USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=40 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 180:sc= -0.328 USER MOD Set 1.2: A 157 GLN :FLIP amide:sc= -0.702 F(o=-1.7,f=-1) USER MOD Set 2.1: A 121 LYS NZ :NH3+ -170:sc= 0.351 (180deg=0) USER MOD Set 2.2: A 123 TYR OH : rot 165:sc= 0.335 USER MOD Set 3.1: A 78 ASN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Set 3.2: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 65 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 88 ASN :FLIP amide:sc= -5.88! C(o=-6.7!,f=-5.9!) USER MOD Set 5.1: A 59 ASN : amide:sc= -3.97 K(o=-20,f=-27!) USER MOD Set 5.2: A 71 HIS : no HD1:sc= -4.13 X(o=-20,f=-20!) USER MOD Set 5.3: A 73 ASN :FLIP amide:sc= -9.32! C(o=-21!,f=-20!) USER MOD Set 5.4: A 84 ASN : amide:sc= -2.46! X(o=-20!,f=-20) USER MOD Set 6.1: A 17 MET CE :methyl 143:sc= -3.06! (180deg=-3.42!) USER MOD Set 6.2: A 22 THR OG1 : rot -150:sc= 0 USER MOD Set 6.3: A 29 TYR OH : rot 120:sc= 0.555 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 28:sc= 0.0237 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc=-0.00565 X(o=-0.0057,f=-0.0057) USER MOD Single : A 9 GLN : amide:sc= -0.417 X(o=-0.42,f=-0.63) USER MOD Single : A 10 GLN : amide:sc=-0.00164 X(o=-0.0016,f=-0.0016) USER MOD Single : A 12 ASN : amide:sc= -0.355 K(o=-0.36,f=-3.3!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0732 X(o=-0.073,f=0) USER MOD Single : A 34 GLN : amide:sc= -0.0392 X(o=-0.039,f=-0.26) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.736 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -164:sc= -0.781 (180deg=-1.17) USER MOD Single : A 48 TYR OH : rot -140:sc= -0.56 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 76 MET CE :methyl 165:sc= -2.98! (180deg=-3.66!) USER MOD Single : A 85 SER OG : rot 6:sc= 1.16 USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 26:sc= 1.12 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= -2.18 K(o=-2.2,f=-3.1!) USER MOD Single : A 101 ASN : amide:sc= -2.7! C(o=-2.7!,f=-6.7!) USER MOD Single : A 107 GLN : amide:sc= -0.578 X(o=-0.58,f=-0.25) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 CYS SG : rot -79:sc= -1.09 USER MOD Single : A 125 ASN : amide:sc= -0.0297 K(o=-0.03,f=-1.9!) USER MOD Single : A 127 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 134 HIS :FLIP no HD1:sc= -5.01! C(o=-7.4!,f=-5!) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0.0914 K(o=0.091,f=-8.4!) USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.132 USER MOD Single : A 148 GLN :FLIP amide:sc= -0.199 F(o=-0.91,f=-0.2) 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 180:sc= 0 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.789 -26.372 -3.877 1.00 0.00 N ATOM 2 CA GLY A 1 -3.574 -26.272 -5.093 1.00 0.00 C ATOM 3 C GLY A 1 -5.025 -25.928 -4.821 1.00 0.00 C ATOM 4 O GLY A 1 -5.773 -26.745 -4.285 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.805 -26.609 -4.117 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.813 -25.463 -3.373 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.185 -27.116 -3.268 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -3.139 -25.511 -5.741 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -3.523 -27.217 -5.633 1.00 0.00 H new ATOM 8 N SER A 2 -5.423 -24.715 -5.189 1.00 0.00 N ATOM 9 CA SER A 2 -6.793 -24.263 -4.977 1.00 0.00 C ATOM 10 C SER A 2 -7.109 -23.056 -5.855 1.00 0.00 C ATOM 11 O SER A 2 -6.317 -22.119 -5.951 1.00 0.00 O ATOM 12 CB SER A 2 -7.012 -23.907 -3.505 1.00 0.00 C ATOM 13 OG SER A 2 -8.246 -23.236 -3.321 1.00 0.00 O ATOM 0 H SER A 2 -4.816 -24.027 -5.636 1.00 0.00 H new ATOM 0 HA SER A 2 -7.465 -25.076 -5.252 1.00 0.00 H new ATOM 0 HB2 SER A 2 -6.994 -24.815 -2.902 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.195 -23.276 -3.155 1.00 0.00 H new ATOM 0 HG SER A 2 -8.363 -23.021 -2.372 1.00 0.00 H new ATOM 19 N SER A 3 -8.274 -23.087 -6.496 1.00 0.00 N ATOM 20 CA SER A 3 -8.695 -21.999 -7.370 1.00 0.00 C ATOM 21 C SER A 3 -10.171 -22.133 -7.732 1.00 0.00 C ATOM 22 O SER A 3 -10.646 -23.221 -8.056 1.00 0.00 O ATOM 23 CB SER A 3 -7.845 -21.981 -8.642 1.00 0.00 C ATOM 24 OG SER A 3 -8.101 -20.817 -9.410 1.00 0.00 O ATOM 0 H SER A 3 -8.943 -23.854 -6.426 1.00 0.00 H new ATOM 0 HA SER A 3 -8.554 -21.060 -6.834 1.00 0.00 H new ATOM 0 HB2 SER A 3 -6.788 -22.021 -8.378 1.00 0.00 H new ATOM 0 HB3 SER A 3 -8.058 -22.868 -9.238 1.00 0.00 H new ATOM 0 HG SER A 3 -7.544 -20.828 -10.217 1.00 0.00 H new ATOM 30 N GLY A 4 -10.892 -21.017 -7.674 1.00 0.00 N ATOM 31 CA GLY A 4 -12.306 -21.030 -7.998 1.00 0.00 C ATOM 32 C GLY A 4 -13.183 -20.869 -6.772 1.00 0.00 C ATOM 33 O GLY A 4 -13.186 -21.724 -5.886 1.00 0.00 O ATOM 0 H GLY A 4 -10.522 -20.105 -7.408 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -12.521 -20.227 -8.703 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.553 -21.967 -8.497 1.00 0.00 H new ATOM 37 N SER A 5 -13.928 -19.769 -6.719 1.00 0.00 N ATOM 38 CA SER A 5 -14.809 -19.496 -5.590 1.00 0.00 C ATOM 39 C SER A 5 -16.068 -18.767 -6.047 1.00 0.00 C ATOM 40 O SER A 5 -16.001 -17.829 -6.842 1.00 0.00 O ATOM 41 CB SER A 5 -14.077 -18.663 -4.535 1.00 0.00 C ATOM 42 OG SER A 5 -13.409 -19.494 -3.602 1.00 0.00 O ATOM 0 H SER A 5 -13.939 -19.053 -7.445 1.00 0.00 H new ATOM 0 HA SER A 5 -15.102 -20.449 -5.151 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.357 -18.006 -5.022 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.789 -18.024 -4.013 1.00 0.00 H new ATOM 0 HG SER A 5 -13.165 -20.340 -4.033 1.00 0.00 H new ATOM 48 N SER A 6 -17.215 -19.205 -5.539 1.00 0.00 N ATOM 49 CA SER A 6 -18.492 -18.597 -5.897 1.00 0.00 C ATOM 50 C SER A 6 -19.211 -18.073 -4.658 1.00 0.00 C ATOM 51 O SER A 6 -19.685 -18.848 -3.827 1.00 0.00 O ATOM 52 CB SER A 6 -19.377 -19.610 -6.625 1.00 0.00 C ATOM 53 OG SER A 6 -18.698 -20.178 -7.732 1.00 0.00 O ATOM 0 H SER A 6 -17.287 -19.979 -4.878 1.00 0.00 H new ATOM 0 HA SER A 6 -18.292 -17.757 -6.562 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.676 -20.398 -5.934 1.00 0.00 H new ATOM 0 HB3 SER A 6 -20.290 -19.121 -6.966 1.00 0.00 H new ATOM 0 HG SER A 6 -19.284 -20.823 -8.179 1.00 0.00 H new ATOM 59 N GLY A 7 -19.289 -16.751 -4.540 1.00 0.00 N ATOM 60 CA GLY A 7 -19.951 -16.146 -3.400 1.00 0.00 C ATOM 61 C GLY A 7 -19.475 -14.731 -3.137 1.00 0.00 C ATOM 62 O GLY A 7 -18.273 -14.464 -3.127 1.00 0.00 O ATOM 0 H GLY A 7 -18.905 -16.088 -5.214 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -21.027 -16.138 -3.571 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -19.773 -16.756 -2.515 1.00 0.00 H new ATOM 66 N HIS A 8 -20.420 -13.820 -2.925 1.00 0.00 N ATOM 67 CA HIS A 8 -20.091 -12.423 -2.662 1.00 0.00 C ATOM 68 C HIS A 8 -21.018 -11.837 -1.603 1.00 0.00 C ATOM 69 O HIS A 8 -22.094 -12.373 -1.341 1.00 0.00 O ATOM 70 CB HIS A 8 -20.185 -11.604 -3.950 1.00 0.00 C ATOM 71 CG HIS A 8 -19.096 -11.905 -4.932 1.00 0.00 C ATOM 72 ND1 HIS A 8 -17.797 -11.471 -4.773 1.00 0.00 N ATOM 73 CD2 HIS A 8 -19.118 -12.604 -6.092 1.00 0.00 C ATOM 74 CE1 HIS A 8 -17.067 -11.888 -5.792 1.00 0.00 C ATOM 75 NE2 HIS A 8 -17.845 -12.578 -6.607 1.00 0.00 N ATOM 0 H HIS A 8 -21.419 -14.024 -2.930 1.00 0.00 H new ATOM 0 HA HIS A 8 -19.068 -12.380 -2.287 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -21.150 -11.792 -4.421 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -20.154 -10.544 -3.700 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -19.977 -13.091 -6.530 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -16.014 -11.697 -5.935 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -17.548 -13.020 -7.477 1.00 0.00 H new ATOM 84 N GLN A 9 -20.593 -10.733 -0.996 1.00 0.00 N ATOM 85 CA GLN A 9 -21.386 -10.075 0.036 1.00 0.00 C ATOM 86 C GLN A 9 -22.158 -8.894 -0.541 1.00 0.00 C ATOM 87 O GLN A 9 -21.727 -8.275 -1.513 1.00 0.00 O ATOM 88 CB GLN A 9 -20.483 -9.601 1.177 1.00 0.00 C ATOM 89 CG GLN A 9 -20.155 -10.690 2.186 1.00 0.00 C ATOM 90 CD GLN A 9 -21.395 -11.312 2.797 1.00 0.00 C ATOM 91 OE1 GLN A 9 -22.387 -10.627 3.049 1.00 0.00 O ATOM 92 NE2 GLN A 9 -21.345 -12.617 3.039 1.00 0.00 N ATOM 0 H GLN A 9 -19.705 -10.276 -1.201 1.00 0.00 H new ATOM 0 HA GLN A 9 -22.103 -10.798 0.425 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -19.554 -9.214 0.757 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -20.969 -8.773 1.693 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -19.566 -11.467 1.698 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -19.535 -10.271 2.979 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -20.502 -13.145 2.814 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -22.150 -13.091 3.450 1.00 0.00 H new ATOM 101 N GLN A 10 -23.302 -8.589 0.064 1.00 0.00 N ATOM 102 CA GLN A 10 -24.135 -7.482 -0.392 1.00 0.00 C ATOM 103 C GLN A 10 -24.082 -6.319 0.593 1.00 0.00 C ATOM 104 O GLN A 10 -24.722 -6.354 1.646 1.00 0.00 O ATOM 105 CB GLN A 10 -25.581 -7.946 -0.574 1.00 0.00 C ATOM 106 CG GLN A 10 -25.849 -8.586 -1.927 1.00 0.00 C ATOM 107 CD GLN A 10 -25.350 -10.016 -2.006 1.00 0.00 C ATOM 108 OE1 GLN A 10 -25.893 -10.911 -1.358 1.00 0.00 O ATOM 109 NE2 GLN A 10 -24.311 -10.238 -2.802 1.00 0.00 N ATOM 0 H GLN A 10 -23.673 -9.092 0.870 1.00 0.00 H new ATOM 0 HA GLN A 10 -23.747 -7.140 -1.351 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -25.826 -8.661 0.212 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -26.247 -7.092 -0.447 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -26.920 -8.568 -2.127 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -25.369 -7.994 -2.706 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -23.892 -9.466 -3.321 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -23.932 -11.180 -2.895 1.00 0.00 H new ATOM 118 N LEU A 11 -23.316 -5.291 0.246 1.00 0.00 N ATOM 119 CA LEU A 11 -23.179 -4.116 1.101 1.00 0.00 C ATOM 120 C LEU A 11 -23.122 -2.840 0.267 1.00 0.00 C ATOM 121 O LEU A 11 -22.779 -2.874 -0.914 1.00 0.00 O ATOM 122 CB LEU A 11 -21.921 -4.232 1.963 1.00 0.00 C ATOM 123 CG LEU A 11 -22.025 -5.150 3.182 1.00 0.00 C ATOM 124 CD1 LEU A 11 -20.653 -5.682 3.568 1.00 0.00 C ATOM 125 CD2 LEU A 11 -22.662 -4.413 4.351 1.00 0.00 C ATOM 0 H LEU A 11 -22.780 -5.247 -0.621 1.00 0.00 H new ATOM 0 HA LEU A 11 -24.053 -4.065 1.750 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -21.105 -4.588 1.334 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -21.647 -3.235 2.307 1.00 0.00 H new ATOM 0 HG LEU A 11 -22.660 -5.997 2.923 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -20.747 -6.333 4.437 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -20.234 -6.247 2.735 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -19.994 -4.848 3.809 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -22.728 -5.081 5.210 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -22.053 -3.547 4.611 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -23.662 -4.082 4.071 1.00 0.00 H new ATOM 137 N ASN A 12 -23.460 -1.717 0.891 1.00 0.00 N ATOM 138 CA ASN A 12 -23.446 -0.429 0.207 1.00 0.00 C ATOM 139 C ASN A 12 -22.048 0.183 0.227 1.00 0.00 C ATOM 140 O ASN A 12 -21.882 1.369 0.510 1.00 0.00 O ATOM 141 CB ASN A 12 -24.444 0.530 0.860 1.00 0.00 C ATOM 142 CG ASN A 12 -23.979 1.009 2.222 1.00 0.00 C ATOM 143 OD1 ASN A 12 -23.517 0.219 3.045 1.00 0.00 O ATOM 144 ND2 ASN A 12 -24.100 2.309 2.464 1.00 0.00 N ATOM 0 H ASN A 12 -23.747 -1.672 1.869 1.00 0.00 H new ATOM 0 HA ASN A 12 -23.736 -0.594 -0.831 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -24.597 1.390 0.208 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -25.408 0.032 0.963 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -23.804 2.690 3.363 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -24.489 2.926 1.751 1.00 0.00 H new ATOM 151 N SER A 13 -21.046 -0.636 -0.076 1.00 0.00 N ATOM 152 CA SER A 13 -19.662 -0.177 -0.090 1.00 0.00 C ATOM 153 C SER A 13 -19.287 0.377 -1.461 1.00 0.00 C ATOM 154 O SER A 13 -19.913 0.047 -2.469 1.00 0.00 O ATOM 155 CB SER A 13 -18.719 -1.322 0.285 1.00 0.00 C ATOM 156 OG SER A 13 -18.551 -1.406 1.689 1.00 0.00 O ATOM 0 H SER A 13 -21.167 -1.620 -0.315 1.00 0.00 H new ATOM 0 HA SER A 13 -19.563 0.622 0.645 1.00 0.00 H new ATOM 0 HB2 SER A 13 -19.117 -2.264 -0.094 1.00 0.00 H new ATOM 0 HB3 SER A 13 -17.751 -1.170 -0.192 1.00 0.00 H new ATOM 0 HG SER A 13 -17.946 -2.146 1.902 1.00 0.00 H new ATOM 162 N LEU A 14 -18.262 1.222 -1.490 1.00 0.00 N ATOM 163 CA LEU A 14 -17.802 1.823 -2.737 1.00 0.00 C ATOM 164 C LEU A 14 -17.770 0.792 -3.860 1.00 0.00 C ATOM 165 O LEU A 14 -17.588 -0.404 -3.633 1.00 0.00 O ATOM 166 CB LEU A 14 -16.411 2.433 -2.549 1.00 0.00 C ATOM 167 CG LEU A 14 -16.302 3.548 -1.508 1.00 0.00 C ATOM 168 CD1 LEU A 14 -14.874 3.664 -0.999 1.00 0.00 C ATOM 169 CD2 LEU A 14 -16.771 4.872 -2.094 1.00 0.00 C ATOM 0 H LEU A 14 -17.734 1.506 -0.665 1.00 0.00 H new ATOM 0 HA LEU A 14 -18.504 2.610 -3.012 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.721 1.636 -2.272 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -16.076 2.825 -3.509 1.00 0.00 H new ATOM 0 HG LEU A 14 -16.947 3.298 -0.666 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -14.815 4.462 -0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -14.573 2.722 -0.541 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -14.208 3.891 -1.832 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -16.687 5.654 -1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -16.152 5.129 -2.954 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -17.811 4.783 -2.409 1.00 0.00 H new ATOM 181 N PRO A 15 -17.949 1.264 -5.103 1.00 0.00 N ATOM 182 CA PRO A 15 -17.942 0.400 -6.287 1.00 0.00 C ATOM 183 C PRO A 15 -16.555 -0.154 -6.592 1.00 0.00 C ATOM 184 O PRO A 15 -15.544 0.394 -6.151 1.00 0.00 O ATOM 185 CB PRO A 15 -18.405 1.333 -7.409 1.00 0.00 C ATOM 186 CG PRO A 15 -18.032 2.698 -6.945 1.00 0.00 C ATOM 187 CD PRO A 15 -18.171 2.679 -5.448 1.00 0.00 C ATOM 0 HA PRO A 15 -18.575 -0.478 -6.156 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -17.918 1.089 -8.353 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -19.479 1.251 -7.574 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -17.012 2.945 -7.239 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -18.683 3.452 -7.388 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -17.440 3.329 -4.968 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -19.157 3.020 -5.132 1.00 0.00 H new ATOM 195 N THR A 16 -16.512 -1.245 -7.351 1.00 0.00 N ATOM 196 CA THR A 16 -15.249 -1.874 -7.715 1.00 0.00 C ATOM 197 C THR A 16 -14.616 -1.181 -8.916 1.00 0.00 C ATOM 198 O THR A 16 -15.306 -0.808 -9.864 1.00 0.00 O ATOM 199 CB THR A 16 -15.438 -3.368 -8.039 1.00 0.00 C ATOM 200 OG1 THR A 16 -14.169 -3.975 -8.306 1.00 0.00 O ATOM 201 CG2 THR A 16 -16.356 -3.550 -9.238 1.00 0.00 C ATOM 0 H THR A 16 -17.338 -1.711 -7.726 1.00 0.00 H new ATOM 0 HA THR A 16 -14.588 -1.778 -6.854 1.00 0.00 H new ATOM 0 HB THR A 16 -15.896 -3.850 -7.175 1.00 0.00 H new ATOM 0 HG1 THR A 16 -14.297 -4.925 -8.510 1.00 0.00 H new ATOM 0 HG21 THR A 16 -16.474 -4.613 -9.448 1.00 0.00 H new ATOM 0 HG22 THR A 16 -17.330 -3.113 -9.020 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.922 -3.055 -10.107 1.00 0.00 H new ATOM 209 N MET A 17 -13.298 -1.013 -8.870 1.00 0.00 N ATOM 210 CA MET A 17 -12.572 -0.366 -9.957 1.00 0.00 C ATOM 211 C MET A 17 -12.077 -1.395 -10.967 1.00 0.00 C ATOM 212 O MET A 17 -10.943 -1.318 -11.439 1.00 0.00 O ATOM 213 CB MET A 17 -11.391 0.434 -9.404 1.00 0.00 C ATOM 214 CG MET A 17 -10.386 -0.415 -8.642 1.00 0.00 C ATOM 215 SD MET A 17 -8.910 0.509 -8.174 1.00 0.00 S ATOM 216 CE MET A 17 -7.933 -0.780 -7.404 1.00 0.00 C ATOM 0 H MET A 17 -12.712 -1.316 -8.092 1.00 0.00 H new ATOM 0 HA MET A 17 -13.256 0.314 -10.464 1.00 0.00 H new ATOM 0 HB2 MET A 17 -10.882 0.932 -10.229 1.00 0.00 H new ATOM 0 HB3 MET A 17 -11.769 1.215 -8.744 1.00 0.00 H new ATOM 0 HG2 MET A 17 -10.860 -0.814 -7.745 1.00 0.00 H new ATOM 0 HG3 MET A 17 -10.097 -1.268 -9.256 1.00 0.00 H new ATOM 0 HE1 MET A 17 -6.880 -0.632 -7.646 1.00 0.00 H new ATOM 0 HE2 MET A 17 -8.066 -0.741 -6.323 1.00 0.00 H new ATOM 0 HE3 MET A 17 -8.257 -1.753 -7.774 1.00 0.00 H new ATOM 226 N GLU A 18 -12.934 -2.358 -11.294 1.00 0.00 N ATOM 227 CA GLU A 18 -12.580 -3.403 -12.248 1.00 0.00 C ATOM 228 C GLU A 18 -12.329 -2.812 -13.633 1.00 0.00 C ATOM 229 O GLU A 18 -12.803 -1.723 -13.951 1.00 0.00 O ATOM 230 CB GLU A 18 -13.691 -4.452 -12.323 1.00 0.00 C ATOM 231 CG GLU A 18 -15.016 -3.902 -12.824 1.00 0.00 C ATOM 232 CD GLU A 18 -15.881 -4.966 -13.472 1.00 0.00 C ATOM 233 OE1 GLU A 18 -16.091 -6.024 -12.843 1.00 0.00 O ATOM 234 OE2 GLU A 18 -16.349 -4.740 -14.608 1.00 0.00 O ATOM 0 H GLU A 18 -13.877 -2.436 -10.913 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.662 -3.880 -11.903 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -13.371 -5.261 -12.980 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -13.838 -4.885 -11.333 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -15.559 -3.456 -11.990 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -14.826 -3.106 -13.543 1.00 0.00 H new ATOM 241 N GLY A 19 -11.579 -3.542 -14.453 1.00 0.00 N ATOM 242 CA GLY A 19 -11.276 -3.075 -15.794 1.00 0.00 C ATOM 243 C GLY A 19 -9.815 -2.710 -15.965 1.00 0.00 C ATOM 244 O GLY A 19 -8.918 -3.434 -15.534 1.00 0.00 O ATOM 0 H GLY A 19 -11.176 -4.448 -14.213 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.540 -3.850 -16.514 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.893 -2.206 -16.021 1.00 0.00 H new ATOM 248 N PRO A 20 -9.559 -1.562 -16.609 1.00 0.00 N ATOM 249 CA PRO A 20 -8.198 -1.076 -16.852 1.00 0.00 C ATOM 250 C PRO A 20 -7.506 -0.625 -15.570 1.00 0.00 C ATOM 251 O PRO A 20 -8.133 -0.457 -14.524 1.00 0.00 O ATOM 252 CB PRO A 20 -8.407 0.112 -17.794 1.00 0.00 C ATOM 253 CG PRO A 20 -9.792 0.581 -17.509 1.00 0.00 C ATOM 254 CD PRO A 20 -10.580 -0.648 -17.150 1.00 0.00 C ATOM 0 HA PRO A 20 -7.555 -1.854 -17.263 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.676 0.899 -17.607 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -8.296 -0.185 -18.837 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.799 1.302 -16.691 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.222 1.080 -18.378 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.353 -0.429 -16.414 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -11.080 -1.073 -18.020 1.00 0.00 H new ATOM 262 N PRO A 21 -6.182 -0.423 -15.651 1.00 0.00 N ATOM 263 CA PRO A 21 -5.377 0.013 -14.506 1.00 0.00 C ATOM 264 C PRO A 21 -5.672 1.454 -14.105 1.00 0.00 C ATOM 265 O PRO A 21 -6.493 2.128 -14.728 1.00 0.00 O ATOM 266 CB PRO A 21 -3.939 -0.118 -15.014 1.00 0.00 C ATOM 267 CG PRO A 21 -4.047 0.007 -16.495 1.00 0.00 C ATOM 268 CD PRO A 21 -5.370 -0.604 -16.866 1.00 0.00 C ATOM 0 HA PRO A 21 -5.584 -0.577 -13.613 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.299 0.660 -14.597 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.504 -1.076 -14.728 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -3.999 1.051 -16.803 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -3.225 -0.510 -16.991 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.816 -0.104 -17.726 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.267 -1.657 -17.127 1.00 0.00 H new ATOM 276 N THR A 22 -4.996 1.923 -13.061 1.00 0.00 N ATOM 277 CA THR A 22 -5.186 3.285 -12.577 1.00 0.00 C ATOM 278 C THR A 22 -4.177 4.238 -13.206 1.00 0.00 C ATOM 279 O THR A 22 -3.074 3.835 -13.578 1.00 0.00 O ATOM 280 CB THR A 22 -5.057 3.358 -11.043 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.293 2.978 -10.429 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.674 4.762 -10.599 1.00 0.00 C ATOM 0 H THR A 22 -4.312 1.380 -12.534 1.00 0.00 H new ATOM 0 HA THR A 22 -6.193 3.586 -12.865 1.00 0.00 H new ATOM 0 HB THR A 22 -4.271 2.669 -10.733 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.392 3.448 -9.575 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.589 4.790 -9.513 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.718 5.037 -11.045 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.440 5.467 -10.921 1.00 0.00 H new ATOM 290 N PHE A 23 -4.560 5.505 -13.324 1.00 0.00 N ATOM 291 CA PHE A 23 -3.689 6.517 -13.909 1.00 0.00 C ATOM 292 C PHE A 23 -3.969 7.891 -13.307 1.00 0.00 C ATOM 293 O PHE A 23 -5.120 8.309 -13.197 1.00 0.00 O ATOM 294 CB PHE A 23 -3.876 6.565 -15.427 1.00 0.00 C ATOM 295 CG PHE A 23 -2.954 5.643 -16.174 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.171 4.275 -16.173 1.00 0.00 C ATOM 297 CD2 PHE A 23 -1.871 6.146 -16.877 1.00 0.00 C ATOM 298 CE1 PHE A 23 -2.325 3.424 -16.860 1.00 0.00 C ATOM 299 CE2 PHE A 23 -1.022 5.300 -17.566 1.00 0.00 C ATOM 300 CZ PHE A 23 -1.249 3.938 -17.557 1.00 0.00 C ATOM 0 H PHE A 23 -5.469 5.855 -13.022 1.00 0.00 H new ATOM 0 HA PHE A 23 -2.657 6.246 -13.685 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -4.908 6.307 -15.666 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -3.715 7.586 -15.773 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.011 3.868 -15.629 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.688 7.210 -16.887 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.505 2.359 -16.852 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -0.182 5.704 -18.111 1.00 0.00 H new ATOM 0 HZ PHE A 23 -0.586 3.276 -18.094 1.00 0.00 H new ATOM 310 N ASN A 24 -2.906 8.587 -12.918 1.00 0.00 N ATOM 311 CA ASN A 24 -3.036 9.914 -12.326 1.00 0.00 C ATOM 312 C ASN A 24 -4.051 9.903 -11.187 1.00 0.00 C ATOM 313 O ASN A 24 -4.921 10.768 -11.090 1.00 0.00 O ATOM 314 CB ASN A 24 -3.456 10.931 -13.389 1.00 0.00 C ATOM 315 CG ASN A 24 -2.379 11.155 -14.432 1.00 0.00 C ATOM 316 OD1 ASN A 24 -1.596 12.101 -14.339 1.00 0.00 O ATOM 317 ND2 ASN A 24 -2.334 10.284 -15.433 1.00 0.00 N ATOM 0 H ASN A 24 -1.945 8.255 -13.002 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.065 10.202 -11.922 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.366 10.585 -13.879 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.694 11.879 -12.907 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.631 10.384 -16.165 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -3.003 9.515 -15.470 1.00 0.00 H new ATOM 324 N PRO A 25 -3.937 8.901 -10.303 1.00 0.00 N ATOM 325 CA PRO A 25 -4.835 8.754 -9.153 1.00 0.00 C ATOM 326 C PRO A 25 -4.614 9.836 -8.102 1.00 0.00 C ATOM 327 O PRO A 25 -3.483 10.187 -7.767 1.00 0.00 O ATOM 328 CB PRO A 25 -4.468 7.379 -8.590 1.00 0.00 C ATOM 329 CG PRO A 25 -3.060 7.156 -9.021 1.00 0.00 C ATOM 330 CD PRO A 25 -2.924 7.834 -10.356 1.00 0.00 C ATOM 0 HA PRO A 25 -5.882 8.847 -9.440 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.557 7.359 -7.504 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.128 6.603 -8.978 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.360 7.574 -8.298 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.840 6.091 -9.100 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -1.922 8.238 -10.501 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.111 7.143 -11.178 1.00 0.00 H new ATOM 338 N PRO A 26 -5.719 10.379 -7.569 1.00 0.00 N ATOM 339 CA PRO A 26 -5.671 11.429 -6.547 1.00 0.00 C ATOM 340 C PRO A 26 -5.160 10.911 -5.207 1.00 0.00 C ATOM 341 O PRO A 26 -4.842 9.730 -5.067 1.00 0.00 O ATOM 342 CB PRO A 26 -7.130 11.874 -6.427 1.00 0.00 C ATOM 343 CG PRO A 26 -7.924 10.692 -6.866 1.00 0.00 C ATOM 344 CD PRO A 26 -7.100 10.009 -7.922 1.00 0.00 C ATOM 0 HA PRO A 26 -4.987 12.233 -6.820 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.375 12.157 -5.403 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.332 12.742 -7.055 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.120 10.021 -6.030 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -8.892 10.998 -7.263 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.243 8.929 -7.907 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.365 10.352 -8.922 1.00 0.00 H new ATOM 352 N VAL A 27 -5.083 11.802 -4.224 1.00 0.00 N ATOM 353 CA VAL A 27 -4.612 11.434 -2.894 1.00 0.00 C ATOM 354 C VAL A 27 -5.431 12.127 -1.810 1.00 0.00 C ATOM 355 O VAL A 27 -5.764 13.308 -1.908 1.00 0.00 O ATOM 356 CB VAL A 27 -3.126 11.791 -2.706 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.680 11.493 -1.283 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.267 11.039 -3.711 1.00 0.00 C ATOM 0 H VAL A 27 -5.341 12.784 -4.323 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.733 10.355 -2.803 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.002 12.859 -2.883 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.627 11.752 -1.170 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.275 12.081 -0.584 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.817 10.432 -1.073 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.220 11.303 -3.564 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.394 9.966 -3.568 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.571 11.308 -4.723 1.00 0.00 H new ATOM 368 N PRO A 28 -5.763 11.377 -0.749 1.00 0.00 N ATOM 369 CA PRO A 28 -5.373 9.969 -0.622 1.00 0.00 C ATOM 370 C PRO A 28 -6.109 9.072 -1.611 1.00 0.00 C ATOM 371 O PRO A 28 -7.276 9.304 -1.925 1.00 0.00 O ATOM 372 CB PRO A 28 -5.770 9.620 0.815 1.00 0.00 C ATOM 373 CG PRO A 28 -6.864 10.575 1.148 1.00 0.00 C ATOM 374 CD PRO A 28 -6.546 11.844 0.407 1.00 0.00 C ATOM 0 HA PRO A 28 -4.315 9.818 -0.835 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.109 8.587 0.892 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.927 9.731 1.497 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -7.833 10.179 0.845 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -6.914 10.752 2.222 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.451 12.365 0.095 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -5.976 12.538 1.025 1.00 0.00 H new ATOM 382 N TYR A 29 -5.419 8.047 -2.098 1.00 0.00 N ATOM 383 CA TYR A 29 -6.007 7.115 -3.054 1.00 0.00 C ATOM 384 C TYR A 29 -6.518 5.863 -2.349 1.00 0.00 C ATOM 385 O TYR A 29 -5.759 5.154 -1.687 1.00 0.00 O ATOM 386 CB TYR A 29 -4.980 6.731 -4.120 1.00 0.00 C ATOM 387 CG TYR A 29 -5.351 5.488 -4.898 1.00 0.00 C ATOM 388 CD1 TYR A 29 -5.037 4.223 -4.415 1.00 0.00 C ATOM 389 CD2 TYR A 29 -6.015 5.578 -6.115 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.373 3.085 -5.123 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.357 4.446 -6.828 1.00 0.00 C ATOM 392 CZ TYR A 29 -6.034 3.202 -6.328 1.00 0.00 C ATOM 393 OH TYR A 29 -6.371 2.071 -7.036 1.00 0.00 O ATOM 0 H TYR A 29 -4.452 7.840 -1.847 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.851 7.610 -3.534 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.862 7.563 -4.815 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.013 6.575 -3.642 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.522 4.128 -3.471 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.268 6.551 -6.510 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.120 2.109 -4.735 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.874 4.534 -7.772 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.344 2.035 -7.151 1.00 0.00 H new ATOM 403 N PHE A 30 -7.812 5.595 -2.497 1.00 0.00 N ATOM 404 CA PHE A 30 -8.427 4.429 -1.875 1.00 0.00 C ATOM 405 C PHE A 30 -8.767 3.371 -2.921 1.00 0.00 C ATOM 406 O PHE A 30 -9.764 3.485 -3.633 1.00 0.00 O ATOM 407 CB PHE A 30 -9.691 4.837 -1.116 1.00 0.00 C ATOM 408 CG PHE A 30 -9.411 5.556 0.173 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.222 4.848 1.349 1.00 0.00 C ATOM 410 CD2 PHE A 30 -9.336 6.939 0.208 1.00 0.00 C ATOM 411 CE1 PHE A 30 -8.965 5.507 2.536 1.00 0.00 C ATOM 412 CE2 PHE A 30 -9.079 7.603 1.392 1.00 0.00 C ATOM 413 CZ PHE A 30 -8.892 6.887 2.558 1.00 0.00 C ATOM 0 H PHE A 30 -8.454 6.170 -3.042 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.711 4.003 -1.172 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.298 5.478 -1.756 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.282 3.946 -0.905 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.276 3.769 1.338 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.480 7.505 -0.701 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.821 4.944 3.446 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -9.024 8.682 1.406 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.689 7.404 3.484 1.00 0.00 H new ATOM 423 N GLY A 31 -7.930 2.341 -3.007 1.00 0.00 N ATOM 424 CA GLY A 31 -8.158 1.278 -3.968 1.00 0.00 C ATOM 425 C GLY A 31 -8.416 -0.059 -3.303 1.00 0.00 C ATOM 426 O GLY A 31 -7.492 -0.699 -2.802 1.00 0.00 O ATOM 0 H GLY A 31 -7.098 2.224 -2.428 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -9.009 1.538 -4.597 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.291 1.193 -4.624 1.00 0.00 H new ATOM 430 N ARG A 32 -9.677 -0.481 -3.297 1.00 0.00 N ATOM 431 CA ARG A 32 -10.054 -1.750 -2.686 1.00 0.00 C ATOM 432 C ARG A 32 -9.581 -2.925 -3.536 1.00 0.00 C ATOM 433 O ARG A 32 -9.810 -2.962 -4.746 1.00 0.00 O ATOM 434 CB ARG A 32 -11.571 -1.819 -2.499 1.00 0.00 C ATOM 435 CG ARG A 32 -12.301 -2.446 -3.675 1.00 0.00 C ATOM 436 CD ARG A 32 -12.279 -3.965 -3.600 1.00 0.00 C ATOM 437 NE ARG A 32 -13.473 -4.560 -4.193 1.00 0.00 N ATOM 438 CZ ARG A 32 -14.641 -4.645 -3.565 1.00 0.00 C ATOM 439 NH1 ARG A 32 -14.770 -4.176 -2.332 1.00 0.00 N ATOM 440 NH2 ARG A 32 -15.682 -5.201 -4.172 1.00 0.00 N ATOM 0 H ARG A 32 -10.454 0.037 -3.708 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.571 -1.813 -1.711 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.792 -2.391 -1.598 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -11.955 -0.812 -2.339 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.333 -2.097 -3.692 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -11.839 -2.120 -4.607 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -11.394 -4.340 -4.114 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -12.199 -4.275 -2.558 1.00 0.00 H new ATOM 0 HE ARG A 32 -13.407 -4.931 -5.141 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -13.972 -3.748 -1.863 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -15.668 -4.243 -1.852 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.586 -5.563 -5.121 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -16.578 -5.266 -3.690 1.00 0.00 H new ATOM 454 N LEU A 33 -8.921 -3.884 -2.896 1.00 0.00 N ATOM 455 CA LEU A 33 -8.415 -5.061 -3.594 1.00 0.00 C ATOM 456 C LEU A 33 -9.552 -6.016 -3.946 1.00 0.00 C ATOM 457 O LEU A 33 -10.536 -6.120 -3.214 1.00 0.00 O ATOM 458 CB LEU A 33 -7.377 -5.782 -2.732 1.00 0.00 C ATOM 459 CG LEU A 33 -6.271 -4.907 -2.141 1.00 0.00 C ATOM 460 CD1 LEU A 33 -5.775 -5.488 -0.826 1.00 0.00 C ATOM 461 CD2 LEU A 33 -5.122 -4.761 -3.129 1.00 0.00 C ATOM 0 H LEU A 33 -8.724 -3.870 -1.895 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.944 -4.730 -4.519 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.896 -6.279 -1.913 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.912 -6.562 -3.335 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.683 -3.917 -1.944 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.988 -4.852 -0.421 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.601 -5.540 -0.117 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.380 -6.489 -0.997 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.344 -4.135 -2.692 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.711 -5.745 -3.357 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.487 -4.299 -4.046 1.00 0.00 H new ATOM 473 N GLN A 34 -9.407 -6.711 -5.069 1.00 0.00 N ATOM 474 CA GLN A 34 -10.421 -7.658 -5.517 1.00 0.00 C ATOM 475 C GLN A 34 -9.939 -9.095 -5.342 1.00 0.00 C ATOM 476 O GLN A 34 -9.335 -9.672 -6.245 1.00 0.00 O ATOM 477 CB GLN A 34 -10.777 -7.402 -6.982 1.00 0.00 C ATOM 478 CG GLN A 34 -11.414 -6.043 -7.225 1.00 0.00 C ATOM 479 CD GLN A 34 -11.539 -5.712 -8.699 1.00 0.00 C ATOM 480 OE1 GLN A 34 -12.401 -6.247 -9.396 1.00 0.00 O ATOM 481 NE2 GLN A 34 -10.676 -4.826 -9.182 1.00 0.00 N ATOM 0 H GLN A 34 -8.598 -6.636 -5.685 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.311 -7.515 -4.904 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -9.874 -7.484 -7.586 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.460 -8.180 -7.323 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.403 -6.022 -6.767 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -10.819 -5.274 -6.733 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -9.978 -4.407 -8.568 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -10.712 -4.564 -10.167 1.00 0.00 H new ATOM 490 N GLY A 35 -10.211 -9.667 -4.173 1.00 0.00 N ATOM 491 CA GLY A 35 -9.798 -11.031 -3.901 1.00 0.00 C ATOM 492 C GLY A 35 -9.172 -11.185 -2.529 1.00 0.00 C ATOM 493 O GLY A 35 -9.515 -12.099 -1.781 1.00 0.00 O ATOM 0 H GLY A 35 -10.710 -9.210 -3.410 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.662 -11.691 -3.979 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.084 -11.349 -4.661 1.00 0.00 H new ATOM 497 N GLY A 36 -8.248 -10.287 -2.197 1.00 0.00 N ATOM 498 CA GLY A 36 -7.586 -10.346 -0.907 1.00 0.00 C ATOM 499 C GLY A 36 -6.167 -10.870 -1.007 1.00 0.00 C ATOM 500 O GLY A 36 -5.811 -11.537 -1.979 1.00 0.00 O ATOM 0 H GLY A 36 -7.947 -9.520 -2.799 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.572 -9.350 -0.463 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.160 -10.986 -0.236 1.00 0.00 H new ATOM 504 N LEU A 37 -5.354 -10.566 -0.001 1.00 0.00 N ATOM 505 CA LEU A 37 -3.964 -11.010 0.020 1.00 0.00 C ATOM 506 C LEU A 37 -3.871 -12.519 -0.179 1.00 0.00 C ATOM 507 O LEU A 37 -4.261 -13.297 0.693 1.00 0.00 O ATOM 508 CB LEU A 37 -3.303 -10.616 1.341 1.00 0.00 C ATOM 509 CG LEU A 37 -3.323 -9.126 1.685 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.636 -8.876 3.018 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.660 -8.315 0.581 1.00 0.00 C ATOM 0 H LEU A 37 -5.633 -10.014 0.810 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.440 -10.522 -0.801 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.795 -11.161 2.147 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.265 -10.949 1.318 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.362 -8.807 1.770 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.660 -7.810 3.246 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.154 -9.427 3.803 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.600 -9.212 2.962 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.683 -7.257 0.843 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.625 -8.637 0.464 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.196 -8.469 -0.356 1.00 0.00 H new ATOM 523 N THR A 38 -3.350 -12.928 -1.332 1.00 0.00 N ATOM 524 CA THR A 38 -3.205 -14.344 -1.645 1.00 0.00 C ATOM 525 C THR A 38 -1.822 -14.642 -2.213 1.00 0.00 C ATOM 526 O THR A 38 -1.058 -13.729 -2.522 1.00 0.00 O ATOM 527 CB THR A 38 -4.273 -14.809 -2.653 1.00 0.00 C ATOM 528 OG1 THR A 38 -3.812 -15.969 -3.354 1.00 0.00 O ATOM 529 CG2 THR A 38 -4.596 -13.704 -3.647 1.00 0.00 C ATOM 0 H THR A 38 -3.022 -12.298 -2.064 1.00 0.00 H new ATOM 0 HA THR A 38 -3.337 -14.890 -0.711 1.00 0.00 H new ATOM 0 HB THR A 38 -5.180 -15.055 -2.101 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.497 -16.260 -3.992 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.352 -14.056 -4.349 1.00 0.00 H new ATOM 0 HG22 THR A 38 -4.974 -12.833 -3.112 1.00 0.00 H new ATOM 0 HG23 THR A 38 -3.693 -13.431 -4.193 1.00 0.00 H new ATOM 537 N ALA A 39 -1.507 -15.926 -2.349 1.00 0.00 N ATOM 538 CA ALA A 39 -0.217 -16.344 -2.883 1.00 0.00 C ATOM 539 C ALA A 39 -0.004 -15.800 -4.291 1.00 0.00 C ATOM 540 O ALA A 39 1.089 -15.347 -4.633 1.00 0.00 O ATOM 541 CB ALA A 39 -0.111 -17.862 -2.879 1.00 0.00 C ATOM 0 H ALA A 39 -2.128 -16.695 -2.097 1.00 0.00 H new ATOM 0 HA ALA A 39 0.564 -15.935 -2.242 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.858 -18.160 -3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.210 -18.231 -1.858 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.905 -18.284 -3.496 1.00 0.00 H new ATOM 547 N ARG A 40 -1.053 -15.850 -5.105 1.00 0.00 N ATOM 548 CA ARG A 40 -0.980 -15.364 -6.478 1.00 0.00 C ATOM 549 C ARG A 40 -1.460 -13.919 -6.569 1.00 0.00 C ATOM 550 O ARG A 40 -2.310 -13.588 -7.396 1.00 0.00 O ATOM 551 CB ARG A 40 -1.818 -16.251 -7.401 1.00 0.00 C ATOM 552 CG ARG A 40 -1.156 -17.576 -7.739 1.00 0.00 C ATOM 553 CD ARG A 40 -1.465 -18.636 -6.694 1.00 0.00 C ATOM 554 NE ARG A 40 -0.640 -19.829 -6.864 1.00 0.00 N ATOM 555 CZ ARG A 40 -0.655 -20.859 -6.024 1.00 0.00 C ATOM 556 NH1 ARG A 40 -1.448 -20.841 -4.962 1.00 0.00 N ATOM 557 NH2 ARG A 40 0.125 -21.909 -6.247 1.00 0.00 N ATOM 0 H ARG A 40 -1.964 -16.222 -4.838 1.00 0.00 H new ATOM 0 HA ARG A 40 0.062 -15.403 -6.796 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.780 -16.446 -6.928 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -2.021 -15.710 -8.325 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.499 -17.916 -8.716 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -0.077 -17.437 -7.810 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -1.303 -18.222 -5.699 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -2.518 -18.911 -6.757 1.00 0.00 H new ATOM 0 HE ARG A 40 -0.018 -19.874 -7.671 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -2.049 -20.035 -4.788 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -1.457 -21.633 -4.319 1.00 0.00 H new ATOM 0 HH21 ARG A 40 0.736 -21.926 -7.063 1.00 0.00 H new ATOM 0 HH22 ARG A 40 0.113 -22.699 -5.602 1.00 0.00 H new ATOM 571 N ARG A 41 -0.909 -13.063 -5.715 1.00 0.00 N ATOM 572 CA ARG A 41 -1.282 -11.653 -5.698 1.00 0.00 C ATOM 573 C ARG A 41 -0.053 -10.768 -5.510 1.00 0.00 C ATOM 574 O ARG A 41 0.814 -11.057 -4.685 1.00 0.00 O ATOM 575 CB ARG A 41 -2.293 -11.385 -4.582 1.00 0.00 C ATOM 576 CG ARG A 41 -2.706 -9.926 -4.472 1.00 0.00 C ATOM 577 CD ARG A 41 -4.133 -9.788 -3.965 1.00 0.00 C ATOM 578 NE ARG A 41 -5.112 -10.219 -4.960 1.00 0.00 N ATOM 579 CZ ARG A 41 -5.337 -9.571 -6.097 1.00 0.00 C ATOM 580 NH1 ARG A 41 -4.657 -8.469 -6.383 1.00 0.00 N ATOM 581 NH2 ARG A 41 -6.244 -10.025 -6.953 1.00 0.00 N ATOM 0 H ARG A 41 -0.203 -13.321 -5.026 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.739 -11.412 -6.658 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.181 -11.993 -4.754 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.866 -11.706 -3.632 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.027 -9.404 -3.798 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.617 -9.447 -5.447 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.254 -10.380 -3.058 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.323 -8.749 -3.696 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.652 -11.063 -4.771 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.958 -8.117 -5.729 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -4.833 -7.974 -7.257 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -6.769 -10.873 -6.738 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -6.416 -9.526 -7.826 1.00 0.00 H new ATOM 595 N THR A 42 0.014 -9.687 -6.281 1.00 0.00 N ATOM 596 CA THR A 42 1.136 -8.760 -6.201 1.00 0.00 C ATOM 597 C THR A 42 0.664 -7.315 -6.300 1.00 0.00 C ATOM 598 O THR A 42 -0.021 -6.940 -7.252 1.00 0.00 O ATOM 599 CB THR A 42 2.167 -9.029 -7.314 1.00 0.00 C ATOM 600 OG1 THR A 42 2.669 -10.365 -7.205 1.00 0.00 O ATOM 601 CG2 THR A 42 3.320 -8.040 -7.234 1.00 0.00 C ATOM 0 H THR A 42 -0.696 -9.432 -6.968 1.00 0.00 H new ATOM 0 HA THR A 42 1.608 -8.919 -5.232 1.00 0.00 H new ATOM 0 HB THR A 42 1.670 -8.906 -8.276 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.322 -10.528 -7.917 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.035 -8.250 -8.030 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.938 -7.026 -7.348 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.815 -8.135 -6.267 1.00 0.00 H new ATOM 609 N ILE A 43 1.033 -6.507 -5.312 1.00 0.00 N ATOM 610 CA ILE A 43 0.648 -5.102 -5.289 1.00 0.00 C ATOM 611 C ILE A 43 1.754 -4.219 -5.857 1.00 0.00 C ATOM 612 O ILE A 43 2.935 -4.433 -5.581 1.00 0.00 O ATOM 613 CB ILE A 43 0.313 -4.632 -3.861 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.822 -5.474 -3.277 1.00 0.00 C ATOM 615 CG2 ILE A 43 -0.060 -3.157 -3.862 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.344 -6.706 -2.540 1.00 0.00 C ATOM 0 H ILE A 43 1.599 -6.802 -4.516 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.243 -5.010 -5.911 1.00 0.00 H new ATOM 0 HB ILE A 43 1.196 -4.762 -3.235 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.407 -4.857 -2.595 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.489 -5.779 -4.083 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.294 -2.840 -2.846 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.777 -2.570 -4.241 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.930 -3.002 -4.500 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.203 -7.255 -2.153 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.216 -7.344 -3.223 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.299 -6.408 -1.712 1.00 0.00 H new ATOM 628 N ILE A 44 1.364 -3.226 -6.649 1.00 0.00 N ATOM 629 CA ILE A 44 2.323 -2.309 -7.252 1.00 0.00 C ATOM 630 C ILE A 44 1.896 -0.859 -7.055 1.00 0.00 C ATOM 631 O ILE A 44 0.718 -0.524 -7.187 1.00 0.00 O ATOM 632 CB ILE A 44 2.491 -2.582 -8.759 1.00 0.00 C ATOM 633 CG1 ILE A 44 3.014 -4.002 -8.987 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.431 -1.560 -9.380 1.00 0.00 C ATOM 635 CD1 ILE A 44 2.992 -4.428 -10.438 1.00 0.00 C ATOM 0 H ILE A 44 0.391 -3.036 -6.888 1.00 0.00 H new ATOM 0 HA ILE A 44 3.277 -2.476 -6.751 1.00 0.00 H new ATOM 0 HB ILE A 44 1.517 -2.492 -9.241 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.035 -4.069 -8.613 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.414 -4.700 -8.403 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.540 -1.766 -10.445 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.022 -0.559 -9.244 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.406 -1.622 -8.897 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.376 -5.444 -10.525 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.969 -4.394 -10.812 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.615 -3.753 -11.025 1.00 0.00 H new ATOM 647 N ILE A 45 2.861 -0.002 -6.738 1.00 0.00 N ATOM 648 CA ILE A 45 2.585 1.413 -6.525 1.00 0.00 C ATOM 649 C ILE A 45 3.623 2.287 -7.221 1.00 0.00 C ATOM 650 O ILE A 45 4.771 2.374 -6.785 1.00 0.00 O ATOM 651 CB ILE A 45 2.560 1.763 -5.025 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.367 1.090 -4.343 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.505 3.271 -4.834 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.502 1.001 -2.839 1.00 0.00 C ATOM 0 H ILE A 45 3.840 -0.263 -6.623 1.00 0.00 H new ATOM 0 HA ILE A 45 1.602 1.610 -6.952 1.00 0.00 H new ATOM 0 HB ILE A 45 3.475 1.392 -4.564 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.460 1.644 -4.586 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.246 0.086 -4.749 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.488 3.502 -3.769 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.383 3.728 -5.291 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.605 3.665 -5.305 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.621 0.513 -2.423 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.390 0.422 -2.587 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.592 2.004 -2.422 1.00 0.00 H new ATOM 666 N LYS A 46 3.212 2.934 -8.307 1.00 0.00 N ATOM 667 CA LYS A 46 4.104 3.804 -9.063 1.00 0.00 C ATOM 668 C LYS A 46 3.735 5.270 -8.861 1.00 0.00 C ATOM 669 O LYS A 46 2.684 5.724 -9.313 1.00 0.00 O ATOM 670 CB LYS A 46 4.050 3.454 -10.552 1.00 0.00 C ATOM 671 CG LYS A 46 5.085 2.424 -10.972 1.00 0.00 C ATOM 672 CD LYS A 46 4.782 1.860 -12.350 1.00 0.00 C ATOM 673 CE LYS A 46 3.943 0.594 -12.262 1.00 0.00 C ATOM 674 NZ LYS A 46 4.791 -0.629 -12.193 1.00 0.00 N ATOM 0 H LYS A 46 2.266 2.872 -8.683 1.00 0.00 H new ATOM 0 HA LYS A 46 5.119 3.649 -8.696 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.056 3.077 -10.792 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.196 4.363 -11.136 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.075 2.881 -10.974 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.110 1.614 -10.243 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.254 2.607 -12.942 1.00 0.00 H new ATOM 0 HD3 LYS A 46 5.716 1.644 -12.869 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.303 0.643 -11.381 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.286 0.532 -13.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.211 -1.466 -12.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 5.562 -0.557 -12.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 5.193 -0.720 -11.238 1.00 0.00 H new ATOM 688 N GLY A 47 4.607 6.008 -8.180 1.00 0.00 N ATOM 689 CA GLY A 47 4.355 7.415 -7.932 1.00 0.00 C ATOM 690 C GLY A 47 5.623 8.245 -7.960 1.00 0.00 C ATOM 691 O GLY A 47 6.536 7.969 -8.738 1.00 0.00 O ATOM 0 H GLY A 47 5.484 5.656 -7.796 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.660 7.794 -8.681 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.871 7.529 -6.962 1.00 0.00 H new ATOM 695 N TYR A 48 5.678 9.266 -7.112 1.00 0.00 N ATOM 696 CA TYR A 48 6.842 10.142 -7.045 1.00 0.00 C ATOM 697 C TYR A 48 6.750 11.081 -5.846 1.00 0.00 C ATOM 698 O TYR A 48 5.778 11.821 -5.697 1.00 0.00 O ATOM 699 CB TYR A 48 6.969 10.954 -8.335 1.00 0.00 C ATOM 700 CG TYR A 48 7.709 12.261 -8.157 1.00 0.00 C ATOM 701 CD1 TYR A 48 7.051 13.399 -7.707 1.00 0.00 C ATOM 702 CD2 TYR A 48 9.066 12.358 -8.440 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.723 14.595 -7.543 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.746 13.549 -8.278 1.00 0.00 C ATOM 705 CZ TYR A 48 9.070 14.665 -7.830 1.00 0.00 C ATOM 706 OH TYR A 48 9.744 15.854 -7.668 1.00 0.00 O ATOM 0 H TYR A 48 4.930 9.507 -6.462 1.00 0.00 H new ATOM 0 HA TYR A 48 7.728 9.518 -6.927 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.485 10.353 -9.084 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.972 11.161 -8.724 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.996 13.348 -7.482 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.598 11.487 -8.793 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.196 15.470 -7.192 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.801 13.606 -8.501 1.00 0.00 H new ATOM 0 HH TYR A 48 10.376 15.975 -8.407 1.00 0.00 H new ATOM 716 N VAL A 49 7.769 11.044 -4.994 1.00 0.00 N ATOM 717 CA VAL A 49 7.806 11.892 -3.809 1.00 0.00 C ATOM 718 C VAL A 49 8.098 13.342 -4.179 1.00 0.00 C ATOM 719 O VAL A 49 9.172 13.676 -4.679 1.00 0.00 O ATOM 720 CB VAL A 49 8.867 11.406 -2.804 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.707 12.122 -1.471 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.778 9.898 -2.623 1.00 0.00 C ATOM 0 H VAL A 49 8.580 10.435 -5.102 1.00 0.00 H new ATOM 0 HA VAL A 49 6.822 11.830 -3.345 1.00 0.00 H new ATOM 0 HB VAL A 49 9.854 11.643 -3.201 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.465 11.766 -0.773 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.825 13.196 -1.618 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.716 11.918 -1.065 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.535 9.572 -1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.789 9.634 -2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.946 9.406 -3.581 1.00 0.00 H new ATOM 732 N PRO A 50 7.120 14.225 -3.928 1.00 0.00 N ATOM 733 CA PRO A 50 7.249 15.654 -4.226 1.00 0.00 C ATOM 734 C PRO A 50 8.248 16.350 -3.307 1.00 0.00 C ATOM 735 O PRO A 50 8.515 15.906 -2.191 1.00 0.00 O ATOM 736 CB PRO A 50 5.837 16.195 -3.988 1.00 0.00 C ATOM 737 CG PRO A 50 5.225 15.244 -3.018 1.00 0.00 C ATOM 738 CD PRO A 50 5.814 13.896 -3.333 1.00 0.00 C ATOM 0 HA PRO A 50 7.622 15.828 -5.235 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.864 17.208 -3.586 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.267 16.235 -4.916 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.447 15.537 -1.992 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.140 15.229 -3.118 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.923 13.286 -2.436 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.187 13.335 -4.026 1.00 0.00 H new ATOM 746 N PRO A 51 8.813 17.469 -3.785 1.00 0.00 N ATOM 747 CA PRO A 51 9.791 18.250 -3.022 1.00 0.00 C ATOM 748 C PRO A 51 9.160 18.962 -1.830 1.00 0.00 C ATOM 749 O PRO A 51 9.861 19.453 -0.945 1.00 0.00 O ATOM 750 CB PRO A 51 10.305 19.269 -4.042 1.00 0.00 C ATOM 751 CG PRO A 51 9.198 19.407 -5.030 1.00 0.00 C ATOM 752 CD PRO A 51 8.541 18.056 -5.108 1.00 0.00 C ATOM 0 HA PRO A 51 10.573 17.621 -2.597 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.534 20.223 -3.568 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.221 18.923 -4.520 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.486 20.169 -4.714 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.580 19.712 -6.004 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.471 18.140 -5.298 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.961 17.450 -5.911 1.00 0.00 H new ATOM 760 N THR A 52 7.832 19.014 -1.812 1.00 0.00 N ATOM 761 CA THR A 52 7.107 19.666 -0.729 1.00 0.00 C ATOM 762 C THR A 52 6.342 18.649 0.110 1.00 0.00 C ATOM 763 O THR A 52 5.468 19.011 0.897 1.00 0.00 O ATOM 764 CB THR A 52 6.119 20.718 -1.268 1.00 0.00 C ATOM 765 OG1 THR A 52 5.286 20.136 -2.278 1.00 0.00 O ATOM 766 CG2 THR A 52 6.862 21.914 -1.843 1.00 0.00 C ATOM 0 H THR A 52 7.236 18.612 -2.536 1.00 0.00 H new ATOM 0 HA THR A 52 7.850 20.163 -0.105 1.00 0.00 H new ATOM 0 HB THR A 52 5.499 21.060 -0.439 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.660 20.811 -2.614 1.00 0.00 H new ATOM 0 HG21 THR A 52 6.143 22.643 -2.217 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.472 22.372 -1.064 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.504 21.585 -2.660 1.00 0.00 H new ATOM 774 N GLY A 53 6.676 17.374 -0.062 1.00 0.00 N ATOM 775 CA GLY A 53 6.011 16.325 0.687 1.00 0.00 C ATOM 776 C GLY A 53 6.925 15.668 1.702 1.00 0.00 C ATOM 777 O GLY A 53 7.977 15.135 1.348 1.00 0.00 O ATOM 0 H GLY A 53 7.396 17.049 -0.707 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.144 16.743 1.200 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.639 15.569 -0.005 1.00 0.00 H new ATOM 781 N LYS A 54 6.525 15.706 2.969 1.00 0.00 N ATOM 782 CA LYS A 54 7.315 15.111 4.039 1.00 0.00 C ATOM 783 C LYS A 54 7.429 13.600 3.857 1.00 0.00 C ATOM 784 O LYS A 54 8.528 13.062 3.727 1.00 0.00 O ATOM 785 CB LYS A 54 6.688 15.425 5.399 1.00 0.00 C ATOM 786 CG LYS A 54 6.588 16.912 5.694 1.00 0.00 C ATOM 787 CD LYS A 54 6.612 17.188 7.188 1.00 0.00 C ATOM 788 CE LYS A 54 8.033 17.207 7.728 1.00 0.00 C ATOM 789 NZ LYS A 54 8.089 16.792 9.157 1.00 0.00 N ATOM 0 H LYS A 54 5.657 16.143 3.279 1.00 0.00 H new ATOM 0 HA LYS A 54 8.316 15.541 3.999 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.691 14.987 5.440 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.278 14.947 6.181 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.414 17.435 5.213 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.667 17.308 5.265 1.00 0.00 H new ATOM 0 HD2 LYS A 54 6.132 18.146 7.390 1.00 0.00 H new ATOM 0 HD3 LYS A 54 6.034 16.425 7.709 1.00 0.00 H new ATOM 0 HE2 LYS A 54 8.657 16.541 7.132 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.447 18.210 7.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 9.075 16.818 9.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 7.514 17.442 9.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.717 15.825 9.253 1.00 0.00 H new ATOM 803 N SER A 55 6.285 12.923 3.847 1.00 0.00 N ATOM 804 CA SER A 55 6.257 11.474 3.683 1.00 0.00 C ATOM 805 C SER A 55 4.824 10.973 3.530 1.00 0.00 C ATOM 806 O SER A 55 3.873 11.643 3.933 1.00 0.00 O ATOM 807 CB SER A 55 6.923 10.791 4.879 1.00 0.00 C ATOM 808 OG SER A 55 6.428 11.308 6.102 1.00 0.00 O ATOM 0 H SER A 55 5.366 13.354 3.950 1.00 0.00 H new ATOM 0 HA SER A 55 6.810 11.225 2.777 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.743 9.717 4.835 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.002 10.935 4.830 1.00 0.00 H new ATOM 0 HG SER A 55 6.868 10.854 6.851 1.00 0.00 H new ATOM 814 N PHE A 56 4.677 9.789 2.943 1.00 0.00 N ATOM 815 CA PHE A 56 3.361 9.197 2.734 1.00 0.00 C ATOM 816 C PHE A 56 3.195 7.933 3.572 1.00 0.00 C ATOM 817 O PHE A 56 4.045 7.608 4.401 1.00 0.00 O ATOM 818 CB PHE A 56 3.153 8.873 1.254 1.00 0.00 C ATOM 819 CG PHE A 56 4.279 8.082 0.650 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.447 8.710 0.249 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.167 6.711 0.482 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.485 7.985 -0.306 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.201 5.981 -0.073 1.00 0.00 C ATOM 824 CZ PHE A 56 6.361 6.619 -0.469 1.00 0.00 C ATOM 0 H PHE A 56 5.453 9.221 2.604 1.00 0.00 H new ATOM 0 HA PHE A 56 2.610 9.922 3.048 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.224 8.314 1.140 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.035 9.804 0.699 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.548 9.778 0.371 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.262 6.208 0.788 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.392 8.486 -0.612 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.102 4.913 -0.197 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.169 6.051 -0.905 1.00 0.00 H new ATOM 834 N ALA A 57 2.093 7.223 3.349 1.00 0.00 N ATOM 835 CA ALA A 57 1.815 5.994 4.081 1.00 0.00 C ATOM 836 C ALA A 57 0.883 5.083 3.290 1.00 0.00 C ATOM 837 O ALA A 57 -0.055 5.550 2.642 1.00 0.00 O ATOM 838 CB ALA A 57 1.214 6.314 5.442 1.00 0.00 C ATOM 0 H ALA A 57 1.379 7.479 2.667 1.00 0.00 H new ATOM 0 HA ALA A 57 2.758 5.467 4.228 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.012 5.386 5.978 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.916 6.919 6.016 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.284 6.866 5.308 1.00 0.00 H new ATOM 844 N ILE A 58 1.146 3.782 3.346 1.00 0.00 N ATOM 845 CA ILE A 58 0.330 2.806 2.635 1.00 0.00 C ATOM 846 C ILE A 58 -0.155 1.707 3.574 1.00 0.00 C ATOM 847 O ILE A 58 0.590 0.785 3.904 1.00 0.00 O ATOM 848 CB ILE A 58 1.106 2.165 1.469 1.00 0.00 C ATOM 849 CG1 ILE A 58 1.693 3.248 0.562 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.200 1.236 0.676 1.00 0.00 C ATOM 851 CD1 ILE A 58 3.041 2.884 -0.019 1.00 0.00 C ATOM 0 H ILE A 58 1.918 3.379 3.877 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.529 3.344 2.235 1.00 0.00 H new ATOM 0 HB ILE A 58 1.927 1.576 1.879 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.996 3.445 -0.253 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.789 4.173 1.130 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.763 0.791 -0.144 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.174 0.447 1.329 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.640 1.803 0.274 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.396 3.698 -0.651 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.752 2.716 0.790 1.00 0.00 H new ATOM 0 HD13 ILE A 58 2.947 1.976 -0.615 1.00 0.00 H new ATOM 863 N ASN A 59 -1.410 1.810 3.998 1.00 0.00 N ATOM 864 CA ASN A 59 -1.996 0.823 4.898 1.00 0.00 C ATOM 865 C ASN A 59 -2.924 -0.122 4.140 1.00 0.00 C ATOM 866 O ASN A 59 -3.475 0.235 3.099 1.00 0.00 O ATOM 867 CB ASN A 59 -2.767 1.520 6.021 1.00 0.00 C ATOM 868 CG ASN A 59 -1.851 2.241 6.990 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.659 1.801 8.124 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.280 3.356 6.548 1.00 0.00 N ATOM 0 H ASN A 59 -2.041 2.567 3.733 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.185 0.237 5.332 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.468 2.234 5.588 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.358 0.783 6.564 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.654 3.884 7.156 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.467 3.684 5.601 1.00 0.00 H new ATOM 877 N PHE A 60 -3.091 -1.329 4.670 1.00 0.00 N ATOM 878 CA PHE A 60 -3.952 -2.326 4.043 1.00 0.00 C ATOM 879 C PHE A 60 -5.045 -2.782 5.005 1.00 0.00 C ATOM 880 O PHE A 60 -4.802 -3.587 5.904 1.00 0.00 O ATOM 881 CB PHE A 60 -3.124 -3.529 3.586 1.00 0.00 C ATOM 882 CG PHE A 60 -2.087 -3.187 2.555 1.00 0.00 C ATOM 883 CD1 PHE A 60 -1.029 -2.350 2.869 1.00 0.00 C ATOM 884 CD2 PHE A 60 -2.171 -3.702 1.272 1.00 0.00 C ATOM 885 CE1 PHE A 60 -0.074 -2.033 1.922 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.218 -3.389 0.320 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.168 -2.554 0.646 1.00 0.00 C ATOM 0 H PHE A 60 -2.642 -1.641 5.531 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.425 -1.868 3.174 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.631 -3.971 4.452 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.793 -4.287 3.179 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.950 -1.941 3.865 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -2.990 -4.356 1.012 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.745 -1.378 2.179 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.295 -3.797 -0.677 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.578 -2.309 -0.095 1.00 0.00 H new ATOM 897 N LYS A 61 -6.252 -2.261 4.809 1.00 0.00 N ATOM 898 CA LYS A 61 -7.384 -2.613 5.657 1.00 0.00 C ATOM 899 C LYS A 61 -8.210 -3.730 5.025 1.00 0.00 C ATOM 900 O LYS A 61 -8.027 -4.065 3.855 1.00 0.00 O ATOM 901 CB LYS A 61 -8.267 -1.387 5.899 1.00 0.00 C ATOM 902 CG LYS A 61 -9.363 -1.620 6.925 1.00 0.00 C ATOM 903 CD LYS A 61 -10.063 -0.324 7.297 1.00 0.00 C ATOM 904 CE LYS A 61 -9.270 0.459 8.333 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.900 1.775 8.635 1.00 0.00 N ATOM 0 H LYS A 61 -6.471 -1.593 4.070 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.995 -2.967 6.612 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.641 -0.558 6.230 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.722 -1.085 4.956 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -10.091 -2.327 6.527 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.935 -2.073 7.819 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -10.200 0.286 6.404 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.056 -0.545 7.688 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.193 -0.126 9.250 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.255 0.617 7.970 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.330 2.278 9.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.951 2.343 7.766 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.860 1.623 9.006 1.00 0.00 H new ATOM 919 N VAL A 62 -9.120 -4.302 5.807 1.00 0.00 N ATOM 920 CA VAL A 62 -9.976 -5.379 5.324 1.00 0.00 C ATOM 921 C VAL A 62 -11.358 -4.856 4.948 1.00 0.00 C ATOM 922 O VAL A 62 -12.069 -4.296 5.782 1.00 0.00 O ATOM 923 CB VAL A 62 -10.128 -6.491 6.378 1.00 0.00 C ATOM 924 CG1 VAL A 62 -11.124 -7.540 5.908 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.779 -7.124 6.683 1.00 0.00 C ATOM 0 H VAL A 62 -9.283 -4.037 6.778 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.495 -5.793 4.438 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.511 -6.047 7.297 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.218 -8.318 6.666 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -12.095 -7.073 5.745 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.773 -7.983 4.976 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.905 -7.908 7.430 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.365 -7.555 5.771 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.099 -6.364 7.067 1.00 0.00 H new ATOM 935 N GLY A 63 -11.733 -5.044 3.687 1.00 0.00 N ATOM 936 CA GLY A 63 -13.030 -4.586 3.223 1.00 0.00 C ATOM 937 C GLY A 63 -14.174 -5.180 4.021 1.00 0.00 C ATOM 938 O GLY A 63 -15.223 -4.554 4.173 1.00 0.00 O ATOM 0 H GLY A 63 -11.162 -5.505 2.978 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -13.072 -3.499 3.287 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.150 -4.848 2.172 1.00 0.00 H new ATOM 942 N SER A 64 -13.973 -6.391 4.530 1.00 0.00 N ATOM 943 CA SER A 64 -14.998 -7.071 5.312 1.00 0.00 C ATOM 944 C SER A 64 -15.141 -6.435 6.691 1.00 0.00 C ATOM 945 O SER A 64 -16.099 -5.708 6.955 1.00 0.00 O ATOM 946 CB SER A 64 -14.659 -8.556 5.455 1.00 0.00 C ATOM 947 OG SER A 64 -15.203 -9.309 4.385 1.00 0.00 O ATOM 0 H SER A 64 -13.109 -6.921 4.415 1.00 0.00 H new ATOM 0 HA SER A 64 -15.947 -6.971 4.785 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.577 -8.684 5.481 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.047 -8.931 6.402 1.00 0.00 H new ATOM 0 HG SER A 64 -14.971 -10.254 4.499 1.00 0.00 H new ATOM 953 N SER A 65 -14.181 -6.715 7.567 1.00 0.00 N ATOM 954 CA SER A 65 -14.200 -6.174 8.921 1.00 0.00 C ATOM 955 C SER A 65 -13.709 -4.729 8.936 1.00 0.00 C ATOM 956 O SER A 65 -14.487 -3.799 9.144 1.00 0.00 O ATOM 957 CB SER A 65 -13.333 -7.029 9.847 1.00 0.00 C ATOM 958 OG SER A 65 -13.808 -6.977 11.181 1.00 0.00 O ATOM 0 H SER A 65 -13.380 -7.313 7.363 1.00 0.00 H new ATOM 0 HA SER A 65 -15.229 -6.193 9.279 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.331 -8.062 9.498 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.301 -6.679 9.811 1.00 0.00 H new ATOM 0 HG SER A 65 -13.238 -7.533 11.753 1.00 0.00 H new ATOM 964 N GLY A 66 -12.411 -4.550 8.713 1.00 0.00 N ATOM 965 CA GLY A 66 -11.836 -3.217 8.705 1.00 0.00 C ATOM 966 C GLY A 66 -10.588 -3.119 9.559 1.00 0.00 C ATOM 967 O GLY A 66 -10.386 -2.130 10.264 1.00 0.00 O ATOM 0 H GLY A 66 -11.747 -5.304 8.538 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.594 -2.935 7.680 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.576 -2.503 9.066 1.00 0.00 H new ATOM 971 N ASP A 67 -9.748 -4.146 9.497 1.00 0.00 N ATOM 972 CA ASP A 67 -8.513 -4.172 10.271 1.00 0.00 C ATOM 973 C ASP A 67 -7.298 -4.013 9.361 1.00 0.00 C ATOM 974 O ASP A 67 -7.311 -4.452 8.211 1.00 0.00 O ATOM 975 CB ASP A 67 -8.407 -5.478 11.060 1.00 0.00 C ATOM 976 CG ASP A 67 -9.763 -6.012 11.480 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.586 -5.215 11.978 1.00 0.00 O ATOM 978 OD2 ASP A 67 -10.000 -7.226 11.310 1.00 0.00 O ATOM 0 H ASP A 67 -9.900 -4.972 8.918 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.534 -3.336 10.970 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.897 -6.226 10.452 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.793 -5.315 11.946 1.00 0.00 H new ATOM 983 N ILE A 68 -6.252 -3.383 9.885 1.00 0.00 N ATOM 984 CA ILE A 68 -5.030 -3.167 9.120 1.00 0.00 C ATOM 985 C ILE A 68 -4.014 -4.272 9.383 1.00 0.00 C ATOM 986 O ILE A 68 -3.497 -4.403 10.492 1.00 0.00 O ATOM 987 CB ILE A 68 -4.390 -1.806 9.454 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.417 -0.683 9.298 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.183 -1.556 8.562 1.00 0.00 C ATOM 990 CD1 ILE A 68 -4.946 0.647 9.844 1.00 0.00 C ATOM 0 H ILE A 68 -6.226 -3.013 10.835 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.311 -3.179 8.067 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.054 -1.823 10.491 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.659 -0.568 8.242 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.337 -0.970 9.807 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.741 -0.591 8.810 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.446 -2.343 8.719 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.496 -1.555 7.518 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.725 1.396 9.699 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.731 0.548 10.908 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.043 0.957 9.319 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.731 -5.066 8.355 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.773 -6.158 8.474 1.00 0.00 C ATOM 1004 C ALA A 69 -1.350 -5.670 8.225 1.00 0.00 C ATOM 1005 O ALA A 69 -0.394 -6.188 8.805 1.00 0.00 O ATOM 1006 CB ALA A 69 -3.126 -7.278 7.506 1.00 0.00 C ATOM 0 H ALA A 69 -4.152 -4.973 7.431 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.824 -6.543 9.492 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.402 -8.087 7.606 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.124 -7.654 7.733 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -3.105 -6.897 6.485 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.215 -4.672 7.359 1.00 0.00 N ATOM 1013 CA LEU A 70 0.093 -4.114 7.032 1.00 0.00 C ATOM 1014 C LEU A 70 0.027 -2.593 6.936 1.00 0.00 C ATOM 1015 O LEU A 70 -0.848 -2.039 6.269 1.00 0.00 O ATOM 1016 CB LEU A 70 0.603 -4.697 5.714 1.00 0.00 C ATOM 1017 CG LEU A 70 1.919 -4.122 5.190 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.016 -4.261 6.235 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.325 -4.811 3.895 1.00 0.00 C ATOM 0 H LEU A 70 -1.995 -4.232 6.870 1.00 0.00 H new ATOM 0 HA LEU A 70 0.784 -4.380 7.832 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.724 -5.773 5.839 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -0.164 -4.548 4.953 1.00 0.00 H new ATOM 0 HG LEU A 70 1.773 -3.062 4.984 1.00 0.00 H new ATOM 0 HD11 LEU A 70 3.945 -3.846 5.844 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.729 -3.722 7.138 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.161 -5.315 6.473 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.264 -4.389 3.537 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.453 -5.878 4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.550 -4.660 3.144 1.00 0.00 H new ATOM 1031 N HIS A 71 0.959 -1.922 7.606 1.00 0.00 N ATOM 1032 CA HIS A 71 1.009 -0.464 7.594 1.00 0.00 C ATOM 1033 C HIS A 71 2.435 0.029 7.368 1.00 0.00 C ATOM 1034 O HIS A 71 3.220 0.140 8.310 1.00 0.00 O ATOM 1035 CB HIS A 71 0.466 0.097 8.908 1.00 0.00 C ATOM 1036 CG HIS A 71 0.849 1.523 9.155 1.00 0.00 C ATOM 1037 ND1 HIS A 71 1.020 2.442 8.141 1.00 0.00 N ATOM 1038 CD2 HIS A 71 1.093 2.188 10.309 1.00 0.00 C ATOM 1039 CE1 HIS A 71 1.355 3.610 8.661 1.00 0.00 C ATOM 1040 NE2 HIS A 71 1.405 3.483 9.975 1.00 0.00 N ATOM 0 H HIS A 71 1.689 -2.364 8.164 1.00 0.00 H new ATOM 0 HA HIS A 71 0.386 -0.111 6.772 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.621 0.017 8.906 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.829 -0.516 9.733 1.00 0.00 H new ATOM 0 HD2 HIS A 71 1.050 1.776 11.307 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.554 4.515 8.106 1.00 0.00 H new ATOM 0 HE2 HIS A 71 1.637 4.226 10.634 1.00 0.00 H new ATOM 1049 N ILE A 72 2.763 0.321 6.114 1.00 0.00 N ATOM 1050 CA ILE A 72 4.094 0.802 5.765 1.00 0.00 C ATOM 1051 C ILE A 72 4.103 2.317 5.591 1.00 0.00 C ATOM 1052 O ILE A 72 3.254 2.878 4.899 1.00 0.00 O ATOM 1053 CB ILE A 72 4.609 0.145 4.471 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.542 -1.379 4.585 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.031 0.598 4.176 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.564 -2.087 3.249 1.00 0.00 C ATOM 0 H ILE A 72 2.125 0.233 5.323 1.00 0.00 H new ATOM 0 HA ILE A 72 4.754 0.529 6.589 1.00 0.00 H new ATOM 0 HB ILE A 72 3.971 0.457 3.644 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.382 -1.727 5.185 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.633 -1.656 5.119 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.381 0.125 3.258 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.050 1.681 4.056 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.682 0.313 5.002 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.514 -3.164 3.407 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.709 -1.767 2.654 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.486 -1.840 2.722 1.00 0.00 H new ATOM 1068 N ASN A 73 5.071 2.974 6.223 1.00 0.00 N ATOM 1069 CA ASN A 73 5.192 4.425 6.137 1.00 0.00 C ATOM 1070 C ASN A 73 6.656 4.844 6.048 1.00 0.00 C ATOM 1071 O ASN A 73 7.408 4.774 7.020 1.00 0.00 O ATOM 1072 CB ASN A 73 4.534 5.085 7.351 1.00 0.00 C ATOM 1073 CG ASN A 73 4.128 6.521 7.079 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.073 7.321 6.598 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 2.980 6.905 7.299 1.00 0.00 N flip ATOM 0 H ASN A 73 5.782 2.525 6.800 1.00 0.00 H new ATOM 0 HA ASN A 73 4.682 4.754 5.232 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.654 4.510 7.641 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.224 5.059 8.194 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.287 6.255 7.669 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.722 7.874 7.111 1.00 0.00 H new ATOM 1082 N PRO A 74 7.071 5.292 4.853 1.00 0.00 N ATOM 1083 CA PRO A 74 8.448 5.733 4.608 1.00 0.00 C ATOM 1084 C PRO A 74 8.773 7.041 5.321 1.00 0.00 C ATOM 1085 O PRO A 74 7.881 7.835 5.619 1.00 0.00 O ATOM 1086 CB PRO A 74 8.493 5.925 3.090 1.00 0.00 C ATOM 1087 CG PRO A 74 7.081 6.197 2.700 1.00 0.00 C ATOM 1088 CD PRO A 74 6.229 5.403 3.651 1.00 0.00 C ATOM 0 HA PRO A 74 9.179 5.017 4.983 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.146 6.753 2.815 1.00 0.00 H new ATOM 0 HB3 PRO A 74 8.878 5.036 2.590 1.00 0.00 H new ATOM 0 HG2 PRO A 74 6.855 7.261 2.769 1.00 0.00 H new ATOM 0 HG3 PRO A 74 6.897 5.898 1.668 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.288 5.909 3.865 1.00 0.00 H new ATOM 0 HD3 PRO A 74 5.979 4.423 3.244 1.00 0.00 H new ATOM 1096 N ARG A 75 10.056 7.258 5.592 1.00 0.00 N ATOM 1097 CA ARG A 75 10.498 8.470 6.271 1.00 0.00 C ATOM 1098 C ARG A 75 11.685 9.098 5.545 1.00 0.00 C ATOM 1099 O ARG A 75 12.823 8.658 5.700 1.00 0.00 O ATOM 1100 CB ARG A 75 10.880 8.159 7.719 1.00 0.00 C ATOM 1101 CG ARG A 75 9.687 7.859 8.612 1.00 0.00 C ATOM 1102 CD ARG A 75 10.127 7.354 9.978 1.00 0.00 C ATOM 1103 NE ARG A 75 10.825 8.383 10.743 1.00 0.00 N ATOM 1104 CZ ARG A 75 11.574 8.125 11.809 1.00 0.00 C ATOM 1105 NH1 ARG A 75 11.722 6.877 12.233 1.00 0.00 N ATOM 1106 NH2 ARG A 75 12.178 9.116 12.453 1.00 0.00 N ATOM 0 H ARG A 75 10.807 6.611 5.352 1.00 0.00 H new ATOM 0 HA ARG A 75 9.672 9.181 6.265 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.557 7.305 7.732 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.428 9.006 8.131 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.085 8.760 8.732 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.052 7.113 8.134 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.255 7.015 10.537 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.780 6.490 9.852 1.00 0.00 H new ATOM 0 HE ARG A 75 10.732 9.353 10.442 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.260 6.113 11.740 1.00 0.00 H new ATOM 0 HH12 ARG A 75 12.298 6.682 13.052 1.00 0.00 H new ATOM 0 HH21 ARG A 75 12.067 10.077 12.129 1.00 0.00 H new ATOM 0 HH22 ARG A 75 12.753 8.917 13.272 1.00 0.00 H new ATOM 1120 N MET A 76 11.409 10.128 4.751 1.00 0.00 N ATOM 1121 CA MET A 76 12.453 10.816 4.002 1.00 0.00 C ATOM 1122 C MET A 76 13.383 11.579 4.940 1.00 0.00 C ATOM 1123 O MET A 76 14.598 11.596 4.748 1.00 0.00 O ATOM 1124 CB MET A 76 11.833 11.777 2.986 1.00 0.00 C ATOM 1125 CG MET A 76 11.111 11.075 1.848 1.00 0.00 C ATOM 1126 SD MET A 76 9.370 10.777 2.209 1.00 0.00 S ATOM 1127 CE MET A 76 9.083 9.274 1.278 1.00 0.00 C ATOM 0 H MET A 76 10.471 10.504 4.610 1.00 0.00 H new ATOM 0 HA MET A 76 13.038 10.066 3.471 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.131 12.434 3.500 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.617 12.411 2.572 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.192 11.679 0.944 1.00 0.00 H new ATOM 0 HG3 MET A 76 11.603 10.125 1.642 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.148 8.818 1.603 1.00 0.00 H new ATOM 0 HE2 MET A 76 9.021 9.510 0.216 1.00 0.00 H new ATOM 0 HE3 MET A 76 9.905 8.578 1.448 1.00 0.00 H new ATOM 1137 N GLY A 77 12.802 12.210 5.956 1.00 0.00 N ATOM 1138 CA GLY A 77 13.594 12.967 6.909 1.00 0.00 C ATOM 1139 C GLY A 77 14.830 12.216 7.362 1.00 0.00 C ATOM 1140 O GLY A 77 15.953 12.625 7.074 1.00 0.00 O ATOM 0 H GLY A 77 11.798 12.211 6.136 1.00 0.00 H new ATOM 0 HA2 GLY A 77 13.893 13.913 6.458 1.00 0.00 H new ATOM 0 HA3 GLY A 77 12.980 13.207 7.777 1.00 0.00 H new ATOM 1144 N ASN A 78 14.622 11.113 8.075 1.00 0.00 N ATOM 1145 CA ASN A 78 15.729 10.304 8.571 1.00 0.00 C ATOM 1146 C ASN A 78 16.128 9.243 7.550 1.00 0.00 C ATOM 1147 O ASN A 78 17.291 9.147 7.160 1.00 0.00 O ATOM 1148 CB ASN A 78 15.347 9.637 9.894 1.00 0.00 C ATOM 1149 CG ASN A 78 16.508 8.888 10.520 1.00 0.00 C ATOM 1150 OD1 ASN A 78 17.604 9.429 10.665 1.00 0.00 O ATOM 1151 ND2 ASN A 78 16.271 7.636 10.895 1.00 0.00 N ATOM 0 H ASN A 78 13.698 10.760 8.322 1.00 0.00 H new ATOM 0 HA ASN A 78 16.582 10.962 8.736 1.00 0.00 H new ATOM 0 HB2 ASN A 78 14.990 10.396 10.590 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.521 8.946 9.724 1.00 0.00 H new ATOM 0 HD21 ASN A 78 17.013 7.082 11.323 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.347 7.228 10.755 1.00 0.00 H new ATOM 1158 N GLY A 79 15.153 8.447 7.120 1.00 0.00 N ATOM 1159 CA GLY A 79 15.422 7.404 6.148 1.00 0.00 C ATOM 1160 C GLY A 79 15.121 6.019 6.686 1.00 0.00 C ATOM 1161 O GLY A 79 15.929 5.100 6.545 1.00 0.00 O ATOM 0 H GLY A 79 14.182 8.506 7.428 1.00 0.00 H new ATOM 0 HA2 GLY A 79 14.824 7.581 5.254 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.468 7.454 5.846 1.00 0.00 H new ATOM 1165 N THR A 80 13.955 5.867 7.305 1.00 0.00 N ATOM 1166 CA THR A 80 13.550 4.585 7.869 1.00 0.00 C ATOM 1167 C THR A 80 12.061 4.336 7.655 1.00 0.00 C ATOM 1168 O THR A 80 11.223 5.148 8.047 1.00 0.00 O ATOM 1169 CB THR A 80 13.861 4.510 9.375 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.401 5.698 10.030 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.354 4.341 9.612 1.00 0.00 C ATOM 0 H THR A 80 13.274 6.616 7.429 1.00 0.00 H new ATOM 0 HA THR A 80 14.122 3.816 7.350 1.00 0.00 H new ATOM 0 HB THR A 80 13.343 3.644 9.787 1.00 0.00 H new ATOM 0 HG1 THR A 80 13.601 5.642 10.988 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.549 4.291 10.683 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.696 3.421 9.137 1.00 0.00 H new ATOM 0 HG23 THR A 80 15.888 5.190 9.186 1.00 0.00 H new ATOM 1179 N VAL A 81 11.738 3.207 7.032 1.00 0.00 N ATOM 1180 CA VAL A 81 10.350 2.850 6.769 1.00 0.00 C ATOM 1181 C VAL A 81 9.794 1.953 7.869 1.00 0.00 C ATOM 1182 O VAL A 81 10.180 0.790 7.991 1.00 0.00 O ATOM 1183 CB VAL A 81 10.202 2.132 5.414 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.733 1.972 5.051 1.00 0.00 C ATOM 1185 CG2 VAL A 81 10.949 2.890 4.326 1.00 0.00 C ATOM 0 H VAL A 81 12.419 2.524 6.700 1.00 0.00 H new ATOM 0 HA VAL A 81 9.784 3.781 6.743 1.00 0.00 H new ATOM 0 HB VAL A 81 10.640 1.138 5.500 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.649 1.463 4.091 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.230 1.384 5.819 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.266 2.955 4.983 1.00 0.00 H new ATOM 0 HG21 VAL A 81 10.834 2.369 3.375 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.542 3.897 4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.007 2.947 4.583 1.00 0.00 H new ATOM 1195 N VAL A 82 8.885 2.501 8.669 1.00 0.00 N ATOM 1196 CA VAL A 82 8.274 1.750 9.760 1.00 0.00 C ATOM 1197 C VAL A 82 7.131 0.877 9.254 1.00 0.00 C ATOM 1198 O VAL A 82 6.410 1.256 8.331 1.00 0.00 O ATOM 1199 CB VAL A 82 7.742 2.689 10.858 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.209 1.886 12.035 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.829 3.652 11.309 1.00 0.00 C ATOM 0 H VAL A 82 8.555 3.462 8.582 1.00 0.00 H new ATOM 0 HA VAL A 82 9.052 1.114 10.182 1.00 0.00 H new ATOM 0 HB VAL A 82 6.920 3.273 10.444 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.837 2.566 12.801 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.398 1.241 11.698 1.00 0.00 H new ATOM 0 HG13 VAL A 82 8.010 1.274 12.451 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.435 4.308 12.085 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.673 3.088 11.705 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.159 4.251 10.461 1.00 0.00 H new ATOM 1211 N ARG A 83 6.972 -0.292 9.864 1.00 0.00 N ATOM 1212 CA ARG A 83 5.916 -1.220 9.475 1.00 0.00 C ATOM 1213 C ARG A 83 5.071 -1.619 10.681 1.00 0.00 C ATOM 1214 O ARG A 83 5.592 -2.116 11.679 1.00 0.00 O ATOM 1215 CB ARG A 83 6.518 -2.467 8.825 1.00 0.00 C ATOM 1216 CG ARG A 83 6.949 -2.254 7.383 1.00 0.00 C ATOM 1217 CD ARG A 83 8.403 -1.818 7.295 1.00 0.00 C ATOM 1218 NE ARG A 83 9.323 -2.923 7.552 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.590 -2.933 7.152 1.00 0.00 C ATOM 1220 NH1 ARG A 83 11.085 -1.903 6.481 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.364 -3.976 7.425 1.00 0.00 N ATOM 0 H ARG A 83 7.561 -0.620 10.630 1.00 0.00 H new ATOM 0 HA ARG A 83 5.272 -0.717 8.753 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.380 -2.791 9.409 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.787 -3.274 8.861 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.810 -3.177 6.820 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.313 -1.500 6.920 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.599 -1.406 6.305 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.586 -1.019 8.014 1.00 0.00 H new ATOM 0 HE ARG A 83 8.974 -3.731 8.067 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.493 -1.100 6.270 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.058 -1.914 6.175 1.00 0.00 H new ATOM 0 HH21 ARG A 83 10.986 -4.770 7.942 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.337 -3.984 7.118 1.00 0.00 H new ATOM 1235 N ASN A 84 3.765 -1.397 10.582 1.00 0.00 N ATOM 1236 CA ASN A 84 2.848 -1.732 11.665 1.00 0.00 C ATOM 1237 C ASN A 84 1.595 -2.415 11.125 1.00 0.00 C ATOM 1238 O ASN A 84 1.446 -2.598 9.917 1.00 0.00 O ATOM 1239 CB ASN A 84 2.461 -0.472 12.442 1.00 0.00 C ATOM 1240 CG ASN A 84 3.566 0.566 12.447 1.00 0.00 C ATOM 1241 OD1 ASN A 84 3.597 1.459 11.600 1.00 0.00 O ATOM 1242 ND2 ASN A 84 4.480 0.454 13.404 1.00 0.00 N ATOM 0 H ASN A 84 3.317 -0.986 9.763 1.00 0.00 H new ATOM 0 HA ASN A 84 3.356 -2.423 12.337 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.562 -0.040 12.003 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.216 -0.743 13.469 1.00 0.00 H new ATOM 0 HD21 ASN A 84 5.247 1.124 13.458 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.415 -0.302 14.085 1.00 0.00 H new ATOM 1249 N SER A 85 0.695 -2.789 12.029 1.00 0.00 N ATOM 1250 CA SER A 85 -0.544 -3.455 11.645 1.00 0.00 C ATOM 1251 C SER A 85 -1.589 -3.337 12.750 1.00 0.00 C ATOM 1252 O SER A 85 -1.494 -3.999 13.784 1.00 0.00 O ATOM 1253 CB SER A 85 -0.280 -4.929 11.332 1.00 0.00 C ATOM 1254 OG SER A 85 -0.091 -5.677 12.520 1.00 0.00 O ATOM 0 H SER A 85 0.801 -2.642 13.033 1.00 0.00 H new ATOM 0 HA SER A 85 -0.929 -2.965 10.751 1.00 0.00 H new ATOM 0 HB2 SER A 85 -1.118 -5.340 10.769 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.603 -5.017 10.699 1.00 0.00 H new ATOM 0 HG SER A 85 -0.268 -5.107 13.297 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.587 -2.490 12.523 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.652 -2.284 13.499 1.00 0.00 C ATOM 1262 C LEU A 86 -4.650 -3.437 13.467 1.00 0.00 C ATOM 1263 O LEU A 86 -5.333 -3.653 12.465 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.373 -0.962 13.225 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.710 -0.766 13.941 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.500 -0.654 15.443 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.425 0.466 13.407 1.00 0.00 C ATOM 0 H LEU A 86 -2.681 -1.935 11.672 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.201 -2.246 14.490 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.710 -0.144 13.506 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.543 -0.880 12.151 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.336 -1.637 13.747 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.462 -0.515 15.936 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.031 -1.565 15.814 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.856 0.199 15.658 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.374 0.590 13.928 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.804 1.347 13.570 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.610 0.345 12.340 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.731 -4.172 14.570 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.648 -5.303 14.670 1.00 0.00 C ATOM 1281 C LEU A 87 -6.991 -4.865 15.246 1.00 0.00 C ATOM 1282 O LEU A 87 -7.095 -3.811 15.873 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.040 -6.402 15.543 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.886 -7.190 14.922 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.503 -8.364 15.810 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.258 -7.672 13.528 1.00 0.00 C ATOM 0 H LEU A 87 -4.173 -4.006 15.408 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.814 -5.695 13.666 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.687 -5.949 16.470 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.830 -7.104 15.812 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.024 -6.529 14.837 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.680 -8.913 15.352 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.193 -7.995 16.788 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.361 -9.026 15.927 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.425 -8.231 13.102 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -5.135 -8.317 13.588 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.482 -6.814 12.894 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.017 -5.683 15.031 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.353 -5.381 15.530 1.00 0.00 C ATOM 1300 C ASN A 88 -9.291 -4.820 16.947 1.00 0.00 C ATOM 1301 O ASN A 88 -9.128 -5.564 17.914 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.226 -6.638 15.504 1.00 0.00 C ATOM 1303 CG ASN A 88 -10.334 -7.239 14.116 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -9.331 -8.018 13.730 1.00 0.00 O flip ATOM 1305 ND2 ASN A 88 -11.308 -7.004 13.400 1.00 0.00 N flip ATOM 0 H ASN A 88 -7.948 -6.560 14.515 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.795 -4.626 14.879 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.811 -7.379 16.187 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -11.223 -6.392 15.869 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -12.056 -6.399 13.739 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -11.367 -7.415 12.468 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.422 -3.502 17.063 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.379 -2.864 18.366 1.00 0.00 C ATOM 1314 C GLY A 89 -8.009 -2.952 19.009 1.00 0.00 C ATOM 1315 O GLY A 89 -7.787 -2.405 20.089 1.00 0.00 O ATOM 0 H GLY A 89 -9.557 -2.865 16.278 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.663 -1.816 18.264 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.115 -3.331 19.020 1.00 0.00 H new ATOM 1319 N SER A 90 -7.089 -3.644 18.345 1.00 0.00 N ATOM 1320 CA SER A 90 -5.735 -3.807 18.862 1.00 0.00 C ATOM 1321 C SER A 90 -4.704 -3.322 17.847 1.00 0.00 C ATOM 1322 O SER A 90 -5.043 -2.999 16.708 1.00 0.00 O ATOM 1323 CB SER A 90 -5.472 -5.274 19.210 1.00 0.00 C ATOM 1324 OG SER A 90 -4.662 -5.386 20.367 1.00 0.00 O ATOM 0 H SER A 90 -7.256 -4.101 17.448 1.00 0.00 H new ATOM 0 HA SER A 90 -5.643 -3.204 19.765 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.419 -5.788 19.374 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.983 -5.768 18.371 1.00 0.00 H new ATOM 0 HG SER A 90 -4.510 -6.333 20.569 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.446 -3.273 18.269 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.365 -2.826 17.398 1.00 0.00 C ATOM 1332 C TRP A 91 -1.213 -3.826 17.403 1.00 0.00 C ATOM 1333 O TRP A 91 -1.074 -4.621 18.331 1.00 0.00 O ATOM 1334 CB TRP A 91 -1.863 -1.450 17.837 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.500 -0.319 17.088 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.534 0.466 17.512 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.144 0.153 15.784 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.843 1.397 16.550 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -3.004 1.226 15.480 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.181 -0.225 14.844 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -2.930 1.922 14.277 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.109 0.466 13.650 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -1.978 1.530 13.375 1.00 0.00 C ATOM 0 H TRP A 91 -3.149 -3.537 19.208 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.756 -2.755 16.383 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -2.055 -1.324 18.903 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.783 -1.404 17.700 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -4.035 0.369 18.464 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.578 2.101 16.621 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.505 -1.043 15.048 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.600 2.742 14.063 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.370 0.181 12.916 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.895 2.051 12.433 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.390 -3.780 16.360 1.00 0.00 N ATOM 1355 CA GLY A 92 0.738 -4.688 16.265 1.00 0.00 C ATOM 1356 C GLY A 92 1.987 -4.130 16.919 1.00 0.00 C ATOM 1357 O GLY A 92 2.083 -4.078 18.145 1.00 0.00 O ATOM 0 H GLY A 92 -0.484 -3.130 15.579 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.478 -5.636 16.735 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.944 -4.898 15.216 1.00 0.00 H new ATOM 1361 N SER A 93 2.947 -3.714 16.100 1.00 0.00 N ATOM 1362 CA SER A 93 4.198 -3.163 16.606 1.00 0.00 C ATOM 1363 C SER A 93 4.941 -2.404 15.510 1.00 0.00 C ATOM 1364 O SER A 93 4.508 -2.376 14.359 1.00 0.00 O ATOM 1365 CB SER A 93 5.085 -4.280 17.160 1.00 0.00 C ATOM 1366 OG SER A 93 4.727 -4.602 18.493 1.00 0.00 O ATOM 0 H SER A 93 2.882 -3.748 15.083 1.00 0.00 H new ATOM 0 HA SER A 93 3.960 -2.466 17.409 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.994 -5.166 16.532 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.129 -3.970 17.125 1.00 0.00 H new ATOM 0 HG SER A 93 3.786 -4.373 18.643 1.00 0.00 H new ATOM 1372 N GLU A 94 6.062 -1.792 15.878 1.00 0.00 N ATOM 1373 CA GLU A 94 6.865 -1.033 14.927 1.00 0.00 C ATOM 1374 C GLU A 94 8.045 -1.861 14.428 1.00 0.00 C ATOM 1375 O GLU A 94 8.894 -2.284 15.212 1.00 0.00 O ATOM 1376 CB GLU A 94 7.371 0.260 15.570 1.00 0.00 C ATOM 1377 CG GLU A 94 6.322 0.976 16.405 1.00 0.00 C ATOM 1378 CD GLU A 94 6.912 2.078 17.263 1.00 0.00 C ATOM 1379 OE1 GLU A 94 7.810 1.779 18.078 1.00 0.00 O ATOM 1380 OE2 GLU A 94 6.474 3.239 17.121 1.00 0.00 O ATOM 0 H GLU A 94 6.434 -1.807 16.827 1.00 0.00 H new ATOM 0 HA GLU A 94 6.233 -0.783 14.075 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.230 0.030 16.200 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.721 0.933 14.787 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.565 1.400 15.745 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.817 0.253 17.046 1.00 0.00 H new ATOM 1387 N GLU A 95 8.090 -2.088 13.119 1.00 0.00 N ATOM 1388 CA GLU A 95 9.166 -2.867 12.516 1.00 0.00 C ATOM 1389 C GLU A 95 9.944 -2.029 11.506 1.00 0.00 C ATOM 1390 O GLU A 95 9.399 -1.595 10.490 1.00 0.00 O ATOM 1391 CB GLU A 95 8.601 -4.114 11.833 1.00 0.00 C ATOM 1392 CG GLU A 95 8.379 -5.280 12.781 1.00 0.00 C ATOM 1393 CD GLU A 95 9.639 -6.093 13.010 1.00 0.00 C ATOM 1394 OE1 GLU A 95 10.508 -5.638 13.782 1.00 0.00 O ATOM 1395 OE2 GLU A 95 9.754 -7.186 12.416 1.00 0.00 O ATOM 0 H GLU A 95 7.395 -1.744 12.456 1.00 0.00 H new ATOM 0 HA GLU A 95 9.848 -3.173 13.310 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.655 -3.859 11.356 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.283 -4.425 11.042 1.00 0.00 H new ATOM 0 HG2 GLU A 95 8.016 -4.902 13.737 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.601 -5.928 12.378 1.00 0.00 H new ATOM 1402 N LYS A 96 11.222 -1.804 11.792 1.00 0.00 N ATOM 1403 CA LYS A 96 12.077 -1.019 10.910 1.00 0.00 C ATOM 1404 C LYS A 96 13.285 -1.833 10.457 1.00 0.00 C ATOM 1405 O LYS A 96 14.093 -2.273 11.275 1.00 0.00 O ATOM 1406 CB LYS A 96 12.545 0.254 11.620 1.00 0.00 C ATOM 1407 CG LYS A 96 11.468 1.319 11.731 1.00 0.00 C ATOM 1408 CD LYS A 96 12.014 2.604 12.331 1.00 0.00 C ATOM 1409 CE LYS A 96 12.187 2.486 13.838 1.00 0.00 C ATOM 1410 NZ LYS A 96 12.100 3.811 14.511 1.00 0.00 N ATOM 0 H LYS A 96 11.689 -2.155 12.629 1.00 0.00 H new ATOM 0 HA LYS A 96 11.495 -0.745 10.030 1.00 0.00 H new ATOM 0 HB2 LYS A 96 12.893 -0.005 12.620 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.399 0.667 11.082 1.00 0.00 H new ATOM 0 HG2 LYS A 96 11.055 1.524 10.743 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.650 0.947 12.348 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.973 2.843 11.871 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.338 3.429 12.105 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.421 1.823 14.241 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.152 2.029 14.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.223 3.688 15.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.847 4.436 14.145 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.170 4.236 14.322 1.00 0.00 H new ATOM 1424 N LYS A 97 13.401 -2.030 9.148 1.00 0.00 N ATOM 1425 CA LYS A 97 14.511 -2.790 8.584 1.00 0.00 C ATOM 1426 C LYS A 97 14.584 -2.605 7.072 1.00 0.00 C ATOM 1427 O LYS A 97 13.747 -3.125 6.333 1.00 0.00 O ATOM 1428 CB LYS A 97 14.363 -4.275 8.921 1.00 0.00 C ATOM 1429 CG LYS A 97 15.415 -5.155 8.268 1.00 0.00 C ATOM 1430 CD LYS A 97 15.732 -6.372 9.120 1.00 0.00 C ATOM 1431 CE LYS A 97 16.535 -7.404 8.342 1.00 0.00 C ATOM 1432 NZ LYS A 97 17.975 -7.034 8.254 1.00 0.00 N ATOM 0 H LYS A 97 12.740 -1.674 8.458 1.00 0.00 H new ATOM 0 HA LYS A 97 15.436 -2.415 9.023 1.00 0.00 H new ATOM 0 HB2 LYS A 97 14.417 -4.401 10.002 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.375 -4.613 8.610 1.00 0.00 H new ATOM 0 HG2 LYS A 97 15.063 -5.478 7.288 1.00 0.00 H new ATOM 0 HG3 LYS A 97 16.325 -4.577 8.106 1.00 0.00 H new ATOM 0 HD2 LYS A 97 16.292 -6.064 10.003 1.00 0.00 H new ATOM 0 HD3 LYS A 97 14.804 -6.822 9.473 1.00 0.00 H new ATOM 0 HE2 LYS A 97 16.439 -8.377 8.823 1.00 0.00 H new ATOM 0 HE3 LYS A 97 16.123 -7.503 7.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 18.488 -7.762 7.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 18.069 -6.117 7.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 18.375 -6.964 9.212 1.00 0.00 H new ATOM 1446 N ILE A 98 15.589 -1.864 6.618 1.00 0.00 N ATOM 1447 CA ILE A 98 15.772 -1.614 5.194 1.00 0.00 C ATOM 1448 C ILE A 98 17.247 -1.439 4.851 1.00 0.00 C ATOM 1449 O ILE A 98 18.026 -0.925 5.654 1.00 0.00 O ATOM 1450 CB ILE A 98 14.998 -0.363 4.738 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.373 0.000 3.300 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.277 0.803 5.674 1.00 0.00 C ATOM 1453 CD1 ILE A 98 14.419 0.980 2.655 1.00 0.00 C ATOM 0 H ILE A 98 16.289 -1.426 7.216 1.00 0.00 H new ATOM 0 HA ILE A 98 15.381 -2.485 4.668 1.00 0.00 H new ATOM 0 HB ILE A 98 13.931 -0.583 4.771 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.377 0.424 3.291 1.00 0.00 H new ATOM 0 HG13 ILE A 98 15.406 -0.910 2.701 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.723 1.680 5.338 1.00 0.00 H new ATOM 0 HG22 ILE A 98 14.964 0.541 6.685 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.344 1.025 5.670 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.747 1.191 1.637 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.417 0.551 2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.404 1.905 3.231 1.00 0.00 H new ATOM 1465 N THR A 99 17.625 -1.867 3.651 1.00 0.00 N ATOM 1466 CA THR A 99 19.007 -1.757 3.200 1.00 0.00 C ATOM 1467 C THR A 99 19.252 -0.426 2.499 1.00 0.00 C ATOM 1468 O THR A 99 20.232 0.265 2.781 1.00 0.00 O ATOM 1469 CB THR A 99 19.379 -2.905 2.243 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.774 -2.845 1.925 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.559 -2.830 0.964 1.00 0.00 C ATOM 0 H THR A 99 16.993 -2.293 2.973 1.00 0.00 H new ATOM 0 HA THR A 99 19.635 -1.817 4.089 1.00 0.00 H new ATOM 0 HB THR A 99 19.161 -3.849 2.741 1.00 0.00 H new ATOM 0 HG1 THR A 99 21.003 -3.579 1.317 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.839 -3.651 0.304 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.499 -2.905 1.206 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.751 -1.881 0.464 1.00 0.00 H new ATOM 1479 N HIS A 100 18.355 -0.070 1.584 1.00 0.00 N ATOM 1480 CA HIS A 100 18.474 1.181 0.843 1.00 0.00 C ATOM 1481 C HIS A 100 17.116 1.862 0.706 1.00 0.00 C ATOM 1482 O HIS A 100 16.157 1.263 0.221 1.00 0.00 O ATOM 1483 CB HIS A 100 19.071 0.923 -0.540 1.00 0.00 C ATOM 1484 CG HIS A 100 18.060 0.495 -1.559 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.201 -0.566 -1.367 1.00 0.00 N ATOM 1486 CD2 HIS A 100 17.772 0.993 -2.784 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.429 -0.703 -2.430 1.00 0.00 C ATOM 1488 NE2 HIS A 100 16.756 0.231 -3.305 1.00 0.00 N ATOM 0 H HIS A 100 17.539 -0.630 1.338 1.00 0.00 H new ATOM 0 HA HIS A 100 19.138 1.843 1.399 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.564 1.830 -0.889 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.839 0.154 -0.457 1.00 0.00 H new ATOM 0 HD2 HIS A 100 18.252 1.834 -3.263 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.661 -1.451 -2.561 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.324 0.364 -4.219 1.00 0.00 H new ATOM 1497 N ASN A 101 17.042 3.117 1.136 1.00 0.00 N ATOM 1498 CA ASN A 101 15.801 3.879 1.062 1.00 0.00 C ATOM 1499 C ASN A 101 15.842 4.875 -0.093 1.00 0.00 C ATOM 1500 O ASN A 101 16.363 5.983 0.029 1.00 0.00 O ATOM 1501 CB ASN A 101 15.552 4.618 2.379 1.00 0.00 C ATOM 1502 CG ASN A 101 14.365 5.558 2.299 1.00 0.00 C ATOM 1503 OD1 ASN A 101 14.210 6.298 1.327 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.520 5.532 3.323 1.00 0.00 N ATOM 0 H ASN A 101 17.827 3.628 1.540 1.00 0.00 H new ATOM 0 HA ASN A 101 14.984 3.179 0.886 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.384 3.891 3.174 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.443 5.185 2.649 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.702 6.142 3.325 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.689 4.902 4.107 1.00 0.00 H new ATOM 1511 N PRO A 102 15.279 4.472 -1.242 1.00 0.00 N ATOM 1512 CA PRO A 102 15.238 5.314 -2.441 1.00 0.00 C ATOM 1513 C PRO A 102 14.295 6.502 -2.282 1.00 0.00 C ATOM 1514 O PRO A 102 14.551 7.585 -2.810 1.00 0.00 O ATOM 1515 CB PRO A 102 14.722 4.363 -3.524 1.00 0.00 C ATOM 1516 CG PRO A 102 13.947 3.329 -2.783 1.00 0.00 C ATOM 1517 CD PRO A 102 14.640 3.163 -1.459 1.00 0.00 C ATOM 0 HA PRO A 102 16.211 5.751 -2.666 1.00 0.00 H new ATOM 0 HB2 PRO A 102 14.094 4.887 -4.245 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.544 3.916 -4.083 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.912 3.641 -2.645 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.926 2.388 -3.333 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.934 2.923 -0.663 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.374 2.357 -1.488 1.00 0.00 H new ATOM 1525 N PHE A 103 13.205 6.294 -1.552 1.00 0.00 N ATOM 1526 CA PHE A 103 12.224 7.348 -1.324 1.00 0.00 C ATOM 1527 C PHE A 103 12.912 8.692 -1.103 1.00 0.00 C ATOM 1528 O PHE A 103 13.391 8.984 -0.008 1.00 0.00 O ATOM 1529 CB PHE A 103 11.347 7.006 -0.117 1.00 0.00 C ATOM 1530 CG PHE A 103 10.863 5.585 -0.112 1.00 0.00 C ATOM 1531 CD1 PHE A 103 10.085 5.100 -1.151 1.00 0.00 C ATOM 1532 CD2 PHE A 103 11.186 4.733 0.932 1.00 0.00 C ATOM 1533 CE1 PHE A 103 9.637 3.793 -1.148 1.00 0.00 C ATOM 1534 CE2 PHE A 103 10.741 3.424 0.940 1.00 0.00 C ATOM 1535 CZ PHE A 103 9.967 2.953 -0.102 1.00 0.00 C ATOM 0 H PHE A 103 12.978 5.404 -1.108 1.00 0.00 H new ATOM 0 HA PHE A 103 11.595 7.423 -2.211 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.911 7.192 0.797 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.486 7.675 -0.102 1.00 0.00 H new ATOM 0 HD1 PHE A 103 9.826 5.751 -1.973 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.792 5.096 1.749 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.029 3.428 -1.963 1.00 0.00 H new ATOM 0 HE2 PHE A 103 10.999 2.771 1.760 1.00 0.00 H new ATOM 0 HZ PHE A 103 9.620 1.930 -0.099 1.00 0.00 H new ATOM 1545 N GLY A 104 12.957 9.507 -2.153 1.00 0.00 N ATOM 1546 CA GLY A 104 13.588 10.810 -2.054 1.00 0.00 C ATOM 1547 C GLY A 104 12.704 11.924 -2.579 1.00 0.00 C ATOM 1548 O GLY A 104 12.072 11.801 -3.629 1.00 0.00 O ATOM 0 H GLY A 104 12.568 9.288 -3.070 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.839 11.010 -1.012 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.524 10.800 -2.612 1.00 0.00 H new ATOM 1552 N PRO A 105 12.651 13.041 -1.839 1.00 0.00 N ATOM 1553 CA PRO A 105 11.840 14.203 -2.217 1.00 0.00 C ATOM 1554 C PRO A 105 12.394 14.923 -3.441 1.00 0.00 C ATOM 1555 O PRO A 105 13.336 15.707 -3.339 1.00 0.00 O ATOM 1556 CB PRO A 105 11.919 15.106 -0.983 1.00 0.00 C ATOM 1557 CG PRO A 105 13.196 14.727 -0.317 1.00 0.00 C ATOM 1558 CD PRO A 105 13.378 13.257 -0.577 1.00 0.00 C ATOM 0 HA PRO A 105 10.824 13.920 -2.491 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.916 16.160 -1.263 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.066 14.949 -0.322 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.031 15.301 -0.719 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.154 14.932 0.753 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.431 12.993 -0.670 1.00 0.00 H new ATOM 0 HD3 PRO A 105 12.968 12.652 0.232 1.00 0.00 H new ATOM 1566 N GLY A 106 11.801 14.652 -4.600 1.00 0.00 N ATOM 1567 CA GLY A 106 12.249 15.283 -5.828 1.00 0.00 C ATOM 1568 C GLY A 106 12.476 14.283 -6.944 1.00 0.00 C ATOM 1569 O GLY A 106 12.709 14.667 -8.090 1.00 0.00 O ATOM 0 H GLY A 106 11.019 14.007 -4.710 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.509 16.017 -6.147 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.175 15.826 -5.637 1.00 0.00 H new ATOM 1573 N GLN A 107 12.409 12.999 -6.609 1.00 0.00 N ATOM 1574 CA GLN A 107 12.611 11.942 -7.593 1.00 0.00 C ATOM 1575 C GLN A 107 11.503 10.898 -7.505 1.00 0.00 C ATOM 1576 O GLN A 107 10.791 10.815 -6.504 1.00 0.00 O ATOM 1577 CB GLN A 107 13.972 11.277 -7.386 1.00 0.00 C ATOM 1578 CG GLN A 107 14.325 11.056 -5.923 1.00 0.00 C ATOM 1579 CD GLN A 107 15.813 10.862 -5.705 1.00 0.00 C ATOM 1580 OE1 GLN A 107 16.519 10.357 -6.578 1.00 0.00 O ATOM 1581 NE2 GLN A 107 16.297 11.263 -4.535 1.00 0.00 N ATOM 0 H GLN A 107 12.217 12.665 -5.665 1.00 0.00 H new ATOM 0 HA GLN A 107 12.582 12.393 -8.585 1.00 0.00 H new ATOM 0 HB2 GLN A 107 13.980 10.317 -7.902 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.743 11.894 -7.848 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.984 11.910 -5.338 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.790 10.182 -5.552 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.675 11.676 -3.840 1.00 0.00 H new ATOM 0 HE22 GLN A 107 17.291 11.158 -4.331 1.00 0.00 H new ATOM 1590 N PHE A 108 11.362 10.101 -8.560 1.00 0.00 N ATOM 1591 CA PHE A 108 10.339 9.063 -8.603 1.00 0.00 C ATOM 1592 C PHE A 108 10.787 7.826 -7.829 1.00 0.00 C ATOM 1593 O PHE A 108 11.935 7.735 -7.394 1.00 0.00 O ATOM 1594 CB PHE A 108 10.026 8.685 -10.052 1.00 0.00 C ATOM 1595 CG PHE A 108 9.394 9.799 -10.838 1.00 0.00 C ATOM 1596 CD1 PHE A 108 10.121 10.933 -11.164 1.00 0.00 C ATOM 1597 CD2 PHE A 108 8.074 9.711 -11.250 1.00 0.00 C ATOM 1598 CE1 PHE A 108 9.543 11.959 -11.888 1.00 0.00 C ATOM 1599 CE2 PHE A 108 7.491 10.734 -11.974 1.00 0.00 C ATOM 1600 CZ PHE A 108 8.226 11.860 -12.292 1.00 0.00 C ATOM 0 H PHE A 108 11.944 10.155 -9.396 1.00 0.00 H new ATOM 0 HA PHE A 108 9.437 9.457 -8.135 1.00 0.00 H new ATOM 0 HB2 PHE A 108 10.948 8.379 -10.547 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.359 7.823 -10.059 1.00 0.00 H new ATOM 0 HD1 PHE A 108 11.151 11.016 -10.849 1.00 0.00 H new ATOM 0 HD2 PHE A 108 7.495 8.834 -11.003 1.00 0.00 H new ATOM 0 HE1 PHE A 108 10.121 12.837 -12.137 1.00 0.00 H new ATOM 0 HE2 PHE A 108 6.462 10.653 -12.291 1.00 0.00 H new ATOM 0 HZ PHE A 108 7.771 12.661 -12.856 1.00 0.00 H new ATOM 1610 N PHE A 109 9.873 6.877 -7.661 1.00 0.00 N ATOM 1611 CA PHE A 109 10.172 5.646 -6.939 1.00 0.00 C ATOM 1612 C PHE A 109 9.156 4.558 -7.274 1.00 0.00 C ATOM 1613 O PHE A 109 7.958 4.718 -7.038 1.00 0.00 O ATOM 1614 CB PHE A 109 10.181 5.904 -5.431 1.00 0.00 C ATOM 1615 CG PHE A 109 8.808 6.011 -4.833 1.00 0.00 C ATOM 1616 CD1 PHE A 109 8.143 4.880 -4.384 1.00 0.00 C ATOM 1617 CD2 PHE A 109 8.181 7.241 -4.719 1.00 0.00 C ATOM 1618 CE1 PHE A 109 6.879 4.976 -3.834 1.00 0.00 C ATOM 1619 CE2 PHE A 109 6.917 7.343 -4.169 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.265 6.209 -3.725 1.00 0.00 C ATOM 0 H PHE A 109 8.918 6.937 -8.015 1.00 0.00 H new ATOM 0 HA PHE A 109 11.160 5.304 -7.248 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.722 5.098 -4.936 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.728 6.825 -5.231 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.618 3.914 -4.465 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.686 8.131 -5.064 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.371 4.087 -3.489 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.440 8.308 -4.086 1.00 0.00 H new ATOM 0 HZ PHE A 109 5.278 6.286 -3.294 1.00 0.00 H new ATOM 1630 N ASP A 110 9.643 3.452 -7.827 1.00 0.00 N ATOM 1631 CA ASP A 110 8.778 2.337 -8.195 1.00 0.00 C ATOM 1632 C ASP A 110 8.713 1.306 -7.071 1.00 0.00 C ATOM 1633 O ASP A 110 9.633 0.506 -6.895 1.00 0.00 O ATOM 1634 CB ASP A 110 9.280 1.677 -9.480 1.00 0.00 C ATOM 1635 CG ASP A 110 8.840 0.231 -9.599 1.00 0.00 C ATOM 1636 OD1 ASP A 110 7.622 -0.009 -9.737 1.00 0.00 O ATOM 1637 OD2 ASP A 110 9.714 -0.659 -9.554 1.00 0.00 O ATOM 0 H ASP A 110 10.632 3.304 -8.030 1.00 0.00 H new ATOM 0 HA ASP A 110 7.775 2.728 -8.364 1.00 0.00 H new ATOM 0 HB2 ASP A 110 8.913 2.237 -10.340 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.369 1.726 -9.509 1.00 0.00 H new ATOM 1642 N LEU A 111 7.623 1.333 -6.314 1.00 0.00 N ATOM 1643 CA LEU A 111 7.438 0.402 -5.206 1.00 0.00 C ATOM 1644 C LEU A 111 6.501 -0.735 -5.601 1.00 0.00 C ATOM 1645 O LEU A 111 5.469 -0.511 -6.234 1.00 0.00 O ATOM 1646 CB LEU A 111 6.881 1.135 -3.985 1.00 0.00 C ATOM 1647 CG LEU A 111 7.087 0.445 -2.636 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.518 -0.965 -2.666 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.563 0.418 -2.269 1.00 0.00 C ATOM 0 H LEU A 111 6.853 1.989 -6.446 1.00 0.00 H new ATOM 0 HA LEU A 111 8.410 -0.023 -4.955 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.339 2.123 -3.939 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.812 1.286 -4.134 1.00 0.00 H new ATOM 0 HG LEU A 111 6.555 1.014 -1.874 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.674 -1.441 -1.698 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.450 -0.922 -2.882 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.022 -1.544 -3.440 1.00 0.00 H new ATOM 0 HD21 LEU A 111 8.690 -0.077 -1.306 1.00 0.00 H new ATOM 0 HD22 LEU A 111 9.118 -0.127 -3.033 1.00 0.00 H new ATOM 0 HD23 LEU A 111 8.941 1.438 -2.205 1.00 0.00 H new ATOM 1661 N SER A 112 6.866 -1.956 -5.221 1.00 0.00 N ATOM 1662 CA SER A 112 6.059 -3.128 -5.537 1.00 0.00 C ATOM 1663 C SER A 112 6.053 -4.114 -4.373 1.00 0.00 C ATOM 1664 O SER A 112 7.080 -4.709 -4.044 1.00 0.00 O ATOM 1665 CB SER A 112 6.590 -3.814 -6.798 1.00 0.00 C ATOM 1666 OG SER A 112 6.796 -2.877 -7.840 1.00 0.00 O ATOM 0 H SER A 112 7.715 -2.159 -4.694 1.00 0.00 H new ATOM 0 HA SER A 112 5.036 -2.797 -5.715 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.527 -4.323 -6.572 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.884 -4.577 -7.125 1.00 0.00 H new ATOM 0 HG SER A 112 7.137 -3.340 -8.634 1.00 0.00 H new ATOM 1672 N ILE A 113 4.890 -4.279 -3.752 1.00 0.00 N ATOM 1673 CA ILE A 113 4.749 -5.193 -2.625 1.00 0.00 C ATOM 1674 C ILE A 113 4.204 -6.543 -3.076 1.00 0.00 C ATOM 1675 O ILE A 113 3.075 -6.639 -3.557 1.00 0.00 O ATOM 1676 CB ILE A 113 3.820 -4.612 -1.543 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.246 -3.187 -1.184 1.00 0.00 C ATOM 1678 CG2 ILE A 113 3.827 -5.500 -0.307 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.526 -2.122 -1.982 1.00 0.00 C ATOM 0 H ILE A 113 4.032 -3.792 -4.010 1.00 0.00 H new ATOM 0 HA ILE A 113 5.745 -5.330 -2.203 1.00 0.00 H new ATOM 0 HB ILE A 113 2.804 -4.578 -1.937 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.065 -3.019 -0.122 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.319 -3.086 -1.344 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.166 -5.076 0.449 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.480 -6.498 -0.574 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.840 -5.562 0.091 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.878 -1.137 -1.675 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.727 -2.264 -3.044 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.453 -2.196 -1.803 1.00 0.00 H new ATOM 1691 N ARG A 114 5.014 -7.585 -2.917 1.00 0.00 N ATOM 1692 CA ARG A 114 4.613 -8.931 -3.307 1.00 0.00 C ATOM 1693 C ARG A 114 3.922 -9.649 -2.152 1.00 0.00 C ATOM 1694 O ARG A 114 4.319 -9.510 -0.994 1.00 0.00 O ATOM 1695 CB ARG A 114 5.830 -9.736 -3.767 1.00 0.00 C ATOM 1696 CG ARG A 114 6.123 -9.602 -5.252 1.00 0.00 C ATOM 1697 CD ARG A 114 7.273 -10.503 -5.676 1.00 0.00 C ATOM 1698 NE ARG A 114 6.810 -11.828 -6.079 1.00 0.00 N ATOM 1699 CZ ARG A 114 6.373 -12.113 -7.301 1.00 0.00 C ATOM 1700 NH1 ARG A 114 6.340 -11.171 -8.233 1.00 0.00 N ATOM 1701 NH2 ARG A 114 5.969 -13.343 -7.592 1.00 0.00 N ATOM 0 H ARG A 114 5.952 -7.522 -2.521 1.00 0.00 H new ATOM 0 HA ARG A 114 3.908 -8.847 -4.134 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.704 -9.412 -3.202 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.670 -10.788 -3.530 1.00 0.00 H new ATOM 0 HG2 ARG A 114 5.231 -9.855 -5.824 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.367 -8.565 -5.484 1.00 0.00 H new ATOM 0 HD2 ARG A 114 7.811 -10.040 -6.503 1.00 0.00 H new ATOM 0 HD3 ARG A 114 7.980 -10.601 -4.852 1.00 0.00 H new ATOM 0 HE ARG A 114 6.823 -12.575 -5.385 1.00 0.00 H new ATOM 0 HH11 ARG A 114 6.651 -10.225 -8.013 1.00 0.00 H new ATOM 0 HH12 ARG A 114 6.004 -11.392 -9.170 1.00 0.00 H new ATOM 0 HH21 ARG A 114 5.994 -14.070 -6.877 1.00 0.00 H new ATOM 0 HH22 ARG A 114 5.634 -13.561 -8.530 1.00 0.00 H new ATOM 1715 N CYS A 115 2.885 -10.415 -2.474 1.00 0.00 N ATOM 1716 CA CYS A 115 2.137 -11.154 -1.463 1.00 0.00 C ATOM 1717 C CYS A 115 2.320 -12.658 -1.642 1.00 0.00 C ATOM 1718 O CYS A 115 1.906 -13.228 -2.650 1.00 0.00 O ATOM 1719 CB CYS A 115 0.652 -10.797 -1.534 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.413 -11.865 -0.537 1.00 0.00 S ATOM 0 H CYS A 115 2.543 -10.540 -3.427 1.00 0.00 H new ATOM 0 HA CYS A 115 2.524 -10.873 -0.483 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.521 -9.765 -1.208 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.327 -10.846 -2.573 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.613 -12.986 -1.164 1.00 0.00 H new ATOM 1726 N GLY A 116 2.946 -13.295 -0.656 1.00 0.00 N ATOM 1727 CA GLY A 116 3.175 -14.726 -0.725 1.00 0.00 C ATOM 1728 C GLY A 116 2.361 -15.493 0.298 1.00 0.00 C ATOM 1729 O GLY A 116 1.206 -15.155 0.563 1.00 0.00 O ATOM 0 H GLY A 116 3.298 -12.845 0.189 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.926 -15.083 -1.724 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.234 -14.929 -0.568 1.00 0.00 H new ATOM 1733 N LEU A 117 2.961 -16.530 0.872 1.00 0.00 N ATOM 1734 CA LEU A 117 2.283 -17.349 1.871 1.00 0.00 C ATOM 1735 C LEU A 117 2.967 -17.229 3.229 1.00 0.00 C ATOM 1736 O LEU A 117 2.314 -17.286 4.271 1.00 0.00 O ATOM 1737 CB LEU A 117 2.258 -18.813 1.427 1.00 0.00 C ATOM 1738 CG LEU A 117 1.638 -19.088 0.056 1.00 0.00 C ATOM 1739 CD1 LEU A 117 2.263 -20.324 -0.573 1.00 0.00 C ATOM 1740 CD2 LEU A 117 0.130 -19.252 0.176 1.00 0.00 C ATOM 0 H LEU A 117 3.915 -16.824 0.663 1.00 0.00 H new ATOM 0 HA LEU A 117 1.259 -16.987 1.968 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.281 -19.188 1.423 1.00 0.00 H new ATOM 0 HB3 LEU A 117 1.711 -19.389 2.173 1.00 0.00 H new ATOM 0 HG LEU A 117 1.840 -18.235 -0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.810 -20.505 -1.548 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.335 -20.168 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 117 2.092 -21.186 0.072 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.294 -19.447 -0.809 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.093 -20.088 0.839 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.304 -18.339 0.584 1.00 0.00 H new ATOM 1752 N ASP A 118 4.284 -17.061 3.209 1.00 0.00 N ATOM 1753 CA ASP A 118 5.057 -16.929 4.438 1.00 0.00 C ATOM 1754 C ASP A 118 5.155 -15.468 4.865 1.00 0.00 C ATOM 1755 O ASP A 118 5.026 -15.146 6.046 1.00 0.00 O ATOM 1756 CB ASP A 118 6.458 -17.513 4.251 1.00 0.00 C ATOM 1757 CG ASP A 118 6.435 -19.012 4.024 1.00 0.00 C ATOM 1758 OD1 ASP A 118 6.241 -19.434 2.865 1.00 0.00 O ATOM 1759 OD2 ASP A 118 6.610 -19.764 5.006 1.00 0.00 O ATOM 0 H ASP A 118 4.839 -17.013 2.355 1.00 0.00 H new ATOM 0 HA ASP A 118 4.542 -17.484 5.222 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.941 -17.027 3.403 1.00 0.00 H new ATOM 0 HB3 ASP A 118 7.061 -17.291 5.131 1.00 0.00 H new ATOM 1764 N ARG A 119 5.385 -14.588 3.896 1.00 0.00 N ATOM 1765 CA ARG A 119 5.503 -13.161 4.171 1.00 0.00 C ATOM 1766 C ARG A 119 5.425 -12.350 2.881 1.00 0.00 C ATOM 1767 O ARG A 119 5.214 -12.901 1.801 1.00 0.00 O ATOM 1768 CB ARG A 119 6.819 -12.866 4.893 1.00 0.00 C ATOM 1769 CG ARG A 119 8.053 -13.217 4.078 1.00 0.00 C ATOM 1770 CD ARG A 119 8.485 -14.656 4.313 1.00 0.00 C ATOM 1771 NE ARG A 119 9.399 -14.775 5.446 1.00 0.00 N ATOM 1772 CZ ARG A 119 10.202 -15.817 5.636 1.00 0.00 C ATOM 1773 NH1 ARG A 119 10.203 -16.823 4.773 1.00 0.00 N ATOM 1774 NH2 ARG A 119 11.005 -15.852 6.691 1.00 0.00 N ATOM 0 H ARG A 119 5.493 -14.838 2.913 1.00 0.00 H new ATOM 0 HA ARG A 119 4.671 -12.871 4.813 1.00 0.00 H new ATOM 0 HB2 ARG A 119 6.853 -11.807 5.150 1.00 0.00 H new ATOM 0 HB3 ARG A 119 6.842 -13.423 5.830 1.00 0.00 H new ATOM 0 HG2 ARG A 119 7.846 -13.067 3.019 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.868 -12.543 4.342 1.00 0.00 H new ATOM 0 HD2 ARG A 119 7.605 -15.274 4.491 1.00 0.00 H new ATOM 0 HD3 ARG A 119 8.969 -15.041 3.415 1.00 0.00 H new ATOM 0 HE ARG A 119 9.422 -14.017 6.128 1.00 0.00 H new ATOM 0 HH11 ARG A 119 9.587 -16.799 3.961 1.00 0.00 H new ATOM 0 HH12 ARG A 119 10.820 -17.621 4.921 1.00 0.00 H new ATOM 0 HH21 ARG A 119 11.006 -15.079 7.357 1.00 0.00 H new ATOM 0 HH22 ARG A 119 11.621 -16.652 6.837 1.00 0.00 H new ATOM 1788 N PHE A 120 5.597 -11.038 3.002 1.00 0.00 N ATOM 1789 CA PHE A 120 5.545 -10.150 1.847 1.00 0.00 C ATOM 1790 C PHE A 120 6.949 -9.740 1.412 1.00 0.00 C ATOM 1791 O PHE A 120 7.889 -9.764 2.206 1.00 0.00 O ATOM 1792 CB PHE A 120 4.715 -8.906 2.169 1.00 0.00 C ATOM 1793 CG PHE A 120 3.243 -9.088 1.930 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.497 -9.937 2.732 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.606 -8.411 0.903 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.143 -10.107 2.514 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.252 -8.577 0.680 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.520 -9.425 1.487 1.00 0.00 C ATOM 0 H PHE A 120 5.774 -10.566 3.889 1.00 0.00 H new ATOM 0 HA PHE A 120 5.073 -10.690 1.027 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.874 -8.633 3.212 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.073 -8.074 1.563 1.00 0.00 H new ATOM 0 HD1 PHE A 120 2.979 -10.472 3.537 1.00 0.00 H new ATOM 0 HD2 PHE A 120 3.174 -7.746 0.269 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.573 -10.772 3.146 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.767 -8.044 -0.125 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.538 -9.555 1.316 1.00 0.00 H new ATOM 1808 N LYS A 121 7.083 -9.364 0.145 1.00 0.00 N ATOM 1809 CA LYS A 121 8.371 -8.948 -0.398 1.00 0.00 C ATOM 1810 C LYS A 121 8.246 -7.618 -1.135 1.00 0.00 C ATOM 1811 O LYS A 121 7.710 -7.558 -2.242 1.00 0.00 O ATOM 1812 CB LYS A 121 8.919 -10.018 -1.344 1.00 0.00 C ATOM 1813 CG LYS A 121 9.006 -11.398 -0.716 1.00 0.00 C ATOM 1814 CD LYS A 121 9.911 -12.320 -1.517 1.00 0.00 C ATOM 1815 CE LYS A 121 11.369 -12.156 -1.117 1.00 0.00 C ATOM 1816 NZ LYS A 121 12.291 -12.735 -2.132 1.00 0.00 N ATOM 0 H LYS A 121 6.315 -9.339 -0.526 1.00 0.00 H new ATOM 0 HA LYS A 121 9.063 -8.819 0.434 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.283 -10.070 -2.228 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.911 -9.719 -1.682 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.383 -11.312 0.303 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.008 -11.833 -0.651 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.605 -13.355 -1.364 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.798 -12.108 -2.580 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.593 -11.097 -0.985 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.538 -12.640 -0.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 13.258 -12.757 -1.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.988 -13.703 -2.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.272 -12.151 -2.992 1.00 0.00 H new ATOM 1830 N VAL A 122 8.746 -6.554 -0.516 1.00 0.00 N ATOM 1831 CA VAL A 122 8.693 -5.225 -1.114 1.00 0.00 C ATOM 1832 C VAL A 122 9.946 -4.942 -1.935 1.00 0.00 C ATOM 1833 O VAL A 122 11.066 -5.160 -1.473 1.00 0.00 O ATOM 1834 CB VAL A 122 8.537 -4.132 -0.041 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.403 -2.762 -0.689 1.00 0.00 C ATOM 1836 CG2 VAL A 122 7.341 -4.428 0.851 1.00 0.00 C ATOM 0 H VAL A 122 9.193 -6.586 0.400 1.00 0.00 H new ATOM 0 HA VAL A 122 7.822 -5.207 -1.768 1.00 0.00 H new ATOM 0 HB VAL A 122 9.432 -4.127 0.580 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.294 -2.002 0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.293 -2.551 -1.281 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.526 -2.750 -1.336 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.246 -3.645 1.604 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.435 -4.461 0.246 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.484 -5.390 1.344 1.00 0.00 H new ATOM 1846 N TYR A 123 9.750 -4.455 -3.155 1.00 0.00 N ATOM 1847 CA TYR A 123 10.864 -4.143 -4.042 1.00 0.00 C ATOM 1848 C TYR A 123 10.828 -2.678 -4.468 1.00 0.00 C ATOM 1849 O TYR A 123 9.760 -2.075 -4.565 1.00 0.00 O ATOM 1850 CB TYR A 123 10.829 -5.045 -5.277 1.00 0.00 C ATOM 1851 CG TYR A 123 11.027 -6.511 -4.961 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.973 -7.293 -4.505 1.00 0.00 C ATOM 1853 CD2 TYR A 123 12.269 -7.113 -5.120 1.00 0.00 C ATOM 1854 CE1 TYR A 123 10.151 -8.632 -4.215 1.00 0.00 C ATOM 1855 CE2 TYR A 123 12.456 -8.452 -4.834 1.00 0.00 C ATOM 1856 CZ TYR A 123 11.394 -9.207 -4.381 1.00 0.00 C ATOM 1857 OH TYR A 123 11.574 -10.540 -4.095 1.00 0.00 O ATOM 0 H TYR A 123 8.829 -4.268 -3.552 1.00 0.00 H new ATOM 0 HA TYR A 123 11.790 -4.322 -3.496 1.00 0.00 H new ATOM 0 HB2 TYR A 123 9.872 -4.917 -5.783 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.604 -4.724 -5.973 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.998 -6.847 -4.375 1.00 0.00 H new ATOM 0 HD2 TYR A 123 13.103 -6.524 -5.473 1.00 0.00 H new ATOM 0 HE1 TYR A 123 9.321 -9.226 -3.860 1.00 0.00 H new ATOM 0 HE2 TYR A 123 13.428 -8.905 -4.964 1.00 0.00 H new ATOM 0 HH TYR A 123 12.420 -10.847 -4.483 1.00 0.00 H new ATOM 1867 N ALA A 124 12.004 -2.113 -4.722 1.00 0.00 N ATOM 1868 CA ALA A 124 12.108 -0.721 -5.140 1.00 0.00 C ATOM 1869 C ALA A 124 13.069 -0.571 -6.315 1.00 0.00 C ATOM 1870 O ALA A 124 14.282 -0.702 -6.157 1.00 0.00 O ATOM 1871 CB ALA A 124 12.558 0.148 -3.974 1.00 0.00 C ATOM 0 H ALA A 124 12.898 -2.598 -4.645 1.00 0.00 H new ATOM 0 HA ALA A 124 11.122 -0.391 -5.466 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.631 1.185 -4.300 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.833 0.073 -3.163 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.532 -0.191 -3.622 1.00 0.00 H new ATOM 1877 N ASN A 125 12.517 -0.297 -7.493 1.00 0.00 N ATOM 1878 CA ASN A 125 13.325 -0.131 -8.695 1.00 0.00 C ATOM 1879 C ASN A 125 14.174 -1.372 -8.955 1.00 0.00 C ATOM 1880 O ASN A 125 15.304 -1.275 -9.433 1.00 0.00 O ATOM 1881 CB ASN A 125 14.226 1.098 -8.563 1.00 0.00 C ATOM 1882 CG ASN A 125 13.567 2.217 -7.780 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.692 2.916 -8.292 1.00 0.00 O ATOM 1884 ND2 ASN A 125 13.985 2.391 -6.532 1.00 0.00 N ATOM 0 H ASN A 125 11.514 -0.185 -7.640 1.00 0.00 H new ATOM 0 HA ASN A 125 12.651 0.010 -9.540 1.00 0.00 H new ATOM 0 HB2 ASN A 125 15.156 0.812 -8.071 1.00 0.00 H new ATOM 0 HB3 ASN A 125 14.490 1.460 -9.557 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.578 3.128 -5.956 1.00 0.00 H new ATOM 0 HD22 ASN A 125 14.713 1.788 -6.149 1.00 0.00 H new ATOM 1891 N GLY A 126 13.621 -2.539 -8.638 1.00 0.00 N ATOM 1892 CA GLY A 126 14.340 -3.782 -8.845 1.00 0.00 C ATOM 1893 C GLY A 126 15.327 -4.073 -7.732 1.00 0.00 C ATOM 1894 O GLY A 126 16.424 -4.572 -7.982 1.00 0.00 O ATOM 0 H GLY A 126 12.687 -2.645 -8.241 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.627 -4.603 -8.918 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.872 -3.737 -9.795 1.00 0.00 H new ATOM 1898 N GLN A 127 14.937 -3.759 -6.501 1.00 0.00 N ATOM 1899 CA GLN A 127 15.797 -3.988 -5.346 1.00 0.00 C ATOM 1900 C GLN A 127 14.972 -4.356 -4.117 1.00 0.00 C ATOM 1901 O GLN A 127 14.043 -3.639 -3.743 1.00 0.00 O ATOM 1902 CB GLN A 127 16.639 -2.745 -5.056 1.00 0.00 C ATOM 1903 CG GLN A 127 17.362 -2.201 -6.278 1.00 0.00 C ATOM 1904 CD GLN A 127 18.630 -1.451 -5.920 1.00 0.00 C ATOM 1905 OE1 GLN A 127 18.686 -0.224 -6.014 1.00 0.00 O ATOM 1906 NE2 GLN A 127 19.656 -2.185 -5.508 1.00 0.00 N ATOM 0 H GLN A 127 14.032 -3.346 -6.278 1.00 0.00 H new ATOM 0 HA GLN A 127 16.460 -4.821 -5.578 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.994 -1.966 -4.649 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.373 -2.985 -4.287 1.00 0.00 H new ATOM 0 HG2 GLN A 127 17.609 -3.026 -6.947 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.693 -1.536 -6.825 1.00 0.00 H new ATOM 0 HE21 GLN A 127 19.565 -3.199 -5.445 1.00 0.00 H new ATOM 0 HE22 GLN A 127 20.535 -1.735 -5.254 1.00 0.00 H new ATOM 1915 N HIS A 128 15.317 -5.477 -3.493 1.00 0.00 N ATOM 1916 CA HIS A 128 14.608 -5.940 -2.305 1.00 0.00 C ATOM 1917 C HIS A 128 14.699 -4.911 -1.182 1.00 0.00 C ATOM 1918 O HIS A 128 15.725 -4.801 -0.509 1.00 0.00 O ATOM 1919 CB HIS A 128 15.178 -7.278 -1.834 1.00 0.00 C ATOM 1920 CG HIS A 128 14.484 -7.834 -0.628 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.089 -7.940 0.606 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.228 -8.314 -0.473 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.236 -8.463 1.469 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.099 -8.699 0.839 1.00 0.00 N ATOM 0 H HIS A 128 16.083 -6.082 -3.790 1.00 0.00 H new ATOM 0 HA HIS A 128 13.558 -6.073 -2.568 1.00 0.00 H new ATOM 0 HB2 HIS A 128 15.109 -8.000 -2.648 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.237 -7.153 -1.608 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.469 -8.382 -1.238 1.00 0.00 H new ATOM 0 HE1 HIS A 128 14.434 -8.663 2.512 1.00 0.00 H new ATOM 0 HE2 HIS A 128 12.261 -9.102 1.259 1.00 0.00 H new ATOM 1933 N LEU A 129 13.621 -4.160 -0.986 1.00 0.00 N ATOM 1934 CA LEU A 129 13.580 -3.139 0.055 1.00 0.00 C ATOM 1935 C LEU A 129 13.544 -3.775 1.441 1.00 0.00 C ATOM 1936 O LEU A 129 14.490 -3.648 2.218 1.00 0.00 O ATOM 1937 CB LEU A 129 12.359 -2.237 -0.136 1.00 0.00 C ATOM 1938 CG LEU A 129 12.514 -0.790 0.333 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.450 -0.026 -0.591 1.00 0.00 C ATOM 1940 CD2 LEU A 129 11.157 -0.104 0.405 1.00 0.00 C ATOM 0 H LEU A 129 12.764 -4.239 -1.534 1.00 0.00 H new ATOM 0 HA LEU A 129 14.485 -2.537 -0.025 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.100 -2.229 -1.195 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.517 -2.682 0.395 1.00 0.00 H new ATOM 0 HG LEU A 129 12.949 -0.798 1.332 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.548 1.002 -0.241 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.430 -0.504 -0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 129 13.044 -0.028 -1.603 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.287 0.925 0.741 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.694 -0.108 -0.582 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.517 -0.637 1.108 1.00 0.00 H new ATOM 1952 N PHE A 130 12.447 -4.462 1.743 1.00 0.00 N ATOM 1953 CA PHE A 130 12.288 -5.120 3.035 1.00 0.00 C ATOM 1954 C PHE A 130 11.187 -6.174 2.976 1.00 0.00 C ATOM 1955 O PHE A 130 10.467 -6.281 1.983 1.00 0.00 O ATOM 1956 CB PHE A 130 11.967 -4.089 4.119 1.00 0.00 C ATOM 1957 CG PHE A 130 10.588 -3.506 4.002 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.472 -4.261 4.322 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.408 -2.201 3.571 1.00 0.00 C ATOM 1960 CE1 PHE A 130 8.201 -3.727 4.215 1.00 0.00 C ATOM 1961 CE2 PHE A 130 9.140 -1.661 3.463 1.00 0.00 C ATOM 1962 CZ PHE A 130 8.036 -2.426 3.784 1.00 0.00 C ATOM 0 H PHE A 130 11.655 -4.578 1.111 1.00 0.00 H new ATOM 0 HA PHE A 130 13.227 -5.615 3.282 1.00 0.00 H new ATOM 0 HB2 PHE A 130 12.073 -4.557 5.097 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.699 -3.283 4.071 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.596 -5.279 4.659 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.268 -1.599 3.317 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.339 -4.327 4.468 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.013 -0.642 3.128 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.044 -2.007 3.698 1.00 0.00 H new ATOM 1972 N ASP A 131 11.062 -6.950 4.047 1.00 0.00 N ATOM 1973 CA ASP A 131 10.049 -7.996 4.119 1.00 0.00 C ATOM 1974 C ASP A 131 9.073 -7.729 5.261 1.00 0.00 C ATOM 1975 O ASP A 131 9.453 -7.200 6.306 1.00 0.00 O ATOM 1976 CB ASP A 131 10.709 -9.363 4.305 1.00 0.00 C ATOM 1977 CG ASP A 131 11.555 -9.432 5.561 1.00 0.00 C ATOM 1978 OD1 ASP A 131 12.217 -8.424 5.885 1.00 0.00 O ATOM 1979 OD2 ASP A 131 11.557 -10.494 6.218 1.00 0.00 O ATOM 0 H ASP A 131 11.650 -6.874 4.877 1.00 0.00 H new ATOM 0 HA ASP A 131 9.493 -7.994 3.181 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.938 -10.133 4.347 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.332 -9.583 3.438 1.00 0.00 H new ATOM 1984 N PHE A 132 7.813 -8.099 5.054 1.00 0.00 N ATOM 1985 CA PHE A 132 6.782 -7.897 6.066 1.00 0.00 C ATOM 1986 C PHE A 132 6.286 -9.234 6.610 1.00 0.00 C ATOM 1987 O PHE A 132 5.566 -9.964 5.930 1.00 0.00 O ATOM 1988 CB PHE A 132 5.610 -7.106 5.479 1.00 0.00 C ATOM 1989 CG PHE A 132 4.274 -7.520 6.026 1.00 0.00 C ATOM 1990 CD1 PHE A 132 4.080 -7.653 7.392 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.212 -7.777 5.175 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.852 -8.034 7.897 1.00 0.00 C ATOM 1993 CE2 PHE A 132 1.981 -8.158 5.674 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.800 -8.286 7.038 1.00 0.00 C ATOM 0 H PHE A 132 7.482 -8.540 4.196 1.00 0.00 H new ATOM 0 HA PHE A 132 7.219 -7.330 6.888 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.762 -6.045 5.678 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.605 -7.230 4.396 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.898 -7.457 8.069 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.348 -7.678 4.108 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.714 -8.135 8.963 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.161 -8.355 4.999 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.839 -8.582 7.431 1.00 0.00 H new ATOM 2004 N ALA A 133 6.677 -9.546 7.841 1.00 0.00 N ATOM 2005 CA ALA A 133 6.272 -10.793 8.478 1.00 0.00 C ATOM 2006 C ALA A 133 4.759 -10.850 8.660 1.00 0.00 C ATOM 2007 O ALA A 133 4.140 -9.882 9.103 1.00 0.00 O ATOM 2008 CB ALA A 133 6.973 -10.953 9.819 1.00 0.00 C ATOM 0 H ALA A 133 7.274 -8.952 8.417 1.00 0.00 H new ATOM 0 HA ALA A 133 6.565 -11.617 7.827 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.661 -11.889 10.283 1.00 0.00 H new ATOM 0 HB2 ALA A 133 8.052 -10.966 9.666 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.709 -10.119 10.469 1.00 0.00 H new ATOM 2014 N HIS A 134 4.169 -11.990 8.315 1.00 0.00 N ATOM 2015 CA HIS A 134 2.727 -12.173 8.441 1.00 0.00 C ATOM 2016 C HIS A 134 2.284 -12.019 9.893 1.00 0.00 C ATOM 2017 O HIS A 134 2.447 -12.932 10.702 1.00 0.00 O ATOM 2018 CB HIS A 134 2.318 -13.549 7.915 1.00 0.00 C ATOM 2019 CG HIS A 134 2.285 -13.633 6.420 1.00 0.00 C ATOM 2020 ND1 HIS A 134 2.552 -14.664 5.585 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.946 -12.567 5.613 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.371 -14.208 4.302 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 2.005 -12.939 4.347 1.00 0.00 N flip ATOM 0 H HIS A 134 4.667 -12.800 7.946 1.00 0.00 H new ATOM 0 HA HIS A 134 2.235 -11.404 7.846 1.00 0.00 H new ATOM 0 HB2 HIS A 134 3.013 -14.296 8.297 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.332 -13.800 8.307 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.675 -11.582 5.962 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.506 -14.791 3.403 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.803 -12.347 3.541 1.00 0.00 H new ATOM 2032 N ARG A 135 1.725 -10.857 10.215 1.00 0.00 N ATOM 2033 CA ARG A 135 1.261 -10.582 11.570 1.00 0.00 C ATOM 2034 C ARG A 135 -0.180 -11.047 11.756 1.00 0.00 C ATOM 2035 O ARG A 135 -0.513 -11.689 12.754 1.00 0.00 O ATOM 2036 CB ARG A 135 1.369 -9.087 11.876 1.00 0.00 C ATOM 2037 CG ARG A 135 2.742 -8.665 12.373 1.00 0.00 C ATOM 2038 CD ARG A 135 2.673 -7.366 13.162 1.00 0.00 C ATOM 2039 NE ARG A 135 3.762 -7.255 14.129 1.00 0.00 N ATOM 2040 CZ ARG A 135 3.776 -7.888 15.296 1.00 0.00 C ATOM 2041 NH1 ARG A 135 2.765 -8.673 15.640 1.00 0.00 N ATOM 2042 NH2 ARG A 135 4.803 -7.736 16.123 1.00 0.00 N ATOM 0 H ARG A 135 1.582 -10.091 9.557 1.00 0.00 H new ATOM 0 HA ARG A 135 1.896 -11.134 12.263 1.00 0.00 H new ATOM 0 HB2 ARG A 135 1.128 -8.522 10.975 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.623 -8.823 12.626 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.161 -9.452 13.001 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.415 -8.542 11.525 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.712 -6.521 12.474 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.718 -7.309 13.684 1.00 0.00 H new ATOM 0 HE ARG A 135 4.555 -6.658 13.895 1.00 0.00 H new ATOM 0 HH11 ARG A 135 1.974 -8.792 15.008 1.00 0.00 H new ATOM 0 HH12 ARG A 135 2.778 -9.158 16.537 1.00 0.00 H new ATOM 0 HH21 ARG A 135 5.583 -7.132 15.862 1.00 0.00 H new ATOM 0 HH22 ARG A 135 4.812 -8.223 17.019 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.031 -10.720 10.790 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.437 -11.104 10.846 1.00 0.00 C ATOM 2058 C LEU A 136 -2.694 -12.355 10.012 1.00 0.00 C ATOM 2059 O LEU A 136 -2.674 -12.307 8.782 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.320 -9.957 10.352 1.00 0.00 C ATOM 2061 CG LEU A 136 -4.815 -10.258 10.246 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.496 -10.061 11.591 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.462 -9.380 9.184 1.00 0.00 C ATOM 0 H LEU A 136 -0.772 -10.190 9.958 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.686 -11.325 11.884 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.187 -9.108 11.023 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -2.962 -9.646 9.370 1.00 0.00 H new ATOM 0 HG LEU A 136 -4.936 -11.300 9.950 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.560 -10.280 11.496 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.052 -10.733 12.326 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.366 -9.029 11.917 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.526 -9.608 9.122 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.330 -8.331 9.449 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -4.993 -9.571 8.219 1.00 0.00 H new ATOM 2075 N SER A 137 -2.938 -13.472 10.689 1.00 0.00 N ATOM 2076 CA SER A 137 -3.198 -14.736 10.010 1.00 0.00 C ATOM 2077 C SER A 137 -4.297 -14.575 8.965 1.00 0.00 C ATOM 2078 O SER A 137 -4.301 -15.258 7.941 1.00 0.00 O ATOM 2079 CB SER A 137 -3.595 -15.812 11.023 1.00 0.00 C ATOM 2080 OG SER A 137 -4.941 -15.653 11.434 1.00 0.00 O ATOM 0 H SER A 137 -2.961 -13.528 11.707 1.00 0.00 H new ATOM 0 HA SER A 137 -2.282 -15.043 9.505 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.461 -16.799 10.581 1.00 0.00 H new ATOM 0 HB3 SER A 137 -2.938 -15.759 11.891 1.00 0.00 H new ATOM 0 HG SER A 137 -5.171 -16.353 12.080 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.230 -13.667 9.232 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.335 -13.414 8.315 1.00 0.00 C ATOM 2088 C ALA A 138 -5.916 -12.460 7.201 1.00 0.00 C ATOM 2089 O ALA A 138 -6.738 -11.716 6.666 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.531 -12.854 9.070 1.00 0.00 C ATOM 0 H ALA A 138 -5.243 -13.094 10.076 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.620 -14.362 7.858 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.348 -12.670 8.372 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -7.853 -13.571 9.825 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.250 -11.919 9.554 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.633 -12.486 6.857 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.105 -11.622 5.808 1.00 0.00 C ATOM 2098 C PHE A 139 -4.963 -11.707 4.550 1.00 0.00 C ATOM 2099 O PHE A 139 -5.142 -10.717 3.841 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.660 -12.006 5.480 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.548 -13.213 4.593 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -3.024 -14.444 5.013 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -1.965 -13.115 3.340 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.922 -15.557 4.199 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -1.861 -14.224 2.521 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.339 -15.446 2.952 1.00 0.00 C ATOM 0 H PHE A 139 -3.939 -13.096 7.290 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.127 -10.595 6.173 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.169 -11.162 4.996 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.123 -12.197 6.409 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -3.480 -14.536 5.988 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -1.588 -12.162 2.999 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -3.298 -16.511 4.538 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.407 -14.135 1.545 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.257 -16.314 2.314 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.491 -12.897 4.280 1.00 0.00 N ATOM 2117 CA GLN A 140 -6.330 -13.111 3.107 1.00 0.00 C ATOM 2118 C GLN A 140 -7.565 -12.217 3.149 1.00 0.00 C ATOM 2119 O GLN A 140 -8.102 -11.835 2.110 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.752 -14.579 3.017 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.817 -14.969 4.029 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.228 -15.525 5.311 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -6.156 -15.107 5.748 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -7.929 -16.474 5.921 1.00 0.00 N ATOM 0 H GLN A 140 -5.353 -13.727 4.857 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.747 -12.852 2.223 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.126 -14.780 2.013 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.875 -15.210 3.163 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -8.428 -14.097 4.263 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.479 -15.712 3.586 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -8.813 -16.790 5.523 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -7.583 -16.886 6.787 1.00 0.00 H new ATOM 2133 N ARG A 141 -8.009 -11.887 4.358 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.181 -11.039 4.535 1.00 0.00 C ATOM 2135 C ARG A 141 -8.921 -9.633 4.001 1.00 0.00 C ATOM 2136 O ARG A 141 -9.799 -9.013 3.402 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.569 -10.971 6.013 1.00 0.00 C ATOM 2138 CG ARG A 141 -9.809 -12.333 6.643 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.540 -12.212 7.971 1.00 0.00 C ATOM 2140 NE ARG A 141 -11.960 -11.925 7.790 1.00 0.00 N ATOM 2141 CZ ARG A 141 -12.870 -12.855 7.524 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -12.510 -14.126 7.409 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -14.144 -12.515 7.373 1.00 0.00 N ATOM 0 H ARG A 141 -7.575 -12.194 5.228 1.00 0.00 H new ATOM 0 HA ARG A 141 -10.004 -11.477 3.970 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -8.780 -10.459 6.564 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.472 -10.369 6.116 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.391 -12.953 5.961 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -8.855 -12.837 6.796 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.426 -13.139 8.533 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.083 -11.421 8.565 1.00 0.00 H new ATOM 0 HE ARG A 141 -12.270 -10.957 7.872 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -11.532 -14.392 7.525 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -13.211 -14.838 7.205 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -14.425 -11.538 7.461 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -14.842 -13.230 7.169 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.708 -9.136 4.224 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.332 -7.804 3.766 1.00 0.00 C ATOM 2159 C VAL A 142 -7.561 -7.654 2.266 1.00 0.00 C ATOM 2160 O VAL A 142 -6.840 -8.237 1.457 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.856 -7.498 4.082 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.498 -6.085 3.647 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.577 -7.694 5.565 1.00 0.00 C ATOM 0 H VAL A 142 -6.969 -9.636 4.719 1.00 0.00 H new ATOM 0 HA VAL A 142 -7.965 -7.095 4.300 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.231 -8.194 3.522 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.451 -5.887 3.878 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.658 -5.983 2.574 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -6.128 -5.371 4.177 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.529 -7.473 5.770 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.210 -7.023 6.146 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.792 -8.726 5.842 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.568 -6.868 1.903 1.00 0.00 N ATOM 2174 CA ASP A 143 -8.892 -6.640 0.499 1.00 0.00 C ATOM 2175 C ASP A 143 -9.016 -5.148 0.206 1.00 0.00 C ATOM 2176 O ASP A 143 -9.743 -4.739 -0.699 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.193 -7.354 0.131 1.00 0.00 C ATOM 2178 CG ASP A 143 -11.384 -6.820 0.901 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -11.900 -5.747 0.526 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -11.801 -7.476 1.879 1.00 0.00 O ATOM 0 H ASP A 143 -9.174 -6.378 2.561 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.081 -7.045 -0.106 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -10.375 -7.243 -0.938 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -10.086 -8.421 0.327 1.00 0.00 H new ATOM 2185 N THR A 144 -8.301 -4.336 0.980 1.00 0.00 N ATOM 2186 CA THR A 144 -8.332 -2.890 0.806 1.00 0.00 C ATOM 2187 C THR A 144 -6.930 -2.297 0.876 1.00 0.00 C ATOM 2188 O THR A 144 -6.136 -2.654 1.747 1.00 0.00 O ATOM 2189 CB THR A 144 -9.217 -2.214 1.871 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.302 -3.079 2.226 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.763 -0.890 1.360 1.00 0.00 C ATOM 0 H THR A 144 -7.693 -4.657 1.734 1.00 0.00 H new ATOM 0 HA THR A 144 -8.755 -2.700 -0.181 1.00 0.00 H new ATOM 0 HB THR A 144 -8.604 -2.020 2.751 1.00 0.00 H new ATOM 0 HG1 THR A 144 -10.859 -2.643 2.904 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.385 -0.432 2.129 1.00 0.00 H new ATOM 0 HG22 THR A 144 -8.935 -0.224 1.118 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.362 -1.064 0.466 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.630 -1.388 -0.046 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.321 -0.744 -0.088 1.00 0.00 C ATOM 2201 C LEU A 145 -5.463 0.770 -0.203 1.00 0.00 C ATOM 2202 O LEU A 145 -5.768 1.294 -1.274 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.504 -1.282 -1.264 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.377 -0.379 -1.767 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.192 -0.424 -0.815 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -2.952 -0.788 -3.170 1.00 0.00 C ATOM 0 H LEU A 145 -7.275 -1.080 -0.774 1.00 0.00 H new ATOM 0 HA LEU A 145 -4.801 -0.972 0.842 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -4.073 -2.240 -0.973 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.184 -1.477 -2.093 1.00 0.00 H new ATOM 0 HG LEU A 145 -3.748 0.645 -1.805 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.400 0.225 -1.189 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.505 -0.082 0.172 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.821 -1.446 -0.744 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.149 -0.135 -3.512 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.600 -1.819 -3.157 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -3.802 -0.703 -3.847 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.238 1.466 0.907 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.340 2.921 0.929 1.00 0.00 C ATOM 2220 C GLU A 146 -3.957 3.562 1.001 1.00 0.00 C ATOM 2221 O GLU A 146 -3.018 2.977 1.541 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.188 3.377 2.118 1.00 0.00 C ATOM 2223 CG GLU A 146 -5.959 2.559 3.378 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.541 3.217 4.615 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -7.775 3.158 4.794 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -5.760 3.790 5.403 1.00 0.00 O ATOM 0 H GLU A 146 -4.984 1.047 1.802 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.822 3.240 0.005 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -5.969 4.424 2.330 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.242 3.321 1.845 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.405 1.572 3.252 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.889 2.409 3.520 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.841 4.767 0.453 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.574 5.487 0.455 1.00 0.00 C ATOM 2235 C ILE A 147 -2.787 6.973 0.723 1.00 0.00 C ATOM 2236 O ILE A 147 -3.315 7.696 -0.122 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.829 5.320 -0.883 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.749 3.841 -1.266 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.436 5.926 -0.792 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.569 3.610 -2.750 1.00 0.00 C ATOM 0 H ILE A 147 -4.609 5.265 0.002 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.969 5.059 1.254 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.383 5.847 -1.660 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.918 3.380 -0.731 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.658 3.339 -0.936 1.00 0.00 H new ATOM 0 HG21 ILE A 147 0.078 5.800 -1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.516 6.988 -0.560 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.128 5.424 -0.006 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.520 2.539 -2.948 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.412 4.041 -3.290 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.645 4.083 -3.082 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.372 7.421 1.903 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.517 8.822 2.282 1.00 0.00 C ATOM 2254 C GLN A 148 -1.159 9.449 2.579 1.00 0.00 C ATOM 2255 O GLN A 148 -0.145 8.755 2.647 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.428 8.950 3.504 1.00 0.00 C ATOM 2257 CG GLN A 148 -3.151 7.914 4.581 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.958 6.645 4.392 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -3.281 5.560 4.035 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -5.178 6.639 4.565 1.00 0.00 N flip ATOM 0 H GLN A 148 -1.933 6.835 2.613 1.00 0.00 H new ATOM 0 HA GLN A 148 -2.967 9.354 1.444 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.311 9.946 3.931 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.466 8.860 3.184 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -2.089 7.668 4.579 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.377 8.342 5.558 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.658 7.496 4.839 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.707 5.777 4.434 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.146 10.767 2.753 1.00 0.00 N ATOM 2270 CA GLY A 149 0.093 11.466 3.039 1.00 0.00 C ATOM 2271 C GLY A 149 0.555 12.326 1.880 1.00 0.00 C ATOM 2272 O GLY A 149 -0.260 12.819 1.101 1.00 0.00 O ATOM 0 H GLY A 149 -1.972 11.363 2.701 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -0.042 12.092 3.921 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.869 10.739 3.280 1.00 0.00 H new ATOM 2276 N ASP A 150 1.866 12.508 1.766 1.00 0.00 N ATOM 2277 CA ASP A 150 2.436 13.315 0.693 1.00 0.00 C ATOM 2278 C ASP A 150 3.127 12.434 -0.342 1.00 0.00 C ATOM 2279 O ASP A 150 4.312 12.124 -0.218 1.00 0.00 O ATOM 2280 CB ASP A 150 3.429 14.330 1.262 1.00 0.00 C ATOM 2281 CG ASP A 150 2.857 15.107 2.432 1.00 0.00 C ATOM 2282 OD1 ASP A 150 2.066 16.042 2.192 1.00 0.00 O ATOM 2283 OD2 ASP A 150 3.202 14.780 3.587 1.00 0.00 O ATOM 0 H ASP A 150 2.554 12.108 2.403 1.00 0.00 H new ATOM 0 HA ASP A 150 1.622 13.850 0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.332 13.810 1.582 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.723 15.026 0.476 1.00 0.00 H new ATOM 2288 N VAL A 151 2.377 12.031 -1.364 1.00 0.00 N ATOM 2289 CA VAL A 151 2.917 11.185 -2.421 1.00 0.00 C ATOM 2290 C VAL A 151 2.198 11.431 -3.743 1.00 0.00 C ATOM 2291 O VAL A 151 0.974 11.561 -3.783 1.00 0.00 O ATOM 2292 CB VAL A 151 2.805 9.692 -2.058 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.381 9.349 -1.647 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.256 8.826 -3.224 1.00 0.00 C ATOM 0 H VAL A 151 1.394 12.277 -1.482 1.00 0.00 H new ATOM 0 HA VAL A 151 3.970 11.447 -2.529 1.00 0.00 H new ATOM 0 HB VAL A 151 3.461 9.490 -1.211 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.320 8.290 -1.394 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.099 9.946 -0.780 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.702 9.564 -2.472 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.170 7.774 -2.951 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.628 9.028 -4.091 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.294 9.054 -3.467 1.00 0.00 H new ATOM 2304 N THR A 152 2.967 11.494 -4.826 1.00 0.00 N ATOM 2305 CA THR A 152 2.404 11.725 -6.150 1.00 0.00 C ATOM 2306 C THR A 152 2.207 10.412 -6.900 1.00 0.00 C ATOM 2307 O THR A 152 3.123 9.918 -7.559 1.00 0.00 O ATOM 2308 CB THR A 152 3.304 12.652 -6.989 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.617 13.835 -6.245 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.621 13.034 -8.294 1.00 0.00 C ATOM 0 H THR A 152 3.981 11.388 -4.812 1.00 0.00 H new ATOM 0 HA THR A 152 1.437 12.205 -6.003 1.00 0.00 H new ATOM 0 HB THR A 152 4.224 12.115 -7.222 1.00 0.00 H new ATOM 0 HG1 THR A 152 4.191 14.418 -6.784 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.276 13.689 -8.869 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.410 12.134 -8.871 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.688 13.553 -8.078 1.00 0.00 H new ATOM 2318 N LEU A 153 1.007 9.852 -6.798 1.00 0.00 N ATOM 2319 CA LEU A 153 0.689 8.596 -7.468 1.00 0.00 C ATOM 2320 C LEU A 153 0.420 8.824 -8.953 1.00 0.00 C ATOM 2321 O LEU A 153 -0.326 9.728 -9.327 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.528 7.940 -6.813 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.389 7.600 -5.329 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.737 7.213 -4.742 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.623 6.482 -5.130 1.00 0.00 C ATOM 0 H LEU A 153 0.238 10.248 -6.258 1.00 0.00 H new ATOM 0 HA LEU A 153 1.548 7.933 -7.371 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.383 8.605 -6.934 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.757 7.023 -7.355 1.00 0.00 H new ATOM 0 HG LEU A 153 -0.029 8.485 -4.805 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.619 6.974 -3.685 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.433 8.045 -4.850 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.127 6.342 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.709 6.254 -4.068 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.293 5.593 -5.667 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.594 6.797 -5.513 1.00 0.00 H new ATOM 2337 N SER A 154 1.032 7.996 -9.793 1.00 0.00 N ATOM 2338 CA SER A 154 0.861 8.107 -11.237 1.00 0.00 C ATOM 2339 C SER A 154 0.250 6.833 -11.812 1.00 0.00 C ATOM 2340 O SER A 154 -0.614 6.885 -12.687 1.00 0.00 O ATOM 2341 CB SER A 154 2.205 8.391 -11.911 1.00 0.00 C ATOM 2342 OG SER A 154 2.766 9.604 -11.438 1.00 0.00 O ATOM 0 H SER A 154 1.651 7.241 -9.499 1.00 0.00 H new ATOM 0 HA SER A 154 0.181 8.936 -11.434 1.00 0.00 H new ATOM 0 HB2 SER A 154 2.893 7.568 -11.718 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.069 8.446 -12.991 1.00 0.00 H new ATOM 0 HG SER A 154 3.625 9.762 -11.882 1.00 0.00 H new ATOM 2348 N TYR A 155 0.706 5.689 -11.313 1.00 0.00 N ATOM 2349 CA TYR A 155 0.207 4.400 -11.777 1.00 0.00 C ATOM 2350 C TYR A 155 0.079 3.416 -10.619 1.00 0.00 C ATOM 2351 O TYR A 155 1.015 3.228 -9.842 1.00 0.00 O ATOM 2352 CB TYR A 155 1.136 3.826 -12.848 1.00 0.00 C ATOM 2353 CG TYR A 155 0.682 2.490 -13.391 1.00 0.00 C ATOM 2354 CD1 TYR A 155 0.953 1.311 -12.707 1.00 0.00 C ATOM 2355 CD2 TYR A 155 -0.020 2.406 -14.587 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.541 0.089 -13.200 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.437 1.188 -15.087 1.00 0.00 C ATOM 2358 CZ TYR A 155 -0.154 0.032 -14.390 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.568 -1.184 -14.884 1.00 0.00 O ATOM 0 H TYR A 155 1.420 5.628 -10.587 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.782 4.556 -12.208 1.00 0.00 H new ATOM 0 HB2 TYR A 155 1.211 4.537 -13.671 1.00 0.00 H new ATOM 0 HB3 TYR A 155 2.136 3.717 -12.429 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.495 1.351 -11.774 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.244 3.309 -15.135 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.762 -0.818 -12.657 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -0.982 1.141 -16.018 1.00 0.00 H new ATOM 0 HH TYR A 155 -1.045 -1.048 -15.729 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.088 2.789 -10.509 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.341 1.823 -9.448 1.00 0.00 C ATOM 2371 C VAL A 156 -2.150 0.638 -9.964 1.00 0.00 C ATOM 2372 O VAL A 156 -3.352 0.751 -10.200 1.00 0.00 O ATOM 2373 CB VAL A 156 -2.092 2.468 -8.268 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.516 1.409 -7.261 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.229 3.531 -7.605 1.00 0.00 C ATOM 0 H VAL A 156 -1.874 2.934 -11.143 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.369 1.472 -9.102 1.00 0.00 H new ATOM 0 HB VAL A 156 -2.991 2.950 -8.652 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -3.045 1.884 -6.435 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.174 0.688 -7.746 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.633 0.896 -6.880 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.775 3.976 -6.773 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.311 3.075 -7.234 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -0.981 4.304 -8.332 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.481 -0.498 -10.136 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.138 -1.704 -10.625 1.00 0.00 C ATOM 2387 C GLN A 157 -2.020 -2.838 -9.611 1.00 0.00 C ATOM 2388 O GLN A 157 -0.936 -3.110 -9.094 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.533 -2.134 -11.962 1.00 0.00 C ATOM 2390 CG GLN A 157 -2.031 -3.485 -12.449 1.00 0.00 C ATOM 2391 CD GLN A 157 -1.889 -3.653 -13.949 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -2.959 -3.365 -14.681 1.00 0.00 O flip ATOM 2393 NE2 GLN A 157 -0.830 -4.038 -14.445 1.00 0.00 N flip ATOM 0 H GLN A 157 -0.485 -0.608 -9.944 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.195 -1.478 -10.769 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -1.762 -1.379 -12.714 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.448 -2.169 -11.866 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.476 -4.276 -11.944 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -3.078 -3.604 -12.171 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -0.032 -4.248 -13.845 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -0.750 -4.147 -15.456 1.00 0.00 H new ATOM 2402 N ILE A 158 -3.140 -3.495 -9.332 1.00 0.00 N ATOM 2403 CA ILE A 158 -3.161 -4.599 -8.381 1.00 0.00 C ATOM 2404 C ILE A 158 -3.214 -5.943 -9.099 1.00 0.00 C ATOM 2405 O ILE A 158 -4.291 -6.481 -9.352 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.362 -4.494 -7.422 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.341 -3.152 -6.688 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.349 -5.647 -6.430 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.719 -2.622 -6.359 1.00 0.00 C ATOM 0 H ILE A 158 -4.045 -3.282 -9.751 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.239 -4.535 -7.803 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.281 -4.553 -8.006 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.772 -3.261 -5.764 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -3.816 -2.420 -7.301 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.203 -5.559 -5.759 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.407 -6.592 -6.970 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.427 -5.617 -5.849 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.627 -1.668 -5.839 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.284 -2.481 -7.280 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.240 -3.335 -5.720 1.00 0.00 H new ATOM 2421 N SER A 159 -2.042 -6.480 -9.425 1.00 0.00 N ATOM 2422 CA SER A 159 -1.955 -7.761 -10.117 1.00 0.00 C ATOM 2423 C SER A 159 -2.763 -8.829 -9.387 1.00 0.00 C ATOM 2424 O SER A 159 -2.874 -8.810 -8.162 1.00 0.00 O ATOM 2425 CB SER A 159 -0.495 -8.202 -10.235 1.00 0.00 C ATOM 2426 OG SER A 159 -0.400 -9.522 -10.741 1.00 0.00 O ATOM 0 H SER A 159 -1.141 -6.048 -9.221 1.00 0.00 H new ATOM 0 HA SER A 159 -2.371 -7.635 -11.116 1.00 0.00 H new ATOM 0 HB2 SER A 159 0.043 -7.518 -10.892 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.016 -8.149 -9.258 1.00 0.00 H new ATOM 0 HG SER A 159 0.543 -9.779 -10.808 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.327 -9.760 -10.150 1.00 0.00 N ATOM 2433 CA GLY A 160 -4.118 -10.824 -9.560 1.00 0.00 C ATOM 2434 C GLY A 160 -4.637 -11.803 -10.594 1.00 0.00 C ATOM 2435 O GLY A 160 -4.355 -11.687 -11.787 1.00 0.00 O ATOM 0 H GLY A 160 -3.250 -9.796 -11.166 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -3.513 -11.360 -8.829 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -4.960 -10.390 -9.020 1.00 0.00 H new ATOM 2439 N PRO A 161 -5.414 -12.796 -10.137 1.00 0.00 N ATOM 2440 CA PRO A 161 -5.989 -13.819 -11.015 1.00 0.00 C ATOM 2441 C PRO A 161 -7.075 -13.258 -11.927 1.00 0.00 C ATOM 2442 O PRO A 161 -7.850 -12.391 -11.523 1.00 0.00 O ATOM 2443 CB PRO A 161 -6.585 -14.833 -10.035 1.00 0.00 C ATOM 2444 CG PRO A 161 -6.864 -14.048 -8.800 1.00 0.00 C ATOM 2445 CD PRO A 161 -5.792 -12.996 -8.728 1.00 0.00 C ATOM 0 HA PRO A 161 -5.244 -14.243 -11.689 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -7.495 -15.281 -10.434 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -5.889 -15.648 -9.837 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -7.854 -13.594 -8.841 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -6.843 -14.688 -7.918 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -6.162 -12.075 -8.277 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -4.944 -13.327 -8.128 1.00 0.00 H new ATOM 2453 N SER A 162 -7.125 -13.758 -13.157 1.00 0.00 N ATOM 2454 CA SER A 162 -8.115 -13.303 -14.127 1.00 0.00 C ATOM 2455 C SER A 162 -9.517 -13.749 -13.723 1.00 0.00 C ATOM 2456 O SER A 162 -9.800 -14.944 -13.641 1.00 0.00 O ATOM 2457 CB SER A 162 -7.778 -13.839 -15.520 1.00 0.00 C ATOM 2458 OG SER A 162 -8.240 -12.959 -16.530 1.00 0.00 O ATOM 0 H SER A 162 -6.492 -14.478 -13.506 1.00 0.00 H new ATOM 0 HA SER A 162 -8.092 -12.213 -14.149 1.00 0.00 H new ATOM 0 HB2 SER A 162 -6.700 -13.969 -15.612 1.00 0.00 H new ATOM 0 HB3 SER A 162 -8.230 -14.822 -15.654 1.00 0.00 H new ATOM 0 HG SER A 162 -8.011 -13.323 -17.411 1.00 0.00 H new ATOM 2464 N SER A 163 -10.390 -12.779 -13.472 1.00 0.00 N ATOM 2465 CA SER A 163 -11.762 -13.070 -13.073 1.00 0.00 C ATOM 2466 C SER A 163 -12.674 -13.165 -14.292 1.00 0.00 C ATOM 2467 O SER A 163 -12.645 -12.305 -15.171 1.00 0.00 O ATOM 2468 CB SER A 163 -12.278 -11.992 -12.118 1.00 0.00 C ATOM 2469 OG SER A 163 -11.441 -11.875 -10.981 1.00 0.00 O ATOM 0 H SER A 163 -10.172 -11.785 -13.538 1.00 0.00 H new ATOM 0 HA SER A 163 -11.769 -14.032 -12.561 1.00 0.00 H new ATOM 0 HB2 SER A 163 -12.327 -11.035 -12.637 1.00 0.00 H new ATOM 0 HB3 SER A 163 -13.293 -12.236 -11.803 1.00 0.00 H new ATOM 0 HG SER A 163 -11.791 -11.179 -10.387 1.00 0.00 H new ATOM 2475 N GLY A 164 -13.484 -14.219 -14.337 1.00 0.00 N ATOM 2476 CA GLY A 164 -14.394 -14.408 -15.452 1.00 0.00 C ATOM 2477 C GLY A 164 -14.472 -15.855 -15.897 1.00 0.00 C ATOM 2478 O GLY A 164 -13.941 -16.218 -16.947 1.00 0.00 O ATOM 0 H GLY A 164 -13.526 -14.945 -13.622 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -15.389 -14.064 -15.168 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -14.071 -13.790 -16.290 1.00 0.00 H new TER 2482 GLY A 164