USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 86 SER OG : rot -95:sc= 0.872 USER MOD Set 1.2: A 108 ASN : amide:sc= -1.22! C(o=-0.35!,f=-3.3!) USER MOD Set 2.1: A 89 HIS : no HE2:sc= -2.94! K(o=-2.3!,f=-3.1) USER MOD Set 2.2: A 110 THR OG1 : rot -5:sc= 0.624 USER MOD Set 3.1: A 65 GLN : amide:sc= -0.352 X(o=-0.35,f=-0.68) USER MOD Set 3.2: A 68 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 36 SER OG : rot 132:sc= 1.21 USER MOD Set 4.2: A 123 GLN : amide:sc= 0.555 K(o=1.8,f=-0.79) USER MOD Set 5.1: A 26 MET CE :methyl -111:sc= -0.558 (180deg=-1.82) USER MOD Set 5.2: A 129 GLN : amide:sc= -0.122 K(o=-0.68,f=-7!) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.11 (180deg=-0.426) USER MOD Single : A 1 MET N :NH3+ 160:sc= -0.0745 (180deg=-0.534) USER MOD Single : A 2 SER OG : rot 180:sc= 0.0127 USER MOD Single : A 4 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 5 ASN : amide:sc=-0.00448 X(o=-0.0045,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0.00394 X(o=0.0039,f=0) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -165:sc= 1.23 (180deg=0.706) USER MOD Single : A 28 SER OG : rot 180:sc= 0.0222 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 80:sc= 1.03 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= 0.0252! X(o=0.025!,f=-0.076) USER MOD Single : A 46 SER OG : rot -140:sc= -0.121 USER MOD Single : A 52 LYS NZ :NH3+ -168:sc= -0.025 (180deg=-0.168) USER MOD Single : A 56 ASN : amide:sc= -2.4 K(o=-2.4,f=-5.5!) USER MOD Single : A 67 THR OG1 : rot 180:sc= -0.0451 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 HIS : no HE2:sc= 0.858 K(o=0.86,f=-5.7!) USER MOD Single : A 76 SER OG : rot 170:sc= 0 USER MOD Single : A 84 THR OG1 : rot 81:sc= 0.822 USER MOD Single : A 95 ASN : amide:sc= -0.09 X(o=-0.09,f=-0.58) USER MOD Single : A 106 SER OG : rot 153:sc= 0.822 USER MOD Single : A 111 TYR OH : rot 180:sc= -0.0145 USER MOD Single : A 113 ASN : amide:sc= 1.47 K(o=1.5,f=-0.031) USER MOD Single : A 118 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 GLN : amide:sc= -0.008 K(o=-0.008,f=-0.85) USER MOD Single : A 122 MET CE :methyl -159:sc= -2.81! (180deg=-4.07) USER MOD Single : A 124 THR OG1 : rot 45:sc= 0.141 USER MOD Single : A 132 LYS NZ :NH3+ -164:sc= -0.0333 (180deg=-0.24) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 21.056 -11.453 6.255 1.00 11.00 N ATOM 2 CA MET A 1 21.203 -11.002 4.869 1.00 43.05 C ATOM 3 C MET A 1 20.785 -9.550 4.749 1.00 62.53 C ATOM 4 O MET A 1 20.370 -9.089 3.669 1.00 1.14 O ATOM 5 CB MET A 1 20.387 -11.893 3.913 1.00 23.24 C ATOM 6 CG MET A 1 18.884 -11.921 4.152 1.00 2.24 C ATOM 7 SD MET A 1 18.033 -13.084 3.054 1.00 1.24 S ATOM 8 CE MET A 1 18.385 -12.382 1.436 1.00 24.24 C ATOM 0 H1 MET A 1 21.010 -12.492 6.279 1.00 11.00 H new ATOM 0 H2 MET A 1 21.871 -11.129 6.814 1.00 11.00 H new ATOM 0 H3 MET A 1 20.182 -11.059 6.657 1.00 11.00 H new ATOM 0 HA MET A 1 22.252 -11.085 4.584 1.00 43.05 H new ATOM 0 HB2 MET A 1 20.567 -11.557 2.892 1.00 23.24 H new ATOM 0 HB3 MET A 1 20.766 -12.912 3.985 1.00 23.24 H new ATOM 0 HG2 MET A 1 18.689 -12.195 5.189 1.00 2.24 H new ATOM 0 HG3 MET A 1 18.476 -10.921 4.004 1.00 2.24 H new ATOM 0 HE1 MET A 1 17.707 -12.811 0.698 1.00 24.24 H new ATOM 0 HE2 MET A 1 18.248 -11.301 1.471 1.00 24.24 H new ATOM 0 HE3 MET A 1 19.414 -12.608 1.157 1.00 24.24 H new ATOM 20 N SER A 2 20.954 -8.827 5.836 1.00 64.31 N ATOM 21 CA SER A 2 20.561 -7.456 5.950 1.00 23.31 C ATOM 22 C SER A 2 21.348 -6.568 4.975 1.00 73.40 C ATOM 23 O SER A 2 22.587 -6.617 4.920 1.00 21.24 O ATOM 24 CB SER A 2 20.804 -7.040 7.389 1.00 1.53 C ATOM 25 OG SER A 2 20.244 -8.020 8.268 1.00 11.51 O ATOM 0 H SER A 2 21.382 -9.197 6.685 1.00 64.31 H new ATOM 0 HA SER A 2 19.509 -7.338 5.690 1.00 23.31 H new ATOM 0 HB2 SER A 2 21.873 -6.938 7.574 1.00 1.53 H new ATOM 0 HB3 SER A 2 20.354 -6.066 7.579 1.00 1.53 H new ATOM 0 HG SER A 2 20.402 -7.754 9.198 1.00 11.51 H new ATOM 31 N ASP A 3 20.624 -5.795 4.207 1.00 33.12 N ATOM 32 CA ASP A 3 21.196 -4.886 3.225 1.00 70.01 C ATOM 33 C ASP A 3 21.504 -3.542 3.865 1.00 45.42 C ATOM 34 O ASP A 3 21.326 -3.372 5.082 1.00 51.01 O ATOM 35 CB ASP A 3 20.266 -4.716 2.007 1.00 3.34 C ATOM 36 CG ASP A 3 18.885 -4.211 2.358 1.00 75.20 C ATOM 37 OD1 ASP A 3 18.666 -2.998 2.399 1.00 63.32 O ATOM 38 OD2 ASP A 3 17.975 -5.044 2.585 1.00 64.14 O ATOM 0 H ASP A 3 19.605 -5.773 4.240 1.00 33.12 H new ATOM 0 HA ASP A 3 22.129 -5.321 2.866 1.00 70.01 H new ATOM 0 HB2 ASP A 3 20.728 -4.023 1.303 1.00 3.34 H new ATOM 0 HB3 ASP A 3 20.173 -5.674 1.496 1.00 3.34 H new ATOM 43 N ASN A 4 21.973 -2.603 3.065 1.00 44.45 N ATOM 44 CA ASN A 4 22.392 -1.298 3.565 1.00 70.31 C ATOM 45 C ASN A 4 21.240 -0.419 3.976 1.00 22.40 C ATOM 46 O ASN A 4 20.563 0.181 3.133 1.00 22.20 O ATOM 47 CB ASN A 4 23.285 -0.520 2.566 1.00 44.30 C ATOM 48 CG ASN A 4 24.693 -1.069 2.409 1.00 61.10 C ATOM 49 OD1 ASN A 4 24.943 -2.268 2.565 1.00 5.23 O ATOM 50 ND2 ASN A 4 25.626 -0.203 2.077 1.00 75.42 N ATOM 0 H ASN A 4 22.076 -2.717 2.057 1.00 44.45 H new ATOM 0 HA ASN A 4 22.982 -1.535 4.451 1.00 70.31 H new ATOM 0 HB2 ASN A 4 22.799 -0.520 1.590 1.00 44.30 H new ATOM 0 HB3 ASN A 4 23.349 0.519 2.890 1.00 44.30 H new ATOM 0 HD21 ASN A 4 26.587 -0.516 1.941 1.00 75.42 H new ATOM 0 HD22 ASN A 4 25.388 0.781 1.955 1.00 75.42 H new ATOM 57 N ASN A 5 20.992 -0.374 5.254 1.00 43.13 N ATOM 58 CA ASN A 5 20.079 0.594 5.803 1.00 54.05 C ATOM 59 C ASN A 5 20.907 1.797 6.139 1.00 13.43 C ATOM 60 O ASN A 5 21.619 1.814 7.150 1.00 62.41 O ATOM 61 CB ASN A 5 19.357 0.075 7.055 1.00 14.40 C ATOM 62 CG ASN A 5 18.452 1.124 7.709 1.00 22.22 C ATOM 63 OD1 ASN A 5 17.288 1.265 7.355 1.00 73.33 O ATOM 64 ND2 ASN A 5 18.974 1.843 8.675 1.00 30.23 N ATOM 0 H ASN A 5 21.411 -1.000 5.941 1.00 43.13 H new ATOM 0 HA ASN A 5 19.294 0.822 5.082 1.00 54.05 H new ATOM 0 HB2 ASN A 5 18.758 -0.795 6.786 1.00 14.40 H new ATOM 0 HB3 ASN A 5 20.098 -0.260 7.781 1.00 14.40 H new ATOM 0 HD21 ASN A 5 18.407 2.543 9.154 1.00 30.23 H new ATOM 0 HD22 ASN A 5 19.947 1.702 8.947 1.00 30.23 H new ATOM 71 N GLY A 6 20.891 2.751 5.264 1.00 31.42 N ATOM 72 CA GLY A 6 21.713 3.892 5.428 1.00 13.53 C ATOM 73 C GLY A 6 20.970 5.044 6.015 1.00 70.12 C ATOM 74 O GLY A 6 19.860 4.891 6.521 1.00 35.34 O ATOM 0 H GLY A 6 20.311 2.756 4.425 1.00 31.42 H new ATOM 0 HA2 GLY A 6 22.556 3.640 6.071 1.00 13.53 H new ATOM 0 HA3 GLY A 6 22.125 4.182 4.462 1.00 13.53 H new ATOM 78 N THR A 7 21.571 6.176 5.963 1.00 30.35 N ATOM 79 CA THR A 7 20.983 7.372 6.451 1.00 72.11 C ATOM 80 C THR A 7 21.003 8.381 5.314 1.00 42.14 C ATOM 81 O THR A 7 22.065 8.608 4.732 1.00 64.41 O ATOM 82 CB THR A 7 21.808 7.918 7.644 1.00 74.33 C ATOM 83 OG1 THR A 7 22.002 6.866 8.612 1.00 32.22 O ATOM 84 CG2 THR A 7 21.094 9.089 8.312 1.00 73.41 C ATOM 0 H THR A 7 22.505 6.301 5.572 1.00 30.35 H new ATOM 0 HA THR A 7 19.964 7.188 6.793 1.00 72.11 H new ATOM 0 HB THR A 7 22.770 8.267 7.267 1.00 74.33 H new ATOM 0 HG1 THR A 7 22.525 7.208 9.367 1.00 32.22 H new ATOM 0 HG21 THR A 7 21.694 9.453 9.146 1.00 73.41 H new ATOM 0 HG22 THR A 7 20.955 9.891 7.587 1.00 73.41 H new ATOM 0 HG23 THR A 7 20.122 8.760 8.681 1.00 73.41 H new ATOM 92 N PRO A 8 19.841 8.939 4.927 1.00 34.14 N ATOM 93 CA PRO A 8 19.778 9.956 3.879 1.00 5.14 C ATOM 94 C PRO A 8 20.675 11.142 4.216 1.00 30.55 C ATOM 95 O PRO A 8 20.854 11.476 5.401 1.00 10.31 O ATOM 96 CB PRO A 8 18.306 10.384 3.878 1.00 33.05 C ATOM 97 CG PRO A 8 17.571 9.225 4.458 1.00 55.05 C ATOM 98 CD PRO A 8 18.504 8.605 5.459 1.00 51.01 C ATOM 0 HA PRO A 8 20.117 9.583 2.912 1.00 5.14 H new ATOM 0 HB2 PRO A 8 18.156 11.285 4.473 1.00 33.05 H new ATOM 0 HB3 PRO A 8 17.960 10.607 2.869 1.00 33.05 H new ATOM 0 HG2 PRO A 8 16.646 9.548 4.935 1.00 55.05 H new ATOM 0 HG3 PRO A 8 17.297 8.509 3.683 1.00 55.05 H new ATOM 0 HD2 PRO A 8 18.354 9.016 6.457 1.00 51.01 H new ATOM 0 HD3 PRO A 8 18.358 7.527 5.532 1.00 51.01 H new ATOM 106 N GLU A 9 21.189 11.791 3.199 1.00 43.33 N ATOM 107 CA GLU A 9 22.116 12.878 3.373 1.00 53.51 C ATOM 108 C GLU A 9 21.347 14.118 3.774 1.00 60.34 C ATOM 109 O GLU A 9 20.455 14.554 3.043 1.00 61.05 O ATOM 110 CB GLU A 9 22.903 13.180 2.075 1.00 50.41 C ATOM 111 CG GLU A 9 23.861 12.093 1.579 1.00 23.03 C ATOM 112 CD GLU A 9 23.177 10.838 1.104 1.00 4.41 C ATOM 113 OE1 GLU A 9 22.211 10.940 0.305 1.00 3.22 O ATOM 114 OE2 GLU A 9 23.622 9.734 1.461 1.00 21.43 O ATOM 0 H GLU A 9 20.974 11.578 2.225 1.00 43.33 H new ATOM 0 HA GLU A 9 22.831 12.590 4.144 1.00 53.51 H new ATOM 0 HB2 GLU A 9 22.184 13.387 1.282 1.00 50.41 H new ATOM 0 HB3 GLU A 9 23.477 14.093 2.231 1.00 50.41 H new ATOM 0 HG2 GLU A 9 24.461 12.497 0.764 1.00 23.03 H new ATOM 0 HG3 GLU A 9 24.549 11.836 2.384 1.00 23.03 H new ATOM 121 N PRO A 10 21.667 14.678 4.951 1.00 43.24 N ATOM 122 CA PRO A 10 20.982 15.842 5.503 1.00 45.44 C ATOM 123 C PRO A 10 20.937 17.037 4.558 1.00 74.20 C ATOM 124 O PRO A 10 21.943 17.720 4.329 1.00 54.12 O ATOM 125 CB PRO A 10 21.789 16.199 6.746 1.00 24.13 C ATOM 126 CG PRO A 10 22.500 14.954 7.127 1.00 4.15 C ATOM 127 CD PRO A 10 22.730 14.193 5.854 1.00 63.53 C ATOM 0 HA PRO A 10 19.937 15.604 5.700 1.00 45.44 H new ATOM 0 HB2 PRO A 10 22.493 17.005 6.539 1.00 24.13 H new ATOM 0 HB3 PRO A 10 21.139 16.542 7.551 1.00 24.13 H new ATOM 0 HG2 PRO A 10 23.445 15.182 7.620 1.00 4.15 H new ATOM 0 HG3 PRO A 10 21.907 14.367 7.829 1.00 4.15 H new ATOM 0 HD2 PRO A 10 23.721 14.389 5.445 1.00 63.53 H new ATOM 0 HD3 PRO A 10 22.658 13.117 6.014 1.00 63.53 H new ATOM 135 N GLN A 11 19.801 17.219 3.956 1.00 72.35 N ATOM 136 CA GLN A 11 19.518 18.372 3.146 1.00 34.23 C ATOM 137 C GLN A 11 18.633 19.244 3.996 1.00 4.32 C ATOM 138 O GLN A 11 18.130 18.781 5.039 1.00 51.35 O ATOM 139 CB GLN A 11 18.735 18.003 1.870 1.00 3.41 C ATOM 140 CG GLN A 11 19.353 16.933 0.975 1.00 73.13 C ATOM 141 CD GLN A 11 20.714 17.303 0.453 1.00 24.24 C ATOM 142 OE1 GLN A 11 20.839 17.944 -0.593 1.00 71.42 O ATOM 143 NE2 GLN A 11 21.736 16.870 1.131 1.00 75.35 N ATOM 0 H GLN A 11 19.026 16.558 4.013 1.00 72.35 H new ATOM 0 HA GLN A 11 20.447 18.850 2.835 1.00 34.23 H new ATOM 0 HB2 GLN A 11 17.741 17.668 2.165 1.00 3.41 H new ATOM 0 HB3 GLN A 11 18.603 18.908 1.277 1.00 3.41 H new ATOM 0 HG2 GLN A 11 19.428 16.001 1.535 1.00 73.13 H new ATOM 0 HG3 GLN A 11 18.687 16.746 0.132 1.00 73.13 H new ATOM 0 HE21 GLN A 11 21.590 16.343 1.992 1.00 75.35 H new ATOM 0 HE22 GLN A 11 22.683 17.057 0.802 1.00 75.35 H new ATOM 152 N VAL A 12 18.404 20.458 3.606 1.00 23.11 N ATOM 153 CA VAL A 12 17.490 21.249 4.373 1.00 24.00 C ATOM 154 C VAL A 12 16.219 21.352 3.564 1.00 52.05 C ATOM 155 O VAL A 12 16.214 21.856 2.430 1.00 54.40 O ATOM 156 CB VAL A 12 18.048 22.672 4.660 1.00 55.53 C ATOM 157 CG1 VAL A 12 17.109 23.445 5.580 1.00 43.13 C ATOM 158 CG2 VAL A 12 19.447 22.602 5.263 1.00 12.22 C ATOM 0 H VAL A 12 18.819 20.912 2.792 1.00 23.11 H new ATOM 0 HA VAL A 12 17.320 20.779 5.342 1.00 24.00 H new ATOM 0 HB VAL A 12 18.115 23.202 3.710 1.00 55.53 H new ATOM 0 HG11 VAL A 12 17.519 24.437 5.768 1.00 43.13 H new ATOM 0 HG12 VAL A 12 16.132 23.539 5.106 1.00 43.13 H new ATOM 0 HG13 VAL A 12 17.004 22.911 6.525 1.00 43.13 H new ATOM 0 HG21 VAL A 12 19.812 23.611 5.453 1.00 12.22 H new ATOM 0 HG22 VAL A 12 19.412 22.046 6.200 1.00 12.22 H new ATOM 0 HG23 VAL A 12 20.118 22.098 4.567 1.00 12.22 H new ATOM 168 N GLU A 13 15.164 20.857 4.145 1.00 71.42 N ATOM 169 CA GLU A 13 13.868 20.775 3.542 1.00 31.14 C ATOM 170 C GLU A 13 12.927 20.641 4.717 1.00 40.10 C ATOM 171 O GLU A 13 13.324 20.086 5.751 1.00 33.33 O ATOM 172 CB GLU A 13 13.831 19.519 2.626 1.00 43.25 C ATOM 173 CG GLU A 13 12.680 19.415 1.602 1.00 22.45 C ATOM 174 CD GLU A 13 11.302 19.242 2.201 1.00 41.05 C ATOM 175 OE1 GLU A 13 11.080 18.249 2.926 1.00 30.31 O ATOM 176 OE2 GLU A 13 10.420 20.090 1.927 1.00 54.33 O ATOM 0 H GLU A 13 15.187 20.484 5.094 1.00 71.42 H new ATOM 0 HA GLU A 13 13.604 21.631 2.920 1.00 31.14 H new ATOM 0 HB2 GLU A 13 14.773 19.474 2.079 1.00 43.25 H new ATOM 0 HB3 GLU A 13 13.792 18.637 3.266 1.00 43.25 H new ATOM 0 HG2 GLU A 13 12.681 20.314 0.985 1.00 22.45 H new ATOM 0 HG3 GLU A 13 12.879 18.573 0.939 1.00 22.45 H new ATOM 183 N THR A 14 11.754 21.149 4.611 1.00 2.15 N ATOM 184 CA THR A 14 10.836 21.086 5.695 1.00 11.32 C ATOM 185 C THR A 14 9.550 20.403 5.229 1.00 61.23 C ATOM 186 O THR A 14 8.937 20.821 4.249 1.00 73.21 O ATOM 187 CB THR A 14 10.547 22.515 6.211 1.00 54.04 C ATOM 188 OG1 THR A 14 11.797 23.190 6.427 1.00 43.11 O ATOM 189 CG2 THR A 14 9.778 22.480 7.525 1.00 33.31 C ATOM 0 H THR A 14 11.402 21.618 3.777 1.00 2.15 H new ATOM 0 HA THR A 14 11.262 20.505 6.513 1.00 11.32 H new ATOM 0 HB THR A 14 9.944 23.037 5.468 1.00 54.04 H new ATOM 0 HG1 THR A 14 11.626 24.098 6.753 1.00 43.11 H new ATOM 0 HG21 THR A 14 9.589 23.499 7.863 1.00 33.31 H new ATOM 0 HG22 THR A 14 8.829 21.965 7.377 1.00 33.31 H new ATOM 0 HG23 THR A 14 10.365 21.951 8.276 1.00 33.31 H new HETATM 197 N TPO A 15 9.103 19.417 5.959 1.00 24.31 N HETATM 198 CA TPO A 15 7.929 18.682 5.559 1.00 31.13 C HETATM 199 CB TPO A 15 8.122 17.183 5.850 1.00 21.15 C HETATM 200 CG2 TPO A 15 7.075 16.334 5.155 1.00 13.44 C HETATM 201 OG1 TPO A 15 9.402 16.756 5.353 1.00 22.25 O HETATM 202 P TPO A 15 10.667 16.463 6.310 1.00 3.41 P HETATM 203 O1P TPO A 15 10.603 17.331 7.551 1.00 73.32 O HETATM 204 O2P TPO A 15 11.972 16.777 5.606 1.00 2.12 O HETATM 205 O3P TPO A 15 10.668 14.984 6.718 1.00 2.20 O HETATM 206 C TPO A 15 6.772 19.182 6.396 1.00 11.51 C HETATM 207 O TPO A 15 6.856 19.245 7.620 1.00 32.23 O HETATM 0 HG23 TPO A 15 6.083 16.624 5.501 1.00 13.44 H new HETATM 0 HG22 TPO A 15 7.142 16.484 4.077 1.00 13.44 H new HETATM 0 HG21 TPO A 15 7.247 15.283 5.386 1.00 13.44 H new HETATM 0 HB TPO A 15 8.041 17.056 6.930 1.00 21.15 H new HETATM 0 HA TPO A 15 7.746 18.822 4.494 1.00 31.13 H new HETATM 0 H TPO A 15 9.898 18.925 6.367 1.00 24.31 H new ATOM 214 N SER A 16 5.712 19.554 5.723 1.00 32.54 N ATOM 215 CA SER A 16 4.588 20.202 6.334 1.00 11.02 C ATOM 216 C SER A 16 3.560 19.203 6.846 1.00 22.35 C ATOM 217 O SER A 16 3.351 18.142 6.257 1.00 75.11 O ATOM 218 CB SER A 16 3.910 21.079 5.288 1.00 53.34 C ATOM 219 OG SER A 16 4.845 21.909 4.611 1.00 4.12 O ATOM 0 H SER A 16 5.608 19.411 4.718 1.00 32.54 H new ATOM 0 HA SER A 16 4.955 20.783 7.180 1.00 11.02 H new ATOM 0 HB2 SER A 16 3.393 20.449 4.565 1.00 53.34 H new ATOM 0 HB3 SER A 16 3.154 21.700 5.768 1.00 53.34 H new ATOM 0 HG SER A 16 4.376 22.456 3.947 1.00 4.12 H new ATOM 225 N VAL A 17 2.959 19.542 7.953 1.00 10.44 N ATOM 226 CA VAL A 17 1.839 18.821 8.472 1.00 52.25 C ATOM 227 C VAL A 17 0.618 19.535 7.944 1.00 41.11 C ATOM 228 O VAL A 17 0.424 20.723 8.243 1.00 44.34 O ATOM 229 CB VAL A 17 1.801 18.868 10.031 1.00 11.41 C ATOM 230 CG1 VAL A 17 0.616 18.082 10.582 1.00 14.00 C ATOM 231 CG2 VAL A 17 3.101 18.361 10.631 1.00 4.31 C ATOM 0 H VAL A 17 3.240 20.338 8.525 1.00 10.44 H new ATOM 0 HA VAL A 17 1.891 17.774 8.174 1.00 52.25 H new ATOM 0 HB VAL A 17 1.678 19.912 10.319 1.00 11.41 H new ATOM 0 HG11 VAL A 17 0.619 18.135 11.671 1.00 14.00 H new ATOM 0 HG12 VAL A 17 -0.312 18.508 10.200 1.00 14.00 H new ATOM 0 HG13 VAL A 17 0.693 17.041 10.269 1.00 14.00 H new ATOM 0 HG21 VAL A 17 3.042 18.407 11.718 1.00 4.31 H new ATOM 0 HG22 VAL A 17 3.268 17.330 10.320 1.00 4.31 H new ATOM 0 HG23 VAL A 17 3.928 18.982 10.286 1.00 4.31 H new ATOM 241 N PHE A 18 -0.165 18.889 7.130 1.00 64.03 N ATOM 242 CA PHE A 18 -1.331 19.546 6.613 1.00 31.44 C ATOM 243 C PHE A 18 -2.595 18.996 7.227 1.00 40.13 C ATOM 244 O PHE A 18 -2.815 17.778 7.277 1.00 4.25 O ATOM 245 CB PHE A 18 -1.386 19.588 5.061 1.00 32.33 C ATOM 246 CG PHE A 18 -1.436 18.258 4.347 1.00 44.05 C ATOM 247 CD1 PHE A 18 -0.270 17.620 3.965 1.00 11.51 C ATOM 248 CD2 PHE A 18 -2.653 17.665 4.031 1.00 43.44 C ATOM 249 CE1 PHE A 18 -0.314 16.417 3.291 1.00 75.00 C ATOM 250 CE2 PHE A 18 -2.700 16.464 3.353 1.00 30.15 C ATOM 251 CZ PHE A 18 -1.527 15.839 2.984 1.00 5.31 C ATOM 0 H PHE A 18 -0.024 17.929 6.815 1.00 64.03 H new ATOM 0 HA PHE A 18 -1.252 20.590 6.917 1.00 31.44 H new ATOM 0 HB2 PHE A 18 -2.263 20.165 4.767 1.00 32.33 H new ATOM 0 HB3 PHE A 18 -0.512 20.133 4.704 1.00 32.33 H new ATOM 0 HD1 PHE A 18 0.685 18.068 4.197 1.00 11.51 H new ATOM 0 HD2 PHE A 18 -3.573 18.150 4.320 1.00 43.44 H new ATOM 0 HE1 PHE A 18 0.604 15.927 3.003 1.00 75.00 H new ATOM 0 HE2 PHE A 18 -3.652 16.015 3.112 1.00 30.15 H new ATOM 0 HZ PHE A 18 -1.559 14.898 2.455 1.00 5.31 H new ATOM 261 N ARG A 19 -3.390 19.878 7.740 1.00 72.45 N ATOM 262 CA ARG A 19 -4.640 19.517 8.327 1.00 64.11 C ATOM 263 C ARG A 19 -5.772 19.943 7.409 1.00 51.22 C ATOM 264 O ARG A 19 -6.116 21.119 7.310 1.00 33.43 O ATOM 265 CB ARG A 19 -4.777 20.084 9.755 1.00 43.33 C ATOM 266 CG ARG A 19 -4.633 21.587 9.885 1.00 75.22 C ATOM 267 CD ARG A 19 -4.720 22.009 11.327 1.00 60.12 C ATOM 268 NE ARG A 19 -4.713 23.459 11.482 1.00 41.41 N ATOM 269 CZ ARG A 19 -4.703 24.092 12.650 1.00 31.42 C ATOM 270 NH1 ARG A 19 -4.609 23.401 13.778 1.00 23.11 N ATOM 271 NH2 ARG A 19 -4.765 25.415 12.692 1.00 23.35 N ATOM 0 H ARG A 19 -3.189 20.878 7.764 1.00 72.45 H new ATOM 0 HA ARG A 19 -4.690 18.434 8.435 1.00 64.11 H new ATOM 0 HB2 ARG A 19 -5.752 19.796 10.148 1.00 43.33 H new ATOM 0 HB3 ARG A 19 -4.026 19.610 10.387 1.00 43.33 H new ATOM 0 HG2 ARG A 19 -3.678 21.903 9.466 1.00 75.22 H new ATOM 0 HG3 ARG A 19 -5.414 22.083 9.308 1.00 75.22 H new ATOM 0 HD2 ARG A 19 -5.631 21.603 11.767 1.00 60.12 H new ATOM 0 HD3 ARG A 19 -3.882 21.583 11.879 1.00 60.12 H new ATOM 0 HE ARG A 19 -4.716 24.027 10.635 1.00 41.41 H new ATOM 0 HH11 ARG A 19 -4.544 22.383 13.749 1.00 23.11 H new ATOM 0 HH12 ARG A 19 -4.601 23.887 14.675 1.00 23.11 H new ATOM 0 HH21 ARG A 19 -4.821 25.951 11.826 1.00 23.35 H new ATOM 0 HH22 ARG A 19 -4.757 25.898 13.591 1.00 23.35 H new ATOM 285 N ALA A 20 -6.311 18.999 6.695 1.00 23.42 N ATOM 286 CA ALA A 20 -7.324 19.307 5.720 1.00 24.22 C ATOM 287 C ALA A 20 -8.675 18.764 6.132 1.00 64.00 C ATOM 288 O ALA A 20 -8.767 17.923 7.026 1.00 51.52 O ATOM 289 CB ALA A 20 -6.915 18.781 4.352 1.00 53.24 C ATOM 0 H ALA A 20 -6.069 18.011 6.766 1.00 23.42 H new ATOM 0 HA ALA A 20 -7.418 20.391 5.660 1.00 24.22 H new ATOM 0 HB1 ALA A 20 -7.690 19.020 3.624 1.00 53.24 H new ATOM 0 HB2 ALA A 20 -5.976 19.245 4.049 1.00 53.24 H new ATOM 0 HB3 ALA A 20 -6.785 17.700 4.402 1.00 53.24 H new ATOM 295 N ASP A 21 -9.714 19.237 5.450 1.00 30.12 N ATOM 296 CA ASP A 21 -11.136 18.868 5.690 1.00 15.32 C ATOM 297 C ASP A 21 -11.422 17.406 5.341 1.00 23.44 C ATOM 298 O ASP A 21 -12.489 16.875 5.635 1.00 41.25 O ATOM 299 CB ASP A 21 -12.048 19.794 4.852 1.00 30.43 C ATOM 300 CG ASP A 21 -13.542 19.492 4.972 1.00 74.23 C ATOM 301 OD1 ASP A 21 -14.158 19.852 6.004 1.00 12.15 O ATOM 302 OD2 ASP A 21 -14.127 18.907 4.029 1.00 55.54 O ATOM 0 H ASP A 21 -9.604 19.908 4.690 1.00 30.12 H new ATOM 0 HA ASP A 21 -11.340 18.992 6.754 1.00 15.32 H new ATOM 0 HB2 ASP A 21 -11.874 20.826 5.156 1.00 30.43 H new ATOM 0 HB3 ASP A 21 -11.758 19.717 3.804 1.00 30.43 H new ATOM 307 N LEU A 22 -10.449 16.753 4.765 1.00 34.55 N ATOM 308 CA LEU A 22 -10.574 15.382 4.309 1.00 30.35 C ATOM 309 C LEU A 22 -10.973 14.396 5.426 1.00 41.32 C ATOM 310 O LEU A 22 -11.603 13.375 5.147 1.00 60.15 O ATOM 311 CB LEU A 22 -9.291 14.957 3.554 1.00 22.25 C ATOM 312 CG LEU A 22 -7.946 15.072 4.303 1.00 0.41 C ATOM 313 CD1 LEU A 22 -7.696 13.891 5.231 1.00 22.14 C ATOM 314 CD2 LEU A 22 -6.806 15.244 3.326 1.00 53.50 C ATOM 0 H LEU A 22 -9.529 17.159 4.593 1.00 34.55 H new ATOM 0 HA LEU A 22 -11.408 15.342 3.609 1.00 30.35 H new ATOM 0 HB2 LEU A 22 -9.414 13.920 3.242 1.00 22.25 H new ATOM 0 HB3 LEU A 22 -9.222 15.557 2.646 1.00 22.25 H new ATOM 0 HG LEU A 22 -8.003 15.960 4.933 1.00 0.41 H new ATOM 0 HD11 LEU A 22 -6.738 14.020 5.734 1.00 22.14 H new ATOM 0 HD12 LEU A 22 -8.491 13.838 5.974 1.00 22.14 H new ATOM 0 HD13 LEU A 22 -7.680 12.969 4.650 1.00 22.14 H new ATOM 0 HD21 LEU A 22 -5.867 15.323 3.873 1.00 53.50 H new ATOM 0 HD22 LEU A 22 -6.766 14.383 2.659 1.00 53.50 H new ATOM 0 HD23 LEU A 22 -6.962 16.150 2.740 1.00 53.50 H new ATOM 326 N LEU A 23 -10.660 14.731 6.677 1.00 13.05 N ATOM 327 CA LEU A 23 -10.991 13.877 7.801 1.00 54.31 C ATOM 328 C LEU A 23 -12.435 14.057 8.241 1.00 1.43 C ATOM 329 O LEU A 23 -13.063 13.107 8.720 1.00 70.44 O ATOM 330 CB LEU A 23 -10.073 14.159 8.986 1.00 24.43 C ATOM 331 CG LEU A 23 -8.608 13.776 8.835 1.00 61.23 C ATOM 332 CD1 LEU A 23 -7.836 14.190 10.072 1.00 10.33 C ATOM 333 CD2 LEU A 23 -8.476 12.278 8.610 1.00 43.42 C ATOM 0 H LEU A 23 -10.176 15.592 6.931 1.00 13.05 H new ATOM 0 HA LEU A 23 -10.853 12.849 7.466 1.00 54.31 H new ATOM 0 HB2 LEU A 23 -10.123 15.225 9.206 1.00 24.43 H new ATOM 0 HB3 LEU A 23 -10.472 13.635 9.855 1.00 24.43 H new ATOM 0 HG LEU A 23 -8.195 14.295 7.970 1.00 61.23 H new ATOM 0 HD11 LEU A 23 -6.788 13.913 9.957 1.00 10.33 H new ATOM 0 HD12 LEU A 23 -7.913 15.269 10.205 1.00 10.33 H new ATOM 0 HD13 LEU A 23 -8.251 13.686 10.945 1.00 10.33 H new ATOM 0 HD21 LEU A 23 -7.423 12.017 8.504 1.00 43.42 H new ATOM 0 HD22 LEU A 23 -8.898 11.744 9.461 1.00 43.42 H new ATOM 0 HD23 LEU A 23 -9.013 11.998 7.704 1.00 43.42 H new ATOM 345 N LYS A 24 -12.965 15.252 8.016 1.00 50.53 N ATOM 346 CA LYS A 24 -14.287 15.659 8.488 1.00 60.52 C ATOM 347 C LYS A 24 -15.371 14.681 8.053 1.00 71.54 C ATOM 348 O LYS A 24 -16.184 14.256 8.877 1.00 54.14 O ATOM 349 CB LYS A 24 -14.570 17.123 8.037 1.00 12.45 C ATOM 350 CG LYS A 24 -15.835 17.805 8.597 1.00 22.35 C ATOM 351 CD LYS A 24 -17.128 17.455 7.855 1.00 3.41 C ATOM 352 CE LYS A 24 -17.121 17.940 6.400 1.00 60.42 C ATOM 353 NZ LYS A 24 -16.826 19.397 6.260 1.00 31.14 N ATOM 0 H LYS A 24 -12.481 15.981 7.491 1.00 50.53 H new ATOM 0 HA LYS A 24 -14.301 15.636 9.578 1.00 60.52 H new ATOM 0 HB2 LYS A 24 -13.709 17.733 8.311 1.00 12.45 H new ATOM 0 HB3 LYS A 24 -14.635 17.134 6.949 1.00 12.45 H new ATOM 0 HG2 LYS A 24 -15.947 17.529 9.646 1.00 22.35 H new ATOM 0 HG3 LYS A 24 -15.694 18.885 8.565 1.00 22.35 H new ATOM 0 HD2 LYS A 24 -17.273 16.375 7.874 1.00 3.41 H new ATOM 0 HD3 LYS A 24 -17.975 17.899 8.378 1.00 3.41 H new ATOM 0 HE2 LYS A 24 -16.379 17.372 5.839 1.00 60.42 H new ATOM 0 HE3 LYS A 24 -18.091 17.729 5.950 1.00 60.42 H new ATOM 0 HZ1 LYS A 24 -17.082 19.713 5.303 1.00 31.14 H new ATOM 0 HZ2 LYS A 24 -17.378 19.932 6.960 1.00 31.14 H new ATOM 0 HZ3 LYS A 24 -15.812 19.563 6.420 1.00 31.14 H new ATOM 367 N GLU A 25 -15.344 14.276 6.795 1.00 53.14 N ATOM 368 CA GLU A 25 -16.342 13.351 6.283 1.00 63.40 C ATOM 369 C GLU A 25 -16.167 11.938 6.866 1.00 41.00 C ATOM 370 O GLU A 25 -17.152 11.250 7.170 1.00 71.42 O ATOM 371 CB GLU A 25 -16.296 13.255 4.749 1.00 24.13 C ATOM 372 CG GLU A 25 -14.993 12.677 4.193 1.00 50.15 C ATOM 373 CD GLU A 25 -15.109 12.232 2.765 1.00 64.12 C ATOM 374 OE1 GLU A 25 -15.781 11.210 2.502 1.00 72.15 O ATOM 375 OE2 GLU A 25 -14.523 12.883 1.875 1.00 20.23 O ATOM 0 H GLU A 25 -14.646 14.571 6.112 1.00 53.14 H new ATOM 0 HA GLU A 25 -17.307 13.752 6.593 1.00 63.40 H new ATOM 0 HB2 GLU A 25 -17.128 12.637 4.410 1.00 24.13 H new ATOM 0 HB3 GLU A 25 -16.447 14.250 4.330 1.00 24.13 H new ATOM 0 HG2 GLU A 25 -14.207 13.428 4.271 1.00 50.15 H new ATOM 0 HG3 GLU A 25 -14.687 11.830 4.807 1.00 50.15 H new ATOM 382 N MET A 26 -14.924 11.520 7.055 1.00 2.42 N ATOM 383 CA MET A 26 -14.659 10.143 7.413 1.00 25.44 C ATOM 384 C MET A 26 -14.886 9.872 8.875 1.00 64.33 C ATOM 385 O MET A 26 -15.236 8.772 9.220 1.00 42.34 O ATOM 386 CB MET A 26 -13.270 9.651 6.954 1.00 11.53 C ATOM 387 CG MET A 26 -12.081 10.248 7.691 1.00 75.42 C ATOM 388 SD MET A 26 -10.493 9.668 7.052 1.00 43.52 S ATOM 389 CE MET A 26 -10.531 10.321 5.385 1.00 33.21 C ATOM 0 H MET A 26 -14.096 12.109 6.967 1.00 2.42 H new ATOM 0 HA MET A 26 -15.392 9.557 6.859 1.00 25.44 H new ATOM 0 HB2 MET A 26 -13.235 8.567 7.063 1.00 11.53 H new ATOM 0 HB3 MET A 26 -13.161 9.868 5.891 1.00 11.53 H new ATOM 0 HG2 MET A 26 -12.122 11.335 7.616 1.00 75.42 H new ATOM 0 HG3 MET A 26 -12.154 9.999 8.750 1.00 75.42 H new ATOM 0 HE1 MET A 26 -10.626 9.500 4.675 1.00 33.21 H new ATOM 0 HE2 MET A 26 -11.382 10.994 5.277 1.00 33.21 H new ATOM 0 HE3 MET A 26 -9.609 10.867 5.187 1.00 33.21 H new ATOM 399 N GLU A 27 -14.738 10.881 9.726 1.00 10.12 N ATOM 400 CA GLU A 27 -14.940 10.700 11.167 1.00 24.13 C ATOM 401 C GLU A 27 -16.343 10.195 11.466 1.00 31.20 C ATOM 402 O GLU A 27 -16.518 9.196 12.159 1.00 25.41 O ATOM 403 CB GLU A 27 -14.731 11.993 11.918 1.00 33.33 C ATOM 404 CG GLU A 27 -13.361 12.590 11.785 1.00 14.53 C ATOM 405 CD GLU A 27 -13.236 13.819 12.618 1.00 5.22 C ATOM 406 OE1 GLU A 27 -13.739 14.877 12.208 1.00 35.42 O ATOM 407 OE2 GLU A 27 -12.664 13.749 13.720 1.00 72.40 O ATOM 0 H GLU A 27 -14.481 11.829 9.450 1.00 10.12 H new ATOM 0 HA GLU A 27 -14.206 9.964 11.495 1.00 24.13 H new ATOM 0 HB2 GLU A 27 -15.463 12.721 11.569 1.00 33.33 H new ATOM 0 HB3 GLU A 27 -14.934 11.819 12.975 1.00 33.33 H new ATOM 0 HG2 GLU A 27 -12.610 11.861 12.090 1.00 14.53 H new ATOM 0 HG3 GLU A 27 -13.165 12.832 10.740 1.00 14.53 H new ATOM 414 N SER A 28 -17.320 10.858 10.891 1.00 33.43 N ATOM 415 CA SER A 28 -18.718 10.546 11.091 1.00 45.32 C ATOM 416 C SER A 28 -19.075 9.198 10.449 1.00 74.25 C ATOM 417 O SER A 28 -19.981 8.498 10.894 1.00 12.24 O ATOM 418 CB SER A 28 -19.515 11.651 10.435 1.00 62.10 C ATOM 419 OG SER A 28 -18.910 12.912 10.723 1.00 44.45 O ATOM 0 H SER A 28 -17.163 11.644 10.260 1.00 33.43 H new ATOM 0 HA SER A 28 -18.941 10.472 12.156 1.00 45.32 H new ATOM 0 HB2 SER A 28 -19.556 11.493 9.357 1.00 62.10 H new ATOM 0 HB3 SER A 28 -20.543 11.637 10.798 1.00 62.10 H new ATOM 0 HG SER A 28 -19.426 13.627 10.296 1.00 44.45 H new ATOM 425 N SER A 29 -18.325 8.835 9.437 1.00 71.03 N ATOM 426 CA SER A 29 -18.574 7.633 8.689 1.00 53.32 C ATOM 427 C SER A 29 -17.846 6.436 9.336 1.00 73.54 C ATOM 428 O SER A 29 -18.242 5.280 9.160 1.00 73.23 O ATOM 429 CB SER A 29 -18.098 7.849 7.237 1.00 42.45 C ATOM 430 OG SER A 29 -18.496 6.802 6.375 1.00 40.55 O ATOM 0 H SER A 29 -17.521 9.370 9.110 1.00 71.03 H new ATOM 0 HA SER A 29 -19.641 7.409 8.690 1.00 53.32 H new ATOM 0 HB2 SER A 29 -18.496 8.793 6.864 1.00 42.45 H new ATOM 0 HB3 SER A 29 -17.011 7.933 7.223 1.00 42.45 H new ATOM 0 HG SER A 29 -18.173 6.984 5.468 1.00 40.55 H new ATOM 436 N THR A 30 -16.814 6.717 10.096 1.00 10.02 N ATOM 437 CA THR A 30 -15.997 5.683 10.676 1.00 61.24 C ATOM 438 C THR A 30 -16.394 5.378 12.109 1.00 34.24 C ATOM 439 O THR A 30 -16.170 6.175 13.028 1.00 70.24 O ATOM 440 CB THR A 30 -14.506 6.059 10.598 1.00 61.24 C ATOM 441 OG1 THR A 30 -14.186 6.320 9.233 1.00 33.24 O ATOM 442 CG2 THR A 30 -13.618 4.936 11.116 1.00 64.33 C ATOM 0 H THR A 30 -16.520 7.666 10.328 1.00 10.02 H new ATOM 0 HA THR A 30 -16.163 4.777 10.093 1.00 61.24 H new ATOM 0 HB THR A 30 -14.329 6.936 11.220 1.00 61.24 H new ATOM 0 HG1 THR A 30 -14.482 7.223 8.994 1.00 33.24 H new ATOM 0 HG21 THR A 30 -12.573 5.237 11.046 1.00 64.33 H new ATOM 0 HG22 THR A 30 -13.866 4.726 12.157 1.00 64.33 H new ATOM 0 HG23 THR A 30 -13.779 4.040 10.517 1.00 64.33 H new ATOM 450 N GLY A 31 -17.032 4.264 12.261 1.00 3.55 N ATOM 451 CA GLY A 31 -17.370 3.735 13.548 1.00 71.10 C ATOM 452 C GLY A 31 -16.915 2.304 13.632 1.00 73.05 C ATOM 453 O GLY A 31 -16.605 1.795 14.704 1.00 70.14 O ATOM 0 H GLY A 31 -17.340 3.683 11.482 1.00 3.55 H new ATOM 0 HA2 GLY A 31 -16.897 4.326 14.332 1.00 71.10 H new ATOM 0 HA3 GLY A 31 -18.446 3.796 13.708 1.00 71.10 H new ATOM 457 N THR A 32 -16.888 1.663 12.498 1.00 34.41 N ATOM 458 CA THR A 32 -16.455 0.319 12.377 1.00 23.42 C ATOM 459 C THR A 32 -15.192 0.283 11.500 1.00 51.14 C ATOM 460 O THR A 32 -14.985 1.165 10.630 1.00 41.04 O ATOM 461 CB THR A 32 -17.575 -0.520 11.715 1.00 74.31 C ATOM 462 OG1 THR A 32 -18.828 -0.222 12.363 1.00 0.21 O ATOM 463 CG2 THR A 32 -17.299 -2.015 11.849 1.00 2.02 C ATOM 0 H THR A 32 -17.177 2.081 11.614 1.00 34.41 H new ATOM 0 HA THR A 32 -16.231 -0.094 13.361 1.00 23.42 H new ATOM 0 HB THR A 32 -17.614 -0.266 10.656 1.00 74.31 H new ATOM 0 HG1 THR A 32 -19.544 -0.748 11.949 1.00 0.21 H new ATOM 0 HG21 THR A 32 -18.103 -2.577 11.374 1.00 2.02 H new ATOM 0 HG22 THR A 32 -16.353 -2.255 11.364 1.00 2.02 H new ATOM 0 HG23 THR A 32 -17.244 -2.282 12.904 1.00 2.02 H new ATOM 471 N ALA A 33 -14.333 -0.655 11.762 1.00 53.44 N ATOM 472 CA ALA A 33 -13.188 -0.891 10.932 1.00 31.31 C ATOM 473 C ALA A 33 -13.435 -2.208 10.213 1.00 60.44 C ATOM 474 O ALA A 33 -13.977 -3.140 10.823 1.00 64.50 O ATOM 475 CB ALA A 33 -11.920 -0.951 11.771 1.00 22.12 C ATOM 0 H ALA A 33 -14.406 -1.283 12.563 1.00 53.44 H new ATOM 0 HA ALA A 33 -13.049 -0.082 10.214 1.00 31.31 H new ATOM 0 HB1 ALA A 33 -11.063 -1.131 11.122 1.00 22.12 H new ATOM 0 HB2 ALA A 33 -11.786 -0.005 12.296 1.00 22.12 H new ATOM 0 HB3 ALA A 33 -12.002 -1.760 12.497 1.00 22.12 H new ATOM 481 N PRO A 34 -13.101 -2.311 8.921 1.00 32.10 N ATOM 482 CA PRO A 34 -13.363 -3.528 8.141 1.00 60.11 C ATOM 483 C PRO A 34 -12.616 -4.752 8.682 1.00 25.24 C ATOM 484 O PRO A 34 -11.489 -4.643 9.167 1.00 64.35 O ATOM 485 CB PRO A 34 -12.868 -3.173 6.730 1.00 42.24 C ATOM 486 CG PRO A 34 -11.911 -2.049 6.940 1.00 1.14 C ATOM 487 CD PRO A 34 -12.440 -1.274 8.109 1.00 21.33 C ATOM 0 HA PRO A 34 -14.416 -3.806 8.177 1.00 60.11 H new ATOM 0 HB2 PRO A 34 -12.381 -4.025 6.254 1.00 42.24 H new ATOM 0 HB3 PRO A 34 -13.693 -2.876 6.083 1.00 42.24 H new ATOM 0 HG2 PRO A 34 -10.907 -2.423 7.141 1.00 1.14 H new ATOM 0 HG3 PRO A 34 -11.845 -1.421 6.052 1.00 1.14 H new ATOM 0 HD2 PRO A 34 -11.641 -0.778 8.660 1.00 21.33 H new ATOM 0 HD3 PRO A 34 -13.140 -0.499 7.796 1.00 21.33 H new ATOM 495 N ALA A 35 -13.266 -5.889 8.632 1.00 64.45 N ATOM 496 CA ALA A 35 -12.678 -7.139 9.060 1.00 14.22 C ATOM 497 C ALA A 35 -12.952 -8.201 8.011 1.00 5.31 C ATOM 498 O ALA A 35 -13.980 -8.138 7.313 1.00 11.41 O ATOM 499 CB ALA A 35 -13.243 -7.556 10.406 1.00 52.31 C ATOM 0 H ALA A 35 -14.224 -5.976 8.292 1.00 64.45 H new ATOM 0 HA ALA A 35 -11.601 -7.015 9.173 1.00 14.22 H new ATOM 0 HB1 ALA A 35 -12.791 -8.499 10.714 1.00 52.31 H new ATOM 0 HB2 ALA A 35 -13.022 -6.788 11.147 1.00 52.31 H new ATOM 0 HB3 ALA A 35 -14.323 -7.681 10.324 1.00 52.31 H new ATOM 505 N SER A 36 -12.063 -9.149 7.878 1.00 70.42 N ATOM 506 CA SER A 36 -12.223 -10.211 6.913 1.00 1.42 C ATOM 507 C SER A 36 -12.031 -11.574 7.576 1.00 43.13 C ATOM 508 O SER A 36 -11.157 -11.743 8.435 1.00 11.21 O ATOM 509 CB SER A 36 -11.225 -10.031 5.768 1.00 15.34 C ATOM 510 OG SER A 36 -11.380 -8.755 5.158 1.00 42.24 O ATOM 0 H SER A 36 -11.209 -9.210 8.432 1.00 70.42 H new ATOM 0 HA SER A 36 -13.235 -10.167 6.510 1.00 1.42 H new ATOM 0 HB2 SER A 36 -10.208 -10.137 6.146 1.00 15.34 H new ATOM 0 HB3 SER A 36 -11.372 -10.815 5.025 1.00 15.34 H new ATOM 0 HG SER A 36 -10.502 -8.330 5.061 1.00 42.24 H new ATOM 516 N THR A 37 -12.852 -12.519 7.197 1.00 21.42 N ATOM 517 CA THR A 37 -12.771 -13.860 7.702 1.00 54.21 C ATOM 518 C THR A 37 -11.641 -14.581 6.956 1.00 61.42 C ATOM 519 O THR A 37 -11.707 -14.749 5.738 1.00 34.42 O ATOM 520 CB THR A 37 -14.109 -14.573 7.448 1.00 63.24 C ATOM 521 OG1 THR A 37 -15.180 -13.705 7.887 1.00 64.11 O ATOM 522 CG2 THR A 37 -14.181 -15.886 8.218 1.00 11.00 C ATOM 0 H THR A 37 -13.603 -12.375 6.522 1.00 21.42 H new ATOM 0 HA THR A 37 -12.568 -13.861 8.773 1.00 54.21 H new ATOM 0 HB THR A 37 -14.200 -14.794 6.384 1.00 63.24 H new ATOM 0 HG1 THR A 37 -16.042 -14.144 7.730 1.00 64.11 H new ATOM 0 HG21 THR A 37 -15.137 -16.371 8.022 1.00 11.00 H new ATOM 0 HG22 THR A 37 -13.370 -16.540 7.898 1.00 11.00 H new ATOM 0 HG23 THR A 37 -14.088 -15.687 9.286 1.00 11.00 H new ATOM 530 N GLY A 38 -10.607 -14.949 7.670 1.00 41.41 N ATOM 531 CA GLY A 38 -9.464 -15.569 7.042 1.00 23.20 C ATOM 532 C GLY A 38 -8.263 -14.659 7.108 1.00 34.20 C ATOM 533 O GLY A 38 -7.209 -14.943 6.529 1.00 53.14 O ATOM 0 H GLY A 38 -10.531 -14.832 8.680 1.00 41.41 H new ATOM 0 HA2 GLY A 38 -9.239 -16.514 7.537 1.00 23.20 H new ATOM 0 HA3 GLY A 38 -9.695 -15.801 6.002 1.00 23.20 H new ATOM 537 N ALA A 39 -8.418 -13.574 7.854 1.00 2.13 N ATOM 538 CA ALA A 39 -7.399 -12.552 8.003 1.00 33.42 C ATOM 539 C ALA A 39 -6.116 -13.117 8.595 1.00 33.21 C ATOM 540 O ALA A 39 -5.029 -12.787 8.160 1.00 12.11 O ATOM 541 CB ALA A 39 -7.922 -11.429 8.879 1.00 70.41 C ATOM 0 H ALA A 39 -9.270 -13.379 8.380 1.00 2.13 H new ATOM 0 HA ALA A 39 -7.165 -12.167 7.011 1.00 33.42 H new ATOM 0 HB1 ALA A 39 -7.153 -10.664 8.988 1.00 70.41 H new ATOM 0 HB2 ALA A 39 -8.807 -10.991 8.419 1.00 70.41 H new ATOM 0 HB3 ALA A 39 -8.182 -11.824 9.861 1.00 70.41 H new ATOM 547 N GLU A 40 -6.264 -13.997 9.559 1.00 75.43 N ATOM 548 CA GLU A 40 -5.137 -14.583 10.256 1.00 24.04 C ATOM 549 C GLU A 40 -4.671 -15.876 9.583 1.00 34.23 C ATOM 550 O GLU A 40 -3.751 -16.548 10.059 1.00 21.42 O ATOM 551 CB GLU A 40 -5.452 -14.819 11.755 1.00 3.31 C ATOM 552 CG GLU A 40 -6.688 -15.681 12.058 1.00 1.42 C ATOM 553 CD GLU A 40 -8.013 -14.981 11.806 1.00 2.13 C ATOM 554 OE1 GLU A 40 -8.507 -15.001 10.657 1.00 52.34 O ATOM 555 OE2 GLU A 40 -8.593 -14.415 12.757 1.00 2.23 O ATOM 0 H GLU A 40 -7.172 -14.329 9.884 1.00 75.43 H new ATOM 0 HA GLU A 40 -4.318 -13.866 10.200 1.00 24.04 H new ATOM 0 HB2 GLU A 40 -4.584 -15.288 12.218 1.00 3.31 H new ATOM 0 HB3 GLU A 40 -5.584 -13.849 12.235 1.00 3.31 H new ATOM 0 HG2 GLU A 40 -6.645 -16.584 11.449 1.00 1.42 H new ATOM 0 HG3 GLU A 40 -6.650 -15.997 13.100 1.00 1.42 H new ATOM 562 N ASN A 41 -5.310 -16.226 8.496 1.00 75.14 N ATOM 563 CA ASN A 41 -4.910 -17.392 7.724 1.00 23.21 C ATOM 564 C ASN A 41 -4.023 -16.909 6.602 1.00 44.01 C ATOM 565 O ASN A 41 -3.067 -17.591 6.215 1.00 70.44 O ATOM 566 CB ASN A 41 -6.148 -18.101 7.114 1.00 4.23 C ATOM 567 CG ASN A 41 -5.896 -19.508 6.506 1.00 44.10 C ATOM 568 OD1 ASN A 41 -6.808 -20.331 6.459 1.00 40.44 O ATOM 569 ND2 ASN A 41 -4.695 -19.808 6.060 1.00 75.40 N ATOM 0 H ASN A 41 -6.113 -15.723 8.118 1.00 75.14 H new ATOM 0 HA ASN A 41 -4.392 -18.101 8.370 1.00 23.21 H new ATOM 0 HB2 ASN A 41 -6.908 -18.193 7.890 1.00 4.23 H new ATOM 0 HB3 ASN A 41 -6.563 -17.460 6.336 1.00 4.23 H new ATOM 0 HD21 ASN A 41 -4.512 -20.732 5.670 1.00 75.40 H new ATOM 0 HD22 ASN A 41 -3.947 -19.116 6.105 1.00 75.40 H new ATOM 576 N LEU A 42 -4.330 -15.700 6.116 1.00 24.34 N ATOM 577 CA LEU A 42 -3.696 -15.118 4.944 1.00 22.22 C ATOM 578 C LEU A 42 -3.951 -16.040 3.759 1.00 4.14 C ATOM 579 O LEU A 42 -3.114 -16.882 3.438 1.00 53.31 O ATOM 580 CB LEU A 42 -2.181 -14.827 5.131 1.00 22.34 C ATOM 581 CG LEU A 42 -1.775 -13.682 6.089 1.00 22.05 C ATOM 582 CD1 LEU A 42 -2.453 -12.371 5.713 1.00 13.53 C ATOM 583 CD2 LEU A 42 -2.032 -14.039 7.545 1.00 12.11 C ATOM 0 H LEU A 42 -5.036 -15.097 6.537 1.00 24.34 H new ATOM 0 HA LEU A 42 -4.140 -14.139 4.767 1.00 22.22 H new ATOM 0 HB2 LEU A 42 -1.706 -15.742 5.484 1.00 22.34 H new ATOM 0 HB3 LEU A 42 -1.759 -14.607 4.150 1.00 22.34 H new ATOM 0 HG LEU A 42 -0.700 -13.542 5.977 1.00 22.05 H new ATOM 0 HD11 LEU A 42 -2.144 -11.590 6.407 1.00 13.53 H new ATOM 0 HD12 LEU A 42 -2.166 -12.090 4.700 1.00 13.53 H new ATOM 0 HD13 LEU A 42 -3.535 -12.494 5.762 1.00 13.53 H new ATOM 0 HD21 LEU A 42 -1.732 -13.207 8.182 1.00 12.11 H new ATOM 0 HD22 LEU A 42 -3.093 -14.242 7.688 1.00 12.11 H new ATOM 0 HD23 LEU A 42 -1.455 -14.925 7.810 1.00 12.11 H new ATOM 595 N PRO A 43 -5.134 -15.884 3.109 1.00 24.22 N ATOM 596 CA PRO A 43 -5.671 -16.828 2.102 1.00 40.33 C ATOM 597 C PRO A 43 -4.651 -17.357 1.091 1.00 63.14 C ATOM 598 O PRO A 43 -4.371 -18.557 1.039 1.00 3.43 O ATOM 599 CB PRO A 43 -6.776 -16.015 1.389 1.00 74.14 C ATOM 600 CG PRO A 43 -6.617 -14.618 1.889 1.00 42.24 C ATOM 601 CD PRO A 43 -6.058 -14.745 3.265 1.00 71.21 C ATOM 0 HA PRO A 43 -6.020 -17.736 2.593 1.00 40.33 H new ATOM 0 HB2 PRO A 43 -6.662 -16.061 0.306 1.00 74.14 H new ATOM 0 HB3 PRO A 43 -7.766 -16.407 1.622 1.00 74.14 H new ATOM 0 HG2 PRO A 43 -5.949 -14.045 1.246 1.00 42.24 H new ATOM 0 HG3 PRO A 43 -7.573 -14.095 1.901 1.00 42.24 H new ATOM 0 HD2 PRO A 43 -5.541 -13.839 3.582 1.00 71.21 H new ATOM 0 HD3 PRO A 43 -6.833 -14.945 4.005 1.00 71.21 H new ATOM 609 N ALA A 44 -4.076 -16.474 0.318 1.00 23.44 N ATOM 610 CA ALA A 44 -3.156 -16.899 -0.712 1.00 74.21 C ATOM 611 C ALA A 44 -1.729 -17.011 -0.196 1.00 54.23 C ATOM 612 O ALA A 44 -0.876 -17.630 -0.834 1.00 33.32 O ATOM 613 CB ALA A 44 -3.239 -15.982 -1.908 1.00 73.23 C ATOM 0 H ALA A 44 -4.224 -15.466 0.378 1.00 23.44 H new ATOM 0 HA ALA A 44 -3.453 -17.900 -1.026 1.00 74.21 H new ATOM 0 HB1 ALA A 44 -2.539 -16.318 -2.673 1.00 73.23 H new ATOM 0 HB2 ALA A 44 -4.252 -15.999 -2.310 1.00 73.23 H new ATOM 0 HB3 ALA A 44 -2.986 -14.966 -1.606 1.00 73.23 H new ATOM 619 N GLY A 45 -1.482 -16.457 0.973 1.00 54.25 N ATOM 620 CA GLY A 45 -0.146 -16.476 1.546 1.00 62.03 C ATOM 621 C GLY A 45 0.651 -15.246 1.180 1.00 11.21 C ATOM 622 O GLY A 45 1.772 -15.054 1.647 1.00 72.11 O ATOM 0 H GLY A 45 -2.184 -15.989 1.546 1.00 54.25 H new ATOM 0 HA2 GLY A 45 -0.219 -16.549 2.631 1.00 62.03 H new ATOM 0 HA3 GLY A 45 0.382 -17.365 1.201 1.00 62.03 H new ATOM 626 N SER A 46 0.083 -14.419 0.348 1.00 70.24 N ATOM 627 CA SER A 46 0.710 -13.206 -0.070 1.00 73.50 C ATOM 628 C SER A 46 -0.304 -12.072 0.012 1.00 64.04 C ATOM 629 O SER A 46 -1.527 -12.319 0.118 1.00 33.05 O ATOM 630 CB SER A 46 1.246 -13.368 -1.496 1.00 13.23 C ATOM 631 OG SER A 46 2.131 -14.476 -1.573 1.00 10.51 O ATOM 0 H SER A 46 -0.838 -14.574 -0.061 1.00 70.24 H new ATOM 0 HA SER A 46 1.552 -12.971 0.582 1.00 73.50 H new ATOM 0 HB2 SER A 46 0.416 -13.509 -2.189 1.00 13.23 H new ATOM 0 HB3 SER A 46 1.765 -12.459 -1.801 1.00 13.23 H new ATOM 0 HG SER A 46 2.890 -14.249 -2.150 1.00 10.51 H new ATOM 637 N ALA A 47 0.175 -10.855 -0.014 1.00 11.01 N ATOM 638 CA ALA A 47 -0.669 -9.699 0.055 1.00 32.44 C ATOM 639 C ALA A 47 -0.066 -8.589 -0.771 1.00 64.05 C ATOM 640 O ALA A 47 1.169 -8.516 -0.929 1.00 61.12 O ATOM 641 CB ALA A 47 -0.846 -9.263 1.496 1.00 3.11 C ATOM 0 H ALA A 47 1.170 -10.641 -0.084 1.00 11.01 H new ATOM 0 HA ALA A 47 -1.653 -9.943 -0.346 1.00 32.44 H new ATOM 0 HB1 ALA A 47 -1.489 -8.384 1.534 1.00 3.11 H new ATOM 0 HB2 ALA A 47 -1.302 -10.071 2.067 1.00 3.11 H new ATOM 0 HB3 ALA A 47 0.126 -9.020 1.925 1.00 3.11 H new ATOM 647 N LEU A 48 -0.906 -7.743 -1.292 1.00 11.21 N ATOM 648 CA LEU A 48 -0.487 -6.660 -2.134 1.00 10.55 C ATOM 649 C LEU A 48 -1.258 -5.392 -1.797 1.00 44.34 C ATOM 650 O LEU A 48 -2.404 -5.460 -1.350 1.00 63.22 O ATOM 651 CB LEU A 48 -0.602 -7.063 -3.645 1.00 73.14 C ATOM 652 CG LEU A 48 -1.918 -7.711 -4.151 1.00 63.01 C ATOM 653 CD1 LEU A 48 -3.075 -6.732 -4.215 1.00 70.24 C ATOM 654 CD2 LEU A 48 -1.693 -8.365 -5.505 1.00 34.15 C ATOM 0 H LEU A 48 -1.914 -7.786 -1.142 1.00 11.21 H new ATOM 0 HA LEU A 48 0.565 -6.444 -1.947 1.00 10.55 H new ATOM 0 HB2 LEU A 48 -0.427 -6.166 -4.239 1.00 73.14 H new ATOM 0 HB3 LEU A 48 0.211 -7.755 -3.864 1.00 73.14 H new ATOM 0 HG LEU A 48 -2.198 -8.471 -3.422 1.00 63.01 H new ATOM 0 HD11 LEU A 48 -3.966 -7.245 -4.576 1.00 70.24 H new ATOM 0 HD12 LEU A 48 -3.266 -6.329 -3.220 1.00 70.24 H new ATOM 0 HD13 LEU A 48 -2.825 -5.917 -4.895 1.00 70.24 H new ATOM 0 HD21 LEU A 48 -2.623 -8.816 -5.850 1.00 34.15 H new ATOM 0 HD22 LEU A 48 -1.367 -7.612 -6.223 1.00 34.15 H new ATOM 0 HD23 LEU A 48 -0.928 -9.136 -5.414 1.00 34.15 H new ATOM 666 N LEU A 49 -0.643 -4.256 -1.962 1.00 65.02 N ATOM 667 CA LEU A 49 -1.336 -3.018 -1.709 1.00 41.31 C ATOM 668 C LEU A 49 -1.673 -2.378 -3.027 1.00 2.25 C ATOM 669 O LEU A 49 -0.839 -2.348 -3.943 1.00 14.43 O ATOM 670 CB LEU A 49 -0.567 -2.022 -0.784 1.00 4.02 C ATOM 671 CG LEU A 49 0.704 -1.314 -1.327 1.00 25.45 C ATOM 672 CD1 LEU A 49 1.091 -0.183 -0.396 1.00 42.31 C ATOM 673 CD2 LEU A 49 1.879 -2.267 -1.438 1.00 13.42 C ATOM 0 H LEU A 49 0.325 -4.157 -2.267 1.00 65.02 H new ATOM 0 HA LEU A 49 -2.241 -3.265 -1.154 1.00 41.31 H new ATOM 0 HB2 LEU A 49 -1.270 -1.247 -0.480 1.00 4.02 H new ATOM 0 HB3 LEU A 49 -0.281 -2.565 0.117 1.00 4.02 H new ATOM 0 HG LEU A 49 0.468 -0.937 -2.322 1.00 25.45 H new ATOM 0 HD11 LEU A 49 1.983 0.313 -0.778 1.00 42.31 H new ATOM 0 HD12 LEU A 49 0.273 0.535 -0.337 1.00 42.31 H new ATOM 0 HD13 LEU A 49 1.295 -0.583 0.597 1.00 42.31 H new ATOM 0 HD21 LEU A 49 2.747 -1.731 -1.822 1.00 13.42 H new ATOM 0 HD22 LEU A 49 2.110 -2.676 -0.454 1.00 13.42 H new ATOM 0 HD23 LEU A 49 1.625 -3.080 -2.118 1.00 13.42 H new ATOM 685 N VAL A 50 -2.884 -1.927 -3.149 1.00 51.01 N ATOM 686 CA VAL A 50 -3.351 -1.313 -4.364 1.00 72.45 C ATOM 687 C VAL A 50 -3.624 0.142 -4.092 1.00 22.43 C ATOM 688 O VAL A 50 -4.324 0.474 -3.130 1.00 14.02 O ATOM 689 CB VAL A 50 -4.670 -1.974 -4.871 1.00 60.43 C ATOM 690 CG1 VAL A 50 -5.110 -1.384 -6.207 1.00 70.23 C ATOM 691 CG2 VAL A 50 -4.529 -3.482 -4.980 1.00 74.10 C ATOM 0 H VAL A 50 -3.583 -1.973 -2.408 1.00 51.01 H new ATOM 0 HA VAL A 50 -2.584 -1.440 -5.128 1.00 72.45 H new ATOM 0 HB VAL A 50 -5.441 -1.757 -4.132 1.00 60.43 H new ATOM 0 HG11 VAL A 50 -6.032 -1.866 -6.532 1.00 70.23 H new ATOM 0 HG12 VAL A 50 -5.281 -0.314 -6.093 1.00 70.23 H new ATOM 0 HG13 VAL A 50 -4.332 -1.550 -6.952 1.00 70.23 H new ATOM 0 HG21 VAL A 50 -5.466 -3.910 -5.336 1.00 74.10 H new ATOM 0 HG22 VAL A 50 -3.730 -3.723 -5.682 1.00 74.10 H new ATOM 0 HG23 VAL A 50 -4.289 -3.897 -4.001 1.00 74.10 H new ATOM 701 N VAL A 51 -3.075 1.006 -4.894 1.00 11.15 N ATOM 702 CA VAL A 51 -3.349 2.410 -4.757 1.00 35.42 C ATOM 703 C VAL A 51 -4.715 2.642 -5.351 1.00 63.44 C ATOM 704 O VAL A 51 -4.937 2.379 -6.531 1.00 64.33 O ATOM 705 CB VAL A 51 -2.299 3.278 -5.487 1.00 24.22 C ATOM 706 CG1 VAL A 51 -2.527 4.755 -5.196 1.00 33.22 C ATOM 707 CG2 VAL A 51 -0.884 2.860 -5.098 1.00 22.34 C ATOM 0 H VAL A 51 -2.435 0.766 -5.651 1.00 11.15 H new ATOM 0 HA VAL A 51 -3.310 2.696 -3.706 1.00 35.42 H new ATOM 0 HB VAL A 51 -2.414 3.121 -6.559 1.00 24.22 H new ATOM 0 HG11 VAL A 51 -1.777 5.349 -5.719 1.00 33.22 H new ATOM 0 HG12 VAL A 51 -3.521 5.044 -5.537 1.00 33.22 H new ATOM 0 HG13 VAL A 51 -2.446 4.931 -4.123 1.00 33.22 H new ATOM 0 HG21 VAL A 51 -0.162 3.485 -5.624 1.00 22.34 H new ATOM 0 HG22 VAL A 51 -0.752 2.980 -4.023 1.00 22.34 H new ATOM 0 HG23 VAL A 51 -0.726 1.816 -5.369 1.00 22.34 H new ATOM 717 N LYS A 52 -5.630 3.098 -4.545 1.00 73.43 N ATOM 718 CA LYS A 52 -6.985 3.252 -4.991 1.00 11.21 C ATOM 719 C LYS A 52 -7.174 4.634 -5.578 1.00 5.13 C ATOM 720 O LYS A 52 -7.911 4.821 -6.549 1.00 61.14 O ATOM 721 CB LYS A 52 -7.955 3.004 -3.825 1.00 52.11 C ATOM 722 CG LYS A 52 -9.421 2.916 -4.223 1.00 44.31 C ATOM 723 CD LYS A 52 -9.651 1.778 -5.212 1.00 50.21 C ATOM 724 CE LYS A 52 -11.119 1.609 -5.561 1.00 63.21 C ATOM 725 NZ LYS A 52 -11.936 1.225 -4.387 1.00 31.43 N ATOM 0 H LYS A 52 -5.463 3.370 -3.576 1.00 73.43 H new ATOM 0 HA LYS A 52 -7.200 2.518 -5.768 1.00 11.21 H new ATOM 0 HB2 LYS A 52 -7.672 2.077 -3.326 1.00 52.11 H new ATOM 0 HB3 LYS A 52 -7.838 3.806 -3.097 1.00 52.11 H new ATOM 0 HG2 LYS A 52 -10.034 2.761 -3.335 1.00 44.31 H new ATOM 0 HG3 LYS A 52 -9.738 3.859 -4.668 1.00 44.31 H new ATOM 0 HD2 LYS A 52 -9.083 1.970 -6.122 1.00 50.21 H new ATOM 0 HD3 LYS A 52 -9.271 0.848 -4.788 1.00 50.21 H new ATOM 0 HE2 LYS A 52 -11.501 2.541 -5.977 1.00 63.21 H new ATOM 0 HE3 LYS A 52 -11.221 0.849 -6.336 1.00 63.21 H new ATOM 0 HZ1 LYS A 52 -12.880 0.925 -4.704 1.00 31.43 H new ATOM 0 HZ2 LYS A 52 -11.474 0.441 -3.884 1.00 31.43 H new ATOM 0 HZ3 LYS A 52 -12.029 2.040 -3.747 1.00 31.43 H new ATOM 739 N ARG A 53 -6.475 5.582 -5.014 1.00 71.43 N ATOM 740 CA ARG A 53 -6.541 6.957 -5.450 1.00 43.41 C ATOM 741 C ARG A 53 -5.177 7.556 -5.299 1.00 22.04 C ATOM 742 O ARG A 53 -4.507 7.310 -4.304 1.00 3.20 O ATOM 743 CB ARG A 53 -7.562 7.742 -4.617 1.00 5.12 C ATOM 744 CG ARG A 53 -7.802 9.206 -5.042 1.00 53.21 C ATOM 745 CD ARG A 53 -8.429 9.338 -6.443 1.00 24.22 C ATOM 746 NE ARG A 53 -7.457 9.224 -7.551 1.00 44.13 N ATOM 747 CZ ARG A 53 -7.509 8.336 -8.561 1.00 70.24 C ATOM 748 NH1 ARG A 53 -8.352 7.305 -8.517 1.00 45.34 N ATOM 749 NH2 ARG A 53 -6.684 8.464 -9.592 1.00 62.15 N ATOM 0 H ARG A 53 -5.838 5.424 -4.233 1.00 71.43 H new ATOM 0 HA ARG A 53 -6.861 7.001 -6.491 1.00 43.41 H new ATOM 0 HB2 ARG A 53 -8.514 7.213 -4.654 1.00 5.12 H new ATOM 0 HB3 ARG A 53 -7.234 7.736 -3.577 1.00 5.12 H new ATOM 0 HG2 ARG A 53 -8.454 9.687 -4.313 1.00 53.21 H new ATOM 0 HG3 ARG A 53 -6.853 9.743 -5.024 1.00 53.21 H new ATOM 0 HD2 ARG A 53 -9.192 8.569 -6.562 1.00 24.22 H new ATOM 0 HD3 ARG A 53 -8.934 10.301 -6.514 1.00 24.22 H new ATOM 0 HE ARG A 53 -6.675 9.879 -7.550 1.00 44.13 H new ATOM 0 HH11 ARG A 53 -8.966 7.183 -7.712 1.00 45.34 H new ATOM 0 HH12 ARG A 53 -8.383 6.638 -9.288 1.00 45.34 H new ATOM 0 HH21 ARG A 53 -6.014 9.233 -9.617 1.00 62.15 H new ATOM 0 HH22 ARG A 53 -6.720 7.794 -10.360 1.00 62.15 H new ATOM 763 N GLY A 54 -4.770 8.298 -6.278 1.00 14.24 N ATOM 764 CA GLY A 54 -3.480 8.908 -6.279 1.00 11.13 C ATOM 765 C GLY A 54 -2.935 8.923 -7.679 1.00 1.32 C ATOM 766 O GLY A 54 -3.661 8.569 -8.607 1.00 15.53 O ATOM 0 H GLY A 54 -5.329 8.499 -7.107 1.00 14.24 H new ATOM 0 HA2 GLY A 54 -3.546 9.925 -5.892 1.00 11.13 H new ATOM 0 HA3 GLY A 54 -2.806 8.360 -5.621 1.00 11.13 H new ATOM 770 N PRO A 55 -1.668 9.294 -7.874 1.00 12.11 N ATOM 771 CA PRO A 55 -1.056 9.348 -9.212 1.00 54.24 C ATOM 772 C PRO A 55 -0.915 7.947 -9.809 1.00 51.32 C ATOM 773 O PRO A 55 -1.233 7.704 -10.979 1.00 35.21 O ATOM 774 CB PRO A 55 0.335 9.952 -8.958 1.00 23.22 C ATOM 775 CG PRO A 55 0.293 10.494 -7.564 1.00 35.34 C ATOM 776 CD PRO A 55 -0.730 9.702 -6.820 1.00 61.11 C ATOM 0 HA PRO A 55 -1.655 9.925 -9.917 1.00 54.24 H new ATOM 0 HB2 PRO A 55 1.114 9.197 -9.061 1.00 23.22 H new ATOM 0 HB3 PRO A 55 0.557 10.740 -9.678 1.00 23.22 H new ATOM 0 HG2 PRO A 55 1.269 10.408 -7.087 1.00 35.34 H new ATOM 0 HG3 PRO A 55 0.033 11.552 -7.569 1.00 35.34 H new ATOM 0 HD2 PRO A 55 -0.287 8.841 -6.319 1.00 61.11 H new ATOM 0 HD3 PRO A 55 -1.222 10.299 -6.052 1.00 61.11 H new ATOM 784 N ASN A 56 -0.474 7.031 -8.987 1.00 30.33 N ATOM 785 CA ASN A 56 -0.278 5.637 -9.370 1.00 35.24 C ATOM 786 C ASN A 56 -1.497 4.775 -9.039 1.00 12.13 C ATOM 787 O ASN A 56 -1.387 3.554 -8.923 1.00 34.34 O ATOM 788 CB ASN A 56 1.004 5.054 -8.731 1.00 40.12 C ATOM 789 CG ASN A 56 1.176 5.409 -7.263 1.00 0.05 C ATOM 790 OD1 ASN A 56 0.220 5.682 -6.550 1.00 63.34 O ATOM 791 ND2 ASN A 56 2.393 5.402 -6.804 1.00 42.52 N ATOM 0 H ASN A 56 -0.234 7.225 -8.015 1.00 30.33 H new ATOM 0 HA ASN A 56 -0.154 5.619 -10.453 1.00 35.24 H new ATOM 0 HB2 ASN A 56 0.988 3.969 -8.833 1.00 40.12 H new ATOM 0 HB3 ASN A 56 1.871 5.414 -9.286 1.00 40.12 H new ATOM 0 HD21 ASN A 56 2.570 5.628 -5.825 1.00 42.52 H new ATOM 0 HD22 ASN A 56 3.170 5.170 -7.423 1.00 42.52 H new ATOM 798 N ALA A 57 -2.661 5.411 -8.918 1.00 61.42 N ATOM 799 CA ALA A 57 -3.906 4.706 -8.629 1.00 62.10 C ATOM 800 C ALA A 57 -4.177 3.630 -9.665 1.00 31.22 C ATOM 801 O ALA A 57 -4.124 3.884 -10.879 1.00 52.34 O ATOM 802 CB ALA A 57 -5.064 5.666 -8.580 1.00 42.25 C ATOM 0 H ALA A 57 -2.767 6.421 -9.017 1.00 61.42 H new ATOM 0 HA ALA A 57 -3.797 4.232 -7.654 1.00 62.10 H new ATOM 0 HB1 ALA A 57 -5.981 5.119 -8.363 1.00 42.25 H new ATOM 0 HB2 ALA A 57 -4.890 6.406 -7.799 1.00 42.25 H new ATOM 0 HB3 ALA A 57 -5.160 6.169 -9.542 1.00 42.25 H new ATOM 808 N GLY A 58 -4.458 2.451 -9.193 1.00 64.41 N ATOM 809 CA GLY A 58 -4.690 1.333 -10.054 1.00 14.12 C ATOM 810 C GLY A 58 -3.546 0.356 -10.005 1.00 35.34 C ATOM 811 O GLY A 58 -3.703 -0.814 -10.346 1.00 74.30 O ATOM 0 H GLY A 58 -4.532 2.239 -8.198 1.00 64.41 H new ATOM 0 HA2 GLY A 58 -5.612 0.831 -9.761 1.00 14.12 H new ATOM 0 HA3 GLY A 58 -4.829 1.682 -11.077 1.00 14.12 H new ATOM 815 N ALA A 59 -2.391 0.826 -9.587 1.00 2.53 N ATOM 816 CA ALA A 59 -1.224 -0.022 -9.484 1.00 63.32 C ATOM 817 C ALA A 59 -1.259 -0.806 -8.188 1.00 72.42 C ATOM 818 O ALA A 59 -1.776 -0.322 -7.167 1.00 12.45 O ATOM 819 CB ALA A 59 0.054 0.797 -9.571 1.00 51.33 C ATOM 0 H ALA A 59 -2.235 1.796 -9.312 1.00 2.53 H new ATOM 0 HA ALA A 59 -1.236 -0.721 -10.320 1.00 63.32 H new ATOM 0 HB1 ALA A 59 0.916 0.135 -9.491 1.00 51.33 H new ATOM 0 HB2 ALA A 59 0.086 1.321 -10.526 1.00 51.33 H new ATOM 0 HB3 ALA A 59 0.077 1.523 -8.758 1.00 51.33 H new ATOM 825 N ARG A 60 -0.732 -2.003 -8.229 1.00 54.25 N ATOM 826 CA ARG A 60 -0.684 -2.846 -7.072 1.00 23.14 C ATOM 827 C ARG A 60 0.734 -3.342 -6.891 1.00 35.31 C ATOM 828 O ARG A 60 1.420 -3.652 -7.870 1.00 43.42 O ATOM 829 CB ARG A 60 -1.679 -4.012 -7.202 1.00 43.34 C ATOM 830 CG ARG A 60 -1.387 -4.984 -8.332 1.00 11.20 C ATOM 831 CD ARG A 60 -2.492 -6.009 -8.482 1.00 54.34 C ATOM 832 NE ARG A 60 -2.174 -7.001 -9.512 1.00 11.44 N ATOM 833 CZ ARG A 60 -2.935 -7.287 -10.575 1.00 53.23 C ATOM 834 NH1 ARG A 60 -3.970 -6.516 -10.892 1.00 2.22 N ATOM 835 NH2 ARG A 60 -2.612 -8.305 -11.361 1.00 61.25 N ATOM 0 H ARG A 60 -0.325 -2.417 -9.068 1.00 54.25 H new ATOM 0 HA ARG A 60 -0.977 -2.278 -6.189 1.00 23.14 H new ATOM 0 HB2 ARG A 60 -1.692 -4.564 -6.262 1.00 43.34 H new ATOM 0 HB3 ARG A 60 -2.679 -3.602 -7.345 1.00 43.34 H new ATOM 0 HG2 ARG A 60 -1.271 -4.434 -9.266 1.00 11.20 H new ATOM 0 HG3 ARG A 60 -0.442 -5.492 -8.141 1.00 11.20 H new ATOM 0 HD2 ARG A 60 -2.653 -6.513 -7.529 1.00 54.34 H new ATOM 0 HD3 ARG A 60 -3.424 -5.505 -8.738 1.00 54.34 H new ATOM 0 HE ARG A 60 -1.300 -7.517 -9.410 1.00 11.44 H new ATOM 0 HH11 ARG A 60 -4.190 -5.698 -10.323 1.00 2.22 H new ATOM 0 HH12 ARG A 60 -4.544 -6.742 -11.704 1.00 2.22 H new ATOM 0 HH21 ARG A 60 -1.786 -8.867 -11.154 1.00 61.25 H new ATOM 0 HH22 ARG A 60 -3.189 -8.526 -12.172 1.00 61.25 H new ATOM 849 N PHE A 61 1.186 -3.375 -5.678 1.00 53.33 N ATOM 850 CA PHE A 61 2.538 -3.797 -5.386 1.00 4.14 C ATOM 851 C PHE A 61 2.492 -4.972 -4.435 1.00 2.22 C ATOM 852 O PHE A 61 1.781 -4.926 -3.430 1.00 41.03 O ATOM 853 CB PHE A 61 3.335 -2.642 -4.772 1.00 4.14 C ATOM 854 CG PHE A 61 3.352 -1.387 -5.614 1.00 61.25 C ATOM 855 CD1 PHE A 61 4.282 -1.226 -6.620 1.00 13.55 C ATOM 856 CD2 PHE A 61 2.436 -0.367 -5.383 1.00 73.31 C ATOM 857 CE1 PHE A 61 4.302 -0.078 -7.385 1.00 41.50 C ATOM 858 CE2 PHE A 61 2.450 0.781 -6.145 1.00 21.34 C ATOM 859 CZ PHE A 61 3.384 0.927 -7.146 1.00 13.43 C ATOM 0 H PHE A 61 0.639 -3.113 -4.858 1.00 53.33 H new ATOM 0 HA PHE A 61 3.034 -4.097 -6.309 1.00 4.14 H new ATOM 0 HB2 PHE A 61 2.916 -2.405 -3.794 1.00 4.14 H new ATOM 0 HB3 PHE A 61 4.361 -2.970 -4.608 1.00 4.14 H new ATOM 0 HD1 PHE A 61 5.003 -2.007 -6.811 1.00 13.55 H new ATOM 0 HD2 PHE A 61 1.704 -0.476 -4.596 1.00 73.31 H new ATOM 0 HE1 PHE A 61 5.035 0.035 -8.170 1.00 41.50 H new ATOM 0 HE2 PHE A 61 1.730 1.564 -5.958 1.00 21.34 H new ATOM 0 HZ PHE A 61 3.399 1.826 -7.744 1.00 13.43 H new ATOM 869 N LEU A 62 3.218 -6.015 -4.752 1.00 52.32 N ATOM 870 CA LEU A 62 3.211 -7.227 -3.952 1.00 63.34 C ATOM 871 C LEU A 62 4.278 -7.144 -2.875 1.00 21.41 C ATOM 872 O LEU A 62 5.457 -6.894 -3.173 1.00 30.12 O ATOM 873 CB LEU A 62 3.467 -8.447 -4.851 1.00 24.34 C ATOM 874 CG LEU A 62 3.459 -9.821 -4.171 1.00 1.14 C ATOM 875 CD1 LEU A 62 2.084 -10.145 -3.618 1.00 35.31 C ATOM 876 CD2 LEU A 62 3.923 -10.901 -5.136 1.00 65.23 C ATOM 0 H LEU A 62 3.830 -6.054 -5.567 1.00 52.32 H new ATOM 0 HA LEU A 62 2.236 -7.333 -3.476 1.00 63.34 H new ATOM 0 HB2 LEU A 62 2.713 -8.453 -5.638 1.00 24.34 H new ATOM 0 HB3 LEU A 62 4.434 -8.314 -5.337 1.00 24.34 H new ATOM 0 HG LEU A 62 4.157 -9.789 -3.335 1.00 1.14 H new ATOM 0 HD11 LEU A 62 2.105 -11.125 -3.141 1.00 35.31 H new ATOM 0 HD12 LEU A 62 1.800 -9.390 -2.885 1.00 35.31 H new ATOM 0 HD13 LEU A 62 1.358 -10.153 -4.431 1.00 35.31 H new ATOM 0 HD21 LEU A 62 3.910 -11.868 -4.633 1.00 65.23 H new ATOM 0 HD22 LEU A 62 3.256 -10.931 -5.997 1.00 65.23 H new ATOM 0 HD23 LEU A 62 4.937 -10.679 -5.470 1.00 65.23 H new ATOM 888 N LEU A 63 3.881 -7.361 -1.640 1.00 10.42 N ATOM 889 CA LEU A 63 4.813 -7.296 -0.543 1.00 72.43 C ATOM 890 C LEU A 63 5.549 -8.617 -0.436 1.00 33.12 C ATOM 891 O LEU A 63 4.987 -9.615 0.008 1.00 44.11 O ATOM 892 CB LEU A 63 4.114 -6.977 0.811 1.00 63.42 C ATOM 893 CG LEU A 63 3.406 -5.606 0.975 1.00 63.52 C ATOM 894 CD1 LEU A 63 2.163 -5.494 0.113 1.00 1.30 C ATOM 895 CD2 LEU A 63 3.047 -5.366 2.427 1.00 42.21 C ATOM 0 H LEU A 63 2.922 -7.583 -1.374 1.00 10.42 H new ATOM 0 HA LEU A 63 5.510 -6.483 -0.747 1.00 72.43 H new ATOM 0 HB2 LEU A 63 3.374 -7.756 0.993 1.00 63.42 H new ATOM 0 HB3 LEU A 63 4.863 -7.059 1.598 1.00 63.42 H new ATOM 0 HG LEU A 63 4.109 -4.843 0.642 1.00 63.52 H new ATOM 0 HD11 LEU A 63 1.703 -4.517 0.263 1.00 1.30 H new ATOM 0 HD12 LEU A 63 2.436 -5.610 -0.936 1.00 1.30 H new ATOM 0 HD13 LEU A 63 1.455 -6.275 0.392 1.00 1.30 H new ATOM 0 HD21 LEU A 63 2.551 -4.400 2.524 1.00 42.21 H new ATOM 0 HD22 LEU A 63 2.377 -6.154 2.771 1.00 42.21 H new ATOM 0 HD23 LEU A 63 3.954 -5.371 3.032 1.00 42.21 H new ATOM 907 N ASP A 64 6.779 -8.624 -0.881 1.00 24.54 N ATOM 908 CA ASP A 64 7.643 -9.811 -0.808 1.00 50.10 C ATOM 909 C ASP A 64 8.941 -9.409 -0.117 1.00 11.22 C ATOM 910 O ASP A 64 9.868 -10.187 0.065 1.00 30.02 O ATOM 911 CB ASP A 64 7.911 -10.352 -2.235 1.00 3.13 C ATOM 912 CG ASP A 64 8.752 -11.622 -2.275 1.00 24.45 C ATOM 913 OD1 ASP A 64 8.207 -12.725 -2.032 1.00 52.20 O ATOM 914 OD2 ASP A 64 9.974 -11.544 -2.560 1.00 71.14 O ATOM 0 H ASP A 64 7.226 -7.813 -1.308 1.00 24.54 H new ATOM 0 HA ASP A 64 7.162 -10.606 -0.238 1.00 50.10 H new ATOM 0 HB2 ASP A 64 6.956 -10.547 -2.723 1.00 3.13 H new ATOM 0 HB3 ASP A 64 8.414 -9.579 -2.816 1.00 3.13 H new ATOM 919 N GLN A 65 8.949 -8.193 0.333 1.00 62.52 N ATOM 920 CA GLN A 65 10.099 -7.580 0.943 1.00 61.21 C ATOM 921 C GLN A 65 9.851 -7.452 2.436 1.00 55.04 C ATOM 922 O GLN A 65 8.711 -7.332 2.859 1.00 53.32 O ATOM 923 CB GLN A 65 10.343 -6.204 0.287 1.00 5.40 C ATOM 924 CG GLN A 65 9.104 -5.319 0.272 1.00 44.40 C ATOM 925 CD GLN A 65 9.224 -4.067 -0.585 1.00 13.24 C ATOM 926 OE1 GLN A 65 8.230 -3.605 -1.139 1.00 22.25 O ATOM 927 NE2 GLN A 65 10.391 -3.489 -0.674 1.00 64.25 N ATOM 0 H GLN A 65 8.136 -7.578 0.287 1.00 62.52 H new ATOM 0 HA GLN A 65 10.991 -8.189 0.794 1.00 61.21 H new ATOM 0 HB2 GLN A 65 11.142 -5.690 0.822 1.00 5.40 H new ATOM 0 HB3 GLN A 65 10.688 -6.352 -0.736 1.00 5.40 H new ATOM 0 HG2 GLN A 65 8.259 -5.907 -0.085 1.00 44.40 H new ATOM 0 HG3 GLN A 65 8.875 -5.021 1.295 1.00 44.40 H new ATOM 0 HE21 GLN A 65 11.199 -3.896 -0.203 1.00 64.25 H new ATOM 0 HE22 GLN A 65 10.495 -2.630 -1.215 1.00 64.25 H new ATOM 936 N PRO A 66 10.906 -7.506 3.260 1.00 11.13 N ATOM 937 CA PRO A 66 10.774 -7.430 4.723 1.00 4.50 C ATOM 938 C PRO A 66 10.377 -6.031 5.219 1.00 71.22 C ATOM 939 O PRO A 66 9.960 -5.856 6.376 1.00 25.42 O ATOM 940 CB PRO A 66 12.180 -7.792 5.224 1.00 71.04 C ATOM 941 CG PRO A 66 13.089 -7.419 4.104 1.00 24.41 C ATOM 942 CD PRO A 66 12.319 -7.684 2.845 1.00 3.12 C ATOM 0 HA PRO A 66 9.985 -8.088 5.088 1.00 4.50 H new ATOM 0 HB2 PRO A 66 12.429 -7.246 6.134 1.00 71.04 H new ATOM 0 HB3 PRO A 66 12.256 -8.854 5.458 1.00 71.04 H new ATOM 0 HG2 PRO A 66 13.381 -6.371 4.170 1.00 24.41 H new ATOM 0 HG3 PRO A 66 14.006 -8.008 4.132 1.00 24.41 H new ATOM 0 HD2 PRO A 66 12.595 -6.989 2.052 1.00 3.12 H new ATOM 0 HD3 PRO A 66 12.503 -8.689 2.466 1.00 3.12 H new ATOM 950 N THR A 67 10.526 -5.049 4.367 1.00 52.12 N ATOM 951 CA THR A 67 10.219 -3.679 4.686 1.00 5.43 C ATOM 952 C THR A 67 9.889 -2.927 3.394 1.00 74.30 C ATOM 953 O THR A 67 10.624 -3.038 2.412 1.00 53.02 O ATOM 954 CB THR A 67 11.428 -2.991 5.399 1.00 5.14 C ATOM 955 OG1 THR A 67 11.740 -3.707 6.610 1.00 35.41 O ATOM 956 CG2 THR A 67 11.122 -1.539 5.748 1.00 53.53 C ATOM 0 H THR A 67 10.870 -5.182 3.416 1.00 52.12 H new ATOM 0 HA THR A 67 9.364 -3.657 5.362 1.00 5.43 H new ATOM 0 HB THR A 67 12.275 -3.008 4.713 1.00 5.14 H new ATOM 0 HG1 THR A 67 12.499 -3.278 7.057 1.00 35.41 H new ATOM 0 HG21 THR A 67 11.986 -1.094 6.242 1.00 53.53 H new ATOM 0 HG22 THR A 67 10.900 -0.985 4.836 1.00 53.53 H new ATOM 0 HG23 THR A 67 10.261 -1.499 6.416 1.00 53.53 H new ATOM 964 N THR A 68 8.774 -2.246 3.384 1.00 62.23 N ATOM 965 CA THR A 68 8.391 -1.417 2.272 1.00 55.24 C ATOM 966 C THR A 68 8.280 0.025 2.766 1.00 74.54 C ATOM 967 O THR A 68 7.542 0.303 3.706 1.00 1.11 O ATOM 968 CB THR A 68 7.021 -1.844 1.696 1.00 73.41 C ATOM 969 OG1 THR A 68 6.996 -3.254 1.462 1.00 24.10 O ATOM 970 CG2 THR A 68 6.760 -1.130 0.387 1.00 50.52 C ATOM 0 H THR A 68 8.102 -2.251 4.151 1.00 62.23 H new ATOM 0 HA THR A 68 9.142 -1.516 1.488 1.00 55.24 H new ATOM 0 HB THR A 68 6.251 -1.580 2.421 1.00 73.41 H new ATOM 0 HG1 THR A 68 6.122 -3.510 1.099 1.00 24.10 H new ATOM 0 HG21 THR A 68 5.793 -1.439 -0.009 1.00 50.52 H new ATOM 0 HG22 THR A 68 6.757 -0.053 0.554 1.00 50.52 H new ATOM 0 HG23 THR A 68 7.543 -1.384 -0.328 1.00 50.52 H new ATOM 978 N THR A 69 9.031 0.909 2.189 1.00 4.34 N ATOM 979 CA THR A 69 8.952 2.300 2.546 1.00 22.12 C ATOM 980 C THR A 69 8.030 3.031 1.565 1.00 25.45 C ATOM 981 O THR A 69 8.162 2.870 0.341 1.00 65.54 O ATOM 982 CB THR A 69 10.352 2.937 2.527 1.00 22.35 C ATOM 983 OG1 THR A 69 11.223 2.175 3.371 1.00 1.40 O ATOM 984 CG2 THR A 69 10.307 4.378 3.027 1.00 45.25 C ATOM 0 H THR A 69 9.713 0.695 1.462 1.00 4.34 H new ATOM 0 HA THR A 69 8.546 2.385 3.554 1.00 22.12 H new ATOM 0 HB THR A 69 10.718 2.939 1.500 1.00 22.35 H new ATOM 0 HG1 THR A 69 12.118 2.574 3.363 1.00 1.40 H new ATOM 0 HG21 THR A 69 11.310 4.803 3.003 1.00 45.25 H new ATOM 0 HG22 THR A 69 9.649 4.965 2.387 1.00 45.25 H new ATOM 0 HG23 THR A 69 9.930 4.397 4.049 1.00 45.25 H new ATOM 992 N ALA A 70 7.096 3.783 2.093 1.00 73.12 N ATOM 993 CA ALA A 70 6.177 4.542 1.287 1.00 2.03 C ATOM 994 C ALA A 70 6.289 6.021 1.616 1.00 40.13 C ATOM 995 O ALA A 70 6.452 6.399 2.798 1.00 51.53 O ATOM 996 CB ALA A 70 4.756 4.050 1.506 1.00 64.43 C ATOM 0 H ALA A 70 6.953 3.885 3.098 1.00 73.12 H new ATOM 0 HA ALA A 70 6.431 4.403 0.236 1.00 2.03 H new ATOM 0 HB1 ALA A 70 4.070 4.632 0.891 1.00 64.43 H new ATOM 0 HB2 ALA A 70 4.688 2.998 1.229 1.00 64.43 H new ATOM 0 HB3 ALA A 70 4.489 4.166 2.556 1.00 64.43 H new ATOM 1002 N GLY A 71 6.236 6.834 0.589 1.00 30.13 N ATOM 1003 CA GLY A 71 6.311 8.264 0.728 1.00 51.44 C ATOM 1004 C GLY A 71 6.774 8.864 -0.571 1.00 43.23 C ATOM 1005 O GLY A 71 6.678 8.206 -1.614 1.00 24.31 O ATOM 0 H GLY A 71 6.139 6.516 -0.375 1.00 30.13 H new ATOM 0 HA2 GLY A 71 5.335 8.666 1.001 1.00 51.44 H new ATOM 0 HA3 GLY A 71 7.000 8.528 1.530 1.00 51.44 H new ATOM 1009 N ARG A 72 7.263 10.075 -0.550 1.00 65.10 N ATOM 1010 CA ARG A 72 7.776 10.660 -1.751 1.00 45.51 C ATOM 1011 C ARG A 72 9.235 10.992 -1.567 1.00 22.34 C ATOM 1012 O ARG A 72 9.570 11.864 -0.758 1.00 50.21 O ATOM 1013 CB ARG A 72 6.995 11.934 -2.146 1.00 14.24 C ATOM 1014 CG ARG A 72 7.488 12.550 -3.451 1.00 61.51 C ATOM 1015 CD ARG A 72 6.621 13.698 -3.956 1.00 53.33 C ATOM 1016 NE ARG A 72 6.659 14.900 -3.114 1.00 11.04 N ATOM 1017 CZ ARG A 72 6.695 16.164 -3.600 1.00 33.44 C ATOM 1018 NH1 ARG A 72 6.731 16.389 -4.916 1.00 72.03 N ATOM 1019 NH2 ARG A 72 6.684 17.192 -2.770 1.00 25.10 N ATOM 0 H ARG A 72 7.315 10.668 0.279 1.00 65.10 H new ATOM 0 HA ARG A 72 7.657 9.935 -2.556 1.00 45.51 H new ATOM 0 HB2 ARG A 72 5.937 11.691 -2.242 1.00 14.24 H new ATOM 0 HB3 ARG A 72 7.082 12.670 -1.347 1.00 14.24 H new ATOM 0 HG2 ARG A 72 8.507 12.911 -3.309 1.00 61.51 H new ATOM 0 HG3 ARG A 72 7.529 11.774 -4.216 1.00 61.51 H new ATOM 0 HD2 ARG A 72 6.942 13.964 -4.963 1.00 53.33 H new ATOM 0 HD3 ARG A 72 5.590 13.353 -4.030 1.00 53.33 H new ATOM 0 HE ARG A 72 6.658 14.776 -2.102 1.00 11.04 H new ATOM 0 HH11 ARG A 72 6.732 15.604 -5.568 1.00 72.03 H new ATOM 0 HH12 ARG A 72 6.758 17.345 -5.269 1.00 72.03 H new ATOM 0 HH21 ARG A 72 6.648 17.034 -1.763 1.00 25.10 H new ATOM 0 HH22 ARG A 72 6.711 18.144 -3.136 1.00 25.10 H new ATOM 1033 N HIS A 73 10.054 10.329 -2.375 1.00 35.31 N ATOM 1034 CA HIS A 73 11.508 10.480 -2.492 1.00 54.33 C ATOM 1035 C HIS A 73 11.997 9.124 -2.976 1.00 4.03 C ATOM 1036 O HIS A 73 11.289 8.135 -2.775 1.00 54.30 O ATOM 1037 CB HIS A 73 12.199 10.806 -1.140 1.00 12.04 C ATOM 1038 CG HIS A 73 13.163 11.948 -1.257 1.00 3.24 C ATOM 1039 ND1 HIS A 73 14.516 11.862 -1.026 1.00 62.31 N ATOM 1040 CD2 HIS A 73 12.931 13.234 -1.604 1.00 43.24 C ATOM 1041 CE1 HIS A 73 15.049 13.062 -1.241 1.00 1.42 C ATOM 1042 NE2 HIS A 73 14.127 13.933 -1.596 1.00 41.43 N ATOM 0 H HIS A 73 9.698 9.619 -3.014 1.00 35.31 H new ATOM 0 HA HIS A 73 11.745 11.309 -3.159 1.00 54.33 H new ATOM 0 HB2 HIS A 73 11.441 11.048 -0.395 1.00 12.04 H new ATOM 0 HB3 HIS A 73 12.727 9.922 -0.782 1.00 12.04 H new ATOM 0 HD1 HIS A 73 15.023 11.024 -0.740 1.00 62.31 H new ATOM 0 HD2 HIS A 73 11.965 13.651 -1.849 1.00 43.24 H new ATOM 0 HE1 HIS A 73 16.099 13.292 -1.138 1.00 1.42 H new ATOM 1050 N PRO A 74 13.170 9.020 -3.626 1.00 24.50 N ATOM 1051 CA PRO A 74 13.706 7.720 -4.097 1.00 52.33 C ATOM 1052 C PRO A 74 14.003 6.731 -2.949 1.00 64.14 C ATOM 1053 O PRO A 74 14.297 5.562 -3.182 1.00 11.23 O ATOM 1054 CB PRO A 74 14.997 8.108 -4.829 1.00 34.10 C ATOM 1055 CG PRO A 74 14.814 9.542 -5.177 1.00 44.24 C ATOM 1056 CD PRO A 74 14.049 10.134 -4.037 1.00 73.34 C ATOM 0 HA PRO A 74 12.985 7.195 -4.723 1.00 52.33 H new ATOM 0 HB2 PRO A 74 15.871 7.962 -4.195 1.00 34.10 H new ATOM 0 HB3 PRO A 74 15.145 7.499 -5.721 1.00 34.10 H new ATOM 0 HG2 PRO A 74 15.775 10.040 -5.306 1.00 44.24 H new ATOM 0 HG3 PRO A 74 14.269 9.652 -6.115 1.00 44.24 H new ATOM 0 HD2 PRO A 74 14.707 10.451 -3.228 1.00 73.34 H new ATOM 0 HD3 PRO A 74 13.477 11.010 -4.344 1.00 73.34 H new ATOM 1064 N GLU A 75 13.932 7.213 -1.716 1.00 75.02 N ATOM 1065 CA GLU A 75 14.117 6.373 -0.542 1.00 72.13 C ATOM 1066 C GLU A 75 12.892 5.511 -0.300 1.00 22.34 C ATOM 1067 O GLU A 75 12.951 4.506 0.416 1.00 62.01 O ATOM 1068 CB GLU A 75 14.437 7.192 0.722 1.00 2.43 C ATOM 1069 CG GLU A 75 15.859 7.752 0.798 1.00 53.34 C ATOM 1070 CD GLU A 75 16.163 8.779 -0.241 1.00 5.42 C ATOM 1071 OE1 GLU A 75 16.547 8.420 -1.355 1.00 4.31 O ATOM 1072 OE2 GLU A 75 16.031 9.980 0.047 1.00 32.12 O ATOM 0 H GLU A 75 13.745 8.193 -1.502 1.00 75.02 H new ATOM 0 HA GLU A 75 14.976 5.734 -0.747 1.00 72.13 H new ATOM 0 HB2 GLU A 75 13.734 8.022 0.784 1.00 2.43 H new ATOM 0 HB3 GLU A 75 14.265 6.563 1.595 1.00 2.43 H new ATOM 0 HG2 GLU A 75 16.014 8.191 1.784 1.00 53.34 H new ATOM 0 HG3 GLU A 75 16.568 6.930 0.700 1.00 53.34 H new ATOM 1079 N SER A 76 11.791 5.898 -0.887 1.00 44.35 N ATOM 1080 CA SER A 76 10.577 5.162 -0.762 1.00 35.22 C ATOM 1081 C SER A 76 10.390 4.267 -1.982 1.00 23.10 C ATOM 1082 O SER A 76 10.436 4.744 -3.122 1.00 5.14 O ATOM 1083 CB SER A 76 9.420 6.134 -0.617 1.00 53.21 C ATOM 1084 OG SER A 76 9.649 7.002 0.488 1.00 71.11 O ATOM 0 H SER A 76 11.718 6.735 -1.465 1.00 44.35 H new ATOM 0 HA SER A 76 10.614 4.526 0.123 1.00 35.22 H new ATOM 0 HB2 SER A 76 9.308 6.717 -1.531 1.00 53.21 H new ATOM 0 HB3 SER A 76 8.489 5.585 -0.472 1.00 53.21 H new ATOM 0 HG SER A 76 8.986 7.724 0.480 1.00 71.11 H new ATOM 1090 N ASP A 77 10.241 2.969 -1.736 1.00 24.33 N ATOM 1091 CA ASP A 77 10.002 1.987 -2.798 1.00 63.45 C ATOM 1092 C ASP A 77 8.673 2.291 -3.441 1.00 41.24 C ATOM 1093 O ASP A 77 8.528 2.282 -4.664 1.00 74.52 O ATOM 1094 CB ASP A 77 9.977 0.563 -2.229 1.00 3.35 C ATOM 1095 CG ASP A 77 9.857 -0.507 -3.306 1.00 44.31 C ATOM 1096 OD1 ASP A 77 8.737 -0.828 -3.742 1.00 31.13 O ATOM 1097 OD2 ASP A 77 10.899 -1.078 -3.704 1.00 74.14 O ATOM 0 H ASP A 77 10.282 2.566 -0.800 1.00 24.33 H new ATOM 0 HA ASP A 77 10.807 2.049 -3.530 1.00 63.45 H new ATOM 0 HB2 ASP A 77 10.887 0.391 -1.654 1.00 3.35 H new ATOM 0 HB3 ASP A 77 9.140 0.469 -1.537 1.00 3.35 H new ATOM 1102 N ILE A 78 7.705 2.595 -2.609 1.00 4.14 N ATOM 1103 CA ILE A 78 6.421 2.994 -3.092 1.00 12.23 C ATOM 1104 C ILE A 78 6.421 4.500 -3.109 1.00 42.44 C ATOM 1105 O ILE A 78 6.381 5.144 -2.053 1.00 15.42 O ATOM 1106 CB ILE A 78 5.252 2.479 -2.206 1.00 25.21 C ATOM 1107 CG1 ILE A 78 5.381 0.971 -1.950 1.00 60.22 C ATOM 1108 CG2 ILE A 78 3.908 2.779 -2.871 1.00 53.13 C ATOM 1109 CD1 ILE A 78 5.429 0.113 -3.200 1.00 0.33 C ATOM 0 H ILE A 78 7.791 2.571 -1.593 1.00 4.14 H new ATOM 0 HA ILE A 78 6.259 2.565 -4.081 1.00 12.23 H new ATOM 0 HB ILE A 78 5.301 2.999 -1.249 1.00 25.21 H new ATOM 0 HG12 ILE A 78 6.286 0.792 -1.369 1.00 60.22 H new ATOM 0 HG13 ILE A 78 4.539 0.648 -1.337 1.00 60.22 H new ATOM 0 HG21 ILE A 78 3.099 2.412 -2.239 1.00 53.13 H new ATOM 0 HG22 ILE A 78 3.802 3.855 -3.008 1.00 53.13 H new ATOM 0 HG23 ILE A 78 3.863 2.284 -3.841 1.00 53.13 H new ATOM 0 HD11 ILE A 78 5.521 -0.936 -2.918 1.00 0.33 H new ATOM 0 HD12 ILE A 78 4.514 0.256 -3.775 1.00 0.33 H new ATOM 0 HD13 ILE A 78 6.287 0.402 -3.807 1.00 0.33 H new ATOM 1121 N PHE A 79 6.537 5.048 -4.277 1.00 3.33 N ATOM 1122 CA PHE A 79 6.614 6.463 -4.453 1.00 13.31 C ATOM 1123 C PHE A 79 5.216 7.024 -4.577 1.00 40.10 C ATOM 1124 O PHE A 79 4.498 6.715 -5.519 1.00 62.21 O ATOM 1125 CB PHE A 79 7.439 6.776 -5.715 1.00 1.43 C ATOM 1126 CG PHE A 79 7.693 8.240 -5.971 1.00 22.23 C ATOM 1127 CD1 PHE A 79 8.820 8.855 -5.458 1.00 63.01 C ATOM 1128 CD2 PHE A 79 6.817 8.994 -6.742 1.00 72.03 C ATOM 1129 CE1 PHE A 79 9.070 10.187 -5.705 1.00 21.25 C ATOM 1130 CE2 PHE A 79 7.059 10.327 -6.987 1.00 35.23 C ATOM 1131 CZ PHE A 79 8.188 10.924 -6.470 1.00 53.01 C ATOM 0 H PHE A 79 6.581 4.518 -5.147 1.00 3.33 H new ATOM 0 HA PHE A 79 7.103 6.923 -3.594 1.00 13.31 H new ATOM 0 HB2 PHE A 79 8.399 6.266 -5.638 1.00 1.43 H new ATOM 0 HB3 PHE A 79 6.924 6.357 -6.579 1.00 1.43 H new ATOM 0 HD1 PHE A 79 9.512 8.285 -4.857 1.00 63.01 H new ATOM 0 HD2 PHE A 79 5.934 8.528 -7.155 1.00 72.03 H new ATOM 0 HE1 PHE A 79 9.956 10.655 -5.300 1.00 21.25 H new ATOM 0 HE2 PHE A 79 6.366 10.903 -7.583 1.00 35.23 H new ATOM 0 HZ PHE A 79 8.383 11.969 -6.663 1.00 53.01 H new ATOM 1141 N LEU A 80 4.823 7.801 -3.624 1.00 14.45 N ATOM 1142 CA LEU A 80 3.536 8.451 -3.650 1.00 13.34 C ATOM 1143 C LEU A 80 3.751 9.929 -3.852 1.00 53.32 C ATOM 1144 O LEU A 80 4.335 10.594 -3.004 1.00 63.13 O ATOM 1145 CB LEU A 80 2.733 8.222 -2.349 1.00 54.04 C ATOM 1146 CG LEU A 80 2.269 6.795 -2.015 1.00 54.54 C ATOM 1147 CD1 LEU A 80 1.655 6.095 -3.220 1.00 13.11 C ATOM 1148 CD2 LEU A 80 3.364 5.976 -1.374 1.00 34.41 C ATOM 0 H LEU A 80 5.381 8.010 -2.796 1.00 14.45 H new ATOM 0 HA LEU A 80 2.956 8.021 -4.467 1.00 13.34 H new ATOM 0 HB2 LEU A 80 3.342 8.576 -1.517 1.00 54.04 H new ATOM 0 HB3 LEU A 80 1.848 8.857 -2.389 1.00 54.04 H new ATOM 0 HG LEU A 80 1.476 6.889 -1.273 1.00 54.54 H new ATOM 0 HD11 LEU A 80 1.342 5.090 -2.937 1.00 13.11 H new ATOM 0 HD12 LEU A 80 0.790 6.660 -3.567 1.00 13.11 H new ATOM 0 HD13 LEU A 80 2.393 6.033 -4.020 1.00 13.11 H new ATOM 0 HD21 LEU A 80 2.990 4.976 -1.156 1.00 34.41 H new ATOM 0 HD22 LEU A 80 4.212 5.906 -2.055 1.00 34.41 H new ATOM 0 HD23 LEU A 80 3.681 6.455 -0.448 1.00 34.41 H new ATOM 1160 N ASP A 81 3.330 10.433 -4.975 1.00 1.53 N ATOM 1161 CA ASP A 81 3.495 11.843 -5.264 1.00 22.44 C ATOM 1162 C ASP A 81 2.439 12.664 -4.552 1.00 13.14 C ATOM 1163 O ASP A 81 1.238 12.496 -4.785 1.00 13.23 O ATOM 1164 CB ASP A 81 3.490 12.120 -6.770 1.00 52.45 C ATOM 1165 CG ASP A 81 3.613 13.593 -7.099 1.00 71.13 C ATOM 1166 OD1 ASP A 81 4.722 14.148 -7.007 1.00 5.01 O ATOM 1167 OD2 ASP A 81 2.605 14.207 -7.509 1.00 72.32 O ATOM 0 H ASP A 81 2.869 9.897 -5.710 1.00 1.53 H new ATOM 0 HA ASP A 81 4.472 12.144 -4.887 1.00 22.44 H new ATOM 0 HB2 ASP A 81 4.313 11.579 -7.237 1.00 52.45 H new ATOM 0 HB3 ASP A 81 2.568 11.732 -7.203 1.00 52.45 H new ATOM 1172 N ASP A 82 2.881 13.530 -3.687 1.00 22.12 N ATOM 1173 CA ASP A 82 2.004 14.367 -2.899 1.00 40.01 C ATOM 1174 C ASP A 82 2.528 15.798 -2.959 1.00 5.24 C ATOM 1175 O ASP A 82 3.556 16.049 -3.592 1.00 64.55 O ATOM 1176 CB ASP A 82 1.941 13.848 -1.430 1.00 21.41 C ATOM 1177 CG ASP A 82 1.008 14.661 -0.538 1.00 1.41 C ATOM 1178 OD1 ASP A 82 -0.221 14.520 -0.672 1.00 53.11 O ATOM 1179 OD2 ASP A 82 1.513 15.517 0.236 1.00 11.50 O ATOM 0 H ASP A 82 3.873 13.682 -3.502 1.00 22.12 H new ATOM 0 HA ASP A 82 0.990 14.337 -3.298 1.00 40.01 H new ATOM 0 HB2 ASP A 82 1.613 12.809 -1.434 1.00 21.41 H new ATOM 0 HB3 ASP A 82 2.944 13.864 -1.004 1.00 21.41 H new ATOM 1184 N VAL A 83 1.831 16.713 -2.330 1.00 71.20 N ATOM 1185 CA VAL A 83 2.207 18.106 -2.252 1.00 21.54 C ATOM 1186 C VAL A 83 3.440 18.247 -1.352 1.00 65.44 C ATOM 1187 O VAL A 83 4.269 19.141 -1.536 1.00 12.01 O ATOM 1188 CB VAL A 83 1.042 18.935 -1.623 1.00 62.12 C ATOM 1189 CG1 VAL A 83 1.350 20.427 -1.591 1.00 2.21 C ATOM 1190 CG2 VAL A 83 -0.267 18.671 -2.347 1.00 11.43 C ATOM 0 H VAL A 83 0.960 16.503 -1.843 1.00 71.20 H new ATOM 0 HA VAL A 83 2.423 18.472 -3.256 1.00 21.54 H new ATOM 0 HB VAL A 83 0.938 18.604 -0.590 1.00 62.12 H new ATOM 0 HG11 VAL A 83 0.511 20.962 -1.145 1.00 2.21 H new ATOM 0 HG12 VAL A 83 2.248 20.601 -0.998 1.00 2.21 H new ATOM 0 HG13 VAL A 83 1.511 20.787 -2.607 1.00 2.21 H new ATOM 0 HG21 VAL A 83 -1.061 19.260 -1.889 1.00 11.43 H new ATOM 0 HG22 VAL A 83 -0.166 18.951 -3.396 1.00 11.43 H new ATOM 0 HG23 VAL A 83 -0.515 17.612 -2.277 1.00 11.43 H new ATOM 1200 N THR A 84 3.562 17.349 -0.415 1.00 21.51 N ATOM 1201 CA THR A 84 4.598 17.400 0.574 1.00 33.13 C ATOM 1202 C THR A 84 5.706 16.359 0.256 1.00 15.45 C ATOM 1203 O THR A 84 5.458 15.366 -0.446 1.00 73.43 O ATOM 1204 CB THR A 84 3.954 17.072 1.921 1.00 74.13 C ATOM 1205 OG1 THR A 84 2.590 17.542 1.901 1.00 32.55 O ATOM 1206 CG2 THR A 84 4.681 17.781 3.035 1.00 5.14 C ATOM 0 H THR A 84 2.935 16.550 -0.317 1.00 21.51 H new ATOM 0 HA THR A 84 5.060 18.387 0.589 1.00 33.13 H new ATOM 0 HB THR A 84 3.998 15.996 2.087 1.00 74.13 H new ATOM 0 HG1 THR A 84 2.027 16.893 1.430 1.00 32.55 H new ATOM 0 HG21 THR A 84 4.211 17.538 3.988 1.00 5.14 H new ATOM 0 HG22 THR A 84 5.723 17.461 3.051 1.00 5.14 H new ATOM 0 HG23 THR A 84 4.635 18.858 2.872 1.00 5.14 H new ATOM 1214 N VAL A 85 6.935 16.613 0.691 1.00 73.52 N ATOM 1215 CA VAL A 85 8.003 15.640 0.508 1.00 45.43 C ATOM 1216 C VAL A 85 8.070 14.751 1.742 1.00 30.13 C ATOM 1217 O VAL A 85 8.663 15.114 2.761 1.00 2.44 O ATOM 1218 CB VAL A 85 9.406 16.296 0.292 1.00 71.52 C ATOM 1219 CG1 VAL A 85 10.467 15.235 0.039 1.00 5.13 C ATOM 1220 CG2 VAL A 85 9.387 17.292 -0.848 1.00 53.03 C ATOM 0 H VAL A 85 7.213 17.472 1.166 1.00 73.52 H new ATOM 0 HA VAL A 85 7.769 15.072 -0.392 1.00 45.43 H new ATOM 0 HB VAL A 85 9.655 16.834 1.207 1.00 71.52 H new ATOM 0 HG11 VAL A 85 11.434 15.716 -0.108 1.00 5.13 H new ATOM 0 HG12 VAL A 85 10.522 14.564 0.896 1.00 5.13 H new ATOM 0 HG13 VAL A 85 10.206 14.665 -0.852 1.00 5.13 H new ATOM 0 HG21 VAL A 85 10.379 17.727 -0.968 1.00 53.03 H new ATOM 0 HG22 VAL A 85 9.099 16.785 -1.769 1.00 53.03 H new ATOM 0 HG23 VAL A 85 8.669 18.082 -0.629 1.00 53.03 H new ATOM 1230 N SER A 86 7.464 13.617 1.657 1.00 45.32 N ATOM 1231 CA SER A 86 7.440 12.707 2.754 1.00 54.00 C ATOM 1232 C SER A 86 8.491 11.640 2.520 1.00 54.32 C ATOM 1233 O SER A 86 8.225 10.628 1.904 1.00 43.10 O ATOM 1234 CB SER A 86 6.055 12.107 2.845 1.00 63.14 C ATOM 1235 OG SER A 86 5.087 13.121 2.619 1.00 33.34 O ATOM 0 H SER A 86 6.970 13.293 0.825 1.00 45.32 H new ATOM 0 HA SER A 86 7.664 13.210 3.694 1.00 54.00 H new ATOM 0 HB2 SER A 86 5.942 11.311 2.109 1.00 63.14 H new ATOM 0 HB3 SER A 86 5.905 11.658 3.827 1.00 63.14 H new ATOM 0 HG SER A 86 4.789 13.486 3.478 1.00 33.34 H new ATOM 1241 N ARG A 87 9.691 11.921 2.959 1.00 3.12 N ATOM 1242 CA ARG A 87 10.845 11.056 2.723 1.00 62.23 C ATOM 1243 C ARG A 87 10.732 9.722 3.449 1.00 22.40 C ATOM 1244 O ARG A 87 11.281 8.706 3.009 1.00 32.22 O ATOM 1245 CB ARG A 87 12.117 11.804 3.098 1.00 3.40 C ATOM 1246 CG ARG A 87 12.191 12.263 4.555 1.00 44.41 C ATOM 1247 CD ARG A 87 13.219 13.366 4.719 1.00 53.43 C ATOM 1248 NE ARG A 87 12.781 14.615 4.053 1.00 13.15 N ATOM 1249 CZ ARG A 87 13.225 15.069 2.857 1.00 3.11 C ATOM 1250 NH1 ARG A 87 14.065 14.327 2.109 1.00 24.03 N ATOM 1251 NH2 ARG A 87 12.805 16.239 2.396 1.00 13.53 N ATOM 0 H ARG A 87 9.909 12.761 3.496 1.00 3.12 H new ATOM 0 HA ARG A 87 10.879 10.807 1.662 1.00 62.23 H new ATOM 0 HB2 ARG A 87 12.973 11.161 2.891 1.00 3.40 H new ATOM 0 HB3 ARG A 87 12.211 12.677 2.452 1.00 3.40 H new ATOM 0 HG2 ARG A 87 11.213 12.619 4.879 1.00 44.41 H new ATOM 0 HG3 ARG A 87 12.451 11.419 5.194 1.00 44.41 H new ATOM 0 HD2 ARG A 87 13.385 13.556 5.779 1.00 53.43 H new ATOM 0 HD3 ARG A 87 14.172 13.043 4.300 1.00 53.43 H new ATOM 0 HE ARG A 87 12.085 15.182 4.537 1.00 13.15 H new ATOM 0 HH11 ARG A 87 14.373 13.413 2.442 1.00 24.03 H new ATOM 0 HH12 ARG A 87 14.393 14.679 1.210 1.00 24.03 H new ATOM 0 HH21 ARG A 87 12.148 16.796 2.942 1.00 13.53 H new ATOM 0 HH22 ARG A 87 13.139 16.582 1.495 1.00 13.53 H new ATOM 1265 N ARG A 88 10.044 9.735 4.550 1.00 2.24 N ATOM 1266 CA ARG A 88 9.788 8.537 5.302 1.00 14.34 C ATOM 1267 C ARG A 88 8.401 8.700 5.895 1.00 44.00 C ATOM 1268 O ARG A 88 8.255 9.355 6.913 1.00 65.43 O ATOM 1269 CB ARG A 88 10.833 8.391 6.434 1.00 31.33 C ATOM 1270 CG ARG A 88 10.961 6.990 7.025 1.00 73.12 C ATOM 1271 CD ARG A 88 11.625 6.050 6.031 1.00 1.20 C ATOM 1272 NE ARG A 88 11.787 4.679 6.540 1.00 42.23 N ATOM 1273 CZ ARG A 88 12.633 3.771 6.013 1.00 62.34 C ATOM 1274 NH1 ARG A 88 13.499 4.129 5.071 1.00 14.42 N ATOM 1275 NH2 ARG A 88 12.647 2.527 6.467 1.00 11.30 N ATOM 0 H ARG A 88 9.641 10.579 4.957 1.00 2.24 H new ATOM 0 HA ARG A 88 9.852 7.649 4.673 1.00 14.34 H new ATOM 0 HB2 ARG A 88 11.806 8.696 6.049 1.00 31.33 H new ATOM 0 HB3 ARG A 88 10.576 9.084 7.235 1.00 31.33 H new ATOM 0 HG2 ARG A 88 11.546 7.029 7.944 1.00 73.12 H new ATOM 0 HG3 ARG A 88 9.975 6.610 7.291 1.00 73.12 H new ATOM 0 HD2 ARG A 88 11.032 6.022 5.117 1.00 1.20 H new ATOM 0 HD3 ARG A 88 12.604 6.448 5.764 1.00 1.20 H new ATOM 0 HE ARG A 88 11.224 4.398 7.342 1.00 42.23 H new ATOM 0 HH11 ARG A 88 13.526 5.095 4.743 1.00 14.42 H new ATOM 0 HH12 ARG A 88 14.137 3.438 4.676 1.00 14.42 H new ATOM 0 HH21 ARG A 88 12.016 2.251 7.219 1.00 11.30 H new ATOM 0 HH22 ARG A 88 13.289 1.844 6.064 1.00 11.30 H new ATOM 1289 N HIS A 89 7.373 8.247 5.200 1.00 13.13 N ATOM 1290 CA HIS A 89 6.029 8.435 5.723 1.00 30.44 C ATOM 1291 C HIS A 89 5.486 7.164 6.387 1.00 3.12 C ATOM 1292 O HIS A 89 5.061 7.170 7.542 1.00 71.33 O ATOM 1293 CB HIS A 89 5.072 8.938 4.630 1.00 60.31 C ATOM 1294 CG HIS A 89 3.757 9.420 5.171 1.00 13.34 C ATOM 1295 ND1 HIS A 89 3.573 10.721 5.543 1.00 52.14 N ATOM 1296 CD2 HIS A 89 2.625 8.738 5.423 1.00 55.30 C ATOM 1297 CE1 HIS A 89 2.352 10.774 6.009 1.00 35.21 C ATOM 1298 NE2 HIS A 89 1.745 9.609 5.953 1.00 71.43 N ATOM 0 H HIS A 89 7.435 7.763 4.304 1.00 13.13 H new ATOM 0 HA HIS A 89 6.093 9.200 6.496 1.00 30.44 H new ATOM 0 HB2 HIS A 89 5.551 9.749 4.082 1.00 60.31 H new ATOM 0 HB3 HIS A 89 4.891 8.134 3.916 1.00 60.31 H new ATOM 0 HD1 HIS A 89 4.243 11.487 5.473 1.00 52.14 H new ATOM 0 HD2 HIS A 89 2.454 7.688 5.235 1.00 55.30 H new ATOM 0 HE1 HIS A 89 1.894 11.673 6.396 1.00 35.21 H new ATOM 1306 N ALA A 90 5.523 6.084 5.691 1.00 63.32 N ATOM 1307 CA ALA A 90 5.002 4.860 6.230 1.00 23.01 C ATOM 1308 C ALA A 90 5.963 3.752 5.948 1.00 72.51 C ATOM 1309 O ALA A 90 6.599 3.722 4.878 1.00 64.35 O ATOM 1310 CB ALA A 90 3.638 4.546 5.626 1.00 12.14 C ATOM 0 H ALA A 90 5.906 6.013 4.748 1.00 63.32 H new ATOM 0 HA ALA A 90 4.877 4.967 7.308 1.00 23.01 H new ATOM 0 HB1 ALA A 90 3.259 3.615 6.047 1.00 12.14 H new ATOM 0 HB2 ALA A 90 2.944 5.355 5.853 1.00 12.14 H new ATOM 0 HB3 ALA A 90 3.734 4.443 4.545 1.00 12.14 H new ATOM 1316 N GLU A 91 6.102 2.878 6.884 1.00 41.24 N ATOM 1317 CA GLU A 91 6.964 1.763 6.747 1.00 61.21 C ATOM 1318 C GLU A 91 6.144 0.499 6.943 1.00 25.42 C ATOM 1319 O GLU A 91 5.398 0.374 7.910 1.00 34.20 O ATOM 1320 CB GLU A 91 8.082 1.874 7.791 1.00 61.00 C ATOM 1321 CG GLU A 91 9.130 0.785 7.730 1.00 44.33 C ATOM 1322 CD GLU A 91 10.206 0.978 8.767 1.00 2.20 C ATOM 1323 OE1 GLU A 91 11.189 1.696 8.496 1.00 53.22 O ATOM 1324 OE2 GLU A 91 10.103 0.418 9.869 1.00 1.45 O ATOM 0 H GLU A 91 5.612 2.921 7.777 1.00 41.24 H new ATOM 0 HA GLU A 91 7.422 1.733 5.758 1.00 61.21 H new ATOM 0 HB2 GLU A 91 8.576 2.838 7.670 1.00 61.00 H new ATOM 0 HB3 GLU A 91 7.632 1.868 8.784 1.00 61.00 H new ATOM 0 HG2 GLU A 91 8.654 -0.185 7.877 1.00 44.33 H new ATOM 0 HG3 GLU A 91 9.581 0.771 6.738 1.00 44.33 H new ATOM 1331 N PHE A 92 6.266 -0.407 6.035 1.00 23.22 N ATOM 1332 CA PHE A 92 5.571 -1.665 6.104 1.00 3.41 C ATOM 1333 C PHE A 92 6.586 -2.686 6.490 1.00 3.40 C ATOM 1334 O PHE A 92 7.566 -2.878 5.787 1.00 41.10 O ATOM 1335 CB PHE A 92 4.982 -2.062 4.739 1.00 4.15 C ATOM 1336 CG PHE A 92 3.971 -1.106 4.137 1.00 22.42 C ATOM 1337 CD1 PHE A 92 4.337 0.165 3.713 1.00 4.21 C ATOM 1338 CD2 PHE A 92 2.653 -1.489 3.995 1.00 43.45 C ATOM 1339 CE1 PHE A 92 3.413 1.025 3.167 1.00 3.04 C ATOM 1340 CE2 PHE A 92 1.720 -0.633 3.447 1.00 41.22 C ATOM 1341 CZ PHE A 92 2.100 0.626 3.033 1.00 64.22 C ATOM 0 H PHE A 92 6.856 -0.303 5.210 1.00 23.22 H new ATOM 0 HA PHE A 92 4.749 -1.593 6.816 1.00 3.41 H new ATOM 0 HB2 PHE A 92 5.804 -2.179 4.033 1.00 4.15 H new ATOM 0 HB3 PHE A 92 4.509 -3.039 4.842 1.00 4.15 H new ATOM 0 HD1 PHE A 92 5.364 0.483 3.814 1.00 4.21 H new ATOM 0 HD2 PHE A 92 2.347 -2.473 4.318 1.00 43.45 H new ATOM 0 HE1 PHE A 92 3.715 2.010 2.844 1.00 3.04 H new ATOM 0 HE2 PHE A 92 0.693 -0.949 3.342 1.00 41.22 H new ATOM 0 HZ PHE A 92 1.371 1.298 2.605 1.00 64.22 H new ATOM 1351 N ARG A 93 6.397 -3.289 7.597 1.00 23.15 N ATOM 1352 CA ARG A 93 7.320 -4.260 8.072 1.00 32.01 C ATOM 1353 C ARG A 93 6.678 -5.617 7.984 1.00 61.40 C ATOM 1354 O ARG A 93 5.616 -5.863 8.578 1.00 1.33 O ATOM 1355 CB ARG A 93 7.730 -3.935 9.504 1.00 75.04 C ATOM 1356 CG ARG A 93 8.273 -2.522 9.656 1.00 54.23 C ATOM 1357 CD ARG A 93 8.725 -2.229 11.066 1.00 54.44 C ATOM 1358 NE ARG A 93 9.833 -3.092 11.475 1.00 23.30 N ATOM 1359 CZ ARG A 93 11.115 -2.703 11.562 1.00 21.12 C ATOM 1360 NH1 ARG A 93 11.495 -1.502 11.109 1.00 21.22 N ATOM 1361 NH2 ARG A 93 12.021 -3.525 12.071 1.00 51.45 N ATOM 0 H ARG A 93 5.596 -3.128 8.208 1.00 23.15 H new ATOM 0 HA ARG A 93 8.223 -4.253 7.461 1.00 32.01 H new ATOM 0 HB2 ARG A 93 6.869 -4.061 10.161 1.00 75.04 H new ATOM 0 HB3 ARG A 93 8.487 -4.647 9.831 1.00 75.04 H new ATOM 0 HG2 ARG A 93 9.110 -2.382 8.972 1.00 54.23 H new ATOM 0 HG3 ARG A 93 7.503 -1.807 9.368 1.00 54.23 H new ATOM 0 HD2 ARG A 93 9.032 -1.186 11.139 1.00 54.44 H new ATOM 0 HD3 ARG A 93 7.888 -2.364 11.751 1.00 54.44 H new ATOM 0 HE ARG A 93 9.616 -4.060 11.711 1.00 23.30 H new ATOM 0 HH11 ARG A 93 10.808 -0.873 10.693 1.00 21.22 H new ATOM 0 HH12 ARG A 93 12.471 -1.216 11.180 1.00 21.22 H new ATOM 0 HH21 ARG A 93 11.744 -4.451 12.396 1.00 51.45 H new ATOM 0 HH22 ARG A 93 12.996 -3.231 12.138 1.00 51.45 H new ATOM 1375 N ILE A 94 7.278 -6.471 7.221 1.00 23.21 N ATOM 1376 CA ILE A 94 6.779 -7.795 7.017 1.00 72.53 C ATOM 1377 C ILE A 94 7.763 -8.736 7.675 1.00 74.33 C ATOM 1378 O ILE A 94 8.936 -8.818 7.263 1.00 12.02 O ATOM 1379 CB ILE A 94 6.651 -8.172 5.490 1.00 52.22 C ATOM 1380 CG1 ILE A 94 5.757 -7.182 4.692 1.00 60.02 C ATOM 1381 CG2 ILE A 94 6.111 -9.590 5.332 1.00 53.22 C ATOM 1382 CD1 ILE A 94 6.380 -5.823 4.396 1.00 14.10 C ATOM 0 H ILE A 94 8.140 -6.268 6.714 1.00 23.21 H new ATOM 0 HA ILE A 94 5.778 -7.866 7.442 1.00 72.53 H new ATOM 0 HB ILE A 94 7.657 -8.108 5.074 1.00 52.22 H new ATOM 0 HG12 ILE A 94 5.483 -7.650 3.746 1.00 60.02 H new ATOM 0 HG13 ILE A 94 4.834 -7.025 5.249 1.00 60.02 H new ATOM 0 HG21 ILE A 94 6.030 -9.832 4.272 1.00 53.22 H new ATOM 0 HG22 ILE A 94 6.790 -10.294 5.814 1.00 53.22 H new ATOM 0 HG23 ILE A 94 5.127 -9.659 5.797 1.00 53.22 H new ATOM 0 HD11 ILE A 94 5.672 -5.212 3.836 1.00 14.10 H new ATOM 0 HD12 ILE A 94 6.628 -5.324 5.333 1.00 14.10 H new ATOM 0 HD13 ILE A 94 7.287 -5.959 3.807 1.00 14.10 H new ATOM 1394 N ASN A 95 7.340 -9.388 8.708 1.00 35.24 N ATOM 1395 CA ASN A 95 8.212 -10.277 9.433 1.00 11.20 C ATOM 1396 C ASN A 95 7.468 -11.529 9.813 1.00 51.40 C ATOM 1397 O ASN A 95 6.405 -11.447 10.408 1.00 21.21 O ATOM 1398 CB ASN A 95 8.765 -9.575 10.672 1.00 21.12 C ATOM 1399 CG ASN A 95 9.841 -10.371 11.358 1.00 62.42 C ATOM 1400 OD1 ASN A 95 9.576 -11.141 12.262 1.00 23.32 O ATOM 1401 ND2 ASN A 95 11.063 -10.193 10.917 1.00 34.42 N ATOM 0 H ASN A 95 6.391 -9.327 9.077 1.00 35.24 H new ATOM 0 HA ASN A 95 9.051 -10.555 8.795 1.00 11.20 H new ATOM 0 HB2 ASN A 95 9.165 -8.602 10.385 1.00 21.12 H new ATOM 0 HB3 ASN A 95 7.952 -9.391 11.374 1.00 21.12 H new ATOM 0 HD21 ASN A 95 11.836 -10.711 11.335 1.00 34.42 H new ATOM 0 HD22 ASN A 95 11.240 -9.537 10.156 1.00 34.42 H new ATOM 1408 N GLU A 96 8.002 -12.675 9.405 1.00 12.50 N ATOM 1409 CA GLU A 96 7.423 -14.009 9.673 1.00 42.13 C ATOM 1410 C GLU A 96 5.966 -14.110 9.208 1.00 52.32 C ATOM 1411 O GLU A 96 5.150 -14.795 9.818 1.00 21.44 O ATOM 1412 CB GLU A 96 7.513 -14.367 11.160 1.00 44.33 C ATOM 1413 CG GLU A 96 8.918 -14.499 11.697 1.00 75.41 C ATOM 1414 CD GLU A 96 8.931 -15.009 13.113 1.00 40.14 C ATOM 1415 OE1 GLU A 96 8.852 -16.224 13.313 1.00 2.22 O ATOM 1416 OE2 GLU A 96 9.041 -14.205 14.062 1.00 60.53 O ATOM 0 H GLU A 96 8.867 -12.716 8.867 1.00 12.50 H new ATOM 0 HA GLU A 96 8.015 -14.722 9.098 1.00 42.13 H new ATOM 0 HB2 GLU A 96 6.990 -13.603 11.735 1.00 44.33 H new ATOM 0 HB3 GLU A 96 6.986 -15.307 11.325 1.00 44.33 H new ATOM 0 HG2 GLU A 96 9.488 -15.177 11.061 1.00 75.41 H new ATOM 0 HG3 GLU A 96 9.415 -13.530 11.655 1.00 75.41 H new ATOM 1423 N GLY A 97 5.666 -13.477 8.098 1.00 62.24 N ATOM 1424 CA GLY A 97 4.329 -13.522 7.555 1.00 42.42 C ATOM 1425 C GLY A 97 3.389 -12.516 8.196 1.00 71.31 C ATOM 1426 O GLY A 97 2.208 -12.482 7.870 1.00 43.41 O ATOM 0 H GLY A 97 6.329 -12.925 7.554 1.00 62.24 H new ATOM 0 HA2 GLY A 97 4.373 -13.336 6.482 1.00 42.42 H new ATOM 0 HA3 GLY A 97 3.923 -14.525 7.688 1.00 42.42 H new ATOM 1430 N GLU A 98 3.901 -11.692 9.094 1.00 42.11 N ATOM 1431 CA GLU A 98 3.098 -10.685 9.743 1.00 4.54 C ATOM 1432 C GLU A 98 3.367 -9.361 9.081 1.00 22.14 C ATOM 1433 O GLU A 98 4.528 -8.980 8.879 1.00 52.11 O ATOM 1434 CB GLU A 98 3.510 -10.580 11.202 1.00 23.33 C ATOM 1435 CG GLU A 98 3.434 -11.881 11.970 1.00 2.24 C ATOM 1436 CD GLU A 98 2.028 -12.360 12.178 1.00 54.54 C ATOM 1437 OE1 GLU A 98 1.284 -11.743 12.971 1.00 0.31 O ATOM 1438 OE2 GLU A 98 1.636 -13.382 11.564 1.00 70.24 O ATOM 0 H GLU A 98 4.878 -11.706 9.388 1.00 42.11 H new ATOM 0 HA GLU A 98 2.043 -10.948 9.670 1.00 4.54 H new ATOM 0 HB2 GLU A 98 4.531 -10.202 11.252 1.00 23.33 H new ATOM 0 HB3 GLU A 98 2.874 -9.844 11.694 1.00 23.33 H new ATOM 0 HG2 GLU A 98 3.997 -12.646 11.434 1.00 2.24 H new ATOM 0 HG3 GLU A 98 3.915 -11.752 12.940 1.00 2.24 H new ATOM 1445 N PHE A 99 2.317 -8.671 8.739 1.00 42.13 N ATOM 1446 CA PHE A 99 2.430 -7.403 8.074 1.00 54.22 C ATOM 1447 C PHE A 99 2.042 -6.312 9.057 1.00 3.54 C ATOM 1448 O PHE A 99 0.889 -6.255 9.507 1.00 71.31 O ATOM 1449 CB PHE A 99 1.460 -7.348 6.871 1.00 52.35 C ATOM 1450 CG PHE A 99 1.612 -8.460 5.851 1.00 33.32 C ATOM 1451 CD1 PHE A 99 0.967 -9.680 6.026 1.00 30.10 C ATOM 1452 CD2 PHE A 99 2.380 -8.279 4.717 1.00 64.03 C ATOM 1453 CE1 PHE A 99 1.095 -10.691 5.094 1.00 40.15 C ATOM 1454 CE2 PHE A 99 2.511 -9.287 3.776 1.00 4.22 C ATOM 1455 CZ PHE A 99 1.866 -10.495 3.966 1.00 12.40 C ATOM 0 H PHE A 99 1.358 -8.971 8.913 1.00 42.13 H new ATOM 0 HA PHE A 99 3.452 -7.266 7.721 1.00 54.22 H new ATOM 0 HB2 PHE A 99 0.438 -7.366 7.251 1.00 52.35 H new ATOM 0 HB3 PHE A 99 1.595 -6.393 6.363 1.00 52.35 H new ATOM 0 HD1 PHE A 99 0.357 -9.839 6.903 1.00 30.10 H new ATOM 0 HD2 PHE A 99 2.886 -7.337 4.562 1.00 64.03 H new ATOM 0 HE1 PHE A 99 0.592 -11.634 5.248 1.00 40.15 H new ATOM 0 HE2 PHE A 99 3.116 -9.130 2.895 1.00 4.22 H new ATOM 0 HZ PHE A 99 1.965 -11.283 3.234 1.00 12.40 H new ATOM 1465 N GLU A 100 2.964 -5.460 9.384 1.00 33.45 N ATOM 1466 CA GLU A 100 2.693 -4.365 10.276 1.00 3.20 C ATOM 1467 C GLU A 100 3.041 -3.088 9.606 1.00 51.15 C ATOM 1468 O GLU A 100 4.154 -2.928 9.117 1.00 61.10 O ATOM 1469 CB GLU A 100 3.481 -4.474 11.575 1.00 34.14 C ATOM 1470 CG GLU A 100 3.127 -5.662 12.426 1.00 64.03 C ATOM 1471 CD GLU A 100 3.808 -5.605 13.759 1.00 73.24 C ATOM 1472 OE1 GLU A 100 3.343 -4.857 14.644 1.00 32.41 O ATOM 1473 OE2 GLU A 100 4.825 -6.306 13.960 1.00 55.04 O ATOM 0 H GLU A 100 3.925 -5.500 9.043 1.00 33.45 H new ATOM 0 HA GLU A 100 1.632 -4.396 10.523 1.00 3.20 H new ATOM 0 HB2 GLU A 100 4.544 -4.518 11.337 1.00 34.14 H new ATOM 0 HB3 GLU A 100 3.322 -3.567 12.158 1.00 34.14 H new ATOM 0 HG2 GLU A 100 2.047 -5.699 12.569 1.00 64.03 H new ATOM 0 HG3 GLU A 100 3.412 -6.579 11.910 1.00 64.03 H new ATOM 1480 N VAL A 101 2.125 -2.191 9.563 1.00 72.24 N ATOM 1481 CA VAL A 101 2.390 -0.926 8.971 1.00 34.33 C ATOM 1482 C VAL A 101 2.584 0.057 10.079 1.00 55.31 C ATOM 1483 O VAL A 101 1.728 0.193 10.966 1.00 20.11 O ATOM 1484 CB VAL A 101 1.240 -0.478 8.040 1.00 23.11 C ATOM 1485 CG1 VAL A 101 1.549 0.868 7.384 1.00 33.32 C ATOM 1486 CG2 VAL A 101 0.992 -1.537 6.984 1.00 22.15 C ATOM 0 H VAL A 101 1.181 -2.307 9.931 1.00 72.24 H new ATOM 0 HA VAL A 101 3.284 -0.991 8.350 1.00 34.33 H new ATOM 0 HB VAL A 101 0.340 -0.354 8.642 1.00 23.11 H new ATOM 0 HG11 VAL A 101 0.721 1.155 6.736 1.00 33.32 H new ATOM 0 HG12 VAL A 101 1.686 1.626 8.155 1.00 33.32 H new ATOM 0 HG13 VAL A 101 2.461 0.784 6.793 1.00 33.32 H new ATOM 0 HG21 VAL A 101 0.181 -1.216 6.331 1.00 22.15 H new ATOM 0 HG22 VAL A 101 1.897 -1.682 6.394 1.00 22.15 H new ATOM 0 HG23 VAL A 101 0.720 -2.476 7.467 1.00 22.15 H new ATOM 1496 N VAL A 102 3.710 0.689 10.073 1.00 44.43 N ATOM 1497 CA VAL A 102 4.044 1.634 11.070 1.00 22.22 C ATOM 1498 C VAL A 102 4.278 3.000 10.455 1.00 52.42 C ATOM 1499 O VAL A 102 4.860 3.129 9.366 1.00 5.22 O ATOM 1500 CB VAL A 102 5.277 1.192 11.934 1.00 43.11 C ATOM 1501 CG1 VAL A 102 5.008 -0.127 12.644 1.00 22.42 C ATOM 1502 CG2 VAL A 102 6.552 1.089 11.106 1.00 54.10 C ATOM 0 H VAL A 102 4.430 0.557 9.363 1.00 44.43 H new ATOM 0 HA VAL A 102 3.192 1.694 11.748 1.00 22.22 H new ATOM 0 HB VAL A 102 5.427 1.970 12.682 1.00 43.11 H new ATOM 0 HG11 VAL A 102 5.880 -0.407 13.234 1.00 22.42 H new ATOM 0 HG12 VAL A 102 4.145 -0.017 13.301 1.00 22.42 H new ATOM 0 HG13 VAL A 102 4.805 -0.903 11.906 1.00 22.42 H new ATOM 0 HG21 VAL A 102 7.378 0.780 11.747 1.00 54.10 H new ATOM 0 HG22 VAL A 102 6.413 0.354 10.314 1.00 54.10 H new ATOM 0 HG23 VAL A 102 6.779 2.060 10.665 1.00 54.10 H new ATOM 1512 N ASP A 103 3.780 3.986 11.104 1.00 4.41 N ATOM 1513 CA ASP A 103 4.023 5.361 10.739 1.00 12.50 C ATOM 1514 C ASP A 103 5.166 5.830 11.607 1.00 63.34 C ATOM 1515 O ASP A 103 5.181 5.543 12.816 1.00 62.13 O ATOM 1516 CB ASP A 103 2.773 6.208 11.004 1.00 14.31 C ATOM 1517 CG ASP A 103 3.014 7.694 10.866 1.00 73.22 C ATOM 1518 OD1 ASP A 103 3.356 8.347 11.879 1.00 64.42 O ATOM 1519 OD2 ASP A 103 2.833 8.245 9.778 1.00 70.10 O ATOM 0 H ASP A 103 3.179 3.875 11.921 1.00 4.41 H new ATOM 0 HA ASP A 103 4.263 5.456 9.680 1.00 12.50 H new ATOM 0 HB2 ASP A 103 1.987 5.909 10.311 1.00 14.31 H new ATOM 0 HB3 ASP A 103 2.408 5.999 12.009 1.00 14.31 H new ATOM 1524 N VAL A 104 6.107 6.529 11.040 1.00 74.51 N ATOM 1525 CA VAL A 104 7.319 6.912 11.772 1.00 32.02 C ATOM 1526 C VAL A 104 7.198 8.290 12.443 1.00 71.31 C ATOM 1527 O VAL A 104 8.203 8.879 12.861 1.00 34.33 O ATOM 1528 CB VAL A 104 8.564 6.885 10.843 1.00 63.34 C ATOM 1529 CG1 VAL A 104 8.780 5.489 10.269 1.00 65.01 C ATOM 1530 CG2 VAL A 104 8.431 7.900 9.723 1.00 21.43 C ATOM 0 H VAL A 104 6.075 6.854 10.074 1.00 74.51 H new ATOM 0 HA VAL A 104 7.443 6.172 12.563 1.00 32.02 H new ATOM 0 HB VAL A 104 9.433 7.152 11.444 1.00 63.34 H new ATOM 0 HG11 VAL A 104 9.657 5.493 9.622 1.00 65.01 H new ATOM 0 HG12 VAL A 104 8.934 4.781 11.083 1.00 65.01 H new ATOM 0 HG13 VAL A 104 7.904 5.194 9.691 1.00 65.01 H new ATOM 0 HG21 VAL A 104 9.316 7.859 9.088 1.00 21.43 H new ATOM 0 HG22 VAL A 104 7.547 7.671 9.128 1.00 21.43 H new ATOM 0 HG23 VAL A 104 8.334 8.899 10.147 1.00 21.43 H new ATOM 1540 N GLY A 105 5.986 8.773 12.583 1.00 4.34 N ATOM 1541 CA GLY A 105 5.781 10.082 13.138 1.00 53.41 C ATOM 1542 C GLY A 105 5.857 11.062 12.025 1.00 52.44 C ATOM 1543 O GLY A 105 6.550 12.080 12.100 1.00 53.41 O ATOM 0 H GLY A 105 5.133 8.279 12.320 1.00 4.34 H new ATOM 0 HA2 GLY A 105 4.812 10.140 13.633 1.00 53.41 H new ATOM 0 HA3 GLY A 105 6.537 10.300 13.892 1.00 53.41 H new ATOM 1547 N SER A 106 5.166 10.741 10.981 1.00 62.23 N ATOM 1548 CA SER A 106 5.225 11.473 9.764 1.00 12.35 C ATOM 1549 C SER A 106 4.392 12.743 9.804 1.00 35.34 C ATOM 1550 O SER A 106 3.686 13.020 10.786 1.00 5.15 O ATOM 1551 CB SER A 106 4.827 10.559 8.656 1.00 13.10 C ATOM 1552 OG SER A 106 5.573 9.380 8.774 1.00 2.23 O ATOM 0 H SER A 106 4.531 9.944 10.952 1.00 62.23 H new ATOM 0 HA SER A 106 6.245 11.821 9.598 1.00 12.35 H new ATOM 0 HB2 SER A 106 3.760 10.341 8.707 1.00 13.10 H new ATOM 0 HB3 SER A 106 5.010 11.030 7.690 1.00 13.10 H new ATOM 0 HG SER A 106 5.071 8.635 8.383 1.00 2.23 H new ATOM 1558 N LEU A 107 4.468 13.506 8.743 1.00 55.20 N ATOM 1559 CA LEU A 107 3.882 14.815 8.729 1.00 2.54 C ATOM 1560 C LEU A 107 2.544 14.879 7.988 1.00 2.23 C ATOM 1561 O LEU A 107 1.685 15.681 8.349 1.00 24.33 O ATOM 1562 CB LEU A 107 4.873 15.864 8.159 1.00 64.02 C ATOM 1563 CG LEU A 107 6.239 16.082 8.894 1.00 43.02 C ATOM 1564 CD1 LEU A 107 6.061 16.357 10.375 1.00 41.24 C ATOM 1565 CD2 LEU A 107 7.226 14.937 8.660 1.00 11.50 C ATOM 0 H LEU A 107 4.933 13.238 7.876 1.00 55.20 H new ATOM 0 HA LEU A 107 3.668 15.056 9.770 1.00 2.54 H new ATOM 0 HB2 LEU A 107 5.092 15.586 7.128 1.00 64.02 H new ATOM 0 HB3 LEU A 107 4.357 16.824 8.127 1.00 64.02 H new ATOM 0 HG LEU A 107 6.674 16.975 8.446 1.00 43.02 H new ATOM 0 HD11 LEU A 107 7.037 16.501 10.838 1.00 41.24 H new ATOM 0 HD12 LEU A 107 5.460 17.256 10.508 1.00 41.24 H new ATOM 0 HD13 LEU A 107 5.558 15.512 10.844 1.00 41.24 H new ATOM 0 HD21 LEU A 107 8.154 15.142 9.193 1.00 11.50 H new ATOM 0 HD22 LEU A 107 6.796 14.005 9.026 1.00 11.50 H new ATOM 0 HD23 LEU A 107 7.432 14.847 7.594 1.00 11.50 H new ATOM 1577 N ASN A 108 2.318 14.013 7.003 1.00 63.24 N ATOM 1578 CA ASN A 108 1.088 14.168 6.194 1.00 21.22 C ATOM 1579 C ASN A 108 -0.085 13.452 6.839 1.00 4.40 C ATOM 1580 O ASN A 108 -1.229 13.782 6.571 1.00 61.34 O ATOM 1581 CB ASN A 108 1.232 13.622 4.747 1.00 75.14 C ATOM 1582 CG ASN A 108 2.452 14.092 3.971 1.00 1.04 C ATOM 1583 OD1 ASN A 108 3.533 14.322 4.526 1.00 4.22 O ATOM 1584 ND2 ASN A 108 2.300 14.228 2.688 1.00 10.22 N ATOM 0 H ASN A 108 2.925 13.235 6.746 1.00 63.24 H new ATOM 0 HA ASN A 108 0.913 15.243 6.148 1.00 21.22 H new ATOM 0 HB2 ASN A 108 1.253 12.533 4.792 1.00 75.14 H new ATOM 0 HB3 ASN A 108 0.340 13.901 4.185 1.00 75.14 H new ATOM 0 HD21 ASN A 108 3.084 14.532 2.111 1.00 10.22 H new ATOM 0 HD22 ASN A 108 1.396 14.031 2.258 1.00 10.22 H new ATOM 1591 N GLY A 109 0.189 12.498 7.716 1.00 22.11 N ATOM 1592 CA GLY A 109 -0.887 11.852 8.411 1.00 12.30 C ATOM 1593 C GLY A 109 -1.245 10.519 7.812 1.00 75.21 C ATOM 1594 O GLY A 109 -1.873 10.452 6.752 1.00 12.21 O ATOM 0 H GLY A 109 1.125 12.168 7.952 1.00 22.11 H new ATOM 0 HA2 GLY A 109 -0.609 11.714 9.456 1.00 12.30 H new ATOM 0 HA3 GLY A 109 -1.764 12.499 8.398 1.00 12.30 H new ATOM 1598 N THR A 110 -0.770 9.473 8.420 1.00 25.45 N ATOM 1599 CA THR A 110 -1.166 8.150 8.047 1.00 3.13 C ATOM 1600 C THR A 110 -2.432 7.783 8.827 1.00 53.00 C ATOM 1601 O THR A 110 -2.485 7.938 10.060 1.00 2.41 O ATOM 1602 CB THR A 110 -0.046 7.161 8.402 1.00 43.24 C ATOM 1603 OG1 THR A 110 1.172 7.656 7.853 1.00 43.00 O ATOM 1604 CG2 THR A 110 -0.327 5.780 7.823 1.00 1.21 C ATOM 0 H THR A 110 -0.099 9.514 9.187 1.00 25.45 H new ATOM 0 HA THR A 110 -1.358 8.106 6.975 1.00 3.13 H new ATOM 0 HB THR A 110 0.018 7.069 9.486 1.00 43.24 H new ATOM 0 HG1 THR A 110 0.989 8.458 7.320 1.00 43.00 H new ATOM 0 HG21 THR A 110 0.483 5.102 8.091 1.00 1.21 H new ATOM 0 HG22 THR A 110 -1.266 5.401 8.226 1.00 1.21 H new ATOM 0 HG23 THR A 110 -0.399 5.848 6.738 1.00 1.21 H new ATOM 1612 N TYR A 111 -3.439 7.324 8.140 1.00 62.10 N ATOM 1613 CA TYR A 111 -4.642 6.901 8.796 1.00 55.44 C ATOM 1614 C TYR A 111 -4.971 5.500 8.313 1.00 11.54 C ATOM 1615 O TYR A 111 -5.051 5.260 7.123 1.00 34.40 O ATOM 1616 CB TYR A 111 -5.823 7.855 8.483 1.00 73.33 C ATOM 1617 CG TYR A 111 -5.495 9.344 8.571 1.00 51.15 C ATOM 1618 CD1 TYR A 111 -5.441 10.000 9.793 1.00 74.32 C ATOM 1619 CD2 TYR A 111 -5.242 10.090 7.419 1.00 11.11 C ATOM 1620 CE1 TYR A 111 -5.144 11.352 9.867 1.00 64.14 C ATOM 1621 CE2 TYR A 111 -4.946 11.438 7.485 1.00 53.31 C ATOM 1622 CZ TYR A 111 -4.896 12.065 8.707 1.00 62.22 C ATOM 1623 OH TYR A 111 -4.604 13.417 8.778 1.00 41.31 O ATOM 0 H TYR A 111 -3.450 7.233 7.124 1.00 62.10 H new ATOM 0 HA TYR A 111 -4.488 6.915 9.875 1.00 55.44 H new ATOM 0 HB2 TYR A 111 -6.188 7.638 7.479 1.00 73.33 H new ATOM 0 HB3 TYR A 111 -6.638 7.637 9.173 1.00 73.33 H new ATOM 0 HD1 TYR A 111 -5.634 9.448 10.701 1.00 74.32 H new ATOM 0 HD2 TYR A 111 -5.278 9.603 6.456 1.00 11.11 H new ATOM 0 HE1 TYR A 111 -5.106 11.847 10.826 1.00 64.14 H new ATOM 0 HE2 TYR A 111 -4.755 11.996 6.581 1.00 53.31 H new ATOM 0 HH TYR A 111 -4.455 13.767 7.875 1.00 41.31 H new ATOM 1633 N VAL A 112 -5.156 4.595 9.217 1.00 63.35 N ATOM 1634 CA VAL A 112 -5.469 3.230 8.875 1.00 50.23 C ATOM 1635 C VAL A 112 -6.889 2.977 9.313 1.00 13.04 C ATOM 1636 O VAL A 112 -7.255 3.319 10.444 1.00 74.54 O ATOM 1637 CB VAL A 112 -4.504 2.213 9.562 1.00 53.23 C ATOM 1638 CG1 VAL A 112 -4.855 0.776 9.185 1.00 24.34 C ATOM 1639 CG2 VAL A 112 -3.055 2.511 9.194 1.00 74.33 C ATOM 0 H VAL A 112 -5.096 4.773 10.220 1.00 63.35 H new ATOM 0 HA VAL A 112 -5.350 3.088 7.801 1.00 50.23 H new ATOM 0 HB VAL A 112 -4.623 2.323 10.640 1.00 53.23 H new ATOM 0 HG11 VAL A 112 -4.165 0.091 9.679 1.00 24.34 H new ATOM 0 HG12 VAL A 112 -5.874 0.555 9.502 1.00 24.34 H new ATOM 0 HG13 VAL A 112 -4.776 0.654 8.105 1.00 24.34 H new ATOM 0 HG21 VAL A 112 -2.400 1.790 9.683 1.00 74.33 H new ATOM 0 HG22 VAL A 112 -2.932 2.438 8.113 1.00 74.33 H new ATOM 0 HG23 VAL A 112 -2.796 3.518 9.522 1.00 74.33 H new ATOM 1649 N ASN A 113 -7.687 2.398 8.422 1.00 32.10 N ATOM 1650 CA ASN A 113 -9.131 2.159 8.648 1.00 1.31 C ATOM 1651 C ASN A 113 -9.839 3.469 8.942 1.00 55.30 C ATOM 1652 O ASN A 113 -10.805 3.507 9.691 1.00 44.12 O ATOM 1653 CB ASN A 113 -9.362 1.193 9.826 1.00 72.30 C ATOM 1654 CG ASN A 113 -8.869 -0.225 9.611 1.00 53.40 C ATOM 1655 OD1 ASN A 113 -8.387 -0.850 10.551 1.00 14.04 O ATOM 1656 ND2 ASN A 113 -9.022 -0.757 8.419 1.00 73.11 N ATOM 0 H ASN A 113 -7.359 2.074 7.512 1.00 32.10 H new ATOM 0 HA ASN A 113 -9.535 1.711 7.740 1.00 1.31 H new ATOM 0 HB2 ASN A 113 -8.871 1.600 10.710 1.00 72.30 H new ATOM 0 HB3 ASN A 113 -10.430 1.159 10.042 1.00 72.30 H new ATOM 0 HD21 ASN A 113 -8.736 -1.721 8.250 1.00 73.11 H new ATOM 0 HD22 ASN A 113 -9.427 -0.205 7.662 1.00 73.11 H new ATOM 1663 N ARG A 114 -9.409 4.516 8.232 1.00 30.01 N ATOM 1664 CA ARG A 114 -9.932 5.893 8.352 1.00 22.21 C ATOM 1665 C ARG A 114 -9.703 6.511 9.747 1.00 63.31 C ATOM 1666 O ARG A 114 -10.272 7.550 10.073 1.00 51.32 O ATOM 1667 CB ARG A 114 -11.410 6.020 7.928 1.00 21.21 C ATOM 1668 CG ARG A 114 -11.701 5.563 6.506 1.00 14.34 C ATOM 1669 CD ARG A 114 -12.094 4.087 6.431 1.00 64.32 C ATOM 1670 NE ARG A 114 -13.513 3.842 6.769 1.00 34.14 N ATOM 1671 CZ ARG A 114 -13.971 2.961 7.688 1.00 33.44 C ATOM 1672 NH1 ARG A 114 -13.181 2.511 8.658 1.00 5.14 N ATOM 1673 NH2 ARG A 114 -15.248 2.611 7.693 1.00 61.45 N ATOM 0 H ARG A 114 -8.667 4.434 7.537 1.00 30.01 H new ATOM 0 HA ARG A 114 -9.342 6.474 7.643 1.00 22.21 H new ATOM 0 HB2 ARG A 114 -12.023 5.438 8.616 1.00 21.21 H new ATOM 0 HB3 ARG A 114 -11.716 7.061 8.031 1.00 21.21 H new ATOM 0 HG2 ARG A 114 -12.505 6.171 6.090 1.00 14.34 H new ATOM 0 HG3 ARG A 114 -10.820 5.733 5.887 1.00 14.34 H new ATOM 0 HD2 ARG A 114 -11.898 3.717 5.425 1.00 64.32 H new ATOM 0 HD3 ARG A 114 -11.462 3.515 7.110 1.00 64.32 H new ATOM 0 HE ARG A 114 -14.210 4.387 6.263 1.00 34.14 H new ATOM 0 HH11 ARG A 114 -12.214 2.830 8.717 1.00 5.14 H new ATOM 0 HH12 ARG A 114 -13.542 1.847 9.343 1.00 5.14 H new ATOM 0 HH21 ARG A 114 -15.888 3.006 7.003 1.00 61.45 H new ATOM 0 HH22 ARG A 114 -15.592 1.947 8.386 1.00 61.45 H new ATOM 1687 N GLU A 115 -8.849 5.901 10.535 1.00 72.13 N ATOM 1688 CA GLU A 115 -8.509 6.409 11.838 1.00 41.43 C ATOM 1689 C GLU A 115 -7.044 6.727 11.913 1.00 73.45 C ATOM 1690 O GLU A 115 -6.232 6.038 11.293 1.00 0.01 O ATOM 1691 CB GLU A 115 -8.801 5.395 12.926 1.00 2.11 C ATOM 1692 CG GLU A 115 -10.240 5.225 13.300 1.00 2.04 C ATOM 1693 CD GLU A 115 -10.364 4.288 14.456 1.00 14.43 C ATOM 1694 OE1 GLU A 115 -9.589 4.432 15.446 1.00 62.03 O ATOM 1695 OE2 GLU A 115 -11.225 3.397 14.427 1.00 54.10 O ATOM 0 H GLU A 115 -8.370 5.035 10.287 1.00 72.13 H new ATOM 0 HA GLU A 115 -9.113 7.303 11.990 1.00 41.43 H new ATOM 0 HB2 GLU A 115 -8.413 4.428 12.606 1.00 2.11 H new ATOM 0 HB3 GLU A 115 -8.246 5.681 13.819 1.00 2.11 H new ATOM 0 HG2 GLU A 115 -10.673 6.191 13.558 1.00 2.04 H new ATOM 0 HG3 GLU A 115 -10.802 4.841 12.449 1.00 2.04 H new ATOM 1702 N PRO A 116 -6.668 7.776 12.653 1.00 31.43 N ATOM 1703 CA PRO A 116 -5.269 8.047 12.934 1.00 63.31 C ATOM 1704 C PRO A 116 -4.687 6.852 13.679 1.00 50.03 C ATOM 1705 O PRO A 116 -5.208 6.440 14.734 1.00 4.14 O ATOM 1706 CB PRO A 116 -5.310 9.281 13.847 1.00 33.41 C ATOM 1707 CG PRO A 116 -6.630 9.914 13.576 1.00 63.41 C ATOM 1708 CD PRO A 116 -7.564 8.793 13.229 1.00 65.40 C ATOM 0 HA PRO A 116 -4.661 8.214 12.045 1.00 63.31 H new ATOM 0 HB2 PRO A 116 -5.214 9.000 14.896 1.00 33.41 H new ATOM 0 HB3 PRO A 116 -4.491 9.965 13.624 1.00 33.41 H new ATOM 0 HG2 PRO A 116 -6.986 10.462 14.448 1.00 63.41 H new ATOM 0 HG3 PRO A 116 -6.558 10.630 12.757 1.00 63.41 H new ATOM 0 HD2 PRO A 116 -8.087 8.417 14.109 1.00 65.40 H new ATOM 0 HD3 PRO A 116 -8.326 9.109 12.516 1.00 65.40 H new ATOM 1716 N ARG A 117 -3.642 6.292 13.132 1.00 34.33 N ATOM 1717 CA ARG A 117 -3.059 5.088 13.654 1.00 31.01 C ATOM 1718 C ARG A 117 -1.550 5.232 13.579 1.00 44.14 C ATOM 1719 O ARG A 117 -1.042 5.889 12.672 1.00 0.44 O ATOM 1720 CB ARG A 117 -3.539 3.893 12.800 1.00 10.43 C ATOM 1721 CG ARG A 117 -3.165 2.512 13.326 1.00 30.14 C ATOM 1722 CD ARG A 117 -3.853 2.200 14.651 1.00 62.23 C ATOM 1723 NE ARG A 117 -5.316 2.121 14.529 1.00 72.43 N ATOM 1724 CZ ARG A 117 -6.203 2.809 15.266 1.00 62.22 C ATOM 1725 NH1 ARG A 117 -5.785 3.690 16.184 1.00 34.43 N ATOM 1726 NH2 ARG A 117 -7.504 2.594 15.093 1.00 3.34 N ATOM 0 H ARG A 117 -3.169 6.661 12.307 1.00 34.33 H new ATOM 0 HA ARG A 117 -3.356 4.917 14.689 1.00 31.01 H new ATOM 0 HB2 ARG A 117 -4.624 3.946 12.711 1.00 10.43 H new ATOM 0 HB3 ARG A 117 -3.131 4.001 11.795 1.00 10.43 H new ATOM 0 HG2 ARG A 117 -3.438 1.757 12.589 1.00 30.14 H new ATOM 0 HG3 ARG A 117 -2.084 2.454 13.456 1.00 30.14 H new ATOM 0 HD2 ARG A 117 -3.474 1.254 15.038 1.00 62.23 H new ATOM 0 HD3 ARG A 117 -3.595 2.969 15.379 1.00 62.23 H new ATOM 0 HE ARG A 117 -5.690 1.488 13.822 1.00 72.43 H new ATOM 0 HH11 ARG A 117 -4.787 3.842 16.327 1.00 34.43 H new ATOM 0 HH12 ARG A 117 -6.465 4.209 16.740 1.00 34.43 H new ATOM 0 HH21 ARG A 117 -7.821 1.911 14.405 1.00 3.34 H new ATOM 0 HH22 ARG A 117 -8.185 3.112 15.648 1.00 3.34 H new ATOM 1740 N ASN A 118 -0.847 4.673 14.531 1.00 20.25 N ATOM 1741 CA ASN A 118 0.607 4.776 14.548 1.00 35.32 C ATOM 1742 C ASN A 118 1.245 3.482 14.083 1.00 44.53 C ATOM 1743 O ASN A 118 2.180 3.495 13.286 1.00 75.21 O ATOM 1744 CB ASN A 118 1.122 5.168 15.939 1.00 70.24 C ATOM 1745 CG ASN A 118 0.605 6.524 16.391 1.00 21.23 C ATOM 1746 OD1 ASN A 118 -0.463 6.620 17.004 1.00 35.31 O ATOM 1747 ND2 ASN A 118 1.337 7.575 16.111 1.00 64.54 N ATOM 0 H ASN A 118 -1.247 4.142 15.305 1.00 20.25 H new ATOM 0 HA ASN A 118 0.892 5.566 13.853 1.00 35.32 H new ATOM 0 HB2 ASN A 118 0.821 4.409 16.661 1.00 70.24 H new ATOM 0 HB3 ASN A 118 2.212 5.184 15.928 1.00 70.24 H new ATOM 0 HD21 ASN A 118 1.029 8.503 16.401 1.00 64.54 H new ATOM 0 HD22 ASN A 118 2.215 7.465 15.603 1.00 64.54 H new ATOM 1754 N ALA A 119 0.735 2.371 14.565 1.00 44.02 N ATOM 1755 CA ALA A 119 1.216 1.065 14.168 1.00 63.04 C ATOM 1756 C ALA A 119 0.042 0.123 14.148 1.00 45.02 C ATOM 1757 O ALA A 119 -0.790 0.157 15.059 1.00 33.34 O ATOM 1758 CB ALA A 119 2.278 0.569 15.146 1.00 70.22 C ATOM 0 H ALA A 119 -0.026 2.346 15.244 1.00 44.02 H new ATOM 0 HA ALA A 119 1.673 1.118 13.180 1.00 63.04 H new ATOM 0 HB1 ALA A 119 2.630 -0.414 14.834 1.00 70.22 H new ATOM 0 HB2 ALA A 119 3.115 1.267 15.158 1.00 70.22 H new ATOM 0 HB3 ALA A 119 1.848 0.500 16.145 1.00 70.22 H new ATOM 1764 N GLN A 120 -0.056 -0.690 13.133 1.00 0.31 N ATOM 1765 CA GLN A 120 -1.173 -1.604 13.021 1.00 52.24 C ATOM 1766 C GLN A 120 -0.781 -2.859 12.281 1.00 3.13 C ATOM 1767 O GLN A 120 -0.092 -2.793 11.251 1.00 71.34 O ATOM 1768 CB GLN A 120 -2.342 -0.911 12.288 1.00 23.14 C ATOM 1769 CG GLN A 120 -3.615 -1.753 12.137 1.00 64.05 C ATOM 1770 CD GLN A 120 -4.234 -2.156 13.467 1.00 74.20 C ATOM 1771 OE1 GLN A 120 -4.120 -1.452 14.461 1.00 43.24 O ATOM 1772 NE2 GLN A 120 -4.911 -3.263 13.486 1.00 64.42 N ATOM 0 H GLN A 120 0.619 -0.743 12.370 1.00 0.31 H new ATOM 0 HA GLN A 120 -1.484 -1.885 14.027 1.00 52.24 H new ATOM 0 HB2 GLN A 120 -2.593 0.004 12.824 1.00 23.14 H new ATOM 0 HB3 GLN A 120 -2.002 -0.616 11.295 1.00 23.14 H new ATOM 0 HG2 GLN A 120 -4.348 -1.190 11.559 1.00 64.05 H new ATOM 0 HG3 GLN A 120 -3.382 -2.652 11.566 1.00 64.05 H new ATOM 0 HE21 GLN A 120 -4.988 -3.828 12.641 1.00 64.42 H new ATOM 0 HE22 GLN A 120 -5.366 -3.568 14.346 1.00 64.42 H new ATOM 1781 N VAL A 121 -1.181 -3.995 12.816 1.00 1.11 N ATOM 1782 CA VAL A 121 -1.043 -5.244 12.115 1.00 74.04 C ATOM 1783 C VAL A 121 -2.193 -5.256 11.126 1.00 31.41 C ATOM 1784 O VAL A 121 -3.358 -5.240 11.528 1.00 21.11 O ATOM 1785 CB VAL A 121 -1.176 -6.465 13.076 1.00 22.54 C ATOM 1786 CG1 VAL A 121 -0.962 -7.776 12.327 1.00 43.10 C ATOM 1787 CG2 VAL A 121 -0.208 -6.357 14.250 1.00 24.03 C ATOM 0 H VAL A 121 -1.606 -4.073 13.740 1.00 1.11 H new ATOM 0 HA VAL A 121 -0.063 -5.324 11.644 1.00 74.04 H new ATOM 0 HB VAL A 121 -2.191 -6.458 13.474 1.00 22.54 H new ATOM 0 HG11 VAL A 121 -1.060 -8.611 13.020 1.00 43.10 H new ATOM 0 HG12 VAL A 121 -1.708 -7.870 11.538 1.00 43.10 H new ATOM 0 HG13 VAL A 121 0.035 -7.785 11.887 1.00 43.10 H new ATOM 0 HG21 VAL A 121 -0.327 -7.224 14.900 1.00 24.03 H new ATOM 0 HG22 VAL A 121 0.815 -6.321 13.876 1.00 24.03 H new ATOM 0 HG23 VAL A 121 -0.420 -5.449 14.814 1.00 24.03 H new ATOM 1797 N MET A 122 -1.895 -5.225 9.865 1.00 23.05 N ATOM 1798 CA MET A 122 -2.943 -5.075 8.886 1.00 65.33 C ATOM 1799 C MET A 122 -3.396 -6.362 8.292 1.00 73.25 C ATOM 1800 O MET A 122 -2.610 -7.286 8.078 1.00 22.11 O ATOM 1801 CB MET A 122 -2.612 -4.045 7.819 1.00 14.51 C ATOM 1802 CG MET A 122 -2.664 -2.615 8.332 1.00 5.23 C ATOM 1803 SD MET A 122 -2.327 -1.393 7.057 1.00 64.14 S ATOM 1804 CE MET A 122 -3.604 -1.771 5.871 1.00 52.13 C ATOM 0 H MET A 122 -0.951 -5.300 9.486 1.00 23.05 H new ATOM 0 HA MET A 122 -3.794 -4.688 9.447 1.00 65.33 H new ATOM 0 HB2 MET A 122 -1.616 -4.247 7.425 1.00 14.51 H new ATOM 0 HB3 MET A 122 -3.311 -4.153 6.990 1.00 14.51 H new ATOM 0 HG2 MET A 122 -3.649 -2.424 8.758 1.00 5.23 H new ATOM 0 HG3 MET A 122 -1.940 -2.498 9.138 1.00 5.23 H new ATOM 0 HE1 MET A 122 -3.320 -1.381 4.894 1.00 52.13 H new ATOM 0 HE2 MET A 122 -3.733 -2.851 5.807 1.00 52.13 H new ATOM 0 HE3 MET A 122 -4.541 -1.312 6.186 1.00 52.13 H new ATOM 1814 N GLN A 123 -4.664 -6.404 8.030 1.00 53.31 N ATOM 1815 CA GLN A 123 -5.323 -7.538 7.497 1.00 54.32 C ATOM 1816 C GLN A 123 -5.937 -7.151 6.168 1.00 74.12 C ATOM 1817 O GLN A 123 -6.115 -5.960 5.877 1.00 12.42 O ATOM 1818 CB GLN A 123 -6.351 -8.097 8.515 1.00 5.42 C ATOM 1819 CG GLN A 123 -7.451 -7.126 8.934 1.00 3.43 C ATOM 1820 CD GLN A 123 -8.679 -7.190 8.053 1.00 25.00 C ATOM 1821 OE1 GLN A 123 -9.050 -8.261 7.557 1.00 50.33 O ATOM 1822 NE2 GLN A 123 -9.284 -6.064 7.805 1.00 30.12 N ATOM 0 H GLN A 123 -5.288 -5.613 8.191 1.00 53.31 H new ATOM 0 HA GLN A 123 -4.619 -8.351 7.316 1.00 54.32 H new ATOM 0 HB2 GLN A 123 -6.817 -8.984 8.085 1.00 5.42 H new ATOM 0 HB3 GLN A 123 -5.815 -8.419 9.408 1.00 5.42 H new ATOM 0 HG2 GLN A 123 -7.740 -7.339 9.963 1.00 3.43 H new ATOM 0 HG3 GLN A 123 -7.054 -6.111 8.918 1.00 3.43 H new ATOM 0 HE21 GLN A 123 -8.949 -5.200 8.232 1.00 30.12 H new ATOM 0 HE22 GLN A 123 -10.093 -6.046 7.183 1.00 30.12 H new ATOM 1831 N THR A 124 -6.184 -8.118 5.346 1.00 1.04 N ATOM 1832 CA THR A 124 -6.698 -7.925 4.056 1.00 61.42 C ATOM 1833 C THR A 124 -8.059 -7.197 4.089 1.00 2.13 C ATOM 1834 O THR A 124 -8.992 -7.635 4.759 1.00 63.32 O ATOM 1835 CB THR A 124 -6.827 -9.311 3.469 1.00 72.32 C ATOM 1836 OG1 THR A 124 -7.363 -10.178 4.488 1.00 24.43 O ATOM 1837 CG2 THR A 124 -5.471 -9.835 3.021 1.00 22.33 C ATOM 0 H THR A 124 -6.022 -9.098 5.577 1.00 1.04 H new ATOM 0 HA THR A 124 -6.046 -7.291 3.455 1.00 61.42 H new ATOM 0 HB THR A 124 -7.484 -9.280 2.600 1.00 72.32 H new ATOM 0 HG1 THR A 124 -8.112 -9.732 4.936 1.00 24.43 H new ATOM 0 HG21 THR A 124 -5.588 -10.834 2.602 1.00 22.33 H new ATOM 0 HG22 THR A 124 -5.056 -9.170 2.264 1.00 22.33 H new ATOM 0 HG23 THR A 124 -4.796 -9.877 3.876 1.00 22.33 H new ATOM 1845 N GLY A 125 -8.153 -6.122 3.342 1.00 34.24 N ATOM 1846 CA GLY A 125 -9.343 -5.308 3.327 1.00 54.33 C ATOM 1847 C GLY A 125 -9.216 -4.036 4.162 1.00 71.34 C ATOM 1848 O GLY A 125 -10.121 -3.200 4.144 1.00 2.53 O ATOM 0 H GLY A 125 -7.408 -5.789 2.730 1.00 34.24 H new ATOM 0 HA2 GLY A 125 -9.576 -5.037 2.297 1.00 54.33 H new ATOM 0 HA3 GLY A 125 -10.182 -5.896 3.699 1.00 54.33 H new ATOM 1852 N ASP A 126 -8.108 -3.874 4.882 1.00 51.31 N ATOM 1853 CA ASP A 126 -7.865 -2.615 5.597 1.00 62.21 C ATOM 1854 C ASP A 126 -7.410 -1.552 4.606 1.00 33.23 C ATOM 1855 O ASP A 126 -6.686 -1.859 3.635 1.00 4.22 O ATOM 1856 CB ASP A 126 -6.792 -2.734 6.703 1.00 21.30 C ATOM 1857 CG ASP A 126 -7.175 -3.548 7.916 1.00 73.13 C ATOM 1858 OD1 ASP A 126 -8.334 -3.462 8.369 1.00 51.20 O ATOM 1859 OD2 ASP A 126 -6.309 -4.280 8.445 1.00 63.54 O ATOM 0 H ASP A 126 -7.377 -4.578 4.988 1.00 51.31 H new ATOM 0 HA ASP A 126 -8.806 -2.346 6.077 1.00 62.21 H new ATOM 0 HB2 ASP A 126 -5.895 -3.172 6.265 1.00 21.30 H new ATOM 0 HB3 ASP A 126 -6.527 -1.730 7.034 1.00 21.30 H new ATOM 1864 N GLU A 127 -7.820 -0.328 4.819 1.00 51.24 N ATOM 1865 CA GLU A 127 -7.442 0.759 3.946 1.00 3.25 C ATOM 1866 C GLU A 127 -6.524 1.752 4.657 1.00 40.14 C ATOM 1867 O GLU A 127 -6.666 2.004 5.866 1.00 43.44 O ATOM 1868 CB GLU A 127 -8.670 1.496 3.363 1.00 72.31 C ATOM 1869 CG GLU A 127 -9.597 2.166 4.389 1.00 34.25 C ATOM 1870 CD GLU A 127 -10.439 1.190 5.182 1.00 51.14 C ATOM 1871 OE1 GLU A 127 -9.970 0.688 6.220 1.00 42.22 O ATOM 1872 OE2 GLU A 127 -11.586 0.929 4.768 1.00 10.43 O ATOM 0 H GLU A 127 -8.421 -0.055 5.596 1.00 51.24 H new ATOM 0 HA GLU A 127 -6.897 0.311 3.116 1.00 3.25 H new ATOM 0 HB2 GLU A 127 -8.317 2.258 2.669 1.00 72.31 H new ATOM 0 HB3 GLU A 127 -9.256 0.783 2.783 1.00 72.31 H new ATOM 0 HG2 GLU A 127 -8.993 2.755 5.080 1.00 34.25 H new ATOM 0 HG3 GLU A 127 -10.256 2.861 3.869 1.00 34.25 H new ATOM 1879 N ILE A 128 -5.602 2.312 3.909 1.00 22.31 N ATOM 1880 CA ILE A 128 -4.666 3.289 4.411 1.00 53.23 C ATOM 1881 C ILE A 128 -4.904 4.607 3.685 1.00 72.53 C ATOM 1882 O ILE A 128 -4.921 4.659 2.457 1.00 35.44 O ATOM 1883 CB ILE A 128 -3.188 2.878 4.151 1.00 33.21 C ATOM 1884 CG1 ILE A 128 -2.924 1.452 4.625 1.00 20.04 C ATOM 1885 CG2 ILE A 128 -2.239 3.845 4.865 1.00 0.45 C ATOM 1886 CD1 ILE A 128 -1.522 0.954 4.321 1.00 72.35 C ATOM 0 H ILE A 128 -5.480 2.098 2.919 1.00 22.31 H new ATOM 0 HA ILE A 128 -4.823 3.371 5.486 1.00 53.23 H new ATOM 0 HB ILE A 128 -3.009 2.922 3.077 1.00 33.21 H new ATOM 0 HG12 ILE A 128 -3.093 1.400 5.701 1.00 20.04 H new ATOM 0 HG13 ILE A 128 -3.646 0.784 4.156 1.00 20.04 H new ATOM 0 HG21 ILE A 128 -1.207 3.548 4.676 1.00 0.45 H new ATOM 0 HG22 ILE A 128 -2.400 4.856 4.490 1.00 0.45 H new ATOM 0 HG23 ILE A 128 -2.433 3.820 5.937 1.00 0.45 H new ATOM 0 HD11 ILE A 128 -1.411 -0.066 4.688 1.00 72.35 H new ATOM 0 HD12 ILE A 128 -1.355 0.973 3.244 1.00 72.35 H new ATOM 0 HD13 ILE A 128 -0.793 1.598 4.812 1.00 72.35 H new ATOM 1898 N GLN A 129 -5.088 5.633 4.426 1.00 61.02 N ATOM 1899 CA GLN A 129 -5.258 6.953 3.910 1.00 75.42 C ATOM 1900 C GLN A 129 -3.935 7.654 4.182 1.00 64.43 C ATOM 1901 O GLN A 129 -3.549 7.821 5.341 1.00 64.25 O ATOM 1902 CB GLN A 129 -6.380 7.642 4.692 1.00 74.24 C ATOM 1903 CG GLN A 129 -6.880 8.985 4.159 1.00 34.42 C ATOM 1904 CD GLN A 129 -7.752 8.855 2.922 1.00 4.25 C ATOM 1905 OE1 GLN A 129 -8.960 8.680 3.017 1.00 0.13 O ATOM 1906 NE2 GLN A 129 -7.181 8.966 1.775 1.00 11.11 N ATOM 0 H GLN A 129 -5.127 5.584 5.444 1.00 61.02 H new ATOM 0 HA GLN A 129 -5.516 6.967 2.851 1.00 75.42 H new ATOM 0 HB2 GLN A 129 -7.229 6.959 4.737 1.00 74.24 H new ATOM 0 HB3 GLN A 129 -6.036 7.792 5.715 1.00 74.24 H new ATOM 0 HG2 GLN A 129 -7.445 9.491 4.942 1.00 34.42 H new ATOM 0 HG3 GLN A 129 -6.023 9.617 3.926 1.00 34.42 H new ATOM 0 HE21 GLN A 129 -6.173 9.111 1.719 1.00 11.11 H new ATOM 0 HE22 GLN A 129 -7.736 8.909 0.921 1.00 11.11 H new ATOM 1915 N ILE A 130 -3.221 7.988 3.147 1.00 3.32 N ATOM 1916 CA ILE A 130 -1.946 8.639 3.289 1.00 21.44 C ATOM 1917 C ILE A 130 -2.100 10.059 2.833 1.00 53.12 C ATOM 1918 O ILE A 130 -2.225 10.329 1.620 1.00 63.33 O ATOM 1919 CB ILE A 130 -0.824 7.938 2.457 1.00 22.21 C ATOM 1920 CG1 ILE A 130 -0.636 6.483 2.921 1.00 22.24 C ATOM 1921 CG2 ILE A 130 0.495 8.714 2.559 1.00 44.32 C ATOM 1922 CD1 ILE A 130 0.441 5.713 2.172 1.00 61.31 C ATOM 0 H ILE A 130 -3.503 7.818 2.181 1.00 3.32 H new ATOM 0 HA ILE A 130 -1.643 8.588 4.335 1.00 21.44 H new ATOM 0 HB ILE A 130 -1.131 7.928 1.411 1.00 22.21 H new ATOM 0 HG12 ILE A 130 -0.392 6.483 3.983 1.00 22.24 H new ATOM 0 HG13 ILE A 130 -1.584 5.955 2.812 1.00 22.24 H new ATOM 0 HG21 ILE A 130 1.261 8.208 1.972 1.00 44.32 H new ATOM 0 HG22 ILE A 130 0.353 9.725 2.176 1.00 44.32 H new ATOM 0 HG23 ILE A 130 0.809 8.762 3.602 1.00 44.32 H new ATOM 0 HD11 ILE A 130 0.503 4.698 2.566 1.00 61.31 H new ATOM 0 HD12 ILE A 130 0.191 5.676 1.112 1.00 61.31 H new ATOM 0 HD13 ILE A 130 1.401 6.212 2.301 1.00 61.31 H new ATOM 1934 N GLY A 131 -2.163 10.952 3.795 1.00 12.14 N ATOM 1935 CA GLY A 131 -2.323 12.341 3.508 1.00 43.50 C ATOM 1936 C GLY A 131 -3.677 12.623 2.909 1.00 55.34 C ATOM 1937 O GLY A 131 -4.675 12.676 3.615 1.00 52.13 O ATOM 0 H GLY A 131 -2.104 10.728 4.788 1.00 12.14 H new ATOM 0 HA2 GLY A 131 -2.200 12.920 4.423 1.00 43.50 H new ATOM 0 HA3 GLY A 131 -1.543 12.664 2.819 1.00 43.50 H new ATOM 1941 N LYS A 132 -3.718 12.737 1.602 1.00 15.42 N ATOM 1942 CA LYS A 132 -4.944 13.046 0.916 1.00 25.42 C ATOM 1943 C LYS A 132 -5.388 11.969 -0.079 1.00 33.34 C ATOM 1944 O LYS A 132 -6.403 12.137 -0.751 1.00 10.01 O ATOM 1945 CB LYS A 132 -4.896 14.452 0.285 1.00 0.54 C ATOM 1946 CG LYS A 132 -3.630 14.749 -0.505 1.00 53.11 C ATOM 1947 CD LYS A 132 -3.613 16.186 -1.040 1.00 1.13 C ATOM 1948 CE LYS A 132 -4.586 16.394 -2.199 1.00 4.02 C ATOM 1949 NZ LYS A 132 -4.210 15.595 -3.392 1.00 11.11 N ATOM 0 H LYS A 132 -2.909 12.619 0.992 1.00 15.42 H new ATOM 0 HA LYS A 132 -5.722 13.054 1.679 1.00 25.42 H new ATOM 0 HB2 LYS A 132 -5.756 14.569 -0.374 1.00 0.54 H new ATOM 0 HB3 LYS A 132 -4.997 15.195 1.076 1.00 0.54 H new ATOM 0 HG2 LYS A 132 -2.759 14.588 0.131 1.00 53.11 H new ATOM 0 HG3 LYS A 132 -3.550 14.051 -1.338 1.00 53.11 H new ATOM 0 HD2 LYS A 132 -3.864 16.873 -0.232 1.00 1.13 H new ATOM 0 HD3 LYS A 132 -2.604 16.435 -1.369 1.00 1.13 H new ATOM 0 HE2 LYS A 132 -5.592 16.119 -1.881 1.00 4.02 H new ATOM 0 HE3 LYS A 132 -4.613 17.451 -2.464 1.00 4.02 H new ATOM 0 HZ1 LYS A 132 -4.715 15.957 -4.226 1.00 11.11 H new ATOM 0 HZ2 LYS A 132 -3.185 15.668 -3.550 1.00 11.11 H new ATOM 0 HZ3 LYS A 132 -4.466 14.599 -3.238 1.00 11.11 H new ATOM 1963 N PHE A 133 -4.669 10.869 -0.179 1.00 72.34 N ATOM 1964 CA PHE A 133 -5.101 9.791 -1.050 1.00 12.03 C ATOM 1965 C PHE A 133 -5.070 8.440 -0.351 1.00 34.51 C ATOM 1966 O PHE A 133 -4.549 8.334 0.759 1.00 13.12 O ATOM 1967 CB PHE A 133 -4.438 9.810 -2.429 1.00 44.44 C ATOM 1968 CG PHE A 133 -2.953 9.956 -2.466 1.00 44.22 C ATOM 1969 CD1 PHE A 133 -2.129 8.857 -2.356 1.00 32.32 C ATOM 1970 CD2 PHE A 133 -2.383 11.202 -2.653 1.00 22.23 C ATOM 1971 CE1 PHE A 133 -0.766 9.000 -2.425 1.00 34.31 C ATOM 1972 CE2 PHE A 133 -1.021 11.350 -2.732 1.00 20.33 C ATOM 1973 CZ PHE A 133 -0.210 10.253 -2.618 1.00 44.24 C ATOM 0 H PHE A 133 -3.797 10.698 0.322 1.00 72.34 H new ATOM 0 HA PHE A 133 -6.152 9.977 -1.271 1.00 12.03 H new ATOM 0 HB2 PHE A 133 -4.700 8.886 -2.943 1.00 44.44 H new ATOM 0 HB3 PHE A 133 -4.873 10.628 -3.003 1.00 44.44 H new ATOM 0 HD1 PHE A 133 -2.559 7.876 -2.215 1.00 32.32 H new ATOM 0 HD2 PHE A 133 -3.019 12.071 -2.738 1.00 22.23 H new ATOM 0 HE1 PHE A 133 -0.127 8.135 -2.329 1.00 34.31 H new ATOM 0 HE2 PHE A 133 -0.590 12.329 -2.884 1.00 20.33 H new ATOM 0 HZ PHE A 133 0.862 10.365 -2.679 1.00 44.24 H new ATOM 1983 N ARG A 134 -5.647 7.418 -0.959 1.00 3.22 N ATOM 1984 CA ARG A 134 -5.870 6.165 -0.247 1.00 34.13 C ATOM 1985 C ARG A 134 -5.356 4.946 -1.008 1.00 54.22 C ATOM 1986 O ARG A 134 -5.506 4.838 -2.236 1.00 53.34 O ATOM 1987 CB ARG A 134 -7.378 6.016 0.069 1.00 4.11 C ATOM 1988 CG ARG A 134 -7.752 4.801 0.917 1.00 74.40 C ATOM 1989 CD ARG A 134 -9.251 4.752 1.207 1.00 53.22 C ATOM 1990 NE ARG A 134 -9.727 5.937 1.946 1.00 42.30 N ATOM 1991 CZ ARG A 134 -10.929 6.054 2.538 1.00 51.22 C ATOM 1992 NH1 ARG A 134 -11.782 5.035 2.565 1.00 71.43 N ATOM 1993 NH2 ARG A 134 -11.258 7.192 3.120 1.00 74.44 N ATOM 0 H ARG A 134 -5.966 7.426 -1.928 1.00 3.22 H new ATOM 0 HA ARG A 134 -5.297 6.207 0.679 1.00 34.13 H new ATOM 0 HB2 ARG A 134 -7.715 6.915 0.585 1.00 4.11 H new ATOM 0 HB3 ARG A 134 -7.926 5.964 -0.872 1.00 4.11 H new ATOM 0 HG2 ARG A 134 -7.452 3.890 0.399 1.00 74.40 H new ATOM 0 HG3 ARG A 134 -7.201 4.830 1.857 1.00 74.40 H new ATOM 0 HD2 ARG A 134 -9.796 4.672 0.267 1.00 53.22 H new ATOM 0 HD3 ARG A 134 -9.476 3.855 1.783 1.00 53.22 H new ATOM 0 HE ARG A 134 -9.092 6.733 2.013 1.00 42.30 H new ATOM 0 HH11 ARG A 134 -11.529 4.147 2.132 1.00 71.43 H new ATOM 0 HH12 ARG A 134 -12.689 5.141 3.018 1.00 71.43 H new ATOM 0 HH21 ARG A 134 -10.603 7.974 3.118 1.00 74.44 H new ATOM 0 HH22 ARG A 134 -12.167 7.290 3.571 1.00 74.44 H new ATOM 2007 N LEU A 135 -4.754 4.051 -0.261 1.00 3.22 N ATOM 2008 CA LEU A 135 -4.239 2.787 -0.742 1.00 73.51 C ATOM 2009 C LEU A 135 -4.935 1.697 0.062 1.00 2.04 C ATOM 2010 O LEU A 135 -5.155 1.869 1.250 1.00 63.41 O ATOM 2011 CB LEU A 135 -2.701 2.668 -0.535 1.00 65.13 C ATOM 2012 CG LEU A 135 -1.764 3.625 -1.322 1.00 14.21 C ATOM 2013 CD1 LEU A 135 -1.892 5.079 -0.878 1.00 64.35 C ATOM 2014 CD2 LEU A 135 -0.327 3.163 -1.201 1.00 23.21 C ATOM 0 H LEU A 135 -4.603 4.187 0.738 1.00 3.22 H new ATOM 0 HA LEU A 135 -4.428 2.700 -1.812 1.00 73.51 H new ATOM 0 HB2 LEU A 135 -2.499 2.808 0.527 1.00 65.13 H new ATOM 0 HB3 LEU A 135 -2.413 1.646 -0.782 1.00 65.13 H new ATOM 0 HG LEU A 135 -2.076 3.587 -2.366 1.00 14.21 H new ATOM 0 HD11 LEU A 135 -1.213 5.699 -1.463 1.00 64.35 H new ATOM 0 HD12 LEU A 135 -2.917 5.417 -1.032 1.00 64.35 H new ATOM 0 HD13 LEU A 135 -1.638 5.160 0.179 1.00 64.35 H new ATOM 0 HD21 LEU A 135 0.321 3.841 -1.756 1.00 23.21 H new ATOM 0 HD22 LEU A 135 -0.033 3.159 -0.151 1.00 23.21 H new ATOM 0 HD23 LEU A 135 -0.233 2.156 -1.608 1.00 23.21 H new ATOM 2026 N VAL A 136 -5.309 0.623 -0.560 1.00 73.21 N ATOM 2027 CA VAL A 136 -6.021 -0.438 0.134 1.00 72.22 C ATOM 2028 C VAL A 136 -5.174 -1.711 0.122 1.00 20.43 C ATOM 2029 O VAL A 136 -4.499 -2.004 -0.873 1.00 10.52 O ATOM 2030 CB VAL A 136 -7.432 -0.709 -0.489 1.00 43.03 C ATOM 2031 CG1 VAL A 136 -8.239 -1.687 0.368 1.00 31.23 C ATOM 2032 CG2 VAL A 136 -8.211 0.588 -0.675 1.00 10.25 C ATOM 0 H VAL A 136 -5.139 0.445 -1.550 1.00 73.21 H new ATOM 0 HA VAL A 136 -6.187 -0.117 1.162 1.00 72.22 H new ATOM 0 HB VAL A 136 -7.271 -1.160 -1.468 1.00 43.03 H new ATOM 0 HG11 VAL A 136 -9.213 -1.855 -0.091 1.00 31.23 H new ATOM 0 HG12 VAL A 136 -7.704 -2.634 0.440 1.00 31.23 H new ATOM 0 HG13 VAL A 136 -8.375 -1.270 1.366 1.00 31.23 H new ATOM 0 HG21 VAL A 136 -9.186 0.368 -1.109 1.00 10.25 H new ATOM 0 HG22 VAL A 136 -8.345 1.073 0.292 1.00 10.25 H new ATOM 0 HG23 VAL A 136 -7.659 1.252 -1.341 1.00 10.25 H new ATOM 2042 N PHE A 137 -5.172 -2.424 1.221 1.00 53.00 N ATOM 2043 CA PHE A 137 -4.393 -3.639 1.370 1.00 1.25 C ATOM 2044 C PHE A 137 -5.267 -4.846 0.987 1.00 33.34 C ATOM 2045 O PHE A 137 -6.277 -5.116 1.635 1.00 44.34 O ATOM 2046 CB PHE A 137 -3.932 -3.717 2.830 1.00 22.53 C ATOM 2047 CG PHE A 137 -2.984 -4.827 3.177 1.00 42.50 C ATOM 2048 CD1 PHE A 137 -1.641 -4.730 2.857 1.00 22.40 C ATOM 2049 CD2 PHE A 137 -3.428 -5.947 3.851 1.00 10.44 C ATOM 2050 CE1 PHE A 137 -0.762 -5.733 3.199 1.00 1.23 C ATOM 2051 CE2 PHE A 137 -2.554 -6.954 4.202 1.00 72.13 C ATOM 2052 CZ PHE A 137 -1.220 -6.845 3.876 1.00 51.13 C ATOM 0 H PHE A 137 -5.715 -2.179 2.049 1.00 53.00 H new ATOM 0 HA PHE A 137 -3.520 -3.641 0.718 1.00 1.25 H new ATOM 0 HB2 PHE A 137 -3.457 -2.770 3.088 1.00 22.53 H new ATOM 0 HB3 PHE A 137 -4.815 -3.813 3.461 1.00 22.53 H new ATOM 0 HD1 PHE A 137 -1.278 -3.858 2.333 1.00 22.40 H new ATOM 0 HD2 PHE A 137 -4.474 -6.036 4.107 1.00 10.44 H new ATOM 0 HE1 PHE A 137 0.283 -5.650 2.938 1.00 1.23 H new ATOM 0 HE2 PHE A 137 -2.914 -7.825 4.730 1.00 72.13 H new ATOM 0 HZ PHE A 137 -0.532 -7.631 4.151 1.00 51.13 H new ATOM 2062 N LEU A 138 -4.897 -5.545 -0.072 1.00 2.22 N ATOM 2063 CA LEU A 138 -5.680 -6.678 -0.576 1.00 13.35 C ATOM 2064 C LEU A 138 -4.884 -7.969 -0.542 1.00 71.23 C ATOM 2065 O LEU A 138 -3.644 -7.957 -0.466 1.00 5.11 O ATOM 2066 CB LEU A 138 -6.205 -6.466 -2.024 1.00 0.15 C ATOM 2067 CG LEU A 138 -7.334 -5.440 -2.265 1.00 74.01 C ATOM 2068 CD1 LEU A 138 -6.861 -4.017 -2.088 1.00 24.21 C ATOM 2069 CD2 LEU A 138 -7.927 -5.631 -3.649 1.00 44.42 C ATOM 0 H LEU A 138 -4.052 -5.351 -0.609 1.00 2.22 H new ATOM 0 HA LEU A 138 -6.536 -6.747 0.095 1.00 13.35 H new ATOM 0 HB2 LEU A 138 -5.357 -6.174 -2.643 1.00 0.15 H new ATOM 0 HB3 LEU A 138 -6.552 -7.431 -2.393 1.00 0.15 H new ATOM 0 HG LEU A 138 -8.103 -5.619 -1.514 1.00 74.01 H new ATOM 0 HD11 LEU A 138 -7.690 -3.333 -2.268 1.00 24.21 H new ATOM 0 HD12 LEU A 138 -6.492 -3.880 -1.072 1.00 24.21 H new ATOM 0 HD13 LEU A 138 -6.059 -3.809 -2.797 1.00 24.21 H new ATOM 0 HD21 LEU A 138 -8.722 -4.902 -3.808 1.00 44.42 H new ATOM 0 HD22 LEU A 138 -7.150 -5.490 -4.400 1.00 44.42 H new ATOM 0 HD23 LEU A 138 -8.336 -6.638 -3.734 1.00 44.42 H new ATOM 2081 N ALA A 139 -5.595 -9.075 -0.575 1.00 2.32 N ATOM 2082 CA ALA A 139 -4.977 -10.376 -0.638 1.00 74.44 C ATOM 2083 C ALA A 139 -4.472 -10.610 -2.047 1.00 65.13 C ATOM 2084 O ALA A 139 -5.206 -10.395 -3.022 1.00 32.24 O ATOM 2085 CB ALA A 139 -5.973 -11.463 -0.260 1.00 70.34 C ATOM 0 H ALA A 139 -6.615 -9.095 -0.559 1.00 2.32 H new ATOM 0 HA ALA A 139 -4.147 -10.413 0.068 1.00 74.44 H new ATOM 0 HB1 ALA A 139 -5.487 -12.437 -0.314 1.00 70.34 H new ATOM 0 HB2 ALA A 139 -6.331 -11.292 0.755 1.00 70.34 H new ATOM 0 HB3 ALA A 139 -6.816 -11.440 -0.950 1.00 70.34 H new ATOM 2091 N GLY A 140 -3.255 -11.038 -2.162 1.00 71.14 N ATOM 2092 CA GLY A 140 -2.688 -11.254 -3.450 1.00 73.34 C ATOM 2093 C GLY A 140 -2.254 -12.677 -3.611 1.00 21.54 C ATOM 2094 O GLY A 140 -1.800 -13.280 -2.637 1.00 73.31 O ATOM 0 H GLY A 140 -2.636 -11.244 -1.378 1.00 71.14 H new ATOM 0 HA2 GLY A 140 -3.418 -11.003 -4.220 1.00 73.34 H new ATOM 0 HA3 GLY A 140 -1.834 -10.591 -3.592 1.00 73.34 H new ATOM 2098 N PRO A 141 -2.412 -13.265 -4.808 1.00 54.41 N ATOM 2099 CA PRO A 141 -1.968 -14.632 -5.079 1.00 61.35 C ATOM 2100 C PRO A 141 -0.463 -14.790 -4.852 1.00 24.31 C ATOM 2101 O PRO A 141 0.303 -13.813 -4.949 1.00 30.44 O ATOM 2102 CB PRO A 141 -2.298 -14.837 -6.560 1.00 13.30 C ATOM 2103 CG PRO A 141 -3.359 -13.840 -6.855 1.00 53.14 C ATOM 2104 CD PRO A 141 -3.061 -12.658 -5.989 1.00 34.32 C ATOM 0 HA PRO A 141 -2.450 -15.356 -4.422 1.00 61.35 H new ATOM 0 HB2 PRO A 141 -1.420 -14.677 -7.186 1.00 13.30 H new ATOM 0 HB3 PRO A 141 -2.645 -15.852 -6.751 1.00 13.30 H new ATOM 0 HG2 PRO A 141 -3.353 -13.563 -7.909 1.00 53.14 H new ATOM 0 HG3 PRO A 141 -4.347 -14.245 -6.637 1.00 53.14 H new ATOM 0 HD2 PRO A 141 -2.404 -11.947 -6.489 1.00 34.32 H new ATOM 0 HD3 PRO A 141 -3.968 -12.118 -5.718 1.00 34.32 H new ATOM 2112 N ALA A 142 -0.036 -16.001 -4.586 1.00 52.42 N ATOM 2113 CA ALA A 142 1.353 -16.304 -4.324 1.00 63.33 C ATOM 2114 C ALA A 142 2.087 -16.492 -5.641 1.00 63.03 C ATOM 2115 O ALA A 142 2.551 -17.588 -5.991 1.00 52.23 O ATOM 2116 CB ALA A 142 1.483 -17.527 -3.419 1.00 42.22 C ATOM 0 H ALA A 142 -0.650 -16.815 -4.545 1.00 52.42 H new ATOM 0 HA ALA A 142 1.811 -15.470 -3.793 1.00 63.33 H new ATOM 0 HB1 ALA A 142 2.537 -17.734 -3.237 1.00 42.22 H new ATOM 0 HB2 ALA A 142 0.982 -17.333 -2.471 1.00 42.22 H new ATOM 0 HB3 ALA A 142 1.022 -18.388 -3.903 1.00 42.22 H new ATOM 2122 N GLU A 143 2.072 -15.436 -6.385 1.00 14.23 N ATOM 2123 CA GLU A 143 2.687 -15.336 -7.678 1.00 74.53 C ATOM 2124 C GLU A 143 4.206 -15.472 -7.543 1.00 71.10 C ATOM 2125 O GLU A 143 4.759 -16.503 -7.964 1.00 38.02 O ATOM 2126 CB GLU A 143 2.297 -13.995 -8.323 1.00 33.14 C ATOM 2127 CG GLU A 143 2.719 -13.836 -9.772 1.00 35.32 C ATOM 2128 CD GLU A 143 2.358 -12.481 -10.339 1.00 12.43 C ATOM 2129 OE1 GLU A 143 3.153 -11.530 -10.196 1.00 61.43 O ATOM 2130 OE2 GLU A 143 1.282 -12.335 -10.953 1.00 64.41 O ATOM 2131 OXT GLU A 143 4.846 -14.573 -6.957 1.00 38.02 O ATOM 0 H GLU A 143 1.609 -14.574 -6.098 1.00 14.23 H new ATOM 0 HA GLU A 143 2.336 -16.142 -8.322 1.00 74.53 H new ATOM 0 HB2 GLU A 143 1.215 -13.879 -8.260 1.00 33.14 H new ATOM 0 HB3 GLU A 143 2.738 -13.186 -7.740 1.00 33.14 H new ATOM 0 HG2 GLU A 143 3.796 -13.983 -9.851 1.00 35.32 H new ATOM 0 HG3 GLU A 143 2.246 -14.614 -10.371 1.00 35.32 H new TER 2138 GLU A 143