USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1231 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 155 TYR OH : rot -18:sc= -1.3 USER MOD Set 1.2: A 157 GLN : amide:sc= -1.84 K(o=-3.1,f=-3.8) USER MOD Set 2.1: A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 123 TYR OH : rot 165:sc= 0 USER MOD Set 3.1: A 78 ASN : amide:sc= 0.333 X(o=0.69,f=0.77) USER MOD Set 3.2: A 80 THR OG1 : rot 43:sc= 0.352 USER MOD Set 4.1: A 65 SER OG : rot -151:sc= 0.062 USER MOD Set 4.2: A 88 ASN : amide:sc= -6.97! C(o=-6.9!,f=-6.5!) USER MOD Set 5.1: A 59 ASN : amide:sc= -4.04! C(o=-7.4!,f=-14!) USER MOD Set 5.2: A 71 HIS :FLIP no HD1:sc= -3.99! X(o=-7.7,f=-7.4!) USER MOD Set 5.3: A 84 ASN :FLIP amide:sc= -0.132 X(o=-7.7!,f=-7.4) USER MOD Set 5.4: A 148 GLN :FLIP amide:sc= 0.722 F(o=-11,f=-7.4) USER MOD Set 6.1: A 17 MET CE :methyl -176:sc= -2.41 (180deg=-2.63) USER MOD Set 6.2: A 22 THR OG1 : rot 180:sc= 0 USER MOD Set 6.3: A 29 TYR OH : rot 109:sc= 0.711 USER MOD Set 6.4: A 34 GLN :FLIP amide:sc= -1.74 F(o=-5.5!,f=-3.4) USER MOD Single : A 1 GLY N :NH3+ -135:sc= 0.0681 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= -0.0109 USER MOD Single : A 5 SER OG : rot 180:sc= -0.12 USER MOD Single : A 6 SER OG : rot 40:sc= 0.911 USER MOD Single : A 8 HIS : no HD1:sc= -0.0837 X(o=-0.084,f=0) USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 10 GLN : amide:sc= 0.106 X(o=0.11,f=-0.24) USER MOD Single : A 12 ASN : amide:sc= -1.29 K(o=-1.3,f=-7!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot -121:sc= 0.109 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= -1.04 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot -130:sc= -0.72 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 167:sc=-0.00216 (180deg=-0.103) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN :FLIP amide:sc= -4.66! C(o=-6.9!,f=-4.7!) USER MOD Single : A 76 MET CE :methyl 153:sc= -2.39 (180deg=-2.84!) USER MOD Single : A 85 SER OG : rot 17:sc= -1.02 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 4:sc= 0.281 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= -0.779 K(o=-0.78,f=-2.2) USER MOD Single : A 101 ASN : amide:sc= -3.33! C(o=-3.3!,f=-14!) USER MOD Single : A 107 GLN : amide:sc= -0.194 K(o=-0.19,f=-1.2!) USER MOD Single : A 112 SER OG : rot 180:sc= -0.0259 USER MOD Single : A 115 CYS SG : rot 60:sc= -1.58 USER MOD Single : A 125 ASN : amide:sc= 0.126 K(o=0.13,f=-2.8!) USER MOD Single : A 127 GLN :FLIP amide:sc= 0.693 F(o=-0.0071,f=0.69) USER MOD Single : A 128 HIS : no HE2:sc= 0 K(o=0,f=-2.5!) USER MOD Single : A 134 HIS :FLIP+bothHN:sc= -4.88! C(o=-8.3!,f=-4.9!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 THR OG1 : rot -173:sc= -1.52 USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot -50:sc= -0.222 USER MOD Single : A 162 SER OG : rot 19:sc= 0.475 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.498 9.164 -19.202 1.00 0.00 N ATOM 2 CA GLY A 1 -15.406 9.971 -19.995 1.00 0.00 C ATOM 3 C GLY A 1 -16.658 9.215 -20.392 1.00 0.00 C ATOM 4 O GLY A 1 -16.891 8.099 -19.927 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.155 9.721 -18.393 1.00 0.00 H new ATOM 0 H2 GLY A 1 -14.997 8.320 -18.854 1.00 0.00 H new ATOM 0 H3 GLY A 1 -13.691 8.872 -19.789 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.686 10.859 -19.429 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.892 10.314 -20.893 1.00 0.00 H new ATOM 8 N SER A 2 -17.469 9.823 -21.252 1.00 0.00 N ATOM 9 CA SER A 2 -18.707 9.202 -21.706 1.00 0.00 C ATOM 10 C SER A 2 -19.572 8.783 -20.521 1.00 0.00 C ATOM 11 O SER A 2 -20.157 7.701 -20.517 1.00 0.00 O ATOM 12 CB SER A 2 -18.401 7.986 -22.583 1.00 0.00 C ATOM 13 OG SER A 2 -17.499 8.322 -23.624 1.00 0.00 O ATOM 0 H SER A 2 -17.290 10.746 -21.648 1.00 0.00 H new ATOM 0 HA SER A 2 -19.258 9.936 -22.294 1.00 0.00 H new ATOM 0 HB2 SER A 2 -17.975 7.190 -21.971 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.326 7.599 -23.010 1.00 0.00 H new ATOM 0 HG SER A 2 -17.318 7.528 -24.169 1.00 0.00 H new ATOM 19 N SER A 3 -19.647 9.650 -19.516 1.00 0.00 N ATOM 20 CA SER A 3 -20.436 9.370 -18.323 1.00 0.00 C ATOM 21 C SER A 3 -21.006 10.657 -17.734 1.00 0.00 C ATOM 22 O SER A 3 -20.466 11.742 -17.945 1.00 0.00 O ATOM 23 CB SER A 3 -19.581 8.652 -17.277 1.00 0.00 C ATOM 24 OG SER A 3 -20.319 8.416 -16.090 1.00 0.00 O ATOM 0 H SER A 3 -19.171 10.552 -19.505 1.00 0.00 H new ATOM 0 HA SER A 3 -21.265 8.724 -18.610 1.00 0.00 H new ATOM 0 HB2 SER A 3 -19.225 7.705 -17.682 1.00 0.00 H new ATOM 0 HB3 SER A 3 -18.700 9.252 -17.048 1.00 0.00 H new ATOM 0 HG SER A 3 -19.751 7.955 -15.438 1.00 0.00 H new ATOM 30 N GLY A 4 -22.103 10.527 -16.994 1.00 0.00 N ATOM 31 CA GLY A 4 -22.729 11.687 -16.386 1.00 0.00 C ATOM 32 C GLY A 4 -24.076 11.362 -15.770 1.00 0.00 C ATOM 33 O GLY A 4 -25.082 11.272 -16.474 1.00 0.00 O ATOM 0 H GLY A 4 -22.569 9.640 -16.805 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -22.070 12.091 -15.618 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.855 12.465 -17.139 1.00 0.00 H new ATOM 37 N SER A 5 -24.096 11.185 -14.453 1.00 0.00 N ATOM 38 CA SER A 5 -25.328 10.863 -13.744 1.00 0.00 C ATOM 39 C SER A 5 -25.237 11.280 -12.279 1.00 0.00 C ATOM 40 O SER A 5 -24.230 11.038 -11.615 1.00 0.00 O ATOM 41 CB SER A 5 -25.621 9.364 -13.841 1.00 0.00 C ATOM 42 OG SER A 5 -25.812 8.968 -15.188 1.00 0.00 O ATOM 0 H SER A 5 -23.273 11.259 -13.856 1.00 0.00 H new ATOM 0 HA SER A 5 -26.142 11.417 -14.212 1.00 0.00 H new ATOM 0 HB2 SER A 5 -24.796 8.800 -13.406 1.00 0.00 H new ATOM 0 HB3 SER A 5 -26.511 9.126 -13.259 1.00 0.00 H new ATOM 0 HG SER A 5 -25.996 8.006 -15.223 1.00 0.00 H new ATOM 48 N SER A 6 -26.297 11.910 -11.783 1.00 0.00 N ATOM 49 CA SER A 6 -26.337 12.365 -10.398 1.00 0.00 C ATOM 50 C SER A 6 -27.535 11.770 -9.664 1.00 0.00 C ATOM 51 O SER A 6 -28.681 12.136 -9.924 1.00 0.00 O ATOM 52 CB SER A 6 -26.398 13.893 -10.343 1.00 0.00 C ATOM 53 OG SER A 6 -27.604 14.376 -10.910 1.00 0.00 O ATOM 0 H SER A 6 -27.139 12.117 -12.319 1.00 0.00 H new ATOM 0 HA SER A 6 -25.426 12.026 -9.904 1.00 0.00 H new ATOM 0 HB2 SER A 6 -26.320 14.226 -9.308 1.00 0.00 H new ATOM 0 HB3 SER A 6 -25.547 14.314 -10.878 1.00 0.00 H new ATOM 0 HG SER A 6 -28.345 13.788 -10.653 1.00 0.00 H new ATOM 59 N GLY A 7 -27.261 10.850 -8.745 1.00 0.00 N ATOM 60 CA GLY A 7 -28.325 10.218 -7.987 1.00 0.00 C ATOM 61 C GLY A 7 -27.803 9.194 -6.999 1.00 0.00 C ATOM 62 O GLY A 7 -27.946 7.988 -7.209 1.00 0.00 O ATOM 0 H GLY A 7 -26.321 10.531 -8.512 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -28.888 10.982 -7.451 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -29.019 9.734 -8.674 1.00 0.00 H new ATOM 66 N HIS A 8 -27.195 9.672 -5.918 1.00 0.00 N ATOM 67 CA HIS A 8 -26.649 8.789 -4.894 1.00 0.00 C ATOM 68 C HIS A 8 -27.362 8.998 -3.561 1.00 0.00 C ATOM 69 O HIS A 8 -26.868 9.712 -2.689 1.00 0.00 O ATOM 70 CB HIS A 8 -25.149 9.032 -4.727 1.00 0.00 C ATOM 71 CG HIS A 8 -24.399 9.059 -6.024 1.00 0.00 C ATOM 72 ND1 HIS A 8 -23.694 7.977 -6.507 1.00 0.00 N ATOM 73 CD2 HIS A 8 -24.248 10.044 -6.939 1.00 0.00 C ATOM 74 CE1 HIS A 8 -23.140 8.296 -7.663 1.00 0.00 C ATOM 75 NE2 HIS A 8 -23.462 9.545 -7.948 1.00 0.00 N ATOM 0 H HIS A 8 -27.068 10.666 -5.729 1.00 0.00 H new ATOM 0 HA HIS A 8 -26.808 7.759 -5.214 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -24.998 9.979 -4.210 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -24.731 8.251 -4.091 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -24.668 11.038 -6.886 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -22.528 7.646 -8.271 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -23.173 10.056 -8.782 1.00 0.00 H new ATOM 84 N GLN A 9 -28.524 8.370 -3.412 1.00 0.00 N ATOM 85 CA GLN A 9 -29.303 8.489 -2.185 1.00 0.00 C ATOM 86 C GLN A 9 -28.424 8.275 -0.958 1.00 0.00 C ATOM 87 O GLN A 9 -28.466 9.058 -0.009 1.00 0.00 O ATOM 88 CB GLN A 9 -30.452 7.478 -2.187 1.00 0.00 C ATOM 89 CG GLN A 9 -31.370 7.600 -0.981 1.00 0.00 C ATOM 90 CD GLN A 9 -32.580 6.691 -1.075 1.00 0.00 C ATOM 91 OE1 GLN A 9 -32.505 5.595 -1.632 1.00 0.00 O ATOM 92 NE2 GLN A 9 -33.703 7.141 -0.529 1.00 0.00 N ATOM 0 H GLN A 9 -28.946 7.775 -4.124 1.00 0.00 H new ATOM 0 HA GLN A 9 -29.714 9.497 -2.142 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -31.040 7.610 -3.096 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -30.038 6.470 -2.218 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -30.810 7.361 -0.077 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -31.703 8.633 -0.886 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -33.720 8.055 -0.078 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -34.549 6.572 -0.561 1.00 0.00 H new ATOM 101 N GLN A 10 -27.629 7.210 -0.984 1.00 0.00 N ATOM 102 CA GLN A 10 -26.740 6.893 0.128 1.00 0.00 C ATOM 103 C GLN A 10 -25.375 6.442 -0.378 1.00 0.00 C ATOM 104 O GLN A 10 -25.279 5.581 -1.255 1.00 0.00 O ATOM 105 CB GLN A 10 -27.357 5.805 1.007 1.00 0.00 C ATOM 106 CG GLN A 10 -28.465 6.312 1.916 1.00 0.00 C ATOM 107 CD GLN A 10 -27.976 7.346 2.911 1.00 0.00 C ATOM 108 OE1 GLN A 10 -27.242 7.026 3.846 1.00 0.00 O ATOM 109 NE2 GLN A 10 -28.383 8.595 2.715 1.00 0.00 N ATOM 0 H GLN A 10 -27.582 6.552 -1.762 1.00 0.00 H new ATOM 0 HA GLN A 10 -26.606 7.797 0.722 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -27.755 5.016 0.369 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -26.574 5.356 1.618 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -29.259 6.746 1.308 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -28.900 5.471 2.456 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -28.991 8.815 1.926 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -28.087 9.334 3.353 1.00 0.00 H new ATOM 118 N LEU A 11 -24.320 7.027 0.178 1.00 0.00 N ATOM 119 CA LEU A 11 -22.958 6.684 -0.217 1.00 0.00 C ATOM 120 C LEU A 11 -22.301 5.779 0.820 1.00 0.00 C ATOM 121 O LEU A 11 -22.159 6.152 1.983 1.00 0.00 O ATOM 122 CB LEU A 11 -22.125 7.954 -0.402 1.00 0.00 C ATOM 123 CG LEU A 11 -22.709 9.009 -1.343 1.00 0.00 C ATOM 124 CD1 LEU A 11 -22.139 10.382 -1.025 1.00 0.00 C ATOM 125 CD2 LEU A 11 -22.437 8.639 -2.794 1.00 0.00 C ATOM 0 H LEU A 11 -24.381 7.741 0.904 1.00 0.00 H new ATOM 0 HA LEU A 11 -23.006 6.146 -1.164 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -21.975 8.412 0.576 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -21.141 7.668 -0.775 1.00 0.00 H new ATOM 0 HG LEU A 11 -23.788 9.043 -1.194 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -22.566 11.120 -1.705 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -22.386 10.649 0.002 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -21.056 10.363 -1.145 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -22.860 9.401 -3.449 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -21.361 8.576 -2.958 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -22.895 7.675 -3.016 1.00 0.00 H new ATOM 137 N ASN A 12 -21.900 4.587 0.388 1.00 0.00 N ATOM 138 CA ASN A 12 -21.257 3.628 1.279 1.00 0.00 C ATOM 139 C ASN A 12 -19.772 3.496 0.954 1.00 0.00 C ATOM 140 O ASN A 12 -18.915 3.836 1.770 1.00 0.00 O ATOM 141 CB ASN A 12 -21.938 2.263 1.170 1.00 0.00 C ATOM 142 CG ASN A 12 -22.180 1.851 -0.270 1.00 0.00 C ATOM 143 OD1 ASN A 12 -22.693 2.630 -1.072 1.00 0.00 O ATOM 144 ND2 ASN A 12 -21.811 0.619 -0.602 1.00 0.00 N ATOM 0 H ASN A 12 -22.009 4.263 -0.573 1.00 0.00 H new ATOM 0 HA ASN A 12 -21.356 3.995 2.301 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -21.320 1.511 1.661 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -22.889 2.291 1.702 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -21.950 0.285 -1.556 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -21.389 0.007 0.097 1.00 0.00 H new ATOM 151 N SER A 13 -19.475 3.001 -0.243 1.00 0.00 N ATOM 152 CA SER A 13 -18.094 2.821 -0.675 1.00 0.00 C ATOM 153 C SER A 13 -18.013 2.689 -2.193 1.00 0.00 C ATOM 154 O SER A 13 -18.961 2.244 -2.842 1.00 0.00 O ATOM 155 CB SER A 13 -17.488 1.583 -0.012 1.00 0.00 C ATOM 156 OG SER A 13 -18.308 0.444 -0.210 1.00 0.00 O ATOM 0 H SER A 13 -20.172 2.717 -0.931 1.00 0.00 H new ATOM 0 HA SER A 13 -17.527 3.701 -0.373 1.00 0.00 H new ATOM 0 HB2 SER A 13 -16.496 1.396 -0.422 1.00 0.00 H new ATOM 0 HB3 SER A 13 -17.363 1.763 1.056 1.00 0.00 H new ATOM 0 HG SER A 13 -17.897 -0.334 0.222 1.00 0.00 H new ATOM 162 N LEU A 14 -16.874 3.081 -2.754 1.00 0.00 N ATOM 163 CA LEU A 14 -16.666 3.008 -4.196 1.00 0.00 C ATOM 164 C LEU A 14 -16.874 1.585 -4.705 1.00 0.00 C ATOM 165 O LEU A 14 -16.722 0.608 -3.970 1.00 0.00 O ATOM 166 CB LEU A 14 -15.259 3.489 -4.554 1.00 0.00 C ATOM 167 CG LEU A 14 -14.122 2.939 -3.691 1.00 0.00 C ATOM 168 CD1 LEU A 14 -13.639 1.603 -4.232 1.00 0.00 C ATOM 169 CD2 LEU A 14 -12.975 3.936 -3.623 1.00 0.00 C ATOM 0 H LEU A 14 -16.080 3.453 -2.232 1.00 0.00 H new ATOM 0 HA LEU A 14 -17.398 3.657 -4.677 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.060 3.226 -5.593 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -15.242 4.577 -4.492 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.501 2.782 -2.681 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -12.830 1.228 -3.605 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -14.463 0.889 -4.227 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.277 1.733 -5.252 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.175 3.529 -3.005 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -12.597 4.125 -4.628 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -13.330 4.870 -3.187 1.00 0.00 H new ATOM 181 N PRO A 15 -17.228 1.462 -5.993 1.00 0.00 N ATOM 182 CA PRO A 15 -17.462 0.163 -6.629 1.00 0.00 C ATOM 183 C PRO A 15 -16.175 -0.636 -6.805 1.00 0.00 C ATOM 184 O PRO A 15 -15.155 -0.336 -6.184 1.00 0.00 O ATOM 185 CB PRO A 15 -18.050 0.536 -7.992 1.00 0.00 C ATOM 186 CG PRO A 15 -17.533 1.906 -8.265 1.00 0.00 C ATOM 187 CD PRO A 15 -17.427 2.583 -6.927 1.00 0.00 C ATOM 0 HA PRO A 15 -18.112 -0.473 -6.029 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -17.737 -0.167 -8.764 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -19.140 0.521 -7.971 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -16.563 1.865 -8.760 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -18.205 2.452 -8.926 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -16.593 3.285 -6.896 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -18.328 3.148 -6.690 1.00 0.00 H new ATOM 195 N THR A 16 -16.228 -1.655 -7.657 1.00 0.00 N ATOM 196 CA THR A 16 -15.067 -2.498 -7.915 1.00 0.00 C ATOM 197 C THR A 16 -14.179 -1.895 -8.997 1.00 0.00 C ATOM 198 O THR A 16 -14.663 -1.216 -9.903 1.00 0.00 O ATOM 199 CB THR A 16 -15.486 -3.917 -8.342 1.00 0.00 C ATOM 200 OG1 THR A 16 -15.766 -4.714 -7.186 1.00 0.00 O ATOM 201 CG2 THR A 16 -14.394 -4.578 -9.169 1.00 0.00 C ATOM 0 H THR A 16 -17.063 -1.917 -8.181 1.00 0.00 H new ATOM 0 HA THR A 16 -14.507 -2.558 -6.982 1.00 0.00 H new ATOM 0 HB THR A 16 -16.385 -3.838 -8.954 1.00 0.00 H new ATOM 0 HG1 THR A 16 -15.178 -5.498 -7.179 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.713 -5.579 -9.459 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.205 -3.984 -10.063 1.00 0.00 H new ATOM 0 HG23 THR A 16 -13.480 -4.645 -8.578 1.00 0.00 H new ATOM 209 N MET A 17 -12.878 -2.148 -8.899 1.00 0.00 N ATOM 210 CA MET A 17 -11.924 -1.631 -9.872 1.00 0.00 C ATOM 211 C MET A 17 -11.755 -2.602 -11.037 1.00 0.00 C ATOM 212 O MET A 17 -10.878 -3.464 -11.016 1.00 0.00 O ATOM 213 CB MET A 17 -10.570 -1.378 -9.205 1.00 0.00 C ATOM 214 CG MET A 17 -10.635 -0.382 -8.058 1.00 0.00 C ATOM 215 SD MET A 17 -9.028 0.340 -7.674 1.00 0.00 S ATOM 216 CE MET A 17 -8.383 -0.865 -6.517 1.00 0.00 C ATOM 0 H MET A 17 -12.461 -2.708 -8.156 1.00 0.00 H new ATOM 0 HA MET A 17 -12.313 -0.689 -10.260 1.00 0.00 H new ATOM 0 HB2 MET A 17 -10.175 -2.323 -8.833 1.00 0.00 H new ATOM 0 HB3 MET A 17 -9.868 -1.012 -9.954 1.00 0.00 H new ATOM 0 HG2 MET A 17 -11.335 0.414 -8.312 1.00 0.00 H new ATOM 0 HG3 MET A 17 -11.027 -0.880 -7.171 1.00 0.00 H new ATOM 0 HE1 MET A 17 -7.422 -0.523 -6.133 1.00 0.00 H new ATOM 0 HE2 MET A 17 -9.082 -0.986 -5.690 1.00 0.00 H new ATOM 0 HE3 MET A 17 -8.251 -1.821 -7.023 1.00 0.00 H new ATOM 226 N GLU A 18 -12.602 -2.454 -12.051 1.00 0.00 N ATOM 227 CA GLU A 18 -12.547 -3.319 -13.224 1.00 0.00 C ATOM 228 C GLU A 18 -12.118 -2.533 -14.460 1.00 0.00 C ATOM 229 O GLU A 18 -12.098 -1.303 -14.450 1.00 0.00 O ATOM 230 CB GLU A 18 -13.909 -3.972 -13.468 1.00 0.00 C ATOM 231 CG GLU A 18 -14.091 -5.291 -12.736 1.00 0.00 C ATOM 232 CD GLU A 18 -15.028 -6.237 -13.461 1.00 0.00 C ATOM 233 OE1 GLU A 18 -16.254 -6.146 -13.238 1.00 0.00 O ATOM 234 OE2 GLU A 18 -14.536 -7.068 -14.253 1.00 0.00 O ATOM 0 H GLU A 18 -13.334 -1.744 -12.084 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.808 -4.098 -13.035 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -14.694 -3.282 -13.158 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -14.036 -4.139 -14.538 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.120 -5.771 -12.613 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -14.479 -5.097 -11.736 1.00 0.00 H new ATOM 241 N GLY A 19 -11.776 -3.254 -15.523 1.00 0.00 N ATOM 242 CA GLY A 19 -11.352 -2.609 -16.752 1.00 0.00 C ATOM 243 C GLY A 19 -9.863 -2.324 -16.773 1.00 0.00 C ATOM 244 O GLY A 19 -9.053 -3.102 -16.267 1.00 0.00 O ATOM 0 H GLY A 19 -11.785 -4.273 -15.555 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.609 -3.244 -17.600 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.900 -1.675 -16.876 1.00 0.00 H new ATOM 248 N PRO A 20 -9.482 -1.186 -17.373 1.00 0.00 N ATOM 249 CA PRO A 20 -8.079 -0.776 -17.474 1.00 0.00 C ATOM 250 C PRO A 20 -7.493 -0.376 -16.124 1.00 0.00 C ATOM 251 O PRO A 20 -8.205 -0.230 -15.130 1.00 0.00 O ATOM 252 CB PRO A 20 -8.129 0.431 -18.414 1.00 0.00 C ATOM 253 CG PRO A 20 -9.508 0.974 -18.260 1.00 0.00 C ATOM 254 CD PRO A 20 -10.393 -0.213 -17.997 1.00 0.00 C ATOM 0 HA PRO A 20 -7.443 -1.586 -17.831 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.379 1.174 -18.144 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -7.932 0.138 -19.445 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.557 1.687 -17.437 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -9.822 1.503 -19.160 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.222 0.042 -17.337 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.827 -0.602 -18.918 1.00 0.00 H new ATOM 262 N PRO A 21 -6.165 -0.193 -16.085 1.00 0.00 N ATOM 263 CA PRO A 21 -5.455 0.194 -14.862 1.00 0.00 C ATOM 264 C PRO A 21 -5.763 1.627 -14.442 1.00 0.00 C ATOM 265 O PRO A 21 -6.536 2.325 -15.098 1.00 0.00 O ATOM 266 CB PRO A 21 -3.980 0.055 -15.249 1.00 0.00 C ATOM 267 CG PRO A 21 -3.960 0.227 -16.729 1.00 0.00 C ATOM 268 CD PRO A 21 -5.254 -0.350 -17.231 1.00 0.00 C ATOM 0 HA PRO A 21 -5.746 -0.420 -14.010 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.368 0.809 -14.754 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.584 -0.918 -14.958 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -3.872 1.280 -16.998 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -3.106 -0.288 -17.170 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.618 0.183 -18.109 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.144 -1.396 -17.516 1.00 0.00 H new ATOM 276 N THR A 22 -5.152 2.061 -13.344 1.00 0.00 N ATOM 277 CA THR A 22 -5.361 3.411 -12.835 1.00 0.00 C ATOM 278 C THR A 22 -4.340 4.382 -13.417 1.00 0.00 C ATOM 279 O THR A 22 -3.274 3.974 -13.878 1.00 0.00 O ATOM 280 CB THR A 22 -5.275 3.452 -11.298 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.526 3.055 -10.726 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.911 4.847 -10.814 1.00 0.00 C ATOM 0 H THR A 22 -4.508 1.497 -12.790 1.00 0.00 H new ATOM 0 HA THR A 22 -6.362 3.713 -13.143 1.00 0.00 H new ATOM 0 HB THR A 22 -4.495 2.759 -10.981 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.462 3.082 -9.748 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.856 4.852 -9.725 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.944 5.135 -11.227 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.671 5.556 -11.142 1.00 0.00 H new ATOM 290 N PHE A 23 -4.672 5.668 -13.391 1.00 0.00 N ATOM 291 CA PHE A 23 -3.783 6.698 -13.916 1.00 0.00 C ATOM 292 C PHE A 23 -4.048 8.041 -13.241 1.00 0.00 C ATOM 293 O PHE A 23 -5.197 8.425 -13.029 1.00 0.00 O ATOM 294 CB PHE A 23 -3.961 6.832 -15.430 1.00 0.00 C ATOM 295 CG PHE A 23 -3.012 5.979 -16.222 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.292 4.642 -16.457 1.00 0.00 C ATOM 297 CD2 PHE A 23 -1.840 6.514 -16.733 1.00 0.00 C ATOM 298 CE1 PHE A 23 -2.421 3.855 -17.186 1.00 0.00 C ATOM 299 CE2 PHE A 23 -0.966 5.731 -17.463 1.00 0.00 C ATOM 300 CZ PHE A 23 -1.256 4.400 -17.689 1.00 0.00 C ATOM 0 H PHE A 23 -5.550 6.022 -13.012 1.00 0.00 H new ATOM 0 HA PHE A 23 -2.757 6.400 -13.702 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -4.984 6.564 -15.693 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -3.822 7.875 -15.713 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.201 4.210 -16.066 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.607 7.554 -16.559 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.651 2.815 -17.362 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -0.056 6.160 -17.857 1.00 0.00 H new ATOM 0 HZ PHE A 23 -0.573 3.786 -18.258 1.00 0.00 H new ATOM 310 N ASN A 24 -2.974 8.749 -12.905 1.00 0.00 N ATOM 311 CA ASN A 24 -3.089 10.048 -12.253 1.00 0.00 C ATOM 312 C ASN A 24 -4.134 10.009 -11.142 1.00 0.00 C ATOM 313 O ASN A 24 -5.002 10.876 -11.041 1.00 0.00 O ATOM 314 CB ASN A 24 -3.457 11.125 -13.276 1.00 0.00 C ATOM 315 CG ASN A 24 -2.284 11.511 -14.156 1.00 0.00 C ATOM 316 OD1 ASN A 24 -2.034 10.886 -15.186 1.00 0.00 O ATOM 317 ND2 ASN A 24 -1.558 12.547 -13.752 1.00 0.00 N ATOM 0 H ASN A 24 -2.015 8.445 -13.074 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.123 10.291 -11.811 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.274 10.764 -13.901 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.822 12.009 -12.753 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -0.756 12.854 -14.303 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.802 13.036 -12.891 1.00 0.00 H new ATOM 324 N PRO A 25 -4.049 8.979 -10.287 1.00 0.00 N ATOM 325 CA PRO A 25 -4.978 8.801 -9.167 1.00 0.00 C ATOM 326 C PRO A 25 -4.779 9.849 -8.077 1.00 0.00 C ATOM 327 O PRO A 25 -3.656 10.223 -7.739 1.00 0.00 O ATOM 328 CB PRO A 25 -4.634 7.407 -8.637 1.00 0.00 C ATOM 329 CG PRO A 25 -3.215 7.190 -9.038 1.00 0.00 C ATOM 330 CD PRO A 25 -3.040 7.908 -10.347 1.00 0.00 C ATOM 0 HA PRO A 25 -6.017 8.908 -9.479 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.752 7.354 -7.555 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.288 6.648 -9.066 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.532 7.581 -8.284 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.998 6.127 -9.144 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -2.033 8.311 -10.453 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.209 7.244 -11.195 1.00 0.00 H new ATOM 338 N PRO A 26 -5.894 10.336 -7.512 1.00 0.00 N ATOM 339 CA PRO A 26 -5.868 11.347 -6.451 1.00 0.00 C ATOM 340 C PRO A 26 -5.326 10.795 -5.137 1.00 0.00 C ATOM 341 O PRO A 26 -4.993 9.614 -5.039 1.00 0.00 O ATOM 342 CB PRO A 26 -7.339 11.741 -6.300 1.00 0.00 C ATOM 343 CG PRO A 26 -8.101 10.553 -6.777 1.00 0.00 C ATOM 344 CD PRO A 26 -7.267 9.937 -7.866 1.00 0.00 C ATOM 0 HA PRO A 26 -5.213 12.182 -6.700 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.581 11.977 -5.264 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.574 12.626 -6.891 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.268 9.845 -5.965 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -9.082 10.844 -7.153 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.376 8.853 -7.891 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.552 10.309 -8.850 1.00 0.00 H new ATOM 352 N VAL A 27 -5.242 11.656 -4.129 1.00 0.00 N ATOM 353 CA VAL A 27 -4.742 11.254 -2.819 1.00 0.00 C ATOM 354 C VAL A 27 -5.562 11.886 -1.700 1.00 0.00 C ATOM 355 O VAL A 27 -5.929 13.060 -1.753 1.00 0.00 O ATOM 356 CB VAL A 27 -3.262 11.642 -2.640 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.788 11.302 -1.235 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.400 10.950 -3.684 1.00 0.00 C ATOM 0 H VAL A 27 -5.514 12.637 -4.194 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.834 10.169 -2.764 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.167 12.719 -2.780 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.740 11.583 -1.126 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.387 11.848 -0.507 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.896 10.231 -1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.358 11.236 -3.543 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.498 9.870 -3.578 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.726 11.248 -4.681 1.00 0.00 H new ATOM 368 N PRO A 28 -5.856 11.091 -0.661 1.00 0.00 N ATOM 369 CA PRO A 28 -5.425 9.692 -0.587 1.00 0.00 C ATOM 370 C PRO A 28 -6.151 8.808 -1.595 1.00 0.00 C ATOM 371 O PRO A 28 -7.333 9.010 -1.874 1.00 0.00 O ATOM 372 CB PRO A 28 -5.789 9.283 0.843 1.00 0.00 C ATOM 373 CG PRO A 28 -6.903 10.195 1.225 1.00 0.00 C ATOM 374 CD PRO A 28 -6.633 11.497 0.523 1.00 0.00 C ATOM 0 HA PRO A 28 -4.366 9.579 -0.820 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.098 8.239 0.890 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.938 9.394 1.515 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -7.866 9.782 0.924 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -6.940 10.335 2.305 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.558 12.002 0.243 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -6.072 12.186 1.155 1.00 0.00 H new ATOM 382 N TYR A 29 -5.437 7.828 -2.137 1.00 0.00 N ATOM 383 CA TYR A 29 -6.014 6.913 -3.116 1.00 0.00 C ATOM 384 C TYR A 29 -6.511 5.638 -2.443 1.00 0.00 C ATOM 385 O TYR A 29 -5.723 4.854 -1.914 1.00 0.00 O ATOM 386 CB TYR A 29 -4.982 6.568 -4.192 1.00 0.00 C ATOM 387 CG TYR A 29 -5.316 5.315 -4.970 1.00 0.00 C ATOM 388 CD1 TYR A 29 -4.966 4.060 -4.487 1.00 0.00 C ATOM 389 CD2 TYR A 29 -5.979 5.386 -6.189 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.268 2.912 -5.195 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.286 4.244 -6.903 1.00 0.00 C ATOM 392 CZ TYR A 29 -5.929 3.010 -6.402 1.00 0.00 C ATOM 393 OH TYR A 29 -6.232 1.870 -7.110 1.00 0.00 O ATOM 0 H TYR A 29 -4.458 7.646 -1.916 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.864 7.409 -3.584 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.898 7.405 -4.885 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.006 6.445 -3.722 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.449 3.980 -3.542 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.259 6.351 -6.585 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -4.988 1.944 -4.806 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.803 4.317 -7.848 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.199 1.712 -7.077 1.00 0.00 H new ATOM 403 N PHE A 30 -7.824 5.436 -2.469 1.00 0.00 N ATOM 404 CA PHE A 30 -8.428 4.256 -1.862 1.00 0.00 C ATOM 405 C PHE A 30 -8.694 3.180 -2.911 1.00 0.00 C ATOM 406 O PHE A 30 -9.624 3.291 -3.708 1.00 0.00 O ATOM 407 CB PHE A 30 -9.734 4.631 -1.157 1.00 0.00 C ATOM 408 CG PHE A 30 -9.528 5.391 0.122 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.279 4.721 1.309 1.00 0.00 C ATOM 410 CD2 PHE A 30 -9.582 6.775 0.136 1.00 0.00 C ATOM 411 CE1 PHE A 30 -9.090 5.419 2.487 1.00 0.00 C ATOM 412 CE2 PHE A 30 -9.393 7.478 1.312 1.00 0.00 C ATOM 413 CZ PHE A 30 -9.146 6.799 2.488 1.00 0.00 C ATOM 0 H PHE A 30 -8.490 6.074 -2.904 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.728 3.857 -1.128 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.343 5.231 -1.833 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.296 3.722 -0.944 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.232 3.642 1.314 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.774 7.311 -0.782 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.899 4.885 3.406 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.439 8.557 1.310 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.997 7.346 3.407 1.00 0.00 H new ATOM 423 N GLY A 31 -7.868 2.138 -2.904 1.00 0.00 N ATOM 424 CA GLY A 31 -8.029 1.057 -3.859 1.00 0.00 C ATOM 425 C GLY A 31 -8.290 -0.276 -3.187 1.00 0.00 C ATOM 426 O GLY A 31 -7.383 -0.875 -2.607 1.00 0.00 O ATOM 0 H GLY A 31 -7.090 2.023 -2.254 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.855 1.290 -4.531 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.131 0.982 -4.472 1.00 0.00 H new ATOM 430 N ARG A 32 -9.532 -0.742 -3.263 1.00 0.00 N ATOM 431 CA ARG A 32 -9.910 -2.012 -2.654 1.00 0.00 C ATOM 432 C ARG A 32 -9.451 -3.185 -3.515 1.00 0.00 C ATOM 433 O ARG A 32 -9.726 -3.235 -4.714 1.00 0.00 O ATOM 434 CB ARG A 32 -11.426 -2.075 -2.454 1.00 0.00 C ATOM 435 CG ARG A 32 -12.174 -2.649 -3.646 1.00 0.00 C ATOM 436 CD ARG A 32 -12.225 -4.168 -3.592 1.00 0.00 C ATOM 437 NE ARG A 32 -13.437 -4.697 -4.211 1.00 0.00 N ATOM 438 CZ ARG A 32 -13.896 -5.926 -3.997 1.00 0.00 C ATOM 439 NH1 ARG A 32 -13.246 -6.747 -3.184 1.00 0.00 N ATOM 440 NH2 ARG A 32 -15.006 -6.334 -4.597 1.00 0.00 N ATOM 0 H ARG A 32 -10.294 -0.260 -3.740 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.419 -2.081 -1.683 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.643 -2.680 -1.574 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -11.799 -1.071 -2.251 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.188 -2.250 -3.667 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -11.688 -2.333 -4.569 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -11.351 -4.578 -4.098 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -12.176 -4.496 -2.554 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.960 -4.090 -4.842 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -12.392 -6.436 -2.721 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -13.600 -7.690 -3.021 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.508 -5.705 -5.223 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.358 -7.277 -4.432 1.00 0.00 H new ATOM 454 N LEU A 33 -8.749 -4.127 -2.895 1.00 0.00 N ATOM 455 CA LEU A 33 -8.250 -5.301 -3.604 1.00 0.00 C ATOM 456 C LEU A 33 -9.391 -6.250 -3.955 1.00 0.00 C ATOM 457 O LEU A 33 -10.114 -6.719 -3.076 1.00 0.00 O ATOM 458 CB LEU A 33 -7.208 -6.030 -2.754 1.00 0.00 C ATOM 459 CG LEU A 33 -6.100 -5.161 -2.159 1.00 0.00 C ATOM 460 CD1 LEU A 33 -5.579 -5.771 -0.867 1.00 0.00 C ATOM 461 CD2 LEU A 33 -4.968 -4.980 -3.160 1.00 0.00 C ATOM 0 H LEU A 33 -8.512 -4.101 -1.903 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.783 -4.965 -4.530 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.724 -6.535 -1.938 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.746 -6.804 -3.367 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.517 -4.180 -1.931 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.791 -5.139 -0.458 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.393 -5.848 -0.147 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.179 -6.764 -1.069 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.188 -4.359 -2.719 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.553 -5.954 -3.420 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.351 -4.498 -4.059 1.00 0.00 H new ATOM 473 N GLN A 34 -9.545 -6.531 -5.245 1.00 0.00 N ATOM 474 CA GLN A 34 -10.597 -7.426 -5.712 1.00 0.00 C ATOM 475 C GLN A 34 -10.226 -8.882 -5.455 1.00 0.00 C ATOM 476 O GLN A 34 -9.783 -9.590 -6.358 1.00 0.00 O ATOM 477 CB GLN A 34 -10.856 -7.209 -7.204 1.00 0.00 C ATOM 478 CG GLN A 34 -11.573 -5.905 -7.514 1.00 0.00 C ATOM 479 CD GLN A 34 -10.651 -4.704 -7.459 1.00 0.00 C ATOM 480 OE1 GLN A 34 -11.064 -3.672 -6.732 1.00 0.00 O flip ATOM 481 NE2 GLN A 34 -9.578 -4.702 -8.064 1.00 0.00 N flip ATOM 0 H GLN A 34 -8.955 -6.152 -5.985 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.506 -7.198 -5.156 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -9.905 -7.226 -7.736 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.449 -8.040 -7.586 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.022 -5.968 -8.505 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.388 -5.765 -6.804 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -9.299 -5.517 -8.611 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -8.968 -3.886 -8.018 1.00 0.00 H new ATOM 490 N GLY A 35 -10.411 -9.325 -4.215 1.00 0.00 N ATOM 491 CA GLY A 35 -10.091 -10.695 -3.860 1.00 0.00 C ATOM 492 C GLY A 35 -9.419 -10.802 -2.506 1.00 0.00 C ATOM 493 O GLY A 35 -9.799 -11.631 -1.680 1.00 0.00 O ATOM 0 H GLY A 35 -10.777 -8.759 -3.450 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -11.005 -11.289 -3.856 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.437 -11.121 -4.621 1.00 0.00 H new ATOM 497 N GLY A 36 -8.415 -9.960 -2.277 1.00 0.00 N ATOM 498 CA GLY A 36 -7.703 -9.981 -1.012 1.00 0.00 C ATOM 499 C GLY A 36 -6.302 -10.545 -1.145 1.00 0.00 C ATOM 500 O GLY A 36 -5.969 -11.170 -2.152 1.00 0.00 O ATOM 0 H GLY A 36 -8.082 -9.264 -2.945 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.647 -8.968 -0.613 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.264 -10.577 -0.292 1.00 0.00 H new ATOM 504 N LEU A 37 -5.478 -10.322 -0.127 1.00 0.00 N ATOM 505 CA LEU A 37 -4.103 -10.810 -0.135 1.00 0.00 C ATOM 506 C LEU A 37 -4.055 -12.296 -0.476 1.00 0.00 C ATOM 507 O LEU A 37 -4.409 -13.145 0.343 1.00 0.00 O ATOM 508 CB LEU A 37 -3.447 -10.566 1.225 1.00 0.00 C ATOM 509 CG LEU A 37 -3.483 -9.127 1.740 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.848 -9.036 3.118 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.780 -8.194 0.764 1.00 0.00 C ATOM 0 H LEU A 37 -5.738 -9.807 0.714 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.553 -10.262 -0.900 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.934 -11.206 1.961 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.406 -10.883 1.166 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.525 -8.817 1.822 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.883 -8.004 3.467 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.394 -9.673 3.813 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.810 -9.365 3.063 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.815 -7.174 1.146 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.741 -8.503 0.649 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.280 -8.236 -0.204 1.00 0.00 H new ATOM 523 N THR A 38 -3.614 -12.605 -1.692 1.00 0.00 N ATOM 524 CA THR A 38 -3.518 -13.988 -2.142 1.00 0.00 C ATOM 525 C THR A 38 -2.106 -14.316 -2.614 1.00 0.00 C ATOM 526 O THR A 38 -1.448 -13.494 -3.250 1.00 0.00 O ATOM 527 CB THR A 38 -4.510 -14.276 -3.285 1.00 0.00 C ATOM 528 OG1 THR A 38 -4.007 -13.744 -4.515 1.00 0.00 O ATOM 529 CG2 THR A 38 -5.873 -13.672 -2.984 1.00 0.00 C ATOM 0 H THR A 38 -3.318 -11.915 -2.383 1.00 0.00 H new ATOM 0 HA THR A 38 -3.767 -14.617 -1.287 1.00 0.00 H new ATOM 0 HB THR A 38 -4.622 -15.356 -3.376 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.642 -13.933 -5.237 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.556 -13.888 -3.805 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.266 -14.101 -2.062 1.00 0.00 H new ATOM 0 HG23 THR A 38 -5.775 -12.593 -2.868 1.00 0.00 H new ATOM 537 N ALA A 39 -1.648 -15.523 -2.299 1.00 0.00 N ATOM 538 CA ALA A 39 -0.315 -15.960 -2.694 1.00 0.00 C ATOM 539 C ALA A 39 -0.008 -15.558 -4.132 1.00 0.00 C ATOM 540 O ALA A 39 1.151 -15.361 -4.498 1.00 0.00 O ATOM 541 CB ALA A 39 -0.182 -17.467 -2.525 1.00 0.00 C ATOM 0 H ALA A 39 -2.180 -16.215 -1.772 1.00 0.00 H new ATOM 0 HA ALA A 39 0.409 -15.467 -2.045 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.819 -17.780 -2.824 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.349 -17.732 -1.481 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.921 -17.970 -3.149 1.00 0.00 H new ATOM 547 N ARG A 40 -1.054 -15.438 -4.944 1.00 0.00 N ATOM 548 CA ARG A 40 -0.896 -15.060 -6.343 1.00 0.00 C ATOM 549 C ARG A 40 -1.319 -13.611 -6.567 1.00 0.00 C ATOM 550 O ARG A 40 -2.007 -13.298 -7.538 1.00 0.00 O ATOM 551 CB ARG A 40 -1.718 -15.987 -7.239 1.00 0.00 C ATOM 552 CG ARG A 40 -1.317 -17.450 -7.135 1.00 0.00 C ATOM 553 CD ARG A 40 -0.123 -17.764 -8.023 1.00 0.00 C ATOM 554 NE ARG A 40 -0.044 -19.185 -8.351 1.00 0.00 N ATOM 555 CZ ARG A 40 -0.712 -19.747 -9.352 1.00 0.00 C ATOM 556 NH1 ARG A 40 -1.505 -19.011 -10.119 1.00 0.00 N ATOM 557 NH2 ARG A 40 -0.588 -21.047 -9.587 1.00 0.00 N ATOM 0 H ARG A 40 -2.020 -15.597 -4.657 1.00 0.00 H new ATOM 0 HA ARG A 40 0.158 -15.156 -6.602 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.772 -15.889 -6.979 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.614 -15.663 -8.275 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.075 -17.689 -6.100 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -2.159 -18.081 -7.419 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -0.192 -17.183 -8.943 1.00 0.00 H new ATOM 0 HD3 ARG A 40 0.794 -17.456 -7.520 1.00 0.00 H new ATOM 0 HE ARG A 40 0.557 -19.779 -7.780 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -1.603 -18.011 -9.941 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -2.017 -19.444 -10.887 1.00 0.00 H new ATOM 0 HH21 ARG A 40 0.021 -21.616 -8.999 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -1.102 -21.478 -10.356 1.00 0.00 H new ATOM 571 N ARG A 41 -0.904 -12.732 -5.660 1.00 0.00 N ATOM 572 CA ARG A 41 -1.242 -11.317 -5.758 1.00 0.00 C ATOM 573 C ARG A 41 0.003 -10.449 -5.597 1.00 0.00 C ATOM 574 O ARG A 41 0.869 -10.732 -4.769 1.00 0.00 O ATOM 575 CB ARG A 41 -2.277 -10.944 -4.695 1.00 0.00 C ATOM 576 CG ARG A 41 -3.164 -9.775 -5.093 1.00 0.00 C ATOM 577 CD ARG A 41 -4.185 -9.458 -4.012 1.00 0.00 C ATOM 578 NE ARG A 41 -5.425 -8.924 -4.570 1.00 0.00 N ATOM 579 CZ ARG A 41 -6.255 -9.633 -5.328 1.00 0.00 C ATOM 580 NH1 ARG A 41 -5.979 -10.898 -5.615 1.00 0.00 N ATOM 581 NH2 ARG A 41 -7.364 -9.077 -5.799 1.00 0.00 N ATOM 0 H ARG A 41 -0.334 -12.975 -4.850 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.665 -11.137 -6.746 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -2.904 -11.812 -4.490 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.760 -10.698 -3.767 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.547 -8.896 -5.281 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -3.679 -10.008 -6.025 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.403 -10.362 -3.443 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.761 -8.736 -3.314 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.667 -7.954 -4.367 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -5.128 -11.329 -5.254 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -6.618 -11.440 -6.197 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -7.580 -8.105 -5.579 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -8.000 -9.622 -6.381 1.00 0.00 H new ATOM 595 N THR A 42 0.086 -9.390 -6.397 1.00 0.00 N ATOM 596 CA THR A 42 1.225 -8.482 -6.345 1.00 0.00 C ATOM 597 C THR A 42 0.777 -7.031 -6.486 1.00 0.00 C ATOM 598 O THR A 42 0.155 -6.658 -7.481 1.00 0.00 O ATOM 599 CB THR A 42 2.249 -8.801 -7.450 1.00 0.00 C ATOM 600 OG1 THR A 42 2.751 -10.132 -7.283 1.00 0.00 O ATOM 601 CG2 THR A 42 3.403 -7.811 -7.421 1.00 0.00 C ATOM 0 H THR A 42 -0.622 -9.140 -7.088 1.00 0.00 H new ATOM 0 HA THR A 42 1.697 -8.621 -5.372 1.00 0.00 H new ATOM 0 HB THR A 42 1.747 -8.721 -8.414 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.400 -10.328 -7.990 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.113 -8.057 -8.211 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.021 -6.802 -7.578 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.903 -7.863 -6.454 1.00 0.00 H new ATOM 609 N ILE A 43 1.099 -6.218 -5.486 1.00 0.00 N ATOM 610 CA ILE A 43 0.731 -4.807 -5.501 1.00 0.00 C ATOM 611 C ILE A 43 1.833 -3.958 -6.125 1.00 0.00 C ATOM 612 O ILE A 43 3.009 -4.105 -5.789 1.00 0.00 O ATOM 613 CB ILE A 43 0.439 -4.287 -4.081 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.701 -5.085 -3.446 1.00 0.00 C ATOM 615 CG2 ILE A 43 0.098 -2.805 -4.121 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.254 -6.390 -2.827 1.00 0.00 C ATOM 0 H ILE A 43 1.614 -6.511 -4.656 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.174 -4.723 -6.103 1.00 0.00 H new ATOM 0 HB ILE A 43 1.332 -4.419 -3.470 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.179 -4.474 -2.680 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.455 -5.292 -4.205 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.106 -2.451 -3.110 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.938 -2.249 -4.537 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.783 -2.651 -4.744 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.114 -6.902 -2.396 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.197 -7.020 -3.593 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.478 -6.190 -2.045 1.00 0.00 H new ATOM 628 N ILE A 44 1.445 -3.070 -7.034 1.00 0.00 N ATOM 629 CA ILE A 44 2.400 -2.196 -7.703 1.00 0.00 C ATOM 630 C ILE A 44 2.008 -0.731 -7.545 1.00 0.00 C ATOM 631 O ILE A 44 0.953 -0.306 -8.018 1.00 0.00 O ATOM 632 CB ILE A 44 2.513 -2.527 -9.203 1.00 0.00 C ATOM 633 CG1 ILE A 44 3.182 -3.889 -9.398 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.290 -1.439 -9.929 1.00 0.00 C ATOM 635 CD1 ILE A 44 3.028 -4.443 -10.797 1.00 0.00 C ATOM 0 H ILE A 44 0.476 -2.937 -7.324 1.00 0.00 H new ATOM 0 HA ILE A 44 3.367 -2.364 -7.229 1.00 0.00 H new ATOM 0 HB ILE A 44 1.510 -2.573 -9.627 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.243 -3.800 -9.166 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.759 -4.598 -8.687 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.361 -1.688 -10.988 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.775 -0.485 -9.814 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.292 -1.363 -9.506 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.527 -5.410 -10.862 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.969 -4.564 -11.026 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.477 -3.754 -11.513 1.00 0.00 H new ATOM 647 N ILE A 45 2.864 0.037 -6.880 1.00 0.00 N ATOM 648 CA ILE A 45 2.608 1.456 -6.662 1.00 0.00 C ATOM 649 C ILE A 45 3.682 2.315 -7.321 1.00 0.00 C ATOM 650 O ILE A 45 4.818 2.377 -6.852 1.00 0.00 O ATOM 651 CB ILE A 45 2.546 1.793 -5.161 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.375 1.063 -4.500 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.422 3.296 -4.961 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.550 0.863 -3.011 1.00 0.00 C ATOM 0 H ILE A 45 3.741 -0.299 -6.483 1.00 0.00 H new ATOM 0 HA ILE A 45 1.641 1.676 -7.115 1.00 0.00 H new ATOM 0 HB ILE A 45 3.470 1.458 -4.690 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.459 1.627 -4.677 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.248 0.091 -4.976 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.379 3.519 -3.895 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.286 3.794 -5.402 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.512 3.653 -5.443 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.682 0.339 -2.610 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.448 0.273 -2.826 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.646 1.833 -2.523 1.00 0.00 H new ATOM 666 N LYS A 46 3.314 2.979 -8.411 1.00 0.00 N ATOM 667 CA LYS A 46 4.243 3.839 -9.135 1.00 0.00 C ATOM 668 C LYS A 46 3.853 5.306 -8.989 1.00 0.00 C ATOM 669 O LYS A 46 2.823 5.738 -9.505 1.00 0.00 O ATOM 670 CB LYS A 46 4.279 3.454 -10.615 1.00 0.00 C ATOM 671 CG LYS A 46 5.330 2.409 -10.947 1.00 0.00 C ATOM 672 CD LYS A 46 5.088 1.787 -12.312 1.00 0.00 C ATOM 673 CE LYS A 46 4.194 0.561 -12.215 1.00 0.00 C ATOM 674 NZ LYS A 46 4.047 -0.123 -13.530 1.00 0.00 N ATOM 0 H LYS A 46 2.378 2.938 -8.813 1.00 0.00 H new ATOM 0 HA LYS A 46 5.236 3.701 -8.706 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.299 3.077 -10.907 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.467 4.348 -11.210 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.319 2.867 -10.925 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.323 1.630 -10.185 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.628 2.523 -12.972 1.00 0.00 H new ATOM 0 HD3 LYS A 46 6.042 1.509 -12.760 1.00 0.00 H new ATOM 0 HE2 LYS A 46 4.611 -0.136 -11.488 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.211 0.856 -11.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 3.431 -0.954 -13.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 3.626 0.534 -14.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 4.982 -0.427 -13.869 1.00 0.00 H new ATOM 688 N GLY A 47 4.684 6.068 -8.285 1.00 0.00 N ATOM 689 CA GLY A 47 4.408 7.479 -8.086 1.00 0.00 C ATOM 690 C GLY A 47 5.670 8.319 -8.062 1.00 0.00 C ATOM 691 O GLY A 47 6.619 8.047 -8.798 1.00 0.00 O ATOM 0 H GLY A 47 5.543 5.734 -7.849 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.754 7.834 -8.883 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.869 7.612 -7.148 1.00 0.00 H new ATOM 695 N TYR A 48 5.682 9.342 -7.216 1.00 0.00 N ATOM 696 CA TYR A 48 6.835 10.227 -7.102 1.00 0.00 C ATOM 697 C TYR A 48 6.704 11.140 -5.887 1.00 0.00 C ATOM 698 O TYR A 48 5.701 11.835 -5.723 1.00 0.00 O ATOM 699 CB TYR A 48 6.987 11.067 -8.371 1.00 0.00 C ATOM 700 CG TYR A 48 7.606 12.425 -8.128 1.00 0.00 C ATOM 701 CD1 TYR A 48 6.826 13.504 -7.727 1.00 0.00 C ATOM 702 CD2 TYR A 48 8.969 12.631 -8.300 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.386 14.747 -7.504 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.538 13.870 -8.078 1.00 0.00 C ATOM 705 CZ TYR A 48 8.743 14.924 -7.680 1.00 0.00 C ATOM 706 OH TYR A 48 9.306 16.161 -7.460 1.00 0.00 O ATOM 0 H TYR A 48 4.906 9.579 -6.598 1.00 0.00 H new ATOM 0 HA TYR A 48 7.724 9.609 -6.975 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.601 10.520 -9.087 1.00 0.00 H new ATOM 0 HB3 TYR A 48 6.006 11.201 -8.828 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.764 13.368 -7.587 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.595 11.808 -8.613 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.766 15.575 -7.194 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.600 14.012 -8.215 1.00 0.00 H new ATOM 0 HH TYR A 48 9.864 16.407 -8.227 1.00 0.00 H new ATOM 716 N VAL A 49 7.726 11.134 -5.037 1.00 0.00 N ATOM 717 CA VAL A 49 7.727 11.962 -3.837 1.00 0.00 C ATOM 718 C VAL A 49 8.011 13.421 -4.176 1.00 0.00 C ATOM 719 O VAL A 49 9.081 13.772 -4.673 1.00 0.00 O ATOM 720 CB VAL A 49 8.772 11.471 -2.817 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.626 12.218 -1.500 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.645 9.970 -2.605 1.00 0.00 C ATOM 0 H VAL A 49 8.564 10.565 -5.157 1.00 0.00 H new ATOM 0 HA VAL A 49 6.733 11.881 -3.396 1.00 0.00 H new ATOM 0 HB VAL A 49 9.766 11.676 -3.215 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.373 11.857 -0.792 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.772 13.285 -1.669 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.629 12.048 -1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.391 9.640 -1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.648 9.739 -2.230 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.805 9.454 -3.552 1.00 0.00 H new ATOM 732 N PRO A 50 7.030 14.293 -3.901 1.00 0.00 N ATOM 733 CA PRO A 50 7.151 15.730 -4.169 1.00 0.00 C ATOM 734 C PRO A 50 8.150 16.410 -3.239 1.00 0.00 C ATOM 735 O PRO A 50 8.452 15.923 -2.150 1.00 0.00 O ATOM 736 CB PRO A 50 5.737 16.258 -3.913 1.00 0.00 C ATOM 737 CG PRO A 50 5.134 15.283 -2.961 1.00 0.00 C ATOM 738 CD PRO A 50 5.728 13.945 -3.308 1.00 0.00 C ATOM 0 HA PRO A 50 7.519 15.928 -5.176 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.760 17.262 -3.489 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.163 16.315 -4.838 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.359 15.554 -1.930 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.048 15.265 -3.056 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.844 13.316 -2.426 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.100 13.397 -4.010 1.00 0.00 H new ATOM 746 N PRO A 51 8.676 17.564 -3.677 1.00 0.00 N ATOM 747 CA PRO A 51 9.649 18.336 -2.899 1.00 0.00 C ATOM 748 C PRO A 51 9.025 18.976 -1.663 1.00 0.00 C ATOM 749 O PRO A 51 9.730 19.393 -0.744 1.00 0.00 O ATOM 750 CB PRO A 51 10.114 19.413 -3.882 1.00 0.00 C ATOM 751 CG PRO A 51 8.984 19.566 -4.840 1.00 0.00 C ATOM 752 CD PRO A 51 8.361 18.203 -4.966 1.00 0.00 C ATOM 0 HA PRO A 51 10.456 17.710 -2.518 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.328 20.351 -3.369 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.029 19.114 -4.394 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.259 20.294 -4.476 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.338 19.924 -5.807 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.285 18.266 -5.131 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.780 17.646 -5.804 1.00 0.00 H new ATOM 760 N THR A 52 7.698 19.052 -1.647 1.00 0.00 N ATOM 761 CA THR A 52 6.979 19.642 -0.525 1.00 0.00 C ATOM 762 C THR A 52 6.206 18.582 0.251 1.00 0.00 C ATOM 763 O THR A 52 5.273 18.896 0.989 1.00 0.00 O ATOM 764 CB THR A 52 5.999 20.733 -0.997 1.00 0.00 C ATOM 765 OG1 THR A 52 5.062 20.180 -1.928 1.00 0.00 O ATOM 766 CG2 THR A 52 6.747 21.887 -1.647 1.00 0.00 C ATOM 0 H THR A 52 7.099 18.712 -2.399 1.00 0.00 H new ATOM 0 HA THR A 52 7.727 20.093 0.127 1.00 0.00 H new ATOM 0 HB THR A 52 5.464 21.112 -0.126 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.441 20.879 -2.222 1.00 0.00 H new ATOM 0 HG21 THR A 52 6.035 22.645 -1.972 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.438 22.324 -0.927 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.305 21.520 -2.508 1.00 0.00 H new ATOM 774 N GLY A 53 6.602 17.324 0.081 1.00 0.00 N ATOM 775 CA GLY A 53 5.936 16.236 0.774 1.00 0.00 C ATOM 776 C GLY A 53 6.819 15.589 1.822 1.00 0.00 C ATOM 777 O GLY A 53 7.857 15.011 1.499 1.00 0.00 O ATOM 0 H GLY A 53 7.372 17.039 -0.524 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.030 16.613 1.249 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.627 15.483 0.049 1.00 0.00 H new ATOM 781 N LYS A 54 6.408 15.686 3.082 1.00 0.00 N ATOM 782 CA LYS A 54 7.168 15.106 4.182 1.00 0.00 C ATOM 783 C LYS A 54 7.329 13.601 3.998 1.00 0.00 C ATOM 784 O LYS A 54 8.447 13.095 3.896 1.00 0.00 O ATOM 785 CB LYS A 54 6.476 15.396 5.516 1.00 0.00 C ATOM 786 CG LYS A 54 6.272 16.877 5.786 1.00 0.00 C ATOM 787 CD LYS A 54 6.185 17.165 7.276 1.00 0.00 C ATOM 788 CE LYS A 54 7.550 17.079 7.941 1.00 0.00 C ATOM 789 NZ LYS A 54 8.418 18.233 7.577 1.00 0.00 N ATOM 0 H LYS A 54 5.552 16.162 3.366 1.00 0.00 H new ATOM 0 HA LYS A 54 8.158 15.562 4.186 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.508 14.896 5.530 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.068 14.966 6.324 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.096 17.444 5.352 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.359 17.215 5.295 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.765 18.159 7.432 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.505 16.455 7.746 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.425 17.046 9.023 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.039 16.150 7.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 9.243 18.259 8.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 8.738 18.130 6.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.879 19.117 7.674 1.00 0.00 H new ATOM 803 N SER A 55 6.207 12.891 3.954 1.00 0.00 N ATOM 804 CA SER A 55 6.224 11.443 3.784 1.00 0.00 C ATOM 805 C SER A 55 4.809 10.898 3.621 1.00 0.00 C ATOM 806 O SER A 55 3.836 11.528 4.036 1.00 0.00 O ATOM 807 CB SER A 55 6.904 10.776 4.982 1.00 0.00 C ATOM 808 OG SER A 55 6.358 11.241 6.203 1.00 0.00 O ATOM 0 H SER A 55 5.274 13.295 4.034 1.00 0.00 H new ATOM 0 HA SER A 55 6.789 11.215 2.880 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.785 9.695 4.916 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.974 10.981 4.957 1.00 0.00 H new ATOM 0 HG SER A 55 6.808 10.798 6.952 1.00 0.00 H new ATOM 814 N PHE A 56 4.701 9.721 3.012 1.00 0.00 N ATOM 815 CA PHE A 56 3.405 9.090 2.792 1.00 0.00 C ATOM 816 C PHE A 56 3.268 7.822 3.629 1.00 0.00 C ATOM 817 O PHE A 56 4.125 7.517 4.458 1.00 0.00 O ATOM 818 CB PHE A 56 3.221 8.759 1.309 1.00 0.00 C ATOM 819 CG PHE A 56 4.338 7.934 0.736 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.598 8.482 0.555 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.128 6.612 0.379 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.628 7.726 0.028 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.155 5.851 -0.148 1.00 0.00 C ATOM 824 CZ PHE A 56 6.406 6.409 -0.325 1.00 0.00 C ATOM 0 H PHE A 56 5.496 9.185 2.662 1.00 0.00 H new ATOM 0 HA PHE A 56 2.630 9.792 3.100 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.281 8.224 1.178 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.140 9.688 0.745 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.777 9.511 0.829 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.151 6.171 0.514 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.606 8.164 -0.108 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.979 4.821 -0.421 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.209 5.817 -0.739 1.00 0.00 H new ATOM 834 N ALA A 57 2.184 7.086 3.405 1.00 0.00 N ATOM 835 CA ALA A 57 1.935 5.850 4.137 1.00 0.00 C ATOM 836 C ALA A 57 1.036 4.912 3.340 1.00 0.00 C ATOM 837 O ALA A 57 0.143 5.357 2.618 1.00 0.00 O ATOM 838 CB ALA A 57 1.313 6.156 5.492 1.00 0.00 C ATOM 0 H ALA A 57 1.464 7.324 2.723 1.00 0.00 H new ATOM 0 HA ALA A 57 2.891 5.350 4.293 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.132 5.224 6.028 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.992 6.782 6.071 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.369 6.681 5.349 1.00 0.00 H new ATOM 844 N ILE A 58 1.278 3.612 3.474 1.00 0.00 N ATOM 845 CA ILE A 58 0.489 2.612 2.765 1.00 0.00 C ATOM 846 C ILE A 58 -0.097 1.589 3.732 1.00 0.00 C ATOM 847 O ILE A 58 0.587 0.661 4.161 1.00 0.00 O ATOM 848 CB ILE A 58 1.332 1.877 1.707 1.00 0.00 C ATOM 849 CG1 ILE A 58 2.213 2.870 0.945 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.430 1.117 0.746 1.00 0.00 C ATOM 851 CD1 ILE A 58 3.561 3.100 1.592 1.00 0.00 C ATOM 0 H ILE A 58 2.014 3.227 4.067 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.321 3.144 2.267 1.00 0.00 H new ATOM 0 HB ILE A 58 1.978 1.160 2.213 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.364 2.505 -0.071 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.689 3.823 0.867 1.00 0.00 H new ATOM 0 HG21 ILE A 58 1.040 0.603 0.004 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.159 0.387 1.301 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.238 1.817 0.244 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.132 3.814 0.999 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.419 3.495 2.598 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.104 2.157 1.646 1.00 0.00 H new ATOM 863 N ASN A 59 -1.371 1.765 4.070 1.00 0.00 N ATOM 864 CA ASN A 59 -2.051 0.855 4.986 1.00 0.00 C ATOM 865 C ASN A 59 -2.946 -0.116 4.223 1.00 0.00 C ATOM 866 O ASN A 59 -3.544 0.241 3.208 1.00 0.00 O ATOM 867 CB ASN A 59 -2.883 1.646 5.998 1.00 0.00 C ATOM 868 CG ASN A 59 -2.025 2.507 6.905 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.696 2.113 8.024 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.658 3.689 6.424 1.00 0.00 N ATOM 0 H ASN A 59 -1.953 2.528 3.724 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.293 0.280 5.518 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.592 2.279 5.465 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.467 0.954 6.605 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -1.080 4.312 6.988 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.954 3.974 5.491 1.00 0.00 H new ATOM 877 N PHE A 60 -3.033 -1.346 4.720 1.00 0.00 N ATOM 878 CA PHE A 60 -3.855 -2.370 4.085 1.00 0.00 C ATOM 879 C PHE A 60 -4.965 -2.835 5.023 1.00 0.00 C ATOM 880 O PHE A 60 -4.737 -3.650 5.918 1.00 0.00 O ATOM 881 CB PHE A 60 -2.991 -3.562 3.668 1.00 0.00 C ATOM 882 CG PHE A 60 -2.040 -3.250 2.549 1.00 0.00 C ATOM 883 CD1 PHE A 60 -0.931 -2.448 2.767 1.00 0.00 C ATOM 884 CD2 PHE A 60 -2.253 -3.759 1.278 1.00 0.00 C ATOM 885 CE1 PHE A 60 -0.054 -2.159 1.738 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.380 -3.474 0.245 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.279 -2.674 0.476 1.00 0.00 C ATOM 0 H PHE A 60 -2.545 -1.657 5.560 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.313 -1.934 3.197 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.423 -3.908 4.531 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.641 -4.383 3.364 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.750 -2.044 3.752 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.112 -4.386 1.092 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.806 -1.531 1.921 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.559 -3.876 -0.741 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.406 -2.451 -0.329 1.00 0.00 H new ATOM 897 N LYS A 61 -6.168 -2.311 4.813 1.00 0.00 N ATOM 898 CA LYS A 61 -7.315 -2.672 5.637 1.00 0.00 C ATOM 899 C LYS A 61 -8.131 -3.780 4.980 1.00 0.00 C ATOM 900 O LYS A 61 -7.930 -4.101 3.808 1.00 0.00 O ATOM 901 CB LYS A 61 -8.200 -1.447 5.880 1.00 0.00 C ATOM 902 CG LYS A 61 -9.365 -1.715 6.817 1.00 0.00 C ATOM 903 CD LYS A 61 -10.075 -0.428 7.204 1.00 0.00 C ATOM 904 CE LYS A 61 -9.321 0.320 8.292 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.955 1.629 8.607 1.00 0.00 N ATOM 0 H LYS A 61 -6.374 -1.634 4.078 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.942 -3.039 6.593 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.589 -0.644 6.293 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.587 -1.093 4.924 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -10.072 -2.392 6.336 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -9.004 -2.217 7.715 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -10.177 0.210 6.326 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.083 -0.657 7.550 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.283 -0.291 9.194 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.291 0.483 7.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.411 2.108 9.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.968 2.223 7.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.929 1.473 8.935 1.00 0.00 H new ATOM 919 N VAL A 62 -9.054 -4.360 5.740 1.00 0.00 N ATOM 920 CA VAL A 62 -9.903 -5.430 5.230 1.00 0.00 C ATOM 921 C VAL A 62 -11.275 -4.900 4.830 1.00 0.00 C ATOM 922 O VAL A 62 -11.984 -4.307 5.641 1.00 0.00 O ATOM 923 CB VAL A 62 -10.081 -6.550 6.273 1.00 0.00 C ATOM 924 CG1 VAL A 62 -10.815 -7.735 5.663 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.733 -6.977 6.832 1.00 0.00 C ATOM 0 H VAL A 62 -9.233 -4.107 6.712 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.404 -5.838 4.351 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.683 -6.165 7.096 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.932 -8.516 6.414 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.798 -7.415 5.316 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.242 -8.124 4.821 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.878 -7.769 7.567 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.103 -7.345 6.022 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.250 -6.124 7.308 1.00 0.00 H new ATOM 935 N GLY A 63 -11.643 -5.119 3.571 1.00 0.00 N ATOM 936 CA GLY A 63 -12.930 -4.657 3.084 1.00 0.00 C ATOM 937 C GLY A 63 -14.089 -5.226 3.879 1.00 0.00 C ATOM 938 O GLY A 63 -15.106 -4.559 4.070 1.00 0.00 O ATOM 0 H GLY A 63 -11.073 -5.608 2.880 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.962 -3.568 3.129 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.040 -4.936 2.036 1.00 0.00 H new ATOM 942 N SER A 64 -13.937 -6.462 4.342 1.00 0.00 N ATOM 943 CA SER A 64 -14.982 -7.123 5.115 1.00 0.00 C ATOM 944 C SER A 64 -15.120 -6.487 6.495 1.00 0.00 C ATOM 945 O SER A 64 -16.064 -5.741 6.755 1.00 0.00 O ATOM 946 CB SER A 64 -14.674 -8.615 5.258 1.00 0.00 C ATOM 947 OG SER A 64 -14.914 -9.303 4.043 1.00 0.00 O ATOM 0 H SER A 64 -13.100 -7.026 4.195 1.00 0.00 H new ATOM 0 HA SER A 64 -15.925 -7.003 4.582 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.634 -8.748 5.556 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.289 -9.043 6.050 1.00 0.00 H new ATOM 0 HG SER A 64 -14.708 -10.254 4.159 1.00 0.00 H new ATOM 953 N SER A 65 -14.172 -6.788 7.377 1.00 0.00 N ATOM 954 CA SER A 65 -14.189 -6.249 8.732 1.00 0.00 C ATOM 955 C SER A 65 -13.708 -4.801 8.747 1.00 0.00 C ATOM 956 O SER A 65 -14.495 -3.876 8.941 1.00 0.00 O ATOM 957 CB SER A 65 -13.311 -7.100 9.652 1.00 0.00 C ATOM 958 OG SER A 65 -13.415 -6.668 10.998 1.00 0.00 O ATOM 0 H SER A 65 -13.383 -7.402 7.177 1.00 0.00 H new ATOM 0 HA SER A 65 -15.216 -6.276 9.095 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.608 -8.146 9.578 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.272 -7.040 9.327 1.00 0.00 H new ATOM 0 HG SER A 65 -12.577 -6.860 11.469 1.00 0.00 H new ATOM 964 N GLY A 66 -12.408 -4.614 8.541 1.00 0.00 N ATOM 965 CA GLY A 66 -11.843 -3.277 8.534 1.00 0.00 C ATOM 966 C GLY A 66 -10.634 -3.154 9.441 1.00 0.00 C ATOM 967 O GLY A 66 -10.499 -2.176 10.176 1.00 0.00 O ATOM 0 H GLY A 66 -11.736 -5.364 8.379 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.558 -3.012 7.516 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.604 -2.563 8.849 1.00 0.00 H new ATOM 971 N ASP A 67 -9.755 -4.149 9.390 1.00 0.00 N ATOM 972 CA ASP A 67 -8.552 -4.148 10.214 1.00 0.00 C ATOM 973 C ASP A 67 -7.301 -4.030 9.349 1.00 0.00 C ATOM 974 O ASP A 67 -7.230 -4.604 8.262 1.00 0.00 O ATOM 975 CB ASP A 67 -8.485 -5.422 11.058 1.00 0.00 C ATOM 976 CG ASP A 67 -9.856 -5.899 11.497 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.660 -5.057 11.951 1.00 0.00 O ATOM 978 OD2 ASP A 67 -10.125 -7.113 11.385 1.00 0.00 O ATOM 0 H ASP A 67 -9.853 -4.966 8.787 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.596 -3.284 10.877 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.996 -6.209 10.484 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.868 -5.239 11.938 1.00 0.00 H new ATOM 983 N ILE A 68 -6.318 -3.282 9.838 1.00 0.00 N ATOM 984 CA ILE A 68 -5.071 -3.089 9.109 1.00 0.00 C ATOM 985 C ILE A 68 -4.075 -4.201 9.420 1.00 0.00 C ATOM 986 O ILE A 68 -3.664 -4.379 10.566 1.00 0.00 O ATOM 987 CB ILE A 68 -4.427 -1.731 9.445 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.430 -0.597 9.221 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.178 -1.514 8.604 1.00 0.00 C ATOM 990 CD1 ILE A 68 -5.020 0.709 9.866 1.00 0.00 C ATOM 0 H ILE A 68 -6.361 -2.800 10.736 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.319 -3.112 8.048 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.138 -1.733 10.496 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.555 -0.440 8.150 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.401 -0.898 9.615 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.735 -0.550 8.853 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.459 -2.308 8.808 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.444 -1.529 7.547 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.777 1.467 9.666 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.923 0.568 10.942 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.064 1.034 9.455 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.689 -4.947 8.389 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.738 -6.040 8.551 1.00 0.00 C ATOM 1004 C ALA A 69 -1.309 -5.563 8.317 1.00 0.00 C ATOM 1005 O ALA A 69 -0.363 -6.096 8.898 1.00 0.00 O ATOM 1006 CB ALA A 69 -3.079 -7.180 7.602 1.00 0.00 C ATOM 0 H ALA A 69 -4.020 -4.814 7.434 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.808 -6.402 9.577 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.361 -7.990 7.733 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.083 -7.546 7.819 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.038 -6.822 6.573 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.159 -4.557 7.462 1.00 0.00 N ATOM 1013 CA LEU A 70 0.157 -4.008 7.150 1.00 0.00 C ATOM 1014 C LEU A 70 0.090 -2.493 6.988 1.00 0.00 C ATOM 1015 O LEU A 70 -0.749 -1.973 6.252 1.00 0.00 O ATOM 1016 CB LEU A 70 0.707 -4.646 5.873 1.00 0.00 C ATOM 1017 CG LEU A 70 2.006 -4.048 5.331 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.134 -4.221 6.337 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.373 -4.688 4.000 1.00 0.00 C ATOM 0 H LEU A 70 -1.931 -4.105 6.973 1.00 0.00 H new ATOM 0 HA LEU A 70 0.826 -4.236 7.980 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.870 -5.707 6.062 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.055 -4.573 5.097 1.00 0.00 H new ATOM 0 HG LEU A 70 1.852 -2.981 5.168 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.050 -3.790 5.934 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.873 -3.715 7.267 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.288 -5.282 6.532 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.300 -4.250 3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.508 -5.761 4.137 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.575 -4.512 3.279 1.00 0.00 H new ATOM 1031 N HIS A 71 0.981 -1.789 7.680 1.00 0.00 N ATOM 1032 CA HIS A 71 1.025 -0.333 7.610 1.00 0.00 C ATOM 1033 C HIS A 71 2.461 0.160 7.452 1.00 0.00 C ATOM 1034 O HIS A 71 3.170 0.361 8.438 1.00 0.00 O ATOM 1035 CB HIS A 71 0.399 0.277 8.864 1.00 0.00 C ATOM 1036 CG HIS A 71 0.763 1.715 9.076 1.00 0.00 C ATOM 1037 ND1 HIS A 71 0.993 2.411 10.214 1.00 0.00 N flip ATOM 1038 CD2 HIS A 71 0.928 2.610 8.041 1.00 0.00 C flip ATOM 1039 CE1 HIS A 71 1.291 3.701 9.849 1.00 0.00 C flip ATOM 1040 NE2 HIS A 71 1.245 3.795 8.532 1.00 0.00 N flip ATOM 0 H HIS A 71 1.681 -2.203 8.295 1.00 0.00 H new ATOM 0 HA HIS A 71 0.453 -0.018 6.737 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.686 0.191 8.797 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.712 -0.301 9.734 1.00 0.00 H new ATOM 0 HD2 HIS A 71 0.816 2.379 6.992 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.525 4.507 10.528 1.00 0.00 H new ATOM 0 HE2 HIS A 71 1.424 4.639 7.987 1.00 0.00 H new ATOM 1049 N ILE A 72 2.882 0.351 6.206 1.00 0.00 N ATOM 1050 CA ILE A 72 4.232 0.820 5.920 1.00 0.00 C ATOM 1051 C ILE A 72 4.262 2.335 5.748 1.00 0.00 C ATOM 1052 O ILE A 72 3.458 2.902 5.009 1.00 0.00 O ATOM 1053 CB ILE A 72 4.800 0.159 4.651 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.687 -1.363 4.748 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.249 0.576 4.441 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.771 -2.062 3.409 1.00 0.00 C ATOM 0 H ILE A 72 2.308 0.188 5.379 1.00 0.00 H new ATOM 0 HA ILE A 72 4.851 0.541 6.773 1.00 0.00 H new ATOM 0 HB ILE A 72 4.217 0.493 3.793 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.480 -1.738 5.395 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.740 -1.619 5.224 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.637 0.101 3.540 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.304 1.659 4.333 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.845 0.267 5.300 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.684 -3.139 3.555 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.962 -1.716 2.766 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.729 -1.836 2.940 1.00 0.00 H new ATOM 1068 N ASN A 73 5.196 2.985 6.435 1.00 0.00 N ATOM 1069 CA ASN A 73 5.333 4.435 6.357 1.00 0.00 C ATOM 1070 C ASN A 73 6.799 4.837 6.226 1.00 0.00 C ATOM 1071 O ASN A 73 7.568 4.796 7.186 1.00 0.00 O ATOM 1072 CB ASN A 73 4.721 5.093 7.596 1.00 0.00 C ATOM 1073 CG ASN A 73 4.298 6.526 7.339 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.151 7.282 6.657 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 3.217 6.949 7.750 1.00 0.00 N flip ATOM 0 H ASN A 73 5.869 2.531 7.052 1.00 0.00 H new ATOM 0 HA ASN A 73 4.800 4.778 5.470 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.856 4.515 7.922 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.445 5.071 8.411 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.592 6.333 8.270 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.946 7.916 7.570 1.00 0.00 H new ATOM 1082 N PRO A 74 7.196 5.235 5.008 1.00 0.00 N ATOM 1083 CA PRO A 74 8.572 5.653 4.722 1.00 0.00 C ATOM 1084 C PRO A 74 8.921 6.984 5.379 1.00 0.00 C ATOM 1085 O PRO A 74 8.041 7.795 5.668 1.00 0.00 O ATOM 1086 CB PRO A 74 8.592 5.788 3.197 1.00 0.00 C ATOM 1087 CG PRO A 74 7.175 6.058 2.822 1.00 0.00 C ATOM 1088 CD PRO A 74 6.333 5.308 3.817 1.00 0.00 C ATOM 0 HA PRO A 74 9.303 4.944 5.110 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.247 6.600 2.880 1.00 0.00 H new ATOM 0 HB3 PRO A 74 8.960 4.878 2.724 1.00 0.00 H new ATOM 0 HG2 PRO A 74 6.959 7.126 2.855 1.00 0.00 H new ATOM 0 HG3 PRO A 74 6.970 5.722 1.805 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.400 5.830 4.028 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.067 4.316 3.452 1.00 0.00 H new ATOM 1096 N ARG A 75 10.211 7.203 5.611 1.00 0.00 N ATOM 1097 CA ARG A 75 10.677 8.436 6.235 1.00 0.00 C ATOM 1098 C ARG A 75 11.827 9.047 5.439 1.00 0.00 C ATOM 1099 O ARG A 75 12.967 8.595 5.531 1.00 0.00 O ATOM 1100 CB ARG A 75 11.123 8.169 7.673 1.00 0.00 C ATOM 1101 CG ARG A 75 9.975 7.857 8.619 1.00 0.00 C ATOM 1102 CD ARG A 75 10.478 7.298 9.941 1.00 0.00 C ATOM 1103 NE ARG A 75 9.586 7.627 11.049 1.00 0.00 N ATOM 1104 CZ ARG A 75 9.609 8.789 11.691 1.00 0.00 C ATOM 1105 NH1 ARG A 75 10.474 9.729 11.337 1.00 0.00 N ATOM 1106 NH2 ARG A 75 8.764 9.014 12.690 1.00 0.00 N ATOM 0 H ARG A 75 10.952 6.543 5.376 1.00 0.00 H new ATOM 0 HA ARG A 75 9.848 9.144 6.245 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.824 7.334 7.678 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.662 9.040 8.045 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.397 8.763 8.802 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.302 7.138 8.151 1.00 0.00 H new ATOM 0 HD2 ARG A 75 10.575 6.215 9.863 1.00 0.00 H new ATOM 0 HD3 ARG A 75 11.473 7.693 10.147 1.00 0.00 H new ATOM 0 HE ARG A 75 8.908 6.926 11.346 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.124 9.561 10.569 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.489 10.621 11.832 1.00 0.00 H new ATOM 0 HH21 ARG A 75 8.096 8.294 12.965 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.783 9.907 13.182 1.00 0.00 H new ATOM 1120 N MET A 76 11.518 10.078 4.659 1.00 0.00 N ATOM 1121 CA MET A 76 12.526 10.751 3.848 1.00 0.00 C ATOM 1122 C MET A 76 13.635 11.323 4.724 1.00 0.00 C ATOM 1123 O MET A 76 13.403 11.691 5.875 1.00 0.00 O ATOM 1124 CB MET A 76 11.884 11.868 3.022 1.00 0.00 C ATOM 1125 CG MET A 76 10.995 11.360 1.900 1.00 0.00 C ATOM 1126 SD MET A 76 9.387 10.795 2.489 1.00 0.00 S ATOM 1127 CE MET A 76 9.073 9.436 1.365 1.00 0.00 C ATOM 0 H MET A 76 10.578 10.465 4.572 1.00 0.00 H new ATOM 0 HA MET A 76 12.964 10.016 3.173 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.294 12.504 3.682 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.670 12.492 2.597 1.00 0.00 H new ATOM 0 HG2 MET A 76 10.851 12.155 1.168 1.00 0.00 H new ATOM 0 HG3 MET A 76 11.498 10.541 1.386 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.420 8.709 1.847 1.00 0.00 H new ATOM 0 HE2 MET A 76 8.592 9.814 0.463 1.00 0.00 H new ATOM 0 HE3 MET A 76 10.016 8.958 1.100 1.00 0.00 H new ATOM 1137 N GLY A 77 14.842 11.395 4.172 1.00 0.00 N ATOM 1138 CA GLY A 77 15.969 11.923 4.919 1.00 0.00 C ATOM 1139 C GLY A 77 16.674 10.858 5.735 1.00 0.00 C ATOM 1140 O GLY A 77 17.631 10.241 5.269 1.00 0.00 O ATOM 0 H GLY A 77 15.060 11.097 3.221 1.00 0.00 H new ATOM 0 HA2 GLY A 77 16.679 12.376 4.227 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.622 12.715 5.583 1.00 0.00 H new ATOM 1144 N ASN A 78 16.201 10.644 6.959 1.00 0.00 N ATOM 1145 CA ASN A 78 16.794 9.647 7.844 1.00 0.00 C ATOM 1146 C ASN A 78 17.006 8.326 7.111 1.00 0.00 C ATOM 1147 O ASN A 78 18.112 7.789 7.084 1.00 0.00 O ATOM 1148 CB ASN A 78 15.904 9.428 9.068 1.00 0.00 C ATOM 1149 CG ASN A 78 16.660 8.813 10.230 1.00 0.00 C ATOM 1150 OD1 ASN A 78 17.511 9.459 10.842 1.00 0.00 O ATOM 1151 ND2 ASN A 78 16.351 7.559 10.539 1.00 0.00 N ATOM 0 H ASN A 78 15.410 11.147 7.360 1.00 0.00 H new ATOM 0 HA ASN A 78 17.765 10.019 8.171 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.478 10.382 9.379 1.00 0.00 H new ATOM 0 HB3 ASN A 78 15.071 8.780 8.797 1.00 0.00 H new ATOM 0 HD21 ASN A 78 16.826 7.092 11.312 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.639 7.063 10.004 1.00 0.00 H new ATOM 1158 N GLY A 79 15.936 7.807 6.516 1.00 0.00 N ATOM 1159 CA GLY A 79 16.025 6.554 5.791 1.00 0.00 C ATOM 1160 C GLY A 79 15.565 5.371 6.619 1.00 0.00 C ATOM 1161 O GLY A 79 16.285 4.381 6.756 1.00 0.00 O ATOM 0 H GLY A 79 15.009 8.233 6.524 1.00 0.00 H new ATOM 0 HA2 GLY A 79 15.420 6.618 4.886 1.00 0.00 H new ATOM 0 HA3 GLY A 79 17.056 6.393 5.475 1.00 0.00 H new ATOM 1165 N THR A 80 14.362 5.471 7.175 1.00 0.00 N ATOM 1166 CA THR A 80 13.808 4.402 7.997 1.00 0.00 C ATOM 1167 C THR A 80 12.306 4.262 7.777 1.00 0.00 C ATOM 1168 O THR A 80 11.540 5.187 8.047 1.00 0.00 O ATOM 1169 CB THR A 80 14.075 4.648 9.493 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.842 6.024 9.813 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.504 4.274 9.856 1.00 0.00 C ATOM 0 H THR A 80 13.752 6.282 7.071 1.00 0.00 H new ATOM 0 HA THR A 80 14.305 3.480 7.694 1.00 0.00 H new ATOM 0 HB THR A 80 13.394 4.021 10.068 1.00 0.00 H new ATOM 0 HG1 THR A 80 13.023 6.329 9.369 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.669 4.456 10.918 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.670 3.219 9.639 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.198 4.878 9.272 1.00 0.00 H new ATOM 1179 N VAL A 81 11.890 3.099 7.286 1.00 0.00 N ATOM 1180 CA VAL A 81 10.479 2.837 7.032 1.00 0.00 C ATOM 1181 C VAL A 81 9.870 1.983 8.138 1.00 0.00 C ATOM 1182 O VAL A 81 10.242 0.823 8.318 1.00 0.00 O ATOM 1183 CB VAL A 81 10.274 2.128 5.680 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.791 1.961 5.383 1.00 0.00 C ATOM 1185 CG2 VAL A 81 10.966 2.898 4.565 1.00 0.00 C ATOM 0 H VAL A 81 12.511 2.323 7.056 1.00 0.00 H new ATOM 0 HA VAL A 81 9.978 3.805 7.007 1.00 0.00 H new ATOM 0 HB VAL A 81 10.722 1.136 5.738 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.666 1.458 4.424 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.328 1.364 6.169 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.315 2.941 5.343 1.00 0.00 H new ATOM 0 HG21 VAL A 81 10.811 2.383 3.617 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.549 3.903 4.504 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.034 2.960 4.774 1.00 0.00 H new ATOM 1195 N VAL A 82 8.931 2.564 8.878 1.00 0.00 N ATOM 1196 CA VAL A 82 8.269 1.856 9.967 1.00 0.00 C ATOM 1197 C VAL A 82 7.117 1.003 9.448 1.00 0.00 C ATOM 1198 O VAL A 82 6.420 1.388 8.509 1.00 0.00 O ATOM 1199 CB VAL A 82 7.731 2.834 11.028 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.056 2.076 12.161 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.853 3.714 11.558 1.00 0.00 C ATOM 0 H VAL A 82 8.612 3.523 8.743 1.00 0.00 H new ATOM 0 HA VAL A 82 9.018 1.210 10.425 1.00 0.00 H new ATOM 0 HB VAL A 82 6.986 3.477 10.560 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.682 2.784 12.901 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.225 1.493 11.764 1.00 0.00 H new ATOM 0 HG13 VAL A 82 7.777 1.407 12.631 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.455 4.399 12.307 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.623 3.089 12.011 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.286 4.285 10.737 1.00 0.00 H new ATOM 1211 N ARG A 83 6.922 -0.158 10.066 1.00 0.00 N ATOM 1212 CA ARG A 83 5.854 -1.066 9.665 1.00 0.00 C ATOM 1213 C ARG A 83 4.976 -1.432 10.858 1.00 0.00 C ATOM 1214 O ARG A 83 5.466 -1.913 11.879 1.00 0.00 O ATOM 1215 CB ARG A 83 6.442 -2.335 9.043 1.00 0.00 C ATOM 1216 CG ARG A 83 6.907 -2.150 7.608 1.00 0.00 C ATOM 1217 CD ARG A 83 8.371 -1.744 7.545 1.00 0.00 C ATOM 1218 NE ARG A 83 9.252 -2.792 8.052 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.539 -2.885 7.739 1.00 0.00 C ATOM 1220 NH1 ARG A 83 11.093 -1.998 6.924 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.276 -3.868 8.241 1.00 0.00 N ATOM 0 H ARG A 83 7.489 -0.491 10.845 1.00 0.00 H new ATOM 0 HA ARG A 83 5.237 -0.558 8.924 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.284 -2.670 9.649 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.692 -3.126 9.074 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.761 -3.078 7.055 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.296 -1.390 7.122 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.639 -1.513 6.514 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.520 -0.833 8.125 1.00 0.00 H new ATOM 0 HE ARG A 83 8.857 -3.491 8.681 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.530 -1.241 6.535 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.082 -2.072 6.686 1.00 0.00 H new ATOM 0 HH21 ARG A 83 10.854 -4.553 8.868 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.265 -3.939 8.000 1.00 0.00 H new ATOM 1235 N ASN A 84 3.674 -1.200 10.721 1.00 0.00 N ATOM 1236 CA ASN A 84 2.727 -1.503 11.788 1.00 0.00 C ATOM 1237 C ASN A 84 1.490 -2.204 11.234 1.00 0.00 C ATOM 1238 O ASN A 84 1.355 -2.382 10.023 1.00 0.00 O ATOM 1239 CB ASN A 84 2.318 -0.221 12.516 1.00 0.00 C ATOM 1240 CG ASN A 84 3.466 0.762 12.645 1.00 0.00 C ATOM 1241 OD1 ASN A 84 4.406 0.460 13.532 1.00 0.00 O flip ATOM 1242 ND2 ASN A 84 3.506 1.780 11.954 1.00 0.00 N flip ATOM 0 H ASN A 84 3.251 -0.803 9.882 1.00 0.00 H new ATOM 0 HA ASN A 84 3.217 -2.173 12.495 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.496 0.253 11.978 1.00 0.00 H new ATOM 0 HB3 ASN A 84 1.946 -0.473 13.509 1.00 0.00 H new ATOM 0 HD21 ASN A 84 2.761 1.972 11.285 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.284 2.432 12.051 1.00 0.00 H new ATOM 1249 N SER A 85 0.589 -2.598 12.128 1.00 0.00 N ATOM 1250 CA SER A 85 -0.635 -3.281 11.730 1.00 0.00 C ATOM 1251 C SER A 85 -1.711 -3.138 12.802 1.00 0.00 C ATOM 1252 O SER A 85 -1.652 -3.787 13.848 1.00 0.00 O ATOM 1253 CB SER A 85 -0.355 -4.762 11.467 1.00 0.00 C ATOM 1254 OG SER A 85 -1.548 -5.458 11.149 1.00 0.00 O ATOM 0 H SER A 85 0.684 -2.456 13.133 1.00 0.00 H new ATOM 0 HA SER A 85 -0.998 -2.818 10.812 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.357 -4.861 10.647 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.107 -5.210 12.347 1.00 0.00 H new ATOM 0 HG SER A 85 -2.247 -4.815 10.905 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.693 -2.284 12.536 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.783 -2.055 13.478 1.00 0.00 C ATOM 1262 C LEU A 86 -4.789 -3.201 13.436 1.00 0.00 C ATOM 1263 O LEU A 86 -5.419 -3.451 12.408 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.486 -0.733 13.162 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.811 -0.488 13.884 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.590 -0.387 15.386 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.481 0.772 13.357 1.00 0.00 C ATOM 0 H LEU A 86 -2.757 -1.739 11.676 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.359 -2.004 14.481 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.806 0.084 13.405 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.667 -0.688 12.088 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.470 -1.334 13.690 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.544 -0.213 15.883 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.154 -1.316 15.753 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.913 0.440 15.599 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.423 0.930 13.883 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.826 1.628 13.520 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.675 0.662 12.290 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.936 -3.893 14.561 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.867 -5.011 14.654 1.00 0.00 C ATOM 1281 C LEU A 87 -7.205 -4.560 15.231 1.00 0.00 C ATOM 1282 O LEU A 87 -7.301 -3.497 15.844 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.274 -6.123 15.522 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.961 -6.732 15.027 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.495 -7.831 15.969 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.123 -7.271 13.613 1.00 0.00 C ATOM 0 H LEU A 87 -4.422 -3.699 15.421 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.037 -5.394 13.648 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.113 -5.727 16.525 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.011 -6.921 15.609 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.202 -5.950 15.011 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.560 -8.253 15.601 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.339 -7.415 16.964 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.252 -8.614 16.017 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.179 -7.700 13.277 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.896 -8.040 13.603 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.410 -6.459 12.945 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.235 -5.376 15.033 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.568 -5.061 15.535 1.00 0.00 C ATOM 1300 C ASN A 88 -9.494 -4.469 16.939 1.00 0.00 C ATOM 1301 O ASN A 88 -9.313 -5.190 17.920 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.442 -6.316 15.544 1.00 0.00 C ATOM 1303 CG ASN A 88 -10.480 -7.004 14.193 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -11.403 -6.799 13.405 1.00 0.00 O ATOM 1305 ND2 ASN A 88 -9.474 -7.827 13.920 1.00 0.00 N ATOM 0 H ASN A 88 -8.172 -6.260 14.529 1.00 0.00 H new ATOM 0 HA ASN A 88 -10.014 -4.321 14.871 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -10.065 -7.013 16.293 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -11.456 -6.047 15.840 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -9.446 -8.319 13.027 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -8.730 -7.967 14.603 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.636 -3.150 17.028 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.583 -2.483 18.316 1.00 0.00 C ATOM 1314 C GLY A 89 -8.226 -2.611 18.980 1.00 0.00 C ATOM 1315 O GLY A 89 -8.009 -2.084 20.071 1.00 0.00 O ATOM 0 H GLY A 89 -9.787 -2.531 16.231 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.822 -1.428 18.185 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.346 -2.904 18.971 1.00 0.00 H new ATOM 1319 N SER A 90 -7.311 -3.315 18.321 1.00 0.00 N ATOM 1320 CA SER A 90 -5.970 -3.516 18.857 1.00 0.00 C ATOM 1321 C SER A 90 -4.911 -3.074 17.851 1.00 0.00 C ATOM 1322 O SER A 90 -5.223 -2.763 16.702 1.00 0.00 O ATOM 1323 CB SER A 90 -5.759 -4.986 19.224 1.00 0.00 C ATOM 1324 OG SER A 90 -4.975 -5.112 20.397 1.00 0.00 O ATOM 0 H SER A 90 -7.474 -3.755 17.416 1.00 0.00 H new ATOM 0 HA SER A 90 -5.870 -2.907 19.755 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.725 -5.468 19.375 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.270 -5.503 18.399 1.00 0.00 H new ATOM 0 HG SER A 90 -4.856 -6.061 20.611 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.659 -3.049 18.293 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.553 -2.645 17.432 1.00 0.00 C ATOM 1332 C TRP A 91 -1.432 -3.679 17.464 1.00 0.00 C ATOM 1333 O TRP A 91 -1.351 -4.491 18.385 1.00 0.00 O ATOM 1334 CB TRP A 91 -2.016 -1.280 17.864 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.614 -0.138 17.100 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.625 0.683 17.510 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.238 0.308 15.792 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.901 1.612 16.536 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -3.063 1.404 15.472 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.284 -0.110 14.860 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -2.962 2.084 14.261 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.185 0.565 13.659 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -2.019 1.652 13.368 1.00 0.00 C ATOM 0 H TRP A 91 -3.384 -3.303 19.242 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.928 -2.574 16.411 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -2.213 -1.140 18.927 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.934 -1.266 17.736 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -4.133 0.613 18.460 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.614 2.339 16.595 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.635 -0.946 15.075 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.605 2.922 14.035 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.452 0.249 12.932 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.916 2.159 12.420 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.570 -3.643 16.453 1.00 0.00 N ATOM 1355 CA GLY A 92 0.534 -4.582 16.385 1.00 0.00 C ATOM 1356 C GLY A 92 1.798 -4.038 17.021 1.00 0.00 C ATOM 1357 O GLY A 92 1.842 -3.803 18.228 1.00 0.00 O ATOM 0 H GLY A 92 -0.617 -2.980 15.679 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.250 -5.509 16.884 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.733 -4.829 15.342 1.00 0.00 H new ATOM 1361 N SER A 93 2.830 -3.839 16.207 1.00 0.00 N ATOM 1362 CA SER A 93 4.103 -3.324 16.698 1.00 0.00 C ATOM 1363 C SER A 93 4.832 -2.547 15.606 1.00 0.00 C ATOM 1364 O SER A 93 4.396 -2.517 14.455 1.00 0.00 O ATOM 1365 CB SER A 93 4.982 -4.472 17.197 1.00 0.00 C ATOM 1366 OG SER A 93 4.452 -5.044 18.380 1.00 0.00 O ATOM 0 H SER A 93 2.809 -4.027 15.205 1.00 0.00 H new ATOM 0 HA SER A 93 3.898 -2.646 17.526 1.00 0.00 H new ATOM 0 HB2 SER A 93 5.061 -5.236 16.424 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.991 -4.105 17.387 1.00 0.00 H new ATOM 0 HG SER A 93 3.592 -4.624 18.590 1.00 0.00 H new ATOM 1372 N GLU A 94 5.944 -1.920 15.976 1.00 0.00 N ATOM 1373 CA GLU A 94 6.733 -1.142 15.029 1.00 0.00 C ATOM 1374 C GLU A 94 7.973 -1.916 14.589 1.00 0.00 C ATOM 1375 O GLU A 94 8.779 -2.339 15.417 1.00 0.00 O ATOM 1376 CB GLU A 94 7.147 0.193 15.651 1.00 0.00 C ATOM 1377 CG GLU A 94 6.027 0.883 16.412 1.00 0.00 C ATOM 1378 CD GLU A 94 6.531 1.996 17.310 1.00 0.00 C ATOM 1379 OE1 GLU A 94 7.249 1.692 18.285 1.00 0.00 O ATOM 1380 OE2 GLU A 94 6.206 3.171 17.037 1.00 0.00 O ATOM 0 H GLU A 94 6.319 -1.936 16.925 1.00 0.00 H new ATOM 0 HA GLU A 94 6.115 -0.950 14.152 1.00 0.00 H new ATOM 0 HB2 GLU A 94 7.985 0.025 16.328 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.502 0.857 14.863 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.308 1.292 15.702 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.496 0.147 17.015 1.00 0.00 H new ATOM 1387 N GLU A 95 8.116 -2.097 13.280 1.00 0.00 N ATOM 1388 CA GLU A 95 9.256 -2.821 12.730 1.00 0.00 C ATOM 1389 C GLU A 95 10.020 -1.956 11.731 1.00 0.00 C ATOM 1390 O GLU A 95 9.443 -1.431 10.779 1.00 0.00 O ATOM 1391 CB GLU A 95 8.790 -4.112 12.052 1.00 0.00 C ATOM 1392 CG GLU A 95 8.056 -5.059 12.986 1.00 0.00 C ATOM 1393 CD GLU A 95 8.930 -5.547 14.126 1.00 0.00 C ATOM 1394 OE1 GLU A 95 10.154 -5.681 13.919 1.00 0.00 O ATOM 1395 OE2 GLU A 95 8.389 -5.795 15.224 1.00 0.00 O ATOM 0 H GLU A 95 7.457 -1.753 12.581 1.00 0.00 H new ATOM 0 HA GLU A 95 9.925 -3.072 13.553 1.00 0.00 H new ATOM 0 HB2 GLU A 95 8.136 -3.859 11.218 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.656 -4.626 11.634 1.00 0.00 H new ATOM 0 HG2 GLU A 95 7.180 -4.555 13.395 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.694 -5.916 12.418 1.00 0.00 H new ATOM 1402 N LYS A 96 11.321 -1.813 11.956 1.00 0.00 N ATOM 1403 CA LYS A 96 12.166 -1.013 11.077 1.00 0.00 C ATOM 1404 C LYS A 96 13.405 -1.796 10.653 1.00 0.00 C ATOM 1405 O LYS A 96 14.216 -2.194 11.488 1.00 0.00 O ATOM 1406 CB LYS A 96 12.583 0.282 11.777 1.00 0.00 C ATOM 1407 CG LYS A 96 11.457 1.293 11.907 1.00 0.00 C ATOM 1408 CD LYS A 96 11.956 2.615 12.467 1.00 0.00 C ATOM 1409 CE LYS A 96 12.322 2.494 13.939 1.00 0.00 C ATOM 1410 NZ LYS A 96 12.301 3.816 14.625 1.00 0.00 N ATOM 0 H LYS A 96 11.814 -2.241 12.740 1.00 0.00 H new ATOM 0 HA LYS A 96 11.590 -0.767 10.185 1.00 0.00 H new ATOM 0 HB2 LYS A 96 12.961 0.042 12.771 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.405 0.736 11.224 1.00 0.00 H new ATOM 0 HG2 LYS A 96 11.002 1.459 10.931 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.680 0.892 12.557 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.826 2.946 11.901 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.187 3.377 12.344 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.624 1.817 14.433 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.314 2.052 14.032 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.556 3.692 15.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.985 4.454 14.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.348 4.226 14.559 1.00 0.00 H new ATOM 1424 N LYS A 97 13.545 -2.011 9.349 1.00 0.00 N ATOM 1425 CA LYS A 97 14.686 -2.744 8.813 1.00 0.00 C ATOM 1426 C LYS A 97 14.726 -2.649 7.291 1.00 0.00 C ATOM 1427 O LYS A 97 13.926 -3.279 6.599 1.00 0.00 O ATOM 1428 CB LYS A 97 14.623 -4.211 9.241 1.00 0.00 C ATOM 1429 CG LYS A 97 15.915 -4.972 8.999 1.00 0.00 C ATOM 1430 CD LYS A 97 17.009 -4.531 9.957 1.00 0.00 C ATOM 1431 CE LYS A 97 16.845 -5.177 11.325 1.00 0.00 C ATOM 1432 NZ LYS A 97 17.501 -6.512 11.390 1.00 0.00 N ATOM 0 H LYS A 97 12.882 -1.688 8.644 1.00 0.00 H new ATOM 0 HA LYS A 97 15.595 -2.295 9.212 1.00 0.00 H new ATOM 0 HB2 LYS A 97 14.375 -4.261 10.301 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.814 -4.704 8.701 1.00 0.00 H new ATOM 0 HG2 LYS A 97 15.736 -6.041 9.116 1.00 0.00 H new ATOM 0 HG3 LYS A 97 16.244 -4.815 7.972 1.00 0.00 H new ATOM 0 HD2 LYS A 97 17.983 -4.793 9.544 1.00 0.00 H new ATOM 0 HD3 LYS A 97 16.988 -3.446 10.061 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.271 -4.525 12.088 1.00 0.00 H new ATOM 0 HE3 LYS A 97 15.784 -5.282 11.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 17.367 -6.919 12.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 17.077 -7.142 10.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 18.518 -6.409 11.198 1.00 0.00 H new ATOM 1446 N ILE A 98 15.663 -1.860 6.776 1.00 0.00 N ATOM 1447 CA ILE A 98 15.809 -1.686 5.336 1.00 0.00 C ATOM 1448 C ILE A 98 17.276 -1.543 4.946 1.00 0.00 C ATOM 1449 O ILE A 98 18.093 -1.050 5.724 1.00 0.00 O ATOM 1450 CB ILE A 98 15.033 -0.452 4.837 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.373 -0.167 3.373 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.348 0.758 5.704 1.00 0.00 C ATOM 1453 CD1 ILE A 98 14.512 0.910 2.751 1.00 0.00 C ATOM 0 H ILE A 98 16.333 -1.331 7.335 1.00 0.00 H new ATOM 0 HA ILE A 98 15.396 -2.579 4.866 1.00 0.00 H new ATOM 0 HB ILE A 98 13.965 -0.659 4.909 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.419 0.130 3.303 1.00 0.00 H new ATOM 0 HG13 ILE A 98 15.263 -1.086 2.797 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.792 1.622 5.339 1.00 0.00 H new ATOM 0 HG22 ILE A 98 15.061 0.551 6.735 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.416 0.969 5.660 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.809 1.059 1.713 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.466 0.607 2.789 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.640 1.842 3.302 1.00 0.00 H new ATOM 1465 N THR A 99 17.604 -1.975 3.732 1.00 0.00 N ATOM 1466 CA THR A 99 18.972 -1.895 3.236 1.00 0.00 C ATOM 1467 C THR A 99 19.240 -0.547 2.576 1.00 0.00 C ATOM 1468 O THR A 99 20.265 0.087 2.829 1.00 0.00 O ATOM 1469 CB THR A 99 19.270 -3.017 2.224 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.636 -2.945 1.800 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.352 -2.913 1.016 1.00 0.00 C ATOM 0 H THR A 99 16.940 -2.384 3.074 1.00 0.00 H new ATOM 0 HA THR A 99 19.628 -2.011 4.099 1.00 0.00 H new ATOM 0 HB THR A 99 19.093 -3.975 2.714 1.00 0.00 H new ATOM 0 HG1 THR A 99 20.817 -3.663 1.158 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.581 -3.716 0.315 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.314 -2.998 1.339 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.502 -1.950 0.527 1.00 0.00 H new ATOM 1479 N HIS A 100 18.312 -0.113 1.729 1.00 0.00 N ATOM 1480 CA HIS A 100 18.447 1.162 1.034 1.00 0.00 C ATOM 1481 C HIS A 100 17.082 1.805 0.807 1.00 0.00 C ATOM 1482 O HIS A 100 16.181 1.188 0.241 1.00 0.00 O ATOM 1483 CB HIS A 100 19.159 0.963 -0.305 1.00 0.00 C ATOM 1484 CG HIS A 100 18.228 0.674 -1.442 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.465 -0.472 -1.517 1.00 0.00 N ATOM 1486 CD2 HIS A 100 17.937 1.392 -2.552 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.747 -0.448 -2.626 1.00 0.00 C ATOM 1488 NE2 HIS A 100 17.014 0.673 -3.271 1.00 0.00 N ATOM 0 H HIS A 100 17.458 -0.626 1.507 1.00 0.00 H new ATOM 0 HA HIS A 100 19.042 1.827 1.659 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.735 1.859 -0.537 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.870 0.142 -0.211 1.00 0.00 H new ATOM 0 HD2 HIS A 100 18.353 2.351 -2.822 1.00 0.00 H new ATOM 0 HE1 HIS A 100 16.059 -1.215 -2.950 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.602 0.958 -4.159 1.00 0.00 H new ATOM 1497 N ASN A 101 16.938 3.048 1.254 1.00 0.00 N ATOM 1498 CA ASN A 101 15.682 3.774 1.100 1.00 0.00 C ATOM 1499 C ASN A 101 15.746 4.726 -0.090 1.00 0.00 C ATOM 1500 O ASN A 101 16.311 5.818 -0.014 1.00 0.00 O ATOM 1501 CB ASN A 101 15.362 4.556 2.376 1.00 0.00 C ATOM 1502 CG ASN A 101 14.152 5.456 2.215 1.00 0.00 C ATOM 1503 OD1 ASN A 101 13.740 5.766 1.097 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.577 5.880 3.334 1.00 0.00 N ATOM 0 H ASN A 101 17.674 3.573 1.725 1.00 0.00 H new ATOM 0 HA ASN A 101 14.891 3.047 0.918 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.185 3.856 3.193 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.226 5.160 2.655 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.759 6.488 3.289 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.953 5.598 4.239 1.00 0.00 H new ATOM 1511 N PRO A 102 15.153 4.306 -1.217 1.00 0.00 N ATOM 1512 CA PRO A 102 15.127 5.106 -2.445 1.00 0.00 C ATOM 1513 C PRO A 102 14.234 6.335 -2.317 1.00 0.00 C ATOM 1514 O PRO A 102 14.543 7.398 -2.857 1.00 0.00 O ATOM 1515 CB PRO A 102 14.561 4.139 -3.487 1.00 0.00 C ATOM 1516 CG PRO A 102 13.757 3.162 -2.700 1.00 0.00 C ATOM 1517 CD PRO A 102 14.460 3.016 -1.379 1.00 0.00 C ATOM 0 HA PRO A 102 16.113 5.497 -2.698 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.944 4.662 -4.218 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.358 3.642 -4.040 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.736 3.518 -2.562 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.693 2.204 -3.216 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.756 2.833 -0.567 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.161 2.181 -1.387 1.00 0.00 H new ATOM 1525 N PHE A 103 13.126 6.183 -1.600 1.00 0.00 N ATOM 1526 CA PHE A 103 12.187 7.282 -1.402 1.00 0.00 C ATOM 1527 C PHE A 103 12.928 8.589 -1.137 1.00 0.00 C ATOM 1528 O PHE A 103 13.531 8.771 -0.080 1.00 0.00 O ATOM 1529 CB PHE A 103 11.245 6.972 -0.237 1.00 0.00 C ATOM 1530 CG PHE A 103 10.784 5.542 -0.203 1.00 0.00 C ATOM 1531 CD1 PHE A 103 10.305 4.927 -1.348 1.00 0.00 C ATOM 1532 CD2 PHE A 103 10.831 4.813 0.975 1.00 0.00 C ATOM 1533 CE1 PHE A 103 9.880 3.613 -1.319 1.00 0.00 C ATOM 1534 CE2 PHE A 103 10.408 3.498 1.010 1.00 0.00 C ATOM 1535 CZ PHE A 103 9.933 2.897 -0.139 1.00 0.00 C ATOM 0 H PHE A 103 12.856 5.310 -1.146 1.00 0.00 H new ATOM 0 HA PHE A 103 11.601 7.395 -2.314 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.750 7.205 0.700 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.374 7.625 -0.301 1.00 0.00 H new ATOM 0 HD1 PHE A 103 10.263 5.481 -2.274 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.203 5.278 1.876 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.507 3.146 -2.218 1.00 0.00 H new ATOM 0 HE2 PHE A 103 10.449 2.941 1.934 1.00 0.00 H new ATOM 0 HZ PHE A 103 9.603 1.869 -0.115 1.00 0.00 H new ATOM 1545 N GLY A 104 12.878 9.498 -2.107 1.00 0.00 N ATOM 1546 CA GLY A 104 13.548 10.776 -1.961 1.00 0.00 C ATOM 1547 C GLY A 104 12.708 11.932 -2.467 1.00 0.00 C ATOM 1548 O GLY A 104 12.057 11.845 -3.508 1.00 0.00 O ATOM 0 H GLY A 104 12.385 9.371 -2.991 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.789 10.939 -0.910 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.492 10.752 -2.505 1.00 0.00 H new ATOM 1552 N PRO A 105 12.716 13.046 -1.719 1.00 0.00 N ATOM 1553 CA PRO A 105 11.953 14.245 -2.078 1.00 0.00 C ATOM 1554 C PRO A 105 12.521 14.948 -3.306 1.00 0.00 C ATOM 1555 O PRO A 105 13.535 15.641 -3.223 1.00 0.00 O ATOM 1556 CB PRO A 105 12.090 15.136 -0.841 1.00 0.00 C ATOM 1557 CG PRO A 105 13.358 14.695 -0.195 1.00 0.00 C ATOM 1558 CD PRO A 105 13.470 13.220 -0.467 1.00 0.00 C ATOM 0 HA PRO A 105 10.921 14.009 -2.338 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.131 16.190 -1.115 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.240 15.014 -0.169 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.213 15.233 -0.605 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.340 14.894 0.877 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.509 12.909 -0.577 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.045 12.628 0.344 1.00 0.00 H new ATOM 1566 N GLY A 106 11.861 14.765 -4.446 1.00 0.00 N ATOM 1567 CA GLY A 106 12.316 15.389 -5.675 1.00 0.00 C ATOM 1568 C GLY A 106 12.614 14.377 -6.763 1.00 0.00 C ATOM 1569 O GLY A 106 12.974 14.746 -7.880 1.00 0.00 O ATOM 0 H GLY A 106 11.020 14.196 -4.540 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.555 16.085 -6.029 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.213 15.974 -5.471 1.00 0.00 H new ATOM 1573 N GLN A 107 12.465 13.097 -6.436 1.00 0.00 N ATOM 1574 CA GLN A 107 12.724 12.029 -7.394 1.00 0.00 C ATOM 1575 C GLN A 107 11.643 10.956 -7.317 1.00 0.00 C ATOM 1576 O GLN A 107 11.106 10.676 -6.245 1.00 0.00 O ATOM 1577 CB GLN A 107 14.097 11.405 -7.137 1.00 0.00 C ATOM 1578 CG GLN A 107 14.278 10.899 -5.715 1.00 0.00 C ATOM 1579 CD GLN A 107 15.724 10.943 -5.260 1.00 0.00 C ATOM 1580 OE1 GLN A 107 16.476 11.845 -5.630 1.00 0.00 O ATOM 1581 NE2 GLN A 107 16.120 9.967 -4.451 1.00 0.00 N ATOM 0 H GLN A 107 12.166 12.775 -5.515 1.00 0.00 H new ATOM 0 HA GLN A 107 12.711 12.462 -8.394 1.00 0.00 H new ATOM 0 HB2 GLN A 107 14.246 10.577 -7.830 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.869 12.144 -7.352 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.670 11.500 -5.039 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.911 9.875 -5.648 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.463 9.240 -4.170 1.00 0.00 H new ATOM 0 HE22 GLN A 107 17.081 9.945 -4.111 1.00 0.00 H new ATOM 1590 N PHE A 108 11.327 10.359 -8.462 1.00 0.00 N ATOM 1591 CA PHE A 108 10.308 9.317 -8.525 1.00 0.00 C ATOM 1592 C PHE A 108 10.801 8.034 -7.862 1.00 0.00 C ATOM 1593 O PHE A 108 11.967 7.926 -7.482 1.00 0.00 O ATOM 1594 CB PHE A 108 9.923 9.038 -9.979 1.00 0.00 C ATOM 1595 CG PHE A 108 11.069 9.178 -10.940 1.00 0.00 C ATOM 1596 CD1 PHE A 108 11.948 8.128 -11.149 1.00 0.00 C ATOM 1597 CD2 PHE A 108 11.267 10.361 -11.635 1.00 0.00 C ATOM 1598 CE1 PHE A 108 13.004 8.254 -12.032 1.00 0.00 C ATOM 1599 CE2 PHE A 108 12.320 10.492 -12.520 1.00 0.00 C ATOM 1600 CZ PHE A 108 13.190 9.438 -12.718 1.00 0.00 C ATOM 0 H PHE A 108 11.762 10.579 -9.358 1.00 0.00 H new ATOM 0 HA PHE A 108 9.429 9.670 -7.985 1.00 0.00 H new ATOM 0 HB2 PHE A 108 9.519 8.028 -10.052 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.127 9.722 -10.273 1.00 0.00 H new ATOM 0 HD1 PHE A 108 11.807 7.200 -10.616 1.00 0.00 H new ATOM 0 HD2 PHE A 108 10.591 11.189 -11.483 1.00 0.00 H new ATOM 0 HE1 PHE A 108 13.683 7.428 -12.185 1.00 0.00 H new ATOM 0 HE2 PHE A 108 12.463 11.418 -13.057 1.00 0.00 H new ATOM 0 HZ PHE A 108 14.014 9.539 -13.408 1.00 0.00 H new ATOM 1610 N PHE A 109 9.903 7.063 -7.727 1.00 0.00 N ATOM 1611 CA PHE A 109 10.245 5.787 -7.109 1.00 0.00 C ATOM 1612 C PHE A 109 9.240 4.707 -7.499 1.00 0.00 C ATOM 1613 O PHE A 109 8.033 4.948 -7.524 1.00 0.00 O ATOM 1614 CB PHE A 109 10.292 5.930 -5.586 1.00 0.00 C ATOM 1615 CG PHE A 109 8.934 6.028 -4.952 1.00 0.00 C ATOM 1616 CD1 PHE A 109 8.320 7.259 -4.785 1.00 0.00 C ATOM 1617 CD2 PHE A 109 8.272 4.890 -4.521 1.00 0.00 C ATOM 1618 CE1 PHE A 109 7.070 7.353 -4.202 1.00 0.00 C ATOM 1619 CE2 PHE A 109 7.022 4.978 -3.937 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.421 6.211 -3.776 1.00 0.00 C ATOM 0 H PHE A 109 8.934 7.136 -8.037 1.00 0.00 H new ATOM 0 HA PHE A 109 11.230 5.489 -7.470 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.820 5.075 -5.165 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.869 6.819 -5.330 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.824 8.156 -5.114 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.738 3.923 -4.643 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.602 8.318 -4.080 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.516 4.083 -3.607 1.00 0.00 H new ATOM 0 HZ PHE A 109 5.446 6.282 -3.318 1.00 0.00 H new ATOM 1630 N ASP A 110 9.747 3.518 -7.804 1.00 0.00 N ATOM 1631 CA ASP A 110 8.895 2.400 -8.193 1.00 0.00 C ATOM 1632 C ASP A 110 8.806 1.369 -7.072 1.00 0.00 C ATOM 1633 O ASP A 110 9.765 0.645 -6.802 1.00 0.00 O ATOM 1634 CB ASP A 110 9.430 1.743 -9.466 1.00 0.00 C ATOM 1635 CG ASP A 110 9.109 0.262 -9.532 1.00 0.00 C ATOM 1636 OD1 ASP A 110 7.911 -0.088 -9.505 1.00 0.00 O ATOM 1637 OD2 ASP A 110 10.058 -0.546 -9.610 1.00 0.00 O ATOM 0 H ASP A 110 10.744 3.303 -7.789 1.00 0.00 H new ATOM 0 HA ASP A 110 7.895 2.787 -8.386 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.005 2.243 -10.336 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.510 1.880 -9.516 1.00 0.00 H new ATOM 1642 N LEU A 111 7.649 1.308 -6.422 1.00 0.00 N ATOM 1643 CA LEU A 111 7.434 0.367 -5.329 1.00 0.00 C ATOM 1644 C LEU A 111 6.474 -0.742 -5.746 1.00 0.00 C ATOM 1645 O LEU A 111 5.455 -0.486 -6.388 1.00 0.00 O ATOM 1646 CB LEU A 111 6.886 1.096 -4.101 1.00 0.00 C ATOM 1647 CG LEU A 111 7.180 0.447 -2.748 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.455 -0.884 -2.626 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.679 0.260 -2.561 1.00 0.00 C ATOM 0 H LEU A 111 6.845 1.899 -6.633 1.00 0.00 H new ATOM 0 HA LEU A 111 8.394 -0.084 -5.077 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.293 2.107 -4.092 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.805 1.188 -4.210 1.00 0.00 H new ATOM 0 HG LEU A 111 6.816 1.109 -1.962 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.676 -1.331 -1.657 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.381 -0.723 -2.715 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.788 -1.554 -3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 111 8.870 -0.203 -1.593 1.00 0.00 H new ATOM 0 HD22 LEU A 111 9.067 -0.381 -3.353 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.175 1.230 -2.603 1.00 0.00 H new ATOM 1661 N SER A 112 6.805 -1.975 -5.376 1.00 0.00 N ATOM 1662 CA SER A 112 5.972 -3.124 -5.714 1.00 0.00 C ATOM 1663 C SER A 112 5.999 -4.161 -4.595 1.00 0.00 C ATOM 1664 O SER A 112 7.032 -4.774 -4.326 1.00 0.00 O ATOM 1665 CB SER A 112 6.447 -3.757 -7.023 1.00 0.00 C ATOM 1666 OG SER A 112 6.676 -2.770 -8.013 1.00 0.00 O ATOM 0 H SER A 112 7.644 -2.204 -4.842 1.00 0.00 H new ATOM 0 HA SER A 112 4.947 -2.775 -5.839 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.364 -4.319 -6.847 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.701 -4.467 -7.379 1.00 0.00 H new ATOM 0 HG SER A 112 6.980 -3.200 -8.839 1.00 0.00 H new ATOM 1672 N ILE A 113 4.855 -4.352 -3.947 1.00 0.00 N ATOM 1673 CA ILE A 113 4.745 -5.315 -2.858 1.00 0.00 C ATOM 1674 C ILE A 113 4.252 -6.665 -3.366 1.00 0.00 C ATOM 1675 O ILE A 113 3.337 -6.735 -4.186 1.00 0.00 O ATOM 1676 CB ILE A 113 3.792 -4.814 -1.757 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.171 -3.394 -1.331 1.00 0.00 C ATOM 1678 CG2 ILE A 113 3.821 -5.757 -0.563 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.479 -2.317 -2.137 1.00 0.00 C ATOM 0 H ILE A 113 3.991 -3.853 -4.157 1.00 0.00 H new ATOM 0 HA ILE A 113 5.744 -5.431 -2.437 1.00 0.00 H new ATOM 0 HB ILE A 113 2.778 -4.794 -2.156 1.00 0.00 H new ATOM 0 HG12 ILE A 113 3.926 -3.262 -0.277 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.250 -3.271 -1.425 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.143 -5.390 0.207 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.508 -6.752 -0.878 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.833 -5.805 -0.162 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.795 -1.336 -1.781 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.744 -2.423 -3.189 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.399 -2.414 -2.023 1.00 0.00 H new ATOM 1691 N ARG A 114 4.864 -7.737 -2.872 1.00 0.00 N ATOM 1692 CA ARG A 114 4.487 -9.086 -3.276 1.00 0.00 C ATOM 1693 C ARG A 114 3.785 -9.819 -2.135 1.00 0.00 C ATOM 1694 O ARG A 114 4.243 -9.790 -0.992 1.00 0.00 O ATOM 1695 CB ARG A 114 5.721 -9.873 -3.719 1.00 0.00 C ATOM 1696 CG ARG A 114 6.022 -9.749 -5.203 1.00 0.00 C ATOM 1697 CD ARG A 114 6.838 -10.930 -5.707 1.00 0.00 C ATOM 1698 NE ARG A 114 5.989 -12.017 -6.186 1.00 0.00 N ATOM 1699 CZ ARG A 114 6.388 -13.282 -6.261 1.00 0.00 C ATOM 1700 NH1 ARG A 114 7.616 -13.616 -5.891 1.00 0.00 N ATOM 1701 NH2 ARG A 114 5.557 -14.215 -6.708 1.00 0.00 N ATOM 0 H ARG A 114 5.623 -7.697 -2.192 1.00 0.00 H new ATOM 0 HA ARG A 114 3.795 -9.007 -4.115 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.585 -9.527 -3.152 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.578 -10.925 -3.473 1.00 0.00 H new ATOM 0 HG2 ARG A 114 5.088 -9.686 -5.761 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.567 -8.823 -5.389 1.00 0.00 H new ATOM 0 HD2 ARG A 114 7.494 -10.600 -6.513 1.00 0.00 H new ATOM 0 HD3 ARG A 114 7.478 -11.297 -4.905 1.00 0.00 H new ATOM 0 HE ARG A 114 5.038 -11.793 -6.479 1.00 0.00 H new ATOM 0 HH11 ARG A 114 8.257 -12.901 -5.548 1.00 0.00 H new ATOM 0 HH12 ARG A 114 7.920 -14.588 -5.950 1.00 0.00 H new ATOM 0 HH21 ARG A 114 4.611 -13.961 -6.994 1.00 0.00 H new ATOM 0 HH22 ARG A 114 5.864 -15.186 -6.765 1.00 0.00 H new ATOM 1715 N CYS A 115 2.675 -10.473 -2.454 1.00 0.00 N ATOM 1716 CA CYS A 115 1.909 -11.212 -1.456 1.00 0.00 C ATOM 1717 C CYS A 115 2.190 -12.708 -1.554 1.00 0.00 C ATOM 1718 O CYS A 115 1.874 -13.345 -2.558 1.00 0.00 O ATOM 1719 CB CYS A 115 0.413 -10.949 -1.633 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.650 -12.077 -0.701 1.00 0.00 S ATOM 0 H CYS A 115 2.284 -10.507 -3.396 1.00 0.00 H new ATOM 0 HA CYS A 115 2.216 -10.867 -0.469 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.196 -9.926 -1.326 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.165 -11.024 -2.692 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.389 -11.970 0.568 1.00 0.00 H new ATOM 1726 N GLY A 116 2.788 -13.263 -0.504 1.00 0.00 N ATOM 1727 CA GLY A 116 3.103 -14.680 -0.493 1.00 0.00 C ATOM 1728 C GLY A 116 2.258 -15.454 0.499 1.00 0.00 C ATOM 1729 O GLY A 116 1.068 -15.177 0.662 1.00 0.00 O ATOM 0 H GLY A 116 3.060 -12.757 0.339 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.953 -15.090 -1.492 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.157 -14.813 -0.249 1.00 0.00 H new ATOM 1733 N LEU A 117 2.871 -16.427 1.163 1.00 0.00 N ATOM 1734 CA LEU A 117 2.167 -17.245 2.144 1.00 0.00 C ATOM 1735 C LEU A 117 2.788 -17.091 3.529 1.00 0.00 C ATOM 1736 O LEU A 117 2.088 -17.121 4.541 1.00 0.00 O ATOM 1737 CB LEU A 117 2.191 -18.716 1.723 1.00 0.00 C ATOM 1738 CG LEU A 117 1.166 -19.128 0.666 1.00 0.00 C ATOM 1739 CD1 LEU A 117 1.724 -20.233 -0.217 1.00 0.00 C ATOM 1740 CD2 LEU A 117 -0.131 -19.574 1.326 1.00 0.00 C ATOM 0 H LEU A 117 3.854 -16.669 1.040 1.00 0.00 H new ATOM 0 HA LEU A 117 1.133 -16.903 2.190 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.187 -18.949 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 117 2.035 -19.330 2.610 1.00 0.00 H new ATOM 0 HG LEU A 117 0.952 -18.263 0.038 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.980 -20.513 -0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.625 -19.879 -0.718 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.967 -21.101 0.396 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.849 -19.864 0.559 1.00 0.00 H new ATOM 0 HD22 LEU A 117 0.066 -20.425 1.978 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.541 -18.753 1.915 1.00 0.00 H new ATOM 1752 N ASP A 118 4.106 -16.925 3.565 1.00 0.00 N ATOM 1753 CA ASP A 118 4.822 -16.763 4.825 1.00 0.00 C ATOM 1754 C ASP A 118 5.022 -15.286 5.150 1.00 0.00 C ATOM 1755 O ASP A 118 4.796 -14.852 6.280 1.00 0.00 O ATOM 1756 CB ASP A 118 6.176 -17.472 4.762 1.00 0.00 C ATOM 1757 CG ASP A 118 6.039 -18.982 4.773 1.00 0.00 C ATOM 1758 OD1 ASP A 118 5.084 -19.495 4.154 1.00 0.00 O ATOM 1759 OD2 ASP A 118 6.888 -19.650 5.401 1.00 0.00 O ATOM 0 H ASP A 118 4.700 -16.899 2.736 1.00 0.00 H new ATOM 0 HA ASP A 118 4.222 -17.213 5.616 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.702 -17.164 3.859 1.00 0.00 H new ATOM 0 HB3 ASP A 118 6.787 -17.159 5.609 1.00 0.00 H new ATOM 1764 N ARG A 119 5.448 -14.518 4.152 1.00 0.00 N ATOM 1765 CA ARG A 119 5.680 -13.090 4.332 1.00 0.00 C ATOM 1766 C ARG A 119 5.555 -12.347 3.005 1.00 0.00 C ATOM 1767 O ARG A 119 5.283 -12.950 1.967 1.00 0.00 O ATOM 1768 CB ARG A 119 7.066 -12.850 4.934 1.00 0.00 C ATOM 1769 CG ARG A 119 7.375 -13.740 6.126 1.00 0.00 C ATOM 1770 CD ARG A 119 8.825 -13.604 6.563 1.00 0.00 C ATOM 1771 NE ARG A 119 8.993 -13.854 7.992 1.00 0.00 N ATOM 1772 CZ ARG A 119 10.136 -14.249 8.540 1.00 0.00 C ATOM 1773 NH1 ARG A 119 11.208 -14.438 7.782 1.00 0.00 N ATOM 1774 NH2 ARG A 119 10.210 -14.457 9.848 1.00 0.00 N ATOM 0 H ARG A 119 5.639 -14.861 3.211 1.00 0.00 H new ATOM 0 HA ARG A 119 4.922 -12.707 5.016 1.00 0.00 H new ATOM 0 HB2 ARG A 119 7.820 -13.013 4.164 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.144 -11.807 5.240 1.00 0.00 H new ATOM 0 HG2 ARG A 119 6.718 -13.479 6.956 1.00 0.00 H new ATOM 0 HG3 ARG A 119 7.167 -14.779 5.869 1.00 0.00 H new ATOM 0 HD2 ARG A 119 9.441 -14.304 5.998 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.182 -12.602 6.326 1.00 0.00 H new ATOM 0 HE ARG A 119 8.188 -13.718 8.603 1.00 0.00 H new ATOM 0 HH11 ARG A 119 11.155 -14.280 6.776 1.00 0.00 H new ATOM 0 HH12 ARG A 119 12.085 -14.741 8.205 1.00 0.00 H new ATOM 0 HH21 ARG A 119 9.388 -14.314 10.435 1.00 0.00 H new ATOM 0 HH22 ARG A 119 11.089 -14.760 10.267 1.00 0.00 H new ATOM 1788 N PHE A 120 5.753 -11.034 3.048 1.00 0.00 N ATOM 1789 CA PHE A 120 5.661 -10.208 1.849 1.00 0.00 C ATOM 1790 C PHE A 120 7.049 -9.827 1.342 1.00 0.00 C ATOM 1791 O PHE A 120 8.023 -9.838 2.096 1.00 0.00 O ATOM 1792 CB PHE A 120 4.847 -8.944 2.137 1.00 0.00 C ATOM 1793 CG PHE A 120 3.365 -9.141 1.992 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.641 -9.805 2.969 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.695 -8.660 0.878 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.278 -9.988 2.837 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.331 -8.839 0.741 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.622 -9.503 1.723 1.00 0.00 C ATOM 0 H PHE A 120 5.978 -10.519 3.899 1.00 0.00 H new ATOM 0 HA PHE A 120 5.158 -10.789 1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 120 5.063 -8.605 3.150 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.168 -8.152 1.460 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.148 -10.184 3.844 1.00 0.00 H new ATOM 0 HD2 PHE A 120 3.245 -8.139 0.108 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.726 -10.510 3.605 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.821 -8.460 -0.132 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.444 -9.643 1.620 1.00 0.00 H new ATOM 1808 N LYS A 121 7.132 -9.492 0.060 1.00 0.00 N ATOM 1809 CA LYS A 121 8.399 -9.107 -0.551 1.00 0.00 C ATOM 1810 C LYS A 121 8.260 -7.792 -1.312 1.00 0.00 C ATOM 1811 O LYS A 121 7.769 -7.766 -2.441 1.00 0.00 O ATOM 1812 CB LYS A 121 8.889 -10.206 -1.496 1.00 0.00 C ATOM 1813 CG LYS A 121 9.102 -11.546 -0.812 1.00 0.00 C ATOM 1814 CD LYS A 121 9.724 -12.561 -1.756 1.00 0.00 C ATOM 1815 CE LYS A 121 11.243 -12.502 -1.714 1.00 0.00 C ATOM 1816 NZ LYS A 121 11.860 -13.321 -2.795 1.00 0.00 N ATOM 0 H LYS A 121 6.336 -9.479 -0.578 1.00 0.00 H new ATOM 0 HA LYS A 121 9.130 -8.969 0.246 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.166 -10.330 -2.302 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.826 -9.889 -1.954 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.746 -11.414 0.057 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.148 -11.925 -0.447 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.390 -13.563 -1.486 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.379 -12.373 -2.773 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.569 -11.467 -1.812 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.594 -12.856 -0.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.896 -13.255 -2.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.569 -14.314 -2.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 11.546 -12.967 -3.721 1.00 0.00 H new ATOM 1830 N VAL A 122 8.696 -6.703 -0.688 1.00 0.00 N ATOM 1831 CA VAL A 122 8.621 -5.385 -1.308 1.00 0.00 C ATOM 1832 C VAL A 122 9.875 -5.090 -2.123 1.00 0.00 C ATOM 1833 O VAL A 122 10.995 -5.229 -1.630 1.00 0.00 O ATOM 1834 CB VAL A 122 8.435 -4.278 -0.253 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.270 -2.923 -0.924 1.00 0.00 C ATOM 1836 CG2 VAL A 122 7.244 -4.589 0.641 1.00 0.00 C ATOM 0 H VAL A 122 9.105 -6.707 0.246 1.00 0.00 H new ATOM 0 HA VAL A 122 7.755 -5.395 -1.970 1.00 0.00 H new ATOM 0 HB VAL A 122 9.328 -4.241 0.371 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.140 -2.154 -0.163 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.157 -2.700 -1.517 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.395 -2.943 -1.573 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.127 -3.797 1.380 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.341 -4.655 0.034 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.409 -5.539 1.150 1.00 0.00 H new ATOM 1846 N TYR A 123 9.680 -4.682 -3.371 1.00 0.00 N ATOM 1847 CA TYR A 123 10.796 -4.368 -4.257 1.00 0.00 C ATOM 1848 C TYR A 123 10.800 -2.888 -4.624 1.00 0.00 C ATOM 1849 O TYR A 123 9.752 -2.244 -4.665 1.00 0.00 O ATOM 1850 CB TYR A 123 10.722 -5.220 -5.525 1.00 0.00 C ATOM 1851 CG TYR A 123 10.670 -6.707 -5.254 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.457 -7.357 -5.071 1.00 0.00 C ATOM 1853 CD2 TYR A 123 11.835 -7.461 -5.182 1.00 0.00 C ATOM 1854 CE1 TYR A 123 9.405 -8.715 -4.822 1.00 0.00 C ATOM 1855 CE2 TYR A 123 11.793 -8.819 -4.936 1.00 0.00 C ATOM 1856 CZ TYR A 123 10.575 -9.442 -4.756 1.00 0.00 C ATOM 1857 OH TYR A 123 10.527 -10.795 -4.510 1.00 0.00 O ATOM 0 H TYR A 123 8.759 -4.561 -3.793 1.00 0.00 H new ATOM 0 HA TYR A 123 11.722 -4.595 -3.729 1.00 0.00 H new ATOM 0 HB2 TYR A 123 9.839 -4.932 -6.095 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.589 -5.003 -6.149 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.538 -6.792 -5.124 1.00 0.00 H new ATOM 0 HD2 TYR A 123 12.790 -6.976 -5.321 1.00 0.00 H new ATOM 0 HE1 TYR A 123 8.453 -9.205 -4.680 1.00 0.00 H new ATOM 0 HE2 TYR A 123 12.708 -9.390 -4.885 1.00 0.00 H new ATOM 0 HH TYR A 123 11.393 -11.198 -4.730 1.00 0.00 H new ATOM 1867 N ALA A 124 11.988 -2.355 -4.892 1.00 0.00 N ATOM 1868 CA ALA A 124 12.130 -0.951 -5.259 1.00 0.00 C ATOM 1869 C ALA A 124 13.094 -0.785 -6.428 1.00 0.00 C ATOM 1870 O ALA A 124 14.306 -0.926 -6.271 1.00 0.00 O ATOM 1871 CB ALA A 124 12.603 -0.138 -4.063 1.00 0.00 C ATOM 0 H ALA A 124 12.866 -2.874 -4.862 1.00 0.00 H new ATOM 0 HA ALA A 124 11.153 -0.582 -5.572 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.705 0.908 -4.351 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.876 -0.223 -3.255 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.568 -0.516 -3.724 1.00 0.00 H new ATOM 1877 N ASN A 125 12.548 -0.485 -7.602 1.00 0.00 N ATOM 1878 CA ASN A 125 13.360 -0.300 -8.799 1.00 0.00 C ATOM 1879 C ASN A 125 14.221 -1.531 -9.067 1.00 0.00 C ATOM 1880 O ASN A 125 15.348 -1.420 -9.547 1.00 0.00 O ATOM 1881 CB ASN A 125 14.249 0.936 -8.652 1.00 0.00 C ATOM 1882 CG ASN A 125 13.581 2.037 -7.851 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.662 2.699 -8.333 1.00 0.00 O ATOM 1884 ND2 ASN A 125 14.041 2.237 -6.622 1.00 0.00 N ATOM 0 H ASN A 125 11.546 -0.365 -7.750 1.00 0.00 H new ATOM 0 HA ASN A 125 12.688 -0.157 -9.645 1.00 0.00 H new ATOM 0 HB2 ASN A 125 15.183 0.653 -8.166 1.00 0.00 H new ATOM 0 HB3 ASN A 125 14.506 1.315 -9.641 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.631 2.964 -6.036 1.00 0.00 H new ATOM 0 HD22 ASN A 125 14.805 1.664 -6.264 1.00 0.00 H new ATOM 1891 N GLY A 126 13.681 -2.705 -8.752 1.00 0.00 N ATOM 1892 CA GLY A 126 14.413 -3.939 -8.966 1.00 0.00 C ATOM 1893 C GLY A 126 15.414 -4.219 -7.862 1.00 0.00 C ATOM 1894 O GLY A 126 16.460 -4.820 -8.103 1.00 0.00 O ATOM 0 H GLY A 126 12.750 -2.823 -8.353 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.709 -4.768 -9.033 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.935 -3.887 -9.921 1.00 0.00 H new ATOM 1898 N GLN A 127 15.092 -3.781 -6.649 1.00 0.00 N ATOM 1899 CA GLN A 127 15.972 -3.986 -5.505 1.00 0.00 C ATOM 1900 C GLN A 127 15.174 -4.383 -4.268 1.00 0.00 C ATOM 1901 O GLN A 127 14.260 -3.671 -3.851 1.00 0.00 O ATOM 1902 CB GLN A 127 16.777 -2.717 -5.221 1.00 0.00 C ATOM 1903 CG GLN A 127 17.556 -2.208 -6.423 1.00 0.00 C ATOM 1904 CD GLN A 127 18.872 -2.935 -6.616 1.00 0.00 C ATOM 1905 OE1 GLN A 127 19.976 -2.238 -6.373 1.00 0.00 O flip ATOM 1906 NE2 GLN A 127 18.897 -4.111 -6.981 1.00 0.00 N flip ATOM 0 H GLN A 127 14.229 -3.282 -6.433 1.00 0.00 H new ATOM 0 HA GLN A 127 16.658 -4.797 -5.748 1.00 0.00 H new ATOM 0 HB2 GLN A 127 16.098 -1.935 -4.881 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.472 -2.913 -4.405 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.948 -2.322 -7.320 1.00 0.00 H new ATOM 0 HG3 GLN A 127 17.749 -1.142 -6.301 1.00 0.00 H new ATOM 0 HE21 GLN A 127 18.024 -4.609 -7.157 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.790 -4.587 -7.108 1.00 0.00 H new ATOM 1915 N HIS A 128 15.524 -5.526 -3.685 1.00 0.00 N ATOM 1916 CA HIS A 128 14.840 -6.018 -2.495 1.00 0.00 C ATOM 1917 C HIS A 128 14.865 -4.974 -1.383 1.00 0.00 C ATOM 1918 O HIS A 128 15.875 -4.806 -0.698 1.00 0.00 O ATOM 1919 CB HIS A 128 15.488 -7.315 -2.009 1.00 0.00 C ATOM 1920 CG HIS A 128 14.905 -7.832 -0.730 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.587 -7.816 0.469 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.696 -8.381 -0.465 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.823 -8.334 1.414 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.670 -8.685 0.873 1.00 0.00 N ATOM 0 H HIS A 128 16.277 -6.128 -4.018 1.00 0.00 H new ATOM 0 HA HIS A 128 13.801 -6.216 -2.759 1.00 0.00 H new ATOM 0 HB2 HIS A 128 15.381 -8.077 -2.781 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.556 -7.148 -1.871 1.00 0.00 H new ATOM 0 HD1 HIS A 128 16.533 -7.460 0.605 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.900 -8.549 -1.175 1.00 0.00 H new ATOM 0 HE1 HIS A 128 15.095 -8.451 2.453 1.00 0.00 H new ATOM 1933 N LEU A 129 13.749 -4.275 -1.209 1.00 0.00 N ATOM 1934 CA LEU A 129 13.644 -3.247 -0.180 1.00 0.00 C ATOM 1935 C LEU A 129 13.629 -3.869 1.213 1.00 0.00 C ATOM 1936 O LEU A 129 14.585 -3.731 1.976 1.00 0.00 O ATOM 1937 CB LEU A 129 12.378 -2.414 -0.392 1.00 0.00 C ATOM 1938 CG LEU A 129 12.395 -1.005 0.202 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.375 -0.119 -0.552 1.00 0.00 C ATOM 1940 CD2 LEU A 129 10.999 -0.399 0.178 1.00 0.00 C ATOM 0 H LEU A 129 12.904 -4.401 -1.767 1.00 0.00 H new ATOM 0 HA LEU A 129 14.517 -2.599 -0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.196 -2.333 -1.464 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.534 -2.957 0.035 1.00 0.00 H new ATOM 0 HG LEU A 129 12.722 -1.073 1.239 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.373 0.880 -0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.377 -0.543 -0.483 1.00 0.00 H new ATOM 0 HD13 LEU A 129 13.078 -0.057 -1.599 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.030 0.604 0.605 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.644 -0.345 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.322 -1.021 0.763 1.00 0.00 H new ATOM 1952 N PHE A 130 12.539 -4.557 1.537 1.00 0.00 N ATOM 1953 CA PHE A 130 12.400 -5.202 2.837 1.00 0.00 C ATOM 1954 C PHE A 130 11.254 -6.209 2.825 1.00 0.00 C ATOM 1955 O PHE A 130 10.470 -6.262 1.877 1.00 0.00 O ATOM 1956 CB PHE A 130 12.162 -4.155 3.927 1.00 0.00 C ATOM 1957 CG PHE A 130 10.829 -3.472 3.821 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.660 -4.159 4.105 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.745 -2.143 3.438 1.00 0.00 C ATOM 1960 CE1 PHE A 130 8.431 -3.533 4.009 1.00 0.00 C ATOM 1961 CE2 PHE A 130 9.519 -1.512 3.341 1.00 0.00 C ATOM 1962 CZ PHE A 130 8.360 -2.208 3.625 1.00 0.00 C ATOM 0 H PHE A 130 11.739 -4.682 0.917 1.00 0.00 H new ATOM 0 HA PHE A 130 13.327 -5.735 3.051 1.00 0.00 H new ATOM 0 HB2 PHE A 130 12.239 -4.634 4.903 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.951 -3.404 3.877 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.709 -5.195 4.405 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.647 -1.594 3.213 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.527 -4.080 4.234 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.467 -0.475 3.043 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.401 -1.718 3.547 1.00 0.00 H new ATOM 1972 N ASP A 131 11.164 -7.007 3.884 1.00 0.00 N ATOM 1973 CA ASP A 131 10.115 -8.012 3.996 1.00 0.00 C ATOM 1974 C ASP A 131 9.125 -7.645 5.098 1.00 0.00 C ATOM 1975 O ASP A 131 9.436 -6.850 5.985 1.00 0.00 O ATOM 1976 CB ASP A 131 10.724 -9.387 4.279 1.00 0.00 C ATOM 1977 CG ASP A 131 11.447 -9.958 3.075 1.00 0.00 C ATOM 1978 OD1 ASP A 131 11.062 -9.619 1.937 1.00 0.00 O ATOM 1979 OD2 ASP A 131 12.397 -10.744 3.272 1.00 0.00 O ATOM 0 H ASP A 131 11.805 -6.977 4.677 1.00 0.00 H new ATOM 0 HA ASP A 131 9.579 -8.048 3.048 1.00 0.00 H new ATOM 0 HB2 ASP A 131 11.420 -9.308 5.114 1.00 0.00 H new ATOM 0 HB3 ASP A 131 9.936 -10.074 4.586 1.00 0.00 H new ATOM 1984 N PHE A 132 7.933 -8.227 5.034 1.00 0.00 N ATOM 1985 CA PHE A 132 6.897 -7.959 6.025 1.00 0.00 C ATOM 1986 C PHE A 132 6.307 -9.260 6.561 1.00 0.00 C ATOM 1987 O PHE A 132 5.520 -9.922 5.886 1.00 0.00 O ATOM 1988 CB PHE A 132 5.789 -7.097 5.415 1.00 0.00 C ATOM 1989 CG PHE A 132 4.417 -7.439 5.921 1.00 0.00 C ATOM 1990 CD1 PHE A 132 4.171 -7.541 7.281 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.372 -7.657 5.037 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.909 -7.856 7.749 1.00 0.00 C ATOM 1993 CE2 PHE A 132 2.108 -7.972 5.500 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.877 -8.071 6.858 1.00 0.00 C ATOM 0 H PHE A 132 7.660 -8.888 4.306 1.00 0.00 H new ATOM 0 HA PHE A 132 7.354 -7.419 6.854 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.996 -6.048 5.629 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.807 -7.210 4.331 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.974 -7.373 7.983 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.547 -7.580 3.974 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.731 -7.934 8.811 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.302 -8.140 4.801 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.890 -8.316 7.222 1.00 0.00 H new ATOM 2004 N ALA A 133 6.696 -9.620 7.780 1.00 0.00 N ATOM 2005 CA ALA A 133 6.205 -10.841 8.408 1.00 0.00 C ATOM 2006 C ALA A 133 4.695 -10.786 8.609 1.00 0.00 C ATOM 2007 O ALA A 133 4.154 -9.776 9.060 1.00 0.00 O ATOM 2008 CB ALA A 133 6.909 -11.069 9.738 1.00 0.00 C ATOM 0 H ALA A 133 7.349 -9.084 8.352 1.00 0.00 H new ATOM 0 HA ALA A 133 6.426 -11.677 7.744 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.533 -11.984 10.196 1.00 0.00 H new ATOM 0 HB2 ALA A 133 7.982 -11.161 9.571 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.717 -10.225 10.401 1.00 0.00 H new ATOM 2014 N HIS A 134 4.018 -11.879 8.271 1.00 0.00 N ATOM 2015 CA HIS A 134 2.568 -11.955 8.415 1.00 0.00 C ATOM 2016 C HIS A 134 2.153 -11.726 9.865 1.00 0.00 C ATOM 2017 O HIS A 134 2.308 -12.606 10.711 1.00 0.00 O ATOM 2018 CB HIS A 134 2.058 -13.314 7.935 1.00 0.00 C ATOM 2019 CG HIS A 134 2.060 -13.462 6.444 1.00 0.00 C ATOM 2020 ND1 HIS A 134 2.352 -14.527 5.661 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.735 -12.434 5.585 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.199 -14.127 4.356 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 1.826 -12.860 4.338 1.00 0.00 N flip ATOM 0 H HIS A 134 4.450 -12.724 7.896 1.00 0.00 H new ATOM 0 HA HIS A 134 2.125 -11.171 7.801 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.676 -14.099 8.371 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.044 -13.464 8.305 1.00 0.00 H new ATOM 0 HD1 HIS A 134 2.633 -15.454 5.981 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.450 -11.436 5.885 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.358 -14.747 3.486 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.640 -12.305 3.503 1.00 0.00 H new ATOM 2032 N ARG A 135 1.625 -10.538 10.143 1.00 0.00 N ATOM 2033 CA ARG A 135 1.190 -10.193 11.491 1.00 0.00 C ATOM 2034 C ARG A 135 -0.222 -10.708 11.755 1.00 0.00 C ATOM 2035 O ARG A 135 -0.463 -11.415 12.735 1.00 0.00 O ATOM 2036 CB ARG A 135 1.237 -8.677 11.692 1.00 0.00 C ATOM 2037 CG ARG A 135 2.641 -8.133 11.895 1.00 0.00 C ATOM 2038 CD ARG A 135 2.628 -6.842 12.698 1.00 0.00 C ATOM 2039 NE ARG A 135 3.849 -6.672 13.482 1.00 0.00 N ATOM 2040 CZ ARG A 135 4.134 -7.389 14.563 1.00 0.00 C ATOM 2041 NH1 ARG A 135 3.290 -8.319 14.987 1.00 0.00 N ATOM 2042 NH2 ARG A 135 5.265 -7.176 15.223 1.00 0.00 N ATOM 0 H ARG A 135 1.488 -9.799 9.453 1.00 0.00 H new ATOM 0 HA ARG A 135 1.870 -10.668 12.198 1.00 0.00 H new ATOM 0 HB2 ARG A 135 0.790 -8.190 10.825 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.626 -8.414 12.556 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.249 -8.877 12.410 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.107 -7.955 10.926 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.511 -5.996 12.021 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.766 -6.839 13.365 1.00 0.00 H new ATOM 0 HE ARG A 135 4.519 -5.964 13.183 1.00 0.00 H new ATOM 0 HH11 ARG A 135 2.419 -8.485 14.483 1.00 0.00 H new ATOM 0 HH12 ARG A 135 3.511 -8.868 15.818 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.917 -6.461 14.900 1.00 0.00 H new ATOM 0 HH22 ARG A 135 5.483 -7.727 16.053 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.151 -10.350 10.876 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.539 -10.776 11.013 1.00 0.00 C ATOM 2058 C LEU A 136 -2.788 -12.076 10.255 1.00 0.00 C ATOM 2059 O LEU A 136 -2.827 -12.091 9.025 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.481 -9.685 10.501 1.00 0.00 C ATOM 2061 CG LEU A 136 -4.958 -10.068 10.396 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.678 -9.780 11.704 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.621 -9.325 9.245 1.00 0.00 C ATOM 0 H LEU A 136 -0.968 -9.765 10.060 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.736 -10.951 12.071 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.396 -8.821 11.160 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.137 -9.369 9.516 1.00 0.00 H new ATOM 0 HG LEU A 136 -5.023 -11.138 10.197 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.728 -10.059 11.611 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.219 -10.357 12.507 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.604 -8.717 11.934 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.671 -9.610 9.185 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.545 -8.251 9.414 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.122 -9.582 8.311 1.00 0.00 H new ATOM 2075 N SER A 137 -2.958 -13.165 10.998 1.00 0.00 N ATOM 2076 CA SER A 137 -3.202 -14.470 10.395 1.00 0.00 C ATOM 2077 C SER A 137 -4.251 -14.372 9.292 1.00 0.00 C ATOM 2078 O SER A 137 -4.165 -15.060 8.275 1.00 0.00 O ATOM 2079 CB SER A 137 -3.658 -15.470 11.460 1.00 0.00 C ATOM 2080 OG SER A 137 -4.194 -16.639 10.866 1.00 0.00 O ATOM 0 H SER A 137 -2.931 -13.169 12.018 1.00 0.00 H new ATOM 0 HA SER A 137 -2.268 -14.819 9.954 1.00 0.00 H new ATOM 0 HB2 SER A 137 -2.815 -15.736 12.098 1.00 0.00 H new ATOM 0 HB3 SER A 137 -4.409 -15.007 12.100 1.00 0.00 H new ATOM 0 HG SER A 137 -4.476 -17.262 11.567 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.242 -13.511 9.500 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.307 -13.320 8.524 1.00 0.00 C ATOM 2088 C ALA A 138 -5.878 -12.353 7.426 1.00 0.00 C ATOM 2089 O ALA A 138 -6.704 -11.642 6.853 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.568 -12.818 9.210 1.00 0.00 C ATOM 0 H ALA A 138 -5.329 -12.934 10.337 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.519 -14.284 8.061 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.355 -12.680 8.469 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -7.893 -13.547 9.953 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.361 -11.867 9.701 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.581 -12.329 7.138 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.042 -11.447 6.109 1.00 0.00 C ATOM 2098 C PHE A 139 -4.857 -11.549 4.824 1.00 0.00 C ATOM 2099 O PHE A 139 -5.204 -10.537 4.215 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.578 -11.792 5.827 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.405 -13.015 4.973 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -2.321 -14.273 5.549 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -2.325 -12.908 3.594 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.162 -15.400 4.766 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -2.167 -14.032 2.805 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.083 -15.279 3.392 1.00 0.00 C ATOM 0 H PHE A 139 -3.883 -12.910 7.603 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.102 -10.422 6.476 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.101 -10.944 5.335 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.060 -11.943 6.774 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -2.381 -14.373 6.623 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -2.387 -11.935 3.130 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.100 -16.374 5.227 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -2.109 -13.935 1.731 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.956 -16.158 2.778 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.159 -12.778 4.417 1.00 0.00 N ATOM 2117 CA GLN A 140 -5.932 -13.012 3.203 1.00 0.00 C ATOM 2118 C GLN A 140 -7.170 -12.122 3.166 1.00 0.00 C ATOM 2119 O GLN A 140 -7.520 -11.572 2.122 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.344 -14.482 3.111 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.190 -14.952 4.283 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.089 -16.446 4.514 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -7.515 -17.246 3.680 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -6.523 -16.833 5.652 1.00 0.00 N ATOM 0 H GLN A 140 -4.880 -13.626 4.910 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.303 -12.764 2.348 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -6.901 -14.637 2.187 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.447 -15.099 3.051 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -6.877 -14.427 5.185 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.232 -14.686 4.104 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.183 -16.137 6.315 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.428 -17.827 5.862 1.00 0.00 H new ATOM 2133 N ARG A 141 -7.829 -11.985 4.312 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.029 -11.163 4.410 1.00 0.00 C ATOM 2135 C ARG A 141 -8.762 -9.749 3.901 1.00 0.00 C ATOM 2136 O ARG A 141 -9.589 -9.163 3.202 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.521 -11.111 5.858 1.00 0.00 C ATOM 2138 CG ARG A 141 -9.866 -12.475 6.432 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.658 -12.351 7.725 1.00 0.00 C ATOM 2140 NE ARG A 141 -12.057 -12.012 7.479 1.00 0.00 N ATOM 2141 CZ ARG A 141 -13.035 -12.258 8.343 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -12.769 -12.842 9.503 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -14.284 -11.920 8.048 1.00 0.00 N ATOM 0 H ARG A 141 -7.552 -12.433 5.186 1.00 0.00 H new ATOM 0 HA ARG A 141 -9.801 -11.615 3.787 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -8.753 -10.649 6.478 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.401 -10.470 5.911 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.444 -13.042 5.703 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -8.950 -13.035 6.618 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.604 -13.291 8.275 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.205 -11.586 8.356 1.00 0.00 H new ATOM 0 HE ARG A 141 -12.296 -11.562 6.595 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -11.811 -13.104 9.734 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -13.523 -13.029 10.164 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -14.494 -11.471 7.157 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -15.034 -12.110 8.713 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.603 -9.206 4.258 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.227 -7.862 3.837 1.00 0.00 C ATOM 2159 C VAL A 142 -7.426 -7.679 2.337 1.00 0.00 C ATOM 2160 O VAL A 142 -6.622 -8.149 1.531 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.759 -7.553 4.190 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.359 -6.185 3.660 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.545 -7.635 5.694 1.00 0.00 C ATOM 0 H VAL A 142 -6.908 -9.676 4.838 1.00 0.00 H new ATOM 0 HA VAL A 142 -7.876 -7.170 4.374 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.124 -8.300 3.714 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.319 -5.984 3.919 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.473 -6.167 2.576 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.997 -5.422 4.105 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.503 -7.414 5.926 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.189 -6.911 6.193 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.789 -8.639 6.042 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.503 -6.994 1.968 1.00 0.00 N ATOM 2174 CA ASP A 143 -8.808 -6.747 0.563 1.00 0.00 C ATOM 2175 C ASP A 143 -8.972 -5.254 0.297 1.00 0.00 C ATOM 2176 O ASP A 143 -9.700 -4.850 -0.610 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.081 -7.493 0.158 1.00 0.00 C ATOM 2178 CG ASP A 143 -11.307 -6.989 0.893 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -11.856 -5.945 0.484 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -11.716 -7.637 1.879 1.00 0.00 O ATOM 0 H ASP A 143 -9.179 -6.600 2.622 1.00 0.00 H new ATOM 0 HA ASP A 143 -7.974 -7.114 -0.035 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -10.235 -7.386 -0.916 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -9.954 -8.557 0.357 1.00 0.00 H new ATOM 2185 N THR A 144 -8.290 -4.438 1.094 1.00 0.00 N ATOM 2186 CA THR A 144 -8.361 -2.989 0.946 1.00 0.00 C ATOM 2187 C THR A 144 -6.975 -2.359 1.031 1.00 0.00 C ATOM 2188 O THR A 144 -6.243 -2.571 1.999 1.00 0.00 O ATOM 2189 CB THR A 144 -9.265 -2.359 2.022 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.301 -3.276 2.390 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.883 -1.063 1.518 1.00 0.00 C ATOM 0 H THR A 144 -7.682 -4.756 1.849 1.00 0.00 H new ATOM 0 HA THR A 144 -8.787 -2.792 -0.038 1.00 0.00 H new ATOM 0 HB THR A 144 -8.652 -2.135 2.895 1.00 0.00 H new ATOM 0 HG1 THR A 144 -10.934 -2.830 2.991 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.517 -0.636 2.295 1.00 0.00 H new ATOM 0 HG22 THR A 144 -9.092 -0.356 1.267 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.483 -1.267 0.631 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.620 -1.584 0.012 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.321 -0.922 -0.029 1.00 0.00 C ATOM 2201 C LEU A 145 -5.483 0.586 -0.195 1.00 0.00 C ATOM 2202 O LEU A 145 -5.829 1.067 -1.273 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.475 -1.484 -1.173 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.370 -0.570 -1.703 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.164 -0.598 -0.777 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -2.972 -0.978 -3.114 1.00 0.00 C ATOM 0 H LEU A 145 -7.213 -1.399 -0.797 1.00 0.00 H new ATOM 0 HA LEU A 145 -4.814 -1.113 0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -4.019 -2.415 -0.837 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.139 -1.735 -2.000 1.00 0.00 H new ATOM 0 HG LEU A 145 -3.753 0.450 -1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.388 0.058 -1.170 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.459 -0.257 0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.779 -1.616 -0.711 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.184 -0.317 -3.475 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.608 -2.005 -3.107 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -3.838 -0.904 -3.772 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.229 1.325 0.881 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.346 2.778 0.853 1.00 0.00 C ATOM 2220 C GLU A 146 -3.973 3.437 0.951 1.00 0.00 C ATOM 2221 O GLU A 146 -3.036 2.861 1.505 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.239 3.262 1.997 1.00 0.00 C ATOM 2223 CG GLU A 146 -5.981 2.549 3.314 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.729 3.177 4.474 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -6.490 4.370 4.757 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -7.553 2.476 5.098 1.00 0.00 O ATOM 0 H GLU A 146 -4.941 0.942 1.781 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.799 3.062 -0.097 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.087 4.332 2.137 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.283 3.122 1.716 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.275 1.504 3.220 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.912 2.562 3.526 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.863 4.645 0.409 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.605 5.382 0.436 1.00 0.00 C ATOM 2235 C ILE A 147 -2.839 6.856 0.746 1.00 0.00 C ATOM 2236 O ILE A 147 -3.465 7.573 -0.035 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.855 5.263 -0.904 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.670 3.791 -1.281 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.509 5.967 -0.821 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.557 3.559 -2.771 1.00 0.00 C ATOM 0 H ILE A 147 -4.629 5.134 -0.054 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.996 4.940 1.224 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.449 5.746 -1.680 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.773 3.409 -0.793 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.512 3.217 -0.895 1.00 0.00 H new ATOM 0 HG21 ILE A 147 0.009 5.874 -1.775 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.663 7.022 -0.593 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.093 5.510 -0.035 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.428 2.494 -2.965 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.464 3.910 -3.264 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.698 4.105 -3.160 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.330 7.303 1.889 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.482 8.693 2.302 1.00 0.00 C ATOM 2254 C GLN A 148 -1.126 9.323 2.603 1.00 0.00 C ATOM 2255 O GLN A 148 -0.098 8.649 2.578 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.386 8.786 3.532 1.00 0.00 C ATOM 2257 CG GLN A 148 -3.031 7.790 4.624 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.775 6.477 4.481 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -3.059 5.430 4.090 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -4.981 6.405 4.719 1.00 0.00 N flip ATOM 0 H GLN A 148 -1.808 6.723 2.546 1.00 0.00 H new ATOM 0 HA GLN A 148 -2.942 9.242 1.480 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.328 9.795 3.940 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.420 8.624 3.226 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -1.958 7.599 4.602 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.257 8.227 5.597 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.492 7.236 5.017 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.469 5.515 4.618 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.133 10.622 2.889 1.00 0.00 N ATOM 2270 CA GLY A 149 0.102 11.321 3.191 1.00 0.00 C ATOM 2271 C GLY A 149 0.541 12.236 2.065 1.00 0.00 C ATOM 2272 O GLY A 149 -0.290 12.853 1.398 1.00 0.00 O ATOM 0 H GLY A 149 -1.972 11.202 2.917 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -0.029 11.907 4.101 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.888 10.593 3.391 1.00 0.00 H new ATOM 2276 N ASP A 150 1.849 12.326 1.853 1.00 0.00 N ATOM 2277 CA ASP A 150 2.396 13.173 0.799 1.00 0.00 C ATOM 2278 C ASP A 150 3.087 12.332 -0.270 1.00 0.00 C ATOM 2279 O ASP A 150 4.273 12.020 -0.160 1.00 0.00 O ATOM 2280 CB ASP A 150 3.383 14.182 1.389 1.00 0.00 C ATOM 2281 CG ASP A 150 2.935 14.710 2.737 1.00 0.00 C ATOM 2282 OD1 ASP A 150 3.060 13.971 3.736 1.00 0.00 O ATOM 2283 OD2 ASP A 150 2.461 15.864 2.794 1.00 0.00 O ATOM 0 H ASP A 150 2.550 11.823 2.397 1.00 0.00 H new ATOM 0 HA ASP A 150 1.571 13.712 0.334 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.361 13.711 1.493 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.503 15.016 0.697 1.00 0.00 H new ATOM 2288 N VAL A 151 2.337 11.968 -1.305 1.00 0.00 N ATOM 2289 CA VAL A 151 2.876 11.164 -2.395 1.00 0.00 C ATOM 2290 C VAL A 151 2.149 11.452 -3.703 1.00 0.00 C ATOM 2291 O VAL A 151 0.947 11.722 -3.713 1.00 0.00 O ATOM 2292 CB VAL A 151 2.775 9.658 -2.085 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.338 9.275 -1.764 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.307 8.838 -3.250 1.00 0.00 C ATOM 0 H VAL A 151 1.354 12.217 -1.412 1.00 0.00 H new ATOM 0 HA VAL A 151 3.926 11.437 -2.499 1.00 0.00 H new ATOM 0 HB VAL A 151 3.388 9.442 -1.210 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.286 8.208 -1.548 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.997 9.839 -0.896 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.701 9.504 -2.618 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.228 7.777 -3.014 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.723 9.055 -4.144 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.352 9.093 -3.428 1.00 0.00 H new ATOM 2304 N THR A 152 2.885 11.393 -4.809 1.00 0.00 N ATOM 2305 CA THR A 152 2.310 11.648 -6.124 1.00 0.00 C ATOM 2306 C THR A 152 2.131 10.352 -6.906 1.00 0.00 C ATOM 2307 O THR A 152 3.052 9.889 -7.581 1.00 0.00 O ATOM 2308 CB THR A 152 3.189 12.612 -6.943 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.506 13.769 -6.163 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.482 13.034 -8.222 1.00 0.00 C ATOM 0 H THR A 152 3.880 11.171 -4.820 1.00 0.00 H new ATOM 0 HA THR A 152 1.335 12.107 -5.960 1.00 0.00 H new ATOM 0 HB THR A 152 4.109 12.092 -7.210 1.00 0.00 H new ATOM 0 HG1 THR A 152 4.066 14.376 -6.691 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.122 13.715 -8.784 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.269 12.153 -8.828 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.548 13.537 -7.972 1.00 0.00 H new ATOM 2318 N LEU A 153 0.940 9.771 -6.814 1.00 0.00 N ATOM 2319 CA LEU A 153 0.639 8.527 -7.514 1.00 0.00 C ATOM 2320 C LEU A 153 0.415 8.781 -9.002 1.00 0.00 C ATOM 2321 O LEU A 153 -0.338 9.677 -9.382 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.598 7.863 -6.906 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.471 7.413 -5.450 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.814 6.937 -4.920 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.576 6.316 -5.320 1.00 0.00 C ATOM 0 H LEU A 153 0.167 10.141 -6.261 1.00 0.00 H new ATOM 0 HA LEU A 153 1.493 7.859 -7.402 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.433 8.560 -6.978 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.855 6.995 -7.513 1.00 0.00 H new ATOM 0 HG LEU A 153 -0.150 8.266 -4.852 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.704 6.621 -3.883 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.537 7.751 -4.977 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.165 6.098 -5.520 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.653 6.008 -4.277 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.285 5.461 -5.930 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.541 6.692 -5.659 1.00 0.00 H new ATOM 2337 N SER A 154 1.071 7.983 -9.838 1.00 0.00 N ATOM 2338 CA SER A 154 0.945 8.122 -11.284 1.00 0.00 C ATOM 2339 C SER A 154 0.254 6.903 -11.889 1.00 0.00 C ATOM 2340 O SER A 154 -0.591 7.031 -12.774 1.00 0.00 O ATOM 2341 CB SER A 154 2.323 8.310 -11.922 1.00 0.00 C ATOM 2342 OG SER A 154 2.775 9.645 -11.776 1.00 0.00 O ATOM 0 H SER A 154 1.695 7.234 -9.539 1.00 0.00 H new ATOM 0 HA SER A 154 0.335 9.002 -11.488 1.00 0.00 H new ATOM 0 HB2 SER A 154 3.037 7.628 -11.460 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.275 8.053 -12.980 1.00 0.00 H new ATOM 0 HG SER A 154 3.658 9.739 -12.190 1.00 0.00 H new ATOM 2348 N TYR A 155 0.621 5.722 -11.404 1.00 0.00 N ATOM 2349 CA TYR A 155 0.040 4.480 -11.897 1.00 0.00 C ATOM 2350 C TYR A 155 -0.098 3.459 -10.772 1.00 0.00 C ATOM 2351 O TYR A 155 0.834 3.239 -9.999 1.00 0.00 O ATOM 2352 CB TYR A 155 0.899 3.901 -13.023 1.00 0.00 C ATOM 2353 CG TYR A 155 0.476 2.517 -13.457 1.00 0.00 C ATOM 2354 CD1 TYR A 155 0.771 1.403 -12.681 1.00 0.00 C ATOM 2355 CD2 TYR A 155 -0.220 2.323 -14.644 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.386 0.136 -13.075 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.610 1.059 -15.045 1.00 0.00 C ATOM 2358 CZ TYR A 155 -0.304 -0.031 -14.258 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.690 -1.291 -14.653 1.00 0.00 O ATOM 0 H TYR A 155 1.318 5.599 -10.670 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.954 4.703 -12.285 1.00 0.00 H new ATOM 0 HB2 TYR A 155 0.857 4.571 -13.882 1.00 0.00 H new ATOM 0 HB3 TYR A 155 1.938 3.868 -12.696 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.310 1.530 -11.754 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.460 3.174 -15.264 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.624 -0.719 -12.460 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -1.152 0.926 -15.970 1.00 0.00 H new ATOM 0 HH TYR A 155 -0.169 -1.961 -14.164 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.270 2.836 -10.687 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.532 1.837 -9.658 1.00 0.00 C ATOM 2371 C VAL A 156 -2.344 0.674 -10.216 1.00 0.00 C ATOM 2372 O VAL A 156 -3.483 0.851 -10.647 1.00 0.00 O ATOM 2373 CB VAL A 156 -2.284 2.447 -8.461 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.616 1.374 -7.435 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.466 3.564 -7.831 1.00 0.00 C ATOM 0 H VAL A 156 -2.053 3.006 -11.319 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.563 1.470 -9.319 1.00 0.00 H new ATOM 0 HB VAL A 156 -3.220 2.873 -8.822 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -3.147 1.824 -6.596 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.245 0.612 -7.896 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.694 0.916 -7.077 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -2.013 3.984 -6.987 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.513 3.166 -7.484 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -1.286 4.344 -8.570 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.750 -0.515 -10.205 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.420 -1.708 -10.710 1.00 0.00 C ATOM 2387 C GLN A 157 -2.249 -2.878 -9.747 1.00 0.00 C ATOM 2388 O GLN A 157 -1.128 -3.239 -9.386 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.870 -2.082 -12.088 1.00 0.00 C ATOM 2390 CG GLN A 157 -2.336 -3.442 -12.580 1.00 0.00 C ATOM 2391 CD GLN A 157 -2.407 -3.523 -14.092 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -1.412 -3.812 -14.757 1.00 0.00 O ATOM 2393 NE2 GLN A 157 -3.587 -3.267 -14.644 1.00 0.00 N ATOM 0 H GLN A 157 -0.807 -0.678 -9.852 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.484 -1.487 -10.798 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -2.171 -1.322 -12.809 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.781 -2.072 -12.050 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.657 -4.210 -12.210 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -3.319 -3.658 -12.162 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -4.385 -3.032 -14.055 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -3.695 -3.306 -15.658 1.00 0.00 H new ATOM 2402 N ILE A 158 -3.367 -3.465 -9.333 1.00 0.00 N ATOM 2403 CA ILE A 158 -3.340 -4.594 -8.412 1.00 0.00 C ATOM 2404 C ILE A 158 -3.439 -5.918 -9.162 1.00 0.00 C ATOM 2405 O ILE A 158 -4.532 -6.441 -9.379 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.486 -4.512 -7.386 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.412 -3.194 -6.612 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.431 -5.696 -6.433 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.750 -2.732 -6.077 1.00 0.00 C ATOM 0 H ILE A 158 -4.302 -3.177 -9.621 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.387 -4.548 -7.885 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.435 -4.546 -7.920 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.717 -3.309 -5.780 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -4.004 -2.422 -7.264 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.247 -5.623 -5.714 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.527 -6.623 -6.998 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.479 -5.692 -5.902 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.622 -1.792 -5.540 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.442 -2.585 -6.906 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.151 -3.486 -5.399 1.00 0.00 H new ATOM 2421 N SER A 159 -2.289 -6.457 -9.555 1.00 0.00 N ATOM 2422 CA SER A 159 -2.245 -7.720 -10.283 1.00 0.00 C ATOM 2423 C SER A 159 -2.639 -8.882 -9.377 1.00 0.00 C ATOM 2424 O SER A 159 -2.209 -8.962 -8.228 1.00 0.00 O ATOM 2425 CB SER A 159 -0.846 -7.955 -10.855 1.00 0.00 C ATOM 2426 OG SER A 159 0.065 -8.331 -9.836 1.00 0.00 O ATOM 0 H SER A 159 -1.375 -6.039 -9.381 1.00 0.00 H new ATOM 0 HA SER A 159 -2.960 -7.663 -11.104 1.00 0.00 H new ATOM 0 HB2 SER A 159 -0.887 -8.734 -11.616 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.493 -7.048 -11.346 1.00 0.00 H new ATOM 0 HG SER A 159 -0.004 -7.702 -9.087 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.462 -9.784 -9.906 1.00 0.00 N ATOM 2433 CA GLY A 160 -3.901 -10.931 -9.133 1.00 0.00 C ATOM 2434 C GLY A 160 -3.927 -12.206 -9.951 1.00 0.00 C ATOM 2435 O GLY A 160 -3.492 -12.239 -11.103 1.00 0.00 O ATOM 0 H GLY A 160 -3.832 -9.740 -10.856 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -3.238 -11.065 -8.279 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -4.897 -10.738 -8.736 1.00 0.00 H new ATOM 2439 N PRO A 161 -4.446 -13.288 -9.352 1.00 0.00 N ATOM 2440 CA PRO A 161 -4.539 -14.592 -10.015 1.00 0.00 C ATOM 2441 C PRO A 161 -5.569 -14.599 -11.139 1.00 0.00 C ATOM 2442 O PRO A 161 -6.725 -14.229 -10.937 1.00 0.00 O ATOM 2443 CB PRO A 161 -4.971 -15.533 -8.888 1.00 0.00 C ATOM 2444 CG PRO A 161 -5.674 -14.656 -7.910 1.00 0.00 C ATOM 2445 CD PRO A 161 -4.984 -13.321 -7.982 1.00 0.00 C ATOM 0 HA PRO A 161 -3.599 -14.876 -10.489 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -5.629 -16.319 -9.259 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -4.112 -16.025 -8.432 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -6.731 -14.563 -8.158 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -5.618 -15.071 -6.903 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -5.678 -12.500 -7.803 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -4.192 -13.237 -7.237 1.00 0.00 H new ATOM 2453 N SER A 162 -5.142 -15.023 -12.325 1.00 0.00 N ATOM 2454 CA SER A 162 -6.027 -15.075 -13.482 1.00 0.00 C ATOM 2455 C SER A 162 -5.549 -16.121 -14.485 1.00 0.00 C ATOM 2456 O SER A 162 -4.429 -16.048 -14.990 1.00 0.00 O ATOM 2457 CB SER A 162 -6.100 -13.703 -14.157 1.00 0.00 C ATOM 2458 OG SER A 162 -7.042 -12.866 -13.508 1.00 0.00 O ATOM 0 H SER A 162 -4.189 -15.335 -12.509 1.00 0.00 H new ATOM 0 HA SER A 162 -7.021 -15.356 -13.135 1.00 0.00 H new ATOM 0 HB2 SER A 162 -5.117 -13.232 -14.139 1.00 0.00 H new ATOM 0 HB3 SER A 162 -6.376 -13.824 -15.204 1.00 0.00 H new ATOM 0 HG SER A 162 -7.222 -13.212 -12.609 1.00 0.00 H new ATOM 2464 N SER A 163 -6.408 -17.096 -14.767 1.00 0.00 N ATOM 2465 CA SER A 163 -6.074 -18.161 -15.705 1.00 0.00 C ATOM 2466 C SER A 163 -6.891 -18.032 -16.987 1.00 0.00 C ATOM 2467 O SER A 163 -8.103 -17.821 -16.945 1.00 0.00 O ATOM 2468 CB SER A 163 -6.319 -19.529 -15.066 1.00 0.00 C ATOM 2469 OG SER A 163 -5.860 -20.574 -15.905 1.00 0.00 O ATOM 0 H SER A 163 -7.340 -17.170 -14.359 1.00 0.00 H new ATOM 0 HA SER A 163 -5.017 -18.070 -15.957 1.00 0.00 H new ATOM 0 HB2 SER A 163 -5.809 -19.581 -14.104 1.00 0.00 H new ATOM 0 HB3 SER A 163 -7.384 -19.657 -14.870 1.00 0.00 H new ATOM 0 HG SER A 163 -6.027 -21.438 -15.473 1.00 0.00 H new ATOM 2475 N GLY A 164 -6.219 -18.161 -18.126 1.00 0.00 N ATOM 2476 CA GLY A 164 -6.898 -18.056 -19.405 1.00 0.00 C ATOM 2477 C GLY A 164 -8.155 -18.900 -19.464 1.00 0.00 C ATOM 2478 O GLY A 164 -8.694 -19.147 -20.543 1.00 0.00 O ATOM 0 H GLY A 164 -5.216 -18.336 -18.187 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -7.155 -17.013 -19.592 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -6.219 -18.365 -20.200 1.00 0.00 H new TER 2482 GLY A 164