USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=42 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 USER MOD Set 1.2: A 157 GLN : amide:sc=-0.00133 X(o=-0.0013,f=0) USER MOD Set 2.1: A 78 ASN : amide:sc= 0.00491 X(o=0.009,f=0.067) USER MOD Set 2.2: A 80 THR OG1 : rot 180:sc= 0.00406 USER MOD Set 3.1: A 55 SER OG : rot 19:sc= 1.49 USER MOD Set 3.2: A 76 MET CE :methyl -167:sc= -1.99 (180deg=-1.94) USER MOD Set 4.1: A 59 ASN : amide:sc= -4.19 K(o=-8.5,f=-13!) USER MOD Set 4.2: A 71 HIS : no HD1:sc= -4.32 K(o=-8.5,f=-13!) USER MOD Set 5.1: A 16 THR OG1 : rot 80:sc= -0.0168 USER MOD Set 5.2: A 34 GLN : amide:sc= 0 X(o=-0.017,f=-0.017) USER MOD Set 6.1: A 17 MET CE :methyl -140:sc= -0.0972 (180deg=-1.03) USER MOD Set 6.2: A 22 THR OG1 : rot -160:sc= 0 USER MOD Set 6.3: A 29 TYR OH : rot 108:sc= 0.0417 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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HE2:sc= 0.259 K(o=0.26,f=-1.3) USER MOD Single : A 9 GLN : amide:sc= -1.31 K(o=-1.3,f=-6.2!) USER MOD Single : A 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.0495 X(o=-0.049,f=-0.55) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.955 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot -130:sc= -0.813 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -120:sc= -0.133 (180deg=-0.625) 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 65 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN :FLIP amide:sc= -9.67! C(o=-11!,f=-9.7!) USER MOD Single : A 84 ASN : amide:sc= -1.26 K(o=-1.3,f=-4.8!) USER MOD Single : A 85 SER OG : rot 15:sc= -1.63 USER MOD Single : A 88 ASN :FLIP amide:sc= -7.36! C(o=-8.3!,f=-7.4!) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 7:sc= 1.29 USER MOD Single : A 96 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.104) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= -0.662 K(o=-0.66,f=-3.4!) USER MOD Single : A 101 ASN : amide:sc= -3.68! C(o=-3.7!,f=-6.2!) USER MOD Single : A 107 GLN : amide:sc= -0.0305 X(o=-0.031,f=-0.34) USER MOD Single : A 112 SER OG : rot 180:sc= -0.04 USER MOD Single : A 115 CYS SG : rot -86:sc= -0.779 USER MOD Single : A 121 LYS NZ :NH3+ -169:sc=-0.00714 (180deg=-0.0889) USER MOD Single : A 123 TYR OH : rot 50:sc= -0.631 USER MOD Single : A 125 ASN : amide:sc= -0.815 K(o=-0.82,f=-1.4) USER MOD Single : A 127 GLN :FLIP amide:sc= 0.951 F(o=0,f=0.95) USER MOD Single : A 128 HIS : no HD1:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 134 HIS :FLIP no HD1:sc= -5.11 F(o=-6.5!,f=-5.1) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.146 X(o=-0.15,f=0) USER MOD Single : A 144 THR OG1 : rot -140:sc= -0.42 USER MOD Single : A 148 GLN :FLIP amide:sc= 0.231 F(o=-2.2,f=0.23) 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 -15.288 -4.124 29.412 1.00 0.00 N ATOM 2 CA GLY A 1 -14.058 -3.935 28.665 1.00 0.00 C ATOM 3 C GLY A 1 -14.077 -4.647 27.327 1.00 0.00 C ATOM 4 O GLY A 1 -13.219 -5.485 27.049 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.225 -3.618 30.318 1.00 0.00 H new ATOM 0 H2 GLY A 1 -16.089 -3.752 28.862 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.433 -5.138 29.591 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -13.895 -2.869 28.504 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -13.218 -4.301 29.256 1.00 0.00 H new ATOM 8 N SER A 2 -15.059 -4.315 26.495 1.00 0.00 N ATOM 9 CA SER A 2 -15.190 -4.932 25.181 1.00 0.00 C ATOM 10 C SER A 2 -15.336 -3.871 24.094 1.00 0.00 C ATOM 11 O SER A 2 -16.443 -3.574 23.646 1.00 0.00 O ATOM 12 CB SER A 2 -16.395 -5.875 25.154 1.00 0.00 C ATOM 13 OG SER A 2 -16.460 -6.585 23.930 1.00 0.00 O ATOM 0 H SER A 2 -15.776 -3.622 26.708 1.00 0.00 H new ATOM 0 HA SER A 2 -14.284 -5.506 24.985 1.00 0.00 H new ATOM 0 HB2 SER A 2 -16.328 -6.579 25.983 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.312 -5.303 25.295 1.00 0.00 H new ATOM 0 HG SER A 2 -17.238 -7.181 23.939 1.00 0.00 H new ATOM 19 N SER A 3 -14.210 -3.303 23.676 1.00 0.00 N ATOM 20 CA SER A 3 -14.211 -2.272 22.644 1.00 0.00 C ATOM 21 C SER A 3 -15.144 -2.652 21.498 1.00 0.00 C ATOM 22 O SER A 3 -14.801 -3.474 20.650 1.00 0.00 O ATOM 23 CB SER A 3 -12.794 -2.052 22.112 1.00 0.00 C ATOM 24 OG SER A 3 -12.745 -0.939 21.236 1.00 0.00 O ATOM 0 H SER A 3 -13.285 -3.539 24.036 1.00 0.00 H new ATOM 0 HA SER A 3 -14.571 -1.345 23.091 1.00 0.00 H new ATOM 0 HB2 SER A 3 -12.110 -1.893 22.946 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.456 -2.946 21.588 1.00 0.00 H new ATOM 0 HG SER A 3 -11.828 -0.819 20.911 1.00 0.00 H new ATOM 30 N GLY A 4 -16.327 -2.044 21.481 1.00 0.00 N ATOM 31 CA GLY A 4 -17.292 -2.330 20.435 1.00 0.00 C ATOM 32 C GLY A 4 -18.051 -1.095 19.993 1.00 0.00 C ATOM 33 O GLY A 4 -19.099 -0.770 20.550 1.00 0.00 O ATOM 0 H GLY A 4 -16.634 -1.359 22.172 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.776 -2.762 19.577 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -17.999 -3.079 20.792 1.00 0.00 H new ATOM 37 N SER A 5 -17.519 -0.403 18.990 1.00 0.00 N ATOM 38 CA SER A 5 -18.151 0.807 18.477 1.00 0.00 C ATOM 39 C SER A 5 -18.745 0.565 17.093 1.00 0.00 C ATOM 40 O SER A 5 -18.101 0.819 16.075 1.00 0.00 O ATOM 41 CB SER A 5 -17.136 1.951 18.415 1.00 0.00 C ATOM 42 OG SER A 5 -16.969 2.554 19.687 1.00 0.00 O ATOM 0 H SER A 5 -16.652 -0.660 18.517 1.00 0.00 H new ATOM 0 HA SER A 5 -18.957 1.082 19.157 1.00 0.00 H new ATOM 0 HB2 SER A 5 -16.178 1.572 18.060 1.00 0.00 H new ATOM 0 HB3 SER A 5 -17.470 2.699 17.695 1.00 0.00 H new ATOM 0 HG SER A 5 -16.315 3.281 19.621 1.00 0.00 H new ATOM 48 N SER A 6 -19.979 0.071 17.065 1.00 0.00 N ATOM 49 CA SER A 6 -20.661 -0.210 15.807 1.00 0.00 C ATOM 50 C SER A 6 -21.515 0.978 15.374 1.00 0.00 C ATOM 51 O SER A 6 -22.309 1.503 16.154 1.00 0.00 O ATOM 52 CB SER A 6 -21.535 -1.458 15.944 1.00 0.00 C ATOM 53 OG SER A 6 -21.778 -2.052 14.680 1.00 0.00 O ATOM 0 H SER A 6 -20.526 -0.143 17.899 1.00 0.00 H new ATOM 0 HA SER A 6 -19.903 -0.388 15.044 1.00 0.00 H new ATOM 0 HB2 SER A 6 -21.046 -2.178 16.600 1.00 0.00 H new ATOM 0 HB3 SER A 6 -22.483 -1.193 16.413 1.00 0.00 H new ATOM 0 HG SER A 6 -22.337 -2.849 14.795 1.00 0.00 H new ATOM 59 N GLY A 7 -21.345 1.398 14.124 1.00 0.00 N ATOM 60 CA GLY A 7 -22.106 2.521 13.609 1.00 0.00 C ATOM 61 C GLY A 7 -22.845 2.182 12.329 1.00 0.00 C ATOM 62 O GLY A 7 -22.472 1.249 11.617 1.00 0.00 O ATOM 0 H GLY A 7 -20.694 0.981 13.459 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.822 2.847 14.363 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -21.433 3.359 13.426 1.00 0.00 H new ATOM 66 N HIS A 8 -23.897 2.940 12.037 1.00 0.00 N ATOM 67 CA HIS A 8 -24.691 2.714 10.834 1.00 0.00 C ATOM 68 C HIS A 8 -23.798 2.340 9.655 1.00 0.00 C ATOM 69 O HIS A 8 -22.632 2.729 9.601 1.00 0.00 O ATOM 70 CB HIS A 8 -25.507 3.962 10.495 1.00 0.00 C ATOM 71 CG HIS A 8 -24.676 5.104 9.996 1.00 0.00 C ATOM 72 ND1 HIS A 8 -24.381 5.294 8.663 1.00 0.00 N ATOM 73 CD2 HIS A 8 -24.078 6.120 10.661 1.00 0.00 C ATOM 74 CE1 HIS A 8 -23.635 6.376 8.529 1.00 0.00 C ATOM 75 NE2 HIS A 8 -23.438 6.897 9.726 1.00 0.00 N ATOM 0 H HIS A 8 -24.219 3.715 12.616 1.00 0.00 H new ATOM 0 HA HIS A 8 -25.372 1.885 11.028 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -26.249 3.706 9.739 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -26.053 4.281 11.383 1.00 0.00 H new ATOM 0 HD1 HIS A 8 -24.690 4.693 7.899 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -24.100 6.288 11.728 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -23.251 6.768 7.598 1.00 0.00 H new ATOM 84 N GLN A 9 -24.354 1.583 8.715 1.00 0.00 N ATOM 85 CA GLN A 9 -23.606 1.155 7.538 1.00 0.00 C ATOM 86 C GLN A 9 -23.640 2.226 6.453 1.00 0.00 C ATOM 87 O GLN A 9 -24.464 3.139 6.496 1.00 0.00 O ATOM 88 CB GLN A 9 -24.175 -0.156 6.995 1.00 0.00 C ATOM 89 CG GLN A 9 -25.622 -0.049 6.539 1.00 0.00 C ATOM 90 CD GLN A 9 -25.750 0.493 5.129 1.00 0.00 C ATOM 91 OE1 GLN A 9 -26.202 1.620 4.924 1.00 0.00 O ATOM 92 NE2 GLN A 9 -25.351 -0.308 4.148 1.00 0.00 N ATOM 0 H GLN A 9 -25.319 1.253 8.745 1.00 0.00 H new ATOM 0 HA GLN A 9 -22.569 0.997 7.835 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -23.562 -0.489 6.157 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -24.102 -0.922 7.767 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -26.089 -1.033 6.590 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -26.168 0.599 7.224 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -24.983 -1.234 4.364 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -25.413 0.003 3.179 1.00 0.00 H new ATOM 101 N GLN A 10 -22.739 2.107 5.483 1.00 0.00 N ATOM 102 CA GLN A 10 -22.667 3.066 4.387 1.00 0.00 C ATOM 103 C GLN A 10 -23.838 2.887 3.428 1.00 0.00 C ATOM 104 O GLN A 10 -23.871 1.939 2.641 1.00 0.00 O ATOM 105 CB GLN A 10 -21.345 2.911 3.632 1.00 0.00 C ATOM 106 CG GLN A 10 -20.121 3.211 4.481 1.00 0.00 C ATOM 107 CD GLN A 10 -18.828 2.792 3.809 1.00 0.00 C ATOM 108 OE1 GLN A 10 -18.317 3.487 2.931 1.00 0.00 O ATOM 109 NE2 GLN A 10 -18.290 1.649 4.220 1.00 0.00 N ATOM 0 H GLN A 10 -22.050 1.357 5.434 1.00 0.00 H new ATOM 0 HA GLN A 10 -22.720 4.069 4.811 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -21.271 1.893 3.250 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -21.349 3.576 2.768 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -20.085 4.279 4.695 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -20.212 2.697 5.438 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -18.747 1.104 4.951 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -17.420 1.317 3.805 1.00 0.00 H new ATOM 118 N LEU A 11 -24.799 3.801 3.498 1.00 0.00 N ATOM 119 CA LEU A 11 -25.974 3.744 2.635 1.00 0.00 C ATOM 120 C LEU A 11 -25.587 3.948 1.174 1.00 0.00 C ATOM 121 O LEU A 11 -26.251 3.444 0.270 1.00 0.00 O ATOM 122 CB LEU A 11 -26.993 4.804 3.057 1.00 0.00 C ATOM 123 CG LEU A 11 -26.425 6.043 3.750 1.00 0.00 C ATOM 124 CD1 LEU A 11 -27.298 7.257 3.474 1.00 0.00 C ATOM 125 CD2 LEU A 11 -26.298 5.805 5.248 1.00 0.00 C ATOM 0 H LEU A 11 -24.788 4.591 4.143 1.00 0.00 H new ATOM 0 HA LEU A 11 -26.422 2.756 2.738 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -27.540 5.127 2.171 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -27.716 4.338 3.726 1.00 0.00 H new ATOM 0 HG LEU A 11 -25.431 6.237 3.347 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -26.878 8.129 3.975 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -27.338 7.440 2.400 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -28.305 7.074 3.848 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -25.892 6.697 5.725 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -27.280 5.585 5.666 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -25.630 4.962 5.427 1.00 0.00 H new ATOM 137 N ASN A 12 -24.507 4.690 0.951 1.00 0.00 N ATOM 138 CA ASN A 12 -24.030 4.959 -0.401 1.00 0.00 C ATOM 139 C ASN A 12 -22.675 4.301 -0.641 1.00 0.00 C ATOM 140 O ASN A 12 -21.697 4.602 0.043 1.00 0.00 O ATOM 141 CB ASN A 12 -23.926 6.468 -0.636 1.00 0.00 C ATOM 142 CG ASN A 12 -25.088 7.229 -0.028 1.00 0.00 C ATOM 143 OD1 ASN A 12 -24.895 8.140 0.777 1.00 0.00 O ATOM 144 ND2 ASN A 12 -26.304 6.858 -0.412 1.00 0.00 N ATOM 0 H ASN A 12 -23.946 5.116 1.689 1.00 0.00 H new ATOM 0 HA ASN A 12 -24.748 4.537 -1.104 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -22.992 6.836 -0.211 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -23.887 6.664 -1.707 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -27.125 7.334 -0.037 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -26.417 6.097 -1.082 1.00 0.00 H new ATOM 151 N SER A 13 -22.625 3.402 -1.618 1.00 0.00 N ATOM 152 CA SER A 13 -21.391 2.698 -1.947 1.00 0.00 C ATOM 153 C SER A 13 -21.045 2.870 -3.423 1.00 0.00 C ATOM 154 O SER A 13 -21.837 3.404 -4.201 1.00 0.00 O ATOM 155 CB SER A 13 -21.522 1.211 -1.613 1.00 0.00 C ATOM 156 OG SER A 13 -21.947 1.025 -0.273 1.00 0.00 O ATOM 0 H SER A 13 -23.425 3.144 -2.196 1.00 0.00 H new ATOM 0 HA SER A 13 -20.587 3.128 -1.350 1.00 0.00 H new ATOM 0 HB2 SER A 13 -22.235 0.744 -2.292 1.00 0.00 H new ATOM 0 HB3 SER A 13 -20.564 0.715 -1.766 1.00 0.00 H new ATOM 0 HG SER A 13 -22.025 0.066 -0.085 1.00 0.00 H new ATOM 162 N LEU A 14 -19.856 2.415 -3.802 1.00 0.00 N ATOM 163 CA LEU A 14 -19.402 2.517 -5.185 1.00 0.00 C ATOM 164 C LEU A 14 -19.130 1.136 -5.772 1.00 0.00 C ATOM 165 O LEU A 14 -18.849 0.174 -5.057 1.00 0.00 O ATOM 166 CB LEU A 14 -18.139 3.376 -5.265 1.00 0.00 C ATOM 167 CG LEU A 14 -17.036 3.044 -4.260 1.00 0.00 C ATOM 168 CD1 LEU A 14 -16.137 1.942 -4.797 1.00 0.00 C ATOM 169 CD2 LEU A 14 -16.221 4.287 -3.932 1.00 0.00 C ATOM 0 H LEU A 14 -19.188 1.972 -3.171 1.00 0.00 H new ATOM 0 HA LEU A 14 -20.193 2.989 -5.768 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -17.726 3.286 -6.270 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -18.424 4.419 -5.129 1.00 0.00 H new ATOM 0 HG LEU A 14 -17.504 2.688 -3.342 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -15.358 1.720 -4.067 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -16.730 1.046 -4.979 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -15.678 2.269 -5.730 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -15.441 4.032 -3.215 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.764 4.674 -4.843 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -16.874 5.047 -3.502 1.00 0.00 H new ATOM 181 N PRO A 15 -19.213 1.034 -7.107 1.00 0.00 N ATOM 182 CA PRO A 15 -18.976 -0.224 -7.821 1.00 0.00 C ATOM 183 C PRO A 15 -17.511 -0.647 -7.781 1.00 0.00 C ATOM 184 O PRO A 15 -16.659 0.077 -7.266 1.00 0.00 O ATOM 185 CB PRO A 15 -19.402 0.097 -9.256 1.00 0.00 C ATOM 186 CG PRO A 15 -19.233 1.572 -9.380 1.00 0.00 C ATOM 187 CD PRO A 15 -19.543 2.139 -8.022 1.00 0.00 C ATOM 0 HA PRO A 15 -19.523 -1.055 -7.375 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -18.785 -0.435 -9.980 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -20.435 -0.200 -9.438 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -18.218 1.824 -9.686 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -19.904 1.980 -10.136 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -18.946 3.027 -7.812 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -20.590 2.431 -7.938 1.00 0.00 H new ATOM 195 N THR A 16 -17.224 -1.823 -8.330 1.00 0.00 N ATOM 196 CA THR A 16 -15.863 -2.342 -8.356 1.00 0.00 C ATOM 197 C THR A 16 -14.989 -1.543 -9.316 1.00 0.00 C ATOM 198 O THR A 16 -15.468 -1.032 -10.327 1.00 0.00 O ATOM 199 CB THR A 16 -15.835 -3.826 -8.769 1.00 0.00 C ATOM 200 OG1 THR A 16 -14.491 -4.319 -8.735 1.00 0.00 O ATOM 201 CG2 THR A 16 -16.413 -4.011 -10.164 1.00 0.00 C ATOM 0 H THR A 16 -17.917 -2.434 -8.763 1.00 0.00 H new ATOM 0 HA THR A 16 -15.469 -2.247 -7.344 1.00 0.00 H new ATOM 0 HB THR A 16 -16.446 -4.388 -8.062 1.00 0.00 H new ATOM 0 HG1 THR A 16 -14.243 -4.530 -7.811 1.00 0.00 H new ATOM 0 HG21 THR A 16 -16.382 -5.067 -10.433 1.00 0.00 H new ATOM 0 HG22 THR A 16 -17.446 -3.662 -10.179 1.00 0.00 H new ATOM 0 HG23 THR A 16 -15.826 -3.437 -10.880 1.00 0.00 H new ATOM 209 N MET A 17 -13.704 -1.441 -8.993 1.00 0.00 N ATOM 210 CA MET A 17 -12.762 -0.705 -9.828 1.00 0.00 C ATOM 211 C MET A 17 -11.969 -1.655 -10.721 1.00 0.00 C ATOM 212 O MET A 17 -10.767 -1.479 -10.916 1.00 0.00 O ATOM 213 CB MET A 17 -11.806 0.112 -8.958 1.00 0.00 C ATOM 214 CG MET A 17 -10.917 -0.739 -8.066 1.00 0.00 C ATOM 215 SD MET A 17 -9.534 0.189 -7.375 1.00 0.00 S ATOM 216 CE MET A 17 -8.256 -1.066 -7.363 1.00 0.00 C ATOM 0 H MET A 17 -13.291 -1.859 -8.159 1.00 0.00 H new ATOM 0 HA MET A 17 -13.332 -0.027 -10.464 1.00 0.00 H new ATOM 0 HB2 MET A 17 -11.178 0.727 -9.602 1.00 0.00 H new ATOM 0 HB3 MET A 17 -12.387 0.792 -8.335 1.00 0.00 H new ATOM 0 HG2 MET A 17 -11.514 -1.153 -7.253 1.00 0.00 H new ATOM 0 HG3 MET A 17 -10.533 -1.582 -8.641 1.00 0.00 H new ATOM 0 HE1 MET A 17 -7.673 -0.983 -6.446 1.00 0.00 H new ATOM 0 HE2 MET A 17 -8.715 -2.053 -7.413 1.00 0.00 H new ATOM 0 HE3 MET A 17 -7.601 -0.927 -8.223 1.00 0.00 H new ATOM 226 N GLU A 18 -12.651 -2.662 -11.259 1.00 0.00 N ATOM 227 CA GLU A 18 -12.008 -3.640 -12.129 1.00 0.00 C ATOM 228 C GLU A 18 -11.795 -3.066 -13.527 1.00 0.00 C ATOM 229 O GLU A 18 -12.092 -1.900 -13.784 1.00 0.00 O ATOM 230 CB GLU A 18 -12.852 -4.914 -12.212 1.00 0.00 C ATOM 231 CG GLU A 18 -12.494 -5.950 -11.159 1.00 0.00 C ATOM 232 CD GLU A 18 -10.996 -6.108 -10.982 1.00 0.00 C ATOM 233 OE1 GLU A 18 -10.291 -6.265 -12.001 1.00 0.00 O ATOM 234 OE2 GLU A 18 -10.530 -6.076 -9.824 1.00 0.00 O ATOM 0 H GLU A 18 -13.647 -2.822 -11.108 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.035 -3.884 -11.703 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -13.904 -4.650 -12.107 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -12.731 -5.356 -13.201 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -12.940 -5.664 -10.207 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -12.927 -6.911 -11.438 1.00 0.00 H new ATOM 241 N GLY A 19 -11.277 -3.896 -14.428 1.00 0.00 N ATOM 242 CA GLY A 19 -11.032 -3.454 -15.788 1.00 0.00 C ATOM 243 C GLY A 19 -9.602 -2.996 -16.000 1.00 0.00 C ATOM 244 O GLY A 19 -8.647 -3.682 -15.634 1.00 0.00 O ATOM 0 H GLY A 19 -11.023 -4.866 -14.240 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.255 -4.268 -16.477 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.712 -2.637 -16.029 1.00 0.00 H new ATOM 248 N PRO A 20 -9.440 -1.811 -16.607 1.00 0.00 N ATOM 249 CA PRO A 20 -8.120 -1.236 -16.882 1.00 0.00 C ATOM 250 C PRO A 20 -7.404 -0.794 -15.610 1.00 0.00 C ATOM 251 O PRO A 20 -7.999 -0.695 -14.537 1.00 0.00 O ATOM 252 CB PRO A 20 -8.437 -0.027 -17.766 1.00 0.00 C ATOM 253 CG PRO A 20 -9.834 0.347 -17.410 1.00 0.00 C ATOM 254 CD PRO A 20 -10.534 -0.941 -17.071 1.00 0.00 C ATOM 0 HA PRO A 20 -7.450 -1.958 -17.349 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.747 0.795 -17.575 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -8.351 -0.277 -18.824 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.851 1.034 -16.564 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.327 0.852 -18.241 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.289 -0.797 -16.298 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -11.043 -1.362 -17.938 1.00 0.00 H new ATOM 262 N PRO A 21 -6.097 -0.520 -15.731 1.00 0.00 N ATOM 263 CA PRO A 21 -5.272 -0.082 -14.601 1.00 0.00 C ATOM 264 C PRO A 21 -5.624 1.327 -14.138 1.00 0.00 C ATOM 265 O PRO A 21 -6.568 1.940 -14.639 1.00 0.00 O ATOM 266 CB PRO A 21 -3.849 -0.119 -15.165 1.00 0.00 C ATOM 267 CG PRO A 21 -4.020 0.050 -16.635 1.00 0.00 C ATOM 268 CD PRO A 21 -5.323 -0.616 -16.981 1.00 0.00 C ATOM 0 HA PRO A 21 -5.414 -0.713 -13.724 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.235 0.677 -14.744 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.354 -1.061 -14.930 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -4.037 1.105 -16.907 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -3.193 -0.406 -17.179 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.826 -0.111 -17.805 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.176 -1.653 -17.284 1.00 0.00 H new ATOM 276 N THR A 22 -4.861 1.838 -13.177 1.00 0.00 N ATOM 277 CA THR A 22 -5.093 3.175 -12.645 1.00 0.00 C ATOM 278 C THR A 22 -4.195 4.201 -13.327 1.00 0.00 C ATOM 279 O THR A 22 -3.102 3.875 -13.790 1.00 0.00 O ATOM 280 CB THR A 22 -4.849 3.225 -11.125 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.008 2.757 -10.427 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.517 4.641 -10.677 1.00 0.00 C ATOM 0 H THR A 22 -4.076 1.345 -12.751 1.00 0.00 H new ATOM 0 HA THR A 22 -6.136 3.419 -12.846 1.00 0.00 H new ATOM 0 HB THR A 22 -4.002 2.580 -10.893 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.983 3.077 -9.501 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.349 4.652 -9.600 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.617 4.983 -11.188 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.347 5.304 -10.921 1.00 0.00 H new ATOM 290 N PHE A 23 -4.663 5.444 -13.385 1.00 0.00 N ATOM 291 CA PHE A 23 -3.902 6.518 -14.011 1.00 0.00 C ATOM 292 C PHE A 23 -4.231 7.863 -13.370 1.00 0.00 C ATOM 293 O PHE A 23 -5.396 8.242 -13.261 1.00 0.00 O ATOM 294 CB PHE A 23 -4.194 6.572 -15.512 1.00 0.00 C ATOM 295 CG PHE A 23 -3.248 5.747 -16.337 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.339 4.365 -16.344 1.00 0.00 C ATOM 297 CD2 PHE A 23 -2.267 6.354 -17.105 1.00 0.00 C ATOM 298 CE1 PHE A 23 -2.470 3.602 -17.102 1.00 0.00 C ATOM 299 CE2 PHE A 23 -1.396 5.598 -17.865 1.00 0.00 C ATOM 300 CZ PHE A 23 -1.496 4.220 -17.863 1.00 0.00 C ATOM 0 H PHE A 23 -5.565 5.732 -13.006 1.00 0.00 H new ATOM 0 HA PHE A 23 -2.842 6.313 -13.861 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -5.213 6.227 -15.688 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -4.146 7.608 -15.846 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -4.098 3.877 -15.750 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -2.183 7.431 -17.109 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.552 2.525 -17.099 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -0.637 6.084 -18.461 1.00 0.00 H new ATOM 0 HZ PHE A 23 -0.814 3.627 -18.455 1.00 0.00 H new ATOM 310 N ASN A 24 -3.195 8.579 -12.945 1.00 0.00 N ATOM 311 CA ASN A 24 -3.373 9.881 -12.312 1.00 0.00 C ATOM 312 C ASN A 24 -4.330 9.784 -11.128 1.00 0.00 C ATOM 313 O ASN A 24 -5.230 10.606 -10.957 1.00 0.00 O ATOM 314 CB ASN A 24 -3.901 10.896 -13.328 1.00 0.00 C ATOM 315 CG ASN A 24 -3.256 10.740 -14.691 1.00 0.00 C ATOM 316 OD1 ASN A 24 -3.795 10.070 -15.572 1.00 0.00 O ATOM 317 ND2 ASN A 24 -2.095 11.359 -14.871 1.00 0.00 N ATOM 0 H ASN A 24 -2.223 8.280 -13.027 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.403 10.215 -11.945 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -4.981 10.781 -13.425 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -3.720 11.905 -12.957 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.614 11.290 -15.768 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.685 11.904 -14.113 1.00 0.00 H new ATOM 324 N PRO A 25 -4.131 8.756 -10.290 1.00 0.00 N ATOM 325 CA PRO A 25 -4.966 8.527 -9.106 1.00 0.00 C ATOM 326 C PRO A 25 -4.740 9.580 -8.026 1.00 0.00 C ATOM 327 O PRO A 25 -3.607 9.908 -7.672 1.00 0.00 O ATOM 328 CB PRO A 25 -4.514 7.150 -8.614 1.00 0.00 C ATOM 329 CG PRO A 25 -3.119 7.006 -9.119 1.00 0.00 C ATOM 330 CD PRO A 25 -3.077 7.738 -10.432 1.00 0.00 C ATOM 0 HA PRO A 25 -6.029 8.583 -9.339 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.550 7.087 -7.526 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.158 6.360 -9.000 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.403 7.428 -8.414 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.857 5.956 -9.249 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -2.102 8.192 -10.608 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.274 7.070 -11.271 1.00 0.00 H new ATOM 338 N PRO A 26 -5.842 10.122 -7.487 1.00 0.00 N ATOM 339 CA PRO A 26 -5.789 11.144 -6.438 1.00 0.00 C ATOM 340 C PRO A 26 -5.296 10.586 -5.108 1.00 0.00 C ATOM 341 O PRO A 26 -4.907 9.421 -5.018 1.00 0.00 O ATOM 342 CB PRO A 26 -7.244 11.604 -6.318 1.00 0.00 C ATOM 343 CG PRO A 26 -8.049 10.444 -6.793 1.00 0.00 C ATOM 344 CD PRO A 26 -7.224 9.778 -7.860 1.00 0.00 C ATOM 0 HA PRO A 26 -5.092 11.945 -6.685 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.493 11.864 -5.289 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.430 12.490 -6.925 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.260 9.755 -5.976 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -9.010 10.772 -7.190 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.380 8.699 -7.874 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.476 10.149 -8.853 1.00 0.00 H new ATOM 352 N VAL A 27 -5.313 11.423 -4.076 1.00 0.00 N ATOM 353 CA VAL A 27 -4.869 11.012 -2.750 1.00 0.00 C ATOM 354 C VAL A 27 -5.726 11.649 -1.661 1.00 0.00 C ATOM 355 O VAL A 27 -6.069 12.829 -1.718 1.00 0.00 O ATOM 356 CB VAL A 27 -3.394 11.387 -2.511 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.969 11.010 -1.100 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.501 10.715 -3.543 1.00 0.00 C ATOM 0 H VAL A 27 -5.630 12.391 -4.133 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.973 9.928 -2.703 1.00 0.00 H new ATOM 0 HB VAL A 27 -3.289 12.466 -2.620 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.924 11.282 -0.950 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.590 11.541 -0.379 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -3.088 9.936 -0.959 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.462 10.990 -3.360 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.608 9.633 -3.467 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.792 11.040 -4.542 1.00 0.00 H new ATOM 368 N PRO A 28 -6.080 10.849 -0.644 1.00 0.00 N ATOM 369 CA PRO A 28 -5.677 9.442 -0.566 1.00 0.00 C ATOM 370 C PRO A 28 -6.374 8.581 -1.614 1.00 0.00 C ATOM 371 O PRO A 28 -7.536 8.811 -1.948 1.00 0.00 O ATOM 372 CB PRO A 28 -6.111 9.026 0.842 1.00 0.00 C ATOM 373 CG PRO A 28 -7.225 9.954 1.184 1.00 0.00 C ATOM 374 CD PRO A 28 -6.901 11.257 0.508 1.00 0.00 C ATOM 0 HA PRO A 28 -4.611 9.312 -0.754 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -6.440 7.987 0.864 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -5.289 9.115 1.552 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -8.181 9.561 0.837 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -7.307 10.084 2.263 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.803 11.781 0.193 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -6.357 11.929 1.171 1.00 0.00 H new ATOM 382 N TYR A 29 -5.656 7.589 -2.130 1.00 0.00 N ATOM 383 CA TYR A 29 -6.205 6.694 -3.142 1.00 0.00 C ATOM 384 C TYR A 29 -6.695 5.394 -2.512 1.00 0.00 C ATOM 385 O TYR A 29 -5.931 4.677 -1.866 1.00 0.00 O ATOM 386 CB TYR A 29 -5.153 6.392 -4.211 1.00 0.00 C ATOM 387 CG TYR A 29 -5.438 5.136 -5.003 1.00 0.00 C ATOM 388 CD1 TYR A 29 -4.994 3.896 -4.561 1.00 0.00 C ATOM 389 CD2 TYR A 29 -6.152 5.189 -6.194 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.251 2.746 -5.281 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.415 4.044 -6.921 1.00 0.00 C ATOM 392 CZ TYR A 29 -5.963 2.825 -6.460 1.00 0.00 C ATOM 393 OH TYR A 29 -6.222 1.683 -7.182 1.00 0.00 O ATOM 0 H TYR A 29 -4.693 7.385 -1.864 1.00 0.00 H new ATOM 0 HA TYR A 29 -7.055 7.192 -3.609 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.091 7.237 -4.896 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -4.178 6.297 -3.733 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.438 3.830 -3.638 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.507 6.142 -6.558 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -4.897 1.791 -4.923 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.971 4.103 -7.845 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.171 1.452 -7.100 1.00 0.00 H new ATOM 403 N PHE A 30 -7.976 5.096 -2.706 1.00 0.00 N ATOM 404 CA PHE A 30 -8.570 3.882 -2.157 1.00 0.00 C ATOM 405 C PHE A 30 -8.719 2.814 -3.237 1.00 0.00 C ATOM 406 O PHE A 30 -9.637 2.867 -4.055 1.00 0.00 O ATOM 407 CB PHE A 30 -9.934 4.192 -1.537 1.00 0.00 C ATOM 408 CG PHE A 30 -9.871 5.193 -0.419 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.440 4.815 0.843 1.00 0.00 C ATOM 410 CD2 PHE A 30 -10.242 6.511 -0.629 1.00 0.00 C ATOM 411 CE1 PHE A 30 -9.382 5.733 1.874 1.00 0.00 C ATOM 412 CE2 PHE A 30 -10.186 7.434 0.398 1.00 0.00 C ATOM 413 CZ PHE A 30 -9.754 7.045 1.651 1.00 0.00 C ATOM 0 H PHE A 30 -8.622 5.678 -3.239 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.906 3.500 -1.382 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.600 4.568 -2.314 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.372 3.267 -1.162 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.146 3.791 1.022 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -10.579 6.821 -1.607 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -9.046 5.425 2.853 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -10.480 8.458 0.221 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.707 7.765 2.455 1.00 0.00 H new ATOM 423 N GLY A 31 -7.810 1.844 -3.231 1.00 0.00 N ATOM 424 CA GLY A 31 -7.857 0.778 -4.214 1.00 0.00 C ATOM 425 C GLY A 31 -8.458 -0.497 -3.657 1.00 0.00 C ATOM 426 O GLY A 31 -7.840 -1.177 -2.838 1.00 0.00 O ATOM 0 H GLY A 31 -7.042 1.778 -2.563 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.441 1.106 -5.074 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -6.848 0.574 -4.573 1.00 0.00 H new ATOM 430 N ARG A 32 -9.668 -0.822 -4.102 1.00 0.00 N ATOM 431 CA ARG A 32 -10.354 -2.023 -3.640 1.00 0.00 C ATOM 432 C ARG A 32 -9.725 -3.275 -4.243 1.00 0.00 C ATOM 433 O ARG A 32 -9.634 -3.411 -5.464 1.00 0.00 O ATOM 434 CB ARG A 32 -11.839 -1.959 -4.004 1.00 0.00 C ATOM 435 CG ARG A 32 -12.705 -1.332 -2.924 1.00 0.00 C ATOM 436 CD ARG A 32 -13.232 -2.379 -1.954 1.00 0.00 C ATOM 437 NE ARG A 32 -14.333 -1.868 -1.142 1.00 0.00 N ATOM 438 CZ ARG A 32 -15.561 -1.673 -1.609 1.00 0.00 C ATOM 439 NH1 ARG A 32 -15.844 -1.945 -2.875 1.00 0.00 N ATOM 440 NH2 ARG A 32 -16.509 -1.205 -0.807 1.00 0.00 N ATOM 0 H ARG A 32 -10.193 -0.271 -4.781 1.00 0.00 H new ATOM 0 HA ARG A 32 -10.254 -2.074 -2.556 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.954 -1.389 -4.926 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -12.199 -2.968 -4.206 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -12.125 -0.588 -2.378 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -13.542 -0.808 -3.386 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -13.568 -3.253 -2.512 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -12.423 -2.709 -1.302 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.149 -1.649 -0.163 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -15.118 -2.305 -3.494 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.788 -1.794 -3.230 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -16.295 -0.995 0.168 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -17.452 -1.055 -1.165 1.00 0.00 H new ATOM 454 N LEU A 33 -9.291 -4.187 -3.381 1.00 0.00 N ATOM 455 CA LEU A 33 -8.669 -5.429 -3.828 1.00 0.00 C ATOM 456 C LEU A 33 -9.721 -6.502 -4.089 1.00 0.00 C ATOM 457 O LEU A 33 -10.389 -6.967 -3.166 1.00 0.00 O ATOM 458 CB LEU A 33 -7.667 -5.925 -2.784 1.00 0.00 C ATOM 459 CG LEU A 33 -6.793 -4.854 -2.130 1.00 0.00 C ATOM 460 CD1 LEU A 33 -6.157 -5.389 -0.857 1.00 0.00 C ATOM 461 CD2 LEU A 33 -5.725 -4.371 -3.100 1.00 0.00 C ATOM 0 H LEU A 33 -9.358 -4.090 -2.368 1.00 0.00 H new ATOM 0 HA LEU A 33 -8.143 -5.227 -4.761 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -8.217 -6.445 -2.000 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -7.014 -6.659 -3.256 1.00 0.00 H new ATOM 0 HG LEU A 33 -7.426 -4.006 -1.867 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -5.539 -4.613 -0.405 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.938 -5.684 -0.156 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.538 -6.254 -1.095 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -5.113 -3.609 -2.617 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -5.095 -5.210 -3.395 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -6.201 -3.947 -3.984 1.00 0.00 H new ATOM 473 N GLN A 34 -9.862 -6.891 -5.352 1.00 0.00 N ATOM 474 CA GLN A 34 -10.832 -7.910 -5.734 1.00 0.00 C ATOM 475 C GLN A 34 -10.253 -9.309 -5.548 1.00 0.00 C ATOM 476 O GLN A 34 -9.800 -9.936 -6.505 1.00 0.00 O ATOM 477 CB GLN A 34 -11.265 -7.713 -7.188 1.00 0.00 C ATOM 478 CG GLN A 34 -12.334 -6.648 -7.365 1.00 0.00 C ATOM 479 CD GLN A 34 -13.739 -7.208 -7.264 1.00 0.00 C ATOM 480 OE1 GLN A 34 -14.312 -7.286 -6.177 1.00 0.00 O ATOM 481 NE2 GLN A 34 -14.302 -7.604 -8.400 1.00 0.00 N ATOM 0 H GLN A 34 -9.317 -6.516 -6.128 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.703 -7.808 -5.087 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -10.393 -7.444 -7.785 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.639 -8.660 -7.579 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -12.200 -5.875 -6.608 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.207 -6.169 -8.336 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.791 -7.521 -9.279 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -15.246 -7.991 -8.394 1.00 0.00 H new ATOM 490 N GLY A 35 -10.272 -9.792 -4.310 1.00 0.00 N ATOM 491 CA GLY A 35 -9.746 -11.114 -4.021 1.00 0.00 C ATOM 492 C GLY A 35 -9.046 -11.179 -2.678 1.00 0.00 C ATOM 493 O GLY A 35 -9.133 -12.183 -1.973 1.00 0.00 O ATOM 0 H GLY A 35 -10.642 -9.292 -3.502 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.561 -11.838 -4.038 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.047 -11.403 -4.806 1.00 0.00 H new ATOM 497 N GLY A 36 -8.348 -10.104 -2.324 1.00 0.00 N ATOM 498 CA GLY A 36 -7.639 -10.064 -1.058 1.00 0.00 C ATOM 499 C GLY A 36 -6.192 -10.497 -1.190 1.00 0.00 C ATOM 500 O GLY A 36 -5.724 -10.796 -2.290 1.00 0.00 O ATOM 0 H GLY A 36 -8.261 -9.261 -2.891 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.677 -9.052 -0.656 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.145 -10.711 -0.341 1.00 0.00 H new ATOM 504 N LEU A 37 -5.482 -10.530 -0.068 1.00 0.00 N ATOM 505 CA LEU A 37 -4.078 -10.928 -0.063 1.00 0.00 C ATOM 506 C LEU A 37 -3.932 -12.411 -0.389 1.00 0.00 C ATOM 507 O LEU A 37 -4.085 -13.268 0.482 1.00 0.00 O ATOM 508 CB LEU A 37 -3.448 -10.629 1.298 1.00 0.00 C ATOM 509 CG LEU A 37 -3.447 -9.162 1.729 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.919 -9.023 3.149 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.618 -8.324 0.766 1.00 0.00 C ATOM 0 H LEU A 37 -5.855 -10.286 0.850 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.560 -10.353 -0.830 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -3.975 -11.209 2.055 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.417 -10.984 1.285 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.474 -8.796 1.707 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.926 -7.972 3.438 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.553 -9.591 3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.900 -9.406 3.197 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.628 -7.283 1.088 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.591 -8.690 0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.040 -8.398 -0.236 1.00 0.00 H new ATOM 523 N THR A 38 -3.632 -12.708 -1.650 1.00 0.00 N ATOM 524 CA THR A 38 -3.464 -14.087 -2.091 1.00 0.00 C ATOM 525 C THR A 38 -1.997 -14.402 -2.361 1.00 0.00 C ATOM 526 O THR A 38 -1.179 -13.499 -2.530 1.00 0.00 O ATOM 527 CB THR A 38 -4.281 -14.373 -3.365 1.00 0.00 C ATOM 528 OG1 THR A 38 -3.985 -13.395 -4.367 1.00 0.00 O ATOM 529 CG2 THR A 38 -5.773 -14.363 -3.064 1.00 0.00 C ATOM 0 H THR A 38 -3.500 -12.012 -2.384 1.00 0.00 H new ATOM 0 HA THR A 38 -3.828 -14.724 -1.284 1.00 0.00 H new ATOM 0 HB THR A 38 -4.007 -15.362 -3.732 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.507 -13.585 -5.174 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.330 -14.567 -3.978 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.000 -15.129 -2.322 1.00 0.00 H new ATOM 0 HG23 THR A 38 -6.059 -13.386 -2.675 1.00 0.00 H new ATOM 537 N ALA A 39 -1.671 -15.690 -2.402 1.00 0.00 N ATOM 538 CA ALA A 39 -0.303 -16.124 -2.655 1.00 0.00 C ATOM 539 C ALA A 39 0.170 -15.674 -4.033 1.00 0.00 C ATOM 540 O ALA A 39 1.365 -15.481 -4.256 1.00 0.00 O ATOM 541 CB ALA A 39 -0.197 -17.637 -2.526 1.00 0.00 C ATOM 0 H ALA A 39 -2.336 -16.451 -2.263 1.00 0.00 H new ATOM 0 HA ALA A 39 0.343 -15.661 -1.909 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.830 -17.947 -2.718 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.485 -17.937 -1.519 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.860 -18.111 -3.249 1.00 0.00 H new ATOM 547 N ARG A 40 -0.774 -15.511 -4.953 1.00 0.00 N ATOM 548 CA ARG A 40 -0.453 -15.085 -6.310 1.00 0.00 C ATOM 549 C ARG A 40 -0.847 -13.628 -6.531 1.00 0.00 C ATOM 550 O ARG A 40 -1.238 -13.240 -7.632 1.00 0.00 O ATOM 551 CB ARG A 40 -1.165 -15.978 -7.329 1.00 0.00 C ATOM 552 CG ARG A 40 -0.432 -17.278 -7.617 1.00 0.00 C ATOM 553 CD ARG A 40 -0.875 -18.387 -6.675 1.00 0.00 C ATOM 554 NE ARG A 40 -0.572 -19.712 -7.209 1.00 0.00 N ATOM 555 CZ ARG A 40 -0.534 -20.812 -6.466 1.00 0.00 C ATOM 556 NH1 ARG A 40 -0.778 -20.747 -5.165 1.00 0.00 N ATOM 557 NH2 ARG A 40 -0.251 -21.982 -7.025 1.00 0.00 N ATOM 0 H ARG A 40 -1.768 -15.667 -4.784 1.00 0.00 H new ATOM 0 HA ARG A 40 0.625 -15.176 -6.447 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.165 -16.208 -6.961 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.287 -15.426 -8.261 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -0.616 -17.580 -8.648 1.00 0.00 H new ATOM 0 HG3 ARG A 40 0.642 -17.121 -7.517 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -0.381 -18.263 -5.711 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -1.947 -18.304 -6.497 1.00 0.00 H new ATOM 0 HE ARG A 40 -0.379 -19.797 -8.207 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -0.996 -19.850 -4.731 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -0.748 -21.594 -4.598 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -0.062 -22.037 -8.026 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -0.222 -22.826 -6.454 1.00 0.00 H new ATOM 571 N ARG A 41 -0.743 -12.826 -5.476 1.00 0.00 N ATOM 572 CA ARG A 41 -1.091 -11.412 -5.555 1.00 0.00 C ATOM 573 C ARG A 41 0.158 -10.540 -5.466 1.00 0.00 C ATOM 574 O ARG A 41 1.055 -10.799 -4.663 1.00 0.00 O ATOM 575 CB ARG A 41 -2.065 -11.042 -4.434 1.00 0.00 C ATOM 576 CG ARG A 41 -2.110 -9.553 -4.135 1.00 0.00 C ATOM 577 CD ARG A 41 -3.414 -9.160 -3.456 1.00 0.00 C ATOM 578 NE ARG A 41 -3.244 -8.017 -2.564 1.00 0.00 N ATOM 579 CZ ARG A 41 -3.223 -6.756 -2.981 1.00 0.00 C ATOM 580 NH1 ARG A 41 -3.362 -6.478 -4.270 1.00 0.00 N ATOM 581 NH2 ARG A 41 -3.064 -5.770 -2.108 1.00 0.00 N ATOM 0 H ARG A 41 -0.421 -13.131 -4.557 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.570 -11.234 -6.518 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.065 -11.380 -4.706 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.783 -11.578 -3.528 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -1.270 -9.284 -3.495 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -1.997 -8.991 -5.062 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.159 -8.920 -4.214 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -3.797 -10.008 -2.889 1.00 0.00 H new ATOM 0 HE ARG A 41 -3.135 -8.196 -1.566 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -3.485 -7.233 -4.944 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -3.346 -5.509 -4.587 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -2.958 -5.980 -1.115 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -3.048 -4.802 -2.429 1.00 0.00 H new ATOM 595 N THR A 42 0.210 -9.504 -6.298 1.00 0.00 N ATOM 596 CA THR A 42 1.349 -8.594 -6.316 1.00 0.00 C ATOM 597 C THR A 42 0.894 -7.147 -6.462 1.00 0.00 C ATOM 598 O THR A 42 0.236 -6.789 -7.439 1.00 0.00 O ATOM 599 CB THR A 42 2.321 -8.933 -7.462 1.00 0.00 C ATOM 600 OG1 THR A 42 2.783 -10.282 -7.330 1.00 0.00 O ATOM 601 CG2 THR A 42 3.508 -7.983 -7.463 1.00 0.00 C ATOM 0 H THR A 42 -0.524 -9.274 -6.968 1.00 0.00 H new ATOM 0 HA THR A 42 1.865 -8.715 -5.364 1.00 0.00 H new ATOM 0 HB THR A 42 1.787 -8.823 -8.406 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.399 -10.490 -8.063 1.00 0.00 H new ATOM 0 HG21 THR A 42 4.181 -8.242 -8.281 1.00 0.00 H new ATOM 0 HG22 THR A 42 3.155 -6.960 -7.593 1.00 0.00 H new ATOM 0 HG23 THR A 42 4.041 -8.065 -6.516 1.00 0.00 H new ATOM 609 N ILE A 43 1.248 -6.319 -5.485 1.00 0.00 N ATOM 610 CA ILE A 43 0.878 -4.909 -5.507 1.00 0.00 C ATOM 611 C ILE A 43 1.982 -4.060 -6.127 1.00 0.00 C ATOM 612 O ILE A 43 3.164 -4.263 -5.850 1.00 0.00 O ATOM 613 CB ILE A 43 0.575 -4.385 -4.091 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.566 -5.185 -3.460 1.00 0.00 C ATOM 615 CG2 ILE A 43 0.228 -2.904 -4.138 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.100 -6.414 -2.710 1.00 0.00 C ATOM 0 H ILE A 43 1.791 -6.600 -4.668 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.023 -4.828 -6.116 1.00 0.00 H new ATOM 0 HB ILE A 43 1.465 -4.511 -3.475 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.117 -4.539 -2.776 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.262 -5.489 -4.242 1.00 0.00 H new ATOM 0 HG21 ILE A 43 0.016 -2.548 -3.130 1.00 0.00 H new ATOM 0 HG22 ILE A 43 1.069 -2.346 -4.551 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.650 -2.756 -4.767 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -0.962 -6.932 -2.289 1.00 0.00 H new ATOM 0 HD12 ILE A 43 0.425 -7.080 -3.394 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.573 -6.116 -1.906 1.00 0.00 H new ATOM 628 N ILE A 44 1.588 -3.106 -6.964 1.00 0.00 N ATOM 629 CA ILE A 44 2.545 -2.224 -7.621 1.00 0.00 C ATOM 630 C ILE A 44 2.158 -0.760 -7.437 1.00 0.00 C ATOM 631 O ILE A 44 1.090 -0.331 -7.873 1.00 0.00 O ATOM 632 CB ILE A 44 2.652 -2.529 -9.126 1.00 0.00 C ATOM 633 CG1 ILE A 44 3.212 -3.936 -9.345 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.524 -1.492 -9.817 1.00 0.00 C ATOM 635 CD1 ILE A 44 2.983 -4.468 -10.742 1.00 0.00 C ATOM 0 H ILE A 44 0.613 -2.924 -7.203 1.00 0.00 H new ATOM 0 HA ILE A 44 3.513 -2.404 -7.153 1.00 0.00 H new ATOM 0 HB ILE A 44 1.654 -2.484 -9.562 1.00 0.00 H new ATOM 0 HG12 ILE A 44 4.282 -3.928 -9.139 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.754 -4.616 -8.627 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.589 -1.722 -10.880 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.086 -0.503 -9.686 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.523 -1.507 -9.380 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.406 -5.469 -10.824 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.913 -4.509 -10.945 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.465 -3.810 -11.465 1.00 0.00 H new ATOM 647 N ILE A 45 3.035 0.001 -6.790 1.00 0.00 N ATOM 648 CA ILE A 45 2.786 1.417 -6.551 1.00 0.00 C ATOM 649 C ILE A 45 3.840 2.283 -7.234 1.00 0.00 C ATOM 650 O ILE A 45 4.989 2.344 -6.795 1.00 0.00 O ATOM 651 CB ILE A 45 2.770 1.739 -5.045 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.613 1.011 -4.358 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.663 3.241 -4.826 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.761 0.925 -2.855 1.00 0.00 C ATOM 0 H ILE A 45 3.923 -0.339 -6.422 1.00 0.00 H new ATOM 0 HA ILE A 45 1.806 1.641 -6.972 1.00 0.00 H new ATOM 0 HB ILE A 45 3.705 1.393 -4.604 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.680 1.523 -4.594 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.535 0.003 -4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.653 3.453 -3.757 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.517 3.738 -5.286 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.742 3.610 -5.278 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.905 0.397 -2.435 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.676 0.386 -2.610 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.808 1.930 -2.436 1.00 0.00 H new ATOM 666 N LYS A 46 3.441 2.953 -8.309 1.00 0.00 N ATOM 667 CA LYS A 46 4.348 3.819 -9.052 1.00 0.00 C ATOM 668 C LYS A 46 3.922 5.279 -8.939 1.00 0.00 C ATOM 669 O LYS A 46 2.907 5.685 -9.502 1.00 0.00 O ATOM 670 CB LYS A 46 4.393 3.402 -10.524 1.00 0.00 C ATOM 671 CG LYS A 46 5.506 2.419 -10.845 1.00 0.00 C ATOM 672 CD LYS A 46 5.350 1.836 -12.239 1.00 0.00 C ATOM 673 CE LYS A 46 4.551 0.542 -12.216 1.00 0.00 C ATOM 674 NZ LYS A 46 4.707 -0.229 -13.480 1.00 0.00 N ATOM 0 H LYS A 46 2.494 2.913 -8.686 1.00 0.00 H new ATOM 0 HA LYS A 46 5.344 3.715 -8.621 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.436 2.956 -10.796 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.517 4.292 -11.141 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.470 2.921 -10.765 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.504 1.614 -10.111 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.853 2.560 -12.884 1.00 0.00 H new ATOM 0 HD3 LYS A 46 6.334 1.650 -12.669 1.00 0.00 H new ATOM 0 HE2 LYS A 46 4.876 -0.070 -11.375 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.497 0.769 -12.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.147 -1.104 -13.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 4.374 0.345 -14.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 5.710 -0.468 -13.619 1.00 0.00 H new ATOM 688 N GLY A 47 4.706 6.065 -8.207 1.00 0.00 N ATOM 689 CA GLY A 47 4.394 7.471 -8.035 1.00 0.00 C ATOM 690 C GLY A 47 5.634 8.342 -8.009 1.00 0.00 C ATOM 691 O GLY A 47 6.600 8.080 -8.726 1.00 0.00 O ATOM 0 H GLY A 47 5.552 5.752 -7.730 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.742 7.797 -8.845 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.840 7.606 -7.106 1.00 0.00 H new ATOM 695 N TYR A 48 5.608 9.381 -7.182 1.00 0.00 N ATOM 696 CA TYR A 48 6.738 10.296 -7.068 1.00 0.00 C ATOM 697 C TYR A 48 6.578 11.212 -5.859 1.00 0.00 C ATOM 698 O TYR A 48 5.541 11.851 -5.682 1.00 0.00 O ATOM 699 CB TYR A 48 6.873 11.133 -8.341 1.00 0.00 C ATOM 700 CG TYR A 48 7.436 12.516 -8.100 1.00 0.00 C ATOM 701 CD1 TYR A 48 6.617 13.555 -7.675 1.00 0.00 C ATOM 702 CD2 TYR A 48 8.784 12.783 -8.299 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.127 14.820 -7.454 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.302 14.045 -8.079 1.00 0.00 C ATOM 705 CZ TYR A 48 8.470 15.060 -7.657 1.00 0.00 C ATOM 706 OH TYR A 48 8.981 16.318 -7.438 1.00 0.00 O ATOM 0 H TYR A 48 4.817 9.611 -6.581 1.00 0.00 H new ATOM 0 HA TYR A 48 7.642 9.702 -6.933 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.516 10.606 -9.046 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.894 11.225 -8.811 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.565 13.371 -7.515 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.439 11.991 -8.631 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.477 15.617 -7.124 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.353 14.235 -8.237 1.00 0.00 H new ATOM 0 HH TYR A 48 9.511 16.596 -8.214 1.00 0.00 H new ATOM 716 N VAL A 49 7.614 11.271 -5.028 1.00 0.00 N ATOM 717 CA VAL A 49 7.591 12.110 -3.836 1.00 0.00 C ATOM 718 C VAL A 49 7.864 13.568 -4.184 1.00 0.00 C ATOM 719 O VAL A 49 8.918 13.919 -4.716 1.00 0.00 O ATOM 720 CB VAL A 49 8.627 11.639 -2.798 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.418 12.354 -1.472 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.551 10.130 -2.617 1.00 0.00 C ATOM 0 H VAL A 49 8.480 10.748 -5.159 1.00 0.00 H new ATOM 0 HA VAL A 49 6.592 12.023 -3.408 1.00 0.00 H new ATOM 0 HB VAL A 49 9.623 11.889 -3.165 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.159 12.008 -0.751 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.527 13.429 -1.617 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.418 12.138 -1.096 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.290 9.814 -1.880 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.554 9.855 -2.272 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.755 9.639 -3.568 1.00 0.00 H new ATOM 732 N PRO A 50 6.893 14.442 -3.878 1.00 0.00 N ATOM 733 CA PRO A 50 7.006 15.878 -4.150 1.00 0.00 C ATOM 734 C PRO A 50 8.035 16.558 -3.253 1.00 0.00 C ATOM 735 O PRO A 50 8.390 16.059 -2.185 1.00 0.00 O ATOM 736 CB PRO A 50 5.601 16.407 -3.849 1.00 0.00 C ATOM 737 CG PRO A 50 5.029 15.432 -2.879 1.00 0.00 C ATOM 738 CD PRO A 50 5.610 14.095 -3.244 1.00 0.00 C ATOM 0 HA PRO A 50 7.342 16.075 -5.168 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.638 17.411 -3.426 1.00 0.00 H new ATOM 0 HB3 PRO A 50 4.997 16.465 -4.755 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.287 15.703 -1.855 1.00 0.00 H new ATOM 0 HG3 PRO A 50 3.941 15.414 -2.939 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.753 13.466 -2.366 1.00 0.00 H new ATOM 0 HD3 PRO A 50 4.960 13.547 -3.926 1.00 0.00 H new ATOM 746 N PRO A 51 8.526 17.726 -3.694 1.00 0.00 N ATOM 747 CA PRO A 51 9.521 18.500 -2.946 1.00 0.00 C ATOM 748 C PRO A 51 8.942 19.112 -1.675 1.00 0.00 C ATOM 749 O PRO A 51 9.679 19.505 -0.771 1.00 0.00 O ATOM 750 CB PRO A 51 9.929 19.598 -3.930 1.00 0.00 C ATOM 751 CG PRO A 51 8.757 19.749 -4.837 1.00 0.00 C ATOM 752 CD PRO A 51 8.148 18.380 -4.958 1.00 0.00 C ATOM 0 HA PRO A 51 10.352 17.880 -2.610 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.151 20.531 -3.412 1.00 0.00 H new ATOM 0 HB3 PRO A 51 10.825 19.320 -4.484 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.039 20.461 -4.431 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.064 20.127 -5.812 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.066 18.431 -5.076 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.538 17.841 -5.822 1.00 0.00 H new ATOM 760 N THR A 52 7.616 19.189 -1.611 1.00 0.00 N ATOM 761 CA THR A 52 6.938 19.754 -0.451 1.00 0.00 C ATOM 762 C THR A 52 6.219 18.672 0.346 1.00 0.00 C ATOM 763 O THR A 52 5.326 18.963 1.141 1.00 0.00 O ATOM 764 CB THR A 52 5.920 20.833 -0.866 1.00 0.00 C ATOM 765 OG1 THR A 52 5.053 20.323 -1.885 1.00 0.00 O ATOM 766 CG2 THR A 52 6.629 22.080 -1.373 1.00 0.00 C ATOM 0 H THR A 52 6.990 18.867 -2.349 1.00 0.00 H new ATOM 0 HA THR A 52 7.706 20.211 0.173 1.00 0.00 H new ATOM 0 HB THR A 52 5.331 21.101 0.011 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.408 21.015 -2.142 1.00 0.00 H new ATOM 0 HG21 THR A 52 5.890 22.828 -1.660 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.265 22.483 -0.585 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.241 21.824 -2.238 1.00 0.00 H new ATOM 774 N GLY A 53 6.615 17.421 0.129 1.00 0.00 N ATOM 775 CA GLY A 53 5.997 16.315 0.836 1.00 0.00 C ATOM 776 C GLY A 53 6.970 15.594 1.748 1.00 0.00 C ATOM 777 O GLY A 53 7.995 15.083 1.296 1.00 0.00 O ATOM 0 H GLY A 53 7.352 17.154 -0.523 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.159 16.687 1.425 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.589 15.608 0.113 1.00 0.00 H new ATOM 781 N LYS A 54 6.650 15.554 3.037 1.00 0.00 N ATOM 782 CA LYS A 54 7.503 14.891 4.017 1.00 0.00 C ATOM 783 C LYS A 54 7.592 13.394 3.737 1.00 0.00 C ATOM 784 O LYS A 54 8.678 12.857 3.523 1.00 0.00 O ATOM 785 CB LYS A 54 6.967 15.126 5.431 1.00 0.00 C ATOM 786 CG LYS A 54 6.733 16.590 5.758 1.00 0.00 C ATOM 787 CD LYS A 54 6.617 16.816 7.256 1.00 0.00 C ATOM 788 CE LYS A 54 7.980 17.037 7.893 1.00 0.00 C ATOM 789 NZ LYS A 54 8.627 18.285 7.401 1.00 0.00 N ATOM 0 H LYS A 54 5.806 15.973 3.428 1.00 0.00 H new ATOM 0 HA LYS A 54 8.503 15.317 3.939 1.00 0.00 H new ATOM 0 HB2 LYS A 54 6.030 14.582 5.550 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.671 14.710 6.151 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.554 17.188 5.362 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.823 16.932 5.266 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.981 17.680 7.447 1.00 0.00 H new ATOM 0 HD3 LYS A 54 6.133 15.956 7.719 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.871 17.088 8.976 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.624 16.185 7.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 9.531 18.050 6.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 8.002 18.752 6.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 8.801 18.925 8.202 1.00 0.00 H new ATOM 803 N SER A 55 6.442 12.727 3.739 1.00 0.00 N ATOM 804 CA SER A 55 6.391 11.292 3.487 1.00 0.00 C ATOM 805 C SER A 55 4.947 10.811 3.379 1.00 0.00 C ATOM 806 O SER A 55 4.011 11.536 3.717 1.00 0.00 O ATOM 807 CB SER A 55 7.111 10.531 4.602 1.00 0.00 C ATOM 808 OG SER A 55 8.510 10.503 4.379 1.00 0.00 O ATOM 0 H SER A 55 5.534 13.157 3.912 1.00 0.00 H new ATOM 0 HA SER A 55 6.894 11.096 2.540 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.902 11.003 5.562 1.00 0.00 H new ATOM 0 HB3 SER A 55 6.728 9.512 4.657 1.00 0.00 H new ATOM 0 HG SER A 55 8.755 11.212 3.748 1.00 0.00 H new ATOM 814 N PHE A 56 4.774 9.581 2.904 1.00 0.00 N ATOM 815 CA PHE A 56 3.445 9.002 2.749 1.00 0.00 C ATOM 816 C PHE A 56 3.296 7.747 3.604 1.00 0.00 C ATOM 817 O PHE A 56 4.168 7.424 4.410 1.00 0.00 O ATOM 818 CB PHE A 56 3.179 8.667 1.280 1.00 0.00 C ATOM 819 CG PHE A 56 4.283 7.878 0.637 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.527 8.449 0.421 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.077 6.564 0.246 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.545 7.725 -0.170 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.091 5.836 -0.346 1.00 0.00 C ATOM 824 CZ PHE A 56 6.327 6.417 -0.555 1.00 0.00 C ATOM 0 H PHE A 56 5.537 8.967 2.620 1.00 0.00 H new ATOM 0 HA PHE A 56 2.714 9.738 3.084 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.249 8.103 1.207 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.034 9.594 0.725 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.703 9.472 0.718 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.113 6.104 0.406 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.510 8.182 -0.331 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.918 4.813 -0.645 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.121 5.850 -1.018 1.00 0.00 H new ATOM 834 N ALA A 57 2.183 7.043 3.422 1.00 0.00 N ATOM 835 CA ALA A 57 1.920 5.822 4.174 1.00 0.00 C ATOM 836 C ALA A 57 0.977 4.899 3.410 1.00 0.00 C ATOM 837 O ALA A 57 -0.044 5.339 2.881 1.00 0.00 O ATOM 838 CB ALA A 57 1.339 6.159 5.540 1.00 0.00 C ATOM 0 H ALA A 57 1.449 7.297 2.761 1.00 0.00 H new ATOM 0 HA ALA A 57 2.866 5.299 4.312 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.147 5.238 6.091 1.00 0.00 H new ATOM 0 HB2 ALA A 57 2.048 6.773 6.095 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.405 6.707 5.413 1.00 0.00 H new ATOM 844 N ILE A 58 1.326 3.618 3.355 1.00 0.00 N ATOM 845 CA ILE A 58 0.510 2.634 2.656 1.00 0.00 C ATOM 846 C ILE A 58 -0.048 1.595 3.623 1.00 0.00 C ATOM 847 O ILE A 58 0.636 0.639 3.985 1.00 0.00 O ATOM 848 CB ILE A 58 1.314 1.915 1.556 1.00 0.00 C ATOM 849 CG1 ILE A 58 2.083 2.932 0.710 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.388 1.082 0.682 1.00 0.00 C ATOM 851 CD1 ILE A 58 3.474 3.221 1.229 1.00 0.00 C ATOM 0 H ILE A 58 2.168 3.238 3.786 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.315 3.178 2.196 1.00 0.00 H new ATOM 0 HB ILE A 58 2.033 1.246 2.029 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.155 2.561 -0.312 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.517 3.863 0.672 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.971 0.580 -0.090 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.119 0.337 1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.352 1.731 0.214 1.00 0.00 H new ATOM 0 HD11 ILE A 58 3.960 3.950 0.581 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.409 3.622 2.241 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.057 2.300 1.240 1.00 0.00 H new ATOM 863 N ASN A 59 -1.296 1.789 4.036 1.00 0.00 N ATOM 864 CA ASN A 59 -1.947 0.868 4.960 1.00 0.00 C ATOM 865 C ASN A 59 -2.876 -0.086 4.215 1.00 0.00 C ATOM 866 O ASN A 59 -3.528 0.299 3.244 1.00 0.00 O ATOM 867 CB ASN A 59 -2.737 1.645 6.016 1.00 0.00 C ATOM 868 CG ASN A 59 -1.835 2.381 6.987 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.692 1.982 8.143 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.221 3.462 6.521 1.00 0.00 N ATOM 0 H ASN A 59 -1.877 2.576 3.745 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.172 0.281 5.453 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.394 2.360 5.521 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.375 0.956 6.569 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.601 3.998 7.128 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.369 3.756 5.556 1.00 0.00 H new ATOM 877 N PHE A 60 -2.930 -1.331 4.676 1.00 0.00 N ATOM 878 CA PHE A 60 -3.779 -2.340 4.053 1.00 0.00 C ATOM 879 C PHE A 60 -4.875 -2.796 5.011 1.00 0.00 C ATOM 880 O PHE A 60 -4.647 -3.641 5.877 1.00 0.00 O ATOM 881 CB PHE A 60 -2.939 -3.541 3.612 1.00 0.00 C ATOM 882 CG PHE A 60 -1.984 -3.227 2.496 1.00 0.00 C ATOM 883 CD1 PHE A 60 -0.869 -2.436 2.722 1.00 0.00 C ATOM 884 CD2 PHE A 60 -2.200 -3.723 1.220 1.00 0.00 C ATOM 885 CE1 PHE A 60 0.011 -2.145 1.697 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.323 -3.436 0.191 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.216 -2.646 0.430 1.00 0.00 C ATOM 0 H PHE A 60 -2.396 -1.665 5.478 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.250 -1.893 3.178 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.376 -3.914 4.467 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.605 -4.343 3.295 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.686 -2.042 3.711 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.064 -4.341 1.027 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.876 -1.526 1.886 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.503 -3.829 -0.799 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.471 -2.420 -0.372 1.00 0.00 H new ATOM 897 N LYS A 61 -6.066 -2.231 4.850 1.00 0.00 N ATOM 898 CA LYS A 61 -7.200 -2.578 5.698 1.00 0.00 C ATOM 899 C LYS A 61 -8.069 -3.643 5.037 1.00 0.00 C ATOM 900 O LYS A 61 -7.910 -3.941 3.853 1.00 0.00 O ATOM 901 CB LYS A 61 -8.039 -1.334 5.999 1.00 0.00 C ATOM 902 CG LYS A 61 -9.160 -1.581 6.993 1.00 0.00 C ATOM 903 CD LYS A 61 -9.838 -0.285 7.403 1.00 0.00 C ATOM 904 CE LYS A 61 -9.029 0.459 8.454 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.595 1.807 8.738 1.00 0.00 N ATOM 0 H LYS A 61 -6.271 -1.529 4.139 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.811 -2.981 6.633 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.387 -0.552 6.387 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.466 -0.960 5.068 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.896 -2.254 6.553 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.761 -2.079 7.877 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -9.971 0.350 6.527 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -10.832 -0.501 7.793 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.004 -0.125 9.374 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -7.999 0.562 8.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.015 2.282 9.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.596 2.374 7.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.570 1.708 9.087 1.00 0.00 H new ATOM 919 N VAL A 62 -8.990 -4.212 5.808 1.00 0.00 N ATOM 920 CA VAL A 62 -9.886 -5.241 5.296 1.00 0.00 C ATOM 921 C VAL A 62 -11.255 -4.660 4.958 1.00 0.00 C ATOM 922 O VAL A 62 -11.901 -4.036 5.799 1.00 0.00 O ATOM 923 CB VAL A 62 -10.063 -6.387 6.310 1.00 0.00 C ATOM 924 CG1 VAL A 62 -10.958 -7.475 5.736 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.711 -6.955 6.713 1.00 0.00 C ATOM 0 H VAL A 62 -9.135 -3.977 6.790 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.428 -5.636 4.389 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.544 -5.988 7.203 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -11.071 -8.276 6.467 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.937 -7.056 5.503 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.508 -7.874 4.827 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.855 -7.763 7.430 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.200 -7.339 5.830 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.108 -6.170 7.168 1.00 0.00 H new ATOM 935 N GLY A 63 -11.692 -4.869 3.720 1.00 0.00 N ATOM 936 CA GLY A 63 -12.982 -4.360 3.293 1.00 0.00 C ATOM 937 C GLY A 63 -14.127 -4.922 4.111 1.00 0.00 C ATOM 938 O GLY A 63 -15.097 -4.220 4.399 1.00 0.00 O ATOM 0 H GLY A 63 -11.176 -5.382 3.005 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.984 -3.273 3.370 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.136 -4.605 2.242 1.00 0.00 H new ATOM 942 N SER A 64 -14.017 -6.192 4.486 1.00 0.00 N ATOM 943 CA SER A 64 -15.054 -6.850 5.272 1.00 0.00 C ATOM 944 C SER A 64 -15.159 -6.230 6.662 1.00 0.00 C ATOM 945 O SER A 64 -16.108 -5.504 6.960 1.00 0.00 O ATOM 946 CB SER A 64 -14.762 -8.347 5.390 1.00 0.00 C ATOM 947 OG SER A 64 -14.768 -8.970 4.117 1.00 0.00 O ATOM 0 H SER A 64 -13.220 -6.786 4.258 1.00 0.00 H new ATOM 0 HA SER A 64 -16.006 -6.712 4.759 1.00 0.00 H new ATOM 0 HB2 SER A 64 -13.793 -8.495 5.866 1.00 0.00 H new ATOM 0 HB3 SER A 64 -15.508 -8.817 6.032 1.00 0.00 H new ATOM 0 HG SER A 64 -14.577 -9.926 4.220 1.00 0.00 H new ATOM 953 N SER A 65 -14.177 -6.521 7.509 1.00 0.00 N ATOM 954 CA SER A 65 -14.159 -5.995 8.869 1.00 0.00 C ATOM 955 C SER A 65 -13.622 -4.567 8.892 1.00 0.00 C ATOM 956 O SER A 65 -14.375 -3.612 9.077 1.00 0.00 O ATOM 957 CB SER A 65 -13.305 -6.888 9.772 1.00 0.00 C ATOM 958 OG SER A 65 -13.923 -8.147 9.975 1.00 0.00 O ATOM 0 H SER A 65 -13.383 -7.118 7.277 1.00 0.00 H new ATOM 0 HA SER A 65 -15.183 -5.986 9.243 1.00 0.00 H new ATOM 0 HB2 SER A 65 -12.322 -7.030 9.323 1.00 0.00 H new ATOM 0 HB3 SER A 65 -13.149 -6.397 10.732 1.00 0.00 H new ATOM 0 HG SER A 65 -13.357 -8.700 10.554 1.00 0.00 H new ATOM 964 N GLY A 66 -12.313 -4.430 8.703 1.00 0.00 N ATOM 965 CA GLY A 66 -11.697 -3.117 8.706 1.00 0.00 C ATOM 966 C GLY A 66 -10.436 -3.070 9.546 1.00 0.00 C ATOM 967 O GLY A 66 -10.190 -2.093 10.254 1.00 0.00 O ATOM 0 H GLY A 66 -11.669 -5.205 8.548 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.459 -2.829 7.682 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.410 -2.385 9.086 1.00 0.00 H new ATOM 971 N ASP A 67 -9.637 -4.128 9.471 1.00 0.00 N ATOM 972 CA ASP A 67 -8.395 -4.204 10.231 1.00 0.00 C ATOM 973 C ASP A 67 -7.185 -4.077 9.310 1.00 0.00 C ATOM 974 O ASP A 67 -7.191 -4.584 8.188 1.00 0.00 O ATOM 975 CB ASP A 67 -8.326 -5.521 11.005 1.00 0.00 C ATOM 976 CG ASP A 67 -9.687 -5.980 11.490 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.428 -5.148 12.055 1.00 0.00 O ATOM 978 OD2 ASP A 67 -10.013 -7.171 11.303 1.00 0.00 O ATOM 0 H ASP A 67 -9.827 -4.945 8.891 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.379 -3.374 10.938 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.892 -6.291 10.367 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.660 -5.402 11.860 1.00 0.00 H new ATOM 983 N ILE A 68 -6.150 -3.397 9.792 1.00 0.00 N ATOM 984 CA ILE A 68 -4.934 -3.204 9.012 1.00 0.00 C ATOM 985 C ILE A 68 -3.915 -4.301 9.302 1.00 0.00 C ATOM 986 O ILE A 68 -3.394 -4.401 10.412 1.00 0.00 O ATOM 987 CB ILE A 68 -4.292 -1.834 9.300 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.320 -0.716 9.117 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.091 -1.611 8.393 1.00 0.00 C ATOM 990 CD1 ILE A 68 -4.910 0.593 9.755 1.00 0.00 C ATOM 0 H ILE A 68 -6.129 -2.971 10.718 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.223 -3.248 7.962 1.00 0.00 H new ATOM 0 HB ILE A 68 -3.949 -1.820 10.334 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.484 -0.556 8.051 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.272 -1.035 9.542 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.648 -0.639 8.608 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.352 -2.393 8.568 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.411 -1.641 7.351 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.686 1.339 9.585 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.774 0.448 10.827 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.974 0.936 9.313 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.635 -5.122 8.294 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.676 -6.209 8.439 1.00 0.00 C ATOM 1004 C ALA A 69 -1.249 -5.714 8.230 1.00 0.00 C ATOM 1005 O ALA A 69 -0.305 -6.236 8.826 1.00 0.00 O ATOM 1006 CB ALA A 69 -2.997 -7.330 7.462 1.00 0.00 C ATOM 0 H ALA A 69 -4.059 -5.054 7.369 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.753 -6.595 9.455 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.272 -8.135 7.582 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.999 -7.711 7.661 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.950 -6.948 6.442 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.097 -4.706 7.379 1.00 0.00 N ATOM 1013 CA LEU A 70 0.217 -4.140 7.090 1.00 0.00 C ATOM 1014 C LEU A 70 0.137 -2.623 6.950 1.00 0.00 C ATOM 1015 O LEU A 70 -0.713 -2.099 6.230 1.00 0.00 O ATOM 1016 CB LEU A 70 0.787 -4.752 5.809 1.00 0.00 C ATOM 1017 CG LEU A 70 2.081 -4.129 5.285 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.210 -4.324 6.284 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.451 -4.724 3.934 1.00 0.00 C ATOM 0 H LEU A 70 -1.867 -4.263 6.877 1.00 0.00 H new ATOM 0 HA LEU A 70 0.878 -4.376 7.924 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.963 -5.813 5.985 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.030 -4.680 5.028 1.00 0.00 H new ATOM 0 HG LEU A 70 1.920 -3.059 5.155 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.123 -3.874 5.894 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.946 -3.848 7.229 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.372 -5.390 6.447 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.375 -4.269 3.577 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.593 -5.800 4.037 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.651 -4.530 3.220 1.00 0.00 H new ATOM 1031 N HIS A 71 1.031 -1.923 7.642 1.00 0.00 N ATOM 1032 CA HIS A 71 1.064 -0.465 7.592 1.00 0.00 C ATOM 1033 C HIS A 71 2.493 0.040 7.417 1.00 0.00 C ATOM 1034 O HIS A 71 3.218 0.231 8.394 1.00 0.00 O ATOM 1035 CB HIS A 71 0.455 0.123 8.866 1.00 0.00 C ATOM 1036 CG HIS A 71 0.832 1.553 9.105 1.00 0.00 C ATOM 1037 ND1 HIS A 71 0.969 2.475 8.088 1.00 0.00 N ATOM 1038 CD2 HIS A 71 1.098 2.218 10.253 1.00 0.00 C ATOM 1039 CE1 HIS A 71 1.306 3.645 8.601 1.00 0.00 C ATOM 1040 NE2 HIS A 71 1.390 3.516 9.913 1.00 0.00 N ATOM 0 H HIS A 71 1.741 -2.341 8.243 1.00 0.00 H new ATOM 0 HA HIS A 71 0.475 -0.141 6.734 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.631 0.047 8.809 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.772 -0.475 9.720 1.00 0.00 H new ATOM 0 HD2 HIS A 71 1.083 1.805 11.251 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.483 4.552 8.043 1.00 0.00 H new ATOM 0 HE2 HIS A 71 1.632 4.260 10.567 1.00 0.00 H new ATOM 1049 N ILE A 72 2.890 0.254 6.167 1.00 0.00 N ATOM 1050 CA ILE A 72 4.232 0.737 5.865 1.00 0.00 C ATOM 1051 C ILE A 72 4.238 2.247 5.656 1.00 0.00 C ATOM 1052 O ILE A 72 3.399 2.788 4.937 1.00 0.00 O ATOM 1053 CB ILE A 72 4.806 0.054 4.610 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.664 -1.465 4.718 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.264 0.443 4.416 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.695 -2.172 3.382 1.00 0.00 C ATOM 0 H ILE A 72 2.302 0.101 5.348 1.00 0.00 H new ATOM 0 HA ILE A 72 4.858 0.489 6.722 1.00 0.00 H new ATOM 0 HB ILE A 72 4.241 0.391 3.741 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.468 -1.853 5.344 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.726 -1.699 5.222 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.656 -0.048 3.525 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.340 1.524 4.298 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.842 0.132 5.286 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.589 -3.246 3.536 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.875 -1.812 2.761 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.643 -1.969 2.885 1.00 0.00 H new ATOM 1068 N ASN A 73 5.191 2.923 6.290 1.00 0.00 N ATOM 1069 CA ASN A 73 5.308 4.372 6.173 1.00 0.00 C ATOM 1070 C ASN A 73 6.771 4.794 6.079 1.00 0.00 C ATOM 1071 O ASN A 73 7.516 4.764 7.059 1.00 0.00 O ATOM 1072 CB ASN A 73 4.644 5.056 7.369 1.00 0.00 C ATOM 1073 CG ASN A 73 4.289 6.503 7.084 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.272 7.275 6.636 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 3.145 6.920 7.265 1.00 0.00 N flip ATOM 0 H ASN A 73 5.893 2.490 6.890 1.00 0.00 H new ATOM 0 HA ASN A 73 4.800 4.680 5.259 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.741 4.510 7.641 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.314 5.011 8.228 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.421 6.290 7.611 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.921 7.896 7.069 1.00 0.00 H new ATOM 1082 N PRO A 74 7.194 5.196 4.871 1.00 0.00 N ATOM 1083 CA PRO A 74 8.571 5.633 4.620 1.00 0.00 C ATOM 1084 C PRO A 74 8.885 6.969 5.284 1.00 0.00 C ATOM 1085 O PRO A 74 7.988 7.773 5.539 1.00 0.00 O ATOM 1086 CB PRO A 74 8.628 5.767 3.096 1.00 0.00 C ATOM 1087 CG PRO A 74 7.219 6.018 2.685 1.00 0.00 C ATOM 1088 CD PRO A 74 6.362 5.257 3.658 1.00 0.00 C ATOM 0 HA PRO A 74 9.301 4.934 5.028 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.280 6.587 2.795 1.00 0.00 H new ATOM 0 HB3 PRO A 74 9.020 4.861 2.633 1.00 0.00 H new ATOM 0 HG2 PRO A 74 6.988 7.083 2.712 1.00 0.00 H new ATOM 0 HG3 PRO A 74 7.044 5.680 1.664 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.417 5.766 3.845 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.120 4.261 3.287 1.00 0.00 H new ATOM 1096 N ARG A 75 10.165 7.201 5.562 1.00 0.00 N ATOM 1097 CA ARG A 75 10.597 8.440 6.197 1.00 0.00 C ATOM 1098 C ARG A 75 11.780 9.049 5.452 1.00 0.00 C ATOM 1099 O ARG A 75 12.920 8.616 5.618 1.00 0.00 O ATOM 1100 CB ARG A 75 10.976 8.184 7.657 1.00 0.00 C ATOM 1101 CG ARG A 75 9.792 7.834 8.542 1.00 0.00 C ATOM 1102 CD ARG A 75 10.244 7.302 9.893 1.00 0.00 C ATOM 1103 NE ARG A 75 10.552 8.378 10.831 1.00 0.00 N ATOM 1104 CZ ARG A 75 10.927 8.173 12.088 1.00 0.00 C ATOM 1105 NH1 ARG A 75 11.041 6.938 12.556 1.00 0.00 N ATOM 1106 NH2 ARG A 75 11.190 9.205 12.880 1.00 0.00 N ATOM 0 H ARG A 75 10.920 6.547 5.357 1.00 0.00 H new ATOM 0 HA ARG A 75 9.767 9.145 6.163 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.702 7.372 7.698 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.468 9.071 8.057 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.171 8.718 8.687 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.173 7.088 8.045 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.463 6.668 10.313 1.00 0.00 H new ATOM 0 HD3 ARG A 75 11.125 6.675 9.759 1.00 0.00 H new ATOM 0 HE ARG A 75 10.475 9.340 10.502 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.840 6.142 11.950 1.00 0.00 H new ATOM 0 HH12 ARG A 75 11.329 6.783 13.522 1.00 0.00 H new ATOM 0 HH21 ARG A 75 11.104 10.157 12.523 1.00 0.00 H new ATOM 0 HH22 ARG A 75 11.478 9.046 13.846 1.00 0.00 H new ATOM 1120 N MET A 76 11.501 10.055 4.629 1.00 0.00 N ATOM 1121 CA MET A 76 12.543 10.724 3.859 1.00 0.00 C ATOM 1122 C MET A 76 13.539 11.419 4.781 1.00 0.00 C ATOM 1123 O MET A 76 13.249 11.665 5.951 1.00 0.00 O ATOM 1124 CB MET A 76 11.923 11.741 2.899 1.00 0.00 C ATOM 1125 CG MET A 76 11.391 11.121 1.617 1.00 0.00 C ATOM 1126 SD MET A 76 10.904 9.398 1.829 1.00 0.00 S ATOM 1127 CE MET A 76 9.176 9.475 1.363 1.00 0.00 C ATOM 0 H MET A 76 10.562 10.424 4.478 1.00 0.00 H new ATOM 0 HA MET A 76 13.076 9.968 3.282 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.110 12.259 3.407 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.671 12.493 2.646 1.00 0.00 H new ATOM 0 HG2 MET A 76 10.534 11.697 1.268 1.00 0.00 H new ATOM 0 HG3 MET A 76 12.155 11.186 0.842 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.678 8.551 1.658 1.00 0.00 H new ATOM 0 HE2 MET A 76 8.701 10.319 1.864 1.00 0.00 H new ATOM 0 HE3 MET A 76 9.096 9.602 0.283 1.00 0.00 H new ATOM 1137 N GLY A 77 14.715 11.733 4.246 1.00 0.00 N ATOM 1138 CA GLY A 77 15.736 12.397 5.035 1.00 0.00 C ATOM 1139 C GLY A 77 16.581 11.420 5.829 1.00 0.00 C ATOM 1140 O GLY A 77 17.768 11.252 5.557 1.00 0.00 O ATOM 0 H GLY A 77 14.979 11.539 3.280 1.00 0.00 H new ATOM 0 HA2 GLY A 77 16.381 12.978 4.375 1.00 0.00 H new ATOM 0 HA3 GLY A 77 15.262 13.102 5.718 1.00 0.00 H new ATOM 1144 N ASN A 78 15.967 10.775 6.816 1.00 0.00 N ATOM 1145 CA ASN A 78 16.671 9.812 7.654 1.00 0.00 C ATOM 1146 C ASN A 78 16.892 8.500 6.907 1.00 0.00 C ATOM 1147 O ASN A 78 18.026 8.051 6.742 1.00 0.00 O ATOM 1148 CB ASN A 78 15.884 9.552 8.941 1.00 0.00 C ATOM 1149 CG ASN A 78 16.758 9.005 10.053 1.00 0.00 C ATOM 1150 OD1 ASN A 78 17.580 9.723 10.622 1.00 0.00 O ATOM 1151 ND2 ASN A 78 16.584 7.727 10.367 1.00 0.00 N ATOM 0 H ASN A 78 14.983 10.902 7.055 1.00 0.00 H new ATOM 0 HA ASN A 78 17.643 10.233 7.909 1.00 0.00 H new ATOM 0 HB2 ASN A 78 15.418 10.480 9.272 1.00 0.00 H new ATOM 0 HB3 ASN A 78 15.079 8.847 8.735 1.00 0.00 H new ATOM 0 HD21 ASN A 78 17.144 7.303 11.107 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.891 7.169 9.869 1.00 0.00 H new ATOM 1158 N GLY A 79 15.800 7.891 6.456 1.00 0.00 N ATOM 1159 CA GLY A 79 15.896 6.637 5.731 1.00 0.00 C ATOM 1160 C GLY A 79 15.456 5.450 6.564 1.00 0.00 C ATOM 1161 O GLY A 79 16.156 4.439 6.638 1.00 0.00 O ATOM 0 H GLY A 79 14.851 8.243 6.579 1.00 0.00 H new ATOM 0 HA2 GLY A 79 15.283 6.693 4.832 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.925 6.487 5.406 1.00 0.00 H new ATOM 1165 N THR A 80 14.293 5.572 7.196 1.00 0.00 N ATOM 1166 CA THR A 80 13.761 4.502 8.031 1.00 0.00 C ATOM 1167 C THR A 80 12.269 4.306 7.790 1.00 0.00 C ATOM 1168 O THR A 80 11.468 5.211 8.026 1.00 0.00 O ATOM 1169 CB THR A 80 13.996 4.787 9.526 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.751 6.170 9.806 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.418 4.427 9.930 1.00 0.00 C ATOM 0 H THR A 80 13.701 6.401 7.145 1.00 0.00 H new ATOM 0 HA THR A 80 14.293 3.591 7.755 1.00 0.00 H new ATOM 0 HB THR A 80 13.305 4.172 10.102 1.00 0.00 H new ATOM 0 HG1 THR A 80 13.901 6.342 10.759 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.559 4.637 10.990 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.592 3.367 9.744 1.00 0.00 H new ATOM 0 HG23 THR A 80 16.123 5.018 9.346 1.00 0.00 H new ATOM 1179 N VAL A 81 11.900 3.119 7.320 1.00 0.00 N ATOM 1180 CA VAL A 81 10.503 2.804 7.049 1.00 0.00 C ATOM 1181 C VAL A 81 9.912 1.934 8.152 1.00 0.00 C ATOM 1182 O VAL A 81 10.319 0.787 8.339 1.00 0.00 O ATOM 1183 CB VAL A 81 10.342 2.082 5.698 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.873 1.992 5.312 1.00 0.00 C ATOM 1185 CG2 VAL A 81 11.144 2.790 4.617 1.00 0.00 C ATOM 0 H VAL A 81 12.550 2.359 7.119 1.00 0.00 H new ATOM 0 HA VAL A 81 9.966 3.752 7.012 1.00 0.00 H new ATOM 0 HB VAL A 81 10.729 1.068 5.799 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.779 1.479 4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.329 1.437 6.076 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.457 2.996 5.228 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.019 2.266 3.669 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.790 3.816 4.514 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.199 2.796 4.892 1.00 0.00 H new ATOM 1195 N VAL A 82 8.948 2.487 8.882 1.00 0.00 N ATOM 1196 CA VAL A 82 8.298 1.760 9.967 1.00 0.00 C ATOM 1197 C VAL A 82 7.163 0.889 9.442 1.00 0.00 C ATOM 1198 O VAL A 82 6.449 1.274 8.516 1.00 0.00 O ATOM 1199 CB VAL A 82 7.742 2.723 11.033 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.192 1.946 12.219 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.817 3.703 11.478 1.00 0.00 C ATOM 0 H VAL A 82 8.600 3.436 8.742 1.00 0.00 H new ATOM 0 HA VAL A 82 9.058 1.125 10.423 1.00 0.00 H new ATOM 0 HB VAL A 82 6.924 3.293 10.592 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.804 2.643 12.962 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.390 1.289 11.883 1.00 0.00 H new ATOM 0 HG13 VAL A 82 7.988 1.348 12.663 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.407 4.376 12.231 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.658 3.153 11.902 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.158 4.283 10.621 1.00 0.00 H new ATOM 1211 N ARG A 83 7.000 -0.286 10.041 1.00 0.00 N ATOM 1212 CA ARG A 83 5.951 -1.213 9.634 1.00 0.00 C ATOM 1213 C ARG A 83 5.079 -1.603 10.824 1.00 0.00 C ATOM 1214 O ARG A 83 5.578 -2.080 11.842 1.00 0.00 O ATOM 1215 CB ARG A 83 6.564 -2.465 9.005 1.00 0.00 C ATOM 1216 CG ARG A 83 6.965 -2.282 7.550 1.00 0.00 C ATOM 1217 CD ARG A 83 8.404 -1.807 7.425 1.00 0.00 C ATOM 1218 NE ARG A 83 9.359 -2.854 7.780 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.608 -2.893 7.330 1.00 0.00 C ATOM 1220 NH1 ARG A 83 11.051 -1.949 6.511 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.417 -3.878 7.699 1.00 0.00 N ATOM 0 H ARG A 83 7.581 -0.619 10.810 1.00 0.00 H new ATOM 0 HA ARG A 83 5.325 -0.713 8.895 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.442 -2.758 9.581 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.849 -3.284 9.076 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.844 -3.225 7.017 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.300 -1.560 7.076 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.590 -1.479 6.402 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.558 -0.942 8.070 1.00 0.00 H new ATOM 0 HE ARG A 83 9.050 -3.596 8.408 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.432 -1.190 6.225 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.011 -1.981 6.167 1.00 0.00 H new ATOM 0 HH21 ARG A 83 11.080 -4.606 8.329 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.376 -3.907 7.353 1.00 0.00 H new ATOM 1235 N ASN A 84 3.773 -1.396 10.687 1.00 0.00 N ATOM 1236 CA ASN A 84 2.831 -1.725 11.750 1.00 0.00 C ATOM 1237 C ASN A 84 1.597 -2.423 11.187 1.00 0.00 C ATOM 1238 O ASN A 84 1.459 -2.579 9.974 1.00 0.00 O ATOM 1239 CB ASN A 84 2.417 -0.459 12.503 1.00 0.00 C ATOM 1240 CG ASN A 84 3.552 0.539 12.624 1.00 0.00 C ATOM 1241 OD1 ASN A 84 4.048 1.057 11.624 1.00 0.00 O ATOM 1242 ND2 ASN A 84 3.969 0.813 13.855 1.00 0.00 N ATOM 0 H ASN A 84 3.343 -1.002 9.850 1.00 0.00 H new ATOM 0 HA ASN A 84 3.326 -2.406 12.443 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.579 0.009 11.987 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.067 -0.730 13.499 1.00 0.00 H new ATOM 0 HD21 ASN A 84 4.730 1.477 14.000 1.00 0.00 H new ATOM 0 HD22 ASN A 84 3.528 0.360 14.655 1.00 0.00 H new ATOM 1249 N SER A 85 0.702 -2.839 12.077 1.00 0.00 N ATOM 1250 CA SER A 85 -0.520 -3.523 11.670 1.00 0.00 C ATOM 1251 C SER A 85 -1.606 -3.374 12.731 1.00 0.00 C ATOM 1252 O SER A 85 -1.558 -4.017 13.780 1.00 0.00 O ATOM 1253 CB SER A 85 -0.240 -5.005 11.416 1.00 0.00 C ATOM 1254 OG SER A 85 -1.418 -5.687 11.021 1.00 0.00 O ATOM 0 H SER A 85 0.800 -2.714 13.085 1.00 0.00 H new ATOM 0 HA SER A 85 -0.873 -3.064 10.747 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.520 -5.107 10.641 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.163 -5.462 12.320 1.00 0.00 H new ATOM 0 HG SER A 85 -2.103 -5.035 10.765 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.585 -2.521 12.451 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.684 -2.285 13.380 1.00 0.00 C ATOM 1262 C LEU A 86 -4.691 -3.430 13.334 1.00 0.00 C ATOM 1263 O LEU A 86 -5.356 -3.646 12.319 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.382 -0.964 13.052 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.702 -0.704 13.778 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.484 -0.651 15.282 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.337 0.588 13.283 1.00 0.00 C ATOM 0 H LEU A 86 -2.640 -1.981 11.587 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.270 -2.229 14.387 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.697 -0.148 13.282 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.568 -0.931 11.979 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.382 -1.527 13.560 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.435 -0.465 15.781 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.074 -1.601 15.624 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.786 0.152 15.520 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.276 0.757 13.810 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.660 1.421 13.470 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.531 0.512 12.213 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.801 -4.160 14.438 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.729 -5.282 14.525 1.00 0.00 C ATOM 1281 C LEU A 87 -7.073 -4.835 15.093 1.00 0.00 C ATOM 1282 O LEU A 87 -7.174 -3.776 15.711 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.139 -6.392 15.395 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.856 -7.043 14.875 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.413 -8.164 15.802 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.060 -7.566 13.461 1.00 0.00 C ATOM 0 H LEU A 87 -4.259 -3.995 15.286 1.00 0.00 H new ATOM 0 HA LEU A 87 -5.891 -5.666 13.518 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.939 -5.983 16.385 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.893 -7.169 15.518 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.071 -6.288 14.852 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.499 -8.615 15.416 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.226 -7.761 16.797 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.196 -8.921 15.858 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.138 -8.026 13.107 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.859 -8.307 13.459 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.330 -6.740 12.803 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.100 -5.651 14.880 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.437 -5.340 15.373 1.00 0.00 C ATOM 1300 C ASN A 88 -9.377 -4.760 16.782 1.00 0.00 C ATOM 1301 O ASN A 88 -9.212 -5.491 17.759 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.312 -6.595 15.362 1.00 0.00 C ATOM 1303 CG ASN A 88 -10.427 -7.208 13.980 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -9.434 -8.003 13.601 1.00 0.00 O flip ATOM 1305 ND2 ASN A 88 -11.399 -6.970 13.262 1.00 0.00 N flip ATOM 0 H ASN A 88 -8.032 -6.532 14.370 1.00 0.00 H new ATOM 0 HA ASN A 88 -9.876 -4.593 14.711 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.895 -7.331 16.049 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -11.307 -6.344 15.729 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -12.140 -6.352 13.594 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -11.463 -7.391 12.335 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.512 -3.441 16.881 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.470 -2.785 18.175 1.00 0.00 C ATOM 1314 C GLY A 89 -8.115 -2.907 18.843 1.00 0.00 C ATOM 1315 O GLY A 89 -7.904 -2.380 19.935 1.00 0.00 O ATOM 0 H GLY A 89 -9.650 -2.815 16.088 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.718 -1.731 18.053 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.232 -3.218 18.823 1.00 0.00 H new ATOM 1319 N SER A 90 -7.193 -3.604 18.186 1.00 0.00 N ATOM 1320 CA SER A 90 -5.852 -3.797 18.725 1.00 0.00 C ATOM 1321 C SER A 90 -4.793 -3.338 17.727 1.00 0.00 C ATOM 1322 O SER A 90 -5.101 -3.039 16.573 1.00 0.00 O ATOM 1323 CB SER A 90 -5.630 -5.269 19.081 1.00 0.00 C ATOM 1324 OG SER A 90 -4.847 -5.397 20.255 1.00 0.00 O ATOM 0 H SER A 90 -7.350 -4.044 17.280 1.00 0.00 H new ATOM 0 HA SER A 90 -5.760 -3.194 19.628 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.592 -5.760 19.226 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.135 -5.776 18.253 1.00 0.00 H new ATOM 0 HG SER A 90 -4.721 -6.347 20.462 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.546 -3.285 18.181 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.441 -2.862 17.329 1.00 0.00 C ATOM 1332 C TRP A 91 -1.308 -3.882 17.361 1.00 0.00 C ATOM 1333 O TRP A 91 -1.220 -4.697 18.278 1.00 0.00 O ATOM 1334 CB TRP A 91 -1.924 -1.492 17.771 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.535 -0.353 17.012 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.549 0.460 17.431 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.172 0.097 15.703 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.838 1.389 16.460 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -3.007 1.188 15.391 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.221 -0.313 14.764 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -2.919 1.870 14.180 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.135 0.364 13.563 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -1.979 1.446 13.280 1.00 0.00 C ATOM 0 H TRP A 91 -3.275 -3.529 19.133 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.811 -2.790 16.306 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -2.126 -1.361 18.834 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.841 -1.463 17.647 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -4.050 0.384 18.385 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.555 2.111 16.525 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.565 -1.145 14.974 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.569 2.704 13.959 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.405 0.054 12.830 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.886 1.956 12.332 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.441 -3.830 16.354 1.00 0.00 N ATOM 1355 CA GLY A 92 0.675 -4.755 16.287 1.00 0.00 C ATOM 1356 C GLY A 92 1.924 -4.204 16.945 1.00 0.00 C ATOM 1357 O GLY A 92 2.042 -4.209 18.171 1.00 0.00 O ATOM 0 H GLY A 92 -0.492 -3.164 15.583 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.396 -5.691 16.770 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.889 -4.986 15.244 1.00 0.00 H new ATOM 1361 N SER A 93 2.861 -3.729 16.130 1.00 0.00 N ATOM 1362 CA SER A 93 4.110 -3.177 16.641 1.00 0.00 C ATOM 1363 C SER A 93 4.867 -2.439 15.541 1.00 0.00 C ATOM 1364 O SER A 93 4.464 -2.453 14.379 1.00 0.00 O ATOM 1365 CB SER A 93 4.986 -4.291 17.219 1.00 0.00 C ATOM 1366 OG SER A 93 4.542 -4.671 18.510 1.00 0.00 O ATOM 0 H SER A 93 2.779 -3.715 15.113 1.00 0.00 H new ATOM 0 HA SER A 93 3.868 -2.467 17.432 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.966 -5.155 16.555 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.021 -3.954 17.272 1.00 0.00 H new ATOM 0 HG SER A 93 3.695 -4.220 18.711 1.00 0.00 H new ATOM 1372 N GLU A 94 5.967 -1.795 15.919 1.00 0.00 N ATOM 1373 CA GLU A 94 6.781 -1.049 14.965 1.00 0.00 C ATOM 1374 C GLU A 94 7.957 -1.891 14.478 1.00 0.00 C ATOM 1375 O GLU A 94 8.758 -2.377 15.276 1.00 0.00 O ATOM 1376 CB GLU A 94 7.294 0.244 15.600 1.00 0.00 C ATOM 1377 CG GLU A 94 6.255 0.961 16.447 1.00 0.00 C ATOM 1378 CD GLU A 94 6.876 1.777 17.564 1.00 0.00 C ATOM 1379 OE1 GLU A 94 7.600 1.192 18.396 1.00 0.00 O ATOM 1380 OE2 GLU A 94 6.637 3.002 17.606 1.00 0.00 O ATOM 0 H GLU A 94 6.315 -1.775 16.878 1.00 0.00 H new ATOM 0 HA GLU A 94 6.155 -0.801 14.108 1.00 0.00 H new ATOM 0 HB2 GLU A 94 8.161 0.015 16.220 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.634 0.916 14.812 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.662 1.617 15.810 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.571 0.228 16.875 1.00 0.00 H new ATOM 1387 N GLU A 95 8.052 -2.060 13.163 1.00 0.00 N ATOM 1388 CA GLU A 95 9.128 -2.844 12.570 1.00 0.00 C ATOM 1389 C GLU A 95 9.942 -2.000 11.593 1.00 0.00 C ATOM 1390 O GLU A 95 9.428 -1.544 10.571 1.00 0.00 O ATOM 1391 CB GLU A 95 8.560 -4.070 11.851 1.00 0.00 C ATOM 1392 CG GLU A 95 8.151 -5.191 12.792 1.00 0.00 C ATOM 1393 CD GLU A 95 9.340 -5.881 13.430 1.00 0.00 C ATOM 1394 OE1 GLU A 95 9.902 -6.800 12.797 1.00 0.00 O ATOM 1395 OE2 GLU A 95 9.709 -5.504 14.561 1.00 0.00 O ATOM 0 H GLU A 95 7.397 -1.665 12.489 1.00 0.00 H new ATOM 0 HA GLU A 95 9.786 -3.175 13.373 1.00 0.00 H new ATOM 0 HB2 GLU A 95 7.694 -3.767 11.262 1.00 0.00 H new ATOM 0 HB3 GLU A 95 9.305 -4.448 11.151 1.00 0.00 H new ATOM 0 HG2 GLU A 95 7.508 -4.787 13.574 1.00 0.00 H new ATOM 0 HG3 GLU A 95 7.562 -5.925 12.242 1.00 0.00 H new ATOM 1402 N LYS A 96 11.215 -1.796 11.914 1.00 0.00 N ATOM 1403 CA LYS A 96 12.101 -1.008 11.067 1.00 0.00 C ATOM 1404 C LYS A 96 13.295 -1.839 10.607 1.00 0.00 C ATOM 1405 O LYS A 96 14.051 -2.364 11.424 1.00 0.00 O ATOM 1406 CB LYS A 96 12.589 0.233 11.818 1.00 0.00 C ATOM 1407 CG LYS A 96 11.500 1.263 12.064 1.00 0.00 C ATOM 1408 CD LYS A 96 12.086 2.633 12.363 1.00 0.00 C ATOM 1409 CE LYS A 96 12.375 2.803 13.847 1.00 0.00 C ATOM 1410 NZ LYS A 96 13.757 2.374 14.195 1.00 0.00 N ATOM 0 H LYS A 96 11.656 -2.166 12.756 1.00 0.00 H new ATOM 0 HA LYS A 96 11.538 -0.695 10.188 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.010 -0.074 12.775 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.395 0.697 11.250 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.853 1.326 11.189 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.877 0.943 12.899 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.006 2.769 11.794 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.391 3.407 12.035 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.238 3.848 14.126 1.00 0.00 H new ATOM 0 HE3 LYS A 96 11.658 2.221 14.426 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.004 2.733 15.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 13.808 1.335 14.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 14.425 2.754 13.494 1.00 0.00 H new ATOM 1424 N LYS A 97 13.460 -1.953 9.293 1.00 0.00 N ATOM 1425 CA LYS A 97 14.563 -2.718 8.724 1.00 0.00 C ATOM 1426 C LYS A 97 14.587 -2.588 7.204 1.00 0.00 C ATOM 1427 O LYS A 97 13.763 -3.182 6.508 1.00 0.00 O ATOM 1428 CB LYS A 97 14.446 -4.191 9.119 1.00 0.00 C ATOM 1429 CG LYS A 97 15.699 -5.000 8.827 1.00 0.00 C ATOM 1430 CD LYS A 97 16.673 -4.959 9.992 1.00 0.00 C ATOM 1431 CE LYS A 97 17.534 -3.705 9.955 1.00 0.00 C ATOM 1432 NZ LYS A 97 18.864 -3.927 10.587 1.00 0.00 N ATOM 0 H LYS A 97 12.843 -1.525 8.602 1.00 0.00 H new ATOM 0 HA LYS A 97 15.495 -2.315 9.121 1.00 0.00 H new ATOM 0 HB2 LYS A 97 14.221 -4.256 10.184 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.604 -4.635 8.588 1.00 0.00 H new ATOM 0 HG2 LYS A 97 15.425 -6.034 8.617 1.00 0.00 H new ATOM 0 HG3 LYS A 97 16.184 -4.611 7.932 1.00 0.00 H new ATOM 0 HD2 LYS A 97 16.121 -4.995 10.931 1.00 0.00 H new ATOM 0 HD3 LYS A 97 17.312 -5.841 9.964 1.00 0.00 H new ATOM 0 HE2 LYS A 97 17.671 -3.389 8.921 1.00 0.00 H new ATOM 0 HE3 LYS A 97 17.018 -2.895 10.470 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 19.421 -3.050 10.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 18.734 -4.204 11.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 19.367 -4.683 10.080 1.00 0.00 H new ATOM 1446 N ILE A 98 15.536 -1.809 6.696 1.00 0.00 N ATOM 1447 CA ILE A 98 15.668 -1.605 5.259 1.00 0.00 C ATOM 1448 C ILE A 98 17.127 -1.403 4.864 1.00 0.00 C ATOM 1449 O ILE A 98 17.914 -0.832 5.620 1.00 0.00 O ATOM 1450 CB ILE A 98 14.848 -0.391 4.785 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.188 -0.053 3.332 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.105 0.807 5.687 1.00 0.00 C ATOM 1453 CD1 ILE A 98 14.312 1.030 2.742 1.00 0.00 C ATOM 0 H ILE A 98 16.225 -1.309 7.258 1.00 0.00 H new ATOM 0 HA ILE A 98 15.284 -2.504 4.777 1.00 0.00 H new ATOM 0 HB ILE A 98 13.789 -0.643 4.841 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.230 0.263 3.275 1.00 0.00 H new ATOM 0 HG13 ILE A 98 15.095 -0.954 2.726 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.518 1.657 5.339 1.00 0.00 H new ATOM 0 HG22 ILE A 98 14.817 0.561 6.709 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.164 1.062 5.660 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.610 1.217 1.710 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.271 0.709 2.766 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.423 1.945 3.324 1.00 0.00 H new ATOM 1465 N THR A 99 17.483 -1.875 3.673 1.00 0.00 N ATOM 1466 CA THR A 99 18.848 -1.746 3.177 1.00 0.00 C ATOM 1467 C THR A 99 19.088 -0.363 2.583 1.00 0.00 C ATOM 1468 O THR A 99 20.115 0.265 2.844 1.00 0.00 O ATOM 1469 CB THR A 99 19.160 -2.813 2.110 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.516 -2.682 1.670 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.220 -2.679 0.921 1.00 0.00 C ATOM 0 H THR A 99 16.845 -2.350 3.034 1.00 0.00 H new ATOM 0 HA THR A 99 19.511 -1.891 4.030 1.00 0.00 H new ATOM 0 HB THR A 99 19.017 -3.797 2.557 1.00 0.00 H new ATOM 0 HG1 THR A 99 20.708 -3.364 0.993 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.459 -3.442 0.181 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.190 -2.807 1.255 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.337 -1.691 0.475 1.00 0.00 H new ATOM 1479 N HIS A 100 18.136 0.106 1.783 1.00 0.00 N ATOM 1480 CA HIS A 100 18.244 1.417 1.153 1.00 0.00 C ATOM 1481 C HIS A 100 16.867 2.047 0.968 1.00 0.00 C ATOM 1482 O HIS A 100 15.900 1.361 0.639 1.00 0.00 O ATOM 1483 CB HIS A 100 18.950 1.300 -0.198 1.00 0.00 C ATOM 1484 CG HIS A 100 18.044 0.874 -1.312 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.262 -0.260 -1.255 1.00 0.00 N ATOM 1486 CD2 HIS A 100 17.797 1.439 -2.517 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.574 -0.375 -2.377 1.00 0.00 C ATOM 1488 NE2 HIS A 100 16.880 0.644 -3.160 1.00 0.00 N ATOM 0 H HIS A 100 17.281 -0.402 1.556 1.00 0.00 H new ATOM 0 HA HIS A 100 18.832 2.060 1.808 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.395 2.262 -0.451 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.767 0.584 -0.111 1.00 0.00 H new ATOM 0 HD2 HIS A 100 18.239 2.346 -2.901 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.879 -1.167 -2.614 1.00 0.00 H new ATOM 0 HE2 HIS A 100 16.498 0.813 -4.090 1.00 0.00 H new ATOM 1497 N ASN A 101 16.786 3.356 1.182 1.00 0.00 N ATOM 1498 CA ASN A 101 15.527 4.077 1.040 1.00 0.00 C ATOM 1499 C ASN A 101 15.477 4.829 -0.287 1.00 0.00 C ATOM 1500 O ASN A 101 16.076 5.892 -0.449 1.00 0.00 O ATOM 1501 CB ASN A 101 15.342 5.057 2.201 1.00 0.00 C ATOM 1502 CG ASN A 101 14.208 6.033 1.959 1.00 0.00 C ATOM 1503 OD1 ASN A 101 14.107 6.632 0.888 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.346 6.198 2.956 1.00 0.00 N ATOM 0 H ASN A 101 17.577 3.939 1.454 1.00 0.00 H new ATOM 0 HA ASN A 101 14.717 3.348 1.055 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.148 4.499 3.117 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.268 5.611 2.356 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.562 6.842 2.851 1.00 0.00 H new ATOM 0 HD22 ASN A 101 13.468 5.681 3.827 1.00 0.00 H new ATOM 1511 N PRO A 102 14.746 4.265 -1.259 1.00 0.00 N ATOM 1512 CA PRO A 102 14.599 4.865 -2.589 1.00 0.00 C ATOM 1513 C PRO A 102 13.759 6.137 -2.561 1.00 0.00 C ATOM 1514 O PRO A 102 13.953 7.039 -3.377 1.00 0.00 O ATOM 1515 CB PRO A 102 13.889 3.773 -3.394 1.00 0.00 C ATOM 1516 CG PRO A 102 13.157 2.968 -2.377 1.00 0.00 C ATOM 1517 CD PRO A 102 14.005 2.998 -1.136 1.00 0.00 C ATOM 0 HA PRO A 102 15.559 5.167 -3.008 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.205 4.202 -4.126 1.00 0.00 H new ATOM 0 HB3 PRO A 102 14.602 3.160 -3.945 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.169 3.387 -2.185 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.008 1.945 -2.723 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.396 2.975 -0.232 1.00 0.00 H new ATOM 0 HD3 PRO A 102 14.678 2.142 -1.089 1.00 0.00 H new ATOM 1525 N PHE A 103 12.827 6.205 -1.617 1.00 0.00 N ATOM 1526 CA PHE A 103 11.957 7.368 -1.483 1.00 0.00 C ATOM 1527 C PHE A 103 12.775 8.635 -1.255 1.00 0.00 C ATOM 1528 O PHE A 103 13.447 8.778 -0.234 1.00 0.00 O ATOM 1529 CB PHE A 103 10.974 7.166 -0.328 1.00 0.00 C ATOM 1530 CG PHE A 103 10.264 5.844 -0.369 1.00 0.00 C ATOM 1531 CD1 PHE A 103 9.565 5.452 -1.499 1.00 0.00 C ATOM 1532 CD2 PHE A 103 10.296 4.991 0.723 1.00 0.00 C ATOM 1533 CE1 PHE A 103 8.910 4.236 -1.539 1.00 0.00 C ATOM 1534 CE2 PHE A 103 9.643 3.773 0.689 1.00 0.00 C ATOM 1535 CZ PHE A 103 8.950 3.395 -0.444 1.00 0.00 C ATOM 0 H PHE A 103 12.654 5.468 -0.933 1.00 0.00 H new ATOM 0 HA PHE A 103 11.397 7.481 -2.411 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.513 7.251 0.616 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.235 7.967 -0.346 1.00 0.00 H new ATOM 0 HD1 PHE A 103 9.532 6.105 -2.359 1.00 0.00 H new ATOM 0 HD2 PHE A 103 10.838 5.281 1.611 1.00 0.00 H new ATOM 0 HE1 PHE A 103 8.367 3.943 -2.426 1.00 0.00 H new ATOM 0 HE2 PHE A 103 9.675 3.118 1.547 1.00 0.00 H new ATOM 0 HZ PHE A 103 8.440 2.443 -0.474 1.00 0.00 H new ATOM 1545 N GLY A 104 12.714 9.554 -2.215 1.00 0.00 N ATOM 1546 CA GLY A 104 13.453 10.797 -2.101 1.00 0.00 C ATOM 1547 C GLY A 104 12.662 11.990 -2.598 1.00 0.00 C ATOM 1548 O GLY A 104 11.961 11.920 -3.608 1.00 0.00 O ATOM 0 H GLY A 104 12.165 9.459 -3.070 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.730 10.957 -1.059 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.380 10.718 -2.668 1.00 0.00 H new ATOM 1552 N PRO A 105 12.768 13.117 -1.879 1.00 0.00 N ATOM 1553 CA PRO A 105 12.062 14.352 -2.233 1.00 0.00 C ATOM 1554 C PRO A 105 12.617 14.993 -3.501 1.00 0.00 C ATOM 1555 O PRO A 105 13.738 15.500 -3.512 1.00 0.00 O ATOM 1556 CB PRO A 105 12.305 15.259 -1.025 1.00 0.00 C ATOM 1557 CG PRO A 105 13.572 14.757 -0.423 1.00 0.00 C ATOM 1558 CD PRO A 105 13.585 13.273 -0.663 1.00 0.00 C ATOM 0 HA PRO A 105 11.007 14.173 -2.443 1.00 0.00 H new ATOM 0 HB2 PRO A 105 12.396 16.303 -1.326 1.00 0.00 H new ATOM 0 HB3 PRO A 105 11.480 15.202 -0.315 1.00 0.00 H new ATOM 0 HG2 PRO A 105 14.438 15.234 -0.882 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.613 14.980 0.643 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.598 12.898 -0.809 1.00 0.00 H new ATOM 0 HD3 PRO A 105 13.161 12.726 0.179 1.00 0.00 H new ATOM 1566 N GLY A 106 11.824 14.968 -4.568 1.00 0.00 N ATOM 1567 CA GLY A 106 12.253 15.550 -5.826 1.00 0.00 C ATOM 1568 C GLY A 106 12.591 14.500 -6.865 1.00 0.00 C ATOM 1569 O GLY A 106 12.987 14.830 -7.983 1.00 0.00 O ATOM 0 H GLY A 106 10.892 14.555 -4.583 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.465 16.197 -6.211 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.126 16.179 -5.653 1.00 0.00 H new ATOM 1573 N GLN A 107 12.434 13.233 -6.497 1.00 0.00 N ATOM 1574 CA GLN A 107 12.728 12.132 -7.406 1.00 0.00 C ATOM 1575 C GLN A 107 11.658 11.049 -7.313 1.00 0.00 C ATOM 1576 O GLN A 107 11.151 10.754 -6.231 1.00 0.00 O ATOM 1577 CB GLN A 107 14.101 11.536 -7.093 1.00 0.00 C ATOM 1578 CG GLN A 107 14.235 11.034 -5.664 1.00 0.00 C ATOM 1579 CD GLN A 107 15.676 10.985 -5.195 1.00 0.00 C ATOM 1580 OE1 GLN A 107 16.432 11.941 -5.372 1.00 0.00 O ATOM 1581 NE2 GLN A 107 16.065 9.867 -4.594 1.00 0.00 N ATOM 0 H GLN A 107 12.105 12.943 -5.576 1.00 0.00 H new ATOM 0 HA GLN A 107 12.734 12.526 -8.422 1.00 0.00 H new ATOM 0 HB2 GLN A 107 14.295 10.711 -7.779 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.866 12.290 -7.278 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.663 11.682 -5.000 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.799 10.038 -5.591 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.405 9.099 -4.468 1.00 0.00 H new ATOM 0 HE22 GLN A 107 17.024 9.776 -4.258 1.00 0.00 H new ATOM 1590 N PHE A 108 11.318 10.460 -8.455 1.00 0.00 N ATOM 1591 CA PHE A 108 10.306 9.411 -8.503 1.00 0.00 C ATOM 1592 C PHE A 108 10.804 8.144 -7.813 1.00 0.00 C ATOM 1593 O PHE A 108 11.959 8.064 -7.396 1.00 0.00 O ATOM 1594 CB PHE A 108 9.930 9.101 -9.954 1.00 0.00 C ATOM 1595 CG PHE A 108 11.068 9.279 -10.918 1.00 0.00 C ATOM 1596 CD1 PHE A 108 11.956 8.244 -11.161 1.00 0.00 C ATOM 1597 CD2 PHE A 108 11.248 10.482 -11.582 1.00 0.00 C ATOM 1598 CE1 PHE A 108 13.003 8.405 -12.049 1.00 0.00 C ATOM 1599 CE2 PHE A 108 12.294 10.648 -12.471 1.00 0.00 C ATOM 1600 CZ PHE A 108 13.173 9.609 -12.704 1.00 0.00 C ATOM 0 H PHE A 108 11.729 10.691 -9.360 1.00 0.00 H new ATOM 0 HA PHE A 108 9.422 9.769 -7.975 1.00 0.00 H new ATOM 0 HB2 PHE A 108 9.569 8.075 -10.016 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.106 9.748 -10.254 1.00 0.00 H new ATOM 0 HD1 PHE A 108 11.829 7.301 -10.651 1.00 0.00 H new ATOM 0 HD2 PHE A 108 10.564 11.298 -11.403 1.00 0.00 H new ATOM 0 HE1 PHE A 108 13.688 7.590 -12.231 1.00 0.00 H new ATOM 0 HE2 PHE A 108 12.423 11.590 -12.983 1.00 0.00 H new ATOM 0 HZ PHE A 108 13.992 9.737 -13.397 1.00 0.00 H new ATOM 1610 N PHE A 109 9.922 7.157 -7.696 1.00 0.00 N ATOM 1611 CA PHE A 109 10.270 5.894 -7.056 1.00 0.00 C ATOM 1612 C PHE A 109 9.285 4.796 -7.446 1.00 0.00 C ATOM 1613 O PHE A 109 8.070 4.992 -7.398 1.00 0.00 O ATOM 1614 CB PHE A 109 10.292 6.058 -5.534 1.00 0.00 C ATOM 1615 CG PHE A 109 8.923 6.148 -4.922 1.00 0.00 C ATOM 1616 CD1 PHE A 109 8.255 5.003 -4.517 1.00 0.00 C ATOM 1617 CD2 PHE A 109 8.306 7.376 -4.750 1.00 0.00 C ATOM 1618 CE1 PHE A 109 6.995 5.083 -3.954 1.00 0.00 C ATOM 1619 CE2 PHE A 109 7.047 7.462 -4.187 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.391 6.314 -3.787 1.00 0.00 C ATOM 0 H PHE A 109 8.962 7.207 -8.036 1.00 0.00 H new ATOM 0 HA PHE A 109 11.264 5.604 -7.398 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.824 5.215 -5.093 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.854 6.957 -5.281 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.724 4.038 -4.643 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.815 8.277 -5.060 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.483 4.184 -3.645 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.576 8.426 -4.060 1.00 0.00 H new ATOM 0 HZ PHE A 109 5.408 6.379 -3.345 1.00 0.00 H new ATOM 1630 N ASP A 110 9.817 3.642 -7.832 1.00 0.00 N ATOM 1631 CA ASP A 110 8.985 2.512 -8.231 1.00 0.00 C ATOM 1632 C ASP A 110 8.925 1.464 -7.124 1.00 0.00 C ATOM 1633 O ASP A 110 9.892 0.740 -6.886 1.00 0.00 O ATOM 1634 CB ASP A 110 9.525 1.883 -9.516 1.00 0.00 C ATOM 1635 CG ASP A 110 9.213 0.402 -9.611 1.00 0.00 C ATOM 1636 OD1 ASP A 110 8.020 0.053 -9.735 1.00 0.00 O ATOM 1637 OD2 ASP A 110 10.162 -0.408 -9.562 1.00 0.00 O ATOM 0 H ASP A 110 10.820 3.464 -7.877 1.00 0.00 H new ATOM 0 HA ASP A 110 7.976 2.882 -8.412 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.097 2.397 -10.377 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.604 2.028 -9.562 1.00 0.00 H new ATOM 1642 N LEU A 111 7.783 1.391 -6.448 1.00 0.00 N ATOM 1643 CA LEU A 111 7.596 0.432 -5.364 1.00 0.00 C ATOM 1644 C LEU A 111 6.628 -0.672 -5.775 1.00 0.00 C ATOM 1645 O LEU A 111 5.606 -0.411 -6.409 1.00 0.00 O ATOM 1646 CB LEU A 111 7.077 1.143 -4.113 1.00 0.00 C ATOM 1647 CG LEU A 111 7.393 0.468 -2.778 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.810 -0.936 -2.738 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.896 0.430 -2.542 1.00 0.00 C ATOM 0 H LEU A 111 6.973 1.984 -6.631 1.00 0.00 H new ATOM 0 HA LEU A 111 8.562 -0.022 -5.142 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.491 2.151 -4.094 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.995 1.244 -4.199 1.00 0.00 H new ATOM 0 HG LEU A 111 6.935 1.052 -1.980 1.00 0.00 H new ATOM 0 HD11 LEU A 111 7.045 -1.400 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.728 -0.884 -2.860 1.00 0.00 H new ATOM 0 HD13 LEU A 111 7.238 -1.531 -3.545 1.00 0.00 H new ATOM 0 HD21 LEU A 111 9.102 -0.054 -1.587 1.00 0.00 H new ATOM 0 HD22 LEU A 111 9.376 -0.131 -3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.288 1.447 -2.525 1.00 0.00 H new ATOM 1661 N SER A 112 6.956 -1.907 -5.407 1.00 0.00 N ATOM 1662 CA SER A 112 6.116 -3.052 -5.738 1.00 0.00 C ATOM 1663 C SER A 112 6.153 -4.093 -4.624 1.00 0.00 C ATOM 1664 O SER A 112 7.188 -4.709 -4.369 1.00 0.00 O ATOM 1665 CB SER A 112 6.572 -3.681 -7.056 1.00 0.00 C ATOM 1666 OG SER A 112 6.896 -2.686 -8.011 1.00 0.00 O ATOM 0 H SER A 112 7.797 -2.140 -4.880 1.00 0.00 H new ATOM 0 HA SER A 112 5.090 -2.700 -5.848 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.440 -4.315 -6.878 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.783 -4.323 -7.448 1.00 0.00 H new ATOM 0 HG SER A 112 7.186 -3.114 -8.844 1.00 0.00 H new ATOM 1672 N ILE A 113 5.016 -4.285 -3.964 1.00 0.00 N ATOM 1673 CA ILE A 113 4.917 -5.252 -2.878 1.00 0.00 C ATOM 1674 C ILE A 113 4.425 -6.602 -3.388 1.00 0.00 C ATOM 1675 O ILE A 113 3.496 -6.672 -4.194 1.00 0.00 O ATOM 1676 CB ILE A 113 3.969 -4.758 -1.769 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.319 -3.323 -1.371 1.00 0.00 C ATOM 1678 CG2 ILE A 113 4.041 -5.681 -0.562 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.560 -2.276 -2.155 1.00 0.00 C ATOM 0 H ILE A 113 4.150 -3.784 -4.162 1.00 0.00 H new ATOM 0 HA ILE A 113 5.919 -5.366 -2.464 1.00 0.00 H new ATOM 0 HB ILE A 113 2.948 -4.770 -2.151 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.114 -3.189 -0.309 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.388 -3.166 -1.512 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.366 -5.319 0.213 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.748 -6.689 -0.857 1.00 0.00 H new ATOM 0 HG23 ILE A 113 5.060 -5.697 -0.177 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.859 -1.283 -1.820 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.784 -2.383 -3.216 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.490 -2.406 -1.995 1.00 0.00 H new ATOM 1691 N ARG A 114 5.052 -7.673 -2.912 1.00 0.00 N ATOM 1692 CA ARG A 114 4.678 -9.022 -3.319 1.00 0.00 C ATOM 1693 C ARG A 114 4.015 -9.773 -2.167 1.00 0.00 C ATOM 1694 O ARG A 114 4.612 -9.952 -1.105 1.00 0.00 O ATOM 1695 CB ARG A 114 5.908 -9.792 -3.803 1.00 0.00 C ATOM 1696 CG ARG A 114 6.169 -9.648 -5.293 1.00 0.00 C ATOM 1697 CD ARG A 114 7.274 -10.583 -5.758 1.00 0.00 C ATOM 1698 NE ARG A 114 7.376 -10.629 -7.214 1.00 0.00 N ATOM 1699 CZ ARG A 114 6.557 -11.335 -7.986 1.00 0.00 C ATOM 1700 NH1 ARG A 114 5.582 -12.050 -7.444 1.00 0.00 N ATOM 1701 NH2 ARG A 114 6.714 -11.326 -9.304 1.00 0.00 N ATOM 0 H ARG A 114 5.822 -7.632 -2.244 1.00 0.00 H new ATOM 0 HA ARG A 114 3.963 -8.942 -4.138 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.783 -9.444 -3.254 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.782 -10.848 -3.565 1.00 0.00 H new ATOM 0 HG2 ARG A 114 5.254 -9.861 -5.846 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.444 -8.618 -5.517 1.00 0.00 H new ATOM 0 HD2 ARG A 114 8.225 -10.257 -5.338 1.00 0.00 H new ATOM 0 HD3 ARG A 114 7.085 -11.586 -5.376 1.00 0.00 H new ATOM 0 HE ARG A 114 8.116 -10.090 -7.663 1.00 0.00 H new ATOM 0 HH11 ARG A 114 5.459 -12.059 -6.432 1.00 0.00 H new ATOM 0 HH12 ARG A 114 4.955 -12.591 -8.039 1.00 0.00 H new ATOM 0 HH21 ARG A 114 7.464 -10.777 -9.725 1.00 0.00 H new ATOM 0 HH22 ARG A 114 6.085 -11.868 -9.896 1.00 0.00 H new ATOM 1715 N CYS A 115 2.779 -10.208 -2.386 1.00 0.00 N ATOM 1716 CA CYS A 115 2.035 -10.939 -1.366 1.00 0.00 C ATOM 1717 C CYS A 115 2.238 -12.443 -1.517 1.00 0.00 C ATOM 1718 O CYS A 115 1.952 -13.015 -2.568 1.00 0.00 O ATOM 1719 CB CYS A 115 0.545 -10.602 -1.453 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.504 -11.615 -0.384 1.00 0.00 S ATOM 0 H CYS A 115 2.271 -10.068 -3.259 1.00 0.00 H new ATOM 0 HA CYS A 115 2.413 -10.636 -0.389 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.405 -9.553 -1.193 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.216 -10.721 -2.485 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.824 -12.712 -1.004 1.00 0.00 H new ATOM 1726 N GLY A 116 2.735 -13.077 -0.460 1.00 0.00 N ATOM 1727 CA GLY A 116 2.970 -14.509 -0.496 1.00 0.00 C ATOM 1728 C GLY A 116 2.246 -15.243 0.614 1.00 0.00 C ATOM 1729 O GLY A 116 1.177 -14.820 1.055 1.00 0.00 O ATOM 0 H GLY A 116 2.979 -12.625 0.421 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.646 -14.903 -1.459 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.040 -14.701 -0.416 1.00 0.00 H new ATOM 1733 N LEU A 117 2.828 -16.348 1.068 1.00 0.00 N ATOM 1734 CA LEU A 117 2.230 -17.146 2.133 1.00 0.00 C ATOM 1735 C LEU A 117 3.033 -17.020 3.424 1.00 0.00 C ATOM 1736 O LEU A 117 2.467 -16.917 4.512 1.00 0.00 O ATOM 1737 CB LEU A 117 2.146 -18.614 1.712 1.00 0.00 C ATOM 1738 CG LEU A 117 1.271 -18.914 0.494 1.00 0.00 C ATOM 1739 CD1 LEU A 117 1.596 -20.289 -0.070 1.00 0.00 C ATOM 1740 CD2 LEU A 117 -0.203 -18.820 0.860 1.00 0.00 C ATOM 0 H LEU A 117 3.713 -16.712 0.715 1.00 0.00 H new ATOM 0 HA LEU A 117 1.224 -16.769 2.315 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.155 -18.970 1.506 1.00 0.00 H new ATOM 0 HB3 LEU A 117 1.770 -19.192 2.556 1.00 0.00 H new ATOM 0 HG LEU A 117 1.482 -18.170 -0.274 1.00 0.00 H new ATOM 0 HD11 LEU A 117 0.964 -20.486 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 117 2.643 -20.321 -0.370 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.414 -21.047 0.692 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.811 -19.036 -0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.430 -19.542 1.645 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.426 -17.814 1.216 1.00 0.00 H new ATOM 1752 N ASP A 118 4.355 -17.026 3.294 1.00 0.00 N ATOM 1753 CA ASP A 118 5.237 -16.910 4.450 1.00 0.00 C ATOM 1754 C ASP A 118 5.375 -15.454 4.883 1.00 0.00 C ATOM 1755 O ASP A 118 5.403 -15.151 6.076 1.00 0.00 O ATOM 1756 CB ASP A 118 6.615 -17.491 4.127 1.00 0.00 C ATOM 1757 CG ASP A 118 6.528 -18.851 3.463 1.00 0.00 C ATOM 1758 OD1 ASP A 118 6.375 -18.897 2.225 1.00 0.00 O ATOM 1759 OD2 ASP A 118 6.612 -19.869 4.181 1.00 0.00 O ATOM 0 H ASP A 118 4.840 -17.110 2.400 1.00 0.00 H new ATOM 0 HA ASP A 118 4.796 -17.475 5.271 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.152 -16.804 3.473 1.00 0.00 H new ATOM 0 HB3 ASP A 118 7.195 -17.575 5.046 1.00 0.00 H new ATOM 1764 N ARG A 119 5.461 -14.556 3.907 1.00 0.00 N ATOM 1765 CA ARG A 119 5.599 -13.132 4.187 1.00 0.00 C ATOM 1766 C ARG A 119 5.530 -12.315 2.900 1.00 0.00 C ATOM 1767 O ARG A 119 5.377 -12.867 1.810 1.00 0.00 O ATOM 1768 CB ARG A 119 6.920 -12.858 4.908 1.00 0.00 C ATOM 1769 CG ARG A 119 8.140 -12.980 4.010 1.00 0.00 C ATOM 1770 CD ARG A 119 8.741 -14.375 4.073 1.00 0.00 C ATOM 1771 NE ARG A 119 9.667 -14.622 2.972 1.00 0.00 N ATOM 1772 CZ ARG A 119 10.639 -15.527 3.018 1.00 0.00 C ATOM 1773 NH1 ARG A 119 10.809 -16.267 4.105 1.00 0.00 N ATOM 1774 NH2 ARG A 119 11.442 -15.694 1.975 1.00 0.00 N ATOM 0 H ARG A 119 5.437 -14.790 2.914 1.00 0.00 H new ATOM 0 HA ARG A 119 4.772 -12.832 4.831 1.00 0.00 H new ATOM 0 HB2 ARG A 119 6.891 -11.855 5.333 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.021 -13.554 5.741 1.00 0.00 H new ATOM 0 HG2 ARG A 119 7.861 -12.749 2.982 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.888 -12.246 4.310 1.00 0.00 H new ATOM 0 HD2 ARG A 119 9.263 -14.502 5.021 1.00 0.00 H new ATOM 0 HD3 ARG A 119 7.942 -15.116 4.047 1.00 0.00 H new ATOM 0 HE ARG A 119 9.562 -14.070 2.121 1.00 0.00 H new ATOM 0 HH11 ARG A 119 10.193 -16.142 4.908 1.00 0.00 H new ATOM 0 HH12 ARG A 119 11.556 -16.961 4.138 1.00 0.00 H new ATOM 0 HH21 ARG A 119 11.314 -15.127 1.137 1.00 0.00 H new ATOM 0 HH22 ARG A 119 12.188 -16.389 2.012 1.00 0.00 H new ATOM 1788 N PHE A 120 5.643 -10.998 3.035 1.00 0.00 N ATOM 1789 CA PHE A 120 5.592 -10.105 1.884 1.00 0.00 C ATOM 1790 C PHE A 120 6.998 -9.722 1.430 1.00 0.00 C ATOM 1791 O PHE A 120 7.945 -9.749 2.215 1.00 0.00 O ATOM 1792 CB PHE A 120 4.793 -8.845 2.224 1.00 0.00 C ATOM 1793 CG PHE A 120 3.309 -9.017 2.074 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.596 -9.804 2.965 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.626 -8.393 1.043 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.230 -9.965 2.829 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.260 -8.550 0.902 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.561 -9.336 1.797 1.00 0.00 C ATOM 0 H PHE A 120 5.770 -10.526 3.930 1.00 0.00 H new ATOM 0 HA PHE A 120 5.097 -10.632 1.069 1.00 0.00 H new ATOM 0 HB2 PHE A 120 5.015 -8.550 3.250 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.123 -8.030 1.580 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.114 -10.297 3.775 1.00 0.00 H new ATOM 0 HD2 PHE A 120 3.167 -7.776 0.341 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.686 -10.582 3.529 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.740 -8.059 0.093 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.507 -9.459 1.690 1.00 0.00 H new ATOM 1808 N LYS A 121 7.125 -9.367 0.156 1.00 0.00 N ATOM 1809 CA LYS A 121 8.413 -8.978 -0.406 1.00 0.00 C ATOM 1810 C LYS A 121 8.299 -7.663 -1.170 1.00 0.00 C ATOM 1811 O LYS A 121 7.843 -7.635 -2.313 1.00 0.00 O ATOM 1812 CB LYS A 121 8.941 -10.075 -1.333 1.00 0.00 C ATOM 1813 CG LYS A 121 9.168 -11.404 -0.635 1.00 0.00 C ATOM 1814 CD LYS A 121 10.060 -12.320 -1.456 1.00 0.00 C ATOM 1815 CE LYS A 121 11.530 -12.109 -1.126 1.00 0.00 C ATOM 1816 NZ LYS A 121 11.977 -12.979 -0.004 1.00 0.00 N ATOM 0 H LYS A 121 6.351 -9.341 -0.507 1.00 0.00 H new ATOM 0 HA LYS A 121 9.113 -8.839 0.418 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.234 -10.220 -2.150 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.879 -9.743 -1.778 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.623 -11.231 0.340 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.209 -11.891 -0.458 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.789 -13.359 -1.267 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.894 -12.136 -2.517 1.00 0.00 H new ATOM 0 HE2 LYS A 121 12.134 -12.317 -2.009 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.697 -11.064 -0.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 12.921 -12.678 0.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 11.305 -12.900 0.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.019 -13.967 -0.326 1.00 0.00 H new ATOM 1830 N VAL A 122 8.717 -6.574 -0.532 1.00 0.00 N ATOM 1831 CA VAL A 122 8.664 -5.256 -1.152 1.00 0.00 C ATOM 1832 C VAL A 122 9.933 -4.972 -1.948 1.00 0.00 C ATOM 1833 O VAL A 122 11.044 -5.115 -1.436 1.00 0.00 O ATOM 1834 CB VAL A 122 8.472 -4.147 -0.101 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.214 -2.809 -0.776 1.00 0.00 C ATOM 1836 CG2 VAL A 122 7.335 -4.504 0.846 1.00 0.00 C ATOM 0 H VAL A 122 9.096 -6.579 0.415 1.00 0.00 H new ATOM 0 HA VAL A 122 7.808 -5.258 -1.826 1.00 0.00 H new ATOM 0 HB VAL A 122 9.389 -4.060 0.483 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.081 -2.038 -0.017 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.063 -2.552 -1.410 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.313 -2.877 -1.386 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.212 -3.710 1.583 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.411 -4.619 0.279 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.566 -5.439 1.356 1.00 0.00 H new ATOM 1846 N TYR A 123 9.761 -4.568 -3.201 1.00 0.00 N ATOM 1847 CA TYR A 123 10.893 -4.265 -4.069 1.00 0.00 C ATOM 1848 C TYR A 123 10.837 -2.819 -4.552 1.00 0.00 C ATOM 1849 O TYR A 123 9.759 -2.245 -4.705 1.00 0.00 O ATOM 1850 CB TYR A 123 10.912 -5.214 -5.268 1.00 0.00 C ATOM 1851 CG TYR A 123 10.969 -6.675 -4.882 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.824 -7.354 -4.483 1.00 0.00 C ATOM 1853 CD2 TYR A 123 12.167 -7.378 -4.919 1.00 0.00 C ATOM 1854 CE1 TYR A 123 9.871 -8.688 -4.129 1.00 0.00 C ATOM 1855 CE2 TYR A 123 12.223 -8.713 -4.568 1.00 0.00 C ATOM 1856 CZ TYR A 123 11.073 -9.363 -4.173 1.00 0.00 C ATOM 1857 OH TYR A 123 11.124 -10.693 -3.823 1.00 0.00 O ATOM 0 H TYR A 123 8.848 -4.443 -3.639 1.00 0.00 H new ATOM 0 HA TYR A 123 11.807 -4.402 -3.492 1.00 0.00 H new ATOM 0 HB2 TYR A 123 10.021 -5.041 -5.872 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.773 -4.978 -5.894 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.881 -6.829 -4.449 1.00 0.00 H new ATOM 0 HD2 TYR A 123 13.070 -6.872 -5.227 1.00 0.00 H new ATOM 0 HE1 TYR A 123 8.972 -9.200 -3.819 1.00 0.00 H new ATOM 0 HE2 TYR A 123 13.162 -9.245 -4.603 1.00 0.00 H new ATOM 0 HH TYR A 123 10.425 -11.185 -4.303 1.00 0.00 H new ATOM 1867 N ALA A 124 12.008 -2.236 -4.792 1.00 0.00 N ATOM 1868 CA ALA A 124 12.094 -0.859 -5.260 1.00 0.00 C ATOM 1869 C ALA A 124 13.080 -0.733 -6.417 1.00 0.00 C ATOM 1870 O ALA A 124 14.289 -0.864 -6.231 1.00 0.00 O ATOM 1871 CB ALA A 124 12.495 0.063 -4.119 1.00 0.00 C ATOM 0 H ALA A 124 12.910 -2.697 -4.670 1.00 0.00 H new ATOM 0 HA ALA A 124 11.110 -0.563 -5.622 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.555 1.088 -4.484 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.751 0.004 -3.325 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.467 -0.241 -3.730 1.00 0.00 H new ATOM 1877 N ASN A 125 12.555 -0.478 -7.611 1.00 0.00 N ATOM 1878 CA ASN A 125 13.390 -0.336 -8.798 1.00 0.00 C ATOM 1879 C ASN A 125 14.218 -1.595 -9.035 1.00 0.00 C ATOM 1880 O ASN A 125 15.332 -1.530 -9.553 1.00 0.00 O ATOM 1881 CB ASN A 125 14.313 0.876 -8.656 1.00 0.00 C ATOM 1882 CG ASN A 125 13.652 2.023 -7.916 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.905 2.806 -8.503 1.00 0.00 O ATOM 1884 ND2 ASN A 125 13.924 2.126 -6.620 1.00 0.00 N ATOM 0 H ASN A 125 11.556 -0.366 -7.782 1.00 0.00 H new ATOM 0 HA ASN A 125 12.735 -0.187 -9.656 1.00 0.00 H new ATOM 0 HB2 ASN A 125 15.218 0.580 -8.127 1.00 0.00 H new ATOM 0 HB3 ASN A 125 14.619 1.214 -9.646 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.508 2.877 -6.070 1.00 0.00 H new ATOM 0 HD22 ASN A 125 14.549 1.454 -6.175 1.00 0.00 H new ATOM 1891 N GLY A 126 13.664 -2.742 -8.652 1.00 0.00 N ATOM 1892 CA GLY A 126 14.364 -4.000 -8.832 1.00 0.00 C ATOM 1893 C GLY A 126 15.382 -4.259 -7.738 1.00 0.00 C ATOM 1894 O GLY A 126 16.465 -4.780 -8.001 1.00 0.00 O ATOM 0 H GLY A 126 12.743 -2.822 -8.220 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.641 -4.815 -8.851 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.867 -3.997 -9.799 1.00 0.00 H new ATOM 1898 N GLN A 127 15.033 -3.891 -6.509 1.00 0.00 N ATOM 1899 CA GLN A 127 15.926 -4.084 -5.373 1.00 0.00 C ATOM 1900 C GLN A 127 15.140 -4.451 -4.119 1.00 0.00 C ATOM 1901 O GLN A 127 14.178 -3.773 -3.755 1.00 0.00 O ATOM 1902 CB GLN A 127 16.747 -2.818 -5.121 1.00 0.00 C ATOM 1903 CG GLN A 127 17.591 -2.393 -6.312 1.00 0.00 C ATOM 1904 CD GLN A 127 18.913 -3.132 -6.385 1.00 0.00 C ATOM 1905 OE1 GLN A 127 19.894 -2.666 -5.620 1.00 0.00 O flip ATOM 1906 NE2 GLN A 127 19.051 -4.110 -7.119 1.00 0.00 N flip ATOM 0 H GLN A 127 14.139 -3.458 -6.275 1.00 0.00 H new ATOM 0 HA GLN A 127 16.602 -4.906 -5.610 1.00 0.00 H new ATOM 0 HB2 GLN A 127 16.072 -2.004 -4.856 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.400 -2.983 -4.264 1.00 0.00 H new ATOM 0 HG2 GLN A 127 17.030 -2.568 -7.230 1.00 0.00 H new ATOM 0 HG3 GLN A 127 17.781 -1.321 -6.254 1.00 0.00 H new ATOM 0 HE21 GLN A 127 18.270 -4.434 -7.690 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.946 -4.597 -7.157 1.00 0.00 H new ATOM 1915 N HIS A 128 15.554 -5.530 -3.461 1.00 0.00 N ATOM 1916 CA HIS A 128 14.888 -5.988 -2.247 1.00 0.00 C ATOM 1917 C HIS A 128 14.916 -4.906 -1.171 1.00 0.00 C ATOM 1918 O HIS A 128 15.960 -4.633 -0.577 1.00 0.00 O ATOM 1919 CB HIS A 128 15.554 -7.261 -1.724 1.00 0.00 C ATOM 1920 CG HIS A 128 14.927 -7.793 -0.472 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.586 -7.838 0.739 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.694 -8.304 -0.247 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.785 -8.355 1.654 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.631 -8.646 1.081 1.00 0.00 N ATOM 0 H HIS A 128 16.347 -6.103 -3.748 1.00 0.00 H new ATOM 0 HA HIS A 128 13.848 -6.205 -2.492 1.00 0.00 H new ATOM 0 HB2 HIS A 128 15.510 -8.028 -2.497 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.608 -7.059 -1.535 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.906 -8.421 -0.977 1.00 0.00 H new ATOM 0 HE1 HIS A 128 15.032 -8.513 2.693 1.00 0.00 H new ATOM 0 HE2 HIS A 128 12.824 -9.058 1.549 1.00 0.00 H new ATOM 1933 N LEU A 129 13.763 -4.293 -0.926 1.00 0.00 N ATOM 1934 CA LEU A 129 13.655 -3.240 0.078 1.00 0.00 C ATOM 1935 C LEU A 129 13.591 -3.832 1.483 1.00 0.00 C ATOM 1936 O LEU A 129 14.503 -3.643 2.289 1.00 0.00 O ATOM 1937 CB LEU A 129 12.414 -2.384 -0.183 1.00 0.00 C ATOM 1938 CG LEU A 129 12.463 -0.952 0.349 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.373 -0.092 -0.515 1.00 0.00 C ATOM 1940 CD2 LEU A 129 11.063 -0.357 0.408 1.00 0.00 C ATOM 0 H LEU A 129 12.890 -4.507 -1.409 1.00 0.00 H new ATOM 0 HA LEU A 129 14.543 -2.612 0.007 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.244 -2.345 -1.259 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.552 -2.885 0.258 1.00 0.00 H new ATOM 0 HG LEU A 129 12.870 -0.974 1.360 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.395 0.924 -0.121 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.381 -0.507 -0.507 1.00 0.00 H new ATOM 0 HD13 LEU A 129 12.996 -0.076 -1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.117 0.663 0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.629 -0.348 -0.592 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.439 -0.959 1.069 1.00 0.00 H new ATOM 1952 N PHE A 130 12.510 -4.550 1.769 1.00 0.00 N ATOM 1953 CA PHE A 130 12.328 -5.170 3.076 1.00 0.00 C ATOM 1954 C PHE A 130 11.197 -6.194 3.039 1.00 0.00 C ATOM 1955 O PHE A 130 10.449 -6.273 2.065 1.00 0.00 O ATOM 1956 CB PHE A 130 12.033 -4.105 4.133 1.00 0.00 C ATOM 1957 CG PHE A 130 10.672 -3.485 3.996 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.531 -4.216 4.284 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.533 -2.171 3.579 1.00 0.00 C ATOM 1960 CE1 PHE A 130 8.277 -3.649 4.160 1.00 0.00 C ATOM 1961 CE2 PHE A 130 9.282 -1.598 3.453 1.00 0.00 C ATOM 1962 CZ PHE A 130 8.152 -2.338 3.742 1.00 0.00 C ATOM 0 H PHE A 130 11.747 -4.717 1.113 1.00 0.00 H new ATOM 0 HA PHE A 130 13.252 -5.685 3.338 1.00 0.00 H new ATOM 0 HB2 PHE A 130 12.121 -4.553 5.123 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.788 -3.322 4.069 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.623 -5.242 4.609 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.413 -1.588 3.350 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.396 -4.230 4.389 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.188 -0.572 3.129 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.173 -1.893 3.641 1.00 0.00 H new ATOM 1972 N ASP A 131 11.080 -6.975 4.107 1.00 0.00 N ATOM 1973 CA ASP A 131 10.040 -7.993 4.199 1.00 0.00 C ATOM 1974 C ASP A 131 9.062 -7.672 5.324 1.00 0.00 C ATOM 1975 O ASP A 131 9.431 -7.059 6.326 1.00 0.00 O ATOM 1976 CB ASP A 131 10.665 -9.371 4.427 1.00 0.00 C ATOM 1977 CG ASP A 131 11.466 -9.437 5.713 1.00 0.00 C ATOM 1978 OD1 ASP A 131 10.922 -9.060 6.772 1.00 0.00 O ATOM 1979 OD2 ASP A 131 12.637 -9.867 5.660 1.00 0.00 O ATOM 0 H ASP A 131 11.692 -6.923 4.921 1.00 0.00 H new ATOM 0 HA ASP A 131 9.491 -8.002 3.257 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.878 -10.124 4.454 1.00 0.00 H new ATOM 0 HB3 ASP A 131 11.313 -9.617 3.586 1.00 0.00 H new ATOM 1984 N PHE A 132 7.812 -8.088 5.151 1.00 0.00 N ATOM 1985 CA PHE A 132 6.779 -7.843 6.152 1.00 0.00 C ATOM 1986 C PHE A 132 6.236 -9.156 6.706 1.00 0.00 C ATOM 1987 O PHE A 132 5.513 -9.880 6.021 1.00 0.00 O ATOM 1988 CB PHE A 132 5.639 -7.021 5.547 1.00 0.00 C ATOM 1989 CG PHE A 132 4.282 -7.412 6.058 1.00 0.00 C ATOM 1990 CD1 PHE A 132 4.033 -7.480 7.419 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.255 -7.710 5.177 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.785 -7.841 7.892 1.00 0.00 C ATOM 1993 CE2 PHE A 132 2.005 -8.071 5.644 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.769 -8.135 7.003 1.00 0.00 C ATOM 0 H PHE A 132 7.489 -8.596 4.328 1.00 0.00 H new ATOM 0 HA PHE A 132 7.228 -7.282 6.972 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.809 -5.966 5.761 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.656 -7.133 4.463 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.823 -7.248 8.118 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.433 -7.660 4.113 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.604 -7.893 8.956 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.214 -8.303 4.947 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.792 -8.414 7.370 1.00 0.00 H new ATOM 2004 N ALA A 133 6.589 -9.457 7.951 1.00 0.00 N ATOM 2005 CA ALA A 133 6.137 -10.682 8.599 1.00 0.00 C ATOM 2006 C ALA A 133 4.620 -10.693 8.753 1.00 0.00 C ATOM 2007 O ALA A 133 4.020 -9.697 9.158 1.00 0.00 O ATOM 2008 CB ALA A 133 6.808 -10.841 9.955 1.00 0.00 C ATOM 0 H ALA A 133 7.187 -8.869 8.531 1.00 0.00 H new ATOM 0 HA ALA A 133 6.419 -11.524 7.966 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.461 -11.760 10.427 1.00 0.00 H new ATOM 0 HB2 ALA A 133 7.889 -10.887 9.823 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.556 -9.990 10.588 1.00 0.00 H new ATOM 2014 N HIS A 134 4.005 -11.826 8.427 1.00 0.00 N ATOM 2015 CA HIS A 134 2.557 -11.966 8.530 1.00 0.00 C ATOM 2016 C HIS A 134 2.099 -11.829 9.979 1.00 0.00 C ATOM 2017 O HIS A 134 2.313 -12.726 10.794 1.00 0.00 O ATOM 2018 CB HIS A 134 2.113 -13.317 7.968 1.00 0.00 C ATOM 2019 CG HIS A 134 2.237 -13.416 6.478 1.00 0.00 C ATOM 2020 ND1 HIS A 134 2.722 -14.407 5.694 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.835 -12.413 5.621 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.605 -13.989 4.391 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 2.067 -12.783 4.375 1.00 0.00 N flip ATOM 0 H HIS A 134 4.487 -12.659 8.090 1.00 0.00 H new ATOM 0 HA HIS A 134 2.097 -11.169 7.946 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.709 -14.106 8.427 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.076 -13.496 8.251 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.399 -11.472 5.922 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.904 -14.555 3.521 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.865 -12.231 3.541 1.00 0.00 H new ATOM 2032 N ARG A 135 1.468 -10.702 10.291 1.00 0.00 N ATOM 2033 CA ARG A 135 0.982 -10.447 11.642 1.00 0.00 C ATOM 2034 C ARG A 135 -0.443 -10.964 11.813 1.00 0.00 C ATOM 2035 O ARG A 135 -0.749 -11.664 12.780 1.00 0.00 O ATOM 2036 CB ARG A 135 1.033 -8.950 11.951 1.00 0.00 C ATOM 2037 CG ARG A 135 2.441 -8.420 12.166 1.00 0.00 C ATOM 2038 CD ARG A 135 2.430 -7.090 12.904 1.00 0.00 C ATOM 2039 NE ARG A 135 3.772 -6.670 13.298 1.00 0.00 N ATOM 2040 CZ ARG A 135 4.446 -7.213 14.306 1.00 0.00 C ATOM 2041 NH1 ARG A 135 3.905 -8.191 15.019 1.00 0.00 N ATOM 2042 NH2 ARG A 135 5.663 -6.777 14.603 1.00 0.00 N ATOM 0 H ARG A 135 1.281 -9.951 9.627 1.00 0.00 H new ATOM 0 HA ARG A 135 1.629 -10.977 12.340 1.00 0.00 H new ATOM 0 HB2 ARG A 135 0.569 -8.402 11.131 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.439 -8.751 12.843 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.022 -9.147 12.733 1.00 0.00 H new ATOM 0 HG3 ARG A 135 2.936 -8.299 11.203 1.00 0.00 H new ATOM 0 HD2 ARG A 135 1.984 -6.326 12.267 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.801 -7.173 13.791 1.00 0.00 H new ATOM 0 HE ARG A 135 4.216 -5.919 12.770 1.00 0.00 H new ATOM 0 HH11 ARG A 135 2.969 -8.528 14.794 1.00 0.00 H new ATOM 0 HH12 ARG A 135 4.425 -8.606 15.792 1.00 0.00 H new ATOM 0 HH21 ARG A 135 6.082 -6.024 14.057 1.00 0.00 H new ATOM 0 HH22 ARG A 135 6.180 -7.195 15.377 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.311 -10.616 10.870 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.704 -11.044 10.916 1.00 0.00 C ATOM 2058 C LEU A 136 -2.906 -12.329 10.120 1.00 0.00 C ATOM 2059 O LEU A 136 -2.842 -12.326 8.890 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.615 -9.944 10.369 1.00 0.00 C ATOM 2061 CG LEU A 136 -5.099 -10.295 10.256 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.792 -10.123 11.599 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.771 -9.438 9.194 1.00 0.00 C ATOM 0 H LEU A 136 -1.074 -10.038 10.064 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.964 -11.238 11.957 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.517 -9.067 11.010 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.254 -9.659 9.381 1.00 0.00 H new ATOM 0 HG LEU A 136 -5.183 -11.340 9.958 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.847 -10.377 11.499 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.328 -10.780 12.335 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.698 -9.088 11.927 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.826 -9.702 9.128 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.676 -8.386 9.462 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.293 -9.611 8.230 1.00 0.00 H new ATOM 2075 N SER A 137 -3.151 -13.427 10.829 1.00 0.00 N ATOM 2076 CA SER A 137 -3.360 -14.720 10.188 1.00 0.00 C ATOM 2077 C SER A 137 -4.404 -14.615 9.080 1.00 0.00 C ATOM 2078 O SER A 137 -4.322 -15.308 8.067 1.00 0.00 O ATOM 2079 CB SER A 137 -3.800 -15.759 11.221 1.00 0.00 C ATOM 2080 OG SER A 137 -4.315 -16.919 10.590 1.00 0.00 O ATOM 0 H SER A 137 -3.210 -13.447 11.847 1.00 0.00 H new ATOM 0 HA SER A 137 -2.415 -15.035 9.745 1.00 0.00 H new ATOM 0 HB2 SER A 137 -2.954 -16.030 11.852 1.00 0.00 H new ATOM 0 HB3 SER A 137 -4.560 -15.329 11.874 1.00 0.00 H new ATOM 0 HG SER A 137 -4.588 -17.568 11.271 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.385 -13.741 9.281 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.444 -13.543 8.300 1.00 0.00 C ATOM 2088 C ALA A 138 -6.041 -12.504 7.259 1.00 0.00 C ATOM 2089 O ALA A 138 -6.879 -11.754 6.759 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.734 -13.127 8.992 1.00 0.00 C ATOM 0 H ALA A 138 -5.468 -13.159 10.115 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.610 -14.489 7.785 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.516 -12.983 8.247 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -8.039 -13.905 9.692 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.572 -12.195 9.533 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.752 -12.464 6.939 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.237 -11.514 5.959 1.00 0.00 C ATOM 2098 C PHE A 139 -5.054 -11.565 4.671 1.00 0.00 C ATOM 2099 O PHE A 139 -5.206 -10.558 3.981 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.767 -11.810 5.655 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.569 -12.950 4.698 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -2.826 -14.254 5.091 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -2.126 -12.718 3.406 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.646 -15.305 4.212 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -1.944 -13.766 2.523 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.203 -15.061 2.927 1.00 0.00 C ATOM 0 H PHE A 139 -4.045 -13.078 7.344 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.320 -10.513 6.382 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.303 -10.915 5.242 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.250 -12.036 6.588 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -3.171 -14.451 6.095 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -1.921 -11.707 3.085 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.852 -16.317 4.530 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.600 -13.572 1.518 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.059 -15.881 2.239 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.576 -12.746 4.355 1.00 0.00 N ATOM 2117 CA GLN A 140 -6.376 -12.929 3.149 1.00 0.00 C ATOM 2118 C GLN A 140 -7.554 -11.961 3.126 1.00 0.00 C ATOM 2119 O GLN A 140 -7.821 -11.317 2.111 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.882 -14.369 3.062 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.619 -14.832 4.309 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.480 -16.322 4.549 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -7.824 -17.136 3.691 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -6.973 -16.689 5.721 1.00 0.00 N ATOM 0 H GLN A 140 -5.460 -13.590 4.916 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.742 -12.722 2.287 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.546 -14.460 2.203 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -6.036 -15.032 2.883 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -7.236 -14.291 5.175 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.675 -14.580 4.217 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.701 -15.981 6.403 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.856 -17.679 5.939 1.00 0.00 H new ATOM 2133 N ARG A 141 -8.255 -11.862 4.251 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.406 -10.974 4.358 1.00 0.00 C ATOM 2135 C ARG A 141 -9.077 -9.589 3.808 1.00 0.00 C ATOM 2136 O ARG A 141 -9.869 -8.996 3.076 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.855 -10.861 5.816 1.00 0.00 C ATOM 2138 CG ARG A 141 -10.183 -12.200 6.458 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.764 -12.022 7.852 1.00 0.00 C ATOM 2140 NE ARG A 141 -11.623 -13.140 8.233 1.00 0.00 N ATOM 2141 CZ ARG A 141 -12.814 -13.370 7.692 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -13.285 -12.564 6.750 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -13.537 -14.409 8.092 1.00 0.00 N ATOM 0 H ARG A 141 -8.046 -12.386 5.101 1.00 0.00 H new ATOM 0 HA ARG A 141 -10.217 -11.398 3.766 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -9.069 -10.374 6.393 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.733 -10.218 5.868 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.894 -12.740 5.833 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -9.281 -12.809 6.514 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -9.953 -11.926 8.573 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -11.336 -11.095 7.891 1.00 0.00 H new ATOM 0 HE ARG A 141 -11.290 -13.780 8.954 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -12.732 -11.765 6.439 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -14.200 -12.743 6.336 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -13.178 -15.032 8.816 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -14.452 -14.584 7.676 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.903 -9.079 4.167 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.469 -7.765 3.709 1.00 0.00 C ATOM 2159 C VAL A 142 -7.772 -7.571 2.227 1.00 0.00 C ATOM 2160 O VAL A 142 -7.074 -8.104 1.365 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.960 -7.559 3.943 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.521 -6.196 3.431 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.625 -7.716 5.419 1.00 0.00 C ATOM 0 H VAL A 142 -7.236 -9.556 4.773 1.00 0.00 H new ATOM 0 HA VAL A 142 -8.024 -7.029 4.290 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.416 -8.322 3.386 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.453 -6.069 3.605 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.726 -6.125 2.363 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -6.070 -5.415 3.958 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.555 -7.567 5.567 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.178 -6.976 5.998 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.902 -8.717 5.750 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.819 -6.804 1.939 1.00 0.00 N ATOM 2174 CA ASP A 143 -9.215 -6.538 0.561 1.00 0.00 C ATOM 2175 C ASP A 143 -9.365 -5.039 0.319 1.00 0.00 C ATOM 2176 O ASP A 143 -10.187 -4.609 -0.491 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.528 -7.253 0.238 1.00 0.00 C ATOM 2178 CG ASP A 143 -10.494 -8.722 0.613 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -9.382 -9.279 0.733 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -11.579 -9.315 0.786 1.00 0.00 O ATOM 0 H ASP A 143 -9.408 -6.356 2.641 1.00 0.00 H new ATOM 0 HA ASP A 143 -8.432 -6.918 -0.096 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -11.345 -6.764 0.769 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -10.738 -7.158 -0.827 1.00 0.00 H new ATOM 2185 N THR A 144 -8.566 -4.247 1.027 1.00 0.00 N ATOM 2186 CA THR A 144 -8.611 -2.797 0.891 1.00 0.00 C ATOM 2187 C THR A 144 -7.214 -2.193 0.982 1.00 0.00 C ATOM 2188 O THR A 144 -6.504 -2.391 1.969 1.00 0.00 O ATOM 2189 CB THR A 144 -9.505 -2.159 1.971 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.764 -2.840 2.030 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.735 -0.684 1.681 1.00 0.00 C ATOM 0 H THR A 144 -7.879 -4.586 1.701 1.00 0.00 H new ATOM 0 HA THR A 144 -9.033 -2.584 -0.091 1.00 0.00 H new ATOM 0 HB THR A 144 -8.997 -2.250 2.931 1.00 0.00 H new ATOM 0 HG1 THR A 144 -11.483 -2.187 2.158 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.369 -0.255 2.457 1.00 0.00 H new ATOM 0 HG22 THR A 144 -8.778 -0.163 1.665 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.223 -0.575 0.713 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.826 -1.454 -0.051 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.514 -0.819 -0.088 1.00 0.00 C ATOM 2201 C LEU A 145 -5.645 0.696 -0.204 1.00 0.00 C ATOM 2202 O LEU A 145 -6.008 1.218 -1.257 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.694 -1.363 -1.259 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.610 -0.435 -1.808 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.426 -0.376 -0.855 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -3.164 -0.894 -3.189 1.00 0.00 C ATOM 0 H LEU A 145 -7.402 -1.280 -0.875 1.00 0.00 H new ATOM 0 HA LEU A 145 -5.000 -1.050 0.845 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -4.222 -2.294 -0.945 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.378 -1.611 -2.071 1.00 0.00 H new ATOM 0 HG LEU A 145 -4.028 0.568 -1.898 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.664 0.289 -1.262 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.757 0.000 0.113 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -2.007 -1.375 -0.732 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.392 -0.222 -3.564 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.764 -1.906 -3.124 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -4.016 -0.883 -3.869 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.344 1.397 0.885 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.427 2.852 0.904 1.00 0.00 C ATOM 2220 C GLU A 146 -4.037 3.476 0.992 1.00 0.00 C ATOM 2221 O GLU A 146 -3.107 2.871 1.524 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.284 3.321 2.082 1.00 0.00 C ATOM 2223 CG GLU A 146 -6.052 2.528 3.357 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.547 3.253 4.593 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -6.533 4.502 4.593 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -6.948 2.572 5.560 1.00 0.00 O ATOM 0 H GLU A 146 -5.041 0.980 1.765 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.893 3.175 -0.027 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.076 4.373 2.276 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.336 3.250 1.806 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.557 1.565 3.279 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.987 2.322 3.463 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.905 4.688 0.464 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.630 5.394 0.483 1.00 0.00 C ATOM 2235 C ILE A 147 -2.825 6.875 0.788 1.00 0.00 C ATOM 2236 O ILE A 147 -3.398 7.613 -0.013 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.887 5.251 -0.859 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.656 3.774 -1.184 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.565 6.003 -0.815 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.532 3.494 -2.665 1.00 0.00 C ATOM 0 H ILE A 147 -4.665 5.201 0.018 1.00 0.00 H new ATOM 0 HA ILE A 147 -2.030 4.940 1.272 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.503 5.685 -1.647 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.749 3.437 -0.682 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.481 3.188 -0.779 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -0.052 5.893 -1.770 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.754 7.060 -0.624 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.059 5.596 -0.019 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.370 2.428 -2.821 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.448 3.800 -3.171 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.689 4.053 -3.072 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.345 7.303 1.951 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.466 8.697 2.362 1.00 0.00 C ATOM 2254 C GLN A 148 -1.097 9.295 2.670 1.00 0.00 C ATOM 2255 O GLN A 148 -0.094 8.584 2.715 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.374 8.813 3.587 1.00 0.00 C ATOM 2257 CG GLN A 148 -3.108 7.752 4.643 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.923 6.493 4.423 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -3.251 5.411 4.047 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -5.143 6.492 4.589 1.00 0.00 N flip ATOM 0 H GLN A 148 -1.869 6.704 2.626 1.00 0.00 H new ATOM 0 HA GLN A 148 -2.908 9.255 1.537 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.244 9.799 4.033 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.413 8.743 3.267 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -2.048 7.499 4.640 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.335 8.160 5.628 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.619 7.346 4.878 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.678 5.637 4.437 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.064 10.607 2.881 1.00 0.00 N ATOM 2270 CA GLY A 149 0.187 11.279 3.181 1.00 0.00 C ATOM 2271 C GLY A 149 0.618 12.223 2.077 1.00 0.00 C ATOM 2272 O GLY A 149 -0.219 12.814 1.395 1.00 0.00 O ATOM 0 H GLY A 149 -1.881 11.217 2.850 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.082 11.837 4.111 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.966 10.534 3.342 1.00 0.00 H new ATOM 2276 N ASP A 150 1.927 12.368 1.902 1.00 0.00 N ATOM 2277 CA ASP A 150 2.467 13.249 0.873 1.00 0.00 C ATOM 2278 C ASP A 150 3.151 12.444 -0.228 1.00 0.00 C ATOM 2279 O ASP A 150 4.352 12.178 -0.163 1.00 0.00 O ATOM 2280 CB ASP A 150 3.458 14.239 1.488 1.00 0.00 C ATOM 2281 CG ASP A 150 2.892 14.943 2.706 1.00 0.00 C ATOM 2282 OD1 ASP A 150 1.714 15.355 2.658 1.00 0.00 O ATOM 2283 OD2 ASP A 150 3.627 15.082 3.706 1.00 0.00 O ATOM 0 H ASP A 150 2.633 11.887 2.459 1.00 0.00 H new ATOM 0 HA ASP A 150 1.638 13.803 0.432 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.369 13.710 1.768 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.737 14.981 0.740 1.00 0.00 H new ATOM 2288 N VAL A 151 2.379 12.056 -1.237 1.00 0.00 N ATOM 2289 CA VAL A 151 2.910 11.281 -2.352 1.00 0.00 C ATOM 2290 C VAL A 151 2.162 11.593 -3.644 1.00 0.00 C ATOM 2291 O VAL A 151 1.008 12.022 -3.619 1.00 0.00 O ATOM 2292 CB VAL A 151 2.824 9.768 -2.075 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.384 9.354 -1.810 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.408 8.980 -3.238 1.00 0.00 C ATOM 0 H VAL A 151 1.383 12.266 -1.306 1.00 0.00 H new ATOM 0 HA VAL A 151 3.957 11.564 -2.464 1.00 0.00 H new ATOM 0 HB VAL A 151 3.411 9.546 -1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.343 8.282 -1.616 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.004 9.894 -0.943 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.772 9.589 -2.681 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.339 7.913 -3.026 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.850 9.206 -4.147 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.453 9.256 -3.376 1.00 0.00 H new ATOM 2304 N THR A 152 2.828 11.374 -4.774 1.00 0.00 N ATOM 2305 CA THR A 152 2.228 11.632 -6.077 1.00 0.00 C ATOM 2306 C THR A 152 2.084 10.345 -6.881 1.00 0.00 C ATOM 2307 O THR A 152 3.017 9.920 -7.563 1.00 0.00 O ATOM 2308 CB THR A 152 3.061 12.641 -6.889 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.375 13.781 -6.081 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.309 13.087 -8.134 1.00 0.00 C ATOM 0 H THR A 152 3.783 11.019 -4.813 1.00 0.00 H new ATOM 0 HA THR A 152 1.240 12.054 -5.892 1.00 0.00 H new ATOM 0 HB THR A 152 3.984 12.150 -7.198 1.00 0.00 H new ATOM 0 HG1 THR A 152 3.906 14.417 -6.605 1.00 0.00 H new ATOM 0 HG21 THR A 152 2.918 13.799 -8.691 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.098 12.221 -8.762 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.371 13.561 -7.843 1.00 0.00 H new ATOM 2318 N LEU A 153 0.910 9.729 -6.797 1.00 0.00 N ATOM 2319 CA LEU A 153 0.643 8.489 -7.518 1.00 0.00 C ATOM 2320 C LEU A 153 0.405 8.762 -9.000 1.00 0.00 C ATOM 2321 O LEU A 153 -0.251 9.738 -9.364 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.570 7.778 -6.917 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.448 7.366 -5.449 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.785 6.871 -4.921 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.622 6.297 -5.283 1.00 0.00 C ATOM 0 H LEU A 153 0.128 10.068 -6.237 1.00 0.00 H new ATOM 0 HA LEU A 153 1.518 7.846 -7.422 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.436 8.431 -7.019 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.772 6.885 -7.508 1.00 0.00 H new ATOM 0 HG LEU A 153 -0.153 8.240 -4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.679 6.582 -3.875 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.526 7.666 -5.005 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.110 6.009 -5.504 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.695 6.016 -4.232 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.357 5.421 -5.875 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.582 6.687 -5.622 1.00 0.00 H new ATOM 2337 N SER A 154 0.940 7.891 -9.850 1.00 0.00 N ATOM 2338 CA SER A 154 0.787 8.039 -11.292 1.00 0.00 C ATOM 2339 C SER A 154 0.256 6.752 -11.917 1.00 0.00 C ATOM 2340 O SER A 154 -0.523 6.787 -12.869 1.00 0.00 O ATOM 2341 CB SER A 154 2.125 8.416 -11.933 1.00 0.00 C ATOM 2342 OG SER A 154 2.590 9.662 -11.445 1.00 0.00 O ATOM 0 H SER A 154 1.483 7.076 -9.565 1.00 0.00 H new ATOM 0 HA SER A 154 0.067 8.836 -11.476 1.00 0.00 H new ATOM 0 HB2 SER A 154 2.863 7.642 -11.724 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.012 8.465 -13.016 1.00 0.00 H new ATOM 0 HG SER A 154 3.447 9.880 -11.868 1.00 0.00 H new ATOM 2348 N TYR A 155 0.683 5.618 -11.373 1.00 0.00 N ATOM 2349 CA TYR A 155 0.254 4.319 -11.877 1.00 0.00 C ATOM 2350 C TYR A 155 0.158 3.300 -10.746 1.00 0.00 C ATOM 2351 O TYR A 155 1.120 3.080 -10.010 1.00 0.00 O ATOM 2352 CB TYR A 155 1.224 3.818 -12.948 1.00 0.00 C ATOM 2353 CG TYR A 155 0.799 2.515 -13.588 1.00 0.00 C ATOM 2354 CD1 TYR A 155 1.061 1.298 -12.971 1.00 0.00 C ATOM 2355 CD2 TYR A 155 0.136 2.502 -14.809 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.676 0.106 -13.552 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.254 1.314 -15.397 1.00 0.00 C ATOM 2358 CZ TYR A 155 0.018 0.119 -14.765 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.368 -1.067 -15.346 1.00 0.00 O ATOM 0 H TYR A 155 1.326 5.572 -10.583 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.735 4.439 -12.319 1.00 0.00 H new ATOM 0 HB2 TYR A 155 1.321 4.579 -13.723 1.00 0.00 H new ATOM 0 HB3 TYR A 155 2.210 3.689 -12.502 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.574 1.284 -12.021 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.078 3.436 -15.307 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.889 -0.831 -13.060 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -0.769 1.321 -16.346 1.00 0.00 H new ATOM 0 HH TYR A 155 -0.820 -0.883 -16.196 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.011 2.681 -10.614 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.234 1.683 -9.574 1.00 0.00 C ATOM 2371 C VAL A 156 -2.035 0.502 -10.109 1.00 0.00 C ATOM 2372 O VAL A 156 -3.240 0.608 -10.334 1.00 0.00 O ATOM 2373 CB VAL A 156 -1.976 2.288 -8.366 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.361 1.199 -7.377 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.121 3.352 -7.695 1.00 0.00 C ATOM 0 H VAL A 156 -1.818 2.853 -11.214 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.252 1.336 -9.252 1.00 0.00 H new ATOM 0 HB VAL A 156 -2.891 2.762 -8.722 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -2.884 1.644 -6.531 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.014 0.476 -7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.462 0.694 -7.023 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.660 3.769 -6.844 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.188 2.905 -7.350 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -0.901 4.146 -8.409 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.357 -0.624 -10.309 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.007 -1.826 -10.817 1.00 0.00 C ATOM 2387 C GLN A 157 -1.883 -2.974 -9.822 1.00 0.00 C ATOM 2388 O GLN A 157 -0.845 -3.145 -9.182 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.396 -2.232 -12.160 1.00 0.00 C ATOM 2390 CG GLN A 157 -1.774 -3.636 -12.601 1.00 0.00 C ATOM 2391 CD GLN A 157 -1.643 -3.834 -14.098 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -0.555 -4.107 -14.607 1.00 0.00 O ATOM 2393 NE2 GLN A 157 -2.753 -3.696 -14.814 1.00 0.00 N ATOM 0 H GLN A 157 -0.359 -0.729 -10.127 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.065 -1.605 -10.958 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -1.714 -1.522 -12.924 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.310 -2.162 -12.092 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.139 -4.357 -12.086 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -2.801 -3.843 -12.300 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -3.633 -3.469 -14.351 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -2.725 -3.817 -15.826 1.00 0.00 H new ATOM 2402 N ILE A 158 -2.949 -3.758 -9.695 1.00 0.00 N ATOM 2403 CA ILE A 158 -2.959 -4.891 -8.777 1.00 0.00 C ATOM 2404 C ILE A 158 -2.955 -6.213 -9.536 1.00 0.00 C ATOM 2405 O ILE A 158 -4.001 -6.693 -9.973 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.184 -4.850 -7.845 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.215 -3.535 -7.064 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.167 -6.037 -6.894 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.612 -3.067 -6.722 1.00 0.00 C ATOM 0 H ILE A 158 -3.816 -3.629 -10.216 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.053 -4.818 -8.175 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.086 -4.910 -8.454 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.645 -3.656 -6.143 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -3.715 -2.763 -7.649 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.039 -5.993 -6.242 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.189 -6.963 -7.468 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.260 -6.006 -6.290 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.556 -2.129 -6.169 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.179 -2.914 -7.640 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.109 -3.820 -6.110 1.00 0.00 H new ATOM 2421 N SER A 159 -1.771 -6.799 -9.687 1.00 0.00 N ATOM 2422 CA SER A 159 -1.630 -8.066 -10.395 1.00 0.00 C ATOM 2423 C SER A 159 -2.695 -9.061 -9.945 1.00 0.00 C ATOM 2424 O SER A 159 -3.045 -9.123 -8.767 1.00 0.00 O ATOM 2425 CB SER A 159 -0.237 -8.653 -10.161 1.00 0.00 C ATOM 2426 OG SER A 159 -0.099 -9.910 -10.800 1.00 0.00 O ATOM 0 H SER A 159 -0.896 -6.417 -9.329 1.00 0.00 H new ATOM 0 HA SER A 159 -1.762 -7.875 -11.460 1.00 0.00 H new ATOM 0 HB2 SER A 159 0.519 -7.965 -10.539 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.061 -8.764 -9.091 1.00 0.00 H new ATOM 0 HG SER A 159 0.800 -10.263 -10.637 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.209 -9.839 -10.894 1.00 0.00 N ATOM 2433 CA GLY A 160 -4.229 -10.820 -10.577 1.00 0.00 C ATOM 2434 C GLY A 160 -3.643 -12.173 -10.223 1.00 0.00 C ATOM 2435 O GLY A 160 -2.428 -12.375 -10.257 1.00 0.00 O ATOM 0 H GLY A 160 -2.936 -9.806 -11.876 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -4.830 -10.458 -9.743 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -4.900 -10.930 -11.429 1.00 0.00 H new ATOM 2439 N PRO A 161 -4.516 -13.128 -9.872 1.00 0.00 N ATOM 2440 CA PRO A 161 -4.101 -14.484 -9.502 1.00 0.00 C ATOM 2441 C PRO A 161 -3.569 -15.272 -10.694 1.00 0.00 C ATOM 2442 O PRO A 161 -2.889 -16.285 -10.527 1.00 0.00 O ATOM 2443 CB PRO A 161 -5.390 -15.118 -8.974 1.00 0.00 C ATOM 2444 CG PRO A 161 -6.486 -14.363 -9.643 1.00 0.00 C ATOM 2445 CD PRO A 161 -5.978 -12.957 -9.809 1.00 0.00 C ATOM 0 HA PRO A 161 -3.286 -14.478 -8.778 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -5.436 -16.180 -9.215 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -5.457 -15.034 -7.889 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -6.732 -14.806 -10.608 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -7.396 -14.381 -9.043 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -6.368 -12.493 -10.715 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -6.273 -12.322 -8.974 1.00 0.00 H new ATOM 2453 N SER A 162 -3.881 -14.801 -11.897 1.00 0.00 N ATOM 2454 CA SER A 162 -3.437 -15.464 -13.117 1.00 0.00 C ATOM 2455 C SER A 162 -2.838 -14.457 -14.095 1.00 0.00 C ATOM 2456 O SER A 162 -3.413 -13.397 -14.341 1.00 0.00 O ATOM 2457 CB SER A 162 -4.604 -16.201 -13.776 1.00 0.00 C ATOM 2458 OG SER A 162 -5.212 -17.106 -12.871 1.00 0.00 O ATOM 0 H SER A 162 -4.440 -13.962 -12.053 1.00 0.00 H new ATOM 0 HA SER A 162 -2.666 -16.187 -12.849 1.00 0.00 H new ATOM 0 HB2 SER A 162 -5.343 -15.480 -14.125 1.00 0.00 H new ATOM 0 HB3 SER A 162 -4.248 -16.742 -14.652 1.00 0.00 H new ATOM 0 HG SER A 162 -5.956 -17.563 -13.316 1.00 0.00 H new ATOM 2464 N SER A 163 -1.679 -14.798 -14.650 1.00 0.00 N ATOM 2465 CA SER A 163 -1.000 -13.924 -15.599 1.00 0.00 C ATOM 2466 C SER A 163 -0.541 -14.706 -16.826 1.00 0.00 C ATOM 2467 O SER A 163 0.055 -15.776 -16.707 1.00 0.00 O ATOM 2468 CB SER A 163 0.200 -13.248 -14.933 1.00 0.00 C ATOM 2469 OG SER A 163 0.794 -12.295 -15.797 1.00 0.00 O ATOM 0 H SER A 163 -1.191 -15.673 -14.459 1.00 0.00 H new ATOM 0 HA SER A 163 -1.707 -13.159 -15.921 1.00 0.00 H new ATOM 0 HB2 SER A 163 -0.119 -12.759 -14.012 1.00 0.00 H new ATOM 0 HB3 SER A 163 0.938 -14.001 -14.655 1.00 0.00 H new ATOM 0 HG SER A 163 1.557 -11.876 -15.347 1.00 0.00 H new ATOM 2475 N GLY A 164 -0.824 -14.163 -18.006 1.00 0.00 N ATOM 2476 CA GLY A 164 -0.434 -14.822 -19.239 1.00 0.00 C ATOM 2477 C GLY A 164 -0.916 -14.081 -20.470 1.00 0.00 C ATOM 2478 O GLY A 164 -1.819 -14.544 -21.167 1.00 0.00 O ATOM 0 H GLY A 164 -1.316 -13.278 -18.130 1.00 0.00 H new ATOM 0 HA2 GLY A 164 0.652 -14.909 -19.273 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -0.835 -15.835 -19.248 1.00 0.00 H new TER 2482 GLY A 164