ATOM 176 CA ALA A 12 -16.173 -1.561 3.224 1.00 13.30 C ATOM 177 C ALA A 12 -16.084 -1.190 4.701 1.00 74.15 C ATOM 178 O ALA A 12 -17.042 -1.365 5.455 1.00 71.53 O ATOM 179 CB ALA A 12 -15.340 -2.802 2.938 1.00 15.53 C ATOM 0 H ALA A 12 -15.019 -0.700 1.700 1.00 72.25 H new ATOM 0 HA ALA A 12 -17.216 -1.776 2.992 1.00 13.30 H new ATOM 0 HB1 ALA A 12 -15.675 -3.620 3.576 1.00 15.53 H new ATOM 0 HB2 ALA A 12 -15.458 -3.086 1.892 1.00 15.53 H new ATOM 0 HB3 ALA A 12 -14.290 -2.590 3.140 1.00 15.53 H new ATOM 185 N THR A 13 -14.928 -0.677 5.109 1.00 41.24 N ATOM 186 CA THR A 13 -14.713 -0.283 6.495 1.00 33.34 C ATOM 187 C THR A 13 -15.742 0.751 6.939 1.00 63.21 C ATOM 188 O THR A 13 -16.404 0.583 7.964 1.00 3.01 O ATOM 189 CB THR A 13 -13.300 0.293 6.704 1.00 60.05 C ATOM 190 OG1 THR A 13 -12.319 -0.620 6.199 1.00 73.15 O ATOM 191 CG2 THR A 13 -13.037 0.563 8.177 1.00 14.14 C ATOM 0 H THR A 13 -14.125 -0.525 4.498 1.00 41.24 H new ATOM 0 HA THR A 13 -14.823 -1.184 7.099 1.00 33.34 H new ATOM 0 HB THR A 13 -13.233 1.236 6.161 1.00 60.05 H new ATOM 0 HG1 THR A 13 -12.327 -0.600 5.219 1.00 73.15 H new ATOM 0 HG21 THR A 13 -12.033 0.969 8.299 1.00 14.14 H new ATOM 0 HG22 THR A 13 -13.767 1.281 8.551 1.00 14.14 H new ATOM 0 HG23 THR A 13 -13.123 -0.367 8.738 1.00 14.14 H new ATOM 199 N LEU A 14 -15.872 1.820 6.161 1.00 30.23 N ATOM 200 CA LEU A 14 -16.822 2.882 6.474 1.00 42.12 C ATOM 201 C LEU A 14 -18.233 2.323 6.628 1.00 43.23 C ATOM 202 O LEU A 14 -18.878 2.518 7.657 1.00 72.20 O ATOM 203 CB LEU A 14 -16.801 3.950 5.379 1.00 3.41 C ATOM 204 CG LEU A 14 -17.127 5.376 5.826 1.00 23.11 C ATOM 205 CD1 LEU A 14 -16.133 5.846 6.877 1.00 34.03 C ATOM 206 CD2 LEU A 14 -17.131 6.321 4.633 1.00 20.13 C ATOM 0 H LEU A 14 -15.332 1.974 5.310 1.00 30.23 H new ATOM 0 HA LEU A 14 -16.525 3.334 7.420 1.00 42.12 H new ATOM 0 HB2 LEU A 14 -15.812 3.952 4.920 1.00 3.41 H new ATOM 0 HB3 LEU A 14 -17.512 3.662 4.605 1.00 3.41 H new ATOM 0 HG LEU A 14 -18.123 5.379 6.270 1.00 23.11 H new ATOM 0 HD11 LEU A 14 -16.381 6.862 7.183 1.00 34.03 H new ATOM 0 HD12 LEU A 14 -16.179 5.185 7.743 1.00 34.03 H new ATOM 0 HD13 LEU A 14 -15.126 5.828 6.460 1.00 34.03 H new ATOM 0 HD21 LEU A 14 -17.365 7.331 4.970 1.00 20.13 H new ATOM 0 HD22 LEU A 14 -16.149 6.314 4.160 1.00 20.13 H new ATOM 0 HD23 LEU A 14 -17.882 5.995 3.913 1.00 20.13 H new ATOM 218 N GLU A 15 -18.703 1.626 5.598 1.00 53.50 N ATOM 219 CA GLU A 15 -20.037 1.038 5.620 1.00 14.24 C ATOM 220 C GLU A 15 -20.264 0.252 6.909 1.00 42.14 C ATOM 221 O GLU A 15 -21.190 0.537 7.667 1.00 34.34 O ATOM 222 CB GLU A 15 -20.236 0.123 4.410 1.00 10.42 C ATOM 223 CG GLU A 15 -20.001 0.816 3.078 1.00 2.04 C ATOM 224 CD GLU A 15 -21.287 1.068 2.317 1.00 74.15 C ATOM 225 OE1 GLU A 15 -21.976 2.062 2.629 1.00 72.11 O ATOM 226 OE2 GLU A 15 -21.606 0.272 1.409 1.00 63.22 O ATOM 0 H GLU A 15 -18.180 1.455 4.739 1.00 53.50 H new ATOM 0 HA GLU A 15 -20.764 1.849 5.576 1.00 14.24 H new ATOM 0 HB2 GLU A 15 -19.559 -0.727 4.492 1.00 10.42 H new ATOM 0 HB3 GLU A 15 -21.251 -0.275 4.429 1.00 10.42 H new ATOM 0 HG2 GLU A 15 -19.494 1.765 3.251 1.00 2.04 H new ATOM 0 HG3 GLU A 15 -19.336 0.206 2.468 1.00 2.04 H new ATOM 233 N SER A 16 -19.411 -0.739 7.148 1.00 4.40 N ATOM 234 CA SER A 16 -19.519 -1.569 8.342 1.00 72.35 C ATOM 235 C SER A 16 -19.470 -0.715 9.604 1.00 14.25 C ATOM 236 O SER A 16 -20.041 -1.075 10.634 1.00 21.33 O ATOM 237 CB SER A 16 -18.395 -2.607 8.370 1.00 14.04 C ATOM 238 OG SER A 16 -18.613 -3.566 9.391 1.00 60.14 O ATOM 0 H SER A 16 -18.638 -0.987 6.531 1.00 4.40 H new ATOM 0 HA SER A 16 -20.479 -2.084 8.311 1.00 72.35 H new ATOM 0 HB2 SER A 16 -18.333 -3.107 7.404 1.00 14.04 H new ATOM 0 HB3 SER A 16 -17.439 -2.109 8.532 1.00 14.04 H new ATOM 0 HG SER A 16 -17.882 -4.219 9.388 1.00 60.14 H new ATOM 244 N PHE A 17 -18.785 0.420 9.517 1.00 4.12 N ATOM 245 CA PHE A 17 -18.659 1.327 10.652 1.00 33.14 C ATOM 246 C PHE A 17 -20.033 1.743 11.170 1.00 30.23 C ATOM 247 O PHE A 17 -20.388 1.464 12.316 1.00 52.42 O ATOM 248 CB PHE A 17 -17.855 2.566 10.256 1.00 45.32 C ATOM 249 CG PHE A 17 -16.863 2.997 11.299 1.00 33.51 C ATOM 250 CD1 PHE A 17 -17.178 2.919 12.646 1.00 11.52 C ATOM 251 CD2 PHE A 17 -15.617 3.477 10.933 1.00 44.43 C ATOM 252 CE1 PHE A 17 -16.268 3.315 13.608 1.00 11.51 C ATOM 253 CE2 PHE A 17 -14.702 3.875 11.890 1.00 33.52 C ATOM 254 CZ PHE A 17 -15.028 3.792 13.230 1.00 52.43 C ATOM 0 H PHE A 17 -18.308 0.734 8.672 1.00 4.12 H new ATOM 0 HA PHE A 17 -18.133 0.801 11.449 1.00 33.14 H new ATOM 0 HB2 PHE A 17 -17.326 2.363 9.325 1.00 45.32 H new ATOM 0 HB3 PHE A 17 -18.543 3.388 10.059 1.00 45.32 H new ATOM 0 HD1 PHE A 17 -18.145 2.545 12.948 1.00 11.52 H new ATOM 0 HD2 PHE A 17 -15.357 3.541 9.887 1.00 44.43 H new ATOM 0 HE1 PHE A 17 -16.526 3.252 14.655 1.00 11.51 H new ATOM 0 HE2 PHE A 17 -13.734 4.250 11.591 1.00 33.52 H new ATOM 0 HZ PHE A 17 -14.315 4.099 13.980 1.00 52.43 H new ATOM 264 N LYS A 18 -20.802 2.412 10.318 1.00 10.23 N ATOM 265 CA LYS A 18 -22.137 2.867 10.687 1.00 13.30 C ATOM 266 C LYS A 18 -23.006 1.697 11.137 1.00 71.14 C ATOM 267 O LYS A 18 -23.837 1.837 12.034 1.00 55.53 O ATOM 268 CB LYS A 18 -22.798 3.583 9.507 1.00 14.31 C ATOM 269 CG LYS A 18 -22.800 2.769 8.225 1.00 44.12 C ATOM 270 CD LYS A 18 -23.750 3.354 7.194 1.00 52.02 C ATOM 271 CE LYS A 18 -23.972 2.396 6.034 1.00 74.23 C ATOM 272 NZ LYS A 18 -23.991 3.105 4.724 1.00 33.13 N ATOM 0 H LYS A 18 -20.523 2.651 9.366 1.00 10.23 H new ATOM 0 HA LYS A 18 -22.039 3.564 11.519 1.00 13.30 H new ATOM 0 HB2 LYS A 18 -23.826 3.830 9.772 1.00 14.31 H new ATOM 0 HB3 LYS A 18 -22.280 4.525 9.328 1.00 14.31 H new ATOM 0 HG2 LYS A 18 -21.791 2.735 7.813 1.00 44.12 H new ATOM 0 HG3 LYS A 18 -23.089 1.742 8.446 1.00 44.12 H new ATOM 0 HD2 LYS A 18 -24.705 3.583 7.666 1.00 52.02 H new ATOM 0 HD3 LYS A 18 -23.347 4.295 6.819 1.00 52.02 H new ATOM 0 HE2 LYS A 18 -23.183 1.644 6.028 1.00 74.23 H new ATOM 0 HE3 LYS A 18 -24.915 1.868 6.175 1.00 74.23 H new ATOM 0 HZ1 LYS A 18 -24.932 3.009 4.291 1.00 33.13 H new ATOM 0 HZ2 LYS A 18 -23.779 4.112 4.871 1.00 33.13 H new ATOM 0 HZ3 LYS A 18 -23.276 2.689 4.094 1.00 33.13 H new ATOM 286 N ASP A 19 -22.807 0.543 10.509 1.00 11.11 N ATOM 287 CA ASP A 19 -23.571 -0.652 10.847 1.00 62.53 C ATOM 288 C ASP A 19 -23.446 -0.976 12.332 1.00 2.33 C ATOM 289 O ASP A 19 -24.302 -1.649 12.906 1.00 35.53 O ATOM 290 CB ASP A 19 -23.093 -1.841 10.011 1.00 31.45 C ATOM 291 CG ASP A 19 -24.073 -2.998 10.037 1.00 21.03 C ATOM 292 OD1 ASP A 19 -24.293 -3.564 11.128 1.00 21.31 O ATOM 293 OD2 ASP A 19 -24.619 -3.337 8.966 1.00 30.45 O ATOM 0 H ASP A 19 -22.123 0.410 9.764 1.00 11.11 H new ATOM 0 HA ASP A 19 -24.620 -0.458 10.624 1.00 62.53 H new ATOM 0 HB2 ASP A 19 -22.942 -1.520 8.980 1.00 31.45 H new ATOM 0 HB3 ASP A 19 -22.126 -2.179 10.384 1.00 31.45 H new ATOM 298 N LEU A 20 -22.373 -0.492 12.949 1.00 34.24 N ATOM 299 CA LEU A 20 -22.135 -0.730 14.369 1.00 71.22 C ATOM 300 C LEU A 20 -23.303 -0.225 15.209 1.00 13.23 C ATOM 301 O LEU A 20 -24.312 0.238 14.676 1.00 43.30 O ATOM 302 CB LEU A 20 -20.840 -0.046 14.811 1.00 54.34 C ATOM 303 CG LEU A 20 -19.542 -0.675 14.305 1.00 60.14 C ATOM 304 CD1 LEU A 20 -18.426 0.358 14.270 1.00 73.24 C ATOM 305 CD2 LEU A 20 -19.148 -1.859 15.176 1.00 12.10 C ATOM 0 H LEU A 20 -21.655 0.067 12.489 1.00 34.24 H new ATOM 0 HA LEU A 20 -22.041 -1.805 14.521 1.00 71.22 H new ATOM 0 HB2 LEU A 20 -20.870 0.992 14.480 1.00 54.34 H new ATOM 0 HB3 LEU A 20 -20.813 -0.033 15.901 1.00 54.34 H new ATOM 0 HG LEU A 20 -19.707 -1.035 13.290 1.00 60.14 H new ATOM 0 HD11 LEU A 20 -17.510 -0.108 13.907 1.00 73.24 H new ATOM 0 HD12 LEU A 20 -18.706 1.174 13.604 1.00 73.24 H new ATOM 0 HD13 LEU A 20 -18.261 0.749 15.274 1.00 73.24 H new ATOM 0 HD21 LEU A 20 -18.222 -2.294 14.801 1.00 12.10 H new ATOM 0 HD22 LEU A 20 -19.001 -1.523 16.202 1.00 12.10 H new ATOM 0 HD23 LEU A 20 -19.938 -2.609 15.149 1.00 12.10 H new ATOM 317 N LYS A 21 -23.160 -0.315 16.527 1.00 1.02 N ATOM 318 CA LYS A 21 -24.201 0.136 17.443 1.00 22.13 C ATOM 319 C LYS A 21 -23.793 1.433 18.135 1.00 65.31 C ATOM 320 O LYS A 21 -24.604 2.073 18.803 1.00 30.13 O ATOM 321 CB LYS A 21 -24.491 -0.943 18.489 1.00 2.12 C ATOM 322 CG LYS A 21 -23.247 -1.664 18.980 1.00 74.54 C ATOM 323 CD LYS A 21 -22.290 -0.714 19.678 1.00 43.54 C ATOM 324 CE LYS A 21 -21.480 -1.426 20.750 1.00 2.21 C ATOM 325 NZ LYS A 21 -20.204 -1.972 20.210 1.00 3.24 N ATOM 0 H LYS A 21 -22.332 -0.697 16.985 1.00 1.02 H new ATOM 0 HA LYS A 21 -25.104 0.323 16.863 1.00 22.13 H new ATOM 0 HB2 LYS A 21 -24.996 -0.486 19.340 1.00 2.12 H new ATOM 0 HB3 LYS A 21 -25.180 -1.673 18.064 1.00 2.12 H new ATOM 0 HG2 LYS A 21 -23.534 -2.461 19.666 1.00 74.54 H new ATOM 0 HG3 LYS A 21 -22.742 -2.136 18.137 1.00 74.54 H new ATOM 0 HD2 LYS A 21 -21.616 -0.272 18.945 1.00 43.54 H new ATOM 0 HD3 LYS A 21 -22.852 0.104 20.129 1.00 43.54 H new ATOM 0 HE2 LYS A 21 -21.263 -0.732 21.562 1.00 2.21 H new ATOM 0 HE3 LYS A 21 -22.072 -2.237 21.173 1.00 2.21 H new ATOM 0 HZ1 LYS A 21 -19.585 -2.251 20.998 1.00 3.24 H new ATOM 0 HZ2 LYS A 21 -20.405 -2.802 19.617 1.00 3.24 H new ATOM 0 HZ3 LYS A 21 -19.730 -1.244 19.638 1.00 3.24 H new ATOM 339 N SER A 22 -22.530 1.815 17.968 1.00 34.14 N ATOM 340 CA SER A 22 -22.014 3.035 18.579 1.00 72.52 C ATOM 341 C SER A 22 -21.449 3.975 17.519 1.00 3.10 C ATOM 342 O SER A 22 -21.799 5.153 17.468 1.00 2.42 O ATOM 343 CB SER A 22 -20.933 2.697 19.607 1.00 44.11 C ATOM 344 OG SER A 22 -21.482 2.009 20.718 1.00 44.34 O ATOM 0 H SER A 22 -21.846 1.298 17.415 1.00 34.14 H new ATOM 0 HA SER A 22 -22.839 3.538 19.083 1.00 72.52 H new ATOM 0 HB2 SER A 22 -20.162 2.084 19.140 1.00 44.11 H new ATOM 0 HB3 SER A 22 -20.450 3.613 19.946 1.00 44.11 H new ATOM 0 HG SER A 22 -20.770 1.803 21.359 1.00 44.34 H new ATOM 350 N GLY A 23 -20.571 3.444 16.673 1.00 3.32 N ATOM 351 CA GLY A 23 -19.970 4.249 15.626 1.00 41.13 C ATOM 352 C GLY A 23 -18.513 4.566 15.901 1.00 33.41 C ATOM 353 O GLY A 23 -17.968 5.528 15.361 1.00 3.51 O ATOM 0 H GLY A 23 -20.266 2.471 16.694 1.00 3.32 H new ATOM 0 HA2 GLY A 23 -20.051 3.722 14.675 1.00 41.13 H new ATOM 0 HA3 GLY A 23 -20.528 5.180 15.523 1.00 41.13 H new ATOM 357 N ILE A 24 -17.883 3.755 16.744 1.00 4.22 N ATOM 358 CA ILE A 24 -16.481 3.955 17.090 1.00 22.44 C ATOM 359 C ILE A 24 -15.742 2.624 17.179 1.00 23.31 C ATOM 360 O ILE A 24 -16.065 1.777 18.012 1.00 70.33 O ATOM 361 CB ILE A 24 -16.332 4.702 18.429 1.00 73.30 C ATOM 362 CG1 ILE A 24 -17.135 6.004 18.403 1.00 0.00 C ATOM 363 CG2 ILE A 24 -14.865 4.983 18.719 1.00 74.13 C ATOM 364 CD1 ILE A 24 -16.618 7.012 17.401 1.00 55.34 C ATOM 0 H ILE A 24 -18.320 2.954 17.200 1.00 4.22 H new ATOM 0 HA ILE A 24 -16.043 4.559 16.296 1.00 22.44 H new ATOM 0 HB ILE A 24 -16.725 4.071 19.226 1.00 73.30 H new ATOM 0 HG12 ILE A 24 -18.175 5.775 18.172 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -17.120 6.451 19.397 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -14.776 5.511 19.668 1.00 74.13 H new ATOM 0 HG22 ILE A 24 -14.318 4.042 18.775 1.00 74.13 H new ATOM 0 HG23 ILE A 24 -14.448 5.598 17.921 1.00 74.13 H new ATOM 0 HD11 ILE A 24 -17.235 7.910 17.437 1.00 55.34 H new ATOM 0 HD12 ILE A 24 -15.587 7.270 17.643 1.00 55.34 H new ATOM 0 HD13 ILE A 24 -16.659 6.584 16.400 1.00 55.34 H new ATOM 376 N SER A 25 -14.746 2.447 16.316 1.00 14.20 N ATOM 377 CA SER A 25 -13.962 1.218 16.295 1.00 4.32 C ATOM 378 C SER A 25 -12.557 1.480 15.761 1.00 24.12 C ATOM 379 O SER A 25 -12.384 1.911 14.622 1.00 4.52 O ATOM 380 CB SER A 25 -14.656 0.159 15.438 1.00 75.05 C ATOM 381 OG SER A 25 -15.773 -0.393 16.114 1.00 50.44 O ATOM 0 H SER A 25 -14.463 3.139 15.622 1.00 14.20 H new ATOM 0 HA SER A 25 -13.881 0.850 17.318 1.00 4.32 H new ATOM 0 HB2 SER A 25 -14.980 0.603 14.497 1.00 75.05 H new ATOM 0 HB3 SER A 25 -13.949 -0.633 15.190 1.00 75.05 H new ATOM 0 HG SER A 25 -15.575 -0.461 17.071 1.00 50.44 H new ATOM 387 N GLY A 26 -11.555 1.215 16.594 1.00 23.12 N ATOM 388 CA GLY A 26 -10.177 1.428 16.189 1.00 34.54 C ATOM 389 C GLY A 26 -9.828 0.691 14.911 1.00 34.45 C ATOM 390 O GLY A 26 -9.279 1.277 13.979 1.00 10.10 O ATOM 0 H GLY A 26 -11.673 0.857 17.542 1.00 23.12 H new ATOM 0 HA2 GLY A 26 -10.004 2.495 16.048 1.00 34.54 H new ATOM 0 HA3 GLY A 26 -9.512 1.099 16.988 1.00 34.54 H new ATOM 394 N SER A 27 -10.146 -0.599 14.868 1.00 34.23 N ATOM 395 CA SER A 27 -9.858 -1.419 13.697 1.00 0.22 C ATOM 396 C SER A 27 -10.352 -0.739 12.424 1.00 61.44 C ATOM 397 O SER A 27 -9.602 -0.583 11.460 1.00 73.04 O ATOM 398 CB SER A 27 -10.509 -2.796 13.839 1.00 2.04 C ATOM 399 OG SER A 27 -10.526 -3.482 12.600 1.00 60.42 O ATOM 0 H SER A 27 -10.603 -1.099 15.631 1.00 34.23 H new ATOM 0 HA SER A 27 -8.777 -1.542 13.627 1.00 0.22 H new ATOM 0 HB2 SER A 27 -9.964 -3.385 14.577 1.00 2.04 H new ATOM 0 HB3 SER A 27 -11.528 -2.684 14.210 1.00 2.04 H new ATOM 0 HG SER A 27 -10.946 -4.360 12.718 1.00 60.42 H new ATOM 405 N ARG A 28 -11.619 -0.338 12.428 1.00 42.31 N ATOM 406 CA ARG A 28 -12.214 0.324 11.273 1.00 35.14 C ATOM 407 C ARG A 28 -11.398 1.547 10.866 1.00 23.31 C ATOM 408 O ARG A 28 -10.829 1.590 9.775 1.00 71.13 O ATOM 409 CB ARG A 28 -13.654 0.739 11.583 1.00 21.12 C ATOM 410 CG ARG A 28 -14.664 -0.383 11.402 1.00 44.44 C ATOM 411 CD ARG A 28 -14.400 -1.531 12.363 1.00 10.44 C ATOM 412 NE ARG A 28 -15.614 -2.285 12.661 1.00 75.32 N ATOM 413 CZ ARG A 28 -15.626 -3.411 13.367 1.00 51.44 C ATOM 414 NH1 ARG A 28 -14.494 -3.909 13.845 1.00 13.42 N ATOM 415 NH2 ARG A 28 -16.772 -4.040 13.595 1.00 4.13 N ATOM 0 H ARG A 28 -12.253 -0.460 13.218 1.00 42.31 H new ATOM 0 HA ARG A 28 -12.216 -0.382 10.443 1.00 35.14 H new ATOM 0 HB2 ARG A 28 -13.706 1.101 12.610 1.00 21.12 H new ATOM 0 HB3 ARG A 28 -13.930 1.573 10.937 1.00 21.12 H new ATOM 0 HG2 ARG A 28 -15.671 0.003 11.562 1.00 44.44 H new ATOM 0 HG3 ARG A 28 -14.623 -0.749 10.376 1.00 44.44 H new ATOM 0 HD2 ARG A 28 -13.654 -2.200 11.933 1.00 10.44 H new ATOM 0 HD3 ARG A 28 -13.980 -1.139 13.289 1.00 10.44 H new ATOM 0 HE ARG A 28 -16.502 -1.928 12.308 1.00 75.32 H new ATOM 0 HH11 ARG A 28 -13.612 -3.428 13.671 1.00 13.42 H new ATOM 0 HH12 ARG A 28 -14.506 -4.773 14.387 1.00 13.42 H new ATOM 0 HH21 ARG A 28 -17.644 -3.659 13.228 1.00 4.13 H new ATOM 0 HH22 ARG A 28 -16.780 -4.904 14.137 1.00 4.13 H new ATOM 429 N ILE A 29 -11.345 2.537 11.750 1.00 43.52 N ATOM 430 CA ILE A 29 -10.597 3.760 11.482 1.00 34.02 C ATOM 431 C ILE A 29 -9.188 3.447 10.992 1.00 70.54 C ATOM 432 O ILE A 29 -8.685 4.082 10.065 1.00 12.50 O ATOM 433 CB ILE A 29 -10.506 4.650 12.736 1.00 74.02 C ATOM 434 CG1 ILE A 29 -11.906 4.963 13.269 1.00 71.24 C ATOM 435 CG2 ILE A 29 -9.755 5.934 12.420 1.00 4.41 C ATOM 436 CD1 ILE A 29 -11.901 5.837 14.503 1.00 14.11 C ATOM 0 H ILE A 29 -11.810 2.517 12.657 1.00 43.52 H new ATOM 0 HA ILE A 29 -11.139 4.297 10.703 1.00 34.02 H new ATOM 0 HB ILE A 29 -9.956 4.111 13.507 1.00 74.02 H new ATOM 0 HG12 ILE A 29 -12.482 5.457 12.486 1.00 71.24 H new ATOM 0 HG13 ILE A 29 -12.416 4.027 13.498 1.00 71.24 H new ATOM 0 HG21 ILE A 29 -9.699 6.553 13.316 1.00 4.41 H new ATOM 0 HG22 ILE A 29 -8.747 5.692 12.082 1.00 4.41 H new ATOM 0 HG23 ILE A 29 -10.280 6.479 11.635 1.00 4.41 H new ATOM 0 HD11 ILE A 29 -12.927 6.018 14.825 1.00 14.11 H new ATOM 0 HD12 ILE A 29 -11.353 5.336 15.301 1.00 14.11 H new ATOM 0 HD13 ILE A 29 -11.420 6.788 14.274 1.00 14.11 H new ATOM 448 N LYS A 30 -8.555 2.460 11.618 1.00 11.41 N ATOM 449 CA LYS A 30 -7.204 2.059 11.244 1.00 33.55 C ATOM 450 C LYS A 30 -7.130 1.715 9.760 1.00 23.12 C ATOM 451 O LYS A 30 -6.338 2.295 9.017 1.00 65.40 O ATOM 452 CB LYS A 30 -6.758 0.857 12.080 1.00 31.41 C ATOM 453 CG LYS A 30 -6.146 1.239 13.416 1.00 25.44 C ATOM 454 CD LYS A 30 -4.632 1.106 13.394 1.00 30.34 C ATOM 455 CE LYS A 30 -4.183 -0.242 13.939 1.00 2.51 C ATOM 456 NZ LYS A 30 -4.573 -0.421 15.365 1.00 71.31 N ATOM 0 H LYS A 30 -8.956 1.923 12.387 1.00 11.41 H new ATOM 0 HA LYS A 30 -6.535 2.898 11.438 1.00 33.55 H new ATOM 0 HB2 LYS A 30 -7.616 0.208 12.255 1.00 31.41 H new ATOM 0 HB3 LYS A 30 -6.032 0.278 11.510 1.00 31.41 H new ATOM 0 HG2 LYS A 30 -6.419 2.265 13.662 1.00 25.44 H new ATOM 0 HG3 LYS A 30 -6.557 0.603 14.200 1.00 25.44 H new ATOM 0 HD2 LYS A 30 -4.270 1.226 12.373 1.00 30.34 H new ATOM 0 HD3 LYS A 30 -4.187 1.906 13.986 1.00 30.34 H new ATOM 0 HE2 LYS A 30 -4.621 -1.040 13.340 1.00 2.51 H new ATOM 0 HE3 LYS A 30 -3.101 -0.330 13.845 1.00 2.51 H new ATOM 0 HZ1 LYS A 30 -3.800 -0.888 15.880 1.00 71.31 H new ATOM 0 HZ2 LYS A 30 -4.763 0.508 15.792 1.00 71.31 H new ATOM 0 HZ3 LYS A 30 -5.429 -1.009 15.420 1.00 71.31 H new ATOM 470 N LYS A 31 -7.960 0.770 9.334 1.00 75.40 N ATOM 471 CA LYS A 31 -7.991 0.350 7.938 1.00 54.11 C ATOM 472 C LYS A 31 -8.168 1.550 7.013 1.00 42.20 C ATOM 473 O LYS A 31 -7.435 1.707 6.035 1.00 21.45 O ATOM 474 CB LYS A 31 -9.124 -0.653 7.710 1.00 32.44 C ATOM 475 CG LYS A 31 -8.720 -2.095 7.966 1.00 61.14 C ATOM 476 CD LYS A 31 -8.530 -2.367 9.449 1.00 54.05 C ATOM 477 CE LYS A 31 -7.936 -3.746 9.691 1.00 42.22 C ATOM 478 NZ LYS A 31 -8.351 -4.306 11.007 1.00 53.42 N ATOM 0 H LYS A 31 -8.621 0.280 9.936 1.00 75.40 H new ATOM 0 HA LYS A 31 -7.039 -0.128 7.708 1.00 54.11 H new ATOM 0 HB2 LYS A 31 -9.960 -0.398 8.361 1.00 32.44 H new ATOM 0 HB3 LYS A 31 -9.479 -0.561 6.684 1.00 32.44 H new ATOM 0 HG2 LYS A 31 -9.483 -2.764 7.568 1.00 61.14 H new ATOM 0 HG3 LYS A 31 -7.795 -2.314 7.434 1.00 61.14 H new ATOM 0 HD2 LYS A 31 -7.876 -1.608 9.878 1.00 54.05 H new ATOM 0 HD3 LYS A 31 -9.489 -2.288 9.960 1.00 54.05 H new ATOM 0 HE2 LYS A 31 -8.249 -4.421 8.894 1.00 42.22 H new ATOM 0 HE3 LYS A 31 -6.849 -3.685 9.649 1.00 42.22 H new ATOM 0 HZ1 LYS A 31 -8.567 -5.318 10.901 1.00 53.42 H new ATOM 0 HZ2 LYS A 31 -7.579 -4.187 11.694 1.00 53.42 H new ATOM 0 HZ3 LYS A 31 -9.197 -3.805 11.346 1.00 53.42 H new ATOM 492 N LEU A 32 -9.143 2.396 7.328 1.00 22.30 N ATOM 493 CA LEU A 32 -9.414 3.583 6.526 1.00 54.52 C ATOM 494 C LEU A 32 -8.172 4.462 6.415 1.00 32.33 C ATOM 495 O LEU A 32 -7.749 4.824 5.317 1.00 74.44 O ATOM 496 CB LEU A 32 -10.566 4.384 7.137 1.00 22.42 C ATOM 497 CG LEU A 32 -11.938 3.709 7.115 1.00 51.34 C ATOM 498 CD1 LEU A 32 -12.786 4.185 8.284 1.00 23.33 C ATOM 499 CD2 LEU A 32 -12.645 3.983 5.795 1.00 11.12 C ATOM 0 H LEU A 32 -9.759 2.282 8.133 1.00 22.30 H new ATOM 0 HA LEU A 32 -9.696 3.257 5.525 1.00 54.52 H new ATOM 0 HB2 LEU A 32 -10.313 4.614 8.172 1.00 22.42 H new ATOM 0 HB3 LEU A 32 -10.642 5.334 6.608 1.00 22.42 H new ATOM 0 HG LEU A 32 -11.794 2.633 7.212 1.00 51.34 H new ATOM 0 HD11 LEU A 32 -13.759 3.694 8.252 1.00 23.33 H new ATOM 0 HD12 LEU A 32 -12.286 3.938 9.221 1.00 23.33 H new ATOM 0 HD13 LEU A 32 -12.922 5.264 8.219 1.00 23.33 H new ATOM 0 HD21 LEU A 32 -13.620 3.495 5.796 1.00 11.12 H new ATOM 0 HD22 LEU A 32 -12.777 5.058 5.669 1.00 11.12 H new ATOM 0 HD23 LEU A 32 -12.045 3.592 4.973 1.00 11.12 H new ATOM 511 N THR A 33 -7.589 4.800 7.561 1.00 11.31 N ATOM 512 CA THR A 33 -6.395 5.635 7.594 1.00 63.15 C ATOM 513 C THR A 33 -5.265 5.010 6.783 1.00 53.15 C ATOM 514 O THR A 33 -4.928 5.486 5.698 1.00 2.41 O ATOM 515 CB THR A 33 -5.909 5.864 9.037 1.00 2.41 C ATOM 516 OG1 THR A 33 -7.013 6.228 9.874 1.00 44.25 O ATOM 517 CG2 THR A 33 -4.849 6.955 9.084 1.00 32.14 C ATOM 0 H THR A 33 -7.925 4.508 8.479 1.00 11.31 H new ATOM 0 HA THR A 33 -6.668 6.594 7.154 1.00 63.15 H new ATOM 0 HB THR A 33 -5.469 4.935 9.401 1.00 2.41 H new ATOM 0 HG1 THR A 33 -7.541 5.430 10.084 1.00 44.25 H new ATOM 0 HG21 THR A 33 -4.521 7.099 10.113 1.00 32.14 H new ATOM 0 HG22 THR A 33 -3.998 6.662 8.469 1.00 32.14 H new ATOM 0 HG23 THR A 33 -5.268 7.886 8.703 1.00 32.14 H new ATOM 525 N THR A 34 -4.683 3.940 7.314 1.00 31.40 N ATOM 526 CA THR A 34 -3.591 3.250 6.640 1.00 62.54 C ATOM 527 C THR A 34 -3.853 3.136 5.142 1.00 14.23 C ATOM 528 O THR A 34 -2.965 3.381 4.326 1.00 25.31 O ATOM 529 CB THR A 34 -3.374 1.839 7.220 1.00 52.14 C ATOM 530 OG1 THR A 34 -2.266 1.207 6.570 1.00 44.21 O ATOM 531 CG2 THR A 34 -4.622 0.986 7.048 1.00 12.15 C ATOM 0 H THR A 34 -4.950 3.532 8.210 1.00 31.40 H new ATOM 0 HA THR A 34 -2.693 3.845 6.805 1.00 62.54 H new ATOM 0 HB THR A 34 -3.163 1.937 8.285 1.00 52.14 H new ATOM 0 HG1 THR A 34 -2.134 0.311 6.945 1.00 44.21 H new ATOM 0 HG21 THR A 34 -4.445 -0.006 7.465 1.00 12.15 H new ATOM 0 HG22 THR A 34 -5.457 1.455 7.568 1.00 12.15 H new ATOM 0 HG23 THR A 34 -4.859 0.897 5.988 1.00 12.15 H new ATOM 539 N TYR A 35 -5.078 2.765 4.788 1.00 75.22 N ATOM 540 CA TYR A 35 -5.457 2.617 3.388 1.00 53.55 C ATOM 541 C TYR A 35 -5.229 3.917 2.622 1.00 63.03 C ATOM 542 O TYR A 35 -4.518 3.942 1.618 1.00 63.14 O ATOM 543 CB TYR A 35 -6.924 2.198 3.276 1.00 60.13 C ATOM 544 CG TYR A 35 -7.462 2.249 1.864 1.00 73.53 C ATOM 545 CD1 TYR A 35 -7.927 3.439 1.318 1.00 22.13 C ATOM 546 CD2 TYR A 35 -7.505 1.106 1.074 1.00 34.45 C ATOM 547 CE1 TYR A 35 -8.420 3.489 0.029 1.00 11.40 C ATOM 548 CE2 TYR A 35 -7.996 1.147 -0.216 1.00 42.14 C ATOM 549 CZ TYR A 35 -8.452 2.341 -0.734 1.00 54.14 C ATOM 550 OH TYR A 35 -8.942 2.388 -2.020 1.00 23.43 O ATOM 0 H TYR A 35 -5.826 2.561 5.451 1.00 75.22 H new ATOM 0 HA TYR A 35 -4.830 1.841 2.948 1.00 53.55 H new ATOM 0 HB2 TYR A 35 -7.034 1.184 3.661 1.00 60.13 H new ATOM 0 HB3 TYR A 35 -7.528 2.847 3.910 1.00 60.13 H new ATOM 0 HD1 TYR A 35 -7.902 4.341 1.912 1.00 22.13 H new ATOM 0 HD2 TYR A 35 -7.148 0.169 1.476 1.00 34.45 H new ATOM 0 HE1 TYR A 35 -8.779 4.422 -0.379 1.00 11.40 H new ATOM 0 HE2 TYR A 35 -8.023 0.249 -0.816 1.00 42.14 H new ATOM 0 HH TYR A 35 -8.242 2.109 -2.647 1.00 23.43 H new ATOM 560 N ALA A 36 -5.837 4.996 3.105 1.00 61.55 N ATOM 561 CA ALA A 36 -5.698 6.300 2.468 1.00 34.34 C ATOM 562 C ALA A 36 -4.231 6.653 2.253 1.00 24.45 C ATOM 563 O ALA A 36 -3.819 6.990 1.143 1.00 63.23 O ATOM 564 CB ALA A 36 -6.384 7.370 3.305 1.00 43.23 C ATOM 0 H ALA A 36 -6.430 4.993 3.935 1.00 61.55 H new ATOM 0 HA ALA A 36 -6.179 6.253 1.491 1.00 34.34 H new ATOM 0 HB1 ALA A 36 -6.273 8.339 2.819 1.00 43.23 H new ATOM 0 HB2 ALA A 36 -7.443 7.132 3.403 1.00 43.23 H new ATOM 0 HB3 ALA A 36 -5.928 7.406 4.294 1.00 43.23 H new ATOM 570 N LEU A 37 -3.446 6.574 3.322 1.00 25.12 N ATOM 571 CA LEU A 37 -2.022 6.886 3.251 1.00 72.23 C ATOM 572 C LEU A 37 -1.322 6.002 2.224 1.00 60.14 C ATOM 573 O LEU A 37 -0.568 6.490 1.382 1.00 64.43 O ATOM 574 CB LEU A 37 -1.371 6.707 4.623 1.00 31.52 C ATOM 575 CG LEU A 37 -1.670 7.794 5.655 1.00 15.24 C ATOM 576 CD1 LEU A 37 -1.375 9.171 5.081 1.00 25.01 C ATOM 577 CD2 LEU A 37 -3.118 7.707 6.118 1.00 64.03 C ATOM 0 H LEU A 37 -3.771 6.297 4.248 1.00 25.12 H new ATOM 0 HA LEU A 37 -1.918 7.925 2.940 1.00 72.23 H new ATOM 0 HB2 LEU A 37 -1.690 5.748 5.032 1.00 31.52 H new ATOM 0 HB3 LEU A 37 -0.291 6.651 4.486 1.00 31.52 H new ATOM 0 HG LEU A 37 -1.023 7.636 6.518 1.00 15.24 H new ATOM 0 HD11 LEU A 37 -1.594 9.932 5.830 1.00 25.01 H new ATOM 0 HD12 LEU A 37 -0.324 9.230 4.800 1.00 25.01 H new ATOM 0 HD13 LEU A 37 -1.996 9.339 4.201 1.00 25.01 H new ATOM 0 HD21 LEU A 37 -3.313 8.488 6.852 1.00 64.03 H new ATOM 0 HD22 LEU A 37 -3.782 7.839 5.263 1.00 64.03 H new ATOM 0 HD23 LEU A 37 -3.297 6.731 6.570 1.00 64.03 H new ATOM 589 N ASP A 38 -1.579 4.701 2.298 1.00 65.32 N ATOM 590 CA ASP A 38 -0.975 3.748 1.372 1.00 15.44 C ATOM 591 C ASP A 38 -1.294 4.119 -0.073 1.00 4.23 C ATOM 592 O ASP A 38 -0.532 3.804 -0.988 1.00 1.04 O ATOM 593 CB ASP A 38 -1.471 2.332 1.670 1.00 40.34 C ATOM 594 CG ASP A 38 -0.559 1.267 1.093 1.00 53.10 C ATOM 595 OD1 ASP A 38 -0.381 1.245 -0.143 1.00 24.04 O ATOM 596 OD2 ASP A 38 -0.025 0.455 1.877 1.00 31.22 O ATOM 0 H ASP A 38 -2.201 4.281 2.989 1.00 65.32 H new ATOM 0 HA ASP A 38 0.106 3.782 1.507 1.00 15.44 H new ATOM 0 HB2 ASP A 38 -1.547 2.196 2.749 1.00 40.34 H new ATOM 0 HB3 ASP A 38 -2.474 2.208 1.262 1.00 40.34 H new ATOM 601 N HIS A 39 -2.424 4.790 -0.271 1.00 71.43 N ATOM 602 CA HIS A 39 -2.844 5.203 -1.606 1.00 5.03 C ATOM 603 C HIS A 39 -3.257 6.672 -1.615 1.00 21.43 C ATOM 604 O HIS A 39 -4.435 6.995 -1.462 1.00 51.50 O ATOM 605 CB HIS A 39 -4.002 4.332 -2.092 1.00 13.01 C ATOM 606 CG HIS A 39 -4.102 4.245 -3.584 1.00 4.32 C ATOM 607 ND1 HIS A 39 -4.952 3.375 -4.232 1.00 53.11 N ATOM 608 CD2 HIS A 39 -3.452 4.928 -4.555 1.00 62.24 C ATOM 609 CE1 HIS A 39 -4.820 3.525 -5.538 1.00 33.20 C ATOM 610 NE2 HIS A 39 -3.916 4.461 -5.761 1.00 11.53 N ATOM 0 H HIS A 39 -3.065 5.059 0.475 1.00 71.43 H new ATOM 0 HA HIS A 39 -1.998 5.078 -2.281 1.00 5.03 H new ATOM 0 HB2 HIS A 39 -3.886 3.328 -1.685 1.00 13.01 H new ATOM 0 HB3 HIS A 39 -4.936 4.730 -1.696 1.00 13.01 H new ATOM 0 HD1 HIS A 39 -5.584 2.718 -3.775 1.00 53.11 H new ATOM 0 HD2 HIS A 39 -2.708 5.697 -4.409 1.00 62.24 H new ATOM 0 HE1 HIS A 39 -5.360 2.975 -6.295 1.00 33.20 H new ATOM 618 N ILE A 40 -2.281 7.555 -1.794 1.00 24.05 N ATOM 619 CA ILE A 40 -2.544 8.988 -1.822 1.00 43.34 C ATOM 620 C ILE A 40 -3.072 9.423 -3.185 1.00 62.14 C ATOM 621 O ILE A 40 -3.344 10.602 -3.410 1.00 2.42 O ATOM 622 CB ILE A 40 -1.277 9.800 -1.492 1.00 52.05 C ATOM 623 CG1 ILE A 40 -0.599 9.241 -0.240 1.00 1.42 C ATOM 624 CG2 ILE A 40 -1.624 11.269 -1.303 1.00 50.21 C ATOM 625 CD1 ILE A 40 -1.383 9.483 1.031 1.00 53.32 C ATOM 0 H ILE A 40 -1.301 7.303 -1.922 1.00 24.05 H new ATOM 0 HA ILE A 40 -3.300 9.185 -1.062 1.00 43.34 H new ATOM 0 HB ILE A 40 -0.581 9.716 -2.327 1.00 52.05 H new ATOM 0 HG12 ILE A 40 -0.449 8.169 -0.366 1.00 1.42 H new ATOM 0 HG13 ILE A 40 0.388 9.692 -0.140 1.00 1.42 H new ATOM 0 HG21 ILE A 40 -0.719 11.830 -1.070 1.00 50.21 H new ATOM 0 HG22 ILE A 40 -2.067 11.659 -2.219 1.00 50.21 H new ATOM 0 HG23 ILE A 40 -2.335 11.372 -0.484 1.00 50.21 H new ATOM 0 HD11 ILE A 40 -0.843 9.060 1.878 1.00 53.32 H new ATOM 0 HD12 ILE A 40 -1.511 10.555 1.181 1.00 53.32 H new ATOM 0 HD13 ILE A 40 -2.361 9.009 0.951 1.00 53.32 H new ATOM 637 N ASP A 41 -3.216 8.462 -4.091 1.00 41.25 N ATOM 638 CA ASP A 41 -3.715 8.745 -5.432 1.00 64.44 C ATOM 639 C ASP A 41 -5.238 8.671 -5.472 1.00 62.15 C ATOM 640 O ASP A 41 -5.840 8.655 -6.546 1.00 70.24 O ATOM 641 CB ASP A 41 -3.117 7.760 -6.439 1.00 53.55 C ATOM 642 CG ASP A 41 -3.087 8.321 -7.848 1.00 24.41 C ATOM 643 OD1 ASP A 41 -2.957 9.554 -7.993 1.00 51.35 O ATOM 644 OD2 ASP A 41 -3.191 7.525 -8.805 1.00 11.23 O ATOM 0 H ASP A 41 -2.994 7.481 -3.921 1.00 41.25 H new ATOM 0 HA ASP A 41 -3.412 9.757 -5.701 1.00 64.44 H new ATOM 0 HB2 ASP A 41 -2.104 7.501 -6.132 1.00 53.55 H new ATOM 0 HB3 ASP A 41 -3.698 6.838 -6.430 1.00 53.55 H new ATOM 649 N ILE A 42 -5.854 8.625 -4.296 1.00 41.31 N ATOM 650 CA ILE A 42 -7.306 8.553 -4.197 1.00 53.24 C ATOM 651 C ILE A 42 -7.826 9.442 -3.073 1.00 3.43 C ATOM 652 O ILE A 42 -8.847 9.144 -2.455 1.00 10.44 O ATOM 653 CB ILE A 42 -7.783 7.109 -3.956 1.00 72.34 C ATOM 654 CG1 ILE A 42 -6.794 6.365 -3.056 1.00 50.34 C ATOM 655 CG2 ILE A 42 -7.954 6.379 -5.281 1.00 12.54 C ATOM 656 CD1 ILE A 42 -7.326 5.051 -2.530 1.00 60.33 C ATOM 0 H ILE A 42 -5.370 8.636 -3.398 1.00 41.31 H new ATOM 0 HA ILE A 42 -7.704 8.905 -5.149 1.00 53.24 H new ATOM 0 HB ILE A 42 -8.750 7.141 -3.453 1.00 72.34 H new ATOM 0 HG12 ILE A 42 -5.877 6.179 -3.614 1.00 50.34 H new ATOM 0 HG13 ILE A 42 -6.530 7.004 -2.213 1.00 50.34 H new ATOM 0 HG21 ILE A 42 -8.292 5.360 -5.094 1.00 12.54 H new ATOM 0 HG22 ILE A 42 -8.693 6.900 -5.891 1.00 12.54 H new ATOM 0 HG23 ILE A 42 -7.000 6.354 -5.809 1.00 12.54 H new ATOM 0 HD11 ILE A 42 -6.572 4.579 -1.900 1.00 60.33 H new ATOM 0 HD12 ILE A 42 -8.227 5.232 -1.944 1.00 60.33 H new ATOM 0 HD13 ILE A 42 -7.563 4.393 -3.366 1.00 60.33 H new ATOM 668 N GLU A 43 -7.116 10.536 -2.815 1.00 4.34 N ATOM 669 CA GLU A 43 -7.506 11.470 -1.765 1.00 33.45 C ATOM 670 C GLU A 43 -8.919 11.996 -2.002 1.00 61.41 C ATOM 671 O GLU A 43 -9.687 12.189 -1.060 1.00 73.01 O ATOM 672 CB GLU A 43 -6.520 12.638 -1.697 1.00 30.52 C ATOM 673 CG GLU A 43 -6.652 13.614 -2.854 1.00 30.52 C ATOM 674 CD GLU A 43 -6.366 12.969 -4.196 1.00 45.12 C ATOM 675 OE1 GLU A 43 -5.405 12.175 -4.279 1.00 40.24 O ATOM 676 OE2 GLU A 43 -7.101 13.259 -5.163 1.00 22.40 O ATOM 0 H GLU A 43 -6.268 10.797 -3.318 1.00 4.34 H new ATOM 0 HA GLU A 43 -7.490 10.935 -0.815 1.00 33.45 H new ATOM 0 HB2 GLU A 43 -6.670 13.175 -0.761 1.00 30.52 H new ATOM 0 HB3 GLU A 43 -5.504 12.244 -1.679 1.00 30.52 H new ATOM 0 HG2 GLU A 43 -7.660 14.029 -2.862 1.00 30.52 H new ATOM 0 HG3 GLU A 43 -5.966 14.447 -2.702 1.00 30.52 H new ATOM 683 N SER A 44 -9.253 12.226 -3.268 1.00 33.42 N ATOM 684 CA SER A 44 -10.571 12.733 -3.630 1.00 14.40 C ATOM 685 C SER A 44 -11.669 11.798 -3.133 1.00 74.10 C ATOM 686 O SER A 44 -12.372 12.103 -2.169 1.00 73.32 O ATOM 687 CB SER A 44 -10.677 12.902 -5.147 1.00 32.11 C ATOM 688 OG SER A 44 -11.878 13.564 -5.504 1.00 10.21 O ATOM 0 H SER A 44 -8.629 12.069 -4.060 1.00 33.42 H new ATOM 0 HA SER A 44 -10.702 13.704 -3.153 1.00 14.40 H new ATOM 0 HB2 SER A 44 -9.822 13.470 -5.513 1.00 32.11 H new ATOM 0 HB3 SER A 44 -10.640 11.925 -5.628 1.00 32.11 H new ATOM 0 HG SER A 44 -11.921 13.661 -6.478 1.00 10.21 H new ATOM 694 N LYS A 45 -11.811 10.657 -3.798 1.00 73.43 N ATOM 695 CA LYS A 45 -12.822 9.674 -3.426 1.00 21.22 C ATOM 696 C LYS A 45 -12.804 9.418 -1.922 1.00 62.12 C ATOM 697 O LYS A 45 -13.851 9.393 -1.275 1.00 11.21 O ATOM 698 CB LYS A 45 -12.590 8.362 -4.180 1.00 11.51 C ATOM 699 CG LYS A 45 -11.127 8.080 -4.474 1.00 2.32 C ATOM 700 CD LYS A 45 -10.734 8.559 -5.862 1.00 35.14 C ATOM 701 CE LYS A 45 -10.885 7.453 -6.895 1.00 43.55 C ATOM 702 NZ LYS A 45 -12.046 7.691 -7.797 1.00 42.30 N ATOM 0 H LYS A 45 -11.238 10.390 -4.598 1.00 73.43 H new ATOM 0 HA LYS A 45 -13.799 10.074 -3.698 1.00 21.22 H new ATOM 0 HB2 LYS A 45 -12.999 7.539 -3.594 1.00 11.51 H new ATOM 0 HB3 LYS A 45 -13.142 8.390 -5.120 1.00 11.51 H new ATOM 0 HG2 LYS A 45 -10.504 8.573 -3.728 1.00 2.32 H new ATOM 0 HG3 LYS A 45 -10.938 7.010 -4.390 1.00 2.32 H new ATOM 0 HD2 LYS A 45 -11.355 9.409 -6.144 1.00 35.14 H new ATOM 0 HD3 LYS A 45 -9.702 8.908 -5.849 1.00 35.14 H new ATOM 0 HE2 LYS A 45 -9.973 7.383 -7.488 1.00 43.55 H new ATOM 0 HE3 LYS A 45 -11.010 6.497 -6.387 1.00 43.55 H new ATOM 0 HZ1 LYS A 45 -12.115 6.915 -8.486 1.00 42.30 H new ATOM 0 HZ2 LYS A 45 -12.920 7.733 -7.235 1.00 42.30 H new ATOM 0 HZ3 LYS A 45 -11.915 8.591 -8.301 1.00 42.30 H new ATOM 716 N ILE A 46 -11.609 9.230 -1.373 1.00 63.40 N ATOM 717 CA ILE A 46 -11.456 8.978 0.055 1.00 45.54 C ATOM 718 C ILE A 46 -12.089 10.093 0.880 1.00 51.31 C ATOM 719 O ILE A 46 -13.131 9.900 1.506 1.00 34.35 O ATOM 720 CB ILE A 46 -9.972 8.844 0.447 1.00 52.43 C ATOM 721 CG1 ILE A 46 -9.394 7.538 -0.101 1.00 24.15 C ATOM 722 CG2 ILE A 46 -9.816 8.907 1.959 1.00 73.23 C ATOM 723 CD1 ILE A 46 -7.883 7.482 -0.059 1.00 45.24 C ATOM 0 H ILE A 46 -10.733 9.247 -1.895 1.00 63.40 H new ATOM 0 HA ILE A 46 -11.966 8.038 0.266 1.00 45.54 H new ATOM 0 HB ILE A 46 -9.419 9.675 0.010 1.00 52.43 H new ATOM 0 HG12 ILE A 46 -9.797 6.703 0.472 1.00 24.15 H new ATOM 0 HG13 ILE A 46 -9.726 7.407 -1.131 1.00 24.15 H new ATOM 0 HG21 ILE A 46 -8.762 8.811 2.220 1.00 73.23 H new ATOM 0 HG22 ILE A 46 -10.195 9.861 2.324 1.00 73.23 H new ATOM 0 HG23 ILE A 46 -10.379 8.094 2.417 1.00 73.23 H new ATOM 0 HD11 ILE A 46 -7.543 6.528 -0.463 1.00 45.24 H new ATOM 0 HD12 ILE A 46 -7.472 8.296 -0.656 1.00 45.24 H new ATOM 0 HD13 ILE A 46 -7.544 7.581 0.972 1.00 45.24 H new ATOM 735 N ILE A 47 -11.454 11.260 0.874 1.00 1.32 N ATOM 736 CA ILE A 47 -11.957 12.407 1.620 1.00 53.11 C ATOM 737 C ILE A 47 -13.449 12.609 1.377 1.00 50.22 C ATOM 738 O ILE A 47 -14.225 12.776 2.318 1.00 62.22 O ATOM 739 CB ILE A 47 -11.207 13.698 1.241 1.00 34.13 C ATOM 740 CG1 ILE A 47 -9.732 13.590 1.632 1.00 11.05 C ATOM 741 CG2 ILE A 47 -11.852 14.901 1.913 1.00 53.35 C ATOM 742 CD1 ILE A 47 -9.516 13.310 3.103 1.00 2.22 C ATOM 0 H ILE A 47 -10.590 11.436 0.361 1.00 1.32 H new ATOM 0 HA ILE A 47 -11.788 12.195 2.676 1.00 53.11 H new ATOM 0 HB ILE A 47 -11.268 13.833 0.161 1.00 34.13 H new ATOM 0 HG12 ILE A 47 -9.267 12.797 1.047 1.00 11.05 H new ATOM 0 HG13 ILE A 47 -9.226 14.519 1.369 1.00 11.05 H new ATOM 0 HG21 ILE A 47 -11.311 15.806 1.636 1.00 53.35 H new ATOM 0 HG22 ILE A 47 -12.890 14.985 1.590 1.00 53.35 H new ATOM 0 HG23 ILE A 47 -11.818 14.775 2.995 1.00 53.35 H new ATOM 0 HD11 ILE A 47 -8.447 13.246 3.308 1.00 2.22 H new ATOM 0 HD12 ILE A 47 -9.952 14.115 3.694 1.00 2.22 H new ATOM 0 HD13 ILE A 47 -9.993 12.366 3.368 1.00 2.22 H new ATOM 754 N SER A 48 -13.844 12.591 0.108 1.00 40.43 N ATOM 755 CA SER A 48 -15.243 12.775 -0.260 1.00 71.31 C ATOM 756 C SER A 48 -16.123 11.726 0.412 1.00 34.34 C ATOM 757 O SER A 48 -17.215 12.031 0.894 1.00 33.22 O ATOM 758 CB SER A 48 -15.407 12.697 -1.779 1.00 74.01 C ATOM 759 OG SER A 48 -15.094 13.937 -2.390 1.00 70.51 O ATOM 0 H SER A 48 -13.215 12.451 -0.683 1.00 40.43 H new ATOM 0 HA SER A 48 -15.557 13.761 0.082 1.00 71.31 H new ATOM 0 HB2 SER A 48 -14.758 11.917 -2.178 1.00 74.01 H new ATOM 0 HB3 SER A 48 -16.431 12.416 -2.023 1.00 74.01 H new ATOM 0 HG SER A 48 -15.205 13.861 -3.361 1.00 70.51 H new ATOM 765 N LEU A 49 -15.641 10.488 0.441 1.00 10.33 N ATOM 766 CA LEU A 49 -16.383 9.392 1.055 1.00 42.04 C ATOM 767 C LEU A 49 -16.683 9.691 2.520 1.00 74.51 C ATOM 768 O LEU A 49 -17.839 9.876 2.901 1.00 14.41 O ATOM 769 CB LEU A 49 -15.592 8.088 0.940 1.00 62.23 C ATOM 770 CG LEU A 49 -16.366 6.804 1.241 1.00 13.31 C ATOM 771 CD1 LEU A 49 -17.419 6.553 0.173 1.00 62.34 C ATOM 772 CD2 LEU A 49 -15.416 5.620 1.346 1.00 53.22 C ATOM 0 H LEU A 49 -14.740 10.218 0.047 1.00 10.33 H new ATOM 0 HA LEU A 49 -17.329 9.284 0.525 1.00 42.04 H new ATOM 0 HB2 LEU A 49 -15.191 8.018 -0.071 1.00 62.23 H new ATOM 0 HB3 LEU A 49 -14.740 8.142 1.618 1.00 62.23 H new ATOM 0 HG LEU A 49 -16.872 6.923 2.199 1.00 13.31 H new ATOM 0 HD11 LEU A 49 -17.960 5.635 0.404 1.00 62.34 H new ATOM 0 HD12 LEU A 49 -18.118 7.389 0.147 1.00 62.34 H new ATOM 0 HD13 LEU A 49 -16.935 6.455 -0.799 1.00 62.34 H new ATOM 0 HD21 LEU A 49 -15.985 4.715 1.561 1.00 53.22 H new ATOM 0 HD22 LEU A 49 -14.881 5.498 0.404 1.00 53.22 H new ATOM 0 HD23 LEU A 49 -14.700 5.798 2.149 1.00 53.22 H new ATOM 784 N ILE A 50 -15.636 9.737 3.336 1.00 63.22 N ATOM 785 CA ILE A 50 -15.788 10.016 4.758 1.00 4.23 C ATOM 786 C ILE A 50 -16.712 11.207 4.989 1.00 61.01 C ATOM 787 O ILE A 50 -17.609 11.155 5.830 1.00 34.14 O ATOM 788 CB ILE A 50 -14.428 10.299 5.425 1.00 53.23 C ATOM 789 CG1 ILE A 50 -13.633 11.313 4.600 1.00 2.54 C ATOM 790 CG2 ILE A 50 -13.640 9.008 5.590 1.00 55.21 C ATOM 791 CD1 ILE A 50 -12.224 11.530 5.106 1.00 44.24 C ATOM 0 H ILE A 50 -14.673 9.585 3.037 1.00 63.22 H new ATOM 0 HA ILE A 50 -16.227 9.126 5.209 1.00 4.23 H new ATOM 0 HB ILE A 50 -14.605 10.722 6.414 1.00 53.23 H new ATOM 0 HG12 ILE A 50 -13.591 10.974 3.565 1.00 2.54 H new ATOM 0 HG13 ILE A 50 -14.162 12.266 4.602 1.00 2.54 H new ATOM 0 HG21 ILE A 50 -12.682 9.224 6.062 1.00 55.21 H new ATOM 0 HG22 ILE A 50 -14.204 8.315 6.214 1.00 55.21 H new ATOM 0 HG23 ILE A 50 -13.469 8.559 4.612 1.00 55.21 H new ATOM 0 HD11 ILE A 50 -11.719 12.261 4.474 1.00 44.24 H new ATOM 0 HD12 ILE A 50 -12.258 11.899 6.131 1.00 44.24 H new ATOM 0 HD13 ILE A 50 -11.678 10.587 5.078 1.00 44.24 H new ATOM 803 N ILE A 51 -16.487 12.278 4.235 1.00 34.12 N ATOM 804 CA ILE A 51 -17.302 13.481 4.356 1.00 70.45 C ATOM 805 C ILE A 51 -18.780 13.167 4.146 1.00 45.04 C ATOM 806 O ILE A 51 -19.605 13.398 5.029 1.00 54.32 O ATOM 807 CB ILE A 51 -16.869 14.558 3.344 1.00 64.33 C ATOM 808 CG1 ILE A 51 -15.496 15.119 3.720 1.00 65.44 C ATOM 809 CG2 ILE A 51 -17.903 15.672 3.281 1.00 63.24 C ATOM 810 CD1 ILE A 51 -14.886 15.993 2.647 1.00 64.05 C ATOM 0 H ILE A 51 -15.748 12.337 3.535 1.00 34.12 H new ATOM 0 HA ILE A 51 -17.154 13.863 5.366 1.00 70.45 H new ATOM 0 HB ILE A 51 -16.796 14.100 2.357 1.00 64.33 H new ATOM 0 HG12 ILE A 51 -15.588 15.697 4.639 1.00 65.44 H new ATOM 0 HG13 ILE A 51 -14.819 14.291 3.931 1.00 65.44 H new ATOM 0 HG21 ILE A 51 -17.583 16.425 2.561 1.00 63.24 H new ATOM 0 HG22 ILE A 51 -18.863 15.260 2.972 1.00 63.24 H new ATOM 0 HG23 ILE A 51 -18.005 16.130 4.265 1.00 63.24 H new ATOM 0 HD11 ILE A 51 -13.914 16.355 2.982 1.00 64.05 H new ATOM 0 HD12 ILE A 51 -14.762 15.413 1.733 1.00 64.05 H new ATOM 0 HD13 ILE A 51 -15.542 16.841 2.452 1.00 64.05 H new ATOM 822 N ASP A 52 -19.105 12.638 2.971 1.00 31.35 N ATOM 823 CA ASP A 52 -20.483 12.289 2.646 1.00 72.02 C ATOM 824 C ASP A 52 -21.056 11.320 3.675 1.00 13.13 C ATOM 825 O ASP A 52 -22.124 11.559 4.240 1.00 31.31 O ATOM 826 CB ASP A 52 -20.559 11.672 1.249 1.00 61.55 C ATOM 827 CG ASP A 52 -21.458 12.459 0.316 1.00 44.15 C ATOM 828 OD1 ASP A 52 -21.336 13.701 0.284 1.00 14.40 O ATOM 829 OD2 ASP A 52 -22.283 11.833 -0.383 1.00 2.24 O ATOM 0 H ASP A 52 -18.434 12.442 2.229 1.00 31.35 H new ATOM 0 HA ASP A 52 -21.077 13.203 2.664 1.00 72.02 H new ATOM 0 HB2 ASP A 52 -19.557 11.619 0.824 1.00 61.55 H new ATOM 0 HB3 ASP A 52 -20.927 10.649 1.326 1.00 61.55 H new ATOM 834 N TYR A 53 -20.341 10.227 3.913 1.00 22.44 N ATOM 835 CA TYR A 53 -20.780 9.220 4.872 1.00 21.32 C ATOM 836 C TYR A 53 -21.173 9.864 6.198 1.00 40.42 C ATOM 837 O TYR A 53 -22.130 9.442 6.847 1.00 63.10 O ATOM 838 CB TYR A 53 -19.674 8.188 5.102 1.00 34.21 C ATOM 839 CG TYR A 53 -19.796 7.453 6.418 1.00 3.42 C ATOM 840 CD1 TYR A 53 -19.242 7.976 7.581 1.00 73.50 C ATOM 841 CD2 TYR A 53 -20.463 6.237 6.499 1.00 3.41 C ATOM 842 CE1 TYR A 53 -19.350 7.308 8.786 1.00 60.13 C ATOM 843 CE2 TYR A 53 -20.577 5.564 7.700 1.00 64.44 C ATOM 844 CZ TYR A 53 -20.018 6.103 8.840 1.00 75.41 C ATOM 845 OH TYR A 53 -20.128 5.434 10.037 1.00 35.24 O ATOM 0 H TYR A 53 -19.454 10.015 3.455 1.00 22.44 H new ATOM 0 HA TYR A 53 -21.656 8.719 4.459 1.00 21.32 H new ATOM 0 HB2 TYR A 53 -19.690 7.463 4.288 1.00 34.21 H new ATOM 0 HB3 TYR A 53 -18.707 8.689 5.064 1.00 34.21 H new ATOM 0 HD1 TYR A 53 -18.719 8.920 7.542 1.00 73.50 H new ATOM 0 HD2 TYR A 53 -20.900 5.811 5.608 1.00 3.41 H new ATOM 0 HE1 TYR A 53 -18.914 7.727 9.680 1.00 60.13 H new ATOM 0 HE2 TYR A 53 -21.101 4.621 7.746 1.00 64.44 H new ATOM 0 HH TYR A 53 -20.849 5.831 10.569 1.00 35.24 H new ATOM 855 N SER A 54 -20.427 10.891 6.593 1.00 11.21 N ATOM 856 CA SER A 54 -20.694 11.594 7.843 1.00 73.24 C ATOM 857 C SER A 54 -22.064 12.264 7.807 1.00 53.33 C ATOM 858 O SER A 54 -23.023 11.775 8.405 1.00 42.13 O ATOM 859 CB SER A 54 -19.609 12.639 8.107 1.00 50.35 C ATOM 860 OG SER A 54 -19.901 13.856 7.442 1.00 10.40 O ATOM 0 H SER A 54 -19.633 11.255 6.066 1.00 11.21 H new ATOM 0 HA SER A 54 -20.688 10.863 8.651 1.00 73.24 H new ATOM 0 HB2 SER A 54 -19.525 12.818 9.179 1.00 50.35 H new ATOM 0 HB3 SER A 54 -18.644 12.259 7.770 1.00 50.35 H new ATOM 0 HG SER A 54 -19.414 13.890 6.592 1.00 10.40 H new ATOM 866 N ARG A 55 -22.148 13.387 7.101 1.00 51.31 N ATOM 867 CA ARG A 55 -23.400 14.127 6.987 1.00 25.52 C ATOM 868 C ARG A 55 -24.573 13.178 6.761 1.00 21.44 C ATOM 869 O ARG A 55 -25.678 13.411 7.253 1.00 41.51 O ATOM 870 CB ARG A 55 -23.318 15.136 5.840 1.00 20.24 C ATOM 871 CG ARG A 55 -23.528 14.517 4.468 1.00 20.32 C ATOM 872 CD ARG A 55 -22.761 15.271 3.394 1.00 63.15 C ATOM 873 NE ARG A 55 -23.392 15.149 2.082 1.00 33.24 N ATOM 874 CZ ARG A 55 -24.425 15.887 1.693 1.00 53.54 C ATOM 875 NH1 ARG A 55 -24.940 16.797 2.509 1.00 61.30 N ATOM 876 NH2 ARG A 55 -24.945 15.718 0.484 1.00 73.33 N ATOM 0 H ARG A 55 -21.364 13.805 6.599 1.00 51.31 H new ATOM 0 HA ARG A 55 -23.563 14.663 7.922 1.00 25.52 H new ATOM 0 HB2 ARG A 55 -24.066 15.913 5.997 1.00 20.24 H new ATOM 0 HB3 ARG A 55 -22.343 15.622 5.864 1.00 20.24 H new ATOM 0 HG2 ARG A 55 -23.205 13.476 4.484 1.00 20.32 H new ATOM 0 HG3 ARG A 55 -24.591 14.518 4.226 1.00 20.32 H new ATOM 0 HD2 ARG A 55 -22.695 16.324 3.668 1.00 63.15 H new ATOM 0 HD3 ARG A 55 -21.741 14.890 3.342 1.00 63.15 H new ATOM 0 HE ARG A 55 -23.019 14.460 1.429 1.00 33.24 H new ATOM 0 HH11 ARG A 55 -24.542 16.932 3.439 1.00 61.30 H new ATOM 0 HH12 ARG A 55 -25.734 17.362 2.207 1.00 61.30 H new ATOM 0 HH21 ARG A 55 -24.551 15.021 -0.148 1.00 73.33 H new ATOM 0 HH22 ARG A 55 -25.739 16.285 0.186 1.00 73.33 H new ATOM 890 N LEU A 56 -24.326 12.107 6.015 1.00 61.02 N ATOM 891 CA LEU A 56 -25.362 11.122 5.723 1.00 1.20 C ATOM 892 C LEU A 56 -25.849 10.449 7.002 1.00 23.31 C ATOM 893 O LEU A 56 -26.935 10.749 7.499 1.00 50.03 O ATOM 894 CB LEU A 56 -24.832 10.069 4.748 1.00 21.04 C ATOM 895 CG LEU A 56 -24.606 10.538 3.311 1.00 53.03 C ATOM 896 CD1 LEU A 56 -23.714 9.559 2.564 1.00 42.14 C ATOM 897 CD2 LEU A 56 -25.936 10.707 2.590 1.00 1.30 C ATOM 0 H LEU A 56 -23.417 11.898 5.601 1.00 61.02 H new ATOM 0 HA LEU A 56 -26.204 11.641 5.265 1.00 1.20 H new ATOM 0 HB2 LEU A 56 -23.888 9.686 5.136 1.00 21.04 H new ATOM 0 HB3 LEU A 56 -25.532 9.234 4.730 1.00 21.04 H new ATOM 0 HG LEU A 56 -24.105 11.506 3.339 1.00 53.03 H new ATOM 0 HD11 LEU A 56 -23.564 9.909 1.543 1.00 42.14 H new ATOM 0 HD12 LEU A 56 -22.750 9.487 3.068 1.00 42.14 H new ATOM 0 HD13 LEU A 56 -24.187 8.577 2.545 1.00 42.14 H new ATOM 0 HD21 LEU A 56 -25.756 11.041 1.568 1.00 1.30 H new ATOM 0 HD22 LEU A 56 -26.464 9.754 2.572 1.00 1.30 H new ATOM 0 HD23 LEU A 56 -26.542 11.447 3.113 1.00 1.30 H new ATOM 909 N CYS A 57 -25.038 9.539 7.531 1.00 41.20 N ATOM 910 CA CYS A 57 -25.385 8.824 8.754 1.00 73.12 C ATOM 911 C CYS A 57 -25.900 9.786 9.819 1.00 1.42 C ATOM 912 O CYS A 57 -25.533 10.961 9.859 1.00 31.00 O ATOM 913 CB CYS A 57 -24.172 8.058 9.284 1.00 50.42 C ATOM 914 SG CYS A 57 -23.756 6.581 8.328 1.00 40.11 S ATOM 0 H CYS A 57 -24.136 9.279 7.132 1.00 41.20 H new ATOM 0 HA CYS A 57 -26.178 8.114 8.518 1.00 73.12 H new ATOM 0 HB2 CYS A 57 -23.310 8.726 9.294 1.00 50.42 H new ATOM 0 HB3 CYS A 57 -24.362 7.767 10.317 1.00 50.42 H new ATOM 0 HG CYS A 57 -22.464 6.447 8.277 1.00 40.11 H new ATOM 920 N PRO A 58 -26.772 9.279 10.703 1.00 2.55 N ATOM 921 CA PRO A 58 -27.357 10.078 11.785 1.00 24.41 C ATOM 922 C PRO A 58 -26.333 10.442 12.855 1.00 12.11 C ATOM 923 O PRO A 58 -25.133 10.496 12.587 1.00 41.02 O ATOM 924 CB PRO A 58 -28.431 9.155 12.365 1.00 15.03 C ATOM 925 CG PRO A 58 -27.968 7.778 12.034 1.00 11.42 C ATOM 926 CD PRO A 58 -27.253 7.888 10.716 1.00 74.12 C ATOM 0 HA PRO A 58 -27.743 11.032 11.425 1.00 24.41 H new ATOM 0 HB2 PRO A 58 -28.530 9.291 13.442 1.00 15.03 H new ATOM 0 HB3 PRO A 58 -29.408 9.360 11.927 1.00 15.03 H new ATOM 0 HG2 PRO A 58 -27.304 7.393 12.808 1.00 11.42 H new ATOM 0 HG3 PRO A 58 -28.810 7.089 11.965 1.00 11.42 H new ATOM 0 HD2 PRO A 58 -26.429 7.178 10.645 1.00 74.12 H new ATOM 0 HD3 PRO A 58 -27.921 7.686 9.879 1.00 74.12 H new ATOM 934 N ASP A 59 -26.815 10.691 14.068 1.00 53.03 N ATOM 935 CA ASP A 59 -25.942 11.049 15.179 1.00 3.11 C ATOM 936 C ASP A 59 -24.647 10.243 15.135 1.00 75.34 C ATOM 937 O ASP A 59 -23.557 10.791 15.294 1.00 10.13 O ATOM 938 CB ASP A 59 -26.656 10.818 16.512 1.00 64.12 C ATOM 939 CG ASP A 59 -27.017 9.362 16.730 1.00 24.32 C ATOM 940 OD1 ASP A 59 -27.878 8.846 15.987 1.00 21.33 O ATOM 941 OD2 ASP A 59 -26.437 8.738 17.643 1.00 32.25 O ATOM 0 H ASP A 59 -27.806 10.651 14.306 1.00 53.03 H new ATOM 0 HA ASP A 59 -25.694 12.106 15.087 1.00 3.11 H new ATOM 0 HB2 ASP A 59 -26.016 11.157 17.327 1.00 64.12 H new ATOM 0 HB3 ASP A 59 -27.562 11.423 16.545 1.00 64.12 H new ATOM 946 N SER A 60 -24.776 8.938 14.918 1.00 74.34 N ATOM 947 CA SER A 60 -23.617 8.055 14.857 1.00 35.31 C ATOM 948 C SER A 60 -22.500 8.681 14.029 1.00 3.42 C ATOM 949 O SER A 60 -21.326 8.607 14.393 1.00 45.30 O ATOM 950 CB SER A 60 -24.011 6.702 14.262 1.00 74.42 C ATOM 951 OG SER A 60 -25.225 6.231 14.823 1.00 43.32 O ATOM 0 H SER A 60 -25.671 8.469 14.782 1.00 74.34 H new ATOM 0 HA SER A 60 -23.252 7.905 15.873 1.00 35.31 H new ATOM 0 HB2 SER A 60 -24.118 6.794 13.181 1.00 74.42 H new ATOM 0 HB3 SER A 60 -23.218 5.977 14.443 1.00 74.42 H new ATOM 0 HG SER A 60 -25.455 5.366 14.425 1.00 43.32 H new ATOM 957 N HIS A 61 -22.874 9.299 12.913 1.00 65.00 N ATOM 958 CA HIS A 61 -21.903 9.940 12.032 1.00 34.22 C ATOM 959 C HIS A 61 -21.112 11.007 12.781 1.00 3.53 C ATOM 960 O HIS A 61 -19.883 11.042 12.720 1.00 64.14 O ATOM 961 CB HIS A 61 -22.610 10.563 10.828 1.00 10.21 C ATOM 962 CG HIS A 61 -22.785 12.047 10.938 1.00 20.42 C ATOM 963 ND1 HIS A 61 -21.760 12.943 10.724 1.00 5.34 N ATOM 964 CD2 HIS A 61 -23.875 12.789 11.240 1.00 15.41 C ATOM 965 CE1 HIS A 61 -22.211 14.173 10.892 1.00 52.43 C ATOM 966 NE2 HIS A 61 -23.493 14.108 11.205 1.00 63.32 N ATOM 0 H HIS A 61 -23.841 9.370 12.597 1.00 65.00 H new ATOM 0 HA HIS A 61 -21.208 9.177 11.681 1.00 34.22 H new ATOM 0 HB2 HIS A 61 -22.040 10.338 9.926 1.00 10.21 H new ATOM 0 HB3 HIS A 61 -23.589 10.098 10.711 1.00 10.21 H new ATOM 0 HD2 HIS A 61 -24.862 12.414 11.467 1.00 15.41 H new ATOM 0 HE1 HIS A 61 -21.631 15.078 10.791 1.00 52.43 H new ATOM 0 HE2 HIS A 61 -24.100 14.907 11.390 1.00 63.32 H new ATOM 974 N LYS A 62 -21.824 11.878 13.488 1.00 11.32 N ATOM 975 CA LYS A 62 -21.189 12.947 14.250 1.00 14.30 C ATOM 976 C LYS A 62 -19.969 12.428 15.003 1.00 20.14 C ATOM 977 O LYS A 62 -18.835 12.801 14.700 1.00 23.44 O ATOM 978 CB LYS A 62 -22.187 13.561 15.235 1.00 1.10 C ATOM 979 CG LYS A 62 -23.561 13.806 14.636 1.00 41.11 C ATOM 980 CD LYS A 62 -24.406 14.702 15.526 1.00 22.12 C ATOM 981 CE LYS A 62 -25.045 15.832 14.734 1.00 73.22 C ATOM 982 NZ LYS A 62 -26.338 15.418 14.122 1.00 35.34 N ATOM 0 H LYS A 62 -22.842 11.865 13.549 1.00 11.32 H new ATOM 0 HA LYS A 62 -20.861 13.714 13.548 1.00 14.30 H new ATOM 0 HB2 LYS A 62 -22.288 12.900 16.096 1.00 1.10 H new ATOM 0 HB3 LYS A 62 -21.787 14.506 15.603 1.00 1.10 H new ATOM 0 HG2 LYS A 62 -23.454 14.265 13.653 1.00 41.11 H new ATOM 0 HG3 LYS A 62 -24.070 12.853 14.489 1.00 41.11 H new ATOM 0 HD2 LYS A 62 -25.183 14.109 16.008 1.00 22.12 H new ATOM 0 HD3 LYS A 62 -23.785 15.118 16.319 1.00 22.12 H new ATOM 0 HE2 LYS A 62 -25.211 16.687 15.390 1.00 73.22 H new ATOM 0 HE3 LYS A 62 -24.361 16.159 13.951 1.00 73.22 H new ATOM 0 HZ1 LYS A 62 -26.355 15.700 13.121 1.00 35.34 H new ATOM 0 HZ2 LYS A 62 -26.440 14.385 14.192 1.00 35.34 H new ATOM 0 HZ3 LYS A 62 -27.123 15.879 14.625 1.00 35.34 H new ATOM 996 N LEU A 63 -20.208 11.565 15.985 1.00 53.14 N ATOM 997 CA LEU A 63 -19.128 10.993 16.781 1.00 70.24 C ATOM 998 C LEU A 63 -18.180 10.179 15.906 1.00 23.43 C ATOM 999 O LEU A 63 -16.984 10.460 15.841 1.00 22.40 O ATOM 1000 CB LEU A 63 -19.699 10.111 17.892 1.00 32.42 C ATOM 1001 CG LEU A 63 -18.692 9.585 18.916 1.00 74.11 C ATOM 1002 CD1 LEU A 63 -17.713 10.679 19.312 1.00 71.11 C ATOM 1003 CD2 LEU A 63 -19.412 9.042 20.142 1.00 74.24 C ATOM 0 H LEU A 63 -21.140 11.246 16.249 1.00 53.14 H new ATOM 0 HA LEU A 63 -18.566 11.812 17.229 1.00 70.24 H new ATOM 0 HB2 LEU A 63 -20.463 10.679 18.422 1.00 32.42 H new ATOM 0 HB3 LEU A 63 -20.198 9.258 17.431 1.00 32.42 H new ATOM 0 HG LEU A 63 -18.130 8.771 18.459 1.00 74.11 H new ATOM 0 HD11 LEU A 63 -17.004 10.286 20.041 1.00 71.11 H new ATOM 0 HD12 LEU A 63 -17.173 11.021 18.429 1.00 71.11 H new ATOM 0 HD13 LEU A 63 -18.259 11.515 19.750 1.00 71.11 H new ATOM 0 HD21 LEU A 63 -18.680 8.672 20.860 1.00 74.24 H new ATOM 0 HD22 LEU A 63 -20.000 9.837 20.600 1.00 74.24 H new ATOM 0 HD23 LEU A 63 -20.073 8.227 19.845 1.00 74.24 H new ATOM 1015 N GLY A 64 -18.723 9.169 15.233 1.00 32.34 N ATOM 1016 CA GLY A 64 -17.912 8.331 14.370 1.00 22.30 C ATOM 1017 C GLY A 64 -17.060 9.139 13.411 1.00 34.11 C ATOM 1018 O GLY A 64 -15.843 9.221 13.570 1.00 45.11 O ATOM 0 H GLY A 64 -19.711 8.916 15.270 1.00 32.34 H new ATOM 0 HA2 GLY A 64 -17.267 7.701 14.982 1.00 22.30 H new ATOM 0 HA3 GLY A 64 -18.561 7.665 13.802 1.00 22.30 H new ATOM 1022 N SER A 65 -17.702 9.736 12.412 1.00 61.13 N ATOM 1023 CA SER A 65 -16.995 10.537 11.420 1.00 45.22 C ATOM 1024 C SER A 65 -15.865 11.331 12.068 1.00 3.33 C ATOM 1025 O SER A 65 -14.705 11.224 11.668 1.00 62.52 O ATOM 1026 CB SER A 65 -17.964 11.489 10.717 1.00 51.32 C ATOM 1027 OG SER A 65 -17.300 12.252 9.724 1.00 0.34 O ATOM 0 H SER A 65 -18.710 9.680 12.268 1.00 61.13 H new ATOM 0 HA SER A 65 -16.564 9.860 10.683 1.00 45.22 H new ATOM 0 HB2 SER A 65 -18.773 10.918 10.261 1.00 51.32 H new ATOM 0 HB3 SER A 65 -18.418 12.156 11.449 1.00 51.32 H new ATOM 0 HG SER A 65 -17.541 13.197 9.822 1.00 0.34 H new ATOM 1033 N LEU A 66 -16.211 12.129 13.072 1.00 35.13 N ATOM 1034 CA LEU A 66 -15.227 12.942 13.778 1.00 15.42 C ATOM 1035 C LEU A 66 -13.947 12.152 14.030 1.00 52.35 C ATOM 1036 O LEU A 66 -12.857 12.581 13.652 1.00 4.42 O ATOM 1037 CB LEU A 66 -15.804 13.437 15.106 1.00 42.42 C ATOM 1038 CG LEU A 66 -16.238 14.903 15.144 1.00 10.13 C ATOM 1039 CD1 LEU A 66 -17.481 15.069 16.004 1.00 13.12 C ATOM 1040 CD2 LEU A 66 -15.108 15.781 15.662 1.00 21.33 C ATOM 0 H LEU A 66 -17.166 12.230 13.416 1.00 35.13 H new ATOM 0 HA LEU A 66 -14.985 13.800 13.151 1.00 15.42 H new ATOM 0 HB2 LEU A 66 -16.664 12.817 15.359 1.00 42.42 H new ATOM 0 HB3 LEU A 66 -15.058 13.279 15.885 1.00 42.42 H new ATOM 0 HG LEU A 66 -16.479 15.217 14.128 1.00 10.13 H new ATOM 0 HD11 LEU A 66 -17.775 16.118 16.019 1.00 13.12 H new ATOM 0 HD12 LEU A 66 -18.293 14.471 15.590 1.00 13.12 H new ATOM 0 HD13 LEU A 66 -17.267 14.737 17.020 1.00 13.12 H new ATOM 0 HD21 LEU A 66 -15.435 16.821 15.682 1.00 21.33 H new ATOM 0 HD22 LEU A 66 -14.836 15.467 16.670 1.00 21.33 H new ATOM 0 HD23 LEU A 66 -14.243 15.685 15.006 1.00 21.33 H new ATOM 1052 N TYR A 67 -14.088 10.995 14.667 1.00 41.41 N ATOM 1053 CA TYR A 67 -12.943 10.145 14.969 1.00 64.02 C ATOM 1054 C TYR A 67 -12.189 9.774 13.695 1.00 30.33 C ATOM 1055 O TYR A 67 -10.962 9.857 13.641 1.00 63.13 O ATOM 1056 CB TYR A 67 -13.399 8.877 15.693 1.00 51.14 C ATOM 1057 CG TYR A 67 -13.468 9.029 17.195 1.00 11.33 C ATOM 1058 CD1 TYR A 67 -13.591 10.283 17.782 1.00 72.24 C ATOM 1059 CD2 TYR A 67 -13.411 7.919 18.029 1.00 72.01 C ATOM 1060 CE1 TYR A 67 -13.654 10.426 19.154 1.00 2.41 C ATOM 1061 CE2 TYR A 67 -13.475 8.053 19.402 1.00 24.04 C ATOM 1062 CZ TYR A 67 -13.595 9.309 19.960 1.00 33.32 C ATOM 1063 OH TYR A 67 -13.659 9.447 21.328 1.00 42.42 O ATOM 0 H TYR A 67 -14.984 10.624 14.984 1.00 41.41 H new ATOM 0 HA TYR A 67 -12.269 10.704 15.619 1.00 64.02 H new ATOM 0 HB2 TYR A 67 -14.382 8.589 15.320 1.00 51.14 H new ATOM 0 HB3 TYR A 67 -12.715 8.064 15.450 1.00 51.14 H new ATOM 0 HD1 TYR A 67 -13.638 11.161 17.154 1.00 72.24 H new ATOM 0 HD2 TYR A 67 -13.315 6.934 17.596 1.00 72.01 H new ATOM 0 HE1 TYR A 67 -13.749 11.408 19.593 1.00 2.41 H new ATOM 0 HE2 TYR A 67 -13.431 7.179 20.035 1.00 24.04 H new ATOM 0 HH TYR A 67 -13.605 8.564 21.749 1.00 42.42 H new ATOM 1073 N ILE A 68 -12.933 9.365 12.673 1.00 32.54 N ATOM 1074 CA ILE A 68 -12.337 8.982 11.400 1.00 43.14 C ATOM 1075 C ILE A 68 -11.478 10.108 10.835 1.00 44.33 C ATOM 1076 O ILE A 68 -10.301 9.911 10.529 1.00 11.42 O ATOM 1077 CB ILE A 68 -13.413 8.604 10.365 1.00 51.31 C ATOM 1078 CG1 ILE A 68 -14.112 7.306 10.774 1.00 1.24 C ATOM 1079 CG2 ILE A 68 -12.793 8.465 8.982 1.00 11.15 C ATOM 1080 CD1 ILE A 68 -15.183 6.864 9.802 1.00 14.25 C ATOM 0 H ILE A 68 -13.950 9.290 12.702 1.00 32.54 H new ATOM 0 HA ILE A 68 -11.710 8.112 11.594 1.00 43.14 H new ATOM 0 HB ILE A 68 -14.157 9.400 10.330 1.00 51.31 H new ATOM 0 HG12 ILE A 68 -13.367 6.515 10.866 1.00 1.24 H new ATOM 0 HG13 ILE A 68 -14.559 7.439 11.759 1.00 1.24 H new ATOM 0 HG21 ILE A 68 -13.566 8.198 8.262 1.00 11.15 H new ATOM 0 HG22 ILE A 68 -12.337 9.411 8.691 1.00 11.15 H new ATOM 0 HG23 ILE A 68 -12.031 7.686 9.002 1.00 11.15 H new ATOM 0 HD11 ILE A 68 -15.635 5.938 10.156 1.00 14.25 H new ATOM 0 HD12 ILE A 68 -15.948 7.637 9.728 1.00 14.25 H new ATOM 0 HD13 ILE A 68 -14.738 6.699 8.821 1.00 14.25 H new ATOM 1092 N ILE A 69 -12.073 11.289 10.700 1.00 22.43 N ATOM 1093 CA ILE A 69 -11.361 12.447 10.175 1.00 10.12 C ATOM 1094 C ILE A 69 -10.104 12.736 10.989 1.00 33.42 C ATOM 1095 O ILE A 69 -9.069 13.111 10.439 1.00 24.33 O ATOM 1096 CB ILE A 69 -12.254 13.702 10.169 1.00 34.42 C ATOM 1097 CG1 ILE A 69 -13.471 13.484 9.267 1.00 64.03 C ATOM 1098 CG2 ILE A 69 -11.460 14.916 9.713 1.00 65.35 C ATOM 1099 CD1 ILE A 69 -14.665 14.330 9.648 1.00 33.43 C ATOM 0 H ILE A 69 -13.046 11.468 10.947 1.00 22.43 H new ATOM 0 HA ILE A 69 -11.080 12.206 9.150 1.00 10.12 H new ATOM 0 HB ILE A 69 -12.606 13.884 11.184 1.00 34.42 H new ATOM 0 HG12 ILE A 69 -13.193 13.705 8.236 1.00 64.03 H new ATOM 0 HG13 ILE A 69 -13.755 12.432 9.302 1.00 64.03 H new ATOM 0 HG21 ILE A 69 -12.105 15.794 9.714 1.00 65.35 H new ATOM 0 HG22 ILE A 69 -10.623 15.080 10.392 1.00 65.35 H new ATOM 0 HG23 ILE A 69 -11.081 14.746 8.705 1.00 65.35 H new ATOM 0 HD11 ILE A 69 -15.490 14.123 8.966 1.00 33.43 H new ATOM 0 HD12 ILE A 69 -14.969 14.092 10.668 1.00 33.43 H new ATOM 0 HD13 ILE A 69 -14.398 15.385 9.585 1.00 33.43 H new ATOM 1111 N ASP A 70 -10.202 12.556 12.302 1.00 53.32 N ATOM 1112 CA ASP A 70 -9.072 12.794 13.192 1.00 14.45 C ATOM 1113 C ASP A 70 -7.872 11.945 12.787 1.00 72.41 C ATOM 1114 O ASP A 70 -6.777 12.463 12.569 1.00 73.01 O ATOM 1115 CB ASP A 70 -9.463 12.490 14.639 1.00 32.35 C ATOM 1116 CG ASP A 70 -8.258 12.235 15.523 1.00 10.23 C ATOM 1117 OD1 ASP A 70 -7.226 12.911 15.329 1.00 0.52 O ATOM 1118 OD2 ASP A 70 -8.347 11.360 16.410 1.00 51.43 O ATOM 0 H ASP A 70 -11.052 12.246 12.773 1.00 53.32 H new ATOM 0 HA ASP A 70 -8.793 13.845 13.112 1.00 14.45 H new ATOM 0 HB2 ASP A 70 -10.035 13.326 15.041 1.00 32.35 H new ATOM 0 HB3 ASP A 70 -10.117 11.618 14.660 1.00 32.35 H new ATOM 1123 N SER A 71 -8.086 10.636 12.689 1.00 40.42 N ATOM 1124 CA SER A 71 -7.021 9.714 12.314 1.00 24.33 C ATOM 1125 C SER A 71 -6.408 10.107 10.974 1.00 62.14 C ATOM 1126 O SER A 71 -5.235 10.473 10.899 1.00 44.31 O ATOM 1127 CB SER A 71 -7.558 8.283 12.242 1.00 10.14 C ATOM 1128 OG SER A 71 -6.507 7.338 12.341 1.00 22.11 O ATOM 0 H SER A 71 -8.987 10.191 12.864 1.00 40.42 H new ATOM 0 HA SER A 71 -6.245 9.765 13.078 1.00 24.33 H new ATOM 0 HB2 SER A 71 -8.275 8.120 13.046 1.00 10.14 H new ATOM 0 HB3 SER A 71 -8.093 8.139 11.304 1.00 10.14 H new ATOM 0 HG SER A 71 -6.484 6.789 11.530 1.00 22.11 H new ATOM 1134 N ILE A 72 -7.210 10.028 9.918 1.00 73.24 N ATOM 1135 CA ILE A 72 -6.748 10.376 8.580 1.00 52.12 C ATOM 1136 C ILE A 72 -6.093 11.753 8.566 1.00 60.04 C ATOM 1137 O ILE A 72 -5.034 11.942 7.970 1.00 65.25 O ATOM 1138 CB ILE A 72 -7.905 10.360 7.563 1.00 64.23 C ATOM 1139 CG1 ILE A 72 -8.330 8.921 7.264 1.00 64.32 C ATOM 1140 CG2 ILE A 72 -7.495 11.073 6.283 1.00 4.52 C ATOM 1141 CD1 ILE A 72 -9.462 8.820 6.267 1.00 75.05 C ATOM 0 H ILE A 72 -8.183 9.726 9.963 1.00 73.24 H new ATOM 0 HA ILE A 72 -6.013 9.623 8.294 1.00 52.12 H new ATOM 0 HB ILE A 72 -8.755 10.888 7.994 1.00 64.23 H new ATOM 0 HG12 ILE A 72 -7.471 8.369 6.883 1.00 64.32 H new ATOM 0 HG13 ILE A 72 -8.632 8.439 8.194 1.00 64.32 H new ATOM 0 HG21 ILE A 72 -8.323 11.053 5.574 1.00 4.52 H new ATOM 0 HG22 ILE A 72 -7.236 12.107 6.510 1.00 4.52 H new ATOM 0 HG23 ILE A 72 -6.632 10.570 5.847 1.00 4.52 H new ATOM 0 HD11 ILE A 72 -9.710 7.771 6.103 1.00 75.05 H new ATOM 0 HD12 ILE A 72 -10.336 9.344 6.654 1.00 75.05 H new ATOM 0 HD13 ILE A 72 -9.157 9.272 5.323 1.00 75.05 H new ATOM 1153 N GLY A 73 -6.731 12.713 9.229 1.00 62.03 N ATOM 1154 CA GLY A 73 -6.194 14.060 9.281 1.00 15.45 C ATOM 1155 C GLY A 73 -4.758 14.094 9.766 1.00 55.33 C ATOM 1156 O GLY A 73 -3.877 14.612 9.080 1.00 52.24 O ATOM 0 H GLY A 73 -7.609 12.582 9.731 1.00 62.03 H new ATOM 0 HA2 GLY A 73 -6.250 14.509 8.289 1.00 15.45 H new ATOM 0 HA3 GLY A 73 -6.812 14.669 9.941 1.00 15.45 H new ATOM 1160 N ARG A 74 -4.522 13.542 10.951 1.00 13.54 N ATOM 1161 CA ARG A 74 -3.184 13.514 11.528 1.00 45.40 C ATOM 1162 C ARG A 74 -2.183 12.903 10.551 1.00 55.42 C ATOM 1163 O ARG A 74 -1.196 13.538 10.180 1.00 73.31 O ATOM 1164 CB ARG A 74 -3.185 12.721 12.836 1.00 61.32 C ATOM 1165 CG ARG A 74 -3.725 13.502 14.022 1.00 13.40 C ATOM 1166 CD ARG A 74 -3.143 12.998 15.333 1.00 34.03 C ATOM 1167 NE ARG A 74 -3.926 11.899 15.893 1.00 52.23 N ATOM 1168 CZ ARG A 74 -3.707 10.621 15.606 1.00 32.34 C ATOM 1169 NH1 ARG A 74 -2.734 10.282 14.772 1.00 31.11 N ATOM 1170 NH2 ARG A 74 -4.462 9.678 16.156 1.00 72.23 N ATOM 0 H ARG A 74 -5.240 13.108 11.531 1.00 13.54 H new ATOM 0 HA ARG A 74 -2.884 14.541 11.735 1.00 45.40 H new ATOM 0 HB2 ARG A 74 -3.783 11.819 12.704 1.00 61.32 H new ATOM 0 HB3 ARG A 74 -2.167 12.400 13.057 1.00 61.32 H new ATOM 0 HG2 ARG A 74 -3.489 14.559 13.901 1.00 13.40 H new ATOM 0 HG3 ARG A 74 -4.811 13.419 14.049 1.00 13.40 H new ATOM 0 HD2 ARG A 74 -2.117 12.666 15.171 1.00 34.03 H new ATOM 0 HD3 ARG A 74 -3.103 13.817 16.051 1.00 34.03 H new ATOM 0 HE ARG A 74 -4.682 12.126 16.539 1.00 52.23 H new ATOM 0 HH11 ARG A 74 -2.151 11.004 14.349 1.00 31.11 H new ATOM 0 HH12 ARG A 74 -2.569 9.299 14.554 1.00 31.11 H new ATOM 0 HH21 ARG A 74 -5.211 9.935 16.799 1.00 72.23 H new ATOM 0 HH22 ARG A 74 -4.293 8.697 15.935 1.00 72.23 H new ATOM 1184 N ALA A 75 -2.446 11.668 10.138 1.00 33.45 N ATOM 1185 CA ALA A 75 -1.571 10.972 9.204 1.00 63.32 C ATOM 1186 C ALA A 75 -1.294 11.826 7.971 1.00 23.33 C ATOM 1187 O ALA A 75 -0.142 12.137 7.666 1.00 53.11 O ATOM 1188 CB ALA A 75 -2.184 9.640 8.798 1.00 21.53 C ATOM 0 H ALA A 75 -3.259 11.129 10.436 1.00 33.45 H new ATOM 0 HA ALA A 75 -0.622 10.785 9.706 1.00 63.32 H new ATOM 0 HB1 ALA A 75 -1.519 9.131 8.100 1.00 21.53 H new ATOM 0 HB2 ALA A 75 -2.325 9.019 9.683 1.00 21.53 H new ATOM 0 HB3 ALA A 75 -3.148 9.814 8.320 1.00 21.53 H new ATOM 1194 N TYR A 76 -2.355 12.201 7.267 1.00 73.24 N ATOM 1195 CA TYR A 76 -2.226 13.017 6.065 1.00 62.50 C ATOM 1196 C TYR A 76 -1.367 14.249 6.333 1.00 33.10 C ATOM 1197 O TYR A 76 -0.477 14.583 5.550 1.00 71.42 O ATOM 1198 CB TYR A 76 -3.606 13.442 5.561 1.00 2.31 C ATOM 1199 CG TYR A 76 -4.184 12.511 4.520 1.00 34.32 C ATOM 1200 CD1 TYR A 76 -3.978 11.139 4.596 1.00 32.43 C ATOM 1201 CD2 TYR A 76 -4.936 13.002 3.460 1.00 12.12 C ATOM 1202 CE1 TYR A 76 -4.504 10.283 3.647 1.00 12.53 C ATOM 1203 CE2 TYR A 76 -5.467 12.154 2.508 1.00 52.44 C ATOM 1204 CZ TYR A 76 -5.248 10.796 2.605 1.00 13.12 C ATOM 1205 OH TYR A 76 -5.774 9.948 1.657 1.00 14.44 O ATOM 0 H TYR A 76 -3.315 11.953 7.507 1.00 73.24 H new ATOM 0 HA TYR A 76 -1.737 12.416 5.299 1.00 62.50 H new ATOM 0 HB2 TYR A 76 -4.291 13.498 6.407 1.00 2.31 H new ATOM 0 HB3 TYR A 76 -3.537 14.445 5.141 1.00 2.31 H new ATOM 0 HD1 TYR A 76 -3.397 10.734 5.411 1.00 32.43 H new ATOM 0 HD2 TYR A 76 -5.108 14.065 3.379 1.00 12.12 H new ATOM 0 HE1 TYR A 76 -4.334 9.219 3.721 1.00 12.53 H new ATOM 0 HE2 TYR A 76 -6.051 12.553 1.692 1.00 52.44 H new ATOM 0 HH TYR A 76 -6.272 10.469 0.993 1.00 14.44 H new ATOM 1215 N LEU A 77 -1.641 14.921 7.446 1.00 43.34 N ATOM 1216 CA LEU A 77 -0.894 16.117 7.820 1.00 42.33 C ATOM 1217 C LEU A 77 0.606 15.840 7.835 1.00 40.21 C ATOM 1218 O LEU A 77 1.383 16.541 7.186 1.00 25.15 O ATOM 1219 CB LEU A 77 -1.346 16.616 9.193 1.00 22.24 C ATOM 1220 CG LEU A 77 -0.575 17.808 9.762 1.00 60.21 C ATOM 1221 CD1 LEU A 77 -1.308 19.107 9.467 1.00 42.23 C ATOM 1222 CD2 LEU A 77 -0.364 17.641 11.260 1.00 64.14 C ATOM 0 H LEU A 77 -2.374 14.658 8.105 1.00 43.34 H new ATOM 0 HA LEU A 77 -1.095 16.888 7.076 1.00 42.33 H new ATOM 0 HB2 LEU A 77 -2.400 16.887 9.130 1.00 22.24 H new ATOM 0 HB3 LEU A 77 -1.271 15.790 9.900 1.00 22.24 H new ATOM 0 HG LEU A 77 0.402 17.848 9.280 1.00 60.21 H new ATOM 0 HD11 LEU A 77 -0.745 19.944 9.879 1.00 42.23 H new ATOM 0 HD12 LEU A 77 -1.407 19.232 8.389 1.00 42.23 H new ATOM 0 HD13 LEU A 77 -2.298 19.077 9.921 1.00 42.23 H new ATOM 0 HD21 LEU A 77 0.186 18.498 11.648 1.00 64.14 H new ATOM 0 HD22 LEU A 77 -1.331 17.575 11.759 1.00 64.14 H new ATOM 0 HD23 LEU A 77 0.204 16.730 11.448 1.00 64.14 H new ATOM 1234 N ASP A 78 1.005 14.813 8.577 1.00 1.31 N ATOM 1235 CA ASP A 78 2.412 14.441 8.674 1.00 33.11 C ATOM 1236 C ASP A 78 3.004 14.190 7.291 1.00 71.41 C ATOM 1237 O ASP A 78 4.130 14.595 7.005 1.00 22.42 O ATOM 1238 CB ASP A 78 2.572 13.194 9.545 1.00 3.25 C ATOM 1239 CG ASP A 78 3.548 13.407 10.686 1.00 21.11 C ATOM 1240 OD1 ASP A 78 3.298 14.301 11.521 1.00 21.22 O ATOM 1241 OD2 ASP A 78 4.562 12.680 10.743 1.00 22.02 O ATOM 0 H ASP A 78 0.374 14.223 9.120 1.00 1.31 H new ATOM 0 HA ASP A 78 2.951 15.269 9.135 1.00 33.11 H new ATOM 0 HB2 ASP A 78 1.601 12.910 9.950 1.00 3.25 H new ATOM 0 HB3 ASP A 78 2.915 12.364 8.927 1.00 3.25 H new ATOM 1246 N GLU A 79 2.237 13.518 6.437 1.00 22.04 N ATOM 1247 CA GLU A 79 2.688 13.211 5.085 1.00 50.40 C ATOM 1248 C GLU A 79 3.087 14.484 4.343 1.00 60.31 C ATOM 1249 O GLU A 79 4.269 14.733 4.105 1.00 43.13 O ATOM 1250 CB GLU A 79 1.589 12.480 4.311 1.00 64.21 C ATOM 1251 CG GLU A 79 1.675 10.966 4.416 1.00 4.50 C ATOM 1252 CD GLU A 79 2.989 10.419 3.892 1.00 74.14 C ATOM 1253 OE1 GLU A 79 3.130 10.297 2.657 1.00 25.11 O ATOM 1254 OE2 GLU A 79 3.875 10.113 4.717 1.00 72.22 O ATOM 0 H GLU A 79 1.302 13.176 6.658 1.00 22.04 H new ATOM 0 HA GLU A 79 3.562 12.564 5.159 1.00 50.40 H new ATOM 0 HB2 GLU A 79 0.617 12.807 4.681 1.00 64.21 H new ATOM 0 HB3 GLU A 79 1.644 12.767 3.261 1.00 64.21 H new ATOM 0 HG2 GLU A 79 1.552 10.670 5.458 1.00 4.50 H new ATOM 0 HG3 GLU A 79 0.852 10.519 3.859 1.00 4.50 H new ATOM 1261 N THR A 80 2.092 15.286 3.979 1.00 53.51 N ATOM 1262 CA THR A 80 2.337 16.532 3.263 1.00 62.23 C ATOM 1263 C THR A 80 3.327 17.413 4.016 1.00 42.15 C ATOM 1264 O THR A 80 4.202 18.035 3.413 1.00 64.32 O ATOM 1265 CB THR A 80 1.032 17.319 3.041 1.00 12.11 C ATOM 1266 OG1 THR A 80 1.325 18.706 2.838 1.00 73.12 O ATOM 1267 CG2 THR A 80 0.097 17.162 4.231 1.00 53.14 C ATOM 0 H THR A 80 1.108 15.095 4.168 1.00 53.51 H new ATOM 0 HA THR A 80 2.758 16.262 2.295 1.00 62.23 H new ATOM 0 HB THR A 80 0.538 16.919 2.155 1.00 12.11 H new ATOM 0 HG1 THR A 80 1.881 18.809 2.038 1.00 73.12 H new ATOM 0 HG21 THR A 80 -0.818 17.726 4.052 1.00 53.14 H new ATOM 0 HG22 THR A 80 -0.147 16.108 4.365 1.00 53.14 H new ATOM 0 HG23 THR A 80 0.585 17.539 5.130 1.00 53.14 H new ATOM 1275 N ARG A 81 3.184 17.462 5.336 1.00 54.11 N ATOM 1276 CA ARG A 81 4.066 18.268 6.171 1.00 52.31 C ATOM 1277 C ARG A 81 5.527 17.897 5.936 1.00 71.54 C ATOM 1278 O ARG A 81 6.401 18.763 5.903 1.00 73.10 O ATOM 1279 CB ARG A 81 3.713 18.084 7.648 1.00 3.52 C ATOM 1280 CG ARG A 81 4.575 18.912 8.588 1.00 63.05 C ATOM 1281 CD ARG A 81 4.166 20.376 8.575 1.00 52.44 C ATOM 1282 NE ARG A 81 4.445 21.034 9.848 1.00 13.04 N ATOM 1283 CZ ARG A 81 4.242 22.329 10.067 1.00 22.51 C ATOM 1284 NH1 ARG A 81 3.761 23.100 9.102 1.00 62.01 N ATOM 1285 NH2 ARG A 81 4.520 22.854 11.253 1.00 23.34 N ATOM 0 H ARG A 81 2.465 16.953 5.851 1.00 54.11 H new ATOM 0 HA ARG A 81 3.927 19.314 5.899 1.00 52.31 H new ATOM 0 HB2 ARG A 81 2.667 18.350 7.799 1.00 3.52 H new ATOM 0 HB3 ARG A 81 3.815 17.031 7.909 1.00 3.52 H new ATOM 0 HG2 ARG A 81 4.491 18.519 9.601 1.00 63.05 H new ATOM 0 HG3 ARG A 81 5.622 18.823 8.297 1.00 63.05 H new ATOM 0 HD2 ARG A 81 4.697 20.893 7.776 1.00 52.44 H new ATOM 0 HD3 ARG A 81 3.102 20.453 8.353 1.00 52.44 H new ATOM 0 HE ARG A 81 4.816 20.469 10.611 1.00 13.04 H new ATOM 0 HH11 ARG A 81 3.546 22.700 8.189 1.00 62.01 H new ATOM 0 HH12 ARG A 81 3.606 24.094 9.273 1.00 62.01 H new ATOM 0 HH21 ARG A 81 4.890 22.264 11.998 1.00 23.34 H new ATOM 0 HH22 ARG A 81 4.364 23.848 11.420 1.00 23.34 H new ATOM 1299 N SER A 82 5.784 16.603 5.773 1.00 61.34 N ATOM 1300 CA SER A 82 7.140 16.116 5.545 1.00 75.43 C ATOM 1301 C SER A 82 7.806 16.878 4.403 1.00 31.43 C ATOM 1302 O SER A 82 8.843 17.513 4.589 1.00 53.11 O ATOM 1303 CB SER A 82 7.120 14.618 5.231 1.00 50.44 C ATOM 1304 OG SER A 82 8.292 13.982 5.709 1.00 61.41 O ATOM 0 H SER A 82 5.072 15.873 5.795 1.00 61.34 H new ATOM 0 HA SER A 82 7.717 16.282 6.454 1.00 75.43 H new ATOM 0 HB2 SER A 82 6.242 14.159 5.686 1.00 50.44 H new ATOM 0 HB3 SER A 82 7.035 14.470 4.154 1.00 50.44 H new ATOM 0 HG SER A 82 8.255 13.026 5.498 1.00 61.41 H new ATOM 1310 N ASN A 83 7.202 16.808 3.222 1.00 55.14 N ATOM 1311 CA ASN A 83 7.736 17.491 2.049 1.00 73.44 C ATOM 1312 C ASN A 83 7.113 18.875 1.894 1.00 73.42 C ATOM 1313 O ASN A 83 7.745 19.888 2.192 1.00 72.02 O ATOM 1314 CB ASN A 83 7.480 16.660 0.789 1.00 1.22 C ATOM 1315 CG ASN A 83 7.742 17.443 -0.483 1.00 14.52 C ATOM 1316 OD1 ASN A 83 6.946 17.408 -1.422 1.00 20.15 O ATOM 1317 ND2 ASN A 83 8.862 18.156 -0.519 1.00 14.01 N ATOM 0 H ASN A 83 6.343 16.286 3.051 1.00 55.14 H new ATOM 0 HA ASN A 83 8.811 17.610 2.186 1.00 73.44 H new ATOM 0 HB2 ASN A 83 8.116 15.775 0.805 1.00 1.22 H new ATOM 0 HB3 ASN A 83 6.448 16.310 0.791 1.00 1.22 H new ATOM 0 HD21 ASN A 83 9.091 18.704 -1.348 1.00 14.01 H new ATOM 0 HD22 ASN A 83 9.493 18.156 0.283 1.00 14.01 H new ATOM 1324 N SER A 84 5.869 18.909 1.426 1.00 31.22 N ATOM 1325 CA SER A 84 5.161 20.168 1.229 1.00 51.24 C ATOM 1326 C SER A 84 3.715 19.919 0.811 1.00 60.25 C ATOM 1327 O SER A 84 3.258 18.777 0.766 1.00 5.34 O ATOM 1328 CB SER A 84 5.871 21.016 0.171 1.00 15.12 C ATOM 1329 OG SER A 84 5.482 22.376 0.263 1.00 70.21 O ATOM 0 H SER A 84 5.331 18.079 1.176 1.00 31.22 H new ATOM 0 HA SER A 84 5.159 20.707 2.176 1.00 51.24 H new ATOM 0 HB2 SER A 84 6.950 20.934 0.299 1.00 15.12 H new ATOM 0 HB3 SER A 84 5.637 20.634 -0.823 1.00 15.12 H new ATOM 0 HG SER A 84 5.950 22.897 -0.422 1.00 70.21 H new ATOM 1335 N ASN A 85 3.000 20.996 0.504 1.00 11.44 N ATOM 1336 CA ASN A 85 1.605 20.896 0.090 1.00 22.12 C ATOM 1337 C ASN A 85 1.475 21.045 -1.423 1.00 31.34 C ATOM 1338 O ASN A 85 2.471 21.040 -2.145 1.00 64.12 O ATOM 1339 CB ASN A 85 0.764 21.964 0.793 1.00 24.52 C ATOM 1340 CG ASN A 85 1.135 23.369 0.361 1.00 63.14 C ATOM 1341 OD1 ASN A 85 0.960 23.739 -0.800 1.00 44.53 O ATOM 1342 ND2 ASN A 85 1.651 24.159 1.295 1.00 32.14 N ATOM 0 H ASN A 85 3.364 21.949 0.534 1.00 11.44 H new ATOM 0 HA ASN A 85 1.238 19.910 0.374 1.00 22.12 H new ATOM 0 HB2 ASN A 85 -0.291 21.789 0.582 1.00 24.52 H new ATOM 0 HB3 ASN A 85 0.893 21.872 1.871 1.00 24.52 H new ATOM 0 HD21 ASN A 85 1.920 25.115 1.063 1.00 32.14 H new ATOM 0 HD22 ASN A 85 1.778 23.810 2.245 1.00 32.14 H new ATOM 1349 N SER A 86 0.239 21.177 -1.894 1.00 44.25 N ATOM 1350 CA SER A 86 -0.022 21.324 -3.321 1.00 51.45 C ATOM 1351 C SER A 86 -0.943 22.512 -3.585 1.00 72.34 C ATOM 1352 O SER A 86 -1.312 23.242 -2.666 1.00 5.14 O ATOM 1353 CB SER A 86 -0.647 20.045 -3.882 1.00 11.25 C ATOM 1354 OG SER A 86 -0.328 19.879 -5.252 1.00 40.42 O ATOM 0 H SER A 86 -0.596 21.185 -1.309 1.00 44.25 H new ATOM 0 HA SER A 86 0.929 21.505 -3.822 1.00 51.45 H new ATOM 0 HB2 SER A 86 -0.291 19.184 -3.316 1.00 11.25 H new ATOM 0 HB3 SER A 86 -1.729 20.082 -3.759 1.00 11.25 H new ATOM 0 HG SER A 86 -0.738 19.054 -5.586 1.00 40.42 H new ATOM 1360 N SER A 87 -1.311 22.698 -4.849 1.00 33.40 N ATOM 1361 CA SER A 87 -2.186 23.798 -5.236 1.00 52.03 C ATOM 1362 C SER A 87 -3.509 23.732 -4.479 1.00 53.35 C ATOM 1363 O SER A 87 -3.724 22.841 -3.658 1.00 4.00 O ATOM 1364 CB SER A 87 -2.446 23.765 -6.744 1.00 23.13 C ATOM 1365 OG SER A 87 -2.299 22.453 -7.258 1.00 23.43 O ATOM 0 H SER A 87 -1.017 22.101 -5.622 1.00 33.40 H new ATOM 0 HA SER A 87 -1.687 24.733 -4.981 1.00 52.03 H new ATOM 0 HB2 SER A 87 -3.452 24.129 -6.951 1.00 23.13 H new ATOM 0 HB3 SER A 87 -1.753 24.437 -7.250 1.00 23.13 H new ATOM 0 HG SER A 87 -2.472 22.458 -8.223 1.00 23.43 H new ATOM 1371 N SER A 88 -4.394 24.683 -4.763 1.00 2.21 N ATOM 1372 CA SER A 88 -5.695 24.737 -4.107 1.00 30.10 C ATOM 1373 C SER A 88 -6.823 24.623 -5.128 1.00 31.42 C ATOM 1374 O SER A 88 -7.831 25.322 -5.037 1.00 4.54 O ATOM 1375 CB SER A 88 -5.838 26.039 -3.316 1.00 63.40 C ATOM 1376 OG SER A 88 -5.549 27.163 -4.128 1.00 51.34 O ATOM 0 H SER A 88 -4.233 25.426 -5.443 1.00 2.21 H new ATOM 0 HA SER A 88 -5.763 23.894 -3.420 1.00 30.10 H new ATOM 0 HB2 SER A 88 -6.852 26.121 -2.924 1.00 63.40 H new ATOM 0 HB3 SER A 88 -5.165 26.023 -2.459 1.00 63.40 H new ATOM 0 HG SER A 88 -5.649 27.982 -3.600 1.00 51.34 H new ATOM 1382 N ASN A 89 -6.645 23.734 -6.100 1.00 42.23 N ATOM 1383 CA ASN A 89 -7.647 23.527 -7.140 1.00 3.53 C ATOM 1384 C ASN A 89 -7.839 22.041 -7.422 1.00 31.53 C ATOM 1385 O ASN A 89 -6.952 21.380 -7.963 1.00 31.35 O ATOM 1386 CB ASN A 89 -7.237 24.253 -8.423 1.00 73.32 C ATOM 1387 CG ASN A 89 -8.076 23.835 -9.616 1.00 24.21 C ATOM 1388 OD1 ASN A 89 -7.622 23.075 -10.472 1.00 10.21 O ATOM 1389 ND2 ASN A 89 -9.306 24.331 -9.677 1.00 41.01 N ATOM 0 H ASN A 89 -5.817 23.146 -6.189 1.00 42.23 H new ATOM 0 HA ASN A 89 -8.593 23.936 -6.785 1.00 3.53 H new ATOM 0 HB2 ASN A 89 -7.331 25.329 -8.275 1.00 73.32 H new ATOM 0 HB3 ASN A 89 -6.187 24.051 -8.632 1.00 73.32 H new ATOM 0 HD21 ASN A 89 -9.917 24.086 -10.456 1.00 41.01 H new ATOM 0 HD22 ASN A 89 -9.640 24.957 -8.945 1.00 41.01 H new ATOM 1396 N LYS A 90 -9.004 21.520 -7.052 1.00 73.22 N ATOM 1397 CA LYS A 90 -9.316 20.112 -7.266 1.00 61.43 C ATOM 1398 C LYS A 90 -8.386 19.219 -6.451 1.00 70.52 C ATOM 1399 O LYS A 90 -7.263 19.594 -6.114 1.00 50.21 O ATOM 1400 CB LYS A 90 -9.202 19.763 -8.752 1.00 51.01 C ATOM 1401 CG LYS A 90 -9.929 20.737 -9.663 1.00 12.22 C ATOM 1402 CD LYS A 90 -10.192 20.131 -11.031 1.00 44.43 C ATOM 1403 CE LYS A 90 -9.059 20.433 -12.001 1.00 54.40 C ATOM 1404 NZ LYS A 90 -7.794 19.757 -11.604 1.00 4.04 N ATOM 0 H LYS A 90 -9.748 22.053 -6.602 1.00 73.22 H new ATOM 0 HA LYS A 90 -10.340 19.938 -6.936 1.00 61.43 H new ATOM 0 HB2 LYS A 90 -8.148 19.735 -9.030 1.00 51.01 H new ATOM 0 HB3 LYS A 90 -9.601 18.761 -8.913 1.00 51.01 H new ATOM 0 HG2 LYS A 90 -10.874 21.028 -9.205 1.00 12.22 H new ATOM 0 HG3 LYS A 90 -9.336 21.645 -9.774 1.00 12.22 H new ATOM 0 HD2 LYS A 90 -10.313 19.052 -10.935 1.00 44.43 H new ATOM 0 HD3 LYS A 90 -11.128 20.522 -11.430 1.00 44.43 H new ATOM 0 HE2 LYS A 90 -9.343 20.112 -13.003 1.00 54.40 H new ATOM 0 HE3 LYS A 90 -8.897 21.510 -12.046 1.00 54.40 H new ATOM 0 HZ1 LYS A 90 -7.202 19.606 -12.446 1.00 4.04 H new ATOM 0 HZ2 LYS A 90 -7.281 20.352 -10.923 1.00 4.04 H new ATOM 0 HZ3 LYS A 90 -8.013 18.840 -11.166 1.00 4.04 H new ATOM 1418 N PRO A 91 -8.862 18.007 -6.127 1.00 64.11 N ATOM 1419 CA PRO A 91 -8.088 17.035 -5.349 1.00 65.24 C ATOM 1420 C PRO A 91 -6.909 16.470 -6.135 1.00 52.14 C ATOM 1421 O PRO A 91 -6.808 16.664 -7.346 1.00 70.11 O ATOM 1422 CB PRO A 91 -9.105 15.932 -5.046 1.00 13.52 C ATOM 1423 CG PRO A 91 -10.111 16.034 -6.140 1.00 70.42 C ATOM 1424 CD PRO A 91 -10.191 17.493 -6.495 1.00 73.53 C ATOM 0 HA PRO A 91 -7.648 17.484 -4.459 1.00 65.24 H new ATOM 0 HB2 PRO A 91 -8.632 14.950 -5.033 1.00 13.52 H new ATOM 0 HB3 PRO A 91 -9.566 16.076 -4.069 1.00 13.52 H new ATOM 0 HG2 PRO A 91 -9.811 15.439 -7.002 1.00 70.42 H new ATOM 0 HG3 PRO A 91 -11.081 15.658 -5.814 1.00 70.42 H new ATOM 0 HD2 PRO A 91 -10.398 17.638 -7.555 1.00 73.53 H new ATOM 0 HD3 PRO A 91 -10.984 17.998 -5.943 1.00 73.53 H new ATOM 1432 N GLY A 92 -6.020 15.770 -5.438 1.00 64.32 N ATOM 1433 CA GLY A 92 -4.860 15.187 -6.088 1.00 50.30 C ATOM 1434 C GLY A 92 -3.971 14.432 -5.120 1.00 75.40 C ATOM 1435 O GLY A 92 -3.352 13.431 -5.484 1.00 52.43 O ATOM 0 H GLY A 92 -6.082 15.596 -4.435 1.00 64.32 H new ATOM 0 HA2 GLY A 92 -5.191 14.510 -6.876 1.00 50.30 H new ATOM 0 HA3 GLY A 92 -4.281 15.976 -6.568 1.00 50.30 H new ATOM 1439 N THR A 93 -3.906 14.911 -3.882 1.00 20.34 N ATOM 1440 CA THR A 93 -3.084 14.276 -2.859 1.00 35.21 C ATOM 1441 C THR A 93 -3.491 14.735 -1.463 1.00 52.25 C ATOM 1442 O THR A 93 -4.453 15.487 -1.303 1.00 54.11 O ATOM 1443 CB THR A 93 -1.589 14.579 -3.071 1.00 72.33 C ATOM 1444 OG1 THR A 93 -1.434 15.843 -3.725 1.00 4.44 O ATOM 1445 CG2 THR A 93 -0.929 13.488 -3.902 1.00 1.53 C ATOM 0 H THR A 93 -4.413 15.737 -3.563 1.00 20.34 H new ATOM 0 HA THR A 93 -3.245 13.202 -2.947 1.00 35.21 H new ATOM 0 HB THR A 93 -1.105 14.614 -2.095 1.00 72.33 H new ATOM 0 HG1 THR A 93 -0.481 16.029 -3.855 1.00 4.44 H new ATOM 0 HG21 THR A 93 0.126 13.723 -4.039 1.00 1.53 H new ATOM 0 HG22 THR A 93 -1.024 12.531 -3.388 1.00 1.53 H new ATOM 0 HG23 THR A 93 -1.416 13.427 -4.875 1.00 1.53 H new ATOM 1453 N CYS A 94 -2.753 14.280 -0.457 1.00 70.14 N ATOM 1454 CA CYS A 94 -3.037 14.645 0.926 1.00 75.20 C ATOM 1455 C CYS A 94 -3.307 16.141 1.049 1.00 33.11 C ATOM 1456 O CYS A 94 -4.249 16.558 1.723 1.00 44.40 O ATOM 1457 CB CYS A 94 -1.869 14.249 1.830 1.00 34.22 C ATOM 1458 SG CYS A 94 -0.240 14.547 1.105 1.00 52.41 S ATOM 0 H CYS A 94 -1.953 13.658 -0.573 1.00 70.14 H new ATOM 0 HA CYS A 94 -3.930 14.106 1.242 1.00 75.20 H new ATOM 0 HB2 CYS A 94 -1.945 14.802 2.766 1.00 34.22 H new ATOM 0 HB3 CYS A 94 -1.957 13.191 2.077 1.00 34.22 H new ATOM 0 HG CYS A 94 0.682 14.183 1.946 1.00 52.41 H new ATOM 1464 N ALA A 95 -2.474 16.943 0.395 1.00 42.02 N ATOM 1465 CA ALA A 95 -2.623 18.393 0.431 1.00 64.42 C ATOM 1466 C ALA A 95 -4.087 18.797 0.304 1.00 53.42 C ATOM 1467 O ALA A 95 -4.728 19.165 1.289 1.00 30.22 O ATOM 1468 CB ALA A 95 -1.798 19.035 -0.674 1.00 43.34 C ATOM 0 H ALA A 95 -1.689 16.614 -0.166 1.00 42.02 H new ATOM 0 HA ALA A 95 -2.258 18.748 1.395 1.00 64.42 H new ATOM 0 HB1 ALA A 95 -1.918 20.118 -0.636 1.00 43.34 H new ATOM 0 HB2 ALA A 95 -0.747 18.782 -0.537 1.00 43.34 H new ATOM 0 HB3 ALA A 95 -2.137 18.666 -1.642 1.00 43.34 H new ATOM 1474 N HIS A 96 -4.612 18.729 -0.916 1.00 31.54 N ATOM 1475 CA HIS A 96 -6.002 19.088 -1.171 1.00 53.31 C ATOM 1476 C HIS A 96 -6.937 18.363 -0.208 1.00 71.41 C ATOM 1477 O HIS A 96 -7.958 18.908 0.210 1.00 73.53 O ATOM 1478 CB HIS A 96 -6.380 18.756 -2.615 1.00 32.12 C ATOM 1479 CG HIS A 96 -7.373 19.707 -3.209 1.00 3.55 C ATOM 1480 ND1 HIS A 96 -8.708 19.591 -3.396 1.00 53.10 N flip ATOM 1481 CD2 HIS A 96 -7.026 20.951 -3.693 1.00 72.11 C flip ATOM 1482 CE1 HIS A 96 -9.140 20.755 -3.983 1.00 41.13 C flip ATOM 1483 NE2 HIS A 96 -8.106 21.559 -4.151 1.00 60.32 N flip ATOM 0 H HIS A 96 -4.096 18.429 -1.743 1.00 31.54 H new ATOM 0 HA HIS A 96 -6.109 20.161 -1.013 1.00 53.31 H new ATOM 0 HB2 HIS A 96 -5.478 18.756 -3.227 1.00 32.12 H new ATOM 0 HB3 HIS A 96 -6.790 17.747 -2.652 1.00 32.12 H new ATOM 0 HD1 HIS A 96 -9.286 18.788 -3.147 1.00 53.10 H new ATOM 0 HD2 HIS A 96 -6.028 21.364 -3.697 1.00 72.11 H new ATOM 0 HE1 HIS A 96 -10.160 20.977 -4.262 1.00 41.13 H new ATOM 1491 N ALA A 97 -6.581 17.130 0.139 1.00 4.31 N ATOM 1492 CA ALA A 97 -7.387 16.331 1.053 1.00 23.13 C ATOM 1493 C ALA A 97 -7.594 17.055 2.379 1.00 54.40 C ATOM 1494 O ALA A 97 -8.728 17.273 2.807 1.00 53.01 O ATOM 1495 CB ALA A 97 -6.734 14.977 1.286 1.00 24.45 C ATOM 0 H ALA A 97 -5.740 16.663 -0.199 1.00 4.31 H new ATOM 0 HA ALA A 97 -8.365 16.177 0.596 1.00 23.13 H new ATOM 0 HB1 ALA A 97 -7.347 14.391 1.971 1.00 24.45 H new ATOM 0 HB2 ALA A 97 -6.643 14.449 0.337 1.00 24.45 H new ATOM 0 HB3 ALA A 97 -5.743 15.120 1.718 1.00 24.45 H new ATOM 1501 N ILE A 98 -6.494 17.426 3.024 1.00 25.54 N ATOM 1502 CA ILE A 98 -6.556 18.126 4.301 1.00 31.22 C ATOM 1503 C ILE A 98 -7.377 19.406 4.187 1.00 60.25 C ATOM 1504 O ILE A 98 -8.333 19.611 4.933 1.00 30.10 O ATOM 1505 CB ILE A 98 -5.149 18.476 4.821 1.00 52.34 C ATOM 1506 CG1 ILE A 98 -4.302 17.209 4.958 1.00 13.52 C ATOM 1507 CG2 ILE A 98 -5.243 19.205 6.153 1.00 22.30 C ATOM 1508 CD1 ILE A 98 -2.858 17.484 5.314 1.00 30.14 C ATOM 0 H ILE A 98 -5.548 17.254 2.683 1.00 25.54 H new ATOM 0 HA ILE A 98 -7.037 17.450 5.008 1.00 31.22 H new ATOM 0 HB ILE A 98 -4.665 19.137 4.101 1.00 52.34 H new ATOM 0 HG12 ILE A 98 -4.741 16.569 5.723 1.00 13.52 H new ATOM 0 HG13 ILE A 98 -4.337 16.655 4.020 1.00 13.52 H new ATOM 0 HG21 ILE A 98 -4.241 19.446 6.508 1.00 22.30 H new ATOM 0 HG22 ILE A 98 -5.813 20.125 6.025 1.00 22.30 H new ATOM 0 HG23 ILE A 98 -5.743 18.567 6.882 1.00 22.30 H new ATOM 0 HD11 ILE A 98 -2.317 16.541 5.395 1.00 30.14 H new ATOM 0 HD12 ILE A 98 -2.402 18.098 4.537 1.00 30.14 H new ATOM 0 HD13 ILE A 98 -2.812 18.011 6.267 1.00 30.14 H new ATOM 1520 N ASN A 99 -6.997 20.263 3.245 1.00 53.33 N ATOM 1521 CA ASN A 99 -7.699 21.524 3.031 1.00 73.32 C ATOM 1522 C ASN A 99 -9.187 21.284 2.789 1.00 25.15 C ATOM 1523 O ASN A 99 -10.037 21.990 3.332 1.00 33.33 O ATOM 1524 CB ASN A 99 -7.093 22.274 1.843 1.00 21.12 C ATOM 1525 CG ASN A 99 -8.091 22.484 0.721 1.00 15.55 C ATOM 1526 OD1 ASN A 99 -8.156 21.530 -0.200 1.00 24.03 O flip ATOM 1527 ND2 ASN A 99 -8.797 23.493 0.684 1.00 1.41 N flip ATOM 0 H ASN A 99 -6.208 20.108 2.618 1.00 53.33 H new ATOM 0 HA ASN A 99 -7.588 22.130 3.930 1.00 73.32 H new ATOM 0 HB2 ASN A 99 -6.720 23.241 2.180 1.00 21.12 H new ATOM 0 HB3 ASN A 99 -6.236 21.717 1.464 1.00 21.12 H new ATOM 0 HD21 ASN A 99 -8.713 24.201 1.414 1.00 1.41 H new ATOM 0 HD22 ASN A 99 -9.465 23.620 -0.076 1.00 1.41 H new ATOM 1534 N THR A 100 -9.494 20.282 1.971 1.00 2.12 N ATOM 1535 CA THR A 100 -10.877 19.949 1.657 1.00 34.20 C ATOM 1536 C THR A 100 -11.674 19.657 2.924 1.00 63.44 C ATOM 1537 O THR A 100 -12.708 20.276 3.176 1.00 40.21 O ATOM 1538 CB THR A 100 -10.963 18.731 0.718 1.00 25.31 C ATOM 1539 OG1 THR A 100 -10.432 19.066 -0.569 1.00 12.20 O ATOM 1540 CG2 THR A 100 -12.402 18.259 0.572 1.00 4.42 C ATOM 0 H THR A 100 -8.803 19.687 1.514 1.00 2.12 H new ATOM 0 HA THR A 100 -11.304 20.817 1.154 1.00 34.20 H new ATOM 0 HB THR A 100 -10.376 17.923 1.154 1.00 25.31 H new ATOM 0 HG1 THR A 100 -9.491 19.322 -0.478 1.00 12.20 H new ATOM 0 HG21 THR A 100 -12.437 17.398 -0.096 1.00 4.42 H new ATOM 0 HG22 THR A 100 -12.793 17.976 1.549 1.00 4.42 H new ATOM 0 HG23 THR A 100 -13.009 19.064 0.158 1.00 4.42 H new ATOM 1548 N LEU A 101 -11.186 18.710 3.718 1.00 12.10 N ATOM 1549 CA LEU A 101 -11.853 18.336 4.961 1.00 63.14 C ATOM 1550 C LEU A 101 -12.109 19.562 5.831 1.00 33.43 C ATOM 1551 O LEU A 101 -13.236 19.807 6.260 1.00 73.44 O ATOM 1552 CB LEU A 101 -11.008 17.318 5.729 1.00 41.10 C ATOM 1553 CG LEU A 101 -10.985 15.899 5.160 1.00 44.00 C ATOM 1554 CD1 LEU A 101 -9.779 15.134 5.683 1.00 44.14 C ATOM 1555 CD2 LEU A 101 -12.273 15.166 5.503 1.00 72.22 C ATOM 0 H LEU A 101 -10.332 18.187 3.524 1.00 12.10 H new ATOM 0 HA LEU A 101 -12.813 17.886 4.709 1.00 63.14 H new ATOM 0 HB2 LEU A 101 -9.983 17.687 5.774 1.00 41.10 H new ATOM 0 HB3 LEU A 101 -11.375 17.271 6.754 1.00 41.10 H new ATOM 0 HG LEU A 101 -10.906 15.964 4.075 1.00 44.00 H new ATOM 0 HD11 LEU A 101 -9.779 14.126 5.267 1.00 44.14 H new ATOM 0 HD12 LEU A 101 -8.865 15.649 5.386 1.00 44.14 H new ATOM 0 HD13 LEU A 101 -9.827 15.078 6.770 1.00 44.14 H new ATOM 0 HD21 LEU A 101 -12.239 14.158 5.090 1.00 72.22 H new ATOM 0 HD22 LEU A 101 -12.383 15.111 6.586 1.00 72.22 H new ATOM 0 HD23 LEU A 101 -13.121 15.703 5.079 1.00 72.22 H new ATOM 1567 N GLY A 102 -11.055 20.330 6.088 1.00 52.52 N ATOM 1568 CA GLY A 102 -11.188 21.523 6.904 1.00 22.24 C ATOM 1569 C GLY A 102 -12.186 22.509 6.332 1.00 51.51 C ATOM 1570 O GLY A 102 -12.623 23.430 7.022 1.00 74.23 O ATOM 0 H GLY A 102 -10.112 20.148 5.746 1.00 52.52 H new ATOM 0 HA2 GLY A 102 -11.498 21.239 7.909 1.00 22.24 H new ATOM 0 HA3 GLY A 102 -10.216 22.007 6.995 1.00 22.24 H new ATOM 1574 N GLU A 103 -12.546 22.318 5.066 1.00 2.34 N ATOM 1575 CA GLU A 103 -13.497 23.201 4.402 1.00 41.34 C ATOM 1576 C GLU A 103 -14.929 22.720 4.618 1.00 42.03 C ATOM 1577 O GLU A 103 -15.887 23.444 4.346 1.00 3.12 O ATOM 1578 CB GLU A 103 -13.194 23.279 2.904 1.00 62.22 C ATOM 1579 CG GLU A 103 -14.252 22.622 2.034 1.00 71.41 C ATOM 1580 CD GLU A 103 -13.900 22.657 0.559 1.00 24.15 C ATOM 1581 OE1 GLU A 103 -13.030 23.468 0.177 1.00 23.44 O ATOM 1582 OE2 GLU A 103 -14.493 21.875 -0.212 1.00 30.30 O ATOM 0 H GLU A 103 -12.194 21.560 4.481 1.00 2.34 H new ATOM 0 HA GLU A 103 -13.396 24.195 4.838 1.00 41.34 H new ATOM 0 HB2 GLU A 103 -13.097 24.326 2.616 1.00 62.22 H new ATOM 0 HB3 GLU A 103 -12.232 22.805 2.711 1.00 62.22 H new ATOM 0 HG2 GLU A 103 -14.383 21.586 2.348 1.00 71.41 H new ATOM 0 HG3 GLU A 103 -15.207 23.125 2.188 1.00 71.41 H new ATOM 1589 N VAL A 104 -15.067 21.492 5.108 1.00 44.12 N ATOM 1590 CA VAL A 104 -16.380 20.913 5.361 1.00 15.02 C ATOM 1591 C VAL A 104 -16.547 20.551 6.833 1.00 40.13 C ATOM 1592 O VAL A 104 -17.666 20.387 7.319 1.00 13.01 O ATOM 1593 CB VAL A 104 -16.614 19.654 4.505 1.00 43.33 C ATOM 1594 CG1 VAL A 104 -16.139 19.884 3.078 1.00 72.32 C ATOM 1595 CG2 VAL A 104 -15.913 18.453 5.122 1.00 52.23 C ATOM 0 H VAL A 104 -14.285 20.879 5.338 1.00 44.12 H new ATOM 0 HA VAL A 104 -17.116 21.670 5.090 1.00 15.02 H new ATOM 0 HB VAL A 104 -17.684 19.447 4.478 1.00 43.33 H new ATOM 0 HG11 VAL A 104 -16.312 18.984 2.487 1.00 72.32 H new ATOM 0 HG12 VAL A 104 -16.690 20.717 2.641 1.00 72.32 H new ATOM 0 HG13 VAL A 104 -15.074 20.116 3.082 1.00 72.32 H new ATOM 0 HG21 VAL A 104 -16.089 17.572 4.504 1.00 52.23 H new ATOM 0 HG22 VAL A 104 -14.842 18.647 5.181 1.00 52.23 H new ATOM 0 HG23 VAL A 104 -16.305 18.278 6.124 1.00 52.23 H new ATOM 1605 N ILE A 105 -15.427 20.429 7.537 1.00 63.45 N ATOM 1606 CA ILE A 105 -15.449 20.088 8.954 1.00 62.45 C ATOM 1607 C ILE A 105 -16.369 21.023 9.730 1.00 40.51 C ATOM 1608 O ILE A 105 -16.916 20.651 10.767 1.00 34.02 O ATOM 1609 CB ILE A 105 -14.038 20.146 9.569 1.00 51.23 C ATOM 1610 CG1 ILE A 105 -13.974 19.289 10.835 1.00 60.05 C ATOM 1611 CG2 ILE A 105 -13.654 21.586 9.877 1.00 32.33 C ATOM 1612 CD1 ILE A 105 -13.798 17.813 10.556 1.00 34.42 C ATOM 0 H ILE A 105 -14.493 20.561 7.149 1.00 63.45 H new ATOM 0 HA ILE A 105 -15.826 19.068 9.027 1.00 62.45 H new ATOM 0 HB ILE A 105 -13.326 19.747 8.847 1.00 51.23 H new ATOM 0 HG12 ILE A 105 -13.148 19.634 11.457 1.00 60.05 H new ATOM 0 HG13 ILE A 105 -14.888 19.436 11.410 1.00 60.05 H new ATOM 0 HG21 ILE A 105 -12.654 21.611 10.311 1.00 32.33 H new ATOM 0 HG22 ILE A 105 -13.665 22.170 8.957 1.00 32.33 H new ATOM 0 HG23 ILE A 105 -14.367 22.010 10.584 1.00 32.33 H new ATOM 0 HD11 ILE A 105 -13.761 17.266 11.498 1.00 34.42 H new ATOM 0 HD12 ILE A 105 -14.637 17.453 9.960 1.00 34.42 H new ATOM 0 HD13 ILE A 105 -12.869 17.655 10.008 1.00 34.42 H new ATOM 1624 N GLN A 106 -16.535 22.239 9.219 1.00 54.12 N ATOM 1625 CA GLN A 106 -17.391 23.228 9.864 1.00 22.02 C ATOM 1626 C GLN A 106 -18.760 22.638 10.183 1.00 33.34 C ATOM 1627 O GLN A 106 -19.100 22.429 11.347 1.00 12.45 O ATOM 1628 CB GLN A 106 -17.549 24.458 8.969 1.00 4.42 C ATOM 1629 CG GLN A 106 -17.441 24.149 7.485 1.00 73.12 C ATOM 1630 CD GLN A 106 -18.352 25.018 6.640 1.00 34.41 C ATOM 1631 OE1 GLN A 106 -18.161 26.230 6.546 1.00 1.41 O ATOM 1632 NE2 GLN A 106 -19.351 24.400 6.019 1.00 1.54 N ATOM 0 H GLN A 106 -16.088 22.563 8.361 1.00 54.12 H new ATOM 0 HA GLN A 106 -16.917 23.526 10.799 1.00 22.02 H new ATOM 0 HB2 GLN A 106 -18.517 24.918 9.166 1.00 4.42 H new ATOM 0 HB3 GLN A 106 -16.787 25.191 9.235 1.00 4.42 H new ATOM 0 HG2 GLN A 106 -16.409 24.290 7.163 1.00 73.12 H new ATOM 0 HG3 GLN A 106 -17.687 23.100 7.317 1.00 73.12 H new ATOM 0 HE21 GLN A 106 -19.472 23.393 6.125 1.00 1.54 H new ATOM 0 HE22 GLN A 106 -19.997 24.933 5.436 1.00 1.54 H new ATOM 1641 N GLU A 107 -19.542 22.371 9.142 1.00 62.15 N ATOM 1642 CA GLU A 107 -20.875 21.806 9.312 1.00 31.45 C ATOM 1643 C GLU A 107 -20.822 20.528 10.145 1.00 65.55 C ATOM 1644 O GLU A 107 -21.646 20.318 11.036 1.00 43.32 O ATOM 1645 CB GLU A 107 -21.508 21.514 7.950 1.00 12.33 C ATOM 1646 CG GLU A 107 -20.983 20.249 7.293 1.00 1.11 C ATOM 1647 CD GLU A 107 -21.412 20.123 5.844 1.00 4.20 C ATOM 1648 OE1 GLU A 107 -22.495 19.556 5.592 1.00 13.34 O ATOM 1649 OE2 GLU A 107 -20.663 20.592 4.962 1.00 44.45 O ATOM 0 H GLU A 107 -19.275 22.537 8.172 1.00 62.15 H new ATOM 0 HA GLU A 107 -21.487 22.538 9.839 1.00 31.45 H new ATOM 0 HB2 GLU A 107 -22.588 21.429 8.072 1.00 12.33 H new ATOM 0 HB3 GLU A 107 -21.328 22.360 7.286 1.00 12.33 H new ATOM 0 HG2 GLU A 107 -19.894 20.241 7.348 1.00 1.11 H new ATOM 0 HG3 GLU A 107 -21.337 19.381 7.850 1.00 1.11 H new ATOM 1656 N LEU A 108 -19.847 19.676 9.847 1.00 62.50 N ATOM 1657 CA LEU A 108 -19.685 18.417 10.566 1.00 23.24 C ATOM 1658 C LEU A 108 -19.577 18.658 12.069 1.00 40.24 C ATOM 1659 O LEU A 108 -20.473 18.296 12.832 1.00 21.24 O ATOM 1660 CB LEU A 108 -18.442 17.677 10.067 1.00 53.43 C ATOM 1661 CG LEU A 108 -18.325 17.510 8.551 1.00 32.44 C ATOM 1662 CD1 LEU A 108 -16.967 16.935 8.181 1.00 23.14 C ATOM 1663 CD2 LEU A 108 -19.443 16.622 8.025 1.00 33.31 C ATOM 0 H LEU A 108 -19.157 19.834 9.113 1.00 62.50 H new ATOM 0 HA LEU A 108 -20.566 17.804 10.377 1.00 23.24 H new ATOM 0 HB2 LEU A 108 -17.560 18.208 10.423 1.00 53.43 H new ATOM 0 HB3 LEU A 108 -18.424 16.688 10.524 1.00 53.43 H new ATOM 0 HG LEU A 108 -18.419 18.492 8.088 1.00 32.44 H new ATOM 0 HD11 LEU A 108 -16.902 16.823 7.099 1.00 23.14 H new ATOM 0 HD12 LEU A 108 -16.181 17.608 8.524 1.00 23.14 H new ATOM 0 HD13 LEU A 108 -16.843 15.961 8.654 1.00 23.14 H new ATOM 0 HD21 LEU A 108 -19.344 16.514 6.945 1.00 33.31 H new ATOM 0 HD22 LEU A 108 -19.380 15.641 8.495 1.00 33.31 H new ATOM 0 HD23 LEU A 108 -20.407 17.074 8.258 1.00 33.31 H new ATOM 1675 N LEU A 109 -18.476 19.274 12.486 1.00 34.11 N ATOM 1676 CA LEU A 109 -18.252 19.567 13.898 1.00 70.54 C ATOM 1677 C LEU A 109 -19.457 20.277 14.505 1.00 53.54 C ATOM 1678 O LEU A 109 -20.163 19.718 15.344 1.00 4.11 O ATOM 1679 CB LEU A 109 -16.999 20.427 14.067 1.00 0.43 C ATOM 1680 CG LEU A 109 -15.716 19.680 14.433 1.00 41.31 C ATOM 1681 CD1 LEU A 109 -14.508 20.351 13.798 1.00 50.43 C ATOM 1682 CD2 LEU A 109 -15.554 19.606 15.944 1.00 1.52 C ATOM 0 H LEU A 109 -17.725 19.580 11.867 1.00 34.11 H new ATOM 0 HA LEU A 109 -18.110 18.622 14.422 1.00 70.54 H new ATOM 0 HB2 LEU A 109 -16.827 20.970 13.137 1.00 0.43 H new ATOM 0 HB3 LEU A 109 -17.195 21.171 14.839 1.00 0.43 H new ATOM 0 HG LEU A 109 -15.787 18.664 14.045 1.00 41.31 H new ATOM 0 HD11 LEU A 109 -13.604 19.806 14.070 1.00 50.43 H new ATOM 0 HD12 LEU A 109 -14.620 20.351 12.714 1.00 50.43 H new ATOM 0 HD13 LEU A 109 -14.433 21.378 14.155 1.00 50.43 H new ATOM 0 HD21 LEU A 109 -14.636 19.071 16.186 1.00 1.52 H new ATOM 0 HD22 LEU A 109 -15.505 20.615 16.355 1.00 1.52 H new ATOM 0 HD23 LEU A 109 -16.405 19.079 16.376 1.00 1.52 H new ATOM 1694 N SER A 110 -19.689 21.513 14.072 1.00 4.05 N ATOM 1695 CA SER A 110 -20.808 22.301 14.574 1.00 1.45 C ATOM 1696 C SER A 110 -22.010 21.410 14.872 1.00 51.24 C ATOM 1697 O SER A 110 -22.369 21.199 16.030 1.00 21.11 O ATOM 1698 CB SER A 110 -21.196 23.379 13.560 1.00 22.10 C ATOM 1699 OG SER A 110 -21.458 22.811 12.288 1.00 10.33 O ATOM 0 H SER A 110 -19.117 21.989 13.375 1.00 4.05 H new ATOM 0 HA SER A 110 -20.495 22.781 15.501 1.00 1.45 H new ATOM 0 HB2 SER A 110 -22.078 23.913 13.912 1.00 22.10 H new ATOM 0 HB3 SER A 110 -20.392 24.111 13.477 1.00 22.10 H new ATOM 0 HG SER A 110 -20.614 22.682 11.807 1.00 10.33 H new ATOM 1705 N ASP A 111 -22.628 20.890 13.817 1.00 51.53 N ATOM 1706 CA ASP A 111 -23.790 20.021 13.963 1.00 64.12 C ATOM 1707 C ASP A 111 -23.514 18.912 14.973 1.00 33.41 C ATOM 1708 O ASP A 111 -24.322 18.658 15.867 1.00 44.04 O ATOM 1709 CB ASP A 111 -24.172 19.414 12.612 1.00 51.10 C ATOM 1710 CG ASP A 111 -25.041 20.342 11.786 1.00 61.13 C ATOM 1711 OD1 ASP A 111 -24.887 21.574 11.919 1.00 21.31 O ATOM 1712 OD2 ASP A 111 -25.876 19.836 11.006 1.00 4.22 O ATOM 0 H ASP A 111 -22.344 21.055 12.851 1.00 51.53 H new ATOM 0 HA ASP A 111 -24.621 20.624 14.330 1.00 64.12 H new ATOM 0 HB2 ASP A 111 -23.266 19.177 12.054 1.00 51.10 H new ATOM 0 HB3 ASP A 111 -24.701 18.475 12.775 1.00 51.10 H new ATOM 1717 N ALA A 112 -22.370 18.253 14.824 1.00 44.01 N ATOM 1718 CA ALA A 112 -21.988 17.172 15.724 1.00 64.35 C ATOM 1719 C ALA A 112 -22.180 17.576 17.181 1.00 12.31 C ATOM 1720 O ALA A 112 -22.936 16.941 17.916 1.00 15.05 O ATOM 1721 CB ALA A 112 -20.544 16.763 15.474 1.00 65.43 C ATOM 0 H ALA A 112 -21.691 18.449 14.088 1.00 44.01 H new ATOM 0 HA ALA A 112 -22.636 16.319 15.523 1.00 64.35 H new ATOM 0 HB1 ALA A 112 -20.272 15.955 16.153 1.00 65.43 H new ATOM 0 HB2 ALA A 112 -20.435 16.424 14.444 1.00 65.43 H new ATOM 0 HB3 ALA A 112 -19.889 17.617 15.646 1.00 65.43 H new ATOM 1727 N ILE A 113 -21.491 18.635 17.592 1.00 14.52 N ATOM 1728 CA ILE A 113 -21.588 19.124 18.962 1.00 3.11 C ATOM 1729 C ILE A 113 -23.026 19.485 19.317 1.00 10.21 C ATOM 1730 O ILE A 113 -23.496 19.197 20.417 1.00 24.24 O ATOM 1731 CB ILE A 113 -20.691 20.356 19.185 1.00 50.44 C ATOM 1732 CG1 ILE A 113 -19.543 20.369 18.173 1.00 73.51 C ATOM 1733 CG2 ILE A 113 -20.151 20.368 20.607 1.00 42.42 C ATOM 1734 CD1 ILE A 113 -18.389 21.258 18.579 1.00 54.42 C ATOM 0 H ILE A 113 -20.860 19.171 16.996 1.00 14.52 H new ATOM 0 HA ILE A 113 -21.249 18.316 19.610 1.00 3.11 H new ATOM 0 HB ILE A 113 -21.290 21.254 19.037 1.00 50.44 H new ATOM 0 HG12 ILE A 113 -19.177 19.351 18.038 1.00 73.51 H new ATOM 0 HG13 ILE A 113 -19.924 20.701 17.207 1.00 73.51 H new ATOM 0 HG21 ILE A 113 -19.519 21.245 20.749 1.00 42.42 H new ATOM 0 HG22 ILE A 113 -20.982 20.402 21.312 1.00 42.42 H new ATOM 0 HG23 ILE A 113 -19.564 19.466 20.781 1.00 42.42 H new ATOM 0 HD11 ILE A 113 -17.613 21.218 17.815 1.00 54.42 H new ATOM 0 HD12 ILE A 113 -18.740 22.284 18.686 1.00 54.42 H new ATOM 0 HD13 ILE A 113 -17.981 20.913 19.529 1.00 54.42 H new ATOM 1746 N ALA A 114 -23.721 20.117 18.377 1.00 72.43 N ATOM 1747 CA ALA A 114 -25.108 20.514 18.588 1.00 24.45 C ATOM 1748 C ALA A 114 -25.964 19.320 18.996 1.00 33.15 C ATOM 1749 O ALA A 114 -26.387 19.210 20.148 1.00 40.14 O ATOM 1750 CB ALA A 114 -25.668 21.163 17.332 1.00 13.41 C ATOM 0 H ALA A 114 -23.346 20.365 17.461 1.00 72.43 H new ATOM 0 HA ALA A 114 -25.133 21.240 19.400 1.00 24.45 H new ATOM 0 HB1 ALA A 114 -26.704 21.454 17.504 1.00 13.41 H new ATOM 0 HB2 ALA A 114 -25.079 22.046 17.085 1.00 13.41 H new ATOM 0 HB3 ALA A 114 -25.623 20.454 16.505 1.00 13.41 H new ATOM 1756 N LYS A 115 -26.218 18.427 18.046 1.00 50.24 N ATOM 1757 CA LYS A 115 -27.024 17.240 18.305 1.00 12.32 C ATOM 1758 C LYS A 115 -26.450 16.436 19.467 1.00 11.23 C ATOM 1759 O LYS A 115 -27.189 15.955 20.326 1.00 22.31 O ATOM 1760 CB LYS A 115 -27.098 16.365 17.052 1.00 21.43 C ATOM 1761 CG LYS A 115 -28.380 15.556 16.950 1.00 44.11 C ATOM 1762 CD LYS A 115 -28.092 14.072 16.793 1.00 41.44 C ATOM 1763 CE LYS A 115 -27.547 13.471 18.079 1.00 34.22 C ATOM 1764 NZ LYS A 115 -28.446 12.414 18.621 1.00 11.21 N ATOM 0 H LYS A 115 -25.877 18.503 17.088 1.00 50.24 H new ATOM 0 HA LYS A 115 -28.029 17.565 18.573 1.00 12.32 H new ATOM 0 HB2 LYS A 115 -27.007 16.999 16.170 1.00 21.43 H new ATOM 0 HB3 LYS A 115 -26.247 15.684 17.044 1.00 21.43 H new ATOM 0 HG2 LYS A 115 -28.985 15.718 17.842 1.00 44.11 H new ATOM 0 HG3 LYS A 115 -28.965 15.906 16.100 1.00 44.11 H new ATOM 0 HD2 LYS A 115 -29.005 13.551 16.505 1.00 41.44 H new ATOM 0 HD3 LYS A 115 -27.373 13.923 15.987 1.00 41.44 H new ATOM 0 HE2 LYS A 115 -26.560 13.048 17.893 1.00 34.22 H new ATOM 0 HE3 LYS A 115 -27.421 14.258 18.823 1.00 34.22 H new ATOM 0 HZ1 LYS A 115 -27.874 11.650 19.033 1.00 11.21 H new ATOM 0 HZ2 LYS A 115 -29.059 12.822 19.355 1.00 11.21 H new ATOM 0 HZ3 LYS A 115 -29.034 12.031 17.853 1.00 11.21 H new ATOM 1778 N SER A 116 -25.128 16.296 19.488 1.00 14.13 N ATOM 1779 CA SER A 116 -24.456 15.548 20.544 1.00 3.31 C ATOM 1780 C SER A 116 -24.933 16.003 21.920 1.00 22.52 C ATOM 1781 O SER A 116 -25.190 17.185 22.141 1.00 52.14 O ATOM 1782 CB SER A 116 -22.940 15.722 20.434 1.00 23.25 C ATOM 1783 OG SER A 116 -22.400 14.874 19.435 1.00 32.25 O ATOM 0 H SER A 116 -24.502 16.691 18.786 1.00 14.13 H new ATOM 0 HA SER A 116 -24.704 14.493 20.423 1.00 3.31 H new ATOM 0 HB2 SER A 116 -22.706 16.760 20.199 1.00 23.25 H new ATOM 0 HB3 SER A 116 -22.475 15.500 21.394 1.00 23.25 H new ATOM 0 HG SER A 116 -22.432 15.329 18.567 1.00 32.25 H new ATOM 1789 N ASN A 117 -25.048 15.053 22.843 1.00 73.23 N ATOM 1790 CA ASN A 117 -25.495 15.354 24.198 1.00 70.10 C ATOM 1791 C ASN A 117 -24.305 15.570 25.128 1.00 62.13 C ATOM 1792 O ASN A 117 -23.159 15.624 24.682 1.00 70.11 O ATOM 1793 CB ASN A 117 -26.374 14.221 24.731 1.00 20.32 C ATOM 1794 CG ASN A 117 -25.864 12.852 24.323 1.00 5.22 C ATOM 1795 OD1 ASN A 117 -24.664 12.509 24.778 1.00 41.12 O flip ATOM 1796 ND2 ASN A 117 -26.540 12.113 23.608 1.00 72.50 N flip ATOM 0 H ASN A 117 -24.838 14.069 22.677 1.00 73.23 H new ATOM 0 HA ASN A 117 -26.079 16.273 24.165 1.00 70.10 H new ATOM 0 HB2 ASN A 117 -26.418 14.280 25.819 1.00 20.32 H new ATOM 0 HB3 ASN A 117 -27.392 14.351 24.363 1.00 20.32 H new ATOM 0 HD21 ASN A 117 -27.457 12.418 23.282 1.00 72.50 H new ATOM 0 HD22 ASN A 117 -26.183 11.195 23.342 1.00 72.50 H new ATOM 1803 N GLN A 118 -24.586 15.692 26.421 1.00 3.10 N ATOM 1804 CA GLN A 118 -23.538 15.902 27.413 1.00 11.12 C ATOM 1805 C GLN A 118 -22.344 14.991 27.146 1.00 55.22 C ATOM 1806 O GLN A 118 -21.207 15.453 27.057 1.00 25.32 O ATOM 1807 CB GLN A 118 -24.082 15.650 28.821 1.00 44.43 C ATOM 1808 CG GLN A 118 -23.004 15.620 29.893 1.00 60.55 C ATOM 1809 CD GLN A 118 -23.569 15.754 31.293 1.00 74.13 C ATOM 1810 OE1 GLN A 118 -23.296 14.930 32.167 1.00 55.55 O ATOM 1811 NE2 GLN A 118 -24.362 16.796 31.514 1.00 74.14 N ATOM 0 H GLN A 118 -25.530 15.649 26.806 1.00 3.10 H new ATOM 0 HA GLN A 118 -23.205 16.937 27.339 1.00 11.12 H new ATOM 0 HB2 GLN A 118 -24.806 16.427 29.067 1.00 44.43 H new ATOM 0 HB3 GLN A 118 -24.618 14.701 28.830 1.00 44.43 H new ATOM 0 HG2 GLN A 118 -22.448 14.685 29.818 1.00 60.55 H new ATOM 0 HG3 GLN A 118 -22.295 16.428 29.713 1.00 60.55 H new ATOM 0 HE21 GLN A 118 -24.561 17.454 30.761 1.00 74.14 H new ATOM 0 HE22 GLN A 118 -24.772 16.938 32.437 1.00 74.14 H new ATOM 1820 N ASP A 119 -22.612 13.696 27.019 1.00 42.23 N ATOM 1821 CA ASP A 119 -21.560 12.720 26.761 1.00 44.04 C ATOM 1822 C ASP A 119 -20.890 12.985 25.416 1.00 51.42 C ATOM 1823 O ASP A 119 -19.709 13.327 25.355 1.00 5.34 O ATOM 1824 CB ASP A 119 -22.132 11.302 26.788 1.00 11.02 C ATOM 1825 CG ASP A 119 -22.730 10.945 28.135 1.00 54.42 C ATOM 1826 OD1 ASP A 119 -22.405 11.629 29.128 1.00 54.02 O ATOM 1827 OD2 ASP A 119 -23.523 9.982 28.196 1.00 70.01 O ATOM 0 H ASP A 119 -23.548 13.298 27.091 1.00 42.23 H new ATOM 0 HA ASP A 119 -20.810 12.816 27.546 1.00 44.04 H new ATOM 0 HB2 ASP A 119 -22.897 11.207 26.017 1.00 11.02 H new ATOM 0 HB3 ASP A 119 -21.343 10.590 26.544 1.00 11.02 H new ATOM 1832 N HIS A 120 -21.652 12.825 24.339 1.00 75.32 N ATOM 1833 CA HIS A 120 -21.133 13.047 22.994 1.00 23.42 C ATOM 1834 C HIS A 120 -20.396 14.380 22.910 1.00 62.23 C ATOM 1835 O HIS A 120 -19.206 14.425 22.597 1.00 41.05 O ATOM 1836 CB HIS A 120 -22.270 13.014 21.973 1.00 32.30 C ATOM 1837 CG HIS A 120 -22.984 11.698 21.914 1.00 41.34 C ATOM 1838 ND1 HIS A 120 -22.800 10.558 22.620 1.00 74.32 N flip ATOM 1839 CD2 HIS A 120 -24.025 11.446 21.046 1.00 45.34 C flip ATOM 1840 CE1 HIS A 120 -23.724 9.647 22.171 1.00 61.20 C flip ATOM 1841 NE2 HIS A 120 -24.452 10.208 21.222 1.00 12.52 N flip ATOM 0 H HIS A 120 -22.632 12.542 24.371 1.00 75.32 H new ATOM 0 HA HIS A 120 -20.428 12.247 22.767 1.00 23.42 H new ATOM 0 HB2 HIS A 120 -22.988 13.797 22.216 1.00 32.30 H new ATOM 0 HB3 HIS A 120 -21.868 13.245 20.986 1.00 32.30 H new ATOM 0 HD2 HIS A 120 -24.428 12.150 20.334 1.00 45.34 H new ATOM 0 HE1 HIS A 120 -23.837 8.636 22.534 1.00 61.20 H new ATOM 0 HE2 HIS A 120 -25.214 9.761 20.712 1.00 12.52 H new ATOM 1849 N LYS A 121 -21.111 15.464 23.190 1.00 4.21 N ATOM 1850 CA LYS A 121 -20.526 16.799 23.147 1.00 44.13 C ATOM 1851 C LYS A 121 -19.174 16.824 23.854 1.00 53.33 C ATOM 1852 O LYS A 121 -18.241 17.488 23.403 1.00 20.24 O ATOM 1853 CB LYS A 121 -21.471 17.814 23.794 1.00 22.31 C ATOM 1854 CG LYS A 121 -21.446 17.786 25.312 1.00 21.55 C ATOM 1855 CD LYS A 121 -20.428 18.766 25.872 1.00 74.32 C ATOM 1856 CE LYS A 121 -19.806 18.249 27.160 1.00 71.22 C ATOM 1857 NZ LYS A 121 -20.628 18.597 28.352 1.00 74.53 N ATOM 0 H LYS A 121 -22.097 15.444 23.449 1.00 4.21 H new ATOM 0 HA LYS A 121 -20.375 17.068 22.102 1.00 44.13 H new ATOM 0 HB2 LYS A 121 -21.205 18.814 23.453 1.00 22.31 H new ATOM 0 HB3 LYS A 121 -22.488 17.621 23.452 1.00 22.31 H new ATOM 0 HG2 LYS A 121 -22.436 18.029 25.697 1.00 21.55 H new ATOM 0 HG3 LYS A 121 -21.209 16.779 25.654 1.00 21.55 H new ATOM 0 HD2 LYS A 121 -19.646 18.941 25.134 1.00 74.32 H new ATOM 0 HD3 LYS A 121 -20.910 19.726 26.059 1.00 74.32 H new ATOM 0 HE2 LYS A 121 -19.694 17.166 27.100 1.00 71.22 H new ATOM 0 HE3 LYS A 121 -18.806 18.667 27.274 1.00 71.22 H new ATOM 0 HZ1 LYS A 121 -20.170 18.227 29.209 1.00 74.53 H new ATOM 0 HZ2 LYS A 121 -20.714 19.631 28.424 1.00 74.53 H new ATOM 0 HZ3 LYS A 121 -21.574 18.176 28.256 1.00 74.53 H new ATOM 1871 N GLU A 122 -19.077 16.096 24.962 1.00 54.22 N ATOM 1872 CA GLU A 122 -17.839 16.036 25.729 1.00 31.34 C ATOM 1873 C GLU A 122 -16.709 15.444 24.893 1.00 64.14 C ATOM 1874 O GLU A 122 -15.591 15.960 24.884 1.00 22.02 O ATOM 1875 CB GLU A 122 -18.039 15.203 26.998 1.00 53.34 C ATOM 1876 CG GLU A 122 -17.200 13.937 27.033 1.00 1.34 C ATOM 1877 CD GLU A 122 -17.314 13.199 28.353 1.00 4.00 C ATOM 1878 OE1 GLU A 122 -17.274 13.864 29.409 1.00 13.24 O ATOM 1879 OE2 GLU A 122 -17.442 11.957 28.330 1.00 45.22 O ATOM 0 H GLU A 122 -19.840 15.540 25.348 1.00 54.22 H new ATOM 0 HA GLU A 122 -17.566 17.053 26.009 1.00 31.34 H new ATOM 0 HB2 GLU A 122 -17.795 15.815 27.866 1.00 53.34 H new ATOM 0 HB3 GLU A 122 -19.092 14.934 27.084 1.00 53.34 H new ATOM 0 HG2 GLU A 122 -17.511 13.277 26.224 1.00 1.34 H new ATOM 0 HG3 GLU A 122 -16.156 14.192 26.853 1.00 1.34 H new ATOM 1886 N LYS A 123 -17.007 14.357 24.190 1.00 75.24 N ATOM 1887 CA LYS A 123 -16.019 13.693 23.348 1.00 4.22 C ATOM 1888 C LYS A 123 -15.467 14.652 22.298 1.00 62.21 C ATOM 1889 O LYS A 123 -14.253 14.803 22.160 1.00 44.44 O ATOM 1890 CB LYS A 123 -16.638 12.472 22.665 1.00 44.05 C ATOM 1891 CG LYS A 123 -17.108 11.404 23.637 1.00 64.24 C ATOM 1892 CD LYS A 123 -17.019 10.016 23.025 1.00 21.52 C ATOM 1893 CE LYS A 123 -16.562 8.985 24.046 1.00 31.13 C ATOM 1894 NZ LYS A 123 -17.706 8.418 24.812 1.00 14.03 N ATOM 0 H LYS A 123 -17.927 13.916 24.187 1.00 75.24 H new ATOM 0 HA LYS A 123 -15.196 13.366 23.984 1.00 4.22 H new ATOM 0 HB2 LYS A 123 -17.483 12.796 22.058 1.00 44.05 H new ATOM 0 HB3 LYS A 123 -15.906 12.036 21.986 1.00 44.05 H new ATOM 0 HG2 LYS A 123 -16.503 11.443 24.543 1.00 64.24 H new ATOM 0 HG3 LYS A 123 -18.137 11.607 23.933 1.00 64.24 H new ATOM 0 HD2 LYS A 123 -17.993 9.729 22.628 1.00 21.52 H new ATOM 0 HD3 LYS A 123 -16.324 10.031 22.185 1.00 21.52 H new ATOM 0 HE2 LYS A 123 -16.031 8.180 23.537 1.00 31.13 H new ATOM 0 HE3 LYS A 123 -15.856 9.446 24.736 1.00 31.13 H new ATOM 0 HZ1 LYS A 123 -17.353 7.720 25.497 1.00 14.03 H new ATOM 0 HZ2 LYS A 123 -18.197 9.182 25.318 1.00 14.03 H new ATOM 0 HZ3 LYS A 123 -18.368 7.956 24.156 1.00 14.03 H new ATOM 1908 N ILE A 124 -16.365 15.297 21.562 1.00 74.11 N ATOM 1909 CA ILE A 124 -15.967 16.242 20.526 1.00 14.44 C ATOM 1910 C ILE A 124 -15.089 17.349 21.100 1.00 24.55 C ATOM 1911 O ILE A 124 -14.004 17.623 20.587 1.00 61.01 O ATOM 1912 CB ILE A 124 -17.193 16.878 19.843 1.00 3.14 C ATOM 1913 CG1 ILE A 124 -18.104 15.792 19.268 1.00 63.02 C ATOM 1914 CG2 ILE A 124 -16.750 17.840 18.751 1.00 74.12 C ATOM 1915 CD1 ILE A 124 -19.320 16.339 18.555 1.00 54.11 C ATOM 0 H ILE A 124 -17.373 15.183 21.664 1.00 74.11 H new ATOM 0 HA ILE A 124 -15.400 15.678 19.785 1.00 14.44 H new ATOM 0 HB ILE A 124 -17.756 17.440 20.588 1.00 3.14 H new ATOM 0 HG12 ILE A 124 -17.531 15.179 18.573 1.00 63.02 H new ATOM 0 HG13 ILE A 124 -18.430 15.138 20.076 1.00 63.02 H new ATOM 0 HG21 ILE A 124 -17.627 18.282 18.277 1.00 74.12 H new ATOM 0 HG22 ILE A 124 -16.137 18.629 19.188 1.00 74.12 H new ATOM 0 HG23 ILE A 124 -16.168 17.300 18.004 1.00 74.12 H new ATOM 0 HD11 ILE A 124 -19.920 15.513 18.173 1.00 54.11 H new ATOM 0 HD12 ILE A 124 -19.916 16.929 19.252 1.00 54.11 H new ATOM 0 HD13 ILE A 124 -19.002 16.970 17.725 1.00 54.11 H new ATOM 1927 N ARG A 125 -15.564 17.979 22.170 1.00 45.35 N ATOM 1928 CA ARG A 125 -14.821 19.055 22.814 1.00 2.44 C ATOM 1929 C ARG A 125 -13.372 18.644 23.062 1.00 53.15 C ATOM 1930 O ARG A 125 -12.442 19.334 22.647 1.00 44.21 O ATOM 1931 CB ARG A 125 -15.485 19.441 24.137 1.00 13.12 C ATOM 1932 CG ARG A 125 -15.089 20.820 24.638 1.00 12.25 C ATOM 1933 CD ARG A 125 -14.157 20.731 25.836 1.00 23.03 C ATOM 1934 NE ARG A 125 -14.084 21.992 26.569 1.00 41.55 N ATOM 1935 CZ ARG A 125 -15.050 22.437 27.365 1.00 22.30 C ATOM 1936 NH1 ARG A 125 -16.156 21.725 27.531 1.00 11.14 N ATOM 1937 NH2 ARG A 125 -14.910 23.595 27.997 1.00 22.35 N ATOM 0 H ARG A 125 -16.459 17.763 22.608 1.00 45.35 H new ATOM 0 HA ARG A 125 -14.827 19.916 22.146 1.00 2.44 H new ATOM 0 HB2 ARG A 125 -16.567 19.405 24.014 1.00 13.12 H new ATOM 0 HB3 ARG A 125 -15.225 18.701 24.894 1.00 13.12 H new ATOM 0 HG2 ARG A 125 -14.600 21.373 23.836 1.00 12.25 H new ATOM 0 HG3 ARG A 125 -15.983 21.379 24.912 1.00 12.25 H new ATOM 0 HD2 ARG A 125 -14.501 19.942 26.505 1.00 23.03 H new ATOM 0 HD3 ARG A 125 -13.159 20.450 25.499 1.00 23.03 H new ATOM 0 HE ARG A 125 -13.245 22.563 26.464 1.00 41.55 H new ATOM 0 HH11 ARG A 125 -16.266 20.834 27.047 1.00 11.14 H new ATOM 0 HH12 ARG A 125 -16.897 22.068 28.143 1.00 11.14 H new ATOM 0 HH21 ARG A 125 -14.060 24.145 27.872 1.00 22.35 H new ATOM 0 HH22 ARG A 125 -15.652 23.936 28.608 1.00 22.35 H new ATOM 1951 N MET A 126 -13.190 17.516 23.740 1.00 74.10 N ATOM 1952 CA MET A 126 -11.855 17.013 24.042 1.00 73.44 C ATOM 1953 C MET A 126 -11.032 16.857 22.767 1.00 74.42 C ATOM 1954 O MET A 126 -9.887 17.304 22.697 1.00 41.14 O ATOM 1955 CB MET A 126 -11.946 15.671 24.772 1.00 45.23 C ATOM 1956 CG MET A 126 -10.967 14.630 24.253 1.00 71.02 C ATOM 1957 SD MET A 126 -10.798 13.221 25.365 1.00 73.43 S ATOM 1958 CE MET A 126 -9.548 13.828 26.494 1.00 13.33 C ATOM 0 H MET A 126 -13.950 16.933 24.091 1.00 74.10 H new ATOM 0 HA MET A 126 -11.358 17.737 24.688 1.00 73.44 H new ATOM 0 HB2 MET A 126 -11.764 15.831 25.835 1.00 45.23 H new ATOM 0 HB3 MET A 126 -12.960 15.283 24.678 1.00 45.23 H new ATOM 0 HG2 MET A 126 -11.300 14.279 23.276 1.00 71.02 H new ATOM 0 HG3 MET A 126 -9.991 15.094 24.110 1.00 71.02 H new ATOM 0 HE1 MET A 126 -9.663 13.339 27.461 1.00 13.33 H new ATOM 0 HE2 MET A 126 -8.558 13.610 26.093 1.00 13.33 H new ATOM 0 HE3 MET A 126 -9.660 14.905 26.616 1.00 13.33 H new ATOM 1968 N LEU A 127 -11.622 16.220 21.761 1.00 33.44 N ATOM 1969 CA LEU A 127 -10.943 16.004 20.488 1.00 13.33 C ATOM 1970 C LEU A 127 -10.443 17.323 19.908 1.00 54.41 C ATOM 1971 O LEU A 127 -9.315 17.412 19.423 1.00 42.55 O ATOM 1972 CB LEU A 127 -11.885 15.321 19.495 1.00 65.01 C ATOM 1973 CG LEU A 127 -11.279 14.954 18.140 1.00 43.33 C ATOM 1974 CD1 LEU A 127 -10.620 13.585 18.202 1.00 1.04 C ATOM 1975 CD2 LEU A 127 -12.344 14.987 17.053 1.00 23.51 C ATOM 0 H LEU A 127 -12.569 15.844 21.802 1.00 33.44 H new ATOM 0 HA LEU A 127 -10.084 15.358 20.667 1.00 13.33 H new ATOM 0 HB2 LEU A 127 -12.270 14.412 19.957 1.00 65.01 H new ATOM 0 HB3 LEU A 127 -12.738 15.978 19.323 1.00 65.01 H new ATOM 0 HG LEU A 127 -10.514 15.691 17.894 1.00 43.33 H new ATOM 0 HD11 LEU A 127 -10.195 13.342 17.228 1.00 1.04 H new ATOM 0 HD12 LEU A 127 -9.829 13.596 18.951 1.00 1.04 H new ATOM 0 HD13 LEU A 127 -11.364 12.835 18.471 1.00 1.04 H new ATOM 0 HD21 LEU A 127 -11.895 14.723 16.095 1.00 23.51 H new ATOM 0 HD22 LEU A 127 -13.132 14.273 17.293 1.00 23.51 H new ATOM 0 HD23 LEU A 127 -12.769 15.989 16.991 1.00 23.51 H new ATOM 1987 N LEU A 128 -11.289 18.346 19.963 1.00 54.11 N ATOM 1988 CA LEU A 128 -10.933 19.662 19.445 1.00 51.53 C ATOM 1989 C LEU A 128 -9.668 20.187 20.115 1.00 4.42 C ATOM 1990 O LEU A 128 -8.734 20.626 19.444 1.00 65.13 O ATOM 1991 CB LEU A 128 -12.084 20.646 19.661 1.00 13.22 C ATOM 1992 CG LEU A 128 -12.410 21.567 18.485 1.00 52.40 C ATOM 1993 CD1 LEU A 128 -13.486 22.569 18.874 1.00 51.31 C ATOM 1994 CD2 LEU A 128 -11.157 22.286 18.007 1.00 1.23 C ATOM 0 H LEU A 128 -12.226 18.289 20.361 1.00 54.11 H new ATOM 0 HA LEU A 128 -10.742 19.565 18.376 1.00 51.53 H new ATOM 0 HB2 LEU A 128 -12.980 20.077 19.910 1.00 13.22 H new ATOM 0 HB3 LEU A 128 -11.849 21.265 20.527 1.00 13.22 H new ATOM 0 HG LEU A 128 -12.790 20.957 17.665 1.00 52.40 H new ATOM 0 HD11 LEU A 128 -13.705 23.216 18.025 1.00 51.31 H new ATOM 0 HD12 LEU A 128 -14.391 22.036 19.167 1.00 51.31 H new ATOM 0 HD13 LEU A 128 -13.135 23.174 19.710 1.00 51.31 H new ATOM 0 HD21 LEU A 128 -11.408 22.937 17.170 1.00 1.23 H new ATOM 0 HD22 LEU A 128 -10.748 22.884 18.821 1.00 1.23 H new ATOM 0 HD23 LEU A 128 -10.416 21.553 17.687 1.00 1.23 H new ATOM 2006 N ASP A 129 -9.643 20.137 21.442 1.00 14.54 N ATOM 2007 CA ASP A 129 -8.491 20.605 22.204 1.00 31.23 C ATOM 2008 C ASP A 129 -7.217 19.899 21.750 1.00 11.24 C ATOM 2009 O ASP A 129 -6.235 20.545 21.385 1.00 43.43 O ATOM 2010 CB ASP A 129 -8.713 20.372 23.700 1.00 61.15 C ATOM 2011 CG ASP A 129 -8.028 21.419 24.556 1.00 34.33 C ATOM 2012 OD1 ASP A 129 -8.181 22.622 24.258 1.00 4.12 O ATOM 2013 OD2 ASP A 129 -7.341 21.035 25.526 1.00 73.34 O ATOM 0 H ASP A 129 -10.408 19.777 22.013 1.00 14.54 H new ATOM 0 HA ASP A 129 -8.377 21.674 22.024 1.00 31.23 H new ATOM 0 HB2 ASP A 129 -9.782 20.377 23.911 1.00 61.15 H new ATOM 0 HB3 ASP A 129 -8.339 19.384 23.970 1.00 61.15 H new ATOM 2018 N ILE A 130 -7.241 18.571 21.778 1.00 62.04 N ATOM 2019 CA ILE A 130 -6.088 17.778 21.369 1.00 42.30 C ATOM 2020 C ILE A 130 -5.666 18.116 19.943 1.00 11.00 C ATOM 2021 O ILE A 130 -4.476 18.174 19.634 1.00 2.45 O ATOM 2022 CB ILE A 130 -6.381 16.269 21.462 1.00 4.20 C ATOM 2023 CG1 ILE A 130 -6.793 15.894 22.887 1.00 53.41 C ATOM 2024 CG2 ILE A 130 -5.163 15.466 21.029 1.00 75.24 C ATOM 2025 CD1 ILE A 130 -7.492 14.556 22.982 1.00 65.15 C ATOM 0 H ILE A 130 -8.046 18.022 22.079 1.00 62.04 H new ATOM 0 HA ILE A 130 -5.276 18.025 22.053 1.00 42.30 H new ATOM 0 HB ILE A 130 -7.207 16.032 20.791 1.00 4.20 H new ATOM 0 HG12 ILE A 130 -5.906 15.877 23.520 1.00 53.41 H new ATOM 0 HG13 ILE A 130 -7.452 16.668 23.282 1.00 53.41 H new ATOM 0 HG21 ILE A 130 -5.385 14.401 21.100 1.00 75.24 H new ATOM 0 HG22 ILE A 130 -4.910 15.716 19.999 1.00 75.24 H new ATOM 0 HG23 ILE A 130 -4.320 15.705 21.678 1.00 75.24 H new ATOM 0 HD11 ILE A 130 -7.755 14.356 24.021 1.00 65.15 H new ATOM 0 HD12 ILE A 130 -8.398 14.575 22.376 1.00 65.15 H new ATOM 0 HD13 ILE A 130 -6.828 13.772 22.618 1.00 65.15 H new ATOM 2037 N TRP A 131 -6.649 18.339 19.079 1.00 53.14 N ATOM 2038 CA TRP A 131 -6.380 18.673 17.685 1.00 40.24 C ATOM 2039 C TRP A 131 -5.457 19.883 17.583 1.00 33.22 C ATOM 2040 O TRP A 131 -4.354 19.790 17.044 1.00 12.13 O ATOM 2041 CB TRP A 131 -7.689 18.951 16.943 1.00 3.14 C ATOM 2042 CG TRP A 131 -8.324 17.717 16.377 1.00 12.42 C ATOM 2043 CD1 TRP A 131 -7.915 16.427 16.560 1.00 51.23 C ATOM 2044 CD2 TRP A 131 -9.481 17.658 15.535 1.00 4.41 C ATOM 2045 NE1 TRP A 131 -8.748 15.570 15.882 1.00 63.32 N ATOM 2046 CE2 TRP A 131 -9.717 16.300 15.246 1.00 5.10 C ATOM 2047 CE3 TRP A 131 -10.341 18.620 14.999 1.00 1.30 C ATOM 2048 CZ2 TRP A 131 -10.776 15.883 14.444 1.00 4.11 C ATOM 2049 CZ3 TRP A 131 -11.391 18.205 14.203 1.00 33.21 C ATOM 2050 CH2 TRP A 131 -11.602 16.846 13.932 1.00 10.23 C ATOM 0 H TRP A 131 -7.639 18.295 19.319 1.00 53.14 H new ATOM 0 HA TRP A 131 -5.883 17.820 17.223 1.00 40.24 H new ATOM 0 HB2 TRP A 131 -8.390 19.432 17.625 1.00 3.14 H new ATOM 0 HB3 TRP A 131 -7.497 19.656 16.134 1.00 3.14 H new ATOM 0 HD1 TRP A 131 -7.063 16.125 17.150 1.00 51.23 H new ATOM 0 HE1 TRP A 131 -8.659 14.554 15.856 1.00 63.32 H new ATOM 0 HE3 TRP A 131 -10.188 19.669 15.203 1.00 1.30 H new ATOM 0 HZ2 TRP A 131 -10.940 14.836 14.234 1.00 4.11 H new ATOM 0 HZ3 TRP A 131 -12.061 18.940 13.782 1.00 33.21 H new ATOM 0 HH2 TRP A 131 -12.433 16.553 13.307 1.00 10.23 H new ATOM 2061 N ASP A 132 -5.915 21.016 18.104 1.00 21.23 N ATOM 2062 CA ASP A 132 -5.129 22.244 18.073 1.00 31.13 C ATOM 2063 C ASP A 132 -3.764 22.032 18.720 1.00 22.11 C ATOM 2064 O ASP A 132 -2.737 22.427 18.169 1.00 43.43 O ATOM 2065 CB ASP A 132 -5.876 23.371 18.788 1.00 73.11 C ATOM 2066 CG ASP A 132 -5.536 24.738 18.227 1.00 73.31 C ATOM 2067 OD1 ASP A 132 -5.222 24.822 17.022 1.00 50.45 O ATOM 2068 OD2 ASP A 132 -5.584 25.723 18.994 1.00 65.44 O ATOM 0 H ASP A 132 -6.826 21.110 18.553 1.00 21.23 H new ATOM 0 HA ASP A 132 -4.978 22.523 17.030 1.00 31.13 H new ATOM 0 HB2 ASP A 132 -6.950 23.203 18.702 1.00 73.11 H new ATOM 0 HB3 ASP A 132 -5.634 23.347 19.850 1.00 73.11 H new ATOM 2073 N ARG A 133 -3.761 21.406 19.893 1.00 40.43 N ATOM 2074 CA ARG A 133 -2.522 21.144 20.616 1.00 54.23 C ATOM 2075 C ARG A 133 -1.534 20.379 19.741 1.00 61.31 C ATOM 2076 O ARG A 133 -0.425 20.847 19.484 1.00 22.03 O ATOM 2077 CB ARG A 133 -2.810 20.352 21.892 1.00 31.32 C ATOM 2078 CG ARG A 133 -3.145 21.226 23.090 1.00 42.15 C ATOM 2079 CD ARG A 133 -1.899 21.881 23.667 1.00 75.51 C ATOM 2080 NE ARG A 133 -1.223 21.015 24.629 1.00 4.33 N ATOM 2081 CZ ARG A 133 -0.271 21.437 25.454 1.00 2.14 C ATOM 2082 NH1 ARG A 133 0.114 22.706 25.435 1.00 71.34 N ATOM 2083 NH2 ARG A 133 0.298 20.589 26.302 1.00 52.20 N ATOM 0 H ARG A 133 -4.602 21.071 20.362 1.00 40.43 H new ATOM 0 HA ARG A 133 -2.077 22.102 20.884 1.00 54.23 H new ATOM 0 HB2 ARG A 133 -3.640 19.671 21.707 1.00 31.32 H new ATOM 0 HB3 ARG A 133 -1.942 19.738 22.132 1.00 31.32 H new ATOM 0 HG2 ARG A 133 -3.857 21.995 22.793 1.00 42.15 H new ATOM 0 HG3 ARG A 133 -3.629 20.623 23.858 1.00 42.15 H new ATOM 0 HD2 ARG A 133 -1.212 22.130 22.858 1.00 75.51 H new ATOM 0 HD3 ARG A 133 -2.173 22.818 24.152 1.00 75.51 H new ATOM 0 HE ARG A 133 -1.496 20.033 24.670 1.00 4.33 H new ATOM 0 HH11 ARG A 133 -0.321 23.361 24.786 1.00 71.34 H new ATOM 0 HH12 ARG A 133 0.845 23.027 26.070 1.00 71.34 H new ATOM 0 HH21 ARG A 133 0.004 19.612 26.321 1.00 52.20 H new ATOM 0 HH22 ARG A 133 1.029 20.914 26.935 1.00 52.20 H new ATOM 2097 N SER A 134 -1.944 19.199 19.287 1.00 71.24 N ATOM 2098 CA SER A 134 -1.093 18.366 18.444 1.00 13.33 C ATOM 2099 C SER A 134 -0.553 19.164 17.261 1.00 32.21 C ATOM 2100 O SER A 134 0.606 19.576 17.253 1.00 61.52 O ATOM 2101 CB SER A 134 -1.872 17.150 17.941 1.00 71.51 C ATOM 2102 OG SER A 134 -1.280 16.613 16.771 1.00 45.13 O ATOM 0 H SER A 134 -2.860 18.798 19.489 1.00 71.24 H new ATOM 0 HA SER A 134 -0.250 18.025 19.045 1.00 13.33 H new ATOM 0 HB2 SER A 134 -1.904 16.387 18.719 1.00 71.51 H new ATOM 0 HB3 SER A 134 -2.903 17.436 17.732 1.00 71.51 H new ATOM 0 HG SER A 134 -1.796 15.836 16.471 1.00 45.13 H new ATOM 2108 N GLY A 135 -1.404 19.378 16.262 1.00 61.22 N ATOM 2109 CA GLY A 135 -0.995 20.125 15.087 1.00 71.34 C ATOM 2110 C GLY A 135 -1.900 19.874 13.897 1.00 52.53 C ATOM 2111 O GLY A 135 -1.443 19.851 12.753 1.00 22.23 O ATOM 0 H GLY A 135 -2.369 19.048 16.246 1.00 61.22 H new ATOM 0 HA2 GLY A 135 -0.993 21.190 15.320 1.00 71.34 H new ATOM 0 HA3 GLY A 135 0.028 19.854 14.825 1.00 71.34 H new ATOM 2115 N LEU A 136 -3.188 19.686 14.164 1.00 24.43 N ATOM 2116 CA LEU A 136 -4.160 19.434 13.106 1.00 20.13 C ATOM 2117 C LEU A 136 -4.600 20.738 12.449 1.00 1.34 C ATOM 2118 O LEU A 136 -3.926 21.762 12.566 1.00 51.23 O ATOM 2119 CB LEU A 136 -5.377 18.698 13.669 1.00 23.55 C ATOM 2120 CG LEU A 136 -5.940 17.571 12.803 1.00 70.15 C ATOM 2121 CD1 LEU A 136 -5.148 16.290 13.011 1.00 23.31 C ATOM 2122 CD2 LEU A 136 -7.413 17.346 13.112 1.00 61.34 C ATOM 0 H LEU A 136 -3.583 19.703 15.104 1.00 24.43 H new ATOM 0 HA LEU A 136 -3.683 18.810 12.350 1.00 20.13 H new ATOM 0 HB2 LEU A 136 -5.108 18.283 14.640 1.00 23.55 H new ATOM 0 HB3 LEU A 136 -6.169 19.427 13.842 1.00 23.55 H new ATOM 0 HG LEU A 136 -5.849 17.863 11.757 1.00 70.15 H new ATOM 0 HD11 LEU A 136 -5.564 15.500 12.386 1.00 23.31 H new ATOM 0 HD12 LEU A 136 -4.106 16.458 12.738 1.00 23.31 H new ATOM 0 HD13 LEU A 136 -5.205 15.993 14.058 1.00 23.31 H new ATOM 0 HD21 LEU A 136 -7.797 16.540 12.486 1.00 61.34 H new ATOM 0 HD22 LEU A 136 -7.527 17.076 14.162 1.00 61.34 H new ATOM 0 HD23 LEU A 136 -7.971 18.260 12.909 1.00 61.34 H new ATOM 2134 N PHE A 137 -5.736 20.694 11.761 1.00 44.42 N ATOM 2135 CA PHE A 137 -6.267 21.873 11.086 1.00 3.12 C ATOM 2136 C PHE A 137 -6.158 23.106 11.979 1.00 34.31 C ATOM 2137 O PHE A 137 -6.116 22.995 13.204 1.00 64.10 O ATOM 2138 CB PHE A 137 -7.726 21.645 10.688 1.00 73.41 C ATOM 2139 CG PHE A 137 -7.963 20.325 10.010 1.00 12.32 C ATOM 2140 CD1 PHE A 137 -7.676 20.161 8.665 1.00 53.23 C ATOM 2141 CD2 PHE A 137 -8.473 19.249 10.719 1.00 53.32 C ATOM 2142 CE1 PHE A 137 -7.893 18.948 8.038 1.00 2.31 C ATOM 2143 CE2 PHE A 137 -8.691 18.034 10.098 1.00 54.13 C ATOM 2144 CZ PHE A 137 -8.402 17.884 8.755 1.00 31.35 C ATOM 0 H PHE A 137 -6.307 19.855 11.656 1.00 44.42 H new ATOM 0 HA PHE A 137 -5.675 22.044 10.187 1.00 3.12 H new ATOM 0 HB2 PHE A 137 -8.351 21.704 11.579 1.00 73.41 H new ATOM 0 HB3 PHE A 137 -8.043 22.448 10.023 1.00 73.41 H new ATOM 0 HD1 PHE A 137 -7.278 20.990 8.099 1.00 53.23 H new ATOM 0 HD2 PHE A 137 -8.703 19.361 11.768 1.00 53.32 H new ATOM 0 HE1 PHE A 137 -7.665 18.833 6.989 1.00 2.31 H new ATOM 0 HE2 PHE A 137 -9.087 17.202 10.662 1.00 54.13 H new ATOM 0 HZ PHE A 137 -8.574 16.936 8.267 1.00 31.35 H new ATOM 2154 N GLN A 138 -6.114 24.279 11.356 1.00 70.35 N ATOM 2155 CA GLN A 138 -6.009 25.532 12.093 1.00 34.03 C ATOM 2156 C GLN A 138 -7.307 25.837 12.835 1.00 43.22 C ATOM 2157 O GLN A 138 -8.113 26.652 12.387 1.00 14.40 O ATOM 2158 CB GLN A 138 -5.669 26.681 11.143 1.00 61.04 C ATOM 2159 CG GLN A 138 -4.873 27.798 11.799 1.00 73.14 C ATOM 2160 CD GLN A 138 -4.509 28.903 10.827 1.00 64.00 C ATOM 2161 OE1 GLN A 138 -5.162 29.082 9.799 1.00 51.12 O ATOM 2162 NE2 GLN A 138 -3.460 29.652 11.148 1.00 32.12 N ATOM 0 H GLN A 138 -6.149 24.388 10.342 1.00 70.35 H new ATOM 0 HA GLN A 138 -5.208 25.427 12.825 1.00 34.03 H new ATOM 0 HB2 GLN A 138 -5.101 26.288 10.300 1.00 61.04 H new ATOM 0 HB3 GLN A 138 -6.594 27.094 10.740 1.00 61.04 H new ATOM 0 HG2 GLN A 138 -5.453 28.218 12.621 1.00 73.14 H new ATOM 0 HG3 GLN A 138 -3.962 27.384 12.231 1.00 73.14 H new ATOM 0 HE21 GLN A 138 -2.947 29.469 12.010 1.00 32.12 H new ATOM 0 HE22 GLN A 138 -3.167 30.411 10.532 1.00 32.12 H new ATOM 2171 N LYS A 139 -7.502 25.177 13.971 1.00 11.23 N ATOM 2172 CA LYS A 139 -8.701 25.378 14.777 1.00 61.33 C ATOM 2173 C LYS A 139 -8.768 26.807 15.305 1.00 34.25 C ATOM 2174 O LYS A 139 -9.851 27.376 15.447 1.00 23.34 O ATOM 2175 CB LYS A 139 -8.727 24.389 15.944 1.00 31.23 C ATOM 2176 CG LYS A 139 -8.707 22.934 15.510 1.00 74.45 C ATOM 2177 CD LYS A 139 -10.061 22.492 14.978 1.00 2.03 C ATOM 2178 CE LYS A 139 -9.965 22.013 13.538 1.00 61.01 C ATOM 2179 NZ LYS A 139 -11.115 21.143 13.165 1.00 44.11 N ATOM 0 H LYS A 139 -6.845 24.498 14.355 1.00 11.23 H new ATOM 0 HA LYS A 139 -9.570 25.204 14.142 1.00 61.33 H new ATOM 0 HB2 LYS A 139 -7.869 24.579 16.589 1.00 31.23 H new ATOM 0 HB3 LYS A 139 -9.621 24.569 16.542 1.00 31.23 H new ATOM 0 HG2 LYS A 139 -7.949 22.794 14.740 1.00 74.45 H new ATOM 0 HG3 LYS A 139 -8.424 22.305 16.354 1.00 74.45 H new ATOM 0 HD2 LYS A 139 -10.455 21.691 15.603 1.00 2.03 H new ATOM 0 HD3 LYS A 139 -10.766 23.321 15.040 1.00 2.03 H new ATOM 0 HE2 LYS A 139 -9.929 22.874 12.870 1.00 61.01 H new ATOM 0 HE3 LYS A 139 -9.034 21.463 13.399 1.00 61.01 H new ATOM 0 HZ1 LYS A 139 -11.227 21.140 12.131 1.00 44.11 H new ATOM 0 HZ2 LYS A 139 -10.939 20.173 13.497 1.00 44.11 H new ATOM 0 HZ3 LYS A 139 -11.983 21.507 13.607 1.00 44.11 H new ATOM 2193 N SER A 140 -7.605 27.382 15.594 1.00 33.21 N ATOM 2194 CA SER A 140 -7.533 28.744 16.109 1.00 0.13 C ATOM 2195 C SER A 140 -7.980 29.749 15.052 1.00 1.21 C ATOM 2196 O SER A 140 -8.214 30.920 15.352 1.00 13.03 O ATOM 2197 CB SER A 140 -6.108 29.065 16.564 1.00 20.12 C ATOM 2198 OG SER A 140 -5.942 30.456 16.779 1.00 70.23 O ATOM 0 H SER A 140 -6.700 26.926 15.480 1.00 33.21 H new ATOM 0 HA SER A 140 -8.205 28.819 16.964 1.00 0.13 H new ATOM 0 HB2 SER A 140 -5.886 28.523 17.483 1.00 20.12 H new ATOM 0 HB3 SER A 140 -5.397 28.723 15.812 1.00 20.12 H new ATOM 0 HG SER A 140 -5.625 30.879 15.954 1.00 70.23 H new ATOM 2204 N TYR A 141 -8.096 29.283 13.814 1.00 44.14 N ATOM 2205 CA TYR A 141 -8.512 30.140 12.710 1.00 2.51 C ATOM 2206 C TYR A 141 -9.739 29.567 12.008 1.00 41.23 C ATOM 2207 O TYR A 141 -10.275 30.171 11.078 1.00 74.13 O ATOM 2208 CB TYR A 141 -7.369 30.308 11.708 1.00 44.41 C ATOM 2209 CG TYR A 141 -6.262 31.214 12.198 1.00 2.40 C ATOM 2210 CD1 TYR A 141 -5.456 30.844 13.268 1.00 54.22 C ATOM 2211 CD2 TYR A 141 -6.021 32.441 11.590 1.00 21.43 C ATOM 2212 CE1 TYR A 141 -4.445 31.669 13.719 1.00 4.23 C ATOM 2213 CE2 TYR A 141 -5.010 33.272 12.034 1.00 34.52 C ATOM 2214 CZ TYR A 141 -4.225 32.882 13.099 1.00 34.42 C ATOM 2215 OH TYR A 141 -3.218 33.706 13.545 1.00 24.30 O ATOM 0 H TYR A 141 -7.908 28.316 13.549 1.00 44.14 H new ATOM 0 HA TYR A 141 -8.773 31.116 13.120 1.00 2.51 H new ATOM 0 HB2 TYR A 141 -6.950 29.328 11.479 1.00 44.41 H new ATOM 0 HB3 TYR A 141 -7.769 30.709 10.777 1.00 44.41 H new ATOM 0 HD1 TYR A 141 -5.623 29.895 13.755 1.00 54.22 H new ATOM 0 HD2 TYR A 141 -6.634 32.750 10.757 1.00 21.43 H new ATOM 0 HE1 TYR A 141 -3.829 31.366 14.553 1.00 4.23 H new ATOM 0 HE2 TYR A 141 -4.836 34.221 11.550 1.00 34.52 H new ATOM 0 HH TYR A 141 -3.196 34.520 13.000 1.00 24.30 H new ATOM 2225 N LEU A 142 -10.179 28.398 12.460 1.00 65.03 N ATOM 2226 CA LEU A 142 -11.343 27.741 11.876 1.00 13.24 C ATOM 2227 C LEU A 142 -12.636 28.343 12.418 1.00 21.01 C ATOM 2228 O LEU A 142 -13.105 27.967 13.492 1.00 43.34 O ATOM 2229 CB LEU A 142 -11.305 26.240 12.167 1.00 74.24 C ATOM 2230 CG LEU A 142 -11.939 25.336 11.109 1.00 33.40 C ATOM 2231 CD1 LEU A 142 -11.021 25.197 9.905 1.00 24.00 C ATOM 2232 CD2 LEU A 142 -12.260 23.969 11.698 1.00 45.40 C ATOM 0 H LEU A 142 -9.747 27.886 13.229 1.00 65.03 H new ATOM 0 HA LEU A 142 -11.315 27.897 10.798 1.00 13.24 H new ATOM 0 HB2 LEU A 142 -10.265 25.941 12.296 1.00 74.24 H new ATOM 0 HB3 LEU A 142 -11.808 26.061 13.118 1.00 74.24 H new ATOM 0 HG LEU A 142 -12.871 25.795 10.778 1.00 33.40 H new ATOM 0 HD11 LEU A 142 -11.489 24.550 9.163 1.00 24.00 H new ATOM 0 HD12 LEU A 142 -10.842 26.180 9.468 1.00 24.00 H new ATOM 0 HD13 LEU A 142 -10.072 24.761 10.219 1.00 24.00 H new ATOM 0 HD21 LEU A 142 -12.711 23.339 10.931 1.00 45.40 H new ATOM 0 HD22 LEU A 142 -11.342 23.503 12.057 1.00 45.40 H new ATOM 0 HD23 LEU A 142 -12.957 24.085 12.528 1.00 45.40 H new ATOM 2244 N ASN A 143 -13.208 29.278 11.666 1.00 30.13 N ATOM 2245 CA ASN A 143 -14.448 29.931 12.070 1.00 20.34 C ATOM 2246 C ASN A 143 -15.440 28.916 12.631 1.00 65.41 C ATOM 2247 O ASN A 143 -16.217 29.225 13.533 1.00 1.03 O ATOM 2248 CB ASN A 143 -15.071 30.667 10.883 1.00 14.31 C ATOM 2249 CG ASN A 143 -16.207 31.581 11.301 1.00 2.44 C ATOM 2250 OD1 ASN A 143 -16.030 32.794 11.423 1.00 21.41 O ATOM 2251 ND2 ASN A 143 -17.381 31.002 11.524 1.00 40.41 N ATOM 0 H ASN A 143 -12.833 29.600 10.774 1.00 30.13 H new ATOM 0 HA ASN A 143 -14.211 30.652 12.853 1.00 20.34 H new ATOM 0 HB2 ASN A 143 -14.303 31.254 10.379 1.00 14.31 H new ATOM 0 HB3 ASN A 143 -15.441 29.939 10.161 1.00 14.31 H new ATOM 0 HD21 ASN A 143 -18.182 31.566 11.809 1.00 40.41 H new ATOM 0 HD22 ASN A 143 -17.482 29.993 11.411 1.00 40.41 H new ATOM 2258 N ALA A 144 -15.405 27.702 12.090 1.00 54.23 N ATOM 2259 CA ALA A 144 -16.299 26.641 12.537 1.00 25.21 C ATOM 2260 C ALA A 144 -16.470 26.670 14.052 1.00 31.20 C ATOM 2261 O ALA A 144 -17.318 27.393 14.576 1.00 21.22 O ATOM 2262 CB ALA A 144 -15.773 25.285 12.089 1.00 22.04 C ATOM 0 H ALA A 144 -14.767 27.429 11.342 1.00 54.23 H new ATOM 0 HA ALA A 144 -17.276 26.807 12.084 1.00 25.21 H new ATOM 0 HB1 ALA A 144 -16.450 24.502 12.429 1.00 22.04 H new ATOM 0 HB2 ALA A 144 -15.708 25.261 11.001 1.00 22.04 H new ATOM 0 HB3 ALA A 144 -14.783 25.120 12.515 1.00 22.04 H new ATOM 2268 N ILE A 145 -15.661 25.879 14.750 1.00 53.44 N ATOM 2269 CA ILE A 145 -15.724 25.816 16.204 1.00 32.34 C ATOM 2270 C ILE A 145 -15.255 27.124 16.833 1.00 71.52 C ATOM 2271 O ILE A 145 -15.607 27.439 17.970 1.00 41.04 O ATOM 2272 CB ILE A 145 -14.869 24.659 16.755 1.00 40.12 C ATOM 2273 CG1 ILE A 145 -13.529 24.591 16.019 1.00 53.33 C ATOM 2274 CG2 ILE A 145 -15.617 23.340 16.627 1.00 2.34 C ATOM 2275 CD1 ILE A 145 -13.463 23.489 14.985 1.00 22.22 C ATOM 0 H ILE A 145 -14.955 25.274 14.331 1.00 53.44 H new ATOM 0 HA ILE A 145 -16.768 25.643 16.467 1.00 32.34 H new ATOM 0 HB ILE A 145 -14.673 24.842 17.811 1.00 40.12 H new ATOM 0 HG12 ILE A 145 -13.343 25.548 15.531 1.00 53.33 H new ATOM 0 HG13 ILE A 145 -12.731 24.444 16.747 1.00 53.33 H new ATOM 0 HG21 ILE A 145 -15.000 22.532 17.020 1.00 2.34 H new ATOM 0 HG22 ILE A 145 -16.548 23.393 17.191 1.00 2.34 H new ATOM 0 HG23 ILE A 145 -15.840 23.148 15.577 1.00 2.34 H new ATOM 0 HD11 ILE A 145 -12.485 23.500 14.503 1.00 22.22 H new ATOM 0 HD12 ILE A 145 -13.617 22.525 15.470 1.00 22.22 H new ATOM 0 HD13 ILE A 145 -14.239 23.646 14.236 1.00 22.22 H new ATOM 2287 N ARG A 146 -14.460 27.882 16.084 1.00 35.44 N ATOM 2288 CA ARG A 146 -13.944 29.156 16.568 1.00 45.22 C ATOM 2289 C ARG A 146 -15.027 29.937 17.306 1.00 43.51 C ATOM 2290 O ARG A 146 -14.823 30.387 18.434 1.00 64.15 O ATOM 2291 CB ARG A 146 -13.405 29.988 15.402 1.00 60.50 C ATOM 2292 CG ARG A 146 -13.499 31.487 15.629 1.00 42.50 C ATOM 2293 CD ARG A 146 -12.300 32.216 15.042 1.00 60.23 C ATOM 2294 NE ARG A 146 -12.209 33.593 15.518 1.00 14.40 N ATOM 2295 CZ ARG A 146 -11.168 34.384 15.286 1.00 43.44 C ATOM 2296 NH1 ARG A 146 -10.134 33.936 14.587 1.00 41.42 N ATOM 2297 NH2 ARG A 146 -11.159 35.626 15.752 1.00 11.53 N ATOM 0 H ARG A 146 -14.160 27.636 15.141 1.00 35.44 H new ATOM 0 HA ARG A 146 -13.132 28.949 17.265 1.00 45.22 H new ATOM 0 HB2 ARG A 146 -12.363 29.720 15.227 1.00 60.50 H new ATOM 0 HB3 ARG A 146 -13.957 29.731 14.498 1.00 60.50 H new ATOM 0 HG2 ARG A 146 -14.415 31.868 15.177 1.00 42.50 H new ATOM 0 HG3 ARG A 146 -13.563 31.691 16.698 1.00 42.50 H new ATOM 0 HD2 ARG A 146 -11.387 31.681 15.304 1.00 60.23 H new ATOM 0 HD3 ARG A 146 -12.371 32.213 13.954 1.00 60.23 H new ATOM 0 HE ARG A 146 -12.988 33.968 16.059 1.00 14.40 H new ATOM 0 HH11 ARG A 146 -10.137 32.982 14.226 1.00 41.42 H new ATOM 0 HH12 ARG A 146 -9.335 34.545 14.410 1.00 41.42 H new ATOM 0 HH21 ARG A 146 -11.953 35.975 16.290 1.00 11.53 H new ATOM 0 HH22 ARG A 146 -10.358 36.232 15.573 1.00 11.53 H new ATOM 2311 N SER A 147 -16.178 30.096 16.661 1.00 34.54 N ATOM 2312 CA SER A 147 -17.292 30.826 17.254 1.00 13.15 C ATOM 2313 C SER A 147 -17.773 30.142 18.531 1.00 62.34 C ATOM 2314 O SER A 147 -18.597 29.228 18.487 1.00 10.21 O ATOM 2315 CB SER A 147 -18.446 30.937 16.256 1.00 34.12 C ATOM 2316 OG SER A 147 -19.253 32.068 16.533 1.00 14.33 O ATOM 0 H SER A 147 -16.363 29.729 15.728 1.00 34.54 H new ATOM 0 HA SER A 147 -16.943 31.827 17.508 1.00 13.15 H new ATOM 0 HB2 SER A 147 -18.049 31.009 15.243 1.00 34.12 H new ATOM 0 HB3 SER A 147 -19.054 30.034 16.297 1.00 34.12 H new ATOM 0 HG SER A 147 -19.982 32.117 15.880 1.00 14.33 H new ATOM 2322 N LYS A 148 -17.251 30.590 19.667 1.00 11.33 N ATOM 2323 CA LYS A 148 -17.626 30.024 20.958 1.00 43.13 C ATOM 2324 C LYS A 148 -19.140 29.884 21.071 1.00 14.44 C ATOM 2325 O LYS A 148 -19.641 29.007 21.776 1.00 10.33 O ATOM 2326 CB LYS A 148 -17.097 30.901 22.095 1.00 21.43 C ATOM 2327 CG LYS A 148 -15.584 30.879 22.227 1.00 61.02 C ATOM 2328 CD LYS A 148 -15.129 29.868 23.266 1.00 61.45 C ATOM 2329 CE LYS A 148 -13.688 29.438 23.032 1.00 15.40 C ATOM 2330 NZ LYS A 148 -13.007 29.067 24.303 1.00 13.32 N ATOM 0 H LYS A 148 -16.566 31.344 19.721 1.00 11.33 H new ATOM 0 HA LYS A 148 -17.181 29.032 21.036 1.00 43.13 H new ATOM 0 HB2 LYS A 148 -17.424 31.928 21.933 1.00 21.43 H new ATOM 0 HB3 LYS A 148 -17.540 30.570 23.034 1.00 21.43 H new ATOM 0 HG2 LYS A 148 -15.137 30.637 21.263 1.00 61.02 H new ATOM 0 HG3 LYS A 148 -15.228 31.871 22.503 1.00 61.02 H new ATOM 0 HD2 LYS A 148 -15.224 30.301 24.262 1.00 61.45 H new ATOM 0 HD3 LYS A 148 -15.780 28.994 23.235 1.00 61.45 H new ATOM 0 HE2 LYS A 148 -13.669 28.589 22.348 1.00 15.40 H new ATOM 0 HE3 LYS A 148 -13.141 30.248 22.550 1.00 15.40 H new ATOM 0 HZ1 LYS A 148 -12.028 28.780 24.101 1.00 13.32 H new ATOM 0 HZ2 LYS A 148 -13.003 29.884 24.946 1.00 13.32 H new ATOM 0 HZ3 LYS A 148 -13.514 28.277 24.751 1.00 13.32 H new ATOM 2344 N CYS A 149 -19.864 30.752 20.373 1.00 1.53 N ATOM 2345 CA CYS A 149 -21.322 30.725 20.396 1.00 51.04 C ATOM 2346 C CYS A 149 -21.842 29.306 20.189 1.00 15.31 C ATOM 2347 O CYS A 149 -22.879 28.928 20.736 1.00 25.12 O ATOM 2348 CB CYS A 149 -21.887 31.650 19.317 1.00 40.40 C ATOM 2349 SG CYS A 149 -21.943 33.393 19.795 1.00 45.42 S ATOM 0 H CYS A 149 -19.465 31.483 19.784 1.00 1.53 H new ATOM 0 HA CYS A 149 -21.652 31.075 21.374 1.00 51.04 H new ATOM 0 HB2 CYS A 149 -21.283 31.551 18.415 1.00 40.40 H new ATOM 0 HB3 CYS A 149 -22.895 31.321 19.063 1.00 40.40 H new ATOM 0 HG CYS A 149 -22.433 34.096 18.817 1.00 45.42 H new ATOM 2355 N PHE A 150 -21.118 28.526 19.395 1.00 65.42 N ATOM 2356 CA PHE A 150 -21.507 27.149 19.113 1.00 32.23 C ATOM 2357 C PHE A 150 -21.658 26.351 20.405 1.00 11.35 C ATOM 2358 O PHE A 150 -22.762 26.199 20.928 1.00 3.22 O ATOM 2359 CB PHE A 150 -20.474 26.479 18.205 1.00 4.33 C ATOM 2360 CG PHE A 150 -20.806 26.578 16.744 1.00 72.21 C ATOM 2361 CD1 PHE A 150 -22.036 26.150 16.269 1.00 23.35 C ATOM 2362 CD2 PHE A 150 -19.890 27.099 15.845 1.00 61.22 C ATOM 2363 CE1 PHE A 150 -22.344 26.238 14.925 1.00 1.51 C ATOM 2364 CE2 PHE A 150 -20.193 27.191 14.499 1.00 23.53 C ATOM 2365 CZ PHE A 150 -21.422 26.761 14.039 1.00 22.41 C ATOM 0 H PHE A 150 -20.258 28.824 18.935 1.00 65.42 H new ATOM 0 HA PHE A 150 -22.470 27.168 18.603 1.00 32.23 H new ATOM 0 HB2 PHE A 150 -19.499 26.934 18.379 1.00 4.33 H new ATOM 0 HB3 PHE A 150 -20.388 25.428 18.479 1.00 4.33 H new ATOM 0 HD1 PHE A 150 -22.762 25.743 16.957 1.00 23.35 H new ATOM 0 HD2 PHE A 150 -18.928 27.437 16.200 1.00 61.22 H new ATOM 0 HE1 PHE A 150 -23.305 25.898 14.567 1.00 1.51 H new ATOM 0 HE2 PHE A 150 -19.470 27.599 13.808 1.00 23.53 H new ATOM 0 HZ PHE A 150 -21.662 26.833 12.988 1.00 22.41 H new ATOM 2375 N ALA A 151 -20.540 25.844 20.914 1.00 32.24 N ATOM 2376 CA ALA A 151 -20.547 25.063 22.145 1.00 1.24 C ATOM 2377 C ALA A 151 -21.407 25.730 23.214 1.00 41.14 C ATOM 2378 O ALA A 151 -22.260 25.089 23.826 1.00 74.11 O ATOM 2379 CB ALA A 151 -19.126 24.868 22.655 1.00 54.45 C ATOM 0 H ALA A 151 -19.618 25.960 20.493 1.00 32.24 H new ATOM 0 HA ALA A 151 -20.980 24.087 21.924 1.00 1.24 H new ATOM 0 HB1 ALA A 151 -19.147 24.283 23.575 1.00 54.45 H new ATOM 0 HB2 ALA A 151 -18.539 24.341 21.903 1.00 54.45 H new ATOM 0 HB3 ALA A 151 -18.674 25.840 22.853 1.00 54.45 H new ATOM 2385 N MET A 152 -21.176 27.020 23.433 1.00 44.35 N ATOM 2386 CA MET A 152 -21.930 27.774 24.427 1.00 34.43 C ATOM 2387 C MET A 152 -23.431 27.614 24.206 1.00 32.25 C ATOM 2388 O MET A 152 -24.186 27.383 25.151 1.00 21.43 O ATOM 2389 CB MET A 152 -21.550 29.255 24.373 1.00 30.53 C ATOM 2390 CG MET A 152 -22.644 30.143 23.803 1.00 32.44 C ATOM 2391 SD MET A 152 -22.278 31.899 23.985 1.00 72.22 S ATOM 2392 CE MET A 152 -20.542 31.930 23.547 1.00 62.24 C ATOM 0 H MET A 152 -20.472 27.565 22.935 1.00 44.35 H new ATOM 0 HA MET A 152 -21.681 27.379 25.412 1.00 34.43 H new ATOM 0 HB2 MET A 152 -21.304 29.595 25.379 1.00 30.53 H new ATOM 0 HB3 MET A 152 -20.650 29.369 23.769 1.00 30.53 H new ATOM 0 HG2 MET A 152 -22.781 29.912 22.747 1.00 32.44 H new ATOM 0 HG3 MET A 152 -23.586 29.918 24.303 1.00 32.44 H new ATOM 0 HE1 MET A 152 -20.338 32.804 22.928 1.00 62.24 H new ATOM 0 HE2 MET A 152 -19.939 31.978 24.454 1.00 62.24 H new ATOM 0 HE3 MET A 152 -20.291 31.026 22.992 1.00 62.24 H new ATOM 2402 N ASP A 153 -23.857 27.739 22.954 1.00 20.44 N ATOM 2403 CA ASP A 153 -25.268 27.607 22.610 1.00 41.12 C ATOM 2404 C ASP A 153 -25.753 26.179 22.841 1.00 0.41 C ATOM 2405 O ASP A 153 -26.556 25.923 23.740 1.00 64.14 O ATOM 2406 CB ASP A 153 -25.498 28.007 21.152 1.00 53.42 C ATOM 2407 CG ASP A 153 -26.970 28.053 20.790 1.00 43.44 C ATOM 2408 OD1 ASP A 153 -27.542 26.983 20.496 1.00 2.12 O ATOM 2409 OD2 ASP A 153 -27.549 29.160 20.799 1.00 60.04 O ATOM 0 H ASP A 153 -23.246 27.932 22.161 1.00 20.44 H new ATOM 0 HA ASP A 153 -25.838 28.274 23.257 1.00 41.12 H new ATOM 0 HB2 ASP A 153 -25.052 28.985 20.972 1.00 53.42 H new ATOM 0 HB3 ASP A 153 -24.988 27.299 20.499 1.00 53.42 H new ATOM 2414 N LEU A 154 -25.262 25.254 22.024 1.00 30.25 N ATOM 2415 CA LEU A 154 -25.646 23.851 22.139 1.00 50.10 C ATOM 2416 C LEU A 154 -25.494 23.360 23.575 1.00 14.53 C ATOM 2417 O LEU A 154 -26.223 22.474 24.018 1.00 74.40 O ATOM 2418 CB LEU A 154 -24.796 22.991 21.202 1.00 52.12 C ATOM 2419 CG LEU A 154 -23.295 23.283 21.200 1.00 72.31 C ATOM 2420 CD1 LEU A 154 -22.523 22.111 21.787 1.00 52.23 C ATOM 2421 CD2 LEU A 154 -22.813 23.589 19.789 1.00 31.53 C ATOM 0 H LEU A 154 -24.598 25.450 21.275 1.00 30.25 H new ATOM 0 HA LEU A 154 -26.694 23.763 21.853 1.00 50.10 H new ATOM 0 HB2 LEU A 154 -24.942 21.944 21.470 1.00 52.12 H new ATOM 0 HB3 LEU A 154 -25.171 23.116 20.186 1.00 52.12 H new ATOM 0 HG LEU A 154 -23.114 24.159 21.822 1.00 72.31 H new ATOM 0 HD11 LEU A 154 -21.457 22.336 21.778 1.00 52.23 H new ATOM 0 HD12 LEU A 154 -22.848 21.938 22.813 1.00 52.23 H new ATOM 0 HD13 LEU A 154 -22.710 21.217 21.192 1.00 52.23 H new ATOM 0 HD21 LEU A 154 -21.743 23.794 19.807 1.00 31.53 H new ATOM 0 HD22 LEU A 154 -23.007 22.732 19.144 1.00 31.53 H new ATOM 0 HD23 LEU A 154 -23.343 24.460 19.404 1.00 31.53 H new ATOM 2433 N GLU A 155 -24.544 23.945 24.298 1.00 52.51 N ATOM 2434 CA GLU A 155 -24.299 23.568 25.685 1.00 63.02 C ATOM 2435 C GLU A 155 -25.602 23.529 26.477 1.00 75.11 C ATOM 2436 O GLU A 155 -26.124 24.566 26.888 1.00 41.25 O ATOM 2437 CB GLU A 155 -23.322 24.548 26.338 1.00 65.40 C ATOM 2438 CG GLU A 155 -21.898 24.024 26.419 1.00 24.44 C ATOM 2439 CD GLU A 155 -21.397 23.913 27.847 1.00 54.13 C ATOM 2440 OE1 GLU A 155 -22.206 23.564 28.733 1.00 42.54 O ATOM 2441 OE2 GLU A 155 -20.199 24.175 28.078 1.00 43.22 O ATOM 0 H GLU A 155 -23.932 24.681 23.946 1.00 52.51 H new ATOM 0 HA GLU A 155 -23.861 22.570 25.691 1.00 63.02 H new ATOM 0 HB2 GLU A 155 -23.325 25.481 25.775 1.00 65.40 H new ATOM 0 HB3 GLU A 155 -23.672 24.781 27.343 1.00 65.40 H new ATOM 0 HG2 GLU A 155 -21.848 23.045 25.943 1.00 24.44 H new ATOM 0 HG3 GLU A 155 -21.239 24.686 25.857 1.00 24.44 H new ATOM 2448 N HIS A 156 -26.124 22.325 26.687 1.00 34.43 N ATOM 2449 CA HIS A 156 -27.367 22.149 27.430 1.00 14.21 C ATOM 2450 C HIS A 156 -28.504 22.931 26.779 1.00 73.00 C ATOM 2451 O HIS A 156 -29.256 23.633 27.456 1.00 0.20 O ATOM 2452 CB HIS A 156 -27.188 22.600 28.880 1.00 43.00 C ATOM 2453 CG HIS A 156 -28.107 21.910 29.840 1.00 22.31 C ATOM 2454 ND1 HIS A 156 -29.380 22.360 30.119 1.00 71.44 N ATOM 2455 CD2 HIS A 156 -27.932 20.795 30.587 1.00 24.41 C ATOM 2456 CE1 HIS A 156 -29.948 21.552 30.997 1.00 42.23 C ATOM 2457 NE2 HIS A 156 -29.090 20.594 31.297 1.00 62.10 N ATOM 0 H HIS A 156 -25.706 21.457 26.353 1.00 34.43 H new ATOM 0 HA HIS A 156 -27.623 21.090 27.416 1.00 14.21 H new ATOM 0 HB2 HIS A 156 -26.157 22.419 29.183 1.00 43.00 H new ATOM 0 HB3 HIS A 156 -27.354 23.676 28.940 1.00 43.00 H new ATOM 0 HD1 HIS A 156 -29.815 23.187 29.711 1.00 71.44 H new ATOM 0 HD2 HIS A 156 -27.046 20.178 30.619 1.00 24.41 H new ATOM 0 HE1 HIS A 156 -30.944 21.657 31.400 1.00 42.23 H new ATOM 2465 N HIS A 157 -28.624 22.805 25.461 1.00 1.20 N ATOM 2466 CA HIS A 157 -29.669 23.500 24.718 1.00 13.34 C ATOM 2467 C HIS A 157 -31.052 23.024 25.152 1.00 32.30 C ATOM 2468 O HIS A 157 -31.178 22.125 25.984 1.00 23.24 O ATOM 2469 CB HIS A 157 -29.489 23.281 23.216 1.00 31.51 C ATOM 2470 CG HIS A 157 -29.865 24.470 22.387 1.00 1.24 C ATOM 2471 ND1 HIS A 157 -30.436 24.366 21.137 1.00 54.11 N ATOM 2472 CD2 HIS A 157 -29.749 25.795 22.638 1.00 54.44 C ATOM 2473 CE1 HIS A 157 -30.655 25.576 20.653 1.00 64.21 C ATOM 2474 NE2 HIS A 157 -30.247 26.461 21.544 1.00 0.03 N ATOM 0 H HIS A 157 -28.010 22.228 24.886 1.00 1.20 H new ATOM 0 HA HIS A 157 -29.586 24.565 24.934 1.00 13.34 H new ATOM 0 HB2 HIS A 157 -28.449 23.024 23.017 1.00 31.51 H new ATOM 0 HB3 HIS A 157 -30.093 22.428 22.907 1.00 31.51 H new ATOM 0 HD2 HIS A 157 -29.341 26.245 23.531 1.00 54.44 H new ATOM 0 HE1 HIS A 157 -31.093 25.802 19.692 1.00 64.21 H new ATOM 0 HE2 HIS A 157 -30.294 27.474 21.438 1.00 0.03 H new ATOM 2482 N HIS A 158 -32.088 23.632 24.583 1.00 50.21 N ATOM 2483 CA HIS A 158 -33.462 23.270 24.911 1.00 33.10 C ATOM 2484 C HIS A 158 -33.895 22.027 24.140 1.00 73.33 C ATOM 2485 O HIS A 158 -34.845 22.069 23.356 1.00 24.14 O ATOM 2486 CB HIS A 158 -34.406 24.432 24.600 1.00 34.33 C ATOM 2487 CG HIS A 158 -35.681 24.395 25.386 1.00 22.43 C ATOM 2488 ND1 HIS A 158 -36.148 23.257 26.010 1.00 64.33 N ATOM 2489 CD2 HIS A 158 -36.587 25.365 25.650 1.00 61.10 C ATOM 2490 CE1 HIS A 158 -37.287 23.528 26.621 1.00 3.23 C ATOM 2491 NE2 HIS A 158 -37.575 24.801 26.419 1.00 52.12 N ATOM 0 H HIS A 158 -32.002 24.378 23.892 1.00 50.21 H new ATOM 0 HA HIS A 158 -33.509 23.049 25.977 1.00 33.10 H new ATOM 0 HB2 HIS A 158 -33.891 25.371 24.802 1.00 34.33 H new ATOM 0 HB3 HIS A 158 -34.644 24.421 23.536 1.00 34.33 H new ATOM 0 HD2 HIS A 158 -36.541 26.392 25.318 1.00 61.10 H new ATOM 0 HE1 HIS A 158 -37.882 22.828 27.189 1.00 3.23 H new ATOM 0 HE2 HIS A 158 -38.398 25.286 26.776 1.00 52.12 H new ATOM 2499 N HIS A 159 -33.193 20.921 24.366 1.00 42.21 N ATOM 2500 CA HIS A 159 -33.505 19.666 23.692 1.00 63.21 C ATOM 2501 C HIS A 159 -32.863 18.486 24.416 1.00 43.31 C ATOM 2502 O HIS A 159 -31.649 18.458 24.624 1.00 52.21 O ATOM 2503 CB HIS A 159 -33.027 19.710 22.240 1.00 22.52 C ATOM 2504 CG HIS A 159 -34.090 20.128 21.272 1.00 71.21 C ATOM 2505 ND1 HIS A 159 -33.873 21.045 20.265 1.00 1.05 N ATOM 2506 CD2 HIS A 159 -35.384 19.747 21.159 1.00 11.11 C ATOM 2507 CE1 HIS A 159 -34.988 21.212 19.577 1.00 62.23 C ATOM 2508 NE2 HIS A 159 -35.920 20.435 20.098 1.00 10.14 N ATOM 0 H HIS A 159 -32.404 20.869 25.011 1.00 42.21 H new ATOM 0 HA HIS A 159 -34.587 19.533 23.707 1.00 63.21 H new ATOM 0 HB2 HIS A 159 -32.186 20.399 22.164 1.00 22.52 H new ATOM 0 HB3 HIS A 159 -32.657 18.724 21.958 1.00 22.52 H new ATOM 0 HD2 HIS A 159 -35.899 19.035 21.786 1.00 11.11 H new ATOM 0 HE1 HIS A 159 -35.116 21.872 18.732 1.00 62.23 H new ATOM 0 HE2 HIS A 159 -36.882 20.358 19.766 1.00 10.14 H new ATOM 2516 N HIS A 160 -33.685 17.514 24.798 1.00 2.25 N ATOM 2517 CA HIS A 160 -33.197 16.332 25.500 1.00 42.03 C ATOM 2518 C HIS A 160 -32.576 16.713 26.840 1.00 14.15 C ATOM 2519 O HIS A 160 -31.381 16.517 27.061 1.00 43.10 O ATOM 2520 CB HIS A 160 -32.171 15.591 24.642 1.00 44.53 C ATOM 2521 CG HIS A 160 -31.844 14.221 25.149 1.00 63.55 C ATOM 2522 ND1 HIS A 160 -32.738 13.172 25.113 1.00 35.10 N ATOM 2523 CD2 HIS A 160 -30.712 13.728 25.704 1.00 45.54 C ATOM 2524 CE1 HIS A 160 -32.171 12.095 25.626 1.00 74.30 C ATOM 2525 NE2 HIS A 160 -30.941 12.406 25.992 1.00 61.54 N ATOM 0 H HIS A 160 -34.692 17.521 24.633 1.00 2.25 H new ATOM 0 HA HIS A 160 -34.046 15.675 25.687 1.00 42.03 H new ATOM 0 HB2 HIS A 160 -32.551 15.511 23.624 1.00 44.53 H new ATOM 0 HB3 HIS A 160 -31.255 16.180 24.595 1.00 44.53 H new ATOM 0 HD2 HIS A 160 -29.798 14.274 25.886 1.00 45.54 H new ATOM 0 HE1 HIS A 160 -32.635 11.125 25.729 1.00 74.30 H new ATOM 0 HE2 HIS A 160 -30.270 11.767 26.419 1.00 61.54 H new ATOM 2533 N HIS A 161 -33.396 17.259 27.733 1.00 54.22 N ATOM 2534 CA HIS A 161 -32.928 17.668 29.052 1.00 2.11 C ATOM 2535 C HIS A 161 -32.471 16.460 29.865 1.00 42.33 C ATOM 2536 O HIS A 161 -33.102 15.408 29.785 1.00 33.24 O ATOM 2537 CB HIS A 161 -34.033 18.413 29.801 1.00 34.32 C ATOM 2538 CG HIS A 161 -33.687 18.725 31.224 1.00 31.15 C ATOM 2539 ND1 HIS A 161 -34.634 18.858 32.218 1.00 73.33 N ATOM 2540 CD2 HIS A 161 -32.489 18.929 31.820 1.00 43.12 C ATOM 2541 CE1 HIS A 161 -34.034 19.132 33.362 1.00 63.20 C ATOM 2542 NE2 HIS A 161 -32.731 19.180 33.148 1.00 53.21 N ATOM 0 H HIS A 161 -34.388 17.428 27.567 1.00 54.22 H new ATOM 0 HA HIS A 161 -32.077 18.336 28.917 1.00 2.11 H new ATOM 0 HB2 HIS A 161 -34.252 19.343 29.277 1.00 34.32 H new ATOM 0 HB3 HIS A 161 -34.943 17.813 29.780 1.00 34.32 H new ATOM 0 HD2 HIS A 161 -31.522 18.900 31.340 1.00 43.12 H new ATOM 0 HE1 HIS A 161 -34.525 19.290 34.311 1.00 63.20 H new ATOM 0 HE2 HIS A 161 -32.021 19.372 33.854 1.00 53.21 H new TER 2550 HIS A 161 ATOM 2551 N ASP B1001 -16.054 -3.154 24.958 1.00 64.24 N ATOM 2552 CA ASP B1001 -16.894 -4.338 25.099 1.00 3.34 C ATOM 2553 C ASP B1001 -16.142 -5.593 24.667 1.00 2.22 C ATOM 2554 O ASP B1001 -16.369 -6.679 25.200 1.00 10.03 O ATOM 2555 CB ASP B1001 -18.172 -4.184 24.273 1.00 22.04 C ATOM 2556 CG ASP B1001 -17.932 -3.455 22.966 1.00 10.10 C ATOM 2557 OD1 ASP B1001 -16.909 -3.737 22.308 1.00 63.12 O ATOM 2558 OD2 ASP B1001 -18.768 -2.603 22.601 1.00 52.44 O ATOM 0 HA ASP B1001 -17.161 -4.441 26.151 1.00 3.34 H new ATOM 0 HB2 ASP B1001 -18.588 -5.170 24.065 1.00 22.04 H new ATOM 0 HB3 ASP B1001 -18.915 -3.642 24.857 1.00 22.04 H new ATOM 2563 N ASP B1002 -15.247 -5.436 23.698 1.00 51.30 N ATOM 2564 CA ASP B1002 -14.461 -6.556 23.194 1.00 74.13 C ATOM 2565 C ASP B1002 -13.433 -6.082 22.172 1.00 62.22 C ATOM 2566 O ASP B1002 -12.227 -6.145 22.415 1.00 74.04 O ATOM 2567 CB ASP B1002 -15.378 -7.607 22.564 1.00 4.41 C ATOM 2568 CG ASP B1002 -15.345 -8.925 23.311 1.00 32.42 C ATOM 2569 OD1 ASP B1002 -15.166 -8.903 24.547 1.00 51.33 O ATOM 2570 OD2 ASP B1002 -15.498 -9.980 22.660 1.00 32.43 O ATOM 0 H ASP B1002 -15.048 -4.544 23.246 1.00 51.30 H new ATOM 0 HA ASP B1002 -13.931 -7.004 24.035 1.00 74.13 H new ATOM 0 HB2 ASP B1002 -16.400 -7.229 22.545 1.00 4.41 H new ATOM 0 HB3 ASP B1002 -15.080 -7.772 21.529 1.00 4.41 H new ATOM 2575 N ASP B1003 -13.917 -5.609 21.029 1.00 63.34 N ATOM 2576 CA ASP B1003 -13.039 -5.125 19.969 1.00 15.43 C ATOM 2577 C ASP B1003 -12.131 -4.012 20.483 1.00 63.13 C ATOM 2578 O ASP B1003 -12.233 -3.598 21.637 1.00 53.54 O ATOM 2579 CB ASP B1003 -13.865 -4.620 18.785 1.00 13.10 C ATOM 2580 CG ASP B1003 -13.290 -5.053 17.451 1.00 22.41 C ATOM 2581 OD1 ASP B1003 -12.873 -6.225 17.337 1.00 74.40 O ATOM 2582 OD2 ASP B1003 -13.257 -4.221 16.521 1.00 4.11 O ATOM 0 H ASP B1003 -14.912 -5.550 20.812 1.00 63.34 H new ATOM 0 HA ASP B1003 -12.415 -5.956 19.639 1.00 15.43 H new ATOM 0 HB2 ASP B1003 -14.886 -4.990 18.874 1.00 13.10 H new ATOM 0 HB3 ASP B1003 -13.916 -3.532 18.819 1.00 13.10 H new ATOM 2587 N GLU B1004 -11.241 -3.535 19.618 1.00 55.55 N ATOM 2588 CA GLU B1004 -10.314 -2.471 19.985 1.00 23.53 C ATOM 2589 C GLU B1004 -11.060 -1.275 20.567 1.00 15.32 C ATOM 2590 O GLU B1004 -11.041 -1.046 21.777 1.00 41.43 O ATOM 2591 CB GLU B1004 -9.496 -2.034 18.768 1.00 54.30 C ATOM 2592 CG GLU B1004 -8.052 -2.503 18.804 1.00 4.43 C ATOM 2593 CD GLU B1004 -7.086 -1.457 18.283 1.00 45.42 C ATOM 2594 OE1 GLU B1004 -6.844 -0.463 19.000 1.00 22.10 O ATOM 2595 OE2 GLU B1004 -6.572 -1.631 17.158 1.00 3.12 O ATOM 0 H GLU B1004 -11.143 -3.868 18.659 1.00 55.55 H new ATOM 0 HA GLU B1004 -9.638 -2.860 20.747 1.00 23.53 H new ATOM 0 HB2 GLU B1004 -9.971 -2.417 17.865 1.00 54.30 H new ATOM 0 HB3 GLU B1004 -9.514 -0.946 18.700 1.00 54.30 H new ATOM 0 HG2 GLU B1004 -7.783 -2.762 19.828 1.00 4.43 H new ATOM 0 HG3 GLU B1004 -7.954 -3.411 18.209 1.00 4.43 H new ATOM 2602 N ASP B1005 -11.717 -0.515 19.698 1.00 52.04 N ATOM 2603 CA ASP B1005 -12.471 0.658 20.124 1.00 52.21 C ATOM 2604 C ASP B1005 -11.598 1.593 20.954 1.00 5.42 C ATOM 2605 O ASP B1005 -10.387 1.401 21.056 1.00 23.12 O ATOM 2606 CB ASP B1005 -13.699 0.236 20.932 1.00 31.20 C ATOM 2607 CG ASP B1005 -14.598 -0.714 20.165 1.00 30.12 C ATOM 2608 OD1 ASP B1005 -14.850 -0.457 18.970 1.00 41.23 O ATOM 2609 OD2 ASP B1005 -15.050 -1.714 20.761 1.00 75.41 O ATOM 0 H ASP B1005 -11.743 -0.690 18.694 1.00 52.04 H new ATOM 0 HA ASP B1005 -12.799 1.192 19.232 1.00 52.21 H new ATOM 0 HB2 ASP B1005 -13.375 -0.242 21.857 1.00 31.20 H new ATOM 0 HB3 ASP B1005 -14.268 1.122 21.213 1.00 31.20 H new ATOM 2614 N GLY B1006 -12.221 2.608 21.545 1.00 1.34 N ATOM 2615 CA GLY B1006 -11.485 3.559 22.358 1.00 43.00 C ATOM 2616 C GLY B1006 -10.319 4.179 21.613 1.00 73.34 C ATOM 2617 O GLY B1006 -9.167 3.799 21.822 1.00 1.34 O ATOM 0 H GLY B1006 -13.222 2.789 21.475 1.00 1.34 H new ATOM 0 HA2 GLY B1006 -12.160 4.347 22.690 1.00 43.00 H new ATOM 0 HA3 GLY B1006 -11.115 3.058 23.253 1.00 43.00 H new ATOM 2621 N TYR B1007 -10.619 5.133 20.739 1.00 44.24 N ATOM 2622 CA TYR B1007 -9.587 5.804 19.956 1.00 31.22 C ATOM 2623 C TYR B1007 -9.539 7.294 20.282 1.00 63.55 C ATOM 2624 O TYR B1007 -10.571 7.928 20.493 1.00 33.33 O ATOM 2625 CB TYR B1007 -9.842 5.605 18.461 1.00 25.10 C ATOM 2626 CG TYR B1007 -9.105 6.593 17.585 1.00 61.32 C ATOM 2627 CD1 TYR B1007 -7.716 6.603 17.531 1.00 34.15 C ATOM 2628 CD2 TYR B1007 -9.797 7.516 16.811 1.00 2.22 C ATOM 2629 CE1 TYR B1007 -7.039 7.504 16.733 1.00 62.01 C ATOM 2630 CE2 TYR B1007 -9.128 8.420 16.009 1.00 63.23 C ATOM 2631 CZ TYR B1007 -7.749 8.410 15.973 1.00 21.01 C ATOM 2632 OH TYR B1007 -7.079 9.309 15.176 1.00 3.51 O ATOM 0 H TYR B1007 -11.568 5.459 20.555 1.00 44.24 H new ATOM 0 HA TYR B1007 -8.625 5.363 20.215 1.00 31.22 H new ATOM 0 HB2 TYR B1007 -9.547 4.594 18.182 1.00 25.10 H new ATOM 0 HB3 TYR B1007 -10.912 5.689 18.269 1.00 25.10 H new ATOM 0 HD1 TYR B1007 -7.157 5.894 18.123 1.00 34.15 H new ATOM 0 HD2 TYR B1007 -10.877 7.527 16.837 1.00 2.22 H new ATOM 0 HE1 TYR B1007 -5.959 7.499 16.704 1.00 62.01 H new ATOM 0 HE2 TYR B1007 -9.682 9.131 15.413 1.00 63.23 H new ATOM 0 HH TYR B1007 -7.229 10.218 15.510 1.00 3.51 H new ATOM 2642 N ASN B1008 -8.330 7.845 20.319 1.00 51.45 N ATOM 2643 CA ASN B1008 -8.145 9.261 20.618 1.00 71.32 C ATOM 2644 C ASN B1008 -7.015 9.851 19.780 1.00 61.33 C ATOM 2645 O ASN B1008 -6.092 9.153 19.359 1.00 44.42 O ATOM 2646 CB ASN B1008 -7.846 9.454 22.106 1.00 71.12 C ATOM 2647 CG ASN B1008 -6.483 8.916 22.496 1.00 30.12 C ATOM 2648 OD1 ASN B1008 -5.459 9.555 22.255 1.00 63.34 O ATOM 2649 ND2 ASN B1008 -6.465 7.735 23.103 1.00 30.12 N ATOM 0 H ASN B1008 -7.465 7.333 20.146 1.00 51.45 H new ATOM 0 HA ASN B1008 -9.069 9.783 20.369 1.00 71.32 H new ATOM 0 HB2 ASN B1008 -7.898 10.515 22.350 1.00 71.12 H new ATOM 0 HB3 ASN B1008 -8.614 8.953 22.696 1.00 71.12 H new ATOM 0 HD21 ASN B1008 -5.577 7.322 23.390 1.00 30.12 H new ATOM 0 HD22 ASN B1008 -7.339 7.241 23.283 1.00 30.12 H new ATOM 2656 N PRO B1009 -7.087 11.167 19.531 1.00 33.24 N ATOM 2657 CA PRO B1009 -6.078 11.880 18.743 1.00 53.30 C ATOM 2658 C PRO B1009 -4.744 11.992 19.473 1.00 14.14 C ATOM 2659 O PRO B1009 -3.694 12.140 18.848 1.00 21.25 O ATOM 2660 CB PRO B1009 -6.697 13.266 18.545 1.00 14.23 C ATOM 2661 CG PRO B1009 -7.628 13.433 19.696 1.00 12.05 C ATOM 2662 CD PRO B1009 -8.160 12.060 20.002 1.00 64.13 C ATOM 0 HA PRO B1009 -5.849 11.363 17.811 1.00 53.30 H new ATOM 0 HB2 PRO B1009 -5.933 14.043 18.538 1.00 14.23 H new ATOM 0 HB3 PRO B1009 -7.227 13.331 17.595 1.00 14.23 H new ATOM 0 HG2 PRO B1009 -7.110 13.852 20.559 1.00 12.05 H new ATOM 0 HG3 PRO B1009 -8.438 14.118 19.446 1.00 12.05 H new ATOM 0 HD2 PRO B1009 -8.352 11.931 21.067 1.00 64.13 H new ATOM 0 HD3 PRO B1009 -9.099 11.868 19.484 1.00 64.13 H new ATOM 2670 N TYR B1010 -4.793 11.920 20.799 1.00 54.31 N ATOM 2671 CA TYR B1010 -3.588 12.015 21.614 1.00 15.45 C ATOM 2672 C TYR B1010 -2.655 10.838 21.347 1.00 14.32 C ATOM 2673 O TYR B1010 -1.478 10.869 21.707 1.00 42.14 O ATOM 2674 CB TYR B1010 -3.955 12.064 23.099 1.00 64.42 C ATOM 2675 CG TYR B1010 -3.525 13.339 23.787 1.00 5.15 C ATOM 2676 CD1 TYR B1010 -2.238 13.838 23.627 1.00 3.30 C ATOM 2677 CD2 TYR B1010 -4.404 14.044 24.599 1.00 11.52 C ATOM 2678 CE1 TYR B1010 -1.840 15.003 24.255 1.00 61.13 C ATOM 2679 CE2 TYR B1010 -4.016 15.211 25.230 1.00 65.44 C ATOM 2680 CZ TYR B1010 -2.732 15.686 25.054 1.00 35.45 C ATOM 2681 OH TYR B1010 -2.341 16.846 25.682 1.00 51.11 O ATOM 0 H TYR B1010 -5.654 11.796 21.332 1.00 54.31 H new ATOM 0 HA TYR B1010 -3.068 12.934 21.344 1.00 15.45 H new ATOM 0 HB2 TYR B1010 -5.034 11.952 23.202 1.00 64.42 H new ATOM 0 HB3 TYR B1010 -3.497 11.215 23.606 1.00 64.42 H new ATOM 0 HD1 TYR B1010 -1.537 13.306 23.001 1.00 3.30 H new ATOM 0 HD2 TYR B1010 -5.409 13.674 24.740 1.00 11.52 H new ATOM 0 HE1 TYR B1010 -0.836 15.376 24.121 1.00 61.13 H new ATOM 0 HE2 TYR B1010 -4.713 15.748 25.857 1.00 65.44 H new ATOM 0 HH TYR B1010 -3.089 17.203 26.206 1.00 51.11 H new ATOM 2691 N THR B1011 -3.190 9.800 20.713 1.00 73.34 N ATOM 2692 CA THR B1011 -2.408 8.611 20.397 1.00 42.54 C ATOM 2693 C THR B1011 -3.171 7.684 19.459 1.00 74.25 C ATOM 2694 O THR B1011 -4.308 7.300 19.738 1.00 52.24 O ATOM 2695 CB THR B1011 -2.027 7.834 21.671 1.00 41.42 C ATOM 2696 OG1 THR B1011 -1.649 6.495 21.333 1.00 4.23 O ATOM 2697 CG2 THR B1011 -3.187 7.806 22.655 1.00 42.43 C ATOM 0 H THR B1011 -4.162 9.758 20.408 1.00 73.34 H new ATOM 0 HA THR B1011 -1.498 8.953 19.904 1.00 42.54 H new ATOM 0 HB THR B1011 -1.185 8.341 22.141 1.00 41.42 H new ATOM 0 HG1 THR B1011 -1.407 6.008 22.148 1.00 4.23 H new ATOM 0 HG21 THR B1011 -2.894 7.252 23.547 1.00 42.43 H new ATOM 0 HG22 THR B1011 -3.453 8.826 22.933 1.00 42.43 H new ATOM 0 HG23 THR B1011 -4.046 7.320 22.192 1.00 42.43 H new ATOM 2705 N LEU B1012 -2.541 7.326 18.346 1.00 64.43 N ATOM 2706 CA LEU B1012 -3.161 6.441 17.366 1.00 61.15 C ATOM 2707 C LEU B1012 -3.049 4.983 17.800 1.00 12.11 C ATOM 2708 O LEU B1012 -2.152 4.618 18.559 1.00 4.12 O ATOM 2709 CB LEU B1012 -2.508 6.628 15.995 1.00 24.10 C ATOM 2710 CG LEU B1012 -3.386 6.312 14.784 1.00 12.20 C ATOM 2711 CD1 LEU B1012 -2.795 6.922 13.522 1.00 14.24 C ATOM 2712 CD2 LEU B1012 -3.553 4.808 14.624 1.00 40.12 C ATOM 0 H LEU B1012 -1.601 7.635 18.099 1.00 64.43 H new ATOM 0 HA LEU B1012 -4.218 6.700 17.297 1.00 61.15 H new ATOM 0 HB2 LEU B1012 -2.170 7.661 15.914 1.00 24.10 H new ATOM 0 HB3 LEU B1012 -1.620 5.998 15.949 1.00 24.10 H new ATOM 0 HG LEU B1012 -4.370 6.751 14.949 1.00 12.20 H new ATOM 0 HD11 LEU B1012 -3.434 6.687 12.671 1.00 14.24 H new ATOM 0 HD12 LEU B1012 -2.728 8.004 13.637 1.00 14.24 H new ATOM 0 HD13 LEU B1012 -1.799 6.513 13.352 1.00 14.24 H new ATOM 0 HD21 LEU B1012 -4.181 4.602 13.757 1.00 40.12 H new ATOM 0 HD22 LEU B1012 -2.576 4.346 14.482 1.00 40.12 H new ATOM 0 HD23 LEU B1012 -4.022 4.397 15.518 1.00 40.12 H new TER 2724 LEU B1012