USER MOD reduce.3.24.130724 H: found=0, std=0, add=1475, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1268 hydrogens (35 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: B 92 MK8 HNA : B 92 MK8 N : B 91 ALA C :(H bumps) USER MOD NoAdj-H: B 96 MK8 HNA : B 96 MK8 N : B 95 ASP C :(H bumps) USER MOD NoAdj-H: B 96 MK8 HN : B 96 MK8 N : B 95 ASP C :(H bumps) USER MOD NoAdj-H: B 97 NLE HN2 : B 97 NLE N : B 96 MK8 C :(H bumps) USER MOD NoAdj-H: B 97 NLE H : B 97 NLE N : B 96 MK8 C :(H bumps) USER MOD Set 1.1: A 98 GLN : amide:sc= -0.196 K(o=-0.2,f=-0.78) USER MOD Set 1.2: A 141 HIS :FLIP no HE2:sc=-0.00393 F(o=-1,f=-0.2) USER MOD Set 2.1: A 116 THR OG1 : rot -42:sc= 0.873 USER MOD Set 2.2: A 165 HIS : no HE2:sc= 0.098 K(o=0.97,f=-1.3) USER MOD Set 3.1: A 38 TYR OH : rot 117:sc= 0.426 USER MOD Set 3.2: A 86 ASN :FLIP amide:sc= -0.0489 F(o=-0.98,f=0.38) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -2.12 X(o=-2.1,f=-1.7!) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 THR OG1 : rot 89:sc= 1.53 USER MOD Single : A 37 SER OG : rot 91:sc= 1 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= -0.924 K(o=-0.92,f=-2.5) USER MOD Single : A 44 GLN : amide:sc= -0.164 K(o=-0.16,f=-1.7) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 47 GLN : amide:sc= -3.15 K(o=-3.2,f=-5.2) USER MOD Single : A 60 MET CE :methyl -149:sc= -0.436 (180deg=-1.7!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0.313 USER MOD Single : A 66 GLN : amide:sc= -0.0112 X(o=-0.011,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0.563 USER MOD Single : A 70 THR OG1 : rot 178:sc= 0.114 USER MOD Single : A 71 MET CE :methyl -106:sc= -0.77 (180deg=-1.4) USER MOD Single : A 73 GLN : amide:sc= -1.77 K(o=-1.8,f=-3.5!) USER MOD Single : A 77 GLN : amide:sc= -5.46! C(o=-5.5!,f=-7.9!) USER MOD Single : A 89 TYR OH : rot 180:sc= -0.0162 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -2.39 K(o=-2.4,f=-5!) USER MOD Single : A 95 THR OG1 : rot 67:sc= 0.902 USER MOD Single : A 96 MET CE :methyl 154:sc= -3.58 (180deg=-5.01!) USER MOD Single : A 99 HIS : no HD1:sc= -0.356 X(o=-0.36,f=-0.052) USER MOD Single : A 101 GLN : amide:sc= -0.0223 K(o=-0.022,f=-1.2!) USER MOD Single : A 103 THR OG1 : rot -170:sc= -0.761 USER MOD Single : A 106 ASN : amide:sc= -0.442 X(o=-0.44,f=-0.049) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 THR OG1 : rot -84:sc= 1.32 USER MOD Single : A 113 LYS NZ :NH3+ 163:sc= -0.483 (180deg=-0.716) USER MOD Single : A 117 SER OG : rot -70:sc= -2.91! USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= -2.78! C(o=-2.8!,f=-2.6!) USER MOD Single : A 136 TYR OH : rot 30:sc= 0 USER MOD Single : A 143 TYR OH : rot 30:sc= 0 USER MOD Single : A 144 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc=-0.00249 X(o=-0.0025,f=-0.11) USER MOD Single : A 148 THR OG1 : rot 27:sc= 0.317 USER MOD Single : A 153 GLN : amide:sc= -0.35 X(o=-0.35,f=-0.29) USER MOD Single : A 155 THR OG1 : rot 80:sc= 1.16 USER MOD Single : A 162 MET CE :methyl -175:sc= -0.351 (180deg=-0.44) USER MOD Single : A 164 HIS : no HD1:sc= -0.408 K(o=-0.41,f=-1.1) USER MOD Single : A 166 CYS SG : rot 180:sc= 0 USER MOD Single : A 173 GLN : amide:sc= -0.17 K(o=-0.17,f=-0.74) USER MOD Single : A 182 ASN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 185 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 85 ASN : amide:sc= -0.382 K(o=-0.38,f=-1.8) USER MOD Single : B 89 HIS : no HD1:sc= -0.14 X(o=-0.14,f=-0.15) USER MOD Single : B 100 SER OG : rot 81:sc= 0.419 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 18 14.910 15.426 -4.713 1.00 2.42 N ATOM 2 CA ALA A 18 14.361 15.880 -5.984 1.00 55.15 C ATOM 3 C ALA A 18 13.754 17.274 -5.853 1.00 41.15 C ATOM 4 O ALA A 18 13.947 17.954 -4.845 1.00 3.34 O ATOM 5 CB ALA A 18 13.319 14.894 -6.491 1.00 72.14 C ATOM 0 HA ALA A 18 15.176 15.933 -6.706 1.00 55.15 H new ATOM 0 HB1 ALA A 18 12.917 15.246 -7.441 1.00 72.14 H new ATOM 0 HB2 ALA A 18 13.781 13.917 -6.632 1.00 72.14 H new ATOM 0 HB3 ALA A 18 12.511 14.812 -5.764 1.00 72.14 H new ATOM 11 N LEU A 19 13.020 17.692 -6.879 1.00 74.51 N ATOM 12 CA LEU A 19 12.385 19.006 -6.879 1.00 34.11 C ATOM 13 C LEU A 19 10.940 18.912 -6.400 1.00 35.20 C ATOM 14 O LEU A 19 10.309 17.856 -6.454 1.00 4.52 O ATOM 15 CB LEU A 19 12.432 19.617 -8.280 1.00 11.31 C ATOM 16 CG LEU A 19 13.766 20.234 -8.699 1.00 41.53 C ATOM 17 CD1 LEU A 19 14.178 21.327 -7.725 1.00 13.13 C ATOM 18 CD2 LEU A 19 14.844 19.164 -8.790 1.00 23.41 C ATOM 0 H LEU A 19 12.850 17.141 -7.720 1.00 74.51 H new ATOM 0 HA LEU A 19 12.935 19.648 -6.191 1.00 34.11 H new ATOM 0 HB2 LEU A 19 12.170 18.843 -9.001 1.00 11.31 H new ATOM 0 HB3 LEU A 19 11.662 20.386 -8.345 1.00 11.31 H new ATOM 0 HG LEU A 19 13.643 20.682 -9.685 1.00 41.53 H new ATOM 0 HD11 LEU A 19 15.130 21.755 -8.039 1.00 13.13 H new ATOM 0 HD12 LEU A 19 13.417 22.107 -7.710 1.00 13.13 H new ATOM 0 HD13 LEU A 19 14.283 20.904 -6.726 1.00 13.13 H new ATOM 0 HD21 LEU A 19 15.787 19.622 -9.090 1.00 23.41 H new ATOM 0 HD22 LEU A 19 14.965 18.686 -7.818 1.00 23.41 H new ATOM 0 HD23 LEU A 19 14.553 18.416 -9.528 1.00 23.41 H new ATOM 29 N PRO A 20 10.400 20.043 -5.921 1.00 45.04 N ATOM 30 CA PRO A 20 9.022 20.114 -5.426 1.00 53.41 C ATOM 31 C PRO A 20 7.996 19.984 -6.547 1.00 12.21 C ATOM 32 O PRO A 20 8.351 19.953 -7.726 1.00 61.41 O ATOM 33 CB PRO A 20 8.945 21.505 -4.791 1.00 34.43 C ATOM 34 CG PRO A 20 9.988 22.303 -5.496 1.00 42.24 C ATOM 35 CD PRO A 20 11.094 21.338 -5.826 1.00 52.05 C ATOM 0 HA PRO A 20 8.794 19.301 -4.736 1.00 53.41 H new ATOM 0 HB2 PRO A 20 7.956 21.945 -4.920 1.00 34.43 H new ATOM 0 HB3 PRO A 20 9.137 21.462 -3.719 1.00 34.43 H new ATOM 0 HG2 PRO A 20 9.585 22.759 -6.400 1.00 42.24 H new ATOM 0 HG3 PRO A 20 10.352 23.114 -4.865 1.00 42.24 H new ATOM 0 HD2 PRO A 20 11.589 21.598 -6.762 1.00 52.05 H new ATOM 0 HD3 PRO A 20 11.862 21.327 -5.052 1.00 52.05 H new ATOM 40 N SER A 21 6.724 19.909 -6.172 1.00 61.44 N ATOM 41 CA SER A 21 5.647 19.778 -7.146 1.00 54.05 C ATOM 42 C SER A 21 5.768 18.469 -7.918 1.00 5.12 C ATOM 43 O SER A 21 6.833 17.853 -7.955 1.00 62.43 O ATOM 44 CB SER A 21 5.662 20.960 -8.118 1.00 11.32 C ATOM 45 OG SER A 21 4.394 21.589 -8.177 1.00 62.13 O ATOM 0 H SER A 21 6.413 19.937 -5.201 1.00 61.44 H new ATOM 0 HA SER A 21 4.701 19.774 -6.605 1.00 54.05 H new ATOM 0 HB2 SER A 21 6.415 21.683 -7.805 1.00 11.32 H new ATOM 0 HB3 SER A 21 5.946 20.614 -9.112 1.00 11.32 H new ATOM 0 HG SER A 21 4.431 22.342 -8.803 1.00 62.13 H new ATOM 50 N ALA A 22 4.668 18.048 -8.536 1.00 20.32 N ATOM 51 CA ALA A 22 4.652 16.813 -9.309 1.00 45.54 C ATOM 52 C ALA A 22 3.285 16.583 -9.946 1.00 64.12 C ATOM 53 O ALA A 22 2.257 16.970 -9.390 1.00 23.31 O ATOM 54 CB ALA A 22 5.030 15.633 -8.427 1.00 2.41 C ATOM 0 H ALA A 22 3.777 18.545 -8.516 1.00 20.32 H new ATOM 0 HA ALA A 22 5.387 16.904 -10.109 1.00 45.54 H new ATOM 0 HB1 ALA A 22 5.014 14.717 -9.018 1.00 2.41 H new ATOM 0 HB2 ALA A 22 6.031 15.787 -8.023 1.00 2.41 H new ATOM 0 HB3 ALA A 22 4.317 15.548 -7.607 1.00 2.41 H new ATOM 60 N SER A 23 3.281 15.952 -11.116 1.00 5.44 N ATOM 61 CA SER A 23 2.041 15.675 -11.831 1.00 25.14 C ATOM 62 C SER A 23 1.729 14.182 -11.818 1.00 45.23 C ATOM 63 O SER A 23 2.597 13.358 -11.531 1.00 2.13 O ATOM 64 CB SER A 23 2.136 16.175 -13.273 1.00 11.43 C ATOM 65 OG SER A 23 1.557 17.462 -13.406 1.00 2.22 O ATOM 0 H SER A 23 4.123 15.623 -11.589 1.00 5.44 H new ATOM 0 HA SER A 23 1.233 16.202 -11.324 1.00 25.14 H new ATOM 0 HB2 SER A 23 3.181 16.209 -13.581 1.00 11.43 H new ATOM 0 HB3 SER A 23 1.630 15.475 -13.938 1.00 11.43 H new ATOM 0 HG SER A 23 1.632 17.760 -14.337 1.00 2.22 H new ATOM 70 N GLU A 24 0.483 13.841 -12.134 1.00 23.44 N ATOM 71 CA GLU A 24 0.056 12.447 -12.158 1.00 33.42 C ATOM 72 C GLU A 24 1.012 11.600 -12.992 1.00 65.23 C ATOM 73 O GLU A 24 1.271 10.441 -12.671 1.00 64.23 O ATOM 74 CB GLU A 24 -1.364 12.335 -12.717 1.00 23.22 C ATOM 75 CG GLU A 24 -1.707 10.948 -13.235 1.00 50.21 C ATOM 76 CD GLU A 24 -3.201 10.691 -13.268 1.00 22.55 C ATOM 77 OE1 GLU A 24 -3.858 10.874 -12.222 1.00 34.24 O ATOM 78 OE2 GLU A 24 -3.713 10.306 -14.340 1.00 24.34 O ATOM 0 H GLU A 24 -0.247 14.510 -12.377 1.00 23.44 H new ATOM 0 HA GLU A 24 0.066 12.073 -11.134 1.00 33.42 H new ATOM 0 HB2 GLU A 24 -2.075 12.608 -11.937 1.00 23.22 H new ATOM 0 HB3 GLU A 24 -1.485 13.056 -13.526 1.00 23.22 H new ATOM 0 HG2 GLU A 24 -1.299 10.828 -14.239 1.00 50.21 H new ATOM 0 HG3 GLU A 24 -1.227 10.200 -12.604 1.00 50.21 H new ATOM 83 N GLU A 25 1.530 12.186 -14.066 1.00 14.31 N ATOM 84 CA GLU A 25 2.456 11.485 -14.948 1.00 61.33 C ATOM 85 C GLU A 25 3.625 10.905 -14.158 1.00 1.35 C ATOM 86 O GLU A 25 3.929 9.717 -14.262 1.00 31.11 O ATOM 87 CB GLU A 25 2.976 12.429 -16.033 1.00 15.11 C ATOM 88 CG GLU A 25 1.878 13.037 -16.891 1.00 65.20 C ATOM 89 CD GLU A 25 2.396 13.563 -18.215 1.00 50.32 C ATOM 90 OE1 GLU A 25 3.627 13.532 -18.426 1.00 74.14 O ATOM 91 OE2 GLU A 25 1.570 14.005 -19.041 1.00 21.12 O ATOM 0 H GLU A 25 1.324 13.145 -14.347 1.00 14.31 H new ATOM 0 HA GLU A 25 1.917 10.664 -15.421 1.00 61.33 H new ATOM 0 HB2 GLU A 25 3.544 13.232 -15.562 1.00 15.11 H new ATOM 0 HB3 GLU A 25 3.667 11.884 -16.676 1.00 15.11 H new ATOM 0 HG2 GLU A 25 1.110 12.286 -17.078 1.00 65.20 H new ATOM 0 HG3 GLU A 25 1.402 13.850 -16.343 1.00 65.20 H new ATOM 96 N GLN A 26 4.279 11.754 -13.370 1.00 51.31 N ATOM 97 CA GLN A 26 5.416 11.326 -12.565 1.00 75.42 C ATOM 98 C GLN A 26 4.954 10.511 -11.362 1.00 32.44 C ATOM 99 O GLN A 26 5.683 9.652 -10.864 1.00 32.25 O ATOM 100 CB GLN A 26 6.220 12.540 -12.096 1.00 34.35 C ATOM 101 CG GLN A 26 5.736 13.117 -10.776 1.00 32.34 C ATOM 102 CD GLN A 26 6.373 12.445 -9.576 1.00 65.41 C ATOM 103 OE1 GLN A 26 7.542 12.058 -9.614 1.00 73.20 O ATOM 104 NE2 GLN A 26 5.606 12.301 -8.501 1.00 12.44 N ATOM 0 H GLN A 26 4.040 12.741 -13.273 1.00 51.31 H new ATOM 0 HA GLN A 26 6.053 10.695 -13.185 1.00 75.42 H new ATOM 0 HB2 GLN A 26 7.267 12.255 -11.996 1.00 34.35 H new ATOM 0 HB3 GLN A 26 6.172 13.315 -12.861 1.00 34.35 H new ATOM 0 HG2 GLN A 26 5.955 14.184 -10.748 1.00 32.34 H new ATOM 0 HG3 GLN A 26 4.653 13.012 -10.714 1.00 32.34 H new ATOM 0 HE21 GLN A 26 4.643 12.636 -8.513 1.00 12.44 H new ATOM 0 HE22 GLN A 26 5.980 11.855 -7.663 1.00 12.44 H new ATOM 111 N VAL A 27 3.740 10.786 -10.897 1.00 72.11 N ATOM 112 CA VAL A 27 3.180 10.077 -9.752 1.00 13.45 C ATOM 113 C VAL A 27 3.081 8.582 -10.027 1.00 71.44 C ATOM 114 O VAL A 27 3.404 7.760 -9.169 1.00 14.14 O ATOM 115 CB VAL A 27 1.784 10.616 -9.386 1.00 2.41 C ATOM 116 CG1 VAL A 27 1.185 9.813 -8.242 1.00 51.22 C ATOM 117 CG2 VAL A 27 1.859 12.093 -9.030 1.00 11.03 C ATOM 0 H VAL A 27 3.125 11.495 -11.296 1.00 72.11 H new ATOM 0 HA VAL A 27 3.856 10.244 -8.914 1.00 13.45 H new ATOM 0 HB VAL A 27 1.133 10.508 -10.254 1.00 2.41 H new ATOM 0 HG11 VAL A 27 0.199 10.208 -7.997 1.00 51.22 H new ATOM 0 HG12 VAL A 27 1.094 8.768 -8.539 1.00 51.22 H new ATOM 0 HG13 VAL A 27 1.832 9.886 -7.368 1.00 51.22 H new ATOM 0 HG21 VAL A 27 0.864 12.457 -8.774 1.00 11.03 H new ATOM 0 HG22 VAL A 27 2.525 12.228 -8.178 1.00 11.03 H new ATOM 0 HG23 VAL A 27 2.242 12.654 -9.883 1.00 11.03 H new ATOM 127 N ALA A 28 2.631 8.234 -11.228 1.00 75.42 N ATOM 128 CA ALA A 28 2.491 6.837 -11.617 1.00 14.31 C ATOM 129 C ALA A 28 3.821 6.100 -11.507 1.00 31.11 C ATOM 130 O ALA A 28 3.906 5.044 -10.882 1.00 40.20 O ATOM 131 CB ALA A 28 1.944 6.735 -13.034 1.00 31.35 C ATOM 0 H ALA A 28 2.357 8.902 -11.949 1.00 75.42 H new ATOM 0 HA ALA A 28 1.786 6.365 -10.933 1.00 14.31 H new ATOM 0 HB1 ALA A 28 1.845 5.685 -13.311 1.00 31.35 H new ATOM 0 HB2 ALA A 28 0.968 7.217 -13.083 1.00 31.35 H new ATOM 0 HB3 ALA A 28 2.627 7.229 -13.724 1.00 31.35 H new ATOM 137 N GLN A 29 4.858 6.665 -12.117 1.00 53.43 N ATOM 138 CA GLN A 29 6.184 6.060 -12.089 1.00 73.03 C ATOM 139 C GLN A 29 6.668 5.879 -10.654 1.00 3.43 C ATOM 140 O GLN A 29 7.151 4.809 -10.283 1.00 10.01 O ATOM 141 CB GLN A 29 7.178 6.922 -12.869 1.00 51.11 C ATOM 142 CG GLN A 29 7.117 6.709 -14.373 1.00 0.24 C ATOM 143 CD GLN A 29 7.945 7.722 -15.140 1.00 74.33 C ATOM 144 OE1 GLN A 29 9.112 7.482 -15.448 1.00 33.42 O ATOM 145 NE2 GLN A 29 7.341 8.864 -15.453 1.00 5.32 N ATOM 0 H GLN A 29 4.805 7.541 -12.637 1.00 53.43 H new ATOM 0 HA GLN A 29 6.118 5.079 -12.559 1.00 73.03 H new ATOM 0 HB2 GLN A 29 6.985 7.972 -12.651 1.00 51.11 H new ATOM 0 HB3 GLN A 29 8.187 6.704 -12.520 1.00 51.11 H new ATOM 0 HG2 GLN A 29 7.469 5.705 -14.608 1.00 0.24 H new ATOM 0 HG3 GLN A 29 6.080 6.769 -14.703 1.00 0.24 H new ATOM 0 HE21 GLN A 29 6.372 9.020 -15.177 1.00 5.32 H new ATOM 0 HE22 GLN A 29 7.847 9.584 -15.969 1.00 5.32 H new ATOM 152 N ASP A 30 6.535 6.929 -9.852 1.00 14.32 N ATOM 153 CA ASP A 30 6.959 6.885 -8.458 1.00 13.12 C ATOM 154 C ASP A 30 6.126 5.880 -7.668 1.00 41.24 C ATOM 155 O ASP A 30 6.616 5.253 -6.729 1.00 31.24 O ATOM 156 CB ASP A 30 6.842 8.272 -7.824 1.00 71.31 C ATOM 157 CG ASP A 30 7.897 9.233 -8.335 1.00 32.11 C ATOM 158 OD1 ASP A 30 8.580 8.894 -9.324 1.00 2.53 O ATOM 159 OD2 ASP A 30 8.040 10.325 -7.746 1.00 15.31 O ATOM 0 H ASP A 30 6.137 7.822 -10.143 1.00 14.32 H new ATOM 0 HA ASP A 30 8.001 6.567 -8.431 1.00 13.12 H new ATOM 0 HB2 ASP A 30 5.853 8.680 -8.030 1.00 71.31 H new ATOM 0 HB3 ASP A 30 6.931 8.182 -6.741 1.00 71.31 H new ATOM 163 N THR A 31 4.863 5.732 -8.055 1.00 11.51 N ATOM 164 CA THR A 31 3.961 4.804 -7.384 1.00 74.11 C ATOM 165 C THR A 31 4.449 3.367 -7.520 1.00 42.11 C ATOM 166 O THR A 31 4.625 2.665 -6.526 1.00 33.23 O ATOM 167 CB THR A 31 2.530 4.906 -7.947 1.00 25.44 C ATOM 168 OG1 THR A 31 1.989 6.203 -7.679 1.00 73.20 O ATOM 169 CG2 THR A 31 1.633 3.840 -7.335 1.00 43.04 C ATOM 0 H THR A 31 4.441 6.243 -8.830 1.00 11.51 H new ATOM 0 HA THR A 31 3.949 5.081 -6.330 1.00 74.11 H new ATOM 0 HB THR A 31 2.574 4.748 -9.025 1.00 25.44 H new ATOM 0 HG1 THR A 31 2.214 6.810 -8.415 1.00 73.20 H new ATOM 0 HG21 THR A 31 0.628 3.930 -7.746 1.00 43.04 H new ATOM 0 HG22 THR A 31 2.032 2.852 -7.566 1.00 43.04 H new ATOM 0 HG23 THR A 31 1.596 3.973 -6.254 1.00 43.04 H new ATOM 177 N GLU A 32 4.666 2.936 -8.759 1.00 31.24 N ATOM 178 CA GLU A 32 5.134 1.580 -9.025 1.00 70.25 C ATOM 179 C GLU A 32 6.491 1.336 -8.372 1.00 70.14 C ATOM 180 O GLU A 32 6.719 0.290 -7.763 1.00 13.01 O ATOM 181 CB GLU A 32 5.229 1.335 -10.532 1.00 73.24 C ATOM 182 CG GLU A 32 6.034 2.391 -11.270 1.00 41.31 C ATOM 183 CD GLU A 32 6.096 2.139 -12.764 1.00 74.05 C ATOM 184 OE1 GLU A 32 5.466 1.166 -13.229 1.00 25.43 O ATOM 185 OE2 GLU A 32 6.773 2.917 -13.469 1.00 43.43 O ATOM 0 H GLU A 32 4.525 3.505 -9.594 1.00 31.24 H new ATOM 0 HA GLU A 32 4.413 0.884 -8.597 1.00 70.25 H new ATOM 0 HB2 GLU A 32 5.681 0.358 -10.705 1.00 73.24 H new ATOM 0 HB3 GLU A 32 4.223 1.299 -10.950 1.00 73.24 H new ATOM 0 HG2 GLU A 32 5.593 3.371 -11.089 1.00 41.31 H new ATOM 0 HG3 GLU A 32 7.047 2.418 -10.868 1.00 41.31 H new ATOM 190 N GLU A 33 7.389 2.307 -8.505 1.00 52.02 N ATOM 191 CA GLU A 33 8.724 2.197 -7.930 1.00 21.41 C ATOM 192 C GLU A 33 8.655 2.104 -6.408 1.00 64.51 C ATOM 193 O GLU A 33 9.212 1.185 -5.805 1.00 34.23 O ATOM 194 CB GLU A 33 9.581 3.397 -8.339 1.00 44.45 C ATOM 195 CG GLU A 33 9.805 3.500 -9.839 1.00 72.23 C ATOM 196 CD GLU A 33 10.059 4.925 -10.292 1.00 10.33 C ATOM 197 OE1 GLU A 33 10.487 5.748 -9.455 1.00 44.24 O ATOM 198 OE2 GLU A 33 9.832 5.216 -11.485 1.00 41.34 O ATOM 0 H GLU A 33 7.216 3.179 -9.006 1.00 52.02 H new ATOM 0 HA GLU A 33 9.182 1.285 -8.313 1.00 21.41 H new ATOM 0 HB2 GLU A 33 9.103 4.311 -7.988 1.00 44.45 H new ATOM 0 HB3 GLU A 33 10.547 3.330 -7.839 1.00 44.45 H new ATOM 0 HG2 GLU A 33 10.654 2.876 -10.120 1.00 72.23 H new ATOM 0 HG3 GLU A 33 8.933 3.106 -10.361 1.00 72.23 H new ATOM 203 N VAL A 34 7.967 3.060 -5.792 1.00 1.32 N ATOM 204 CA VAL A 34 7.824 3.086 -4.342 1.00 54.34 C ATOM 205 C VAL A 34 7.070 1.860 -3.842 1.00 31.43 C ATOM 206 O VAL A 34 7.331 1.361 -2.747 1.00 23.45 O ATOM 207 CB VAL A 34 7.086 4.356 -3.874 1.00 65.52 C ATOM 208 CG1 VAL A 34 6.804 4.289 -2.381 1.00 30.05 C ATOM 209 CG2 VAL A 34 7.893 5.599 -4.218 1.00 25.41 C ATOM 0 H VAL A 34 7.500 3.827 -6.275 1.00 1.32 H new ATOM 0 HA VAL A 34 8.831 3.084 -3.924 1.00 54.34 H new ATOM 0 HB VAL A 34 6.132 4.415 -4.398 1.00 65.52 H new ATOM 0 HG11 VAL A 34 6.283 5.194 -2.068 1.00 30.05 H new ATOM 0 HG12 VAL A 34 6.182 3.420 -2.167 1.00 30.05 H new ATOM 0 HG13 VAL A 34 7.745 4.206 -1.836 1.00 30.05 H new ATOM 0 HG21 VAL A 34 7.357 6.486 -3.880 1.00 25.41 H new ATOM 0 HG22 VAL A 34 8.863 5.551 -3.724 1.00 25.41 H new ATOM 0 HG23 VAL A 34 8.038 5.652 -5.297 1.00 25.41 H new ATOM 219 N PHE A 35 6.133 1.377 -4.651 1.00 62.53 N ATOM 220 CA PHE A 35 5.340 0.207 -4.291 1.00 20.13 C ATOM 221 C PHE A 35 6.227 -1.025 -4.139 1.00 60.12 C ATOM 222 O PHE A 35 6.173 -1.720 -3.124 1.00 61.14 O ATOM 223 CB PHE A 35 4.264 -0.052 -5.347 1.00 15.44 C ATOM 224 CG PHE A 35 3.633 -1.410 -5.240 1.00 54.32 C ATOM 225 CD1 PHE A 35 2.845 -1.737 -4.148 1.00 3.00 C ATOM 226 CD2 PHE A 35 3.825 -2.358 -6.231 1.00 5.04 C ATOM 227 CE1 PHE A 35 2.263 -2.987 -4.046 1.00 31.01 C ATOM 228 CE2 PHE A 35 3.246 -3.610 -6.135 1.00 51.42 C ATOM 229 CZ PHE A 35 2.463 -3.924 -5.041 1.00 51.21 C ATOM 0 H PHE A 35 5.904 1.778 -5.561 1.00 62.53 H new ATOM 0 HA PHE A 35 4.858 0.407 -3.334 1.00 20.13 H new ATOM 0 HB2 PHE A 35 3.488 0.708 -5.257 1.00 15.44 H new ATOM 0 HB3 PHE A 35 4.705 0.058 -6.338 1.00 15.44 H new ATOM 0 HD1 PHE A 35 2.684 -1.007 -3.368 1.00 3.00 H new ATOM 0 HD2 PHE A 35 4.434 -2.117 -7.089 1.00 5.04 H new ATOM 0 HE1 PHE A 35 1.653 -3.231 -3.189 1.00 31.01 H new ATOM 0 HE2 PHE A 35 3.406 -4.341 -6.914 1.00 51.42 H new ATOM 0 HZ PHE A 35 2.008 -4.900 -4.964 1.00 51.21 H new ATOM 238 N ARG A 36 7.041 -1.290 -5.155 1.00 1.33 N ATOM 239 CA ARG A 36 7.939 -2.439 -5.136 1.00 52.55 C ATOM 240 C ARG A 36 8.953 -2.318 -4.003 1.00 3.50 C ATOM 241 O ARG A 36 9.183 -3.270 -3.258 1.00 30.30 O ATOM 242 CB ARG A 36 8.666 -2.566 -6.476 1.00 62.31 C ATOM 243 CG ARG A 36 7.753 -2.416 -7.682 1.00 21.01 C ATOM 244 CD ARG A 36 7.852 -3.618 -8.608 1.00 75.13 C ATOM 245 NE ARG A 36 7.742 -3.237 -10.013 1.00 54.40 N ATOM 246 CZ ARG A 36 8.714 -2.633 -10.689 1.00 61.12 C ATOM 247 NH1 ARG A 36 9.861 -2.346 -10.091 1.00 11.22 N ATOM 248 NH2 ARG A 36 8.538 -2.318 -11.966 1.00 52.40 N ATOM 0 H ARG A 36 7.097 -0.725 -6.002 1.00 1.33 H new ATOM 0 HA ARG A 36 7.340 -3.334 -4.969 1.00 52.55 H new ATOM 0 HB2 ARG A 36 9.449 -1.810 -6.528 1.00 62.31 H new ATOM 0 HB3 ARG A 36 9.158 -3.538 -6.522 1.00 62.31 H new ATOM 0 HG2 ARG A 36 6.723 -2.297 -7.347 1.00 21.01 H new ATOM 0 HG3 ARG A 36 8.017 -1.511 -8.229 1.00 21.01 H new ATOM 0 HD2 ARG A 36 8.803 -4.125 -8.443 1.00 75.13 H new ATOM 0 HD3 ARG A 36 7.064 -4.330 -8.363 1.00 75.13 H new ATOM 0 HE ARG A 36 6.872 -3.446 -10.503 1.00 54.40 H new ATOM 0 HH11 ARG A 36 9.999 -2.589 -9.110 1.00 11.22 H new ATOM 0 HH12 ARG A 36 10.606 -1.882 -10.612 1.00 11.22 H new ATOM 0 HH21 ARG A 36 7.657 -2.539 -12.429 1.00 52.40 H new ATOM 0 HH22 ARG A 36 9.284 -1.854 -12.484 1.00 52.40 H new ATOM 259 N SER A 37 9.558 -1.141 -3.881 1.00 51.33 N ATOM 260 CA SER A 37 10.552 -0.897 -2.842 1.00 34.31 C ATOM 261 C SER A 37 9.926 -1.007 -1.455 1.00 61.33 C ATOM 262 O SER A 37 10.492 -1.627 -0.554 1.00 50.12 O ATOM 263 CB SER A 37 11.178 0.487 -3.022 1.00 34.14 C ATOM 264 OG SER A 37 11.459 0.747 -4.387 1.00 22.21 O ATOM 0 H SER A 37 9.378 -0.342 -4.488 1.00 51.33 H new ATOM 0 HA SER A 37 11.330 -1.655 -2.932 1.00 34.31 H new ATOM 0 HB2 SER A 37 10.501 1.249 -2.636 1.00 34.14 H new ATOM 0 HB3 SER A 37 12.097 0.552 -2.440 1.00 34.14 H new ATOM 0 HG SER A 37 10.688 1.188 -4.801 1.00 22.21 H new ATOM 269 N TYR A 38 8.755 -0.402 -1.291 1.00 20.34 N ATOM 270 CA TYR A 38 8.052 -0.430 -0.014 1.00 53.10 C ATOM 271 C TYR A 38 7.790 -1.865 0.432 1.00 12.22 C ATOM 272 O TYR A 38 8.242 -2.290 1.495 1.00 11.03 O ATOM 273 CB TYR A 38 6.731 0.334 -0.119 1.00 20.45 C ATOM 274 CG TYR A 38 5.771 0.039 1.012 1.00 73.20 C ATOM 275 CD1 TYR A 38 5.855 0.723 2.218 1.00 0.21 C ATOM 276 CD2 TYR A 38 4.777 -0.923 0.873 1.00 10.31 C ATOM 277 CE1 TYR A 38 4.981 0.456 3.253 1.00 54.05 C ATOM 278 CE2 TYR A 38 3.897 -1.195 1.901 1.00 72.42 C ATOM 279 CZ TYR A 38 4.003 -0.503 3.090 1.00 0.05 C ATOM 280 OH TYR A 38 3.129 -0.771 4.118 1.00 75.53 O ATOM 0 H TYR A 38 8.272 0.114 -2.027 1.00 20.34 H new ATOM 0 HA TYR A 38 8.684 0.052 0.731 1.00 53.10 H new ATOM 0 HB2 TYR A 38 6.940 1.404 -0.138 1.00 20.45 H new ATOM 0 HB3 TYR A 38 6.251 0.086 -1.066 1.00 20.45 H new ATOM 0 HD1 TYR A 38 6.617 1.477 2.348 1.00 0.21 H new ATOM 0 HD2 TYR A 38 4.692 -1.467 -0.056 1.00 10.31 H new ATOM 0 HE1 TYR A 38 5.063 0.995 4.185 1.00 54.05 H new ATOM 0 HE2 TYR A 38 3.130 -1.945 1.775 1.00 72.42 H new ATOM 0 HH TYR A 38 2.216 -0.550 3.837 1.00 75.53 H new ATOM 289 N VAL A 39 7.055 -2.607 -0.389 1.00 42.11 N ATOM 290 CA VAL A 39 6.732 -3.996 -0.082 1.00 43.41 C ATOM 291 C VAL A 39 7.997 -4.823 0.121 1.00 13.23 C ATOM 292 O VAL A 39 8.014 -5.766 0.911 1.00 5.44 O ATOM 293 CB VAL A 39 5.888 -4.636 -1.200 1.00 72.34 C ATOM 294 CG1 VAL A 39 4.636 -3.812 -1.462 1.00 1.23 C ATOM 295 CG2 VAL A 39 6.712 -4.789 -2.469 1.00 13.05 C ATOM 0 H VAL A 39 6.672 -2.270 -1.272 1.00 42.11 H new ATOM 0 HA VAL A 39 6.154 -3.989 0.842 1.00 43.41 H new ATOM 0 HB VAL A 39 5.578 -5.629 -0.875 1.00 72.34 H new ATOM 0 HG11 VAL A 39 4.052 -4.279 -2.255 1.00 1.23 H new ATOM 0 HG12 VAL A 39 4.037 -3.761 -0.553 1.00 1.23 H new ATOM 0 HG13 VAL A 39 4.920 -2.805 -1.766 1.00 1.23 H new ATOM 0 HG21 VAL A 39 6.099 -5.243 -3.248 1.00 13.05 H new ATOM 0 HG22 VAL A 39 7.054 -3.809 -2.801 1.00 13.05 H new ATOM 0 HG23 VAL A 39 7.574 -5.425 -2.269 1.00 13.05 H new ATOM 305 N PHE A 40 9.055 -4.460 -0.597 1.00 54.11 N ATOM 306 CA PHE A 40 10.326 -5.169 -0.496 1.00 13.22 C ATOM 307 C PHE A 40 10.924 -5.016 0.899 1.00 22.42 C ATOM 308 O PHE A 40 11.369 -5.991 1.505 1.00 31.45 O ATOM 309 CB PHE A 40 11.310 -4.646 -1.544 1.00 71.02 C ATOM 310 CG PHE A 40 12.750 -4.843 -1.167 1.00 24.52 C ATOM 311 CD1 PHE A 40 13.381 -6.054 -1.399 1.00 63.43 C ATOM 312 CD2 PHE A 40 13.473 -3.817 -0.579 1.00 51.24 C ATOM 313 CE1 PHE A 40 14.706 -6.239 -1.051 1.00 61.23 C ATOM 314 CE2 PHE A 40 14.798 -3.996 -0.230 1.00 32.33 C ATOM 315 CZ PHE A 40 15.416 -5.208 -0.467 1.00 73.40 C ATOM 0 H PHE A 40 9.058 -3.680 -1.254 1.00 54.11 H new ATOM 0 HA PHE A 40 10.139 -6.227 -0.679 1.00 13.22 H new ATOM 0 HB2 PHE A 40 11.119 -5.149 -2.492 1.00 71.02 H new ATOM 0 HB3 PHE A 40 11.127 -3.583 -1.704 1.00 71.02 H new ATOM 0 HD1 PHE A 40 12.831 -6.863 -1.857 1.00 63.43 H new ATOM 0 HD2 PHE A 40 12.995 -2.867 -0.391 1.00 51.24 H new ATOM 0 HE1 PHE A 40 15.186 -7.189 -1.236 1.00 61.23 H new ATOM 0 HE2 PHE A 40 15.350 -3.188 0.228 1.00 32.33 H new ATOM 0 HZ PHE A 40 16.452 -5.349 -0.196 1.00 73.40 H new ATOM 324 N TYR A 41 10.931 -3.787 1.403 1.00 31.40 N ATOM 325 CA TYR A 41 11.476 -3.506 2.725 1.00 32.04 C ATOM 326 C TYR A 41 10.622 -4.147 3.815 1.00 30.11 C ATOM 327 O TYR A 41 11.138 -4.824 4.705 1.00 71.23 O ATOM 328 CB TYR A 41 11.564 -1.996 2.954 1.00 51.21 C ATOM 329 CG TYR A 41 12.863 -1.386 2.476 1.00 60.51 C ATOM 330 CD1 TYR A 41 14.087 -1.927 2.852 1.00 54.25 C ATOM 331 CD2 TYR A 41 12.866 -0.269 1.650 1.00 74.12 C ATOM 332 CE1 TYR A 41 15.275 -1.372 2.419 1.00 32.21 C ATOM 333 CE2 TYR A 41 14.050 0.292 1.211 1.00 43.11 C ATOM 334 CZ TYR A 41 15.252 -0.263 1.599 1.00 42.15 C ATOM 335 OH TYR A 41 16.433 0.292 1.164 1.00 72.40 O ATOM 0 H TYR A 41 10.565 -2.969 0.915 1.00 31.40 H new ATOM 0 HA TYR A 41 12.477 -3.934 2.774 1.00 32.04 H new ATOM 0 HB2 TYR A 41 10.734 -1.510 2.441 1.00 51.21 H new ATOM 0 HB3 TYR A 41 11.446 -1.791 4.018 1.00 51.21 H new ATOM 0 HD1 TYR A 41 14.109 -2.796 3.493 1.00 54.25 H new ATOM 0 HD2 TYR A 41 11.927 0.168 1.346 1.00 74.12 H new ATOM 0 HE1 TYR A 41 16.218 -1.804 2.721 1.00 32.21 H new ATOM 0 HE2 TYR A 41 14.035 1.160 0.568 1.00 43.11 H new ATOM 0 HH TYR A 41 16.241 1.066 0.594 1.00 72.40 H new ATOM 344 N ARG A 42 9.314 -3.930 3.737 1.00 13.12 N ATOM 345 CA ARG A 42 8.387 -4.485 4.716 1.00 25.13 C ATOM 346 C ARG A 42 8.579 -5.993 4.852 1.00 42.24 C ATOM 347 O ARG A 42 8.707 -6.516 5.958 1.00 62.40 O ATOM 348 CB ARG A 42 6.944 -4.178 4.314 1.00 63.25 C ATOM 349 CG ARG A 42 5.915 -4.654 5.327 1.00 54.11 C ATOM 350 CD ARG A 42 4.743 -5.346 4.649 1.00 2.43 C ATOM 351 NE ARG A 42 3.974 -6.164 5.584 1.00 33.04 N ATOM 352 CZ ARG A 42 4.349 -7.374 5.981 1.00 62.12 C ATOM 353 NH1 ARG A 42 5.476 -7.905 5.529 1.00 1.30 N ATOM 354 NH2 ARG A 42 3.595 -8.055 6.834 1.00 65.40 N ATOM 0 H ARG A 42 8.871 -3.373 3.006 1.00 13.12 H new ATOM 0 HA ARG A 42 8.595 -4.021 5.680 1.00 25.13 H new ATOM 0 HB2 ARG A 42 6.835 -3.102 4.176 1.00 63.25 H new ATOM 0 HB3 ARG A 42 6.737 -4.645 3.351 1.00 63.25 H new ATOM 0 HG2 ARG A 42 6.386 -5.340 6.031 1.00 54.11 H new ATOM 0 HG3 ARG A 42 5.552 -3.804 5.905 1.00 54.11 H new ATOM 0 HD2 ARG A 42 4.090 -4.597 4.201 1.00 2.43 H new ATOM 0 HD3 ARG A 42 5.112 -5.973 3.838 1.00 2.43 H new ATOM 0 HE ARG A 42 3.101 -5.785 5.952 1.00 33.04 H new ATOM 0 HH11 ARG A 42 6.059 -7.384 4.874 1.00 1.30 H new ATOM 0 HH12 ARG A 42 5.761 -8.835 5.836 1.00 1.30 H new ATOM 0 HH21 ARG A 42 2.727 -7.649 7.185 1.00 65.40 H new ATOM 0 HH22 ARG A 42 3.883 -8.985 7.139 1.00 65.40 H new ATOM 365 N HIS A 43 8.596 -6.687 3.718 1.00 13.55 N ATOM 366 CA HIS A 43 8.773 -8.134 3.709 1.00 72.01 C ATOM 367 C HIS A 43 10.210 -8.509 4.059 1.00 52.20 C ATOM 368 O HIS A 43 10.461 -9.558 4.650 1.00 61.03 O ATOM 369 CB HIS A 43 8.403 -8.706 2.341 1.00 62.41 C ATOM 370 CG HIS A 43 7.033 -9.310 2.295 1.00 1.41 C ATOM 371 ND1 HIS A 43 5.888 -8.602 2.593 1.00 70.13 N ATOM 372 CD2 HIS A 43 6.627 -10.562 1.981 1.00 44.33 C ATOM 373 CE1 HIS A 43 4.838 -9.393 2.466 1.00 51.32 C ATOM 374 NE2 HIS A 43 5.259 -10.588 2.095 1.00 52.23 N ATOM 0 H HIS A 43 8.489 -6.270 2.793 1.00 13.55 H new ATOM 0 HA HIS A 43 8.112 -8.560 4.463 1.00 72.01 H new ATOM 0 HB2 HIS A 43 8.467 -7.913 1.596 1.00 62.41 H new ATOM 0 HB3 HIS A 43 9.135 -9.464 2.063 1.00 62.41 H new ATOM 0 HD2 HIS A 43 7.261 -11.388 1.694 1.00 44.33 H new ATOM 0 HE1 HIS A 43 3.810 -9.110 2.637 1.00 51.32 H new ATOM 0 HE2 HIS A 43 4.665 -11.399 1.921 1.00 52.23 H new ATOM 381 N GLN A 44 11.149 -7.643 3.689 1.00 50.32 N ATOM 382 CA GLN A 44 12.561 -7.885 3.963 1.00 54.42 C ATOM 383 C GLN A 44 12.805 -8.044 5.459 1.00 4.32 C ATOM 384 O GLN A 44 13.366 -9.046 5.902 1.00 1.14 O ATOM 385 CB GLN A 44 13.411 -6.739 3.414 1.00 11.33 C ATOM 386 CG GLN A 44 14.869 -6.805 3.838 1.00 4.21 C ATOM 387 CD GLN A 44 15.226 -5.755 4.871 1.00 74.14 C ATOM 388 OE1 GLN A 44 14.815 -4.599 4.764 1.00 63.11 O ATOM 389 NE2 GLN A 44 15.994 -6.151 5.879 1.00 42.02 N ATOM 0 H GLN A 44 10.958 -6.769 3.199 1.00 50.32 H new ATOM 0 HA GLN A 44 12.849 -8.812 3.467 1.00 54.42 H new ATOM 0 HB2 GLN A 44 13.357 -6.747 2.325 1.00 11.33 H new ATOM 0 HB3 GLN A 44 12.987 -5.792 3.747 1.00 11.33 H new ATOM 0 HG2 GLN A 44 15.081 -7.794 4.243 1.00 4.21 H new ATOM 0 HG3 GLN A 44 15.504 -6.677 2.961 1.00 4.21 H new ATOM 0 HE21 GLN A 44 16.312 -7.119 5.928 1.00 42.02 H new ATOM 0 HE22 GLN A 44 16.266 -5.487 6.604 1.00 42.02 H new ATOM 396 N GLN A 45 12.382 -7.049 6.232 1.00 65.33 N ATOM 397 CA GLN A 45 12.556 -7.080 7.680 1.00 43.41 C ATOM 398 C GLN A 45 11.700 -8.174 8.308 1.00 72.22 C ATOM 399 O GLN A 45 12.033 -8.704 9.368 1.00 32.32 O ATOM 400 CB GLN A 45 12.198 -5.723 8.286 1.00 52.15 C ATOM 401 CG GLN A 45 13.200 -4.627 7.961 1.00 43.01 C ATOM 402 CD GLN A 45 12.870 -3.314 8.642 1.00 13.22 C ATOM 403 OE1 GLN A 45 13.542 -2.907 9.591 1.00 61.04 O ATOM 404 NE2 GLN A 45 11.831 -2.641 8.161 1.00 5.31 N ATOM 0 H GLN A 45 11.917 -6.212 5.881 1.00 65.33 H new ATOM 0 HA GLN A 45 13.603 -7.299 7.891 1.00 43.41 H new ATOM 0 HB2 GLN A 45 11.214 -5.422 7.926 1.00 52.15 H new ATOM 0 HB3 GLN A 45 12.124 -5.826 9.369 1.00 52.15 H new ATOM 0 HG2 GLN A 45 14.196 -4.949 8.265 1.00 43.01 H new ATOM 0 HG3 GLN A 45 13.229 -4.475 6.882 1.00 43.01 H new ATOM 0 HE21 GLN A 45 11.302 -3.015 7.373 1.00 5.31 H new ATOM 0 HE22 GLN A 45 11.562 -1.750 8.579 1.00 5.31 H new ATOM 411 N GLU A 46 10.594 -8.506 7.648 1.00 25.32 N ATOM 412 CA GLU A 46 9.690 -9.537 8.145 1.00 0.41 C ATOM 413 C GLU A 46 10.310 -10.923 7.995 1.00 44.15 C ATOM 414 O GLU A 46 10.069 -11.813 8.810 1.00 71.32 O ATOM 415 CB GLU A 46 8.356 -9.479 7.397 1.00 73.15 C ATOM 416 CG GLU A 46 7.229 -8.862 8.210 1.00 4.51 C ATOM 417 CD GLU A 46 6.038 -9.788 8.352 1.00 43.21 C ATOM 418 OE1 GLU A 46 5.588 -10.339 7.325 1.00 21.32 O ATOM 419 OE2 GLU A 46 5.555 -9.963 9.490 1.00 73.41 O ATOM 0 H GLU A 46 10.303 -8.077 6.770 1.00 25.32 H new ATOM 0 HA GLU A 46 9.514 -9.350 9.204 1.00 0.41 H new ATOM 0 HB2 GLU A 46 8.488 -8.905 6.480 1.00 73.15 H new ATOM 0 HB3 GLU A 46 8.070 -10.489 7.103 1.00 73.15 H new ATOM 0 HG2 GLU A 46 7.601 -8.601 9.201 1.00 4.51 H new ATOM 0 HG3 GLU A 46 6.909 -7.935 7.735 1.00 4.51 H new ATOM 424 N GLN A 47 11.107 -11.098 6.946 1.00 21.43 N ATOM 425 CA GLN A 47 11.761 -12.375 6.689 1.00 65.15 C ATOM 426 C GLN A 47 12.527 -12.853 7.918 1.00 21.04 C ATOM 427 O GLN A 47 12.684 -14.054 8.136 1.00 42.42 O ATOM 428 CB GLN A 47 12.710 -12.256 5.496 1.00 0.31 C ATOM 429 CG GLN A 47 12.175 -12.897 4.225 1.00 22.00 C ATOM 430 CD GLN A 47 11.084 -12.072 3.571 1.00 40.24 C ATOM 431 OE1 GLN A 47 11.362 -11.165 2.785 1.00 24.21 O ATOM 432 NE2 GLN A 47 9.833 -12.383 3.892 1.00 13.50 N ATOM 0 H GLN A 47 11.315 -10.372 6.261 1.00 21.43 H new ATOM 0 HA GLN A 47 10.989 -13.109 6.458 1.00 65.15 H new ATOM 0 HB2 GLN A 47 12.909 -11.202 5.305 1.00 0.31 H new ATOM 0 HB3 GLN A 47 13.663 -12.719 5.753 1.00 0.31 H new ATOM 0 HG2 GLN A 47 12.994 -13.034 3.519 1.00 22.00 H new ATOM 0 HG3 GLN A 47 11.786 -13.888 4.458 1.00 22.00 H new ATOM 0 HE21 GLN A 47 9.648 -13.142 4.548 1.00 13.50 H new ATOM 0 HE22 GLN A 47 9.057 -11.863 3.483 1.00 13.50 H new ATOM 439 N GLU A 48 13.003 -11.904 8.718 1.00 3.30 N ATOM 440 CA GLU A 48 13.755 -12.229 9.925 1.00 55.30 C ATOM 441 C GLU A 48 12.846 -12.850 10.981 1.00 33.13 C ATOM 442 O GLU A 48 13.153 -13.904 11.537 1.00 44.32 O ATOM 443 CB GLU A 48 14.426 -10.974 10.488 1.00 52.40 C ATOM 444 CG GLU A 48 15.050 -11.180 11.858 1.00 4.41 C ATOM 445 CD GLU A 48 15.888 -12.442 11.933 1.00 32.30 C ATOM 446 OE1 GLU A 48 16.957 -12.483 11.289 1.00 64.43 O ATOM 447 OE2 GLU A 48 15.474 -13.387 12.636 1.00 23.31 O ATOM 0 H GLU A 48 12.882 -10.905 8.553 1.00 3.30 H new ATOM 0 HA GLU A 48 14.523 -12.955 9.659 1.00 55.30 H new ATOM 0 HB2 GLU A 48 15.197 -10.642 9.793 1.00 52.40 H new ATOM 0 HB3 GLU A 48 13.688 -10.175 10.551 1.00 52.40 H new ATOM 0 HG2 GLU A 48 15.673 -10.320 12.103 1.00 4.41 H new ATOM 0 HG3 GLU A 48 14.261 -11.227 12.609 1.00 4.41 H new ATOM 452 N ALA A 49 11.727 -12.188 11.253 1.00 74.23 N ATOM 453 CA ALA A 49 10.772 -12.674 12.242 1.00 0.04 C ATOM 454 C ALA A 49 10.041 -13.913 11.735 1.00 31.34 C ATOM 455 O ALA A 49 10.098 -14.975 12.356 1.00 12.51 O ATOM 456 CB ALA A 49 9.777 -11.580 12.597 1.00 73.41 C ATOM 0 H ALA A 49 11.459 -11.313 10.802 1.00 74.23 H new ATOM 0 HA ALA A 49 11.325 -12.952 13.140 1.00 0.04 H new ATOM 0 HB1 ALA A 49 9.070 -11.957 13.336 1.00 73.41 H new ATOM 0 HB2 ALA A 49 10.310 -10.723 13.009 1.00 73.41 H new ATOM 0 HB3 ALA A 49 9.237 -11.275 11.701 1.00 73.41 H new ATOM 462 N GLU A 50 9.355 -13.769 10.606 1.00 3.33 N ATOM 463 CA GLU A 50 8.612 -14.878 10.018 1.00 3.53 C ATOM 464 C GLU A 50 8.897 -14.992 8.523 1.00 74.43 C ATOM 465 O GLU A 50 9.711 -14.248 7.977 1.00 23.21 O ATOM 466 CB GLU A 50 7.110 -14.694 10.250 1.00 0.25 C ATOM 467 CG GLU A 50 6.681 -14.948 11.684 1.00 63.51 C ATOM 468 CD GLU A 50 5.184 -14.803 11.880 1.00 42.52 C ATOM 469 OE1 GLU A 50 4.510 -14.307 10.953 1.00 65.20 O ATOM 470 OE2 GLU A 50 4.688 -15.184 12.960 1.00 62.21 O ATOM 0 H GLU A 50 9.298 -12.897 10.080 1.00 3.33 H new ATOM 0 HA GLU A 50 8.937 -15.798 10.503 1.00 3.53 H new ATOM 0 HB2 GLU A 50 6.829 -13.679 9.970 1.00 0.25 H new ATOM 0 HB3 GLU A 50 6.564 -15.369 9.591 1.00 0.25 H new ATOM 0 HG2 GLU A 50 6.987 -15.952 11.978 1.00 63.51 H new ATOM 0 HG3 GLU A 50 7.199 -14.251 12.343 1.00 63.51 H new ATOM 475 N GLY A 51 8.220 -15.929 7.867 1.00 43.13 N ATOM 476 CA GLY A 51 8.414 -16.124 6.443 1.00 44.15 C ATOM 477 C GLY A 51 7.104 -16.179 5.681 1.00 72.42 C ATOM 478 O GLY A 51 7.040 -16.725 4.580 1.00 63.12 O ATOM 0 H GLY A 51 7.540 -16.557 8.297 1.00 43.13 H new ATOM 0 HA2 GLY A 51 9.026 -15.313 6.049 1.00 44.15 H new ATOM 0 HA3 GLY A 51 8.966 -17.049 6.278 1.00 44.15 H new ATOM 482 N VAL A 52 6.055 -15.612 6.269 1.00 30.10 N ATOM 483 CA VAL A 52 4.740 -15.599 5.640 1.00 10.30 C ATOM 484 C VAL A 52 4.763 -14.807 4.337 1.00 72.25 C ATOM 485 O VAL A 52 5.196 -13.655 4.306 1.00 22.13 O ATOM 486 CB VAL A 52 3.676 -14.997 6.575 1.00 32.31 C ATOM 487 CG1 VAL A 52 3.470 -15.885 7.792 1.00 64.43 C ATOM 488 CG2 VAL A 52 4.071 -13.589 6.995 1.00 12.41 C ATOM 0 H VAL A 52 6.091 -15.156 7.180 1.00 30.10 H new ATOM 0 HA VAL A 52 4.480 -16.636 5.428 1.00 10.30 H new ATOM 0 HB VAL A 52 2.732 -14.939 6.032 1.00 32.31 H new ATOM 0 HG11 VAL A 52 2.714 -15.443 8.441 1.00 64.43 H new ATOM 0 HG12 VAL A 52 3.139 -16.872 7.470 1.00 64.43 H new ATOM 0 HG13 VAL A 52 4.409 -15.977 8.338 1.00 64.43 H new ATOM 0 HG21 VAL A 52 3.307 -13.179 7.656 1.00 12.41 H new ATOM 0 HG22 VAL A 52 5.026 -13.620 7.519 1.00 12.41 H new ATOM 0 HG23 VAL A 52 4.163 -12.958 6.111 1.00 12.41 H new ATOM 498 N ALA A 53 4.293 -15.432 3.262 1.00 71.44 N ATOM 499 CA ALA A 53 4.257 -14.785 1.957 1.00 72.44 C ATOM 500 C ALA A 53 5.615 -14.193 1.600 1.00 4.20 C ATOM 501 O ALA A 53 5.698 -13.123 0.997 1.00 54.20 O ATOM 502 CB ALA A 53 3.185 -13.704 1.933 1.00 31.44 C ATOM 0 H ALA A 53 3.932 -16.386 3.270 1.00 71.44 H new ATOM 0 HA ALA A 53 4.012 -15.541 1.211 1.00 72.44 H new ATOM 0 HB1 ALA A 53 3.169 -13.229 0.952 1.00 31.44 H new ATOM 0 HB2 ALA A 53 2.212 -14.152 2.135 1.00 31.44 H new ATOM 0 HB3 ALA A 53 3.405 -12.956 2.695 1.00 31.44 H new ATOM 508 N ALA A 54 6.679 -14.896 1.975 1.00 73.31 N ATOM 509 CA ALA A 54 8.034 -14.441 1.693 1.00 54.10 C ATOM 510 C ALA A 54 8.288 -14.369 0.191 1.00 60.45 C ATOM 511 O ALA A 54 7.578 -14.975 -0.612 1.00 30.11 O ATOM 512 CB ALA A 54 9.049 -15.359 2.358 1.00 12.13 C ATOM 0 H ALA A 54 6.628 -15.783 2.475 1.00 73.31 H new ATOM 0 HA ALA A 54 8.145 -13.437 2.103 1.00 54.10 H new ATOM 0 HB1 ALA A 54 10.057 -15.007 2.139 1.00 12.13 H new ATOM 0 HB2 ALA A 54 8.890 -15.356 3.436 1.00 12.13 H new ATOM 0 HB3 ALA A 54 8.928 -16.373 1.976 1.00 12.13 H new ATOM 518 N PRO A 55 9.322 -13.610 -0.200 1.00 15.31 N ATOM 519 CA PRO A 55 9.692 -13.441 -1.609 1.00 24.53 C ATOM 520 C PRO A 55 10.273 -14.715 -2.212 1.00 41.21 C ATOM 521 O PRO A 55 10.222 -15.782 -1.600 1.00 44.44 O ATOM 522 CB PRO A 55 10.753 -12.338 -1.566 1.00 23.22 C ATOM 523 CG PRO A 55 11.334 -12.423 -0.197 1.00 20.31 C ATOM 524 CD PRO A 55 10.211 -12.859 0.703 1.00 74.01 C ATOM 0 HA PRO A 55 8.830 -13.199 -2.231 1.00 24.53 H new ATOM 0 HB2 PRO A 55 11.515 -12.492 -2.330 1.00 23.22 H new ATOM 0 HB3 PRO A 55 10.313 -11.358 -1.749 1.00 23.22 H new ATOM 0 HG2 PRO A 55 12.158 -13.136 -0.166 1.00 20.31 H new ATOM 0 HG3 PRO A 55 11.734 -11.459 0.118 1.00 20.31 H new ATOM 0 HD2 PRO A 55 10.571 -13.482 1.522 1.00 74.01 H new ATOM 0 HD3 PRO A 55 9.701 -12.006 1.151 1.00 74.01 H new ATOM 529 N ALA A 56 10.824 -14.597 -3.415 1.00 2.41 N ATOM 530 CA ALA A 56 11.417 -15.739 -4.100 1.00 40.12 C ATOM 531 C ALA A 56 12.900 -15.867 -3.773 1.00 11.34 C ATOM 532 O ALA A 56 13.718 -16.134 -4.653 1.00 21.03 O ATOM 533 CB ALA A 56 11.214 -15.617 -5.603 1.00 60.45 C ATOM 0 H ALA A 56 10.872 -13.721 -3.936 1.00 2.41 H new ATOM 0 HA ALA A 56 10.916 -16.641 -3.749 1.00 40.12 H new ATOM 0 HB1 ALA A 56 11.662 -16.477 -6.102 1.00 60.45 H new ATOM 0 HB2 ALA A 56 10.147 -15.584 -5.825 1.00 60.45 H new ATOM 0 HB3 ALA A 56 11.687 -14.703 -5.961 1.00 60.45 H new ATOM 539 N ASP A 57 13.241 -15.671 -2.504 1.00 64.04 N ATOM 540 CA ASP A 57 14.627 -15.765 -2.062 1.00 71.20 C ATOM 541 C ASP A 57 15.486 -14.701 -2.737 1.00 34.03 C ATOM 542 O ASP A 57 15.147 -14.174 -3.798 1.00 60.32 O ATOM 543 CB ASP A 57 15.188 -17.156 -2.360 1.00 1.14 C ATOM 544 CG ASP A 57 14.109 -18.220 -2.396 1.00 72.35 C ATOM 545 OD1 ASP A 57 13.252 -18.227 -1.487 1.00 34.30 O ATOM 546 OD2 ASP A 57 14.120 -19.044 -3.333 1.00 24.51 O ATOM 0 H ASP A 57 12.576 -15.446 -1.764 1.00 64.04 H new ATOM 0 HA ASP A 57 14.651 -15.596 -0.985 1.00 71.20 H new ATOM 0 HB2 ASP A 57 15.708 -17.137 -3.318 1.00 1.14 H new ATOM 0 HB3 ASP A 57 15.926 -17.417 -1.602 1.00 1.14 H new ATOM 550 N PRO A 58 16.626 -14.374 -2.111 1.00 22.13 N ATOM 551 CA PRO A 58 17.557 -13.369 -2.633 1.00 5.54 C ATOM 552 C PRO A 58 18.271 -13.842 -3.895 1.00 24.43 C ATOM 553 O PRO A 58 19.368 -14.397 -3.828 1.00 74.43 O ATOM 554 CB PRO A 58 18.558 -13.185 -1.490 1.00 34.22 C ATOM 555 CG PRO A 58 18.511 -14.467 -0.734 1.00 32.13 C ATOM 556 CD PRO A 58 17.094 -14.961 -0.844 1.00 31.43 C ATOM 0 HA PRO A 58 17.046 -12.451 -2.922 1.00 5.54 H new ATOM 0 HB2 PRO A 58 19.560 -12.986 -1.870 1.00 34.22 H new ATOM 0 HB3 PRO A 58 18.284 -12.342 -0.856 1.00 34.22 H new ATOM 0 HG2 PRO A 58 19.210 -15.192 -1.151 1.00 32.13 H new ATOM 0 HG3 PRO A 58 18.792 -14.316 0.308 1.00 32.13 H new ATOM 0 HD2 PRO A 58 17.048 -16.050 -0.864 1.00 31.43 H new ATOM 0 HD3 PRO A 58 16.487 -14.632 -0.000 1.00 31.43 H new ATOM 561 N GLU A 59 17.643 -13.617 -5.045 1.00 64.03 N ATOM 562 CA GLU A 59 18.219 -14.021 -6.322 1.00 64.42 C ATOM 563 C GLU A 59 17.747 -13.105 -7.446 1.00 64.04 C ATOM 564 O GLU A 59 17.180 -12.041 -7.198 1.00 25.51 O ATOM 565 CB GLU A 59 17.846 -15.472 -6.639 1.00 15.02 C ATOM 566 CG GLU A 59 19.033 -16.333 -7.035 1.00 12.02 C ATOM 567 CD GLU A 59 18.626 -17.736 -7.440 1.00 10.14 C ATOM 568 OE1 GLU A 59 17.733 -18.308 -6.781 1.00 60.14 O ATOM 569 OE2 GLU A 59 19.201 -18.263 -8.416 1.00 72.21 O ATOM 0 H GLU A 59 16.735 -13.157 -5.118 1.00 64.03 H new ATOM 0 HA GLU A 59 19.303 -13.941 -6.244 1.00 64.42 H new ATOM 0 HB2 GLU A 59 17.363 -15.913 -5.767 1.00 15.02 H new ATOM 0 HB3 GLU A 59 17.115 -15.482 -7.447 1.00 15.02 H new ATOM 0 HG2 GLU A 59 19.561 -15.859 -7.862 1.00 12.02 H new ATOM 0 HG3 GLU A 59 19.732 -16.388 -6.200 1.00 12.02 H new ATOM 574 N MET A 60 17.985 -13.526 -8.684 1.00 72.25 N ATOM 575 CA MET A 60 17.583 -12.743 -9.847 1.00 2.31 C ATOM 576 C MET A 60 16.080 -12.483 -9.836 1.00 24.15 C ATOM 577 O MET A 60 15.606 -11.498 -10.399 1.00 53.51 O ATOM 578 CB MET A 60 17.978 -13.468 -11.136 1.00 55.05 C ATOM 579 CG MET A 60 17.400 -12.833 -12.391 1.00 53.01 C ATOM 580 SD MET A 60 15.832 -13.573 -12.886 1.00 44.12 S ATOM 581 CE MET A 60 16.320 -15.284 -13.102 1.00 30.20 C ATOM 0 H MET A 60 18.454 -14.404 -8.908 1.00 72.25 H new ATOM 0 HA MET A 60 18.099 -11.784 -9.804 1.00 2.31 H new ATOM 0 HB2 MET A 60 19.065 -13.486 -11.215 1.00 55.05 H new ATOM 0 HB3 MET A 60 17.646 -14.504 -11.077 1.00 55.05 H new ATOM 0 HG2 MET A 60 17.256 -11.766 -12.220 1.00 53.01 H new ATOM 0 HG3 MET A 60 18.117 -12.931 -13.206 1.00 53.01 H new ATOM 0 HE1 MET A 60 15.708 -15.742 -13.879 1.00 30.20 H new ATOM 0 HE2 MET A 60 17.369 -15.329 -13.393 1.00 30.20 H new ATOM 0 HE3 MET A 60 16.180 -15.823 -12.165 1.00 30.20 H new ATOM 589 N VAL A 61 15.335 -13.375 -9.190 1.00 60.23 N ATOM 590 CA VAL A 61 13.886 -13.242 -9.104 1.00 51.22 C ATOM 591 C VAL A 61 13.489 -12.237 -8.029 1.00 21.54 C ATOM 592 O VAL A 61 12.318 -11.877 -7.900 1.00 3.13 O ATOM 593 CB VAL A 61 13.215 -14.595 -8.801 1.00 72.42 C ATOM 594 CG1 VAL A 61 11.706 -14.490 -8.963 1.00 73.33 C ATOM 595 CG2 VAL A 61 13.781 -15.684 -9.699 1.00 32.10 C ATOM 0 H VAL A 61 15.712 -14.197 -8.719 1.00 60.23 H new ATOM 0 HA VAL A 61 13.543 -12.885 -10.075 1.00 51.22 H new ATOM 0 HB VAL A 61 13.428 -14.863 -7.766 1.00 72.42 H new ATOM 0 HG11 VAL A 61 11.249 -15.455 -8.745 1.00 73.33 H new ATOM 0 HG12 VAL A 61 11.317 -13.740 -8.274 1.00 73.33 H new ATOM 0 HG13 VAL A 61 11.469 -14.199 -9.986 1.00 73.33 H new ATOM 0 HG21 VAL A 61 13.295 -16.633 -9.471 1.00 32.10 H new ATOM 0 HG22 VAL A 61 13.600 -15.426 -10.742 1.00 32.10 H new ATOM 0 HG23 VAL A 61 14.854 -15.775 -9.528 1.00 32.10 H new ATOM 605 N THR A 62 14.473 -11.786 -7.255 1.00 65.22 N ATOM 606 CA THR A 62 14.227 -10.824 -6.189 1.00 11.54 C ATOM 607 C THR A 62 13.589 -9.551 -6.734 1.00 12.15 C ATOM 608 O THR A 62 13.195 -9.492 -7.899 1.00 40.50 O ATOM 609 CB THR A 62 15.530 -10.458 -5.452 1.00 54.15 C ATOM 610 OG1 THR A 62 15.225 -9.882 -4.177 1.00 61.31 O ATOM 611 CG2 THR A 62 16.358 -9.479 -6.271 1.00 62.43 C ATOM 0 H THR A 62 15.448 -12.073 -7.348 1.00 65.22 H new ATOM 0 HA THR A 62 13.542 -11.298 -5.486 1.00 11.54 H new ATOM 0 HB THR A 62 16.110 -11.370 -5.310 1.00 54.15 H new ATOM 0 HG1 THR A 62 16.058 -9.654 -3.714 1.00 61.31 H new ATOM 0 HG21 THR A 62 17.273 -9.235 -5.731 1.00 62.43 H new ATOM 0 HG22 THR A 62 16.612 -9.931 -7.230 1.00 62.43 H new ATOM 0 HG23 THR A 62 15.783 -8.569 -6.440 1.00 62.43 H new ATOM 619 N LEU A 63 13.492 -8.534 -5.886 1.00 74.41 N ATOM 620 CA LEU A 63 12.902 -7.260 -6.282 1.00 45.45 C ATOM 621 C LEU A 63 13.969 -6.176 -6.389 1.00 13.13 C ATOM 622 O LEU A 63 14.212 -5.415 -5.452 1.00 60.14 O ATOM 623 CB LEU A 63 11.827 -6.838 -5.278 1.00 3.42 C ATOM 624 CG LEU A 63 10.869 -5.741 -5.743 1.00 62.31 C ATOM 625 CD1 LEU A 63 9.590 -5.767 -4.922 1.00 23.50 C ATOM 626 CD2 LEU A 63 11.536 -4.376 -5.652 1.00 52.04 C ATOM 0 H LEU A 63 13.814 -8.566 -4.919 1.00 74.41 H new ATOM 0 HA LEU A 63 12.443 -7.390 -7.262 1.00 45.45 H new ATOM 0 HB2 LEU A 63 11.240 -7.717 -5.014 1.00 3.42 H new ATOM 0 HB3 LEU A 63 12.321 -6.499 -4.368 1.00 3.42 H new ATOM 0 HG LEU A 63 10.611 -5.928 -6.785 1.00 62.31 H new ATOM 0 HD11 LEU A 63 8.920 -4.979 -5.267 1.00 23.50 H new ATOM 0 HD12 LEU A 63 9.102 -6.735 -5.039 1.00 23.50 H new ATOM 0 HD13 LEU A 63 9.829 -5.605 -3.871 1.00 23.50 H new ATOM 0 HD21 LEU A 63 10.839 -3.608 -5.987 1.00 52.04 H new ATOM 0 HD22 LEU A 63 11.824 -4.180 -4.619 1.00 52.04 H new ATOM 0 HD23 LEU A 63 12.423 -4.362 -6.285 1.00 52.04 H new ATOM 637 N PRO A 64 14.622 -6.100 -7.559 1.00 60.42 N ATOM 638 CA PRO A 64 15.671 -5.110 -7.816 1.00 5.44 C ATOM 639 C PRO A 64 15.119 -3.692 -7.921 1.00 24.11 C ATOM 640 O PRO A 64 14.868 -3.193 -9.018 1.00 61.04 O ATOM 641 CB PRO A 64 16.257 -5.557 -9.159 1.00 35.03 C ATOM 642 CG PRO A 64 15.154 -6.304 -9.824 1.00 61.51 C ATOM 643 CD PRO A 64 14.384 -6.974 -8.719 1.00 64.00 C ATOM 0 HA PRO A 64 16.401 -5.070 -7.008 1.00 5.44 H new ATOM 0 HB2 PRO A 64 16.573 -4.702 -9.757 1.00 35.03 H new ATOM 0 HB3 PRO A 64 17.134 -6.189 -9.018 1.00 35.03 H new ATOM 0 HG2 PRO A 64 14.514 -5.630 -10.393 1.00 61.51 H new ATOM 0 HG3 PRO A 64 15.548 -7.039 -10.526 1.00 61.51 H new ATOM 0 HD2 PRO A 64 13.323 -7.047 -8.956 1.00 64.00 H new ATOM 0 HD3 PRO A 64 14.741 -7.988 -8.538 1.00 64.00 H new ATOM 648 N LEU A 65 14.933 -3.049 -6.773 1.00 2.25 N ATOM 649 CA LEU A 65 14.411 -1.688 -6.735 1.00 51.34 C ATOM 650 C LEU A 65 15.516 -0.673 -7.005 1.00 33.14 C ATOM 651 O LEU A 65 16.697 -1.019 -7.030 1.00 24.34 O ATOM 652 CB LEU A 65 13.764 -1.407 -5.378 1.00 35.23 C ATOM 653 CG LEU A 65 14.691 -1.480 -4.165 1.00 11.13 C ATOM 654 CD1 LEU A 65 14.472 -0.285 -3.252 1.00 75.53 C ATOM 655 CD2 LEU A 65 14.473 -2.781 -3.406 1.00 71.51 C ATOM 0 H LEU A 65 15.136 -3.449 -5.857 1.00 2.25 H new ATOM 0 HA LEU A 65 13.657 -1.592 -7.517 1.00 51.34 H new ATOM 0 HB2 LEU A 65 13.317 -0.413 -5.410 1.00 35.23 H new ATOM 0 HB3 LEU A 65 12.950 -2.117 -5.232 1.00 35.23 H new ATOM 0 HG LEU A 65 15.722 -1.456 -4.518 1.00 11.13 H new ATOM 0 HD11 LEU A 65 15.141 -0.355 -2.394 1.00 75.53 H new ATOM 0 HD12 LEU A 65 14.679 0.634 -3.800 1.00 75.53 H new ATOM 0 HD13 LEU A 65 13.438 -0.276 -2.906 1.00 75.53 H new ATOM 0 HD21 LEU A 65 15.141 -2.817 -2.545 1.00 71.51 H new ATOM 0 HD22 LEU A 65 13.439 -2.835 -3.065 1.00 71.51 H new ATOM 0 HD23 LEU A 65 14.683 -3.625 -4.063 1.00 71.51 H new ATOM 666 N GLN A 66 15.126 0.582 -7.205 1.00 43.05 N ATOM 667 CA GLN A 66 16.084 1.647 -7.471 1.00 3.34 C ATOM 668 C GLN A 66 16.130 2.641 -6.315 1.00 53.05 C ATOM 669 O GLN A 66 15.570 3.736 -6.384 1.00 23.33 O ATOM 670 CB GLN A 66 15.725 2.373 -8.770 1.00 31.43 C ATOM 671 CG GLN A 66 16.863 3.210 -9.332 1.00 54.45 C ATOM 672 CD GLN A 66 17.401 2.660 -10.639 1.00 55.12 C ATOM 673 OE1 GLN A 66 17.425 3.355 -11.655 1.00 53.21 O ATOM 674 NE2 GLN A 66 17.836 1.406 -10.619 1.00 32.54 N ATOM 0 H GLN A 66 14.152 0.886 -7.188 1.00 43.05 H new ATOM 0 HA GLN A 66 17.070 1.195 -7.576 1.00 3.34 H new ATOM 0 HB2 GLN A 66 15.423 1.638 -9.516 1.00 31.43 H new ATOM 0 HB3 GLN A 66 14.865 3.018 -8.591 1.00 31.43 H new ATOM 0 HG2 GLN A 66 16.516 4.231 -9.487 1.00 54.45 H new ATOM 0 HG3 GLN A 66 17.671 3.256 -8.601 1.00 54.45 H new ATOM 0 HE21 GLN A 66 17.797 0.867 -9.754 1.00 32.54 H new ATOM 0 HE22 GLN A 66 18.209 0.982 -11.468 1.00 32.54 H new ATOM 681 N PRO A 67 16.809 2.252 -5.227 1.00 21.40 N ATOM 682 CA PRO A 67 16.943 3.094 -4.034 1.00 14.41 C ATOM 683 C PRO A 67 17.835 4.307 -4.278 1.00 41.03 C ATOM 684 O PRO A 67 17.946 5.190 -3.427 1.00 64.01 O ATOM 685 CB PRO A 67 17.584 2.157 -3.008 1.00 73.10 C ATOM 686 CG PRO A 67 18.311 1.144 -3.823 1.00 60.34 C ATOM 687 CD PRO A 67 17.500 0.960 -5.075 1.00 11.12 C ATOM 0 HA PRO A 67 15.985 3.505 -3.716 1.00 14.41 H new ATOM 0 HB2 PRO A 67 18.264 2.697 -2.349 1.00 73.10 H new ATOM 0 HB3 PRO A 67 16.831 1.689 -2.374 1.00 73.10 H new ATOM 0 HG2 PRO A 67 19.320 1.483 -4.058 1.00 60.34 H new ATOM 0 HG3 PRO A 67 18.409 0.204 -3.280 1.00 60.34 H new ATOM 0 HD2 PRO A 67 18.133 0.739 -5.935 1.00 11.12 H new ATOM 0 HD3 PRO A 67 16.794 0.135 -4.979 1.00 11.12 H new ATOM 692 N SER A 68 18.468 4.344 -5.447 1.00 71.30 N ATOM 693 CA SER A 68 19.353 5.447 -5.801 1.00 15.14 C ATOM 694 C SER A 68 18.567 6.746 -5.955 1.00 51.51 C ATOM 695 O SER A 68 19.144 7.832 -6.002 1.00 33.53 O ATOM 696 CB SER A 68 20.101 5.133 -7.098 1.00 11.41 C ATOM 697 OG SER A 68 19.540 5.836 -8.193 1.00 13.42 O ATOM 0 H SER A 68 18.384 3.623 -6.164 1.00 71.30 H new ATOM 0 HA SER A 68 20.076 5.573 -4.995 1.00 15.14 H new ATOM 0 HB2 SER A 68 21.152 5.401 -6.990 1.00 11.41 H new ATOM 0 HB3 SER A 68 20.064 4.061 -7.292 1.00 11.41 H new ATOM 0 HG SER A 68 20.037 5.620 -9.010 1.00 13.42 H new ATOM 702 N SER A 69 17.246 6.625 -6.037 1.00 60.31 N ATOM 703 CA SER A 69 16.380 7.788 -6.191 1.00 70.43 C ATOM 704 C SER A 69 15.734 8.164 -4.860 1.00 12.22 C ATOM 705 O SER A 69 15.676 7.356 -3.933 1.00 23.01 O ATOM 706 CB SER A 69 15.296 7.509 -7.235 1.00 21.32 C ATOM 707 OG SER A 69 14.014 7.449 -6.635 1.00 51.35 O ATOM 0 H SER A 69 16.752 5.733 -5.999 1.00 60.31 H new ATOM 0 HA SER A 69 16.993 8.624 -6.528 1.00 70.43 H new ATOM 0 HB2 SER A 69 15.309 8.290 -7.995 1.00 21.32 H new ATOM 0 HB3 SER A 69 15.508 6.568 -7.742 1.00 21.32 H new ATOM 0 HG SER A 69 13.339 7.271 -7.323 1.00 51.35 H new ATOM 712 N THR A 70 15.250 9.399 -4.773 1.00 40.32 N ATOM 713 CA THR A 70 14.610 9.885 -3.558 1.00 34.31 C ATOM 714 C THR A 70 13.469 8.968 -3.132 1.00 31.12 C ATOM 715 O THR A 70 13.117 8.904 -1.955 1.00 14.05 O ATOM 716 CB THR A 70 14.064 11.314 -3.742 1.00 62.21 C ATOM 717 OG1 THR A 70 15.132 12.208 -4.072 1.00 63.22 O ATOM 718 CG2 THR A 70 13.365 11.794 -2.479 1.00 45.33 C ATOM 0 H THR A 70 15.289 10.081 -5.530 1.00 40.32 H new ATOM 0 HA THR A 70 15.375 9.894 -2.781 1.00 34.31 H new ATOM 0 HB THR A 70 13.339 11.300 -4.556 1.00 62.21 H new ATOM 0 HG1 THR A 70 14.773 13.109 -4.213 1.00 63.22 H new ATOM 0 HG21 THR A 70 12.988 12.805 -2.634 1.00 45.33 H new ATOM 0 HG22 THR A 70 12.533 11.128 -2.248 1.00 45.33 H new ATOM 0 HG23 THR A 70 14.072 11.793 -1.649 1.00 45.33 H new ATOM 726 N MET A 71 12.895 8.259 -4.098 1.00 64.43 N ATOM 727 CA MET A 71 11.794 7.343 -3.822 1.00 41.30 C ATOM 728 C MET A 71 12.245 6.212 -2.904 1.00 11.03 C ATOM 729 O MET A 71 11.464 5.701 -2.103 1.00 64.45 O ATOM 730 CB MET A 71 11.243 6.767 -5.128 1.00 44.02 C ATOM 731 CG MET A 71 10.732 7.824 -6.091 1.00 55.55 C ATOM 732 SD MET A 71 9.358 8.775 -5.414 1.00 72.43 S ATOM 733 CE MET A 71 10.140 10.366 -5.160 1.00 71.33 C ATOM 0 H MET A 71 13.174 8.301 -5.078 1.00 64.43 H new ATOM 0 HA MET A 71 11.006 7.903 -3.319 1.00 41.30 H new ATOM 0 HB2 MET A 71 12.026 6.188 -5.619 1.00 44.02 H new ATOM 0 HB3 MET A 71 10.433 6.076 -4.897 1.00 44.02 H new ATOM 0 HG2 MET A 71 11.547 8.502 -6.346 1.00 55.55 H new ATOM 0 HG3 MET A 71 10.415 7.344 -7.017 1.00 55.55 H new ATOM 0 HE1 MET A 71 10.316 10.519 -4.095 1.00 71.33 H new ATOM 0 HE2 MET A 71 11.091 10.393 -5.692 1.00 71.33 H new ATOM 0 HE3 MET A 71 9.490 11.155 -5.538 1.00 71.33 H new ATOM 741 N GLY A 72 13.513 5.825 -3.025 1.00 54.15 N ATOM 742 CA GLY A 72 14.045 4.757 -2.199 1.00 54.43 C ATOM 743 C GLY A 72 13.799 4.989 -0.722 1.00 13.30 C ATOM 744 O GLY A 72 13.477 4.056 0.014 1.00 51.43 O ATOM 0 H GLY A 72 14.180 6.233 -3.680 1.00 54.15 H new ATOM 0 HA2 GLY A 72 13.591 3.812 -2.496 1.00 54.43 H new ATOM 0 HA3 GLY A 72 15.117 4.665 -2.376 1.00 54.43 H new ATOM 748 N GLN A 73 13.952 6.236 -0.286 1.00 3.13 N ATOM 749 CA GLN A 73 13.748 6.585 1.114 1.00 54.43 C ATOM 750 C GLN A 73 12.261 6.602 1.459 1.00 10.43 C ATOM 751 O GLN A 73 11.878 6.394 2.611 1.00 2.34 O ATOM 752 CB GLN A 73 14.368 7.950 1.417 1.00 23.21 C ATOM 753 CG GLN A 73 13.386 9.104 1.302 1.00 51.11 C ATOM 754 CD GLN A 73 14.052 10.456 1.462 1.00 32.02 C ATOM 755 OE1 GLN A 73 14.425 11.098 0.479 1.00 31.31 O ATOM 756 NE2 GLN A 73 14.207 10.898 2.705 1.00 2.11 N ATOM 0 H GLN A 73 14.216 7.020 -0.882 1.00 3.13 H new ATOM 0 HA GLN A 73 14.237 5.827 1.726 1.00 54.43 H new ATOM 0 HB2 GLN A 73 14.782 7.936 2.425 1.00 23.21 H new ATOM 0 HB3 GLN A 73 15.199 8.122 0.733 1.00 23.21 H new ATOM 0 HG2 GLN A 73 12.891 9.060 0.332 1.00 51.11 H new ATOM 0 HG3 GLN A 73 12.611 8.993 2.060 1.00 51.11 H new ATOM 0 HE21 GLN A 73 13.883 10.334 3.491 1.00 2.11 H new ATOM 0 HE22 GLN A 73 14.650 11.801 2.874 1.00 2.11 H new ATOM 763 N VAL A 74 11.429 6.851 0.454 1.00 50.43 N ATOM 764 CA VAL A 74 9.984 6.894 0.651 1.00 4.13 C ATOM 765 C VAL A 74 9.455 5.548 1.134 1.00 4.42 C ATOM 766 O VAL A 74 8.833 5.457 2.191 1.00 51.15 O ATOM 767 CB VAL A 74 9.253 7.285 -0.647 1.00 62.43 C ATOM 768 CG1 VAL A 74 7.750 7.339 -0.417 1.00 42.33 C ATOM 769 CG2 VAL A 74 9.769 8.617 -1.170 1.00 33.52 C ATOM 0 H VAL A 74 11.730 7.026 -0.505 1.00 50.43 H new ATOM 0 HA VAL A 74 9.790 7.651 1.411 1.00 4.13 H new ATOM 0 HB VAL A 74 9.455 6.523 -1.400 1.00 62.43 H new ATOM 0 HG11 VAL A 74 7.250 7.617 -1.345 1.00 42.33 H new ATOM 0 HG12 VAL A 74 7.396 6.360 -0.093 1.00 42.33 H new ATOM 0 HG13 VAL A 74 7.526 8.079 0.352 1.00 42.33 H new ATOM 0 HG21 VAL A 74 9.241 8.877 -2.087 1.00 33.52 H new ATOM 0 HG22 VAL A 74 9.600 9.392 -0.422 1.00 33.52 H new ATOM 0 HG23 VAL A 74 10.837 8.538 -1.376 1.00 33.52 H new ATOM 779 N GLY A 75 9.709 4.503 0.352 1.00 51.34 N ATOM 780 CA GLY A 75 9.251 3.175 0.716 1.00 73.01 C ATOM 781 C GLY A 75 9.652 2.791 2.127 1.00 3.01 C ATOM 782 O GLY A 75 8.830 2.300 2.901 1.00 33.02 O ATOM 0 H GLY A 75 10.224 4.553 -0.527 1.00 51.34 H new ATOM 0 HA2 GLY A 75 8.166 3.130 0.625 1.00 73.01 H new ATOM 0 HA3 GLY A 75 9.660 2.448 0.015 1.00 73.01 H new ATOM 786 N ARG A 76 10.919 3.014 2.463 1.00 52.43 N ATOM 787 CA ARG A 76 11.427 2.685 3.789 1.00 14.55 C ATOM 788 C ARG A 76 10.583 3.347 4.873 1.00 72.43 C ATOM 789 O ARG A 76 10.054 2.674 5.757 1.00 71.03 O ATOM 790 CB ARG A 76 12.886 3.126 3.922 1.00 4.00 C ATOM 791 CG ARG A 76 13.442 2.971 5.328 1.00 12.20 C ATOM 792 CD ARG A 76 14.895 3.415 5.404 1.00 34.31 C ATOM 793 NE ARG A 76 15.090 4.484 6.381 1.00 51.41 N ATOM 794 CZ ARG A 76 15.177 4.277 7.689 1.00 73.35 C ATOM 795 NH1 ARG A 76 15.087 3.047 8.177 1.00 33.02 N ATOM 796 NH2 ARG A 76 15.355 5.301 8.515 1.00 54.41 N ATOM 0 H ARG A 76 11.612 3.421 1.835 1.00 52.43 H new ATOM 0 HA ARG A 76 11.368 1.604 3.917 1.00 14.55 H new ATOM 0 HB2 ARG A 76 13.497 2.544 3.232 1.00 4.00 H new ATOM 0 HB3 ARG A 76 12.970 4.170 3.620 1.00 4.00 H new ATOM 0 HG2 ARG A 76 12.844 3.559 6.024 1.00 12.20 H new ATOM 0 HG3 ARG A 76 13.362 1.930 5.640 1.00 12.20 H new ATOM 0 HD2 ARG A 76 15.521 2.563 5.669 1.00 34.31 H new ATOM 0 HD3 ARG A 76 15.221 3.757 4.422 1.00 34.31 H new ATOM 0 HE ARG A 76 15.163 5.442 6.039 1.00 51.41 H new ATOM 0 HH11 ARG A 76 14.951 2.257 7.547 1.00 33.02 H new ATOM 0 HH12 ARG A 76 15.154 2.891 9.183 1.00 33.02 H new ATOM 0 HH21 ARG A 76 15.425 6.249 8.145 1.00 54.41 H new ATOM 0 HH22 ARG A 76 15.422 5.140 9.520 1.00 54.41 H new ATOM 807 N GLN A 77 10.464 4.669 4.799 1.00 61.42 N ATOM 808 CA GLN A 77 9.685 5.421 5.776 1.00 31.32 C ATOM 809 C GLN A 77 8.268 4.866 5.887 1.00 14.13 C ATOM 810 O GLN A 77 7.793 4.562 6.981 1.00 51.13 O ATOM 811 CB GLN A 77 9.639 6.901 5.392 1.00 62.42 C ATOM 812 CG GLN A 77 9.423 7.829 6.577 1.00 54.50 C ATOM 813 CD GLN A 77 8.358 7.324 7.529 1.00 71.53 C ATOM 814 OE1 GLN A 77 7.172 7.609 7.360 1.00 21.13 O ATOM 815 NE2 GLN A 77 8.776 6.569 8.538 1.00 1.23 N ATOM 0 H GLN A 77 10.897 5.241 4.074 1.00 61.42 H new ATOM 0 HA GLN A 77 10.171 5.320 6.747 1.00 31.32 H new ATOM 0 HB2 GLN A 77 10.572 7.169 4.896 1.00 62.42 H new ATOM 0 HB3 GLN A 77 8.838 7.056 4.669 1.00 62.42 H new ATOM 0 HG2 GLN A 77 10.362 7.946 7.118 1.00 54.50 H new ATOM 0 HG3 GLN A 77 9.140 8.817 6.213 1.00 54.50 H new ATOM 0 HE21 GLN A 77 9.769 6.358 8.640 1.00 1.23 H new ATOM 0 HE22 GLN A 77 8.104 6.200 9.211 1.00 1.23 H new ATOM 822 N LEU A 78 7.598 4.739 4.746 1.00 32.14 N ATOM 823 CA LEU A 78 6.234 4.222 4.714 1.00 10.12 C ATOM 824 C LEU A 78 6.137 2.897 5.462 1.00 44.21 C ATOM 825 O LEU A 78 5.205 2.674 6.233 1.00 70.15 O ATOM 826 CB LEU A 78 5.771 4.041 3.267 1.00 73.53 C ATOM 827 CG LEU A 78 5.621 5.321 2.446 1.00 53.32 C ATOM 828 CD1 LEU A 78 5.013 5.014 1.086 1.00 12.33 C ATOM 829 CD2 LEU A 78 4.772 6.339 3.194 1.00 54.14 C ATOM 0 H LEU A 78 7.977 4.987 3.832 1.00 32.14 H new ATOM 0 HA LEU A 78 5.585 4.945 5.209 1.00 10.12 H new ATOM 0 HB2 LEU A 78 6.480 3.388 2.759 1.00 73.53 H new ATOM 0 HB3 LEU A 78 4.811 3.524 3.276 1.00 73.53 H new ATOM 0 HG LEU A 78 6.612 5.748 2.291 1.00 53.32 H new ATOM 0 HD11 LEU A 78 4.914 5.937 0.515 1.00 12.33 H new ATOM 0 HD12 LEU A 78 5.659 4.322 0.547 1.00 12.33 H new ATOM 0 HD13 LEU A 78 4.030 4.563 1.220 1.00 12.33 H new ATOM 0 HD21 LEU A 78 4.676 7.244 2.594 1.00 54.14 H new ATOM 0 HD22 LEU A 78 3.783 5.921 3.381 1.00 54.14 H new ATOM 0 HD23 LEU A 78 5.248 6.582 4.144 1.00 54.14 H new ATOM 840 N ALA A 79 7.108 2.019 5.229 1.00 2.44 N ATOM 841 CA ALA A 79 7.134 0.717 5.883 1.00 64.15 C ATOM 842 C ALA A 79 7.221 0.865 7.397 1.00 71.41 C ATOM 843 O ALA A 79 6.746 0.008 8.143 1.00 64.14 O ATOM 844 CB ALA A 79 8.301 -0.111 5.364 1.00 43.11 C ATOM 0 H ALA A 79 7.887 2.187 4.592 1.00 2.44 H new ATOM 0 HA ALA A 79 6.203 0.201 5.648 1.00 64.15 H new ATOM 0 HB1 ALA A 79 8.308 -1.081 5.861 1.00 43.11 H new ATOM 0 HB2 ALA A 79 8.195 -0.255 4.289 1.00 43.11 H new ATOM 0 HB3 ALA A 79 9.236 0.409 5.570 1.00 43.11 H new ATOM 850 N ILE A 80 7.829 1.958 7.847 1.00 41.13 N ATOM 851 CA ILE A 80 7.976 2.217 9.274 1.00 1.54 C ATOM 852 C ILE A 80 6.659 2.677 9.888 1.00 64.11 C ATOM 853 O ILE A 80 6.179 2.093 10.860 1.00 54.00 O ATOM 854 CB ILE A 80 9.055 3.283 9.544 1.00 2.51 C ATOM 855 CG1 ILE A 80 10.409 2.820 9.000 1.00 52.04 C ATOM 856 CG2 ILE A 80 9.149 3.578 11.033 1.00 44.21 C ATOM 857 CD1 ILE A 80 11.417 3.938 8.857 1.00 73.13 C ATOM 0 H ILE A 80 8.227 2.678 7.244 1.00 41.13 H new ATOM 0 HA ILE A 80 8.281 1.278 9.735 1.00 1.54 H new ATOM 0 HB ILE A 80 8.773 4.201 9.029 1.00 2.51 H new ATOM 0 HG12 ILE A 80 10.816 2.057 9.664 1.00 52.04 H new ATOM 0 HG13 ILE A 80 10.259 2.350 8.028 1.00 52.04 H new ATOM 0 HG21 ILE A 80 9.916 4.333 11.207 1.00 44.21 H new ATOM 0 HG22 ILE A 80 8.188 3.947 11.392 1.00 44.21 H new ATOM 0 HG23 ILE A 80 9.410 2.666 11.569 1.00 44.21 H new ATOM 0 HD11 ILE A 80 12.352 3.537 8.467 1.00 73.13 H new ATOM 0 HD12 ILE A 80 11.030 4.691 8.170 1.00 73.13 H new ATOM 0 HD13 ILE A 80 11.596 4.393 9.831 1.00 73.13 H new ATOM 868 N ILE A 81 6.078 3.724 9.313 1.00 22.32 N ATOM 869 CA ILE A 81 4.813 4.260 9.802 1.00 21.42 C ATOM 870 C ILE A 81 3.706 3.216 9.720 1.00 65.32 C ATOM 871 O ILE A 81 2.733 3.266 10.473 1.00 14.40 O ATOM 872 CB ILE A 81 4.386 5.508 9.009 1.00 12.15 C ATOM 873 CG1 ILE A 81 4.551 5.267 7.507 1.00 25.34 C ATOM 874 CG2 ILE A 81 5.197 6.718 9.448 1.00 0.44 C ATOM 875 CD1 ILE A 81 4.015 6.391 6.650 1.00 32.21 C ATOM 0 H ILE A 81 6.463 4.218 8.508 1.00 22.32 H new ATOM 0 HA ILE A 81 4.970 4.539 10.844 1.00 21.42 H new ATOM 0 HB ILE A 81 3.334 5.706 9.213 1.00 12.15 H new ATOM 0 HG12 ILE A 81 5.609 5.125 7.285 1.00 25.34 H new ATOM 0 HG13 ILE A 81 4.041 4.342 7.238 1.00 25.34 H new ATOM 0 HG21 ILE A 81 4.883 7.593 8.878 1.00 0.44 H new ATOM 0 HG22 ILE A 81 5.034 6.900 10.510 1.00 0.44 H new ATOM 0 HG23 ILE A 81 6.256 6.530 9.271 1.00 0.44 H new ATOM 0 HD11 ILE A 81 4.167 6.150 5.598 1.00 32.21 H new ATOM 0 HD12 ILE A 81 2.950 6.520 6.843 1.00 32.21 H new ATOM 0 HD13 ILE A 81 4.541 7.315 6.890 1.00 32.21 H new ATOM 886 N GLY A 82 3.860 2.267 8.802 1.00 4.12 N ATOM 887 CA GLY A 82 2.867 1.222 8.639 1.00 65.31 C ATOM 888 C GLY A 82 3.402 -0.149 9.001 1.00 30.22 C ATOM 889 O GLY A 82 2.807 -1.168 8.650 1.00 13.33 O ATOM 0 H GLY A 82 4.656 2.203 8.167 1.00 4.12 H new ATOM 0 HA2 GLY A 82 2.002 1.447 9.263 1.00 65.31 H new ATOM 0 HA3 GLY A 82 2.521 1.212 7.605 1.00 65.31 H new ATOM 893 N ASP A 83 4.528 -0.175 9.705 1.00 4.43 N ATOM 894 CA ASP A 83 5.145 -1.432 10.114 1.00 31.21 C ATOM 895 C ASP A 83 4.243 -2.189 11.084 1.00 2.33 C ATOM 896 O ASP A 83 3.693 -3.238 10.746 1.00 32.43 O ATOM 897 CB ASP A 83 6.506 -1.170 10.763 1.00 42.33 C ATOM 898 CG ASP A 83 7.625 -1.940 10.089 1.00 34.44 C ATOM 899 OD1 ASP A 83 7.475 -3.166 9.905 1.00 12.25 O ATOM 900 OD2 ASP A 83 8.650 -1.316 9.746 1.00 20.35 O ATOM 0 H ASP A 83 5.032 0.660 10.004 1.00 4.43 H new ATOM 0 HA ASP A 83 5.288 -2.045 9.224 1.00 31.21 H new ATOM 0 HB2 ASP A 83 6.726 -0.103 10.721 1.00 42.33 H new ATOM 0 HB3 ASP A 83 6.462 -1.446 11.817 1.00 42.33 H new ATOM 904 N ASP A 84 4.096 -1.651 12.290 1.00 25.21 N ATOM 905 CA ASP A 84 3.261 -2.276 13.309 1.00 23.43 C ATOM 906 C ASP A 84 1.844 -2.495 12.791 1.00 41.23 C ATOM 907 O ASP A 84 1.284 -3.584 12.925 1.00 73.42 O ATOM 908 CB ASP A 84 3.228 -1.413 14.571 1.00 22.35 C ATOM 909 CG ASP A 84 4.599 -0.881 14.945 1.00 64.43 C ATOM 910 OD1 ASP A 84 5.599 -1.577 14.670 1.00 72.00 O ATOM 911 OD2 ASP A 84 4.670 0.228 15.514 1.00 42.44 O ATOM 0 H ASP A 84 4.544 -0.784 12.586 1.00 25.21 H new ATOM 0 HA ASP A 84 3.693 -3.246 13.553 1.00 23.43 H new ATOM 0 HB2 ASP A 84 2.546 -0.576 14.418 1.00 22.35 H new ATOM 0 HB3 ASP A 84 2.831 -2.000 15.399 1.00 22.35 H new ATOM 915 N ILE A 85 1.268 -1.454 12.199 1.00 34.00 N ATOM 916 CA ILE A 85 -0.084 -1.533 11.661 1.00 52.22 C ATOM 917 C ILE A 85 -0.233 -2.725 10.721 1.00 42.15 C ATOM 918 O ILE A 85 -1.175 -3.507 10.839 1.00 62.43 O ATOM 919 CB ILE A 85 -0.465 -0.246 10.904 1.00 22.53 C ATOM 920 CG1 ILE A 85 -0.265 0.977 11.802 1.00 70.04 C ATOM 921 CG2 ILE A 85 -1.904 -0.325 10.418 1.00 13.31 C ATOM 922 CD1 ILE A 85 -1.562 1.606 12.262 1.00 25.21 C ATOM 0 H ILE A 85 1.717 -0.546 12.080 1.00 34.00 H new ATOM 0 HA ILE A 85 -0.755 -1.657 12.511 1.00 52.22 H new ATOM 0 HB ILE A 85 0.186 -0.145 10.035 1.00 22.53 H new ATOM 0 HG12 ILE A 85 0.318 0.685 12.676 1.00 70.04 H new ATOM 0 HG13 ILE A 85 0.320 1.722 11.263 1.00 70.04 H new ATOM 0 HG21 ILE A 85 -2.159 0.591 9.885 1.00 13.31 H new ATOM 0 HG22 ILE A 85 -2.015 -1.178 9.748 1.00 13.31 H new ATOM 0 HG23 ILE A 85 -2.570 -0.445 11.272 1.00 13.31 H new ATOM 0 HD11 ILE A 85 -1.345 2.467 12.894 1.00 25.21 H new ATOM 0 HD12 ILE A 85 -2.138 1.929 11.394 1.00 25.21 H new ATOM 0 HD13 ILE A 85 -2.139 0.876 12.829 1.00 25.21 H new ATOM 933 N ASN A 86 0.705 -2.858 9.789 1.00 30.24 N ATOM 934 CA ASN A 86 0.679 -3.955 8.829 1.00 60.54 C ATOM 935 C ASN A 86 0.692 -5.303 9.544 1.00 11.12 C ATOM 936 O ASN A 86 -0.302 -6.029 9.541 1.00 41.42 O ATOM 937 CB ASN A 86 1.874 -3.858 7.879 1.00 0.55 C ATOM 938 CG ASN A 86 1.564 -3.036 6.643 1.00 54.11 C ATOM 939 OD1 ASN A 86 0.455 -3.352 5.984 1.00 11.14 O flip ATOM 940 ND2 ASN A 86 2.313 -2.127 6.285 1.00 31.35 N flip ATOM 0 H ASN A 86 1.493 -2.219 9.678 1.00 30.24 H new ATOM 0 HA ASN A 86 -0.242 -3.878 8.252 1.00 60.54 H new ATOM 0 HB2 ASN A 86 2.718 -3.413 8.406 1.00 0.55 H new ATOM 0 HB3 ASN A 86 2.178 -4.861 7.578 1.00 0.55 H new ATOM 0 HD21 ASN A 86 3.155 -1.919 6.822 1.00 31.35 H new ATOM 0 HD22 ASN A 86 2.092 -1.582 5.452 1.00 31.35 H new ATOM 946 N ARG A 87 1.825 -5.631 10.157 1.00 12.21 N ATOM 947 CA ARG A 87 1.969 -6.892 10.875 1.00 55.31 C ATOM 948 C ARG A 87 0.802 -7.106 11.835 1.00 72.01 C ATOM 949 O ARG A 87 0.402 -8.240 12.099 1.00 3.50 O ATOM 950 CB ARG A 87 3.289 -6.916 11.647 1.00 11.22 C ATOM 951 CG ARG A 87 3.353 -5.900 12.776 1.00 22.05 C ATOM 952 CD ARG A 87 4.673 -5.984 13.526 1.00 35.41 C ATOM 953 NE ARG A 87 5.660 -5.041 13.006 1.00 3.40 N ATOM 954 CZ ARG A 87 6.850 -4.841 13.562 1.00 55.34 C ATOM 955 NH1 ARG A 87 7.198 -5.513 14.649 1.00 34.45 N ATOM 956 NH2 ARG A 87 7.693 -3.966 13.028 1.00 10.13 N ATOM 0 H ARG A 87 2.657 -5.041 10.171 1.00 12.21 H new ATOM 0 HA ARG A 87 1.969 -7.700 10.144 1.00 55.31 H new ATOM 0 HB2 ARG A 87 3.441 -7.914 12.058 1.00 11.22 H new ATOM 0 HB3 ARG A 87 4.109 -6.728 10.954 1.00 11.22 H new ATOM 0 HG2 ARG A 87 3.226 -4.896 12.371 1.00 22.05 H new ATOM 0 HG3 ARG A 87 2.528 -6.071 13.468 1.00 22.05 H new ATOM 0 HD2 ARG A 87 4.502 -5.783 14.584 1.00 35.41 H new ATOM 0 HD3 ARG A 87 5.067 -6.998 13.454 1.00 35.41 H new ATOM 0 HE ARG A 87 5.423 -4.507 12.170 1.00 3.40 H new ATOM 0 HH11 ARG A 87 6.552 -6.186 15.061 1.00 34.45 H new ATOM 0 HH12 ARG A 87 8.112 -5.358 15.074 1.00 34.45 H new ATOM 0 HH21 ARG A 87 7.427 -3.447 12.191 1.00 10.13 H new ATOM 0 HH22 ARG A 87 8.607 -3.812 13.455 1.00 10.13 H new ATOM 967 N ARG A 88 0.260 -6.009 12.354 1.00 40.32 N ATOM 968 CA ARG A 88 -0.859 -6.076 13.285 1.00 62.13 C ATOM 969 C ARG A 88 -2.064 -6.754 12.639 1.00 51.23 C ATOM 970 O ARG A 88 -2.563 -7.764 13.135 1.00 22.33 O ATOM 971 CB ARG A 88 -1.243 -4.673 13.758 1.00 23.41 C ATOM 972 CG ARG A 88 -0.590 -4.274 15.071 1.00 31.21 C ATOM 973 CD ARG A 88 -0.691 -2.776 15.310 1.00 75.00 C ATOM 974 NE ARG A 88 -1.083 -2.465 16.682 1.00 73.44 N ATOM 975 CZ ARG A 88 -0.270 -2.590 17.726 1.00 11.54 C ATOM 976 NH1 ARG A 88 0.974 -3.016 17.553 1.00 71.43 N ATOM 977 NH2 ARG A 88 -0.700 -2.288 18.944 1.00 13.35 N ATOM 0 H ARG A 88 0.578 -5.063 12.145 1.00 40.32 H new ATOM 0 HA ARG A 88 -0.547 -6.669 14.145 1.00 62.13 H new ATOM 0 HB2 ARG A 88 -0.966 -3.951 12.990 1.00 23.41 H new ATOM 0 HB3 ARG A 88 -2.326 -4.620 13.869 1.00 23.41 H new ATOM 0 HG2 ARG A 88 -1.067 -4.808 15.893 1.00 31.21 H new ATOM 0 HG3 ARG A 88 0.458 -4.573 15.063 1.00 31.21 H new ATOM 0 HD2 ARG A 88 0.270 -2.309 15.093 1.00 75.00 H new ATOM 0 HD3 ARG A 88 -1.417 -2.347 14.620 1.00 75.00 H new ATOM 0 HE ARG A 88 -2.033 -2.134 16.848 1.00 73.44 H new ATOM 0 HH11 ARG A 88 1.308 -3.248 16.618 1.00 71.43 H new ATOM 0 HH12 ARG A 88 1.597 -3.111 18.355 1.00 71.43 H new ATOM 0 HH21 ARG A 88 -1.656 -1.959 19.080 1.00 13.35 H new ATOM 0 HH22 ARG A 88 -0.075 -2.385 19.744 1.00 13.35 H new ATOM 988 N TYR A 89 -2.529 -6.190 11.529 1.00 2.31 N ATOM 989 CA TYR A 89 -3.677 -6.737 10.816 1.00 2.11 C ATOM 990 C TYR A 89 -3.227 -7.620 9.655 1.00 71.44 C ATOM 991 O TYR A 89 -4.004 -7.914 8.748 1.00 44.35 O ATOM 992 CB TYR A 89 -4.567 -5.608 10.297 1.00 12.40 C ATOM 993 CG TYR A 89 -5.114 -4.716 11.389 1.00 61.45 C ATOM 994 CD1 TYR A 89 -6.272 -5.058 12.077 1.00 2.23 C ATOM 995 CD2 TYR A 89 -4.472 -3.534 11.735 1.00 31.12 C ATOM 996 CE1 TYR A 89 -6.775 -4.247 13.075 1.00 72.15 C ATOM 997 CE2 TYR A 89 -4.968 -2.717 12.733 1.00 12.23 C ATOM 998 CZ TYR A 89 -6.119 -3.078 13.400 1.00 54.45 C ATOM 999 OH TYR A 89 -6.617 -2.268 14.394 1.00 31.41 O ATOM 0 H TYR A 89 -2.128 -5.354 11.104 1.00 2.31 H new ATOM 0 HA TYR A 89 -4.248 -7.349 11.514 1.00 2.11 H new ATOM 0 HB2 TYR A 89 -3.996 -5.000 9.595 1.00 12.40 H new ATOM 0 HB3 TYR A 89 -5.399 -6.039 9.741 1.00 12.40 H new ATOM 0 HD1 TYR A 89 -6.787 -5.974 11.827 1.00 2.23 H new ATOM 0 HD2 TYR A 89 -3.569 -3.248 11.215 1.00 31.12 H new ATOM 0 HE1 TYR A 89 -7.677 -4.527 13.598 1.00 72.15 H new ATOM 0 HE2 TYR A 89 -4.457 -1.801 12.989 1.00 12.23 H new ATOM 0 HH TYR A 89 -6.037 -1.485 14.499 1.00 31.41 H new ATOM 1008 N ASP A 90 -1.967 -8.039 9.693 1.00 61.53 N ATOM 1009 CA ASP A 90 -1.413 -8.891 8.647 1.00 34.24 C ATOM 1010 C ASP A 90 -1.782 -10.352 8.882 1.00 73.31 C ATOM 1011 O ASP A 90 -2.211 -11.050 7.963 1.00 22.12 O ATOM 1012 CB ASP A 90 0.108 -8.739 8.589 1.00 31.00 C ATOM 1013 CG ASP A 90 0.757 -9.761 7.678 1.00 1.22 C ATOM 1014 OD1 ASP A 90 0.165 -10.081 6.626 1.00 72.11 O ATOM 1015 OD2 ASP A 90 1.858 -10.242 8.017 1.00 4.42 O ATOM 0 H ASP A 90 -1.310 -7.803 10.437 1.00 61.53 H new ATOM 0 HA ASP A 90 -1.839 -8.577 7.694 1.00 34.24 H new ATOM 0 HB2 ASP A 90 0.357 -7.736 8.241 1.00 31.00 H new ATOM 0 HB3 ASP A 90 0.519 -8.839 9.594 1.00 31.00 H new ATOM 1019 N SER A 91 -1.612 -10.808 10.118 1.00 73.31 N ATOM 1020 CA SER A 91 -1.923 -12.188 10.474 1.00 32.12 C ATOM 1021 C SER A 91 -3.335 -12.559 10.029 1.00 24.34 C ATOM 1022 O SER A 91 -3.561 -13.638 9.483 1.00 24.41 O ATOM 1023 CB SER A 91 -1.781 -12.393 11.984 1.00 4.22 C ATOM 1024 OG SER A 91 -0.708 -13.270 12.280 1.00 33.44 O ATOM 0 H SER A 91 -1.260 -10.242 10.891 1.00 73.31 H new ATOM 0 HA SER A 91 -1.216 -12.838 9.959 1.00 32.12 H new ATOM 0 HB2 SER A 91 -1.614 -11.432 12.471 1.00 4.22 H new ATOM 0 HB3 SER A 91 -2.709 -12.798 12.388 1.00 4.22 H new ATOM 0 HG SER A 91 -0.637 -13.384 13.251 1.00 33.44 H new ATOM 1029 N GLU A 92 -4.279 -11.655 10.267 1.00 53.01 N ATOM 1030 CA GLU A 92 -5.670 -11.888 9.892 1.00 35.35 C ATOM 1031 C GLU A 92 -5.875 -11.659 8.397 1.00 2.11 C ATOM 1032 O GLU A 92 -6.704 -12.316 7.765 1.00 35.41 O ATOM 1033 CB GLU A 92 -6.597 -10.969 10.691 1.00 62.50 C ATOM 1034 CG GLU A 92 -6.464 -11.131 12.196 1.00 33.10 C ATOM 1035 CD GLU A 92 -7.682 -11.780 12.824 1.00 35.10 C ATOM 1036 OE1 GLU A 92 -8.763 -11.155 12.804 1.00 64.44 O ATOM 1037 OE2 GLU A 92 -7.554 -12.912 13.334 1.00 4.03 O ATOM 0 H GLU A 92 -4.108 -10.756 10.717 1.00 53.01 H new ATOM 0 HA GLU A 92 -5.913 -12.926 10.121 1.00 35.35 H new ATOM 0 HB2 GLU A 92 -6.385 -9.933 10.425 1.00 62.50 H new ATOM 0 HB3 GLU A 92 -7.629 -11.168 10.402 1.00 62.50 H new ATOM 0 HG2 GLU A 92 -5.582 -11.733 12.416 1.00 33.10 H new ATOM 0 HG3 GLU A 92 -6.304 -10.153 12.650 1.00 33.10 H new ATOM 1042 N PHE A 93 -5.115 -10.724 7.837 1.00 23.35 N ATOM 1043 CA PHE A 93 -5.214 -10.408 6.417 1.00 33.45 C ATOM 1044 C PHE A 93 -5.111 -11.672 5.570 1.00 50.13 C ATOM 1045 O PHE A 93 -5.969 -11.938 4.728 1.00 64.41 O ATOM 1046 CB PHE A 93 -4.116 -9.420 6.016 1.00 10.34 C ATOM 1047 CG PHE A 93 -4.639 -8.182 5.345 1.00 34.01 C ATOM 1048 CD1 PHE A 93 -5.424 -8.273 4.208 1.00 50.40 C ATOM 1049 CD2 PHE A 93 -4.345 -6.927 5.853 1.00 30.44 C ATOM 1050 CE1 PHE A 93 -5.907 -7.136 3.588 1.00 23.42 C ATOM 1051 CE2 PHE A 93 -4.826 -5.786 5.239 1.00 32.11 C ATOM 1052 CZ PHE A 93 -5.607 -5.890 4.104 1.00 63.10 C ATOM 0 H PHE A 93 -4.424 -10.172 8.345 1.00 23.35 H new ATOM 0 HA PHE A 93 -6.187 -9.951 6.238 1.00 33.45 H new ATOM 0 HB2 PHE A 93 -3.555 -9.132 6.905 1.00 10.34 H new ATOM 0 HB3 PHE A 93 -3.417 -9.919 5.345 1.00 10.34 H new ATOM 0 HD1 PHE A 93 -5.662 -9.244 3.801 1.00 50.40 H new ATOM 0 HD2 PHE A 93 -3.733 -6.839 6.739 1.00 30.44 H new ATOM 0 HE1 PHE A 93 -6.518 -7.221 2.702 1.00 23.42 H new ATOM 0 HE2 PHE A 93 -4.591 -4.814 5.646 1.00 32.11 H new ATOM 0 HZ PHE A 93 -5.982 -5.000 3.621 1.00 63.10 H new ATOM 1061 N GLN A 94 -4.056 -12.446 5.798 1.00 1.23 N ATOM 1062 CA GLN A 94 -3.840 -13.682 5.054 1.00 31.12 C ATOM 1063 C GLN A 94 -4.918 -14.709 5.382 1.00 43.33 C ATOM 1064 O GLN A 94 -5.320 -15.499 4.526 1.00 31.43 O ATOM 1065 CB GLN A 94 -2.458 -14.258 5.370 1.00 70.35 C ATOM 1066 CG GLN A 94 -2.383 -14.953 6.719 1.00 62.24 C ATOM 1067 CD GLN A 94 -0.979 -14.968 7.292 1.00 53.01 C ATOM 1068 OE1 GLN A 94 -0.677 -14.246 8.243 1.00 63.02 O ATOM 1069 NE2 GLN A 94 -0.113 -15.791 6.714 1.00 1.12 N ATOM 0 H GLN A 94 -3.337 -12.240 6.492 1.00 1.23 H new ATOM 0 HA GLN A 94 -3.895 -13.451 3.990 1.00 31.12 H new ATOM 0 HB2 GLN A 94 -2.182 -14.967 4.589 1.00 70.35 H new ATOM 0 HB3 GLN A 94 -1.723 -13.453 5.344 1.00 70.35 H new ATOM 0 HG2 GLN A 94 -3.051 -14.452 7.419 1.00 62.24 H new ATOM 0 HG3 GLN A 94 -2.740 -15.978 6.616 1.00 62.24 H new ATOM 0 HE21 GLN A 94 -0.407 -16.371 5.928 1.00 1.12 H new ATOM 0 HE22 GLN A 94 0.847 -15.843 7.055 1.00 1.12 H new ATOM 1076 N THR A 95 -5.386 -14.694 6.626 1.00 33.32 N ATOM 1077 CA THR A 95 -6.417 -15.624 7.067 1.00 44.21 C ATOM 1078 C THR A 95 -7.651 -15.541 6.175 1.00 31.51 C ATOM 1079 O THR A 95 -8.112 -16.551 5.643 1.00 12.50 O ATOM 1080 CB THR A 95 -6.833 -15.353 8.526 1.00 42.40 C ATOM 1081 OG1 THR A 95 -5.682 -15.387 9.377 1.00 14.30 O ATOM 1082 CG2 THR A 95 -7.850 -16.381 8.999 1.00 13.32 C ATOM 0 H THR A 95 -5.066 -14.047 7.347 1.00 33.32 H new ATOM 0 HA THR A 95 -5.989 -16.624 6.999 1.00 44.21 H new ATOM 0 HB THR A 95 -7.291 -14.365 8.573 1.00 42.40 H new ATOM 0 HG1 THR A 95 -5.094 -14.633 9.163 1.00 14.30 H new ATOM 0 HG21 THR A 95 -8.128 -16.169 10.031 1.00 13.32 H new ATOM 0 HG22 THR A 95 -8.737 -16.333 8.367 1.00 13.32 H new ATOM 0 HG23 THR A 95 -7.414 -17.378 8.938 1.00 13.32 H new ATOM 1090 N MET A 96 -8.180 -14.333 6.017 1.00 71.30 N ATOM 1091 CA MET A 96 -9.360 -14.119 5.187 1.00 41.01 C ATOM 1092 C MET A 96 -9.005 -14.199 3.706 1.00 11.14 C ATOM 1093 O MET A 96 -9.781 -14.711 2.898 1.00 71.32 O ATOM 1094 CB MET A 96 -9.990 -12.759 5.500 1.00 4.13 C ATOM 1095 CG MET A 96 -8.993 -11.613 5.498 1.00 3.43 C ATOM 1096 SD MET A 96 -9.792 -9.997 5.535 1.00 5.44 S ATOM 1097 CE MET A 96 -8.683 -9.047 4.496 1.00 71.14 C ATOM 0 H MET A 96 -7.811 -13.488 6.452 1.00 71.30 H new ATOM 0 HA MET A 96 -10.080 -14.906 5.413 1.00 41.01 H new ATOM 0 HB2 MET A 96 -10.770 -12.552 4.768 1.00 4.13 H new ATOM 0 HB3 MET A 96 -10.473 -12.808 6.476 1.00 4.13 H new ATOM 0 HG2 MET A 96 -8.334 -11.708 6.361 1.00 3.43 H new ATOM 0 HG3 MET A 96 -8.366 -11.684 4.609 1.00 3.43 H new ATOM 0 HE1 MET A 96 -9.228 -8.217 4.045 1.00 71.14 H new ATOM 0 HE2 MET A 96 -7.863 -8.657 5.100 1.00 71.14 H new ATOM 0 HE3 MET A 96 -8.282 -9.688 3.710 1.00 71.14 H new ATOM 1105 N LEU A 97 -7.829 -13.690 3.356 1.00 2.11 N ATOM 1106 CA LEU A 97 -7.371 -13.704 1.970 1.00 35.30 C ATOM 1107 C LEU A 97 -7.398 -15.119 1.403 1.00 5.24 C ATOM 1108 O LEU A 97 -7.748 -15.325 0.241 1.00 54.42 O ATOM 1109 CB LEU A 97 -5.956 -13.130 1.875 1.00 60.44 C ATOM 1110 CG LEU A 97 -5.842 -11.718 1.302 1.00 55.00 C ATOM 1111 CD1 LEU A 97 -6.015 -11.739 -0.209 1.00 70.22 C ATOM 1112 CD2 LEU A 97 -6.870 -10.797 1.944 1.00 31.14 C ATOM 0 H LEU A 97 -7.175 -13.263 4.012 1.00 2.11 H new ATOM 0 HA LEU A 97 -8.048 -13.084 1.382 1.00 35.30 H new ATOM 0 HB2 LEU A 97 -5.517 -13.132 2.873 1.00 60.44 H new ATOM 0 HB3 LEU A 97 -5.354 -13.800 1.260 1.00 60.44 H new ATOM 0 HG LEU A 97 -4.847 -11.335 1.529 1.00 55.00 H new ATOM 0 HD11 LEU A 97 -5.931 -10.725 -0.599 1.00 70.22 H new ATOM 0 HD12 LEU A 97 -5.242 -12.365 -0.655 1.00 70.22 H new ATOM 0 HD13 LEU A 97 -6.997 -12.143 -0.457 1.00 70.22 H new ATOM 0 HD21 LEU A 97 -6.774 -9.796 1.524 1.00 31.14 H new ATOM 0 HD22 LEU A 97 -7.872 -11.178 1.749 1.00 31.14 H new ATOM 0 HD23 LEU A 97 -6.701 -10.757 3.020 1.00 31.14 H new ATOM 1123 N GLN A 98 -7.027 -16.091 2.230 1.00 72.31 N ATOM 1124 CA GLN A 98 -7.011 -17.487 1.811 1.00 42.03 C ATOM 1125 C GLN A 98 -8.417 -17.972 1.476 1.00 52.24 C ATOM 1126 O GLN A 98 -8.595 -18.896 0.682 1.00 23.52 O ATOM 1127 CB GLN A 98 -6.404 -18.364 2.906 1.00 23.55 C ATOM 1128 CG GLN A 98 -5.229 -19.205 2.432 1.00 70.55 C ATOM 1129 CD GLN A 98 -3.948 -18.893 3.180 1.00 53.22 C ATOM 1130 OE1 GLN A 98 -3.971 -18.579 4.370 1.00 33.42 O ATOM 1131 NE2 GLN A 98 -2.820 -18.977 2.483 1.00 73.14 N ATOM 0 H GLN A 98 -6.733 -15.937 3.195 1.00 72.31 H new ATOM 0 HA GLN A 98 -6.397 -17.562 0.913 1.00 42.03 H new ATOM 0 HB2 GLN A 98 -6.076 -17.728 3.729 1.00 23.55 H new ATOM 0 HB3 GLN A 98 -7.176 -19.024 3.301 1.00 23.55 H new ATOM 0 HG2 GLN A 98 -5.470 -20.261 2.556 1.00 70.55 H new ATOM 0 HG3 GLN A 98 -5.073 -19.037 1.366 1.00 70.55 H new ATOM 0 HE21 GLN A 98 -2.848 -19.241 1.498 1.00 73.14 H new ATOM 0 HE22 GLN A 98 -1.927 -18.777 2.933 1.00 73.14 H new ATOM 1138 N HIS A 99 -9.416 -17.341 2.086 1.00 42.11 N ATOM 1139 CA HIS A 99 -10.809 -17.708 1.853 1.00 4.53 C ATOM 1140 C HIS A 99 -11.311 -17.123 0.536 1.00 12.32 C ATOM 1141 O HIS A 99 -12.410 -17.442 0.082 1.00 64.44 O ATOM 1142 CB HIS A 99 -11.686 -17.225 3.008 1.00 43.40 C ATOM 1143 CG HIS A 99 -11.314 -17.818 4.331 1.00 11.50 C ATOM 1144 ND1 HIS A 99 -12.046 -17.610 5.481 1.00 31.43 N ATOM 1145 CD2 HIS A 99 -10.282 -18.619 4.683 1.00 21.55 C ATOM 1146 CE1 HIS A 99 -11.478 -18.256 6.484 1.00 14.13 C ATOM 1147 NE2 HIS A 99 -10.405 -18.876 6.026 1.00 70.35 N ATOM 0 H HIS A 99 -9.287 -16.573 2.745 1.00 42.11 H new ATOM 0 HA HIS A 99 -10.868 -18.795 1.793 1.00 4.53 H new ATOM 0 HB2 HIS A 99 -11.619 -16.139 3.074 1.00 43.40 H new ATOM 0 HB3 HIS A 99 -12.726 -17.468 2.790 1.00 43.40 H new ATOM 0 HD2 HIS A 99 -9.506 -18.988 4.029 1.00 21.55 H new ATOM 0 HE1 HIS A 99 -11.831 -18.274 7.505 1.00 14.13 H new ATOM 0 HE2 HIS A 99 -9.771 -19.452 6.580 1.00 70.35 H new ATOM 1154 N LEU A 100 -10.500 -16.264 -0.071 1.00 53.51 N ATOM 1155 CA LEU A 100 -10.863 -15.632 -1.336 1.00 42.24 C ATOM 1156 C LEU A 100 -10.489 -16.523 -2.516 1.00 72.22 C ATOM 1157 O LEU A 100 -11.360 -17.018 -3.232 1.00 1.23 O ATOM 1158 CB LEU A 100 -10.171 -14.275 -1.468 1.00 32.45 C ATOM 1159 CG LEU A 100 -10.590 -13.420 -2.665 1.00 23.10 C ATOM 1160 CD1 LEU A 100 -11.964 -13.840 -3.164 1.00 72.51 C ATOM 1161 CD2 LEU A 100 -10.583 -11.944 -2.295 1.00 3.24 C ATOM 0 H LEU A 100 -9.587 -15.989 0.291 1.00 53.51 H new ATOM 0 HA LEU A 100 -11.943 -15.484 -1.343 1.00 42.24 H new ATOM 0 HB2 LEU A 100 -10.357 -13.705 -0.558 1.00 32.45 H new ATOM 0 HB3 LEU A 100 -9.095 -14.442 -1.526 1.00 32.45 H new ATOM 0 HG LEU A 100 -9.870 -13.575 -3.469 1.00 23.10 H new ATOM 0 HD11 LEU A 100 -12.246 -13.221 -4.016 1.00 72.51 H new ATOM 0 HD12 LEU A 100 -11.936 -14.886 -3.469 1.00 72.51 H new ATOM 0 HD13 LEU A 100 -12.695 -13.714 -2.366 1.00 72.51 H new ATOM 0 HD21 LEU A 100 -10.884 -11.351 -3.159 1.00 3.24 H new ATOM 0 HD22 LEU A 100 -11.281 -11.771 -1.475 1.00 3.24 H new ATOM 0 HD23 LEU A 100 -9.580 -11.651 -1.985 1.00 3.24 H new ATOM 1172 N GLN A 101 -9.189 -16.724 -2.711 1.00 72.15 N ATOM 1173 CA GLN A 101 -8.702 -17.557 -3.804 1.00 24.14 C ATOM 1174 C GLN A 101 -9.067 -16.951 -5.155 1.00 62.05 C ATOM 1175 O GLN A 101 -9.811 -17.536 -5.944 1.00 40.10 O ATOM 1176 CB GLN A 101 -9.277 -18.970 -3.692 1.00 43.22 C ATOM 1177 CG GLN A 101 -9.338 -19.492 -2.266 1.00 25.14 C ATOM 1178 CD GLN A 101 -9.598 -20.984 -2.201 1.00 52.25 C ATOM 1179 OE1 GLN A 101 -9.214 -21.733 -3.100 1.00 74.25 O ATOM 1180 NE2 GLN A 101 -10.255 -21.424 -1.134 1.00 30.44 N ATOM 0 H GLN A 101 -8.456 -16.322 -2.127 1.00 72.15 H new ATOM 0 HA GLN A 101 -7.616 -17.608 -3.732 1.00 24.14 H new ATOM 0 HB2 GLN A 101 -10.281 -18.979 -4.116 1.00 43.22 H new ATOM 0 HB3 GLN A 101 -8.671 -19.648 -4.293 1.00 43.22 H new ATOM 0 HG2 GLN A 101 -8.398 -19.269 -1.761 1.00 25.14 H new ATOM 0 HG3 GLN A 101 -10.124 -18.966 -1.724 1.00 25.14 H new ATOM 0 HE21 GLN A 101 -10.555 -20.768 -0.413 1.00 30.44 H new ATOM 0 HE22 GLN A 101 -10.460 -22.418 -1.036 1.00 30.44 H new ATOM 1187 N PRO A 102 -8.535 -15.752 -5.430 1.00 13.14 N ATOM 1188 CA PRO A 102 -8.791 -15.041 -6.687 1.00 24.43 C ATOM 1189 C PRO A 102 -8.128 -15.719 -7.881 1.00 73.10 C ATOM 1190 O PRO A 102 -7.544 -16.795 -7.753 1.00 44.11 O ATOM 1191 CB PRO A 102 -8.174 -13.661 -6.444 1.00 43.44 C ATOM 1192 CG PRO A 102 -7.125 -13.890 -5.413 1.00 25.44 C ATOM 1193 CD PRO A 102 -7.640 -14.998 -4.536 1.00 11.30 C ATOM 0 HA PRO A 102 -9.853 -15.012 -6.931 1.00 24.43 H new ATOM 0 HB2 PRO A 102 -7.746 -13.252 -7.359 1.00 43.44 H new ATOM 0 HB3 PRO A 102 -8.922 -12.949 -6.096 1.00 43.44 H new ATOM 0 HG2 PRO A 102 -6.178 -14.167 -5.875 1.00 25.44 H new ATOM 0 HG3 PRO A 102 -6.944 -12.985 -4.833 1.00 25.44 H new ATOM 0 HD2 PRO A 102 -6.830 -15.622 -4.159 1.00 11.30 H new ATOM 0 HD3 PRO A 102 -8.173 -14.609 -3.668 1.00 11.30 H new ATOM 1198 N THR A 103 -8.222 -15.081 -9.044 1.00 21.42 N ATOM 1199 CA THR A 103 -7.633 -15.622 -10.262 1.00 20.34 C ATOM 1200 C THR A 103 -6.969 -14.524 -11.087 1.00 60.10 C ATOM 1201 O THR A 103 -7.108 -13.339 -10.786 1.00 24.51 O ATOM 1202 CB THR A 103 -8.688 -16.333 -11.129 1.00 2.32 C ATOM 1203 OG1 THR A 103 -9.798 -15.458 -11.365 1.00 64.31 O ATOM 1204 CG2 THR A 103 -9.174 -17.607 -10.455 1.00 2.01 C ATOM 0 H THR A 103 -8.701 -14.189 -9.167 1.00 21.42 H new ATOM 0 HA THR A 103 -6.880 -16.347 -9.953 1.00 20.34 H new ATOM 0 HB THR A 103 -8.226 -16.598 -12.080 1.00 2.32 H new ATOM 0 HG1 THR A 103 -10.530 -15.962 -11.779 1.00 64.31 H new ATOM 0 HG21 THR A 103 -9.919 -18.091 -11.087 1.00 2.01 H new ATOM 0 HG22 THR A 103 -8.332 -18.282 -10.303 1.00 2.01 H new ATOM 0 HG23 THR A 103 -9.620 -17.361 -9.491 1.00 2.01 H new ATOM 1212 N ALA A 104 -6.248 -14.927 -12.128 1.00 34.53 N ATOM 1213 CA ALA A 104 -5.566 -13.977 -12.997 1.00 0.51 C ATOM 1214 C ALA A 104 -6.551 -13.279 -13.929 1.00 32.43 C ATOM 1215 O ALA A 104 -6.249 -12.227 -14.490 1.00 52.42 O ATOM 1216 CB ALA A 104 -4.484 -14.681 -13.803 1.00 61.32 C ATOM 0 H ALA A 104 -6.121 -15.905 -12.390 1.00 34.53 H new ATOM 0 HA ALA A 104 -5.100 -13.218 -12.368 1.00 0.51 H new ATOM 0 HB1 ALA A 104 -3.983 -13.959 -14.448 1.00 61.32 H new ATOM 0 HB2 ALA A 104 -3.757 -15.127 -13.124 1.00 61.32 H new ATOM 0 HB3 ALA A 104 -4.936 -15.462 -14.415 1.00 61.32 H new ATOM 1222 N GLU A 105 -7.730 -13.873 -14.088 1.00 21.15 N ATOM 1223 CA GLU A 105 -8.758 -13.308 -14.953 1.00 53.14 C ATOM 1224 C GLU A 105 -9.559 -12.237 -14.218 1.00 70.45 C ATOM 1225 O GLU A 105 -9.893 -11.198 -14.785 1.00 13.01 O ATOM 1226 CB GLU A 105 -9.697 -14.409 -15.454 1.00 14.23 C ATOM 1227 CG GLU A 105 -10.407 -15.156 -14.338 1.00 43.33 C ATOM 1228 CD GLU A 105 -11.256 -16.303 -14.854 1.00 31.21 C ATOM 1229 OE1 GLU A 105 -12.154 -16.050 -15.684 1.00 15.23 O ATOM 1230 OE2 GLU A 105 -11.021 -17.453 -14.427 1.00 53.42 O ATOM 0 H GLU A 105 -7.996 -14.744 -13.629 1.00 21.15 H new ATOM 0 HA GLU A 105 -8.264 -12.846 -15.807 1.00 53.14 H new ATOM 0 HB2 GLU A 105 -10.442 -13.967 -16.115 1.00 14.23 H new ATOM 0 HB3 GLU A 105 -9.125 -15.120 -16.049 1.00 14.23 H new ATOM 0 HG2 GLU A 105 -9.668 -15.543 -13.636 1.00 43.33 H new ATOM 0 HG3 GLU A 105 -11.039 -14.461 -13.785 1.00 43.33 H new ATOM 1235 N ASN A 106 -9.866 -12.500 -12.951 1.00 42.50 N ATOM 1236 CA ASN A 106 -10.628 -11.561 -12.138 1.00 61.12 C ATOM 1237 C ASN A 106 -9.730 -10.872 -11.116 1.00 52.21 C ATOM 1238 O ASN A 106 -10.212 -10.252 -10.168 1.00 24.21 O ATOM 1239 CB ASN A 106 -11.772 -12.285 -11.424 1.00 75.11 C ATOM 1240 CG ASN A 106 -12.858 -12.735 -12.380 1.00 52.22 C ATOM 1241 OD1 ASN A 106 -13.475 -11.919 -13.066 1.00 25.42 O ATOM 1242 ND2 ASN A 106 -13.098 -14.040 -12.431 1.00 71.40 N ATOM 0 H ASN A 106 -9.598 -13.356 -12.466 1.00 42.50 H new ATOM 0 HA ASN A 106 -11.044 -10.801 -12.799 1.00 61.12 H new ATOM 0 HB2 ASN A 106 -11.376 -13.152 -10.895 1.00 75.11 H new ATOM 0 HB3 ASN A 106 -12.204 -11.624 -10.673 1.00 75.11 H new ATOM 0 HD21 ASN A 106 -13.818 -14.402 -13.056 1.00 71.40 H new ATOM 0 HD22 ASN A 106 -12.563 -14.680 -11.845 1.00 71.40 H new ATOM 1248 N ALA A 107 -8.421 -10.984 -11.316 1.00 11.54 N ATOM 1249 CA ALA A 107 -7.454 -10.370 -10.414 1.00 71.25 C ATOM 1250 C ALA A 107 -7.804 -8.910 -10.147 1.00 20.43 C ATOM 1251 O ALA A 107 -7.915 -8.489 -8.996 1.00 33.11 O ATOM 1252 CB ALA A 107 -6.050 -10.483 -10.989 1.00 0.02 C ATOM 0 H ALA A 107 -8.006 -11.495 -12.095 1.00 11.54 H new ATOM 0 HA ALA A 107 -7.489 -10.904 -9.464 1.00 71.25 H new ATOM 0 HB1 ALA A 107 -5.338 -10.020 -10.305 1.00 0.02 H new ATOM 0 HB2 ALA A 107 -5.795 -11.534 -11.122 1.00 0.02 H new ATOM 0 HB3 ALA A 107 -6.010 -9.975 -11.953 1.00 0.02 H new ATOM 1258 N TYR A 108 -7.974 -8.142 -11.217 1.00 40.11 N ATOM 1259 CA TYR A 108 -8.307 -6.728 -11.098 1.00 55.12 C ATOM 1260 C TYR A 108 -9.724 -6.545 -10.564 1.00 72.14 C ATOM 1261 O TYR A 108 -9.989 -5.639 -9.775 1.00 11.23 O ATOM 1262 CB TYR A 108 -8.168 -6.033 -12.454 1.00 62.12 C ATOM 1263 CG TYR A 108 -9.120 -6.561 -13.504 1.00 14.30 C ATOM 1264 CD1 TYR A 108 -8.766 -7.631 -14.317 1.00 52.00 C ATOM 1265 CD2 TYR A 108 -10.373 -5.989 -13.685 1.00 34.31 C ATOM 1266 CE1 TYR A 108 -9.632 -8.115 -15.278 1.00 2.41 C ATOM 1267 CE2 TYR A 108 -11.246 -6.467 -14.642 1.00 53.14 C ATOM 1268 CZ TYR A 108 -10.871 -7.530 -15.437 1.00 3.15 C ATOM 1269 OH TYR A 108 -11.737 -8.010 -16.392 1.00 40.43 O ATOM 0 H TYR A 108 -7.887 -8.475 -12.177 1.00 40.11 H new ATOM 0 HA TYR A 108 -7.610 -6.276 -10.392 1.00 55.12 H new ATOM 0 HB2 TYR A 108 -8.339 -4.964 -12.325 1.00 62.12 H new ATOM 0 HB3 TYR A 108 -7.145 -6.151 -12.811 1.00 62.12 H new ATOM 0 HD1 TYR A 108 -7.797 -8.092 -14.195 1.00 52.00 H new ATOM 0 HD2 TYR A 108 -10.670 -5.155 -13.066 1.00 34.31 H new ATOM 0 HE1 TYR A 108 -9.341 -8.947 -15.902 1.00 2.41 H new ATOM 0 HE2 TYR A 108 -12.217 -6.011 -14.767 1.00 53.14 H new ATOM 0 HH TYR A 108 -12.566 -7.488 -16.373 1.00 40.43 H new ATOM 1278 N GLU A 109 -10.631 -7.414 -11.000 1.00 40.41 N ATOM 1279 CA GLU A 109 -12.021 -7.348 -10.566 1.00 63.51 C ATOM 1280 C GLU A 109 -12.121 -7.435 -9.045 1.00 41.21 C ATOM 1281 O GLU A 109 -13.007 -6.836 -8.435 1.00 43.41 O ATOM 1282 CB GLU A 109 -12.833 -8.477 -11.205 1.00 1.25 C ATOM 1283 CG GLU A 109 -14.270 -8.547 -10.718 1.00 34.45 C ATOM 1284 CD GLU A 109 -15.071 -9.629 -11.415 1.00 74.42 C ATOM 1285 OE1 GLU A 109 -15.210 -9.560 -12.653 1.00 71.21 O ATOM 1286 OE2 GLU A 109 -15.559 -10.545 -10.720 1.00 20.43 O ATOM 0 H GLU A 109 -10.428 -8.171 -11.653 1.00 40.41 H new ATOM 0 HA GLU A 109 -12.429 -6.389 -10.887 1.00 63.51 H new ATOM 0 HB2 GLU A 109 -12.831 -8.346 -12.287 1.00 1.25 H new ATOM 0 HB3 GLU A 109 -12.342 -9.428 -10.998 1.00 1.25 H new ATOM 0 HG2 GLU A 109 -14.277 -8.731 -9.644 1.00 34.45 H new ATOM 0 HG3 GLU A 109 -14.752 -7.583 -10.880 1.00 34.45 H new ATOM 1291 N TYR A 110 -11.206 -8.184 -8.440 1.00 55.01 N ATOM 1292 CA TYR A 110 -11.192 -8.352 -6.992 1.00 34.43 C ATOM 1293 C TYR A 110 -10.407 -7.229 -6.321 1.00 54.23 C ATOM 1294 O TYR A 110 -10.904 -6.568 -5.408 1.00 3.54 O ATOM 1295 CB TYR A 110 -10.585 -9.705 -6.620 1.00 64.03 C ATOM 1296 CG TYR A 110 -11.429 -10.886 -7.046 1.00 53.34 C ATOM 1297 CD1 TYR A 110 -12.745 -11.014 -6.620 1.00 62.41 C ATOM 1298 CD2 TYR A 110 -10.911 -11.871 -7.877 1.00 4.33 C ATOM 1299 CE1 TYR A 110 -13.519 -12.091 -7.007 1.00 55.13 C ATOM 1300 CE2 TYR A 110 -11.678 -12.951 -8.271 1.00 74.13 C ATOM 1301 CZ TYR A 110 -12.982 -13.056 -7.832 1.00 3.13 C ATOM 1302 OH TYR A 110 -13.751 -14.129 -8.221 1.00 13.41 O ATOM 0 H TYR A 110 -10.464 -8.684 -8.930 1.00 55.01 H new ATOM 0 HA TYR A 110 -12.222 -8.314 -6.638 1.00 34.43 H new ATOM 0 HB2 TYR A 110 -9.599 -9.790 -7.078 1.00 64.03 H new ATOM 0 HB3 TYR A 110 -10.439 -9.744 -5.540 1.00 64.03 H new ATOM 0 HD1 TYR A 110 -13.170 -10.259 -5.975 1.00 62.41 H new ATOM 0 HD2 TYR A 110 -9.890 -11.791 -8.221 1.00 4.33 H new ATOM 0 HE1 TYR A 110 -14.540 -12.176 -6.665 1.00 55.13 H new ATOM 0 HE2 TYR A 110 -11.260 -13.708 -8.918 1.00 74.13 H new ATOM 0 HH TYR A 110 -13.223 -14.716 -8.802 1.00 13.41 H new ATOM 1311 N PHE A 111 -9.178 -7.018 -6.781 1.00 71.13 N ATOM 1312 CA PHE A 111 -8.324 -5.976 -6.226 1.00 34.14 C ATOM 1313 C PHE A 111 -9.044 -4.630 -6.212 1.00 1.50 C ATOM 1314 O PHE A 111 -9.145 -3.977 -5.174 1.00 53.11 O ATOM 1315 CB PHE A 111 -7.029 -5.864 -7.034 1.00 4.12 C ATOM 1316 CG PHE A 111 -6.212 -4.650 -6.696 1.00 60.34 C ATOM 1317 CD1 PHE A 111 -5.783 -4.428 -5.397 1.00 74.30 C ATOM 1318 CD2 PHE A 111 -5.873 -3.731 -7.676 1.00 61.45 C ATOM 1319 CE1 PHE A 111 -5.033 -3.310 -5.083 1.00 60.13 C ATOM 1320 CE2 PHE A 111 -5.123 -2.613 -7.368 1.00 12.03 C ATOM 1321 CZ PHE A 111 -4.702 -2.402 -6.069 1.00 22.03 C ATOM 0 H PHE A 111 -8.752 -7.555 -7.536 1.00 71.13 H new ATOM 0 HA PHE A 111 -8.082 -6.250 -5.199 1.00 34.14 H new ATOM 0 HB2 PHE A 111 -6.426 -6.756 -6.864 1.00 4.12 H new ATOM 0 HB3 PHE A 111 -7.274 -5.843 -8.096 1.00 4.12 H new ATOM 0 HD1 PHE A 111 -6.037 -5.136 -4.622 1.00 74.30 H new ATOM 0 HD2 PHE A 111 -6.199 -3.891 -8.693 1.00 61.45 H new ATOM 0 HE1 PHE A 111 -4.706 -3.147 -4.067 1.00 60.13 H new ATOM 0 HE2 PHE A 111 -4.866 -1.905 -8.142 1.00 12.03 H new ATOM 0 HZ PHE A 111 -4.115 -1.529 -5.825 1.00 22.03 H new ATOM 1330 N THR A 112 -9.544 -4.222 -7.375 1.00 1.12 N ATOM 1331 CA THR A 112 -10.254 -2.955 -7.499 1.00 32.25 C ATOM 1332 C THR A 112 -11.335 -2.824 -6.433 1.00 60.21 C ATOM 1333 O THR A 112 -11.598 -1.731 -5.931 1.00 54.14 O ATOM 1334 CB THR A 112 -10.900 -2.807 -8.890 1.00 32.42 C ATOM 1335 OG1 THR A 112 -11.793 -3.898 -9.134 1.00 23.20 O ATOM 1336 CG2 THR A 112 -9.837 -2.761 -9.977 1.00 1.13 C ATOM 0 H THR A 112 -9.470 -4.751 -8.244 1.00 1.12 H new ATOM 0 HA THR A 112 -9.516 -2.164 -7.363 1.00 32.25 H new ATOM 0 HB THR A 112 -11.458 -1.871 -8.910 1.00 32.42 H new ATOM 0 HG1 THR A 112 -11.288 -4.664 -9.479 1.00 23.20 H new ATOM 0 HG21 THR A 112 -10.316 -2.656 -10.950 1.00 1.13 H new ATOM 0 HG22 THR A 112 -9.177 -1.911 -9.804 1.00 1.13 H new ATOM 0 HG23 THR A 112 -9.255 -3.683 -9.956 1.00 1.13 H new ATOM 1344 N LYS A 113 -11.960 -3.946 -6.088 1.00 3.43 N ATOM 1345 CA LYS A 113 -13.012 -3.958 -5.079 1.00 3.32 C ATOM 1346 C LYS A 113 -12.439 -3.686 -3.692 1.00 23.21 C ATOM 1347 O LYS A 113 -12.940 -2.833 -2.959 1.00 42.15 O ATOM 1348 CB LYS A 113 -13.739 -5.304 -5.088 1.00 10.01 C ATOM 1349 CG LYS A 113 -14.872 -5.389 -4.080 1.00 51.35 C ATOM 1350 CD LYS A 113 -14.369 -5.805 -2.708 1.00 73.12 C ATOM 1351 CE LYS A 113 -14.846 -7.202 -2.340 1.00 33.43 C ATOM 1352 NZ LYS A 113 -14.399 -8.220 -3.330 1.00 13.04 N ATOM 0 H LYS A 113 -11.755 -4.859 -6.493 1.00 3.43 H new ATOM 0 HA LYS A 113 -13.722 -3.167 -5.320 1.00 3.32 H new ATOM 0 HB2 LYS A 113 -14.137 -5.486 -6.086 1.00 10.01 H new ATOM 0 HB3 LYS A 113 -13.020 -6.097 -4.882 1.00 10.01 H new ATOM 0 HG2 LYS A 113 -15.369 -4.422 -4.008 1.00 51.35 H new ATOM 0 HG3 LYS A 113 -15.617 -6.105 -4.428 1.00 51.35 H new ATOM 0 HD2 LYS A 113 -13.279 -5.776 -2.694 1.00 73.12 H new ATOM 0 HD3 LYS A 113 -14.716 -5.092 -1.960 1.00 73.12 H new ATOM 0 HE2 LYS A 113 -14.468 -7.466 -1.352 1.00 33.43 H new ATOM 0 HE3 LYS A 113 -15.934 -7.209 -2.278 1.00 33.43 H new ATOM 0 HZ1 LYS A 113 -14.485 -9.170 -2.914 1.00 13.04 H new ATOM 0 HZ2 LYS A 113 -14.993 -8.160 -4.182 1.00 13.04 H new ATOM 0 HZ3 LYS A 113 -13.407 -8.043 -3.586 1.00 13.04 H new ATOM 1362 N ILE A 114 -11.386 -4.416 -3.339 1.00 32.12 N ATOM 1363 CA ILE A 114 -10.744 -4.251 -2.041 1.00 25.34 C ATOM 1364 C ILE A 114 -10.348 -2.798 -1.804 1.00 73.31 C ATOM 1365 O ILE A 114 -10.711 -2.202 -0.790 1.00 21.45 O ATOM 1366 CB ILE A 114 -9.491 -5.139 -1.915 1.00 40.32 C ATOM 1367 CG1 ILE A 114 -9.726 -6.488 -2.598 1.00 30.44 C ATOM 1368 CG2 ILE A 114 -9.126 -5.335 -0.451 1.00 45.34 C ATOM 1369 CD1 ILE A 114 -11.086 -7.083 -2.309 1.00 65.04 C ATOM 0 H ILE A 114 -10.960 -5.127 -3.933 1.00 32.12 H new ATOM 0 HA ILE A 114 -11.472 -4.554 -1.289 1.00 25.34 H new ATOM 0 HB ILE A 114 -8.658 -4.642 -2.412 1.00 40.32 H new ATOM 0 HG12 ILE A 114 -9.614 -6.365 -3.675 1.00 30.44 H new ATOM 0 HG13 ILE A 114 -8.956 -7.189 -2.275 1.00 30.44 H new ATOM 0 HG21 ILE A 114 -8.239 -5.964 -0.378 1.00 45.34 H new ATOM 0 HG22 ILE A 114 -8.922 -4.367 0.006 1.00 45.34 H new ATOM 0 HG23 ILE A 114 -9.955 -5.815 0.070 1.00 45.34 H new ATOM 0 HD11 ILE A 114 -11.182 -8.038 -2.825 1.00 65.04 H new ATOM 0 HD12 ILE A 114 -11.195 -7.238 -1.236 1.00 65.04 H new ATOM 0 HD13 ILE A 114 -11.863 -6.402 -2.657 1.00 65.04 H new ATOM 1380 N ALA A 115 -9.603 -2.231 -2.747 1.00 4.12 N ATOM 1381 CA ALA A 115 -9.161 -0.846 -2.644 1.00 63.22 C ATOM 1382 C ALA A 115 -10.350 0.105 -2.557 1.00 44.35 C ATOM 1383 O ALA A 115 -10.461 0.896 -1.621 1.00 33.05 O ATOM 1384 CB ALA A 115 -8.278 -0.484 -3.828 1.00 15.10 C ATOM 0 H ALA A 115 -9.293 -2.710 -3.592 1.00 4.12 H new ATOM 0 HA ALA A 115 -8.580 -0.743 -1.728 1.00 63.22 H new ATOM 0 HB1 ALA A 115 -7.955 0.553 -3.738 1.00 15.10 H new ATOM 0 HB2 ALA A 115 -7.404 -1.136 -3.843 1.00 15.10 H new ATOM 0 HB3 ALA A 115 -8.840 -0.610 -4.753 1.00 15.10 H new ATOM 1390 N THR A 116 -11.240 0.022 -3.542 1.00 74.01 N ATOM 1391 CA THR A 116 -12.421 0.876 -3.578 1.00 2.13 C ATOM 1392 C THR A 116 -13.166 0.840 -2.250 1.00 74.24 C ATOM 1393 O THR A 116 -13.701 1.854 -1.800 1.00 72.12 O ATOM 1394 CB THR A 116 -13.384 0.456 -4.706 1.00 32.13 C ATOM 1395 OG1 THR A 116 -12.740 0.598 -5.977 1.00 70.12 O ATOM 1396 CG2 THR A 116 -14.650 1.297 -4.676 1.00 40.33 C ATOM 0 H THR A 116 -11.165 -0.628 -4.325 1.00 74.01 H new ATOM 0 HA THR A 116 -12.071 1.891 -3.768 1.00 2.13 H new ATOM 0 HB THR A 116 -13.657 -0.588 -4.552 1.00 32.13 H new ATOM 0 HG1 THR A 116 -12.235 1.438 -5.996 1.00 70.12 H new ATOM 0 HG21 THR A 116 -15.315 0.983 -5.481 1.00 40.33 H new ATOM 0 HG22 THR A 116 -15.152 1.164 -3.718 1.00 40.33 H new ATOM 0 HG23 THR A 116 -14.392 2.348 -4.808 1.00 40.33 H new ATOM 1404 N SER A 117 -13.198 -0.333 -1.625 1.00 52.10 N ATOM 1405 CA SER A 117 -13.881 -0.500 -0.348 1.00 61.01 C ATOM 1406 C SER A 117 -13.082 0.139 0.784 1.00 44.04 C ATOM 1407 O SER A 117 -13.651 0.657 1.747 1.00 3.30 O ATOM 1408 CB SER A 117 -14.103 -1.985 -0.056 1.00 64.43 C ATOM 1409 OG SER A 117 -15.367 -2.204 0.545 1.00 52.43 O ATOM 0 H SER A 117 -12.759 -1.181 -1.983 1.00 52.10 H new ATOM 0 HA SER A 117 -14.848 -0.001 -0.413 1.00 61.01 H new ATOM 0 HB2 SER A 117 -14.034 -2.555 -0.982 1.00 64.43 H new ATOM 0 HB3 SER A 117 -13.315 -2.351 0.603 1.00 64.43 H new ATOM 0 HG SER A 117 -15.362 -1.845 1.457 1.00 52.43 H new ATOM 1414 N LEU A 118 -11.760 0.099 0.663 1.00 4.52 N ATOM 1415 CA LEU A 118 -10.880 0.674 1.674 1.00 72.44 C ATOM 1416 C LEU A 118 -10.871 2.196 1.586 1.00 30.10 C ATOM 1417 O LEU A 118 -11.170 2.887 2.560 1.00 74.21 O ATOM 1418 CB LEU A 118 -9.459 0.133 1.509 1.00 34.01 C ATOM 1419 CG LEU A 118 -8.420 0.664 2.497 1.00 11.10 C ATOM 1420 CD1 LEU A 118 -8.778 0.257 3.918 1.00 72.40 C ATOM 1421 CD2 LEU A 118 -7.031 0.164 2.131 1.00 5.32 C ATOM 0 H LEU A 118 -11.273 -0.326 -0.126 1.00 4.52 H new ATOM 0 HA LEU A 118 -11.259 0.388 2.655 1.00 72.44 H new ATOM 0 HB2 LEU A 118 -9.493 -0.953 1.597 1.00 34.01 H new ATOM 0 HB3 LEU A 118 -9.120 0.361 0.498 1.00 34.01 H new ATOM 0 HG LEU A 118 -8.418 1.753 2.442 1.00 11.10 H new ATOM 0 HD11 LEU A 118 -8.027 0.644 4.607 1.00 72.40 H new ATOM 0 HD12 LEU A 118 -9.754 0.665 4.178 1.00 72.40 H new ATOM 0 HD13 LEU A 118 -8.809 -0.830 3.988 1.00 72.40 H new ATOM 0 HD21 LEU A 118 -6.305 0.552 2.845 1.00 5.32 H new ATOM 0 HD22 LEU A 118 -7.018 -0.926 2.156 1.00 5.32 H new ATOM 0 HD23 LEU A 118 -6.773 0.507 1.129 1.00 5.32 H new ATOM 1432 N PHE A 119 -10.529 2.714 0.411 1.00 3.11 N ATOM 1433 CA PHE A 119 -10.482 4.155 0.194 1.00 34.44 C ATOM 1434 C PHE A 119 -11.890 4.737 0.103 1.00 2.45 C ATOM 1435 O PHE A 119 -12.064 5.952 0.016 1.00 75.31 O ATOM 1436 CB PHE A 119 -9.700 4.476 -1.080 1.00 40.43 C ATOM 1437 CG PHE A 119 -8.248 4.102 -1.004 1.00 33.04 C ATOM 1438 CD1 PHE A 119 -7.844 2.793 -1.210 1.00 1.04 C ATOM 1439 CD2 PHE A 119 -7.286 5.060 -0.724 1.00 15.42 C ATOM 1440 CE1 PHE A 119 -6.507 2.447 -1.141 1.00 64.43 C ATOM 1441 CE2 PHE A 119 -5.949 4.719 -0.654 1.00 41.21 C ATOM 1442 CZ PHE A 119 -5.559 3.410 -0.861 1.00 54.01 C ATOM 0 H PHE A 119 -10.280 2.157 -0.406 1.00 3.11 H new ATOM 0 HA PHE A 119 -9.975 4.609 1.045 1.00 34.44 H new ATOM 0 HB2 PHE A 119 -10.158 3.952 -1.919 1.00 40.43 H new ATOM 0 HB3 PHE A 119 -9.781 5.543 -1.287 1.00 40.43 H new ATOM 0 HD1 PHE A 119 -8.581 2.034 -1.427 1.00 1.04 H new ATOM 0 HD2 PHE A 119 -7.585 6.085 -0.559 1.00 15.42 H new ATOM 0 HE1 PHE A 119 -6.205 1.423 -1.306 1.00 64.43 H new ATOM 0 HE2 PHE A 119 -5.209 5.475 -0.438 1.00 41.21 H new ATOM 0 HZ PHE A 119 -4.515 3.141 -0.804 1.00 54.01 H new ATOM 1451 N GLU A 120 -12.888 3.860 0.120 1.00 55.31 N ATOM 1452 CA GLU A 120 -14.280 4.288 0.037 1.00 65.22 C ATOM 1453 C GLU A 120 -14.571 5.392 1.048 1.00 74.25 C ATOM 1454 O GLU A 120 -15.302 6.338 0.756 1.00 55.34 O ATOM 1455 CB GLU A 120 -15.216 3.101 0.277 1.00 21.14 C ATOM 1456 CG GLU A 120 -16.228 2.889 -0.835 1.00 51.43 C ATOM 1457 CD GLU A 120 -17.341 3.919 -0.815 1.00 50.21 C ATOM 1458 OE1 GLU A 120 -17.679 4.406 0.284 1.00 21.32 O ATOM 1459 OE2 GLU A 120 -17.874 4.237 -1.898 1.00 54.15 O ATOM 0 H GLU A 120 -12.760 2.851 0.190 1.00 55.31 H new ATOM 0 HA GLU A 120 -14.454 4.682 -0.964 1.00 65.22 H new ATOM 0 HB2 GLU A 120 -14.619 2.196 0.391 1.00 21.14 H new ATOM 0 HB3 GLU A 120 -15.748 3.253 1.216 1.00 21.14 H new ATOM 0 HG2 GLU A 120 -15.718 2.929 -1.798 1.00 51.43 H new ATOM 0 HG3 GLU A 120 -16.659 1.892 -0.744 1.00 51.43 H new ATOM 1464 N SER A 121 -13.995 5.264 2.238 1.00 72.50 N ATOM 1465 CA SER A 121 -14.196 6.248 3.296 1.00 0.23 C ATOM 1466 C SER A 121 -13.471 7.551 2.970 1.00 22.50 C ATOM 1467 O SER A 121 -13.937 8.636 3.314 1.00 51.51 O ATOM 1468 CB SER A 121 -13.702 5.698 4.635 1.00 64.33 C ATOM 1469 OG SER A 121 -14.777 5.189 5.405 1.00 72.32 O ATOM 0 H SER A 121 -13.385 4.488 2.495 1.00 72.50 H new ATOM 0 HA SER A 121 -15.264 6.454 3.368 1.00 0.23 H new ATOM 0 HB2 SER A 121 -12.970 4.909 4.460 1.00 64.33 H new ATOM 0 HB3 SER A 121 -13.194 6.486 5.190 1.00 64.33 H new ATOM 0 HG SER A 121 -14.435 4.842 6.255 1.00 72.32 H new ATOM 1474 N GLY A 122 -12.327 7.433 2.304 1.00 4.23 N ATOM 1475 CA GLY A 122 -11.555 8.607 1.942 1.00 72.33 C ATOM 1476 C GLY A 122 -10.142 8.263 1.512 1.00 74.51 C ATOM 1477 O GLY A 122 -9.830 7.100 1.258 1.00 33.11 O ATOM 0 H GLY A 122 -11.921 6.545 2.009 1.00 4.23 H new ATOM 0 HA2 GLY A 122 -12.060 9.134 1.132 1.00 72.33 H new ATOM 0 HA3 GLY A 122 -11.517 9.289 2.791 1.00 72.33 H new ATOM 1481 N ILE A 123 -9.287 9.277 1.431 1.00 22.32 N ATOM 1482 CA ILE A 123 -7.901 9.075 1.030 1.00 13.41 C ATOM 1483 C ILE A 123 -6.941 9.737 2.013 1.00 63.35 C ATOM 1484 O ILE A 123 -7.103 10.905 2.363 1.00 74.35 O ATOM 1485 CB ILE A 123 -7.637 9.634 -0.381 1.00 1.33 C ATOM 1486 CG1 ILE A 123 -8.833 9.359 -1.295 1.00 73.43 C ATOM 1487 CG2 ILE A 123 -6.369 9.025 -0.963 1.00 63.14 C ATOM 1488 CD1 ILE A 123 -8.630 9.832 -2.717 1.00 23.22 C ATOM 0 H ILE A 123 -9.530 10.246 1.638 1.00 22.32 H new ATOM 0 HA ILE A 123 -7.728 7.999 1.026 1.00 13.41 H new ATOM 0 HB ILE A 123 -7.500 10.713 -0.308 1.00 1.33 H new ATOM 0 HG12 ILE A 123 -9.035 8.288 -1.303 1.00 73.43 H new ATOM 0 HG13 ILE A 123 -9.716 9.847 -0.881 1.00 73.43 H new ATOM 0 HG21 ILE A 123 -6.196 9.430 -1.960 1.00 63.14 H new ATOM 0 HG22 ILE A 123 -5.522 9.266 -0.321 1.00 63.14 H new ATOM 0 HG23 ILE A 123 -6.481 7.942 -1.025 1.00 63.14 H new ATOM 0 HD11 ILE A 123 -9.518 9.604 -3.307 1.00 23.22 H new ATOM 0 HD12 ILE A 123 -8.458 10.908 -2.721 1.00 23.22 H new ATOM 0 HD13 ILE A 123 -7.767 9.325 -3.149 1.00 23.22 H new ATOM 1499 N ASN A 124 -5.941 8.981 2.454 1.00 62.11 N ATOM 1500 CA ASN A 124 -4.954 9.494 3.397 1.00 12.12 C ATOM 1501 C ASN A 124 -3.633 8.742 3.265 1.00 32.33 C ATOM 1502 O ASN A 124 -3.595 7.618 2.765 1.00 11.22 O ATOM 1503 CB ASN A 124 -5.478 9.380 4.830 1.00 0.01 C ATOM 1504 CG ASN A 124 -6.858 9.988 4.991 1.00 45.04 C ATOM 1505 OD1 ASN A 124 -7.021 11.207 4.946 1.00 64.52 O ATOM 1506 ND2 ASN A 124 -7.861 9.137 5.179 1.00 3.55 N ATOM 0 H ASN A 124 -5.793 8.012 2.174 1.00 62.11 H new ATOM 0 HA ASN A 124 -4.779 10.544 3.165 1.00 12.12 H new ATOM 0 HB2 ASN A 124 -5.511 8.330 5.120 1.00 0.01 H new ATOM 0 HB3 ASN A 124 -4.784 9.876 5.508 1.00 0.01 H new ATOM 0 HD21 ASN A 124 -8.812 9.487 5.293 1.00 3.55 H new ATOM 0 HD22 ASN A 124 -7.680 8.134 5.209 1.00 3.55 H new ATOM 1512 N TRP A 125 -2.554 9.369 3.718 1.00 12.41 N ATOM 1513 CA TRP A 125 -1.230 8.759 3.652 1.00 53.02 C ATOM 1514 C TRP A 125 -1.258 7.338 4.205 1.00 51.51 C ATOM 1515 O TRP A 125 -0.609 6.441 3.668 1.00 2.10 O ATOM 1516 CB TRP A 125 -0.218 9.602 4.428 1.00 32.34 C ATOM 1517 CG TRP A 125 0.415 10.680 3.602 1.00 24.05 C ATOM 1518 CD1 TRP A 125 0.406 12.021 3.858 1.00 31.14 C ATOM 1519 CD2 TRP A 125 1.151 10.506 2.385 1.00 53.33 C ATOM 1520 NE1 TRP A 125 1.090 12.693 2.873 1.00 3.04 N ATOM 1521 CE2 TRP A 125 1.557 11.786 1.959 1.00 11.55 C ATOM 1522 CE3 TRP A 125 1.505 9.396 1.615 1.00 24.33 C ATOM 1523 CZ2 TRP A 125 2.300 11.982 0.798 1.00 41.41 C ATOM 1524 CZ3 TRP A 125 2.242 9.592 0.462 1.00 70.32 C ATOM 1525 CH2 TRP A 125 2.633 10.877 0.063 1.00 22.23 C ATOM 0 H TRP A 125 -2.569 10.300 4.135 1.00 12.41 H new ATOM 0 HA TRP A 125 -0.929 8.716 2.605 1.00 53.02 H new ATOM 0 HB2 TRP A 125 -0.715 10.056 5.285 1.00 32.34 H new ATOM 0 HB3 TRP A 125 0.562 8.950 4.821 1.00 32.34 H new ATOM 0 HD1 TRP A 125 -0.069 12.486 4.709 1.00 31.14 H new ATOM 0 HE1 TRP A 125 1.227 13.703 2.830 1.00 3.04 H new ATOM 0 HE3 TRP A 125 1.208 8.402 1.915 1.00 24.33 H new ATOM 0 HZ2 TRP A 125 2.603 12.971 0.488 1.00 41.41 H new ATOM 0 HZ3 TRP A 125 2.521 8.741 -0.141 1.00 70.32 H new ATOM 0 HH2 TRP A 125 3.209 10.998 -0.843 1.00 22.23 H new ATOM 1535 N GLY A 126 -2.015 7.140 5.280 1.00 15.20 N ATOM 1536 CA GLY A 126 -2.112 5.825 5.886 1.00 74.43 C ATOM 1537 C GLY A 126 -2.807 4.823 4.986 1.00 23.54 C ATOM 1538 O GLY A 126 -2.447 3.645 4.966 1.00 32.30 O ATOM 0 H GLY A 126 -2.562 7.866 5.742 1.00 15.20 H new ATOM 0 HA2 GLY A 126 -1.112 5.463 6.124 1.00 74.43 H new ATOM 0 HA3 GLY A 126 -2.655 5.901 6.828 1.00 74.43 H new ATOM 1542 N ARG A 127 -3.805 5.287 4.243 1.00 34.12 N ATOM 1543 CA ARG A 127 -4.552 4.422 3.340 1.00 63.13 C ATOM 1544 C ARG A 127 -3.676 3.959 2.180 1.00 12.44 C ATOM 1545 O ARG A 127 -3.728 2.799 1.772 1.00 65.34 O ATOM 1546 CB ARG A 127 -5.784 5.152 2.802 1.00 71.22 C ATOM 1547 CG ARG A 127 -6.654 5.761 3.890 1.00 31.10 C ATOM 1548 CD ARG A 127 -7.925 6.364 3.314 1.00 74.14 C ATOM 1549 NE ARG A 127 -9.002 6.416 4.299 1.00 61.00 N ATOM 1550 CZ ARG A 127 -9.655 5.342 4.731 1.00 23.24 C ATOM 1551 NH1 ARG A 127 -9.341 4.140 4.267 1.00 71.20 N ATOM 1552 NH2 ARG A 127 -10.623 5.470 5.630 1.00 31.04 N ATOM 0 H ARG A 127 -4.115 6.259 4.249 1.00 34.12 H new ATOM 0 HA ARG A 127 -4.874 3.545 3.902 1.00 63.13 H new ATOM 0 HB2 ARG A 127 -5.461 5.941 2.123 1.00 71.22 H new ATOM 0 HB3 ARG A 127 -6.383 4.454 2.217 1.00 71.22 H new ATOM 0 HG2 ARG A 127 -6.912 4.996 4.622 1.00 31.10 H new ATOM 0 HG3 ARG A 127 -6.092 6.531 4.419 1.00 31.10 H new ATOM 0 HD2 ARG A 127 -7.717 7.371 2.952 1.00 74.14 H new ATOM 0 HD3 ARG A 127 -8.248 5.776 2.455 1.00 74.14 H new ATOM 0 HE ARG A 127 -9.267 7.326 4.676 1.00 61.00 H new ATOM 0 HH11 ARG A 127 -8.597 4.038 3.577 1.00 71.20 H new ATOM 0 HH12 ARG A 127 -9.844 3.317 4.600 1.00 71.20 H new ATOM 0 HH21 ARG A 127 -10.866 6.393 5.990 1.00 31.04 H new ATOM 0 HH22 ARG A 127 -11.124 4.645 5.961 1.00 31.04 H new ATOM 1563 N VAL A 128 -2.870 4.876 1.652 1.00 43.03 N ATOM 1564 CA VAL A 128 -1.982 4.562 0.539 1.00 2.52 C ATOM 1565 C VAL A 128 -1.003 3.454 0.913 1.00 3.32 C ATOM 1566 O VAL A 128 -0.901 2.441 0.220 1.00 51.52 O ATOM 1567 CB VAL A 128 -1.188 5.802 0.088 1.00 21.24 C ATOM 1568 CG1 VAL A 128 -0.167 5.426 -0.975 1.00 24.12 C ATOM 1569 CG2 VAL A 128 -2.131 6.881 -0.424 1.00 31.35 C ATOM 0 H VAL A 128 -2.814 5.841 1.977 1.00 43.03 H new ATOM 0 HA VAL A 128 -2.612 4.224 -0.284 1.00 2.52 H new ATOM 0 HB VAL A 128 -0.650 6.200 0.948 1.00 21.24 H new ATOM 0 HG11 VAL A 128 0.384 6.315 -1.281 1.00 24.12 H new ATOM 0 HG12 VAL A 128 0.527 4.691 -0.569 1.00 24.12 H new ATOM 0 HG13 VAL A 128 -0.680 5.002 -1.838 1.00 24.12 H new ATOM 0 HG21 VAL A 128 -1.553 7.750 -0.738 1.00 31.35 H new ATOM 0 HG22 VAL A 128 -2.698 6.496 -1.272 1.00 31.35 H new ATOM 0 HG23 VAL A 128 -2.818 7.171 0.371 1.00 31.35 H new ATOM 1579 N VAL A 129 -0.284 3.653 2.012 1.00 32.23 N ATOM 1580 CA VAL A 129 0.686 2.670 2.480 1.00 60.31 C ATOM 1581 C VAL A 129 0.026 1.316 2.717 1.00 11.22 C ATOM 1582 O VAL A 129 0.563 0.277 2.335 1.00 2.42 O ATOM 1583 CB VAL A 129 1.369 3.130 3.782 1.00 53.43 C ATOM 1584 CG1 VAL A 129 2.329 4.277 3.504 1.00 53.03 C ATOM 1585 CG2 VAL A 129 0.328 3.533 4.815 1.00 30.23 C ATOM 0 H VAL A 129 -0.355 4.486 2.596 1.00 32.23 H new ATOM 0 HA VAL A 129 1.439 2.572 1.698 1.00 60.31 H new ATOM 0 HB VAL A 129 1.944 2.296 4.186 1.00 53.43 H new ATOM 0 HG11 VAL A 129 2.802 4.589 4.435 1.00 53.03 H new ATOM 0 HG12 VAL A 129 3.094 3.949 2.800 1.00 53.03 H new ATOM 0 HG13 VAL A 129 1.779 5.116 3.077 1.00 53.03 H new ATOM 0 HG21 VAL A 129 0.828 3.855 5.729 1.00 30.23 H new ATOM 0 HG22 VAL A 129 -0.275 4.352 4.423 1.00 30.23 H new ATOM 0 HG23 VAL A 129 -0.315 2.681 5.035 1.00 30.23 H new ATOM 1595 N ALA A 130 -1.142 1.336 3.350 1.00 72.35 N ATOM 1596 CA ALA A 130 -1.878 0.111 3.635 1.00 61.44 C ATOM 1597 C ALA A 130 -2.171 -0.665 2.356 1.00 53.24 C ATOM 1598 O ALA A 130 -1.997 -1.883 2.302 1.00 3.23 O ATOM 1599 CB ALA A 130 -3.172 0.430 4.370 1.00 33.11 C ATOM 0 H ALA A 130 -1.599 2.188 3.675 1.00 72.35 H new ATOM 0 HA ALA A 130 -1.256 -0.516 4.274 1.00 61.44 H new ATOM 0 HB1 ALA A 130 -3.711 -0.495 4.576 1.00 33.11 H new ATOM 0 HB2 ALA A 130 -2.942 0.933 5.309 1.00 33.11 H new ATOM 0 HB3 ALA A 130 -3.791 1.080 3.752 1.00 33.11 H new ATOM 1605 N LEU A 131 -2.619 0.047 1.327 1.00 34.12 N ATOM 1606 CA LEU A 131 -2.938 -0.574 0.047 1.00 25.33 C ATOM 1607 C LEU A 131 -1.781 -1.441 -0.440 1.00 24.42 C ATOM 1608 O LEU A 131 -1.978 -2.590 -0.841 1.00 71.05 O ATOM 1609 CB LEU A 131 -3.260 0.497 -0.996 1.00 62.23 C ATOM 1610 CG LEU A 131 -4.163 0.060 -2.151 1.00 25.13 C ATOM 1611 CD1 LEU A 131 -4.388 1.210 -3.118 1.00 14.45 C ATOM 1612 CD2 LEU A 131 -3.561 -1.138 -2.873 1.00 54.31 C ATOM 0 H LEU A 131 -2.769 1.055 1.355 1.00 34.12 H new ATOM 0 HA LEU A 131 -3.812 -1.210 0.188 1.00 25.33 H new ATOM 0 HB2 LEU A 131 -3.733 1.338 -0.489 1.00 62.23 H new ATOM 0 HB3 LEU A 131 -2.322 0.863 -1.413 1.00 62.23 H new ATOM 0 HG LEU A 131 -5.129 -0.235 -1.741 1.00 25.13 H new ATOM 0 HD11 LEU A 131 -5.033 0.880 -3.933 1.00 14.45 H new ATOM 0 HD12 LEU A 131 -4.863 2.039 -2.593 1.00 14.45 H new ATOM 0 HD13 LEU A 131 -3.430 1.537 -3.523 1.00 14.45 H new ATOM 0 HD21 LEU A 131 -4.216 -1.436 -3.692 1.00 54.31 H new ATOM 0 HD22 LEU A 131 -2.582 -0.869 -3.271 1.00 54.31 H new ATOM 0 HD23 LEU A 131 -3.453 -1.968 -2.174 1.00 54.31 H new ATOM 1623 N LEU A 132 -0.575 -0.887 -0.400 1.00 24.35 N ATOM 1624 CA LEU A 132 0.615 -1.611 -0.835 1.00 62.53 C ATOM 1625 C LEU A 132 0.913 -2.780 0.100 1.00 11.11 C ATOM 1626 O LEU A 132 1.237 -3.879 -0.349 1.00 3.12 O ATOM 1627 CB LEU A 132 1.818 -0.668 -0.889 1.00 4.01 C ATOM 1628 CG LEU A 132 1.579 0.686 -1.557 1.00 34.43 C ATOM 1629 CD1 LEU A 132 2.902 1.342 -1.922 1.00 4.35 C ATOM 1630 CD2 LEU A 132 0.703 0.526 -2.790 1.00 23.03 C ATOM 0 H LEU A 132 -0.395 0.061 -0.071 1.00 24.35 H new ATOM 0 HA LEU A 132 0.425 -2.006 -1.833 1.00 62.53 H new ATOM 0 HB2 LEU A 132 2.163 -0.492 0.130 1.00 4.01 H new ATOM 0 HB3 LEU A 132 2.627 -1.173 -1.416 1.00 4.01 H new ATOM 0 HG LEU A 132 1.060 1.332 -0.849 1.00 34.43 H new ATOM 0 HD11 LEU A 132 2.712 2.305 -2.396 1.00 4.35 H new ATOM 0 HD12 LEU A 132 3.495 1.493 -1.020 1.00 4.35 H new ATOM 0 HD13 LEU A 132 3.449 0.699 -2.612 1.00 4.35 H new ATOM 0 HD21 LEU A 132 0.544 1.500 -3.252 1.00 23.03 H new ATOM 0 HD22 LEU A 132 1.194 -0.137 -3.502 1.00 23.03 H new ATOM 0 HD23 LEU A 132 -0.258 0.100 -2.501 1.00 23.03 H new ATOM 1641 N GLY A 133 0.799 -2.535 1.401 1.00 60.43 N ATOM 1642 CA GLY A 133 1.056 -3.578 2.378 1.00 10.42 C ATOM 1643 C GLY A 133 0.322 -4.865 2.059 1.00 23.40 C ATOM 1644 O GLY A 133 0.933 -5.930 1.967 1.00 24.41 O ATOM 0 H GLY A 133 0.533 -1.633 1.797 1.00 60.43 H new ATOM 0 HA2 GLY A 133 2.127 -3.775 2.421 1.00 10.42 H new ATOM 0 HA3 GLY A 133 0.757 -3.228 3.366 1.00 10.42 H new ATOM 1648 N PHE A 134 -0.993 -4.769 1.892 1.00 20.44 N ATOM 1649 CA PHE A 134 -1.812 -5.936 1.585 1.00 33.40 C ATOM 1650 C PHE A 134 -1.699 -6.306 0.109 1.00 3.13 C ATOM 1651 O PHE A 134 -1.940 -7.450 -0.275 1.00 32.13 O ATOM 1652 CB PHE A 134 -3.274 -5.667 1.945 1.00 41.35 C ATOM 1653 CG PHE A 134 -4.102 -5.202 0.781 1.00 23.21 C ATOM 1654 CD1 PHE A 134 -4.744 -6.116 -0.038 1.00 3.43 C ATOM 1655 CD2 PHE A 134 -4.239 -3.850 0.507 1.00 64.43 C ATOM 1656 CE1 PHE A 134 -5.505 -5.691 -1.111 1.00 73.45 C ATOM 1657 CE2 PHE A 134 -5.000 -3.420 -0.563 1.00 51.30 C ATOM 1658 CZ PHE A 134 -5.635 -4.341 -1.373 1.00 34.25 C ATOM 0 H PHE A 134 -1.514 -3.895 1.964 1.00 20.44 H new ATOM 0 HA PHE A 134 -1.447 -6.773 2.180 1.00 33.40 H new ATOM 0 HB2 PHE A 134 -3.713 -6.578 2.352 1.00 41.35 H new ATOM 0 HB3 PHE A 134 -3.313 -4.914 2.732 1.00 41.35 H new ATOM 0 HD1 PHE A 134 -4.649 -7.173 0.164 1.00 3.43 H new ATOM 0 HD2 PHE A 134 -3.745 -3.125 1.137 1.00 64.43 H new ATOM 0 HE1 PHE A 134 -5.998 -6.414 -1.744 1.00 73.45 H new ATOM 0 HE2 PHE A 134 -5.098 -2.364 -0.766 1.00 51.30 H new ATOM 0 HZ PHE A 134 -6.232 -4.007 -2.209 1.00 34.25 H new ATOM 1667 N GLY A 135 -1.330 -5.329 -0.714 1.00 52.32 N ATOM 1668 CA GLY A 135 -1.192 -5.571 -2.138 1.00 53.05 C ATOM 1669 C GLY A 135 -0.204 -6.678 -2.445 1.00 64.42 C ATOM 1670 O GLY A 135 -0.532 -7.637 -3.145 1.00 72.41 O ATOM 0 H GLY A 135 -1.124 -4.374 -0.420 1.00 52.32 H new ATOM 0 HA2 GLY A 135 -2.165 -5.831 -2.555 1.00 53.05 H new ATOM 0 HA3 GLY A 135 -0.869 -4.653 -2.630 1.00 53.05 H new ATOM 1674 N TYR A 136 1.010 -6.547 -1.922 1.00 32.12 N ATOM 1675 CA TYR A 136 2.051 -7.543 -2.147 1.00 14.24 C ATOM 1676 C TYR A 136 1.597 -8.922 -1.676 1.00 35.24 C ATOM 1677 O TYR A 136 1.828 -9.926 -2.349 1.00 45.15 O ATOM 1678 CB TYR A 136 3.336 -7.141 -1.420 1.00 4.20 C ATOM 1679 CG TYR A 136 4.519 -8.023 -1.750 1.00 41.24 C ATOM 1680 CD1 TYR A 136 4.720 -8.495 -3.041 1.00 43.42 C ATOM 1681 CD2 TYR A 136 5.435 -8.385 -0.770 1.00 22.42 C ATOM 1682 CE1 TYR A 136 5.799 -9.302 -3.346 1.00 51.54 C ATOM 1683 CE2 TYR A 136 6.518 -9.190 -1.067 1.00 64.54 C ATOM 1684 CZ TYR A 136 6.695 -9.646 -2.356 1.00 43.22 C ATOM 1685 OH TYR A 136 7.771 -10.450 -2.656 1.00 22.41 O ATOM 0 H TYR A 136 1.298 -5.761 -1.339 1.00 32.12 H new ATOM 0 HA TYR A 136 2.247 -7.591 -3.218 1.00 14.24 H new ATOM 0 HB2 TYR A 136 3.580 -6.110 -1.675 1.00 4.20 H new ATOM 0 HB3 TYR A 136 3.160 -7.171 -0.345 1.00 4.20 H new ATOM 0 HD1 TYR A 136 4.021 -8.227 -3.819 1.00 43.42 H new ATOM 0 HD2 TYR A 136 5.298 -8.031 0.241 1.00 22.42 H new ATOM 0 HE1 TYR A 136 5.940 -9.662 -4.355 1.00 51.54 H new ATOM 0 HE2 TYR A 136 7.222 -9.460 -0.294 1.00 64.54 H new ATOM 0 HH TYR A 136 8.038 -10.305 -3.588 1.00 22.41 H new ATOM 1694 N ARG A 137 0.951 -8.960 -0.516 1.00 64.21 N ATOM 1695 CA ARG A 137 0.464 -10.214 0.047 1.00 12.44 C ATOM 1696 C ARG A 137 -0.471 -10.921 -0.930 1.00 23.12 C ATOM 1697 O ARG A 137 -0.276 -12.094 -1.254 1.00 43.42 O ATOM 1698 CB ARG A 137 -0.262 -9.957 1.369 1.00 4.15 C ATOM 1699 CG ARG A 137 0.591 -10.240 2.595 1.00 64.53 C ATOM 1700 CD ARG A 137 0.399 -11.666 3.090 1.00 34.12 C ATOM 1701 NE ARG A 137 0.643 -11.784 4.526 1.00 12.33 N ATOM 1702 CZ ARG A 137 0.873 -12.940 5.139 1.00 34.33 C ATOM 1703 NH1 ARG A 137 0.889 -14.069 4.446 1.00 64.34 N ATOM 1704 NH2 ARG A 137 1.087 -12.967 6.448 1.00 14.21 N ATOM 0 H ARG A 137 0.752 -8.137 0.053 1.00 64.21 H new ATOM 0 HA ARG A 137 1.324 -10.858 0.232 1.00 12.44 H new ATOM 0 HB2 ARG A 137 -0.591 -8.918 1.397 1.00 4.15 H new ATOM 0 HB3 ARG A 137 -1.158 -10.577 1.409 1.00 4.15 H new ATOM 0 HG2 ARG A 137 1.641 -10.075 2.355 1.00 64.53 H new ATOM 0 HG3 ARG A 137 0.332 -9.540 3.389 1.00 64.53 H new ATOM 0 HD2 ARG A 137 -0.616 -11.994 2.867 1.00 34.12 H new ATOM 0 HD3 ARG A 137 1.074 -12.331 2.552 1.00 34.12 H new ATOM 0 HE ARG A 137 0.636 -10.933 5.088 1.00 12.33 H new ATOM 0 HH11 ARG A 137 0.725 -14.052 3.439 1.00 64.34 H new ATOM 0 HH12 ARG A 137 1.066 -14.955 4.919 1.00 64.34 H new ATOM 0 HH21 ARG A 137 1.075 -12.100 6.985 1.00 14.21 H new ATOM 0 HH22 ARG A 137 1.263 -13.855 6.918 1.00 14.21 H new ATOM 1715 N LEU A 138 -1.486 -10.202 -1.396 1.00 23.22 N ATOM 1716 CA LEU A 138 -2.452 -10.760 -2.335 1.00 53.23 C ATOM 1717 C LEU A 138 -1.763 -11.221 -3.615 1.00 44.35 C ATOM 1718 O LEU A 138 -2.119 -12.251 -4.187 1.00 63.31 O ATOM 1719 CB LEU A 138 -3.529 -9.724 -2.665 1.00 4.25 C ATOM 1720 CG LEU A 138 -4.390 -10.021 -3.895 1.00 34.52 C ATOM 1721 CD1 LEU A 138 -5.867 -9.956 -3.538 1.00 3.32 C ATOM 1722 CD2 LEU A 138 -4.067 -9.047 -5.018 1.00 41.41 C ATOM 0 H LEU A 138 -1.661 -9.231 -1.139 1.00 23.22 H new ATOM 0 HA LEU A 138 -2.921 -11.625 -1.866 1.00 53.23 H new ATOM 0 HB2 LEU A 138 -4.186 -9.624 -1.801 1.00 4.25 H new ATOM 0 HB3 LEU A 138 -3.044 -8.758 -2.810 1.00 4.25 H new ATOM 0 HG LEU A 138 -4.164 -11.030 -4.240 1.00 34.52 H new ATOM 0 HD11 LEU A 138 -6.465 -10.170 -4.424 1.00 3.32 H new ATOM 0 HD12 LEU A 138 -6.087 -10.692 -2.765 1.00 3.32 H new ATOM 0 HD13 LEU A 138 -6.109 -8.959 -3.169 1.00 3.32 H new ATOM 0 HD21 LEU A 138 -4.688 -9.272 -5.885 1.00 41.41 H new ATOM 0 HD22 LEU A 138 -4.265 -8.028 -4.684 1.00 41.41 H new ATOM 0 HD23 LEU A 138 -3.016 -9.141 -5.290 1.00 41.41 H new ATOM 1733 N ALA A 139 -0.774 -10.451 -4.059 1.00 61.22 N ATOM 1734 CA ALA A 139 -0.032 -10.784 -5.268 1.00 14.41 C ATOM 1735 C ALA A 139 0.721 -12.099 -5.108 1.00 63.51 C ATOM 1736 O ALA A 139 0.518 -13.041 -5.876 1.00 12.23 O ATOM 1737 CB ALA A 139 0.932 -9.660 -5.621 1.00 32.53 C ATOM 0 H ALA A 139 -0.469 -9.593 -3.599 1.00 61.22 H new ATOM 0 HA ALA A 139 -0.747 -10.904 -6.081 1.00 14.41 H new ATOM 0 HB1 ALA A 139 1.480 -9.922 -6.526 1.00 32.53 H new ATOM 0 HB2 ALA A 139 0.372 -8.740 -5.789 1.00 32.53 H new ATOM 0 HB3 ALA A 139 1.635 -9.513 -4.801 1.00 32.53 H new ATOM 1743 N LEU A 140 1.591 -12.158 -4.105 1.00 44.43 N ATOM 1744 CA LEU A 140 2.376 -13.360 -3.845 1.00 31.31 C ATOM 1745 C LEU A 140 1.469 -14.568 -3.638 1.00 64.10 C ATOM 1746 O LEU A 140 1.813 -15.689 -4.017 1.00 74.31 O ATOM 1747 CB LEU A 140 3.262 -13.157 -2.614 1.00 73.04 C ATOM 1748 CG LEU A 140 4.469 -14.087 -2.495 1.00 23.50 C ATOM 1749 CD1 LEU A 140 5.754 -13.282 -2.378 1.00 63.42 C ATOM 1750 CD2 LEU A 140 4.310 -15.018 -1.301 1.00 43.45 C ATOM 0 H LEU A 140 1.770 -11.389 -3.460 1.00 44.43 H new ATOM 0 HA LEU A 140 3.007 -13.547 -4.714 1.00 31.31 H new ATOM 0 HB2 LEU A 140 3.621 -12.128 -2.615 1.00 73.04 H new ATOM 0 HB3 LEU A 140 2.646 -13.279 -1.723 1.00 73.04 H new ATOM 0 HG LEU A 140 4.526 -14.694 -3.399 1.00 23.50 H new ATOM 0 HD11 LEU A 140 6.602 -13.961 -2.294 1.00 63.42 H new ATOM 0 HD12 LEU A 140 5.875 -12.658 -3.264 1.00 63.42 H new ATOM 0 HD13 LEU A 140 5.707 -12.649 -1.492 1.00 63.42 H new ATOM 0 HD21 LEU A 140 5.179 -15.673 -1.232 1.00 43.45 H new ATOM 0 HD22 LEU A 140 4.227 -14.428 -0.388 1.00 43.45 H new ATOM 0 HD23 LEU A 140 3.410 -15.621 -1.427 1.00 43.45 H new ATOM 1761 N HIS A 141 0.307 -14.334 -3.036 1.00 22.41 N ATOM 1762 CA HIS A 141 -0.651 -15.404 -2.781 1.00 53.41 C ATOM 1763 C HIS A 141 -0.938 -16.191 -4.056 1.00 64.34 C ATOM 1764 O HIS A 141 -1.018 -17.419 -4.035 1.00 61.20 O ATOM 1765 CB HIS A 141 -1.952 -14.829 -2.220 1.00 34.53 C ATOM 1766 CG HIS A 141 -2.314 -15.371 -0.871 1.00 14.31 C ATOM 1767 ND1 HIS A 141 -1.818 -15.091 0.358 1.00 30.41 N flip ATOM 1768 CD2 HIS A 141 -3.294 -16.321 -0.680 1.00 41.42 C flip ATOM 1769 CE1 HIS A 141 -2.503 -15.869 1.259 1.00 64.52 C flip ATOM 1770 NE2 HIS A 141 -3.387 -16.601 0.607 1.00 24.24 N flip ATOM 0 H HIS A 141 0.006 -13.413 -2.716 1.00 22.41 H new ATOM 0 HA HIS A 141 -0.215 -16.081 -2.047 1.00 53.41 H new ATOM 0 HB2 HIS A 141 -1.862 -13.745 -2.155 1.00 34.53 H new ATOM 0 HB3 HIS A 141 -2.763 -15.040 -2.917 1.00 34.53 H new ATOM 0 HD1 HIS A 141 -1.075 -14.427 0.574 1.00 30.41 H new ATOM 0 HD2 HIS A 141 -3.892 -16.767 -1.461 1.00 41.42 H new ATOM 0 HE1 HIS A 141 -2.344 -15.880 2.327 1.00 64.52 H new ATOM 1777 N VAL A 142 -1.093 -15.476 -5.166 1.00 53.01 N ATOM 1778 CA VAL A 142 -1.371 -16.107 -6.450 1.00 2.41 C ATOM 1779 C VAL A 142 -0.089 -16.608 -7.105 1.00 20.21 C ATOM 1780 O VAL A 142 -0.058 -17.696 -7.680 1.00 21.23 O ATOM 1781 CB VAL A 142 -2.079 -15.135 -7.412 1.00 10.40 C ATOM 1782 CG1 VAL A 142 -2.808 -15.901 -8.506 1.00 12.05 C ATOM 1783 CG2 VAL A 142 -3.040 -14.236 -6.649 1.00 22.51 C ATOM 0 H VAL A 142 -1.031 -14.459 -5.201 1.00 53.01 H new ATOM 0 HA VAL A 142 -2.029 -16.953 -6.251 1.00 2.41 H new ATOM 0 HB VAL A 142 -1.325 -14.505 -7.884 1.00 10.40 H new ATOM 0 HG11 VAL A 142 -3.302 -15.197 -9.176 1.00 12.05 H new ATOM 0 HG12 VAL A 142 -2.092 -16.498 -9.071 1.00 12.05 H new ATOM 0 HG13 VAL A 142 -3.553 -16.557 -8.056 1.00 12.05 H new ATOM 0 HG21 VAL A 142 -3.532 -13.556 -7.344 1.00 22.51 H new ATOM 0 HG22 VAL A 142 -3.790 -14.848 -6.148 1.00 22.51 H new ATOM 0 HG23 VAL A 142 -2.488 -13.660 -5.907 1.00 22.51 H new ATOM 1793 N TYR A 143 0.968 -15.809 -7.012 1.00 52.34 N ATOM 1794 CA TYR A 143 2.253 -16.170 -7.597 1.00 31.03 C ATOM 1795 C TYR A 143 2.748 -17.503 -7.046 1.00 61.34 C ATOM 1796 O TYR A 143 3.047 -18.428 -7.802 1.00 73.35 O ATOM 1797 CB TYR A 143 3.288 -15.077 -7.323 1.00 72.21 C ATOM 1798 CG TYR A 143 4.718 -15.548 -7.459 1.00 21.53 C ATOM 1799 CD1 TYR A 143 5.276 -15.784 -8.709 1.00 14.52 C ATOM 1800 CD2 TYR A 143 5.510 -15.760 -6.338 1.00 12.12 C ATOM 1801 CE1 TYR A 143 6.582 -16.215 -8.839 1.00 11.24 C ATOM 1802 CE2 TYR A 143 6.818 -16.189 -6.458 1.00 64.22 C ATOM 1803 CZ TYR A 143 7.349 -16.416 -7.711 1.00 33.34 C ATOM 1804 OH TYR A 143 8.650 -16.846 -7.835 1.00 74.31 O ATOM 0 H TYR A 143 0.960 -14.907 -6.537 1.00 52.34 H new ATOM 0 HA TYR A 143 2.117 -16.271 -8.674 1.00 31.03 H new ATOM 0 HB2 TYR A 143 3.120 -14.249 -8.012 1.00 72.21 H new ATOM 0 HB3 TYR A 143 3.136 -14.689 -6.316 1.00 72.21 H new ATOM 0 HD1 TYR A 143 4.678 -15.628 -9.595 1.00 14.52 H new ATOM 0 HD2 TYR A 143 5.096 -15.587 -5.356 1.00 12.12 H new ATOM 0 HE1 TYR A 143 7.000 -16.394 -9.819 1.00 11.24 H new ATOM 0 HE2 TYR A 143 7.421 -16.346 -5.576 1.00 64.22 H new ATOM 0 HH TYR A 143 9.023 -16.519 -8.680 1.00 74.31 H new ATOM 1813 N GLN A 144 2.830 -17.594 -5.722 1.00 31.44 N ATOM 1814 CA GLN A 144 3.289 -18.814 -5.068 1.00 72.15 C ATOM 1815 C GLN A 144 2.328 -19.969 -5.335 1.00 30.12 C ATOM 1816 O GLN A 144 2.737 -21.128 -5.400 1.00 21.13 O ATOM 1817 CB GLN A 144 3.427 -18.589 -3.561 1.00 13.51 C ATOM 1818 CG GLN A 144 4.841 -18.241 -3.126 1.00 75.41 C ATOM 1819 CD GLN A 144 5.224 -18.889 -1.810 1.00 41.43 C ATOM 1820 OE1 GLN A 144 4.726 -18.510 -0.750 1.00 35.42 O ATOM 1821 NE2 GLN A 144 6.111 -19.875 -1.872 1.00 31.45 N ATOM 0 H GLN A 144 2.585 -16.838 -5.082 1.00 31.44 H new ATOM 0 HA GLN A 144 4.264 -19.073 -5.481 1.00 72.15 H new ATOM 0 HB2 GLN A 144 2.755 -17.786 -3.259 1.00 13.51 H new ATOM 0 HB3 GLN A 144 3.105 -19.489 -3.037 1.00 13.51 H new ATOM 0 HG2 GLN A 144 5.542 -18.555 -3.899 1.00 75.41 H new ATOM 0 HG3 GLN A 144 4.932 -17.159 -3.034 1.00 75.41 H new ATOM 0 HE21 GLN A 144 6.498 -20.157 -2.773 1.00 31.45 H new ATOM 0 HE22 GLN A 144 6.405 -20.351 -1.019 1.00 31.45 H new ATOM 1828 N HIS A 145 1.048 -19.643 -5.489 1.00 23.32 N ATOM 1829 CA HIS A 145 0.029 -20.654 -5.749 1.00 53.11 C ATOM 1830 C HIS A 145 0.355 -21.442 -7.014 1.00 24.14 C ATOM 1831 O HIS A 145 -0.061 -22.590 -7.168 1.00 33.34 O ATOM 1832 CB HIS A 145 -1.346 -19.999 -5.884 1.00 13.04 C ATOM 1833 CG HIS A 145 -2.341 -20.479 -4.872 1.00 31.43 C ATOM 1834 ND1 HIS A 145 -2.590 -21.814 -4.637 1.00 25.14 N ATOM 1835 CD2 HIS A 145 -3.148 -19.794 -4.030 1.00 51.22 C ATOM 1836 CE1 HIS A 145 -3.509 -21.930 -3.696 1.00 44.23 C ATOM 1837 NE2 HIS A 145 -3.864 -20.717 -3.310 1.00 45.33 N ATOM 0 H HIS A 145 0.692 -18.688 -5.438 1.00 23.32 H new ATOM 0 HA HIS A 145 0.014 -21.344 -4.905 1.00 53.11 H new ATOM 0 HB2 HIS A 145 -1.236 -18.919 -5.789 1.00 13.04 H new ATOM 0 HB3 HIS A 145 -1.735 -20.193 -6.884 1.00 13.04 H new ATOM 0 HD2 HIS A 145 -3.216 -18.720 -3.941 1.00 51.22 H new ATOM 0 HE1 HIS A 145 -3.903 -22.858 -3.308 1.00 44.23 H new ATOM 0 HE2 HIS A 145 -4.557 -20.502 -2.594 1.00 45.33 H new ATOM 1844 N GLY A 146 1.103 -20.817 -7.918 1.00 11.15 N ATOM 1845 CA GLY A 146 1.473 -21.475 -9.159 1.00 21.22 C ATOM 1846 C GLY A 146 1.399 -20.545 -10.353 1.00 74.12 C ATOM 1847 O GLY A 146 2.005 -20.807 -11.392 1.00 41.22 O ATOM 0 H GLY A 146 1.460 -19.867 -7.814 1.00 11.15 H new ATOM 0 HA2 GLY A 146 2.486 -21.867 -9.070 1.00 21.22 H new ATOM 0 HA3 GLY A 146 0.814 -22.327 -9.325 1.00 21.22 H new ATOM 1851 N LEU A 147 0.652 -19.456 -10.207 1.00 31.22 N ATOM 1852 CA LEU A 147 0.498 -18.483 -11.283 1.00 41.14 C ATOM 1853 C LEU A 147 1.732 -17.593 -11.394 1.00 23.44 C ATOM 1854 O LEU A 147 1.665 -16.387 -11.159 1.00 34.30 O ATOM 1855 CB LEU A 147 -0.744 -17.623 -11.047 1.00 72.25 C ATOM 1856 CG LEU A 147 -1.378 -17.002 -12.293 1.00 62.51 C ATOM 1857 CD1 LEU A 147 -2.893 -16.965 -12.158 1.00 15.24 C ATOM 1858 CD2 LEU A 147 -0.827 -15.605 -12.531 1.00 61.03 C ATOM 0 H LEU A 147 0.143 -19.225 -9.354 1.00 31.22 H new ATOM 0 HA LEU A 147 0.381 -19.030 -12.219 1.00 41.14 H new ATOM 0 HB2 LEU A 147 -1.496 -18.235 -10.548 1.00 72.25 H new ATOM 0 HB3 LEU A 147 -0.480 -16.819 -10.360 1.00 72.25 H new ATOM 0 HG LEU A 147 -1.126 -17.621 -13.154 1.00 62.51 H new ATOM 0 HD11 LEU A 147 -3.327 -16.520 -13.053 1.00 15.24 H new ATOM 0 HD12 LEU A 147 -3.272 -17.980 -12.036 1.00 15.24 H new ATOM 0 HD13 LEU A 147 -3.166 -16.369 -11.287 1.00 15.24 H new ATOM 0 HD21 LEU A 147 -1.289 -15.178 -13.421 1.00 61.03 H new ATOM 0 HD22 LEU A 147 -1.049 -14.975 -11.670 1.00 61.03 H new ATOM 0 HD23 LEU A 147 0.252 -15.659 -12.673 1.00 61.03 H new ATOM 1869 N THR A 148 2.861 -18.197 -11.755 1.00 61.25 N ATOM 1870 CA THR A 148 4.110 -17.460 -11.897 1.00 44.45 C ATOM 1871 C THR A 148 3.947 -16.282 -12.851 1.00 64.14 C ATOM 1872 O THR A 148 3.548 -16.453 -14.002 1.00 32.23 O ATOM 1873 CB THR A 148 5.242 -18.370 -12.411 1.00 10.45 C ATOM 1874 OG1 THR A 148 4.865 -18.964 -13.658 1.00 3.41 O ATOM 1875 CG2 THR A 148 5.562 -19.460 -11.400 1.00 2.50 C ATOM 0 H THR A 148 2.935 -19.195 -11.954 1.00 61.25 H new ATOM 0 HA THR A 148 4.373 -17.088 -10.907 1.00 44.45 H new ATOM 0 HB THR A 148 6.133 -17.758 -12.555 1.00 10.45 H new ATOM 0 HG1 THR A 148 4.224 -18.382 -14.117 1.00 3.41 H new ATOM 0 HG21 THR A 148 6.364 -20.090 -11.785 1.00 2.50 H new ATOM 0 HG22 THR A 148 5.877 -19.004 -10.461 1.00 2.50 H new ATOM 0 HG23 THR A 148 4.674 -20.068 -11.228 1.00 2.50 H new ATOM 1883 N GLY A 149 4.259 -15.085 -12.363 1.00 13.22 N ATOM 1884 CA GLY A 149 4.141 -13.896 -13.185 1.00 12.51 C ATOM 1885 C GLY A 149 2.945 -13.045 -12.807 1.00 32.25 C ATOM 1886 O GLY A 149 2.162 -12.643 -13.668 1.00 23.43 O ATOM 0 H GLY A 149 4.591 -14.918 -11.413 1.00 13.22 H new ATOM 0 HA2 GLY A 149 5.050 -13.302 -13.091 1.00 12.51 H new ATOM 0 HA3 GLY A 149 4.058 -14.189 -14.232 1.00 12.51 H new ATOM 1890 N PHE A 150 2.803 -12.769 -11.514 1.00 3.23 N ATOM 1891 CA PHE A 150 1.693 -11.962 -11.023 1.00 63.13 C ATOM 1892 C PHE A 150 2.177 -10.587 -10.572 1.00 64.40 C ATOM 1893 O PHE A 150 1.399 -9.633 -10.505 1.00 5.40 O ATOM 1894 CB PHE A 150 0.992 -12.674 -9.863 1.00 10.30 C ATOM 1895 CG PHE A 150 -0.497 -12.478 -9.852 1.00 73.21 C ATOM 1896 CD1 PHE A 150 -1.252 -12.738 -10.984 1.00 61.42 C ATOM 1897 CD2 PHE A 150 -1.141 -12.033 -8.709 1.00 54.35 C ATOM 1898 CE1 PHE A 150 -2.623 -12.559 -10.977 1.00 42.14 C ATOM 1899 CE2 PHE A 150 -2.513 -11.852 -8.696 1.00 5.04 C ATOM 1900 CZ PHE A 150 -3.254 -12.115 -9.832 1.00 30.32 C ATOM 0 H PHE A 150 3.443 -13.093 -10.788 1.00 3.23 H new ATOM 0 HA PHE A 150 0.985 -11.828 -11.840 1.00 63.13 H new ATOM 0 HB2 PHE A 150 1.210 -13.741 -9.917 1.00 10.30 H new ATOM 0 HB3 PHE A 150 1.405 -12.312 -8.922 1.00 10.30 H new ATOM 0 HD1 PHE A 150 -0.764 -13.085 -11.883 1.00 61.42 H new ATOM 0 HD2 PHE A 150 -0.566 -11.825 -7.819 1.00 54.35 H new ATOM 0 HE1 PHE A 150 -3.200 -12.766 -11.866 1.00 42.14 H new ATOM 0 HE2 PHE A 150 -3.004 -11.505 -7.799 1.00 5.04 H new ATOM 0 HZ PHE A 150 -4.325 -11.974 -9.824 1.00 30.32 H new ATOM 1909 N LEU A 151 3.465 -10.493 -10.263 1.00 0.13 N ATOM 1910 CA LEU A 151 4.055 -9.234 -9.817 1.00 63.11 C ATOM 1911 C LEU A 151 3.721 -8.104 -10.785 1.00 44.32 C ATOM 1912 O LEU A 151 3.196 -7.065 -10.386 1.00 64.10 O ATOM 1913 CB LEU A 151 5.572 -9.378 -9.685 1.00 43.51 C ATOM 1914 CG LEU A 151 6.280 -10.096 -10.834 1.00 3.44 C ATOM 1915 CD1 LEU A 151 7.109 -9.115 -11.648 1.00 54.32 C ATOM 1916 CD2 LEU A 151 7.155 -11.222 -10.301 1.00 11.23 C ATOM 0 H LEU A 151 4.121 -11.272 -10.313 1.00 0.13 H new ATOM 0 HA LEU A 151 3.634 -8.988 -8.842 1.00 63.11 H new ATOM 0 HB2 LEU A 151 6.004 -8.382 -9.584 1.00 43.51 H new ATOM 0 HB3 LEU A 151 5.787 -9.914 -8.761 1.00 43.51 H new ATOM 0 HG LEU A 151 5.522 -10.529 -11.487 1.00 3.44 H new ATOM 0 HD11 LEU A 151 7.605 -9.645 -12.461 1.00 54.32 H new ATOM 0 HD12 LEU A 151 6.459 -8.344 -12.061 1.00 54.32 H new ATOM 0 HD13 LEU A 151 7.858 -8.652 -11.006 1.00 54.32 H new ATOM 0 HD21 LEU A 151 7.651 -11.722 -11.133 1.00 11.23 H new ATOM 0 HD22 LEU A 151 7.905 -10.811 -9.625 1.00 11.23 H new ATOM 0 HD23 LEU A 151 6.536 -11.940 -9.763 1.00 11.23 H new ATOM 1927 N GLY A 152 4.028 -8.315 -12.062 1.00 25.23 N ATOM 1928 CA GLY A 152 3.752 -7.306 -13.068 1.00 72.20 C ATOM 1929 C GLY A 152 2.273 -6.998 -13.190 1.00 62.42 C ATOM 1930 O GLY A 152 1.885 -5.842 -13.357 1.00 62.33 O ATOM 0 H GLY A 152 4.463 -9.167 -12.417 1.00 25.23 H new ATOM 0 HA2 GLY A 152 4.291 -6.392 -12.819 1.00 72.20 H new ATOM 0 HA3 GLY A 152 4.130 -7.646 -14.032 1.00 72.20 H new ATOM 1934 N GLN A 153 1.446 -8.036 -13.108 1.00 32.11 N ATOM 1935 CA GLN A 153 0.001 -7.870 -13.213 1.00 32.12 C ATOM 1936 C GLN A 153 -0.527 -6.974 -12.097 1.00 2.41 C ATOM 1937 O GLN A 153 -1.250 -6.011 -12.351 1.00 62.21 O ATOM 1938 CB GLN A 153 -0.694 -9.231 -13.163 1.00 64.43 C ATOM 1939 CG GLN A 153 -0.044 -10.281 -14.050 1.00 55.40 C ATOM 1940 CD GLN A 153 0.401 -9.720 -15.386 1.00 51.02 C ATOM 1941 OE1 GLN A 153 -0.422 -9.318 -16.210 1.00 22.13 O ATOM 1942 NE2 GLN A 153 1.709 -9.688 -15.609 1.00 1.44 N ATOM 0 H GLN A 153 1.752 -8.999 -12.969 1.00 32.11 H new ATOM 0 HA GLN A 153 -0.216 -7.394 -14.169 1.00 32.12 H new ATOM 0 HB2 GLN A 153 -0.698 -9.590 -12.134 1.00 64.43 H new ATOM 0 HB3 GLN A 153 -1.735 -9.109 -13.462 1.00 64.43 H new ATOM 0 HG2 GLN A 153 0.817 -10.706 -13.533 1.00 55.40 H new ATOM 0 HG3 GLN A 153 -0.748 -11.096 -14.218 1.00 55.40 H new ATOM 0 HE21 GLN A 153 2.356 -10.031 -14.899 1.00 1.44 H new ATOM 0 HE22 GLN A 153 2.067 -9.320 -16.490 1.00 1.44 H new ATOM 1949 N VAL A 154 -0.160 -7.299 -10.862 1.00 55.24 N ATOM 1950 CA VAL A 154 -0.597 -6.523 -9.707 1.00 72.32 C ATOM 1951 C VAL A 154 -0.138 -5.072 -9.814 1.00 64.43 C ATOM 1952 O VAL A 154 -0.938 -4.145 -9.679 1.00 4.45 O ATOM 1953 CB VAL A 154 -0.063 -7.123 -8.393 1.00 22.54 C ATOM 1954 CG1 VAL A 154 -0.545 -6.313 -7.199 1.00 45.32 C ATOM 1955 CG2 VAL A 154 -0.481 -8.580 -8.264 1.00 70.24 C ATOM 0 H VAL A 154 0.438 -8.093 -10.635 1.00 55.24 H new ATOM 0 HA VAL A 154 -1.686 -6.557 -9.697 1.00 72.32 H new ATOM 0 HB VAL A 154 1.026 -7.082 -8.412 1.00 22.54 H new ATOM 0 HG11 VAL A 154 -0.157 -6.753 -6.280 1.00 45.32 H new ATOM 0 HG12 VAL A 154 -0.189 -5.287 -7.288 1.00 45.32 H new ATOM 0 HG13 VAL A 154 -1.635 -6.318 -7.172 1.00 45.32 H new ATOM 0 HG21 VAL A 154 -0.095 -8.988 -7.330 1.00 70.24 H new ATOM 0 HG22 VAL A 154 -1.569 -8.648 -8.268 1.00 70.24 H new ATOM 0 HG23 VAL A 154 -0.079 -9.149 -9.102 1.00 70.24 H new ATOM 1965 N THR A 155 1.155 -4.883 -10.057 1.00 1.21 N ATOM 1966 CA THR A 155 1.721 -3.546 -10.182 1.00 0.33 C ATOM 1967 C THR A 155 0.962 -2.721 -11.215 1.00 24.12 C ATOM 1968 O THR A 155 0.613 -1.567 -10.967 1.00 44.21 O ATOM 1969 CB THR A 155 3.209 -3.601 -10.578 1.00 52.33 C ATOM 1970 OG1 THR A 155 3.907 -4.520 -9.731 1.00 5.21 O ATOM 1971 CG2 THR A 155 3.847 -2.224 -10.475 1.00 34.55 C ATOM 0 H THR A 155 1.830 -5.639 -10.171 1.00 1.21 H new ATOM 0 HA THR A 155 1.630 -3.072 -9.205 1.00 0.33 H new ATOM 0 HB THR A 155 3.275 -3.938 -11.612 1.00 52.33 H new ATOM 0 HG1 THR A 155 3.752 -5.436 -10.044 1.00 5.21 H new ATOM 0 HG21 THR A 155 4.897 -2.287 -10.759 1.00 34.55 H new ATOM 0 HG22 THR A 155 3.332 -1.533 -11.142 1.00 34.55 H new ATOM 0 HG23 THR A 155 3.770 -1.863 -9.449 1.00 34.55 H new ATOM 1979 N ARG A 156 0.708 -3.322 -12.373 1.00 0.41 N ATOM 1980 CA ARG A 156 -0.010 -2.642 -13.444 1.00 42.42 C ATOM 1981 C ARG A 156 -1.408 -2.237 -12.990 1.00 74.30 C ATOM 1982 O ARG A 156 -1.836 -1.101 -13.199 1.00 62.32 O ATOM 1983 CB ARG A 156 -0.104 -3.544 -14.678 1.00 72.50 C ATOM 1984 CG ARG A 156 1.171 -3.579 -15.505 1.00 61.55 C ATOM 1985 CD ARG A 156 1.286 -2.356 -16.402 1.00 32.13 C ATOM 1986 NE ARG A 156 2.452 -2.428 -17.278 1.00 22.31 N ATOM 1987 CZ ARG A 156 2.634 -1.634 -18.327 1.00 34.41 C ATOM 1988 NH1 ARG A 156 1.730 -0.711 -18.628 1.00 70.21 N ATOM 1989 NH2 ARG A 156 3.721 -1.760 -19.077 1.00 64.42 N ATOM 0 H ARG A 156 0.989 -4.278 -12.593 1.00 0.41 H new ATOM 0 HA ARG A 156 0.545 -1.740 -13.703 1.00 42.42 H new ATOM 0 HB2 ARG A 156 -0.348 -4.557 -14.359 1.00 72.50 H new ATOM 0 HB3 ARG A 156 -0.926 -3.201 -15.307 1.00 72.50 H new ATOM 0 HG2 ARG A 156 2.035 -3.628 -14.842 1.00 61.55 H new ATOM 0 HG3 ARG A 156 1.186 -4.482 -16.115 1.00 61.55 H new ATOM 0 HD2 ARG A 156 0.384 -2.264 -17.006 1.00 32.13 H new ATOM 0 HD3 ARG A 156 1.350 -1.459 -15.786 1.00 32.13 H new ATOM 0 HE ARG A 156 3.166 -3.127 -17.073 1.00 22.31 H new ATOM 0 HH11 ARG A 156 0.893 -0.610 -18.053 1.00 70.21 H new ATOM 0 HH12 ARG A 156 1.872 -0.102 -19.434 1.00 70.21 H new ATOM 0 HH21 ARG A 156 4.419 -2.468 -18.849 1.00 64.42 H new ATOM 0 HH22 ARG A 156 3.859 -1.149 -19.882 1.00 64.42 H new ATOM 2000 N PHE A 157 -2.117 -3.173 -12.367 1.00 13.14 N ATOM 2001 CA PHE A 157 -3.468 -2.914 -11.884 1.00 40.52 C ATOM 2002 C PHE A 157 -3.468 -1.803 -10.838 1.00 72.04 C ATOM 2003 O PHE A 157 -4.382 -0.981 -10.789 1.00 53.15 O ATOM 2004 CB PHE A 157 -4.074 -4.188 -11.291 1.00 1.55 C ATOM 2005 CG PHE A 157 -4.359 -5.248 -12.316 1.00 63.15 C ATOM 2006 CD1 PHE A 157 -4.925 -4.917 -13.537 1.00 64.13 C ATOM 2007 CD2 PHE A 157 -4.062 -6.578 -12.059 1.00 34.40 C ATOM 2008 CE1 PHE A 157 -5.189 -5.891 -14.481 1.00 3.41 C ATOM 2009 CE2 PHE A 157 -4.322 -7.555 -13.000 1.00 64.24 C ATOM 2010 CZ PHE A 157 -4.888 -7.212 -14.212 1.00 12.13 C ATOM 0 H PHE A 157 -1.778 -4.118 -12.185 1.00 13.14 H new ATOM 0 HA PHE A 157 -4.074 -2.592 -12.731 1.00 40.52 H new ATOM 0 HB2 PHE A 157 -3.392 -4.591 -10.543 1.00 1.55 H new ATOM 0 HB3 PHE A 157 -5.000 -3.934 -10.775 1.00 1.55 H new ATOM 0 HD1 PHE A 157 -5.162 -3.886 -13.753 1.00 64.13 H new ATOM 0 HD2 PHE A 157 -3.622 -6.853 -11.112 1.00 34.40 H new ATOM 0 HE1 PHE A 157 -5.630 -5.620 -15.429 1.00 3.41 H new ATOM 0 HE2 PHE A 157 -4.083 -8.587 -12.788 1.00 64.24 H new ATOM 0 HZ PHE A 157 -5.095 -7.975 -14.948 1.00 12.13 H new ATOM 2019 N VAL A 158 -2.436 -1.787 -10.001 1.00 22.42 N ATOM 2020 CA VAL A 158 -2.316 -0.778 -8.955 1.00 24.13 C ATOM 2021 C VAL A 158 -2.164 0.617 -9.552 1.00 23.34 C ATOM 2022 O VAL A 158 -2.931 1.526 -9.236 1.00 41.34 O ATOM 2023 CB VAL A 158 -1.113 -1.064 -8.035 1.00 52.25 C ATOM 2024 CG1 VAL A 158 -0.976 0.024 -6.982 1.00 75.44 C ATOM 2025 CG2 VAL A 158 -1.255 -2.432 -7.385 1.00 70.33 C ATOM 0 H VAL A 158 -1.671 -2.461 -10.027 1.00 22.42 H new ATOM 0 HA VAL A 158 -3.233 -0.821 -8.367 1.00 24.13 H new ATOM 0 HB VAL A 158 -0.206 -1.066 -8.640 1.00 52.25 H new ATOM 0 HG11 VAL A 158 -0.121 -0.195 -6.342 1.00 75.44 H new ATOM 0 HG12 VAL A 158 -0.826 0.987 -7.471 1.00 75.44 H new ATOM 0 HG13 VAL A 158 -1.882 0.061 -6.377 1.00 75.44 H new ATOM 0 HG21 VAL A 158 -0.397 -2.618 -6.739 1.00 70.33 H new ATOM 0 HG22 VAL A 158 -2.169 -2.460 -6.792 1.00 70.33 H new ATOM 0 HG23 VAL A 158 -1.300 -3.199 -8.158 1.00 70.33 H new ATOM 2035 N VAL A 159 -1.168 0.778 -10.418 1.00 34.42 N ATOM 2036 CA VAL A 159 -0.916 2.062 -11.061 1.00 33.15 C ATOM 2037 C VAL A 159 -2.131 2.526 -11.857 1.00 11.20 C ATOM 2038 O VAL A 159 -2.483 3.706 -11.840 1.00 2.22 O ATOM 2039 CB VAL A 159 0.302 1.990 -12.001 1.00 34.22 C ATOM 2040 CG1 VAL A 159 0.540 3.334 -12.671 1.00 14.20 C ATOM 2041 CG2 VAL A 159 1.538 1.541 -11.236 1.00 24.32 C ATOM 0 H VAL A 159 -0.523 0.036 -10.690 1.00 34.42 H new ATOM 0 HA VAL A 159 -0.710 2.779 -10.266 1.00 33.15 H new ATOM 0 HB VAL A 159 0.096 1.255 -12.779 1.00 34.22 H new ATOM 0 HG11 VAL A 159 1.404 3.263 -13.331 1.00 14.20 H new ATOM 0 HG12 VAL A 159 -0.339 3.611 -13.253 1.00 14.20 H new ATOM 0 HG13 VAL A 159 0.726 4.092 -11.910 1.00 14.20 H new ATOM 0 HG21 VAL A 159 2.390 1.495 -11.915 1.00 24.32 H new ATOM 0 HG22 VAL A 159 1.749 2.251 -10.436 1.00 24.32 H new ATOM 0 HG23 VAL A 159 1.362 0.554 -10.808 1.00 24.32 H new ATOM 2051 N ASP A 160 -2.767 1.591 -12.553 1.00 71.52 N ATOM 2052 CA ASP A 160 -3.945 1.903 -13.354 1.00 43.33 C ATOM 2053 C ASP A 160 -5.122 2.290 -12.464 1.00 62.11 C ATOM 2054 O ASP A 160 -5.855 3.234 -12.761 1.00 20.15 O ATOM 2055 CB ASP A 160 -4.323 0.707 -14.230 1.00 11.11 C ATOM 2056 CG ASP A 160 -3.707 0.785 -15.613 1.00 24.21 C ATOM 2057 OD1 ASP A 160 -3.746 1.875 -16.220 1.00 24.21 O ATOM 2058 OD2 ASP A 160 -3.186 -0.246 -16.089 1.00 24.31 O ATOM 0 H ASP A 160 -2.487 0.611 -12.579 1.00 71.52 H new ATOM 0 HA ASP A 160 -3.704 2.751 -13.994 1.00 43.33 H new ATOM 0 HB2 ASP A 160 -4.000 -0.213 -13.743 1.00 11.11 H new ATOM 0 HB3 ASP A 160 -5.408 0.655 -14.321 1.00 11.11 H new ATOM 2062 N PHE A 161 -5.298 1.554 -11.372 1.00 24.12 N ATOM 2063 CA PHE A 161 -6.387 1.819 -10.439 1.00 20.44 C ATOM 2064 C PHE A 161 -6.159 3.132 -9.695 1.00 53.25 C ATOM 2065 O PHE A 161 -7.098 3.887 -9.447 1.00 72.31 O ATOM 2066 CB PHE A 161 -6.519 0.670 -9.437 1.00 62.03 C ATOM 2067 CG PHE A 161 -7.424 0.985 -8.280 1.00 65.22 C ATOM 2068 CD1 PHE A 161 -6.921 1.573 -7.131 1.00 53.43 C ATOM 2069 CD2 PHE A 161 -8.777 0.692 -8.342 1.00 33.32 C ATOM 2070 CE1 PHE A 161 -7.750 1.862 -6.065 1.00 74.32 C ATOM 2071 CE2 PHE A 161 -9.611 0.980 -7.279 1.00 71.32 C ATOM 2072 CZ PHE A 161 -9.098 1.567 -6.139 1.00 21.12 C ATOM 0 H PHE A 161 -4.701 0.769 -11.111 1.00 24.12 H new ATOM 0 HA PHE A 161 -7.311 1.901 -11.012 1.00 20.44 H new ATOM 0 HB2 PHE A 161 -6.898 -0.211 -9.955 1.00 62.03 H new ATOM 0 HB3 PHE A 161 -5.530 0.415 -9.056 1.00 62.03 H new ATOM 0 HD1 PHE A 161 -5.869 1.808 -7.068 1.00 53.43 H new ATOM 0 HD2 PHE A 161 -9.184 0.233 -9.231 1.00 33.32 H new ATOM 0 HE1 PHE A 161 -7.345 2.318 -5.174 1.00 74.32 H new ATOM 0 HE2 PHE A 161 -10.664 0.746 -7.339 1.00 71.32 H new ATOM 0 HZ PHE A 161 -9.749 1.795 -5.308 1.00 21.12 H new ATOM 2081 N MET A 162 -4.906 3.396 -9.344 1.00 20.24 N ATOM 2082 CA MET A 162 -4.554 4.618 -8.629 1.00 72.12 C ATOM 2083 C MET A 162 -4.815 5.847 -9.494 1.00 3.54 C ATOM 2084 O MET A 162 -5.397 6.831 -9.034 1.00 45.41 O ATOM 2085 CB MET A 162 -3.085 4.581 -8.204 1.00 70.32 C ATOM 2086 CG MET A 162 -2.883 4.705 -6.702 1.00 40.25 C ATOM 2087 SD MET A 162 -1.832 3.402 -6.033 1.00 71.12 S ATOM 2088 CE MET A 162 -0.737 4.356 -4.985 1.00 60.00 C ATOM 0 H MET A 162 -4.117 2.781 -9.542 1.00 20.24 H new ATOM 0 HA MET A 162 -5.180 4.682 -7.739 1.00 72.12 H new ATOM 0 HB2 MET A 162 -2.640 3.647 -8.546 1.00 70.32 H new ATOM 0 HB3 MET A 162 -2.551 5.390 -8.702 1.00 70.32 H new ATOM 0 HG2 MET A 162 -2.440 5.675 -6.478 1.00 40.25 H new ATOM 0 HG3 MET A 162 -3.853 4.675 -6.205 1.00 40.25 H new ATOM 0 HE1 MET A 162 0.030 3.702 -4.569 1.00 60.00 H new ATOM 0 HE2 MET A 162 -0.263 5.142 -5.573 1.00 60.00 H new ATOM 0 HE3 MET A 162 -1.310 4.805 -4.174 1.00 60.00 H new ATOM 2096 N LEU A 163 -4.379 5.786 -10.748 1.00 33.41 N ATOM 2097 CA LEU A 163 -4.564 6.895 -11.678 1.00 34.52 C ATOM 2098 C LEU A 163 -6.006 6.954 -12.174 1.00 31.45 C ATOM 2099 O LEU A 163 -6.386 7.871 -12.903 1.00 23.54 O ATOM 2100 CB LEU A 163 -3.610 6.756 -12.864 1.00 1.40 C ATOM 2101 CG LEU A 163 -2.319 7.572 -12.786 1.00 33.04 C ATOM 2102 CD1 LEU A 163 -1.260 6.821 -11.993 1.00 42.04 C ATOM 2103 CD2 LEU A 163 -1.809 7.899 -14.182 1.00 1.42 C ATOM 0 H LEU A 163 -3.895 4.980 -11.144 1.00 33.41 H new ATOM 0 HA LEU A 163 -4.343 7.822 -11.149 1.00 34.52 H new ATOM 0 HB2 LEU A 163 -3.345 5.704 -12.970 1.00 1.40 H new ATOM 0 HB3 LEU A 163 -4.144 7.044 -13.770 1.00 1.40 H new ATOM 0 HG LEU A 163 -2.535 8.508 -12.271 1.00 33.04 H new ATOM 0 HD11 LEU A 163 -0.348 7.417 -11.948 1.00 42.04 H new ATOM 0 HD12 LEU A 163 -1.624 6.638 -10.982 1.00 42.04 H new ATOM 0 HD13 LEU A 163 -1.048 5.869 -12.480 1.00 42.04 H new ATOM 0 HD21 LEU A 163 -0.890 8.480 -14.107 1.00 1.42 H new ATOM 0 HD22 LEU A 163 -1.610 6.974 -14.723 1.00 1.42 H new ATOM 0 HD23 LEU A 163 -2.561 8.478 -14.718 1.00 1.42 H new ATOM 2114 N HIS A 164 -6.805 5.971 -11.772 1.00 61.41 N ATOM 2115 CA HIS A 164 -8.206 5.913 -12.173 1.00 72.31 C ATOM 2116 C HIS A 164 -9.119 6.327 -11.022 1.00 61.22 C ATOM 2117 O HIS A 164 -10.210 6.855 -11.240 1.00 1.34 O ATOM 2118 CB HIS A 164 -8.566 4.502 -12.643 1.00 73.31 C ATOM 2119 CG HIS A 164 -8.312 4.274 -14.101 1.00 23.50 C ATOM 2120 ND1 HIS A 164 -7.167 4.699 -14.741 1.00 33.03 N ATOM 2121 CD2 HIS A 164 -9.062 3.659 -15.044 1.00 70.52 C ATOM 2122 CE1 HIS A 164 -7.225 4.357 -16.015 1.00 40.34 C ATOM 2123 NE2 HIS A 164 -8.366 3.724 -16.225 1.00 0.25 N ATOM 0 H HIS A 164 -6.507 5.204 -11.169 1.00 61.41 H new ATOM 0 HA HIS A 164 -8.351 6.611 -12.998 1.00 72.31 H new ATOM 0 HB2 HIS A 164 -7.992 3.778 -12.065 1.00 73.31 H new ATOM 0 HB3 HIS A 164 -9.619 4.315 -12.432 1.00 73.31 H new ATOM 0 HD2 HIS A 164 -10.029 3.202 -14.895 1.00 70.52 H new ATOM 0 HE1 HIS A 164 -6.469 4.560 -16.759 1.00 40.34 H new ATOM 0 HE2 HIS A 164 -8.678 3.345 -17.119 1.00 0.25 H new ATOM 2130 N HIS A 165 -8.665 6.083 -9.797 1.00 61.31 N ATOM 2131 CA HIS A 165 -9.441 6.431 -8.611 1.00 43.41 C ATOM 2132 C HIS A 165 -9.056 7.814 -8.096 1.00 2.33 C ATOM 2133 O HIS A 165 -9.326 8.155 -6.943 1.00 4.05 O ATOM 2134 CB HIS A 165 -9.230 5.388 -7.514 1.00 63.25 C ATOM 2135 CG HIS A 165 -10.413 4.492 -7.302 1.00 21.13 C ATOM 2136 ND1 HIS A 165 -11.086 3.879 -8.337 1.00 52.23 N ATOM 2137 CD2 HIS A 165 -11.039 4.107 -6.166 1.00 62.32 C ATOM 2138 CE1 HIS A 165 -12.078 3.157 -7.847 1.00 23.23 C ATOM 2139 NE2 HIS A 165 -12.070 3.277 -6.532 1.00 75.24 N ATOM 0 H HIS A 165 -7.765 5.646 -9.599 1.00 61.31 H new ATOM 0 HA HIS A 165 -10.495 6.447 -8.888 1.00 43.41 H new ATOM 0 HB2 HIS A 165 -8.363 4.777 -7.767 1.00 63.25 H new ATOM 0 HB3 HIS A 165 -8.999 5.898 -6.579 1.00 63.25 H new ATOM 0 HD1 HIS A 165 -10.854 3.969 -9.326 1.00 52.23 H new ATOM 0 HD2 HIS A 165 -10.777 4.398 -5.160 1.00 62.32 H new ATOM 0 HE1 HIS A 165 -12.776 2.569 -8.424 1.00 23.23 H new ATOM 2146 N CYS A 166 -8.425 8.605 -8.956 1.00 13.10 N ATOM 2147 CA CYS A 166 -8.001 9.951 -8.587 1.00 11.45 C ATOM 2148 C CYS A 166 -6.966 9.907 -7.467 1.00 0.14 C ATOM 2149 O CYS A 166 -6.697 10.918 -6.818 1.00 11.02 O ATOM 2150 CB CYS A 166 -9.205 10.786 -8.151 1.00 51.41 C ATOM 2151 SG CYS A 166 -9.030 12.558 -8.470 1.00 23.14 S ATOM 0 H CYS A 166 -8.196 8.338 -9.913 1.00 13.10 H new ATOM 0 HA CYS A 166 -7.544 10.414 -9.462 1.00 11.45 H new ATOM 0 HB2 CYS A 166 -10.093 10.421 -8.667 1.00 51.41 H new ATOM 0 HB3 CYS A 166 -9.372 10.635 -7.084 1.00 51.41 H new ATOM 0 HG CYS A 166 -10.099 13.179 -8.069 1.00 23.14 H new ATOM 2156 N ILE A 167 -6.389 8.730 -7.247 1.00 54.05 N ATOM 2157 CA ILE A 167 -5.386 8.556 -6.205 1.00 23.31 C ATOM 2158 C ILE A 167 -4.115 9.333 -6.531 1.00 32.00 C ATOM 2159 O ILE A 167 -3.582 10.053 -5.687 1.00 63.41 O ATOM 2160 CB ILE A 167 -5.029 7.069 -6.011 1.00 74.12 C ATOM 2161 CG1 ILE A 167 -6.301 6.228 -5.898 1.00 52.11 C ATOM 2162 CG2 ILE A 167 -4.158 6.891 -4.776 1.00 50.24 C ATOM 2163 CD1 ILE A 167 -7.217 6.664 -4.777 1.00 70.21 C ATOM 0 H ILE A 167 -6.599 7.884 -7.776 1.00 54.05 H new ATOM 0 HA ILE A 167 -5.819 8.942 -5.282 1.00 23.31 H new ATOM 0 HB ILE A 167 -4.467 6.728 -6.881 1.00 74.12 H new ATOM 0 HG12 ILE A 167 -6.845 6.279 -6.841 1.00 52.11 H new ATOM 0 HG13 ILE A 167 -6.025 5.185 -5.745 1.00 52.11 H new ATOM 0 HG21 ILE A 167 -3.914 5.836 -4.652 1.00 50.24 H new ATOM 0 HG22 ILE A 167 -3.239 7.465 -4.893 1.00 50.24 H new ATOM 0 HG23 ILE A 167 -4.697 7.245 -3.897 1.00 50.24 H new ATOM 0 HD11 ILE A 167 -8.098 6.023 -4.757 1.00 70.21 H new ATOM 0 HD12 ILE A 167 -6.690 6.587 -3.826 1.00 70.21 H new ATOM 0 HD13 ILE A 167 -7.524 7.697 -4.939 1.00 70.21 H new ATOM 2174 N ALA A 168 -3.636 9.185 -7.761 1.00 44.00 N ATOM 2175 CA ALA A 168 -2.430 9.877 -8.200 1.00 45.54 C ATOM 2176 C ALA A 168 -2.513 11.369 -7.899 1.00 12.12 C ATOM 2177 O ALA A 168 -1.597 11.945 -7.312 1.00 4.53 O ATOM 2178 CB ALA A 168 -2.202 9.648 -9.687 1.00 41.24 C ATOM 0 H ALA A 168 -4.064 8.592 -8.472 1.00 44.00 H new ATOM 0 HA ALA A 168 -1.584 9.468 -7.647 1.00 45.54 H new ATOM 0 HB1 ALA A 168 -1.298 10.170 -10.001 1.00 41.24 H new ATOM 0 HB2 ALA A 168 -2.089 8.581 -9.878 1.00 41.24 H new ATOM 0 HB3 ALA A 168 -3.055 10.029 -10.249 1.00 41.24 H new ATOM 2184 N ARG A 169 -3.615 11.990 -8.305 1.00 65.53 N ATOM 2185 CA ARG A 169 -3.817 13.416 -8.079 1.00 4.05 C ATOM 2186 C ARG A 169 -3.674 13.758 -6.599 1.00 34.33 C ATOM 2187 O ARG A 169 -3.019 14.737 -6.238 1.00 44.34 O ATOM 2188 CB ARG A 169 -5.196 13.844 -8.582 1.00 33.42 C ATOM 2189 CG ARG A 169 -5.334 13.801 -10.095 1.00 24.21 C ATOM 2190 CD ARG A 169 -4.726 15.033 -10.745 1.00 14.30 C ATOM 2191 NE ARG A 169 -4.841 14.997 -12.200 1.00 13.23 N ATOM 2192 CZ ARG A 169 -4.485 16.004 -12.991 1.00 51.24 C ATOM 2193 NH1 ARG A 169 -3.996 17.120 -12.469 1.00 3.14 N ATOM 2194 NH2 ARG A 169 -4.620 15.896 -14.307 1.00 73.44 N ATOM 0 H ARG A 169 -4.382 11.528 -8.793 1.00 65.53 H new ATOM 0 HA ARG A 169 -3.052 13.958 -8.635 1.00 4.05 H new ATOM 0 HB2 ARG A 169 -5.952 13.196 -8.138 1.00 33.42 H new ATOM 0 HB3 ARG A 169 -5.401 14.857 -8.236 1.00 33.42 H new ATOM 0 HG2 ARG A 169 -4.845 12.906 -10.481 1.00 24.21 H new ATOM 0 HG3 ARG A 169 -6.388 13.729 -10.363 1.00 24.21 H new ATOM 0 HD2 ARG A 169 -5.222 15.926 -10.364 1.00 14.30 H new ATOM 0 HD3 ARG A 169 -3.675 15.109 -10.466 1.00 14.30 H new ATOM 0 HE ARG A 169 -5.215 14.153 -12.633 1.00 13.23 H new ATOM 0 HH11 ARG A 169 -3.892 17.207 -11.458 1.00 3.14 H new ATOM 0 HH12 ARG A 169 -3.724 17.891 -13.078 1.00 3.14 H new ATOM 0 HH21 ARG A 169 -4.997 15.039 -14.712 1.00 73.44 H new ATOM 0 HH22 ARG A 169 -4.346 16.670 -14.913 1.00 73.44 H new ATOM 2205 N TRP A 170 -4.290 12.946 -5.748 1.00 74.14 N ATOM 2206 CA TRP A 170 -4.233 13.164 -4.306 1.00 50.20 C ATOM 2207 C TRP A 170 -2.788 13.195 -3.819 1.00 72.43 C ATOM 2208 O TRP A 170 -2.379 14.124 -3.122 1.00 41.03 O ATOM 2209 CB TRP A 170 -5.008 12.068 -3.573 1.00 52.13 C ATOM 2210 CG TRP A 170 -4.933 12.184 -2.081 1.00 62.51 C ATOM 2211 CD1 TRP A 170 -5.807 12.843 -1.265 1.00 34.30 C ATOM 2212 CD2 TRP A 170 -3.927 11.627 -1.228 1.00 41.32 C ATOM 2213 NE1 TRP A 170 -5.406 12.728 0.045 1.00 15.54 N ATOM 2214 CE2 TRP A 170 -4.256 11.986 0.094 1.00 15.24 C ATOM 2215 CE3 TRP A 170 -2.782 10.858 -1.451 1.00 45.33 C ATOM 2216 CZ2 TRP A 170 -3.479 11.604 1.184 1.00 62.31 C ATOM 2217 CZ3 TRP A 170 -2.012 10.479 -0.368 1.00 41.13 C ATOM 2218 CH2 TRP A 170 -2.363 10.851 0.936 1.00 74.22 C ATOM 0 H TRP A 170 -4.835 12.131 -6.030 1.00 74.14 H new ATOM 0 HA TRP A 170 -4.691 14.129 -4.090 1.00 50.20 H new ATOM 0 HB2 TRP A 170 -6.053 12.104 -3.881 1.00 52.13 H new ATOM 0 HB3 TRP A 170 -4.620 11.095 -3.875 1.00 52.13 H new ATOM 0 HD1 TRP A 170 -6.685 13.376 -1.599 1.00 34.30 H new ATOM 0 HE1 TRP A 170 -5.887 13.130 0.850 1.00 15.54 H new ATOM 0 HE3 TRP A 170 -2.504 10.565 -2.452 1.00 45.33 H new ATOM 0 HZ2 TRP A 170 -3.747 11.892 2.190 1.00 62.31 H new ATOM 0 HZ3 TRP A 170 -1.124 9.886 -0.530 1.00 41.13 H new ATOM 0 HH2 TRP A 170 -1.741 10.538 1.762 1.00 74.22 H new ATOM 2228 N ILE A 171 -2.021 12.175 -4.188 1.00 73.12 N ATOM 2229 CA ILE A 171 -0.623 12.088 -3.788 1.00 62.40 C ATOM 2230 C ILE A 171 0.153 13.326 -4.226 1.00 45.24 C ATOM 2231 O ILE A 171 0.942 13.878 -3.462 1.00 30.24 O ATOM 2232 CB ILE A 171 0.055 10.836 -4.377 1.00 53.14 C ATOM 2233 CG1 ILE A 171 -0.446 9.577 -3.666 1.00 25.21 C ATOM 2234 CG2 ILE A 171 1.567 10.950 -4.264 1.00 45.10 C ATOM 2235 CD1 ILE A 171 0.198 8.303 -4.168 1.00 11.20 C ATOM 0 H ILE A 171 -2.344 11.397 -4.763 1.00 73.12 H new ATOM 0 HA ILE A 171 -0.610 12.020 -2.700 1.00 62.40 H new ATOM 0 HB ILE A 171 -0.205 10.762 -5.433 1.00 53.14 H new ATOM 0 HG12 ILE A 171 -0.257 9.674 -2.597 1.00 25.21 H new ATOM 0 HG13 ILE A 171 -1.526 9.503 -3.793 1.00 25.21 H new ATOM 0 HG21 ILE A 171 2.032 10.058 -4.684 1.00 45.10 H new ATOM 0 HG22 ILE A 171 1.908 11.829 -4.812 1.00 45.10 H new ATOM 0 HG23 ILE A 171 1.847 11.045 -3.215 1.00 45.10 H new ATOM 0 HD11 ILE A 171 -0.204 7.451 -3.620 1.00 11.20 H new ATOM 0 HD12 ILE A 171 -0.013 8.183 -5.231 1.00 11.20 H new ATOM 0 HD13 ILE A 171 1.276 8.356 -4.016 1.00 11.20 H new ATOM 2246 N ALA A 172 -0.080 13.756 -5.462 1.00 62.42 N ATOM 2247 CA ALA A 172 0.594 14.931 -6.001 1.00 65.20 C ATOM 2248 C ALA A 172 0.246 16.179 -5.199 1.00 62.42 C ATOM 2249 O ALA A 172 1.087 17.057 -5.006 1.00 72.14 O ATOM 2250 CB ALA A 172 0.227 15.123 -7.466 1.00 21.44 C ATOM 0 H ALA A 172 -0.730 13.309 -6.108 1.00 62.42 H new ATOM 0 HA ALA A 172 1.669 14.770 -5.925 1.00 65.20 H new ATOM 0 HB1 ALA A 172 0.737 16.004 -7.856 1.00 21.44 H new ATOM 0 HB2 ALA A 172 0.532 14.245 -8.036 1.00 21.44 H new ATOM 0 HB3 ALA A 172 -0.851 15.258 -7.556 1.00 21.44 H new ATOM 2256 N GLN A 173 -0.997 16.251 -4.734 1.00 73.00 N ATOM 2257 CA GLN A 173 -1.455 17.394 -3.953 1.00 11.21 C ATOM 2258 C GLN A 173 -0.812 17.402 -2.570 1.00 50.22 C ATOM 2259 O GLN A 173 -0.510 18.462 -2.021 1.00 64.35 O ATOM 2260 CB GLN A 173 -2.979 17.370 -3.820 1.00 11.15 C ATOM 2261 CG GLN A 173 -3.705 17.335 -5.154 1.00 45.44 C ATOM 2262 CD GLN A 173 -4.318 18.672 -5.521 1.00 61.25 C ATOM 2263 OE1 GLN A 173 -4.844 19.383 -4.663 1.00 40.10 O ATOM 2264 NE2 GLN A 173 -4.255 19.022 -6.799 1.00 45.54 N ATOM 0 H GLN A 173 -1.705 15.532 -4.884 1.00 73.00 H new ATOM 0 HA GLN A 173 -1.157 18.302 -4.477 1.00 11.21 H new ATOM 0 HB2 GLN A 173 -3.271 16.498 -3.234 1.00 11.15 H new ATOM 0 HB3 GLN A 173 -3.301 18.250 -3.264 1.00 11.15 H new ATOM 0 HG2 GLN A 173 -3.007 17.033 -5.935 1.00 45.44 H new ATOM 0 HG3 GLN A 173 -4.489 16.578 -5.117 1.00 45.44 H new ATOM 0 HE21 GLN A 173 -3.810 18.402 -7.476 1.00 45.54 H new ATOM 0 HE22 GLN A 173 -4.652 19.911 -7.105 1.00 45.54 H new ATOM 2271 N ARG A 174 -0.604 16.213 -2.012 1.00 50.53 N ATOM 2272 CA ARG A 174 0.001 16.083 -0.694 1.00 31.55 C ATOM 2273 C ARG A 174 1.509 16.308 -0.763 1.00 42.30 C ATOM 2274 O ARG A 174 2.194 16.313 0.259 1.00 22.12 O ATOM 2275 CB ARG A 174 -0.292 14.701 -0.108 1.00 71.33 C ATOM 2276 CG ARG A 174 -1.775 14.366 -0.051 1.00 21.03 C ATOM 2277 CD ARG A 174 -2.370 14.697 1.308 1.00 13.25 C ATOM 2278 NE ARG A 174 -2.594 16.132 1.472 1.00 21.40 N ATOM 2279 CZ ARG A 174 -2.724 16.725 2.654 1.00 43.01 C ATOM 2280 NH1 ARG A 174 -2.651 16.011 3.769 1.00 51.11 N ATOM 2281 NH2 ARG A 174 -2.926 18.034 2.722 1.00 34.43 N ATOM 0 H ARG A 174 -0.846 15.326 -2.454 1.00 50.53 H new ATOM 0 HA ARG A 174 -0.434 16.844 -0.046 1.00 31.55 H new ATOM 0 HB2 ARG A 174 0.220 13.946 -0.705 1.00 71.33 H new ATOM 0 HB3 ARG A 174 0.123 14.647 0.898 1.00 71.33 H new ATOM 0 HG2 ARG A 174 -2.304 14.921 -0.826 1.00 21.03 H new ATOM 0 HG3 ARG A 174 -1.918 13.307 -0.264 1.00 21.03 H new ATOM 0 HD2 ARG A 174 -3.314 14.166 1.429 1.00 13.25 H new ATOM 0 HD3 ARG A 174 -1.702 14.342 2.093 1.00 13.25 H new ATOM 0 HE ARG A 174 -2.654 16.710 0.633 1.00 21.40 H new ATOM 0 HH11 ARG A 174 -2.495 15.004 3.721 1.00 51.11 H new ATOM 0 HH12 ARG A 174 -2.751 16.469 4.675 1.00 51.11 H new ATOM 0 HH21 ARG A 174 -2.982 18.587 1.866 1.00 34.43 H new ATOM 0 HH22 ARG A 174 -3.026 18.488 3.630 1.00 34.43 H new ATOM 2292 N GLY A 175 2.020 16.492 -1.977 1.00 53.34 N ATOM 2293 CA GLY A 175 3.442 16.714 -2.157 1.00 3.31 C ATOM 2294 C GLY A 175 4.141 15.521 -2.780 1.00 71.31 C ATOM 2295 O GLY A 175 5.272 15.198 -2.420 1.00 10.53 O ATOM 0 H GLY A 175 1.474 16.491 -2.839 1.00 53.34 H new ATOM 0 HA2 GLY A 175 3.593 17.590 -2.788 1.00 3.31 H new ATOM 0 HA3 GLY A 175 3.897 16.935 -1.191 1.00 3.31 H new ATOM 2299 N GLY A 176 3.463 14.861 -3.714 1.00 14.21 N ATOM 2300 CA GLY A 176 4.040 13.703 -4.371 1.00 71.02 C ATOM 2301 C GLY A 176 4.569 12.681 -3.385 1.00 35.11 C ATOM 2302 O GLY A 176 4.334 12.791 -2.182 1.00 51.02 O ATOM 0 H GLY A 176 2.524 15.108 -4.027 1.00 14.21 H new ATOM 0 HA2 GLY A 176 3.286 13.236 -5.005 1.00 71.02 H new ATOM 0 HA3 GLY A 176 4.850 14.026 -5.025 1.00 71.02 H new ATOM 2306 N TRP A 177 5.282 11.684 -3.894 1.00 10.32 N ATOM 2307 CA TRP A 177 5.845 10.637 -3.049 1.00 44.22 C ATOM 2308 C TRP A 177 7.023 11.165 -2.239 1.00 31.33 C ATOM 2309 O TRP A 177 7.542 10.477 -1.360 1.00 32.32 O ATOM 2310 CB TRP A 177 6.289 9.447 -3.903 1.00 11.51 C ATOM 2311 CG TRP A 177 5.145 8.630 -4.423 1.00 10.04 C ATOM 2312 CD1 TRP A 177 4.570 8.718 -5.659 1.00 31.04 C ATOM 2313 CD2 TRP A 177 4.439 7.601 -3.722 1.00 72.55 C ATOM 2314 NE1 TRP A 177 3.548 7.806 -5.767 1.00 2.41 N ATOM 2315 CE2 TRP A 177 3.447 7.109 -4.593 1.00 60.21 C ATOM 2316 CE3 TRP A 177 4.547 7.048 -2.443 1.00 45.45 C ATOM 2317 CZ2 TRP A 177 2.572 6.091 -4.224 1.00 23.11 C ATOM 2318 CZ3 TRP A 177 3.677 6.037 -2.079 1.00 13.23 C ATOM 2319 CH2 TRP A 177 2.701 5.567 -2.966 1.00 54.15 C ATOM 0 H TRP A 177 5.484 11.578 -4.888 1.00 10.32 H new ATOM 0 HA TRP A 177 5.070 10.309 -2.356 1.00 44.22 H new ATOM 0 HB2 TRP A 177 6.877 9.812 -4.745 1.00 11.51 H new ATOM 0 HB3 TRP A 177 6.943 8.808 -3.310 1.00 11.51 H new ATOM 0 HD1 TRP A 177 4.874 9.403 -6.437 1.00 31.04 H new ATOM 0 HE1 TRP A 177 2.960 7.670 -6.589 1.00 2.41 H new ATOM 0 HE3 TRP A 177 5.296 7.404 -1.752 1.00 45.45 H new ATOM 0 HZ2 TRP A 177 1.818 5.727 -4.906 1.00 23.11 H new ATOM 0 HZ3 TRP A 177 3.752 5.602 -1.093 1.00 13.23 H new ATOM 0 HH2 TRP A 177 2.037 4.776 -2.652 1.00 54.15 H new ATOM 2329 N VAL A 178 7.441 12.390 -2.540 1.00 51.33 N ATOM 2330 CA VAL A 178 8.558 13.011 -1.838 1.00 2.11 C ATOM 2331 C VAL A 178 8.116 13.575 -0.492 1.00 3.31 C ATOM 2332 O VAL A 178 8.922 14.127 0.256 1.00 1.35 O ATOM 2333 CB VAL A 178 9.188 14.141 -2.674 1.00 5.03 C ATOM 2334 CG1 VAL A 178 10.529 14.555 -2.087 1.00 12.21 C ATOM 2335 CG2 VAL A 178 9.343 13.707 -4.124 1.00 42.13 C ATOM 0 H VAL A 178 7.023 12.972 -3.266 1.00 51.33 H new ATOM 0 HA VAL A 178 9.302 12.231 -1.675 1.00 2.11 H new ATOM 0 HB VAL A 178 8.524 15.005 -2.646 1.00 5.03 H new ATOM 0 HG11 VAL A 178 10.959 15.354 -2.691 1.00 12.21 H new ATOM 0 HG12 VAL A 178 10.386 14.908 -1.066 1.00 12.21 H new ATOM 0 HG13 VAL A 178 11.204 13.699 -2.083 1.00 12.21 H new ATOM 0 HG21 VAL A 178 9.790 14.517 -4.701 1.00 42.13 H new ATOM 0 HG22 VAL A 178 9.986 12.829 -4.174 1.00 42.13 H new ATOM 0 HG23 VAL A 178 8.364 13.464 -4.538 1.00 42.13 H new ATOM 2345 N ALA A 179 6.829 13.433 -0.191 1.00 24.13 N ATOM 2346 CA ALA A 179 6.280 13.926 1.065 1.00 13.11 C ATOM 2347 C ALA A 179 6.462 12.905 2.183 1.00 44.15 C ATOM 2348 O ALA A 179 6.323 13.229 3.362 1.00 1.24 O ATOM 2349 CB ALA A 179 4.808 14.272 0.898 1.00 62.33 C ATOM 0 H ALA A 179 6.148 12.980 -0.800 1.00 24.13 H new ATOM 0 HA ALA A 179 6.825 14.829 1.341 1.00 13.11 H new ATOM 0 HB1 ALA A 179 4.411 14.639 1.844 1.00 62.33 H new ATOM 0 HB2 ALA A 179 4.700 15.043 0.135 1.00 62.33 H new ATOM 0 HB3 ALA A 179 4.257 13.382 0.594 1.00 62.33 H new ATOM 2355 N ALA A 180 6.772 11.670 1.804 1.00 65.21 N ATOM 2356 CA ALA A 180 6.974 10.601 2.774 1.00 5.04 C ATOM 2357 C ALA A 180 8.024 10.991 3.810 1.00 44.34 C ATOM 2358 O ALA A 180 7.853 10.745 5.005 1.00 72.14 O ATOM 2359 CB ALA A 180 7.380 9.316 2.068 1.00 22.03 C ATOM 0 H ALA A 180 6.889 11.385 0.832 1.00 65.21 H new ATOM 0 HA ALA A 180 6.031 10.434 3.294 1.00 5.04 H new ATOM 0 HB1 ALA A 180 7.527 8.527 2.805 1.00 22.03 H new ATOM 0 HB2 ALA A 180 6.596 9.020 1.371 1.00 22.03 H new ATOM 0 HB3 ALA A 180 8.308 9.479 1.521 1.00 22.03 H new ATOM 2365 N LEU A 181 9.110 11.599 3.345 1.00 41.33 N ATOM 2366 CA LEU A 181 10.188 12.023 4.231 1.00 71.40 C ATOM 2367 C LEU A 181 9.708 13.108 5.191 1.00 25.13 C ATOM 2368 O LEU A 181 10.369 13.404 6.186 1.00 54.20 O ATOM 2369 CB LEU A 181 11.374 12.537 3.414 1.00 42.32 C ATOM 2370 CG LEU A 181 11.032 13.436 2.225 1.00 72.45 C ATOM 2371 CD1 LEU A 181 10.351 14.711 2.700 1.00 1.14 C ATOM 2372 CD2 LEU A 181 12.284 13.763 1.425 1.00 62.43 C ATOM 0 H LEU A 181 9.267 11.809 2.359 1.00 41.33 H new ATOM 0 HA LEU A 181 10.505 11.160 4.816 1.00 71.40 H new ATOM 0 HB2 LEU A 181 12.037 13.088 4.081 1.00 42.32 H new ATOM 0 HB3 LEU A 181 11.934 11.678 3.045 1.00 42.32 H new ATOM 0 HG LEU A 181 10.341 12.900 1.575 1.00 72.45 H new ATOM 0 HD11 LEU A 181 10.115 15.339 1.841 1.00 1.14 H new ATOM 0 HD12 LEU A 181 9.432 14.457 3.228 1.00 1.14 H new ATOM 0 HD13 LEU A 181 11.018 15.251 3.372 1.00 1.14 H new ATOM 0 HD21 LEU A 181 12.021 14.403 0.583 1.00 62.43 H new ATOM 0 HD22 LEU A 181 13.000 14.280 2.064 1.00 62.43 H new ATOM 0 HD23 LEU A 181 12.730 12.840 1.053 1.00 62.43 H new ATOM 2383 N ASN A 182 8.555 13.692 4.886 1.00 33.53 N ATOM 2384 CA ASN A 182 7.986 14.743 5.723 1.00 32.44 C ATOM 2385 C ASN A 182 6.898 14.184 6.634 1.00 51.42 C ATOM 2386 O ASN A 182 5.992 14.906 7.052 1.00 43.21 O ATOM 2387 CB ASN A 182 7.414 15.863 4.852 1.00 74.01 C ATOM 2388 CG ASN A 182 7.862 17.238 5.311 1.00 2.31 C ATOM 2389 OD1 ASN A 182 7.828 17.550 6.501 1.00 63.42 O ATOM 2390 ND2 ASN A 182 8.285 18.068 4.364 1.00 53.15 N ATOM 0 H ASN A 182 7.996 13.456 4.066 1.00 33.53 H new ATOM 0 HA ASN A 182 8.783 15.148 6.347 1.00 32.44 H new ATOM 0 HB2 ASN A 182 7.723 15.709 3.818 1.00 74.01 H new ATOM 0 HB3 ASN A 182 6.325 15.814 4.870 1.00 74.01 H new ATOM 0 HD21 ASN A 182 8.599 19.007 4.611 1.00 53.15 H new ATOM 0 HD22 ASN A 182 8.296 17.767 3.390 1.00 53.15 H new ATOM 2396 N LEU A 183 6.993 12.894 6.937 1.00 52.03 N ATOM 2397 CA LEU A 183 6.016 12.237 7.799 1.00 3.02 C ATOM 2398 C LEU A 183 6.599 11.979 9.184 1.00 10.15 C ATOM 2399 O LEU A 183 7.604 12.577 9.568 1.00 51.21 O ATOM 2400 CB LEU A 183 5.558 10.919 7.172 1.00 20.11 C ATOM 2401 CG LEU A 183 4.880 11.026 5.805 1.00 20.11 C ATOM 2402 CD1 LEU A 183 4.197 9.716 5.445 1.00 62.24 C ATOM 2403 CD2 LEU A 183 3.879 12.172 5.795 1.00 54.11 C ATOM 0 H LEU A 183 7.736 12.282 6.599 1.00 52.03 H new ATOM 0 HA LEU A 183 5.157 12.900 7.904 1.00 3.02 H new ATOM 0 HB2 LEU A 183 6.425 10.265 7.075 1.00 20.11 H new ATOM 0 HB3 LEU A 183 4.867 10.433 7.861 1.00 20.11 H new ATOM 0 HG LEU A 183 5.645 11.231 5.056 1.00 20.11 H new ATOM 0 HD11 LEU A 183 3.720 9.810 4.469 1.00 62.24 H new ATOM 0 HD12 LEU A 183 4.938 8.917 5.411 1.00 62.24 H new ATOM 0 HD13 LEU A 183 3.443 9.480 6.196 1.00 62.24 H new ATOM 0 HD21 LEU A 183 3.406 12.234 4.815 1.00 54.11 H new ATOM 0 HD22 LEU A 183 3.118 11.997 6.555 1.00 54.11 H new ATOM 0 HD23 LEU A 183 4.395 13.108 6.008 1.00 54.11 H new ATOM 2414 N GLY A 184 5.963 11.082 9.932 1.00 42.45 N ATOM 2415 CA GLY A 184 6.434 10.758 11.265 1.00 31.42 C ATOM 2416 C GLY A 184 7.941 10.607 11.327 1.00 12.20 C ATOM 2417 O GLY A 184 8.653 11.556 11.651 1.00 43.20 O ATOM 0 H GLY A 184 5.129 10.574 9.637 1.00 42.45 H new ATOM 0 HA2 GLY A 184 6.122 11.540 11.957 1.00 31.42 H new ATOM 0 HA3 GLY A 184 5.965 9.832 11.597 1.00 31.42 H new ATOM 2421 N ASN A 185 8.428 9.409 11.017 1.00 55.34 N ATOM 2422 CA ASN A 185 9.860 9.137 11.041 1.00 43.32 C ATOM 2423 C ASN A 185 10.561 9.811 9.865 1.00 21.24 C ATOM 2424 O ASN A 185 11.789 9.832 9.791 1.00 34.33 O ATOM 2425 CB ASN A 185 10.113 7.628 11.003 1.00 31.44 C ATOM 2426 CG ASN A 185 10.908 7.146 12.203 1.00 52.41 C ATOM 2427 OD1 ASN A 185 12.108 6.888 12.102 1.00 72.43 O ATOM 2428 ND2 ASN A 185 10.240 7.023 13.344 1.00 52.32 N ATOM 0 H ASN A 185 7.852 8.612 10.746 1.00 55.34 H new ATOM 0 HA ASN A 185 10.268 9.545 11.966 1.00 43.32 H new ATOM 0 HB2 ASN A 185 9.159 7.103 10.968 1.00 31.44 H new ATOM 0 HB3 ASN A 185 10.650 7.375 10.089 1.00 31.44 H new ATOM 0 HD21 ASN A 185 10.721 6.703 14.185 1.00 52.32 H new ATOM 0 HD22 ASN A 185 9.246 7.249 13.380 1.00 52.32 H new ATOM 2434 N GLY A 186 9.772 10.361 8.948 1.00 13.30 N ATOM 2435 CA GLY A 186 10.335 11.029 7.789 1.00 42.34 C ATOM 2436 C GLY A 186 11.370 10.181 7.077 1.00 31.11 C ATOM 2437 O GLY A 186 12.563 10.444 7.225 1.00 1.54 O ATOM 0 H GLY A 186 8.753 10.356 8.987 1.00 13.30 H new ATOM 0 HA2 GLY A 186 9.534 11.280 7.093 1.00 42.34 H new ATOM 0 HA3 GLY A 186 10.792 11.968 8.101 1.00 42.34 H new TER 2441 GLY A 186 ATOM 2442 N GLU B 80 -18.855 -15.184 -1.169 1.00 73.01 N ATOM 2443 CA GLU B 80 -19.797 -14.105 -0.892 1.00 3.22 C ATOM 2444 C GLU B 80 -19.461 -13.414 0.426 1.00 63.41 C ATOM 2445 O GLU B 80 -19.139 -12.227 0.453 1.00 73.13 O ATOM 2446 CB GLU B 80 -21.228 -14.646 -0.849 1.00 34.45 C ATOM 2447 CG GLU B 80 -22.254 -13.704 -1.457 1.00 22.12 C ATOM 2448 CD GLU B 80 -23.660 -14.267 -1.414 1.00 61.15 C ATOM 2449 OE1 GLU B 80 -23.822 -15.431 -0.988 1.00 12.03 O ATOM 2450 OE2 GLU B 80 -24.600 -13.545 -1.805 1.00 53.02 O ATOM 0 HA GLU B 80 -19.718 -13.373 -1.695 1.00 3.22 H new ATOM 0 HB2 GLU B 80 -21.263 -15.598 -1.378 1.00 34.45 H new ATOM 0 HB3 GLU B 80 -21.501 -14.847 0.187 1.00 34.45 H new ATOM 0 HG2 GLU B 80 -22.231 -12.754 -0.923 1.00 22.12 H new ATOM 0 HG3 GLU B 80 -21.982 -13.495 -2.492 1.00 22.12 H new ATOM 2455 N ASP B 81 -19.540 -14.167 1.518 1.00 44.11 N ATOM 2456 CA ASP B 81 -19.244 -13.629 2.841 1.00 62.12 C ATOM 2457 C ASP B 81 -17.852 -13.009 2.876 1.00 11.02 C ATOM 2458 O ASP B 81 -17.581 -12.112 3.676 1.00 72.33 O ATOM 2459 CB ASP B 81 -19.352 -14.730 3.898 1.00 52.55 C ATOM 2460 CG ASP B 81 -18.361 -15.853 3.668 1.00 22.13 C ATOM 2461 OD1 ASP B 81 -17.160 -15.653 3.949 1.00 54.24 O ATOM 2462 OD2 ASP B 81 -18.786 -16.934 3.209 1.00 13.44 O ATOM 0 H ASP B 81 -19.806 -15.152 1.513 1.00 44.11 H new ATOM 0 HA ASP B 81 -19.974 -12.851 3.062 1.00 62.12 H new ATOM 0 HB2 ASP B 81 -19.186 -14.299 4.885 1.00 52.55 H new ATOM 0 HB3 ASP B 81 -20.364 -15.136 3.894 1.00 52.55 H new ATOM 2466 N ILE B 82 -16.971 -13.492 2.006 1.00 52.25 N ATOM 2467 CA ILE B 82 -15.607 -12.983 1.938 1.00 44.34 C ATOM 2468 C ILE B 82 -15.548 -11.668 1.167 1.00 64.14 C ATOM 2469 O ILE B 82 -14.689 -10.825 1.425 1.00 23.52 O ATOM 2470 CB ILE B 82 -14.660 -13.999 1.271 1.00 53.25 C ATOM 2471 CG1 ILE B 82 -13.204 -13.658 1.591 1.00 0.02 C ATOM 2472 CG2 ILE B 82 -14.886 -14.024 -0.234 1.00 23.01 C ATOM 2473 CD1 ILE B 82 -12.526 -12.835 0.517 1.00 22.40 C ATOM 0 H ILE B 82 -17.178 -14.235 1.339 1.00 52.25 H new ATOM 0 HA ILE B 82 -15.282 -12.814 2.965 1.00 44.34 H new ATOM 0 HB ILE B 82 -14.876 -14.991 1.668 1.00 53.25 H new ATOM 0 HG12 ILE B 82 -13.166 -13.112 2.534 1.00 0.02 H new ATOM 0 HG13 ILE B 82 -12.646 -14.583 1.735 1.00 0.02 H new ATOM 0 HG21 ILE B 82 -14.210 -14.746 -0.691 1.00 23.01 H new ATOM 0 HG22 ILE B 82 -15.917 -14.310 -0.442 1.00 23.01 H new ATOM 0 HG23 ILE B 82 -14.693 -13.034 -0.647 1.00 23.01 H new ATOM 0 HD11 ILE B 82 -11.496 -12.631 0.811 1.00 22.40 H new ATOM 0 HD12 ILE B 82 -12.532 -13.387 -0.423 1.00 22.40 H new ATOM 0 HD13 ILE B 82 -13.060 -11.894 0.388 1.00 22.40 H new ATOM 2484 N ILE B 83 -16.467 -11.500 0.223 1.00 42.25 N ATOM 2485 CA ILE B 83 -16.521 -10.287 -0.583 1.00 55.13 C ATOM 2486 C ILE B 83 -16.750 -9.058 0.290 1.00 1.33 C ATOM 2487 O ILE B 83 -16.161 -8.001 0.058 1.00 74.43 O ATOM 2488 CB ILE B 83 -17.635 -10.364 -1.643 1.00 45.43 C ATOM 2489 CG1 ILE B 83 -17.401 -11.556 -2.574 1.00 14.42 C ATOM 2490 CG2 ILE B 83 -17.701 -9.068 -2.438 1.00 43.13 C ATOM 2491 CD1 ILE B 83 -16.092 -11.484 -3.329 1.00 24.10 C ATOM 0 H ILE B 83 -17.185 -12.189 -0.003 1.00 42.25 H new ATOM 0 HA ILE B 83 -15.558 -10.199 -1.086 1.00 55.13 H new ATOM 0 HB ILE B 83 -18.590 -10.505 -1.136 1.00 45.43 H new ATOM 0 HG12 ILE B 83 -17.423 -12.475 -1.988 1.00 14.42 H new ATOM 0 HG13 ILE B 83 -18.221 -11.615 -3.289 1.00 14.42 H new ATOM 0 HG21 ILE B 83 -18.493 -9.138 -3.183 1.00 43.13 H new ATOM 0 HG22 ILE B 83 -17.910 -8.238 -1.763 1.00 43.13 H new ATOM 0 HG23 ILE B 83 -16.747 -8.899 -2.937 1.00 43.13 H new ATOM 0 HD11 ILE B 83 -15.992 -12.361 -3.969 1.00 24.10 H new ATOM 0 HD12 ILE B 83 -16.075 -10.583 -3.942 1.00 24.10 H new ATOM 0 HD13 ILE B 83 -15.264 -11.456 -2.620 1.00 24.10 H new ATOM 2502 N ARG B 84 -17.607 -9.203 1.295 1.00 41.31 N ATOM 2503 CA ARG B 84 -17.914 -8.105 2.203 1.00 20.15 C ATOM 2504 C ARG B 84 -16.955 -8.099 3.390 1.00 72.52 C ATOM 2505 O ARG B 84 -16.640 -7.044 3.941 1.00 52.30 O ATOM 2506 CB ARG B 84 -19.356 -8.213 2.700 1.00 41.45 C ATOM 2507 CG ARG B 84 -20.376 -8.356 1.581 1.00 4.10 C ATOM 2508 CD ARG B 84 -20.808 -9.804 1.403 1.00 12.25 C ATOM 2509 NE ARG B 84 -21.115 -10.115 0.009 1.00 60.42 N ATOM 2510 CZ ARG B 84 -22.233 -9.733 -0.598 1.00 44.31 C ATOM 2511 NH1 ARG B 84 -23.143 -9.030 0.060 1.00 72.10 N ATOM 2512 NH2 ARG B 84 -22.441 -10.055 -1.869 1.00 43.34 N ATOM 0 H ARG B 84 -18.101 -10.071 1.501 1.00 41.31 H new ATOM 0 HA ARG B 84 -17.795 -7.170 1.656 1.00 20.15 H new ATOM 0 HB2 ARG B 84 -19.438 -9.071 3.367 1.00 41.45 H new ATOM 0 HB3 ARG B 84 -19.596 -7.327 3.288 1.00 41.45 H new ATOM 0 HG2 ARG B 84 -21.248 -7.739 1.801 1.00 4.10 H new ATOM 0 HG3 ARG B 84 -19.950 -7.985 0.649 1.00 4.10 H new ATOM 0 HD2 ARG B 84 -20.016 -10.465 1.756 1.00 12.25 H new ATOM 0 HD3 ARG B 84 -21.685 -9.999 2.020 1.00 12.25 H new ATOM 0 HE ARG B 84 -20.435 -10.654 -0.527 1.00 60.42 H new ATOM 0 HH11 ARG B 84 -22.986 -8.780 1.036 1.00 72.10 H new ATOM 0 HH12 ARG B 84 -24.000 -8.739 -0.410 1.00 72.10 H new ATOM 0 HH21 ARG B 84 -21.742 -10.596 -2.379 1.00 43.34 H new ATOM 0 HH22 ARG B 84 -23.299 -9.762 -2.335 1.00 43.34 H new ATOM 2523 N ASN B 85 -16.495 -9.283 3.781 1.00 50.34 N ATOM 2524 CA ASN B 85 -15.575 -9.414 4.904 1.00 11.31 C ATOM 2525 C ASN B 85 -14.208 -8.831 4.556 1.00 24.41 C ATOM 2526 O ASN B 85 -13.654 -8.030 5.309 1.00 23.51 O ATOM 2527 CB ASN B 85 -15.429 -10.884 5.302 1.00 42.11 C ATOM 2528 CG ASN B 85 -16.503 -11.328 6.277 1.00 51.32 C ATOM 2529 OD1 ASN B 85 -17.454 -10.595 6.545 1.00 60.33 O ATOM 2530 ND2 ASN B 85 -16.354 -12.535 6.811 1.00 34.21 N ATOM 0 H ASN B 85 -16.745 -10.166 3.336 1.00 50.34 H new ATOM 0 HA ASN B 85 -15.985 -8.856 5.746 1.00 11.31 H new ATOM 0 HB2 ASN B 85 -15.474 -11.506 4.408 1.00 42.11 H new ATOM 0 HB3 ASN B 85 -14.448 -11.041 5.750 1.00 42.11 H new ATOM 0 HD21 ASN B 85 -17.045 -12.889 7.473 1.00 34.21 H new ATOM 0 HD22 ASN B 85 -15.549 -13.108 6.559 1.00 34.21 H new ATOM 2536 N ILE B 86 -13.670 -9.240 3.412 1.00 74.21 N ATOM 2537 CA ILE B 86 -12.370 -8.758 2.965 1.00 13.21 C ATOM 2538 C ILE B 86 -12.337 -7.233 2.911 1.00 61.53 C ATOM 2539 O ILE B 86 -11.280 -6.620 3.055 1.00 22.23 O ATOM 2540 CB ILE B 86 -12.010 -9.316 1.575 1.00 22.40 C ATOM 2541 CG1 ILE B 86 -10.492 -9.307 1.376 1.00 41.02 C ATOM 2542 CG2 ILE B 86 -12.698 -8.508 0.485 1.00 25.34 C ATOM 2543 CD1 ILE B 86 -9.976 -8.045 0.721 1.00 60.14 C ATOM 0 H ILE B 86 -14.115 -9.904 2.778 1.00 74.21 H new ATOM 0 HA ILE B 86 -11.637 -9.110 3.691 1.00 13.21 H new ATOM 0 HB ILE B 86 -12.360 -10.346 1.511 1.00 22.40 H new ATOM 0 HG12 ILE B 86 -10.006 -9.429 2.344 1.00 41.02 H new ATOM 0 HG13 ILE B 86 -10.208 -10.165 0.767 1.00 41.02 H new ATOM 0 HG21 ILE B 86 -12.434 -8.915 -0.491 1.00 25.34 H new ATOM 0 HG22 ILE B 86 -13.778 -8.561 0.620 1.00 25.34 H new ATOM 0 HG23 ILE B 86 -12.376 -7.468 0.544 1.00 25.34 H new ATOM 0 HD11 ILE B 86 -8.893 -8.108 0.612 1.00 60.14 H new ATOM 0 HD12 ILE B 86 -10.434 -7.932 -0.262 1.00 60.14 H new ATOM 0 HD13 ILE B 86 -10.228 -7.184 1.340 1.00 60.14 H new ATOM 2554 N ALA B 87 -13.502 -6.629 2.706 1.00 41.34 N ATOM 2555 CA ALA B 87 -13.608 -5.177 2.637 1.00 43.24 C ATOM 2556 C ALA B 87 -13.884 -4.582 4.014 1.00 33.12 C ATOM 2557 O ALA B 87 -13.364 -3.519 4.356 1.00 51.12 O ATOM 2558 CB ALA B 87 -14.700 -4.773 1.657 1.00 13.23 C ATOM 0 H ALA B 87 -14.386 -7.123 2.585 1.00 41.34 H new ATOM 0 HA ALA B 87 -12.655 -4.784 2.284 1.00 43.24 H new ATOM 0 HB1 ALA B 87 -14.768 -3.686 1.616 1.00 13.23 H new ATOM 0 HB2 ALA B 87 -14.461 -5.160 0.666 1.00 13.23 H new ATOM 0 HB3 ALA B 87 -15.654 -5.184 1.986 1.00 13.23 H new ATOM 2564 N ARG B 88 -14.704 -5.272 4.799 1.00 65.40 N ATOM 2565 CA ARG B 88 -15.049 -4.810 6.138 1.00 12.11 C ATOM 2566 C ARG B 88 -13.857 -4.938 7.082 1.00 61.12 C ATOM 2567 O ARG B 88 -13.782 -4.250 8.101 1.00 52.34 O ATOM 2568 CB ARG B 88 -16.235 -5.607 6.685 1.00 72.41 C ATOM 2569 CG ARG B 88 -15.831 -6.886 7.400 1.00 32.31 C ATOM 2570 CD ARG B 88 -15.732 -6.677 8.903 1.00 3.02 C ATOM 2571 NE ARG B 88 -14.382 -6.922 9.402 1.00 21.34 N ATOM 2572 CZ ARG B 88 -13.951 -6.509 10.589 1.00 62.43 C ATOM 2573 NH1 ARG B 88 -14.761 -5.835 11.394 1.00 32.44 N ATOM 2574 NH2 ARG B 88 -12.708 -6.770 10.974 1.00 45.51 N ATOM 0 H ARG B 88 -15.142 -6.153 4.531 1.00 65.40 H new ATOM 0 HA ARG B 88 -15.326 -3.758 6.072 1.00 12.11 H new ATOM 0 HB2 ARG B 88 -16.798 -4.978 7.374 1.00 72.41 H new ATOM 0 HB3 ARG B 88 -16.905 -5.857 5.862 1.00 72.41 H new ATOM 0 HG2 ARG B 88 -16.560 -7.668 7.188 1.00 32.31 H new ATOM 0 HG3 ARG B 88 -14.871 -7.231 7.016 1.00 32.31 H new ATOM 0 HD2 ARG B 88 -16.029 -5.657 9.147 1.00 3.02 H new ATOM 0 HD3 ARG B 88 -16.432 -7.343 9.408 1.00 3.02 H new ATOM 0 HE ARG B 88 -13.734 -7.438 8.807 1.00 21.34 H new ATOM 0 HH11 ARG B 88 -15.717 -5.633 11.102 1.00 32.44 H new ATOM 0 HH12 ARG B 88 -14.428 -5.519 12.305 1.00 32.44 H new ATOM 0 HH21 ARG B 88 -12.082 -7.289 10.358 1.00 45.51 H new ATOM 0 HH22 ARG B 88 -12.379 -6.452 11.886 1.00 45.51 H new ATOM 2585 N HIS B 89 -12.928 -5.823 6.736 1.00 14.52 N ATOM 2586 CA HIS B 89 -11.739 -6.041 7.553 1.00 10.22 C ATOM 2587 C HIS B 89 -10.780 -4.860 7.443 1.00 0.23 C ATOM 2588 O HIS B 89 -9.998 -4.593 8.357 1.00 42.22 O ATOM 2589 CB HIS B 89 -11.031 -7.328 7.127 1.00 2.01 C ATOM 2590 CG HIS B 89 -10.564 -8.163 8.279 1.00 20.33 C ATOM 2591 ND1 HIS B 89 -11.258 -9.260 8.744 1.00 22.24 N ATOM 2592 CD2 HIS B 89 -9.462 -8.058 9.060 1.00 40.22 C ATOM 2593 CE1 HIS B 89 -10.605 -9.792 9.762 1.00 22.30 C ATOM 2594 NE2 HIS B 89 -9.512 -9.081 9.973 1.00 72.51 N ATOM 0 H HIS B 89 -12.975 -6.400 5.896 1.00 14.52 H new ATOM 0 HA HIS B 89 -12.055 -6.135 8.592 1.00 10.22 H new ATOM 0 HB2 HIS B 89 -11.709 -7.919 6.511 1.00 2.01 H new ATOM 0 HB3 HIS B 89 -10.175 -7.073 6.503 1.00 2.01 H new ATOM 0 HD2 HIS B 89 -8.688 -7.309 8.979 1.00 40.22 H new ATOM 0 HE1 HIS B 89 -10.913 -10.660 10.326 1.00 22.30 H new ATOM 0 HE2 HIS B 89 -8.817 -9.263 10.697 1.00 72.51 H new ATOM 2601 N LEU B 90 -10.843 -4.155 6.319 1.00 42.44 N ATOM 2602 CA LEU B 90 -9.980 -3.002 6.088 1.00 53.02 C ATOM 2603 C LEU B 90 -10.595 -1.735 6.675 1.00 72.14 C ATOM 2604 O LEU B 90 -10.544 -0.668 6.066 1.00 15.02 O ATOM 2605 CB LEU B 90 -9.734 -2.814 4.590 1.00 64.11 C ATOM 2606 CG LEU B 90 -9.663 -4.095 3.756 1.00 31.11 C ATOM 2607 CD1 LEU B 90 -9.262 -3.778 2.324 1.00 21.50 C ATOM 2608 CD2 LEU B 90 -8.687 -5.083 4.379 1.00 74.53 C ATOM 0 H LEU B 90 -11.483 -4.362 5.553 1.00 42.44 H new ATOM 0 HA LEU B 90 -9.028 -3.188 6.586 1.00 53.02 H new ATOM 0 HB2 LEU B 90 -10.529 -2.186 4.188 1.00 64.11 H new ATOM 0 HB3 LEU B 90 -8.800 -2.268 4.461 1.00 64.11 H new ATOM 0 HG LEU B 90 -10.652 -4.552 3.742 1.00 31.11 H new ATOM 0 HD11 LEU B 90 -9.217 -4.701 1.746 1.00 21.50 H new ATOM 0 HD12 LEU B 90 -9.998 -3.108 1.880 1.00 21.50 H new ATOM 0 HD13 LEU B 90 -8.284 -3.298 2.318 1.00 21.50 H new ATOM 0 HD21 LEU B 90 -8.649 -5.988 3.773 1.00 74.53 H new ATOM 0 HD22 LEU B 90 -7.695 -4.635 4.424 1.00 74.53 H new ATOM 0 HD23 LEU B 90 -9.018 -5.335 5.387 1.00 74.53 H new ATOM 2619 N ALA B 91 -11.175 -1.862 7.864 1.00 73.21 N ATOM 2620 CA ALA B 91 -11.796 -0.727 8.537 1.00 72.12 C ATOM 2621 C ALA B 91 -10.813 -0.044 9.480 1.00 33.34 C ATOM 2622 O ALA B 91 -11.123 0.637 10.444 1.00 3.24 O ATOM 2623 CB ALA B 91 -13.035 -1.177 9.297 1.00 23.44 C ATOM 0 H ALA B 91 -11.228 -2.739 8.381 1.00 73.21 H new ATOM 0 HA ALA B 91 -12.093 -0.004 7.778 1.00 72.12 H new ATOM 0 HB1 ALA B 91 -13.488 -0.319 9.794 1.00 23.44 H new ATOM 0 HB2 ALA B 91 -13.751 -1.612 8.600 1.00 23.44 H new ATOM 0 HB3 ALA B 91 -12.754 -1.922 10.042 1.00 23.44 H new HETATM 2629 C MK8 B 92 -7.229 -0.418 9.760 1.00 43.21 C HETATM 2630 N MK8 B 92 -9.517 -0.217 9.210 1.00 64.03 N HETATM 2631 O MK8 B 92 -6.362 -0.210 10.608 1.00 42.11 O HETATM 2632 CA MK8 B 92 -8.624 -0.627 10.331 1.00 72.31 C HETATM 2633 CB MK8 B 92 -8.805 -2.134 10.721 1.00 71.53 C HETATM 2634 CD MK8 B 92 -10.778 -1.852 12.352 1.00 72.43 C HETATM 2635 CE MK8 B 92 -9.648 -1.240 13.145 1.00 30.44 C HETATM 2636 CG MK8 B 92 -10.258 -2.563 11.074 1.00 10.14 C HETATM 2637 CB1 MK8 B 92 -8.591 0.307 11.581 1.00 71.25 C HETATM 0 HB1B MK8 B 92 -7.797 -0.015 12.255 1.00 71.25 H new HETATM 0 HB1A MK8 B 92 -8.404 1.333 11.264 1.00 71.25 H new HETATM 0 HN MK8 B 92 -9.115 0.105 8.330 1.00 64.03 H new HETATM 0 HGA MK8 B 92 -10.918 -2.333 10.237 1.00 10.14 H new HETATM 0 HG MK8 B 92 -10.292 -3.643 11.220 1.00 10.14 H new HETATM 0 HEB MK8 B 92 -8.950 -2.021 13.446 1.00 30.44 H new HETATM 0 HEA MK8 B 92 -9.128 -0.506 12.530 1.00 30.44 H new HETATM 0 HE MK8 B 92 -10.049 -0.751 14.033 1.00 30.44 H new HETATM 0 HDA MK8 B 92 -11.315 -2.568 12.975 1.00 72.43 H new HETATM 0 HD MK8 B 92 -11.490 -1.075 12.073 1.00 72.43 H new HETATM 0 HBA MK8 B 92 -8.453 -2.750 9.894 1.00 71.53 H new HETATM 0 HB1 MK8 B 92 -9.549 0.256 12.099 1.00 71.25 H new HETATM 0 HB MK8 B 92 -8.163 -2.350 11.575 1.00 71.53 H new ATOM 2649 N VAL B 93 -6.971 -0.449 8.456 1.00 63.14 N ATOM 2650 CA VAL B 93 -5.626 -0.236 7.936 1.00 71.15 C ATOM 2651 C VAL B 93 -5.506 1.126 7.264 1.00 51.53 C ATOM 2652 O VAL B 93 -4.406 1.646 7.082 1.00 34.51 O ATOM 2653 CB VAL B 93 -5.234 -1.332 6.926 1.00 34.40 C ATOM 2654 CG1 VAL B 93 -3.722 -1.488 6.868 1.00 73.34 C ATOM 2655 CG2 VAL B 93 -5.902 -2.650 7.285 1.00 23.14 C ATOM 0 H VAL B 93 -7.677 -0.620 7.740 1.00 63.14 H new ATOM 0 HA VAL B 93 -4.947 -0.278 8.788 1.00 71.15 H new ATOM 0 HB VAL B 93 -5.582 -1.033 5.937 1.00 34.40 H new ATOM 0 HG11 VAL B 93 -3.464 -2.266 6.150 1.00 73.34 H new ATOM 0 HG12 VAL B 93 -3.271 -0.545 6.559 1.00 73.34 H new ATOM 0 HG13 VAL B 93 -3.347 -1.765 7.853 1.00 73.34 H new ATOM 0 HG21 VAL B 93 -5.614 -3.413 6.561 1.00 23.14 H new ATOM 0 HG22 VAL B 93 -5.587 -2.958 8.282 1.00 23.14 H new ATOM 0 HG23 VAL B 93 -6.985 -2.525 7.269 1.00 23.14 H new ATOM 2665 N GLY B 94 -6.647 1.702 6.896 1.00 44.52 N ATOM 2666 CA GLY B 94 -6.648 3.000 6.247 1.00 40.22 C ATOM 2667 C GLY B 94 -6.416 4.135 7.224 1.00 51.42 C ATOM 2668 O GLY B 94 -5.420 4.852 7.127 1.00 31.33 O ATOM 0 H GLY B 94 -7.571 1.292 7.036 1.00 44.52 H new ATOM 0 HA2 GLY B 94 -5.874 3.020 5.480 1.00 40.22 H new ATOM 0 HA3 GLY B 94 -7.602 3.149 5.741 1.00 40.22 H new ATOM 2672 N ASP B 95 -7.339 4.302 8.165 1.00 53.21 N ATOM 2673 CA ASP B 95 -7.230 5.360 9.163 1.00 63.34 C ATOM 2674 C ASP B 95 -5.858 5.341 9.828 1.00 22.42 C ATOM 2675 O ASP B 95 -5.023 6.225 9.740 1.00 13.21 O ATOM 2676 CB ASP B 95 -8.325 5.207 10.220 1.00 13.51 C ATOM 2677 CG ASP B 95 -8.816 6.543 10.742 1.00 20.32 C ATOM 2678 OD1 ASP B 95 -8.077 7.541 10.606 1.00 71.53 O ATOM 2679 OD2 ASP B 95 -9.939 6.591 11.286 1.00 62.24 O ATOM 0 H ASP B 95 -8.171 3.719 8.258 1.00 53.21 H new ATOM 0 HA ASP B 95 -7.355 6.317 8.657 1.00 63.34 H new ATOM 0 HB2 ASP B 95 -9.163 4.656 9.793 1.00 13.51 H new ATOM 0 HB3 ASP B 95 -7.944 4.613 11.051 1.00 13.51 H new HETATM 2683 C MK8 B 96 -3.580 4.871 11.670 1.00 24.05 C HETATM 2684 N MK8 B 96 -5.573 4.261 10.559 1.00 12.23 N HETATM 2685 O MK8 B 96 -3.059 5.424 12.636 1.00 33.23 O HETATM 2686 CA MK8 B 96 -5.027 4.477 11.930 1.00 72.34 C HETATM 2687 CB MK8 B 96 -5.064 3.176 12.801 1.00 10.11 C HETATM 2688 CD MK8 B 96 -6.492 1.355 13.931 1.00 54.32 C HETATM 2689 CE MK8 B 96 -7.879 0.768 14.048 1.00 34.11 C HETATM 2690 CG MK8 B 96 -6.410 2.398 12.783 1.00 43.32 C HETATM 2691 CB1 MK8 B 96 -5.727 5.681 12.635 1.00 12.13 C HETATM 0 HB1B MK8 B 96 -5.219 5.898 13.574 1.00 12.13 H new HETATM 0 HB1A MK8 B 96 -5.683 6.557 11.988 1.00 12.13 H new HETATM 0 HGA MK8 B 96 -7.237 3.102 12.872 1.00 43.32 H new HETATM 0 HG MK8 B 96 -6.524 1.892 11.824 1.00 43.32 H new HETATM 0 HEB MK8 B 96 -8.595 1.564 14.254 1.00 34.11 H new HETATM 0 HEA MK8 B 96 -8.145 0.274 13.114 1.00 34.11 H new HETATM 0 HE MK8 B 96 -7.900 0.042 14.861 1.00 34.11 H new HETATM 0 HDA MK8 B 96 -6.215 1.827 14.874 1.00 54.32 H new HETATM 0 HD MK8 B 96 -5.772 0.557 13.751 1.00 54.32 H new HETATM 0 HBA MK8 B 96 -4.273 2.508 12.459 1.00 10.11 H new HETATM 0 HB1 MK8 B 96 -6.769 5.430 12.836 1.00 12.13 H new HETATM 0 HB MK8 B 96 -4.832 3.443 13.832 1.00 10.11 H new HETATM 2703 N NLE B 97 -2.967 4.638 10.518 1.00 60.01 N HETATM 2704 CA NLE B 97 -1.585 5.037 10.311 1.00 53.00 C HETATM 2705 C NLE B 97 -1.464 6.559 10.210 1.00 43.04 C HETATM 2706 O NLE B 97 -0.572 7.182 10.785 1.00 61.14 O HETATM 2707 CB NLE B 97 -1.044 4.387 9.026 1.00 13.20 C HETATM 2708 CG NLE B 97 -1.296 2.870 9.076 1.00 64.14 C HETATM 2709 CD NLE B 97 -1.331 2.310 7.643 1.00 32.42 C HETATM 2710 CE NLE B 97 -0.030 1.535 7.367 1.00 61.11 C HETATM 0 HG3 NLE B 97 -0.511 2.379 9.651 1.00 64.14 H new HETATM 0 HG2 NLE B 97 -2.239 2.663 9.582 1.00 64.14 H new HETATM 0 HE3 NLE B 97 0.823 2.205 7.476 1.00 61.11 H new HETATM 0 HE2 NLE B 97 0.062 0.713 8.077 1.00 61.11 H new HETATM 0 HE1 NLE B 97 -0.052 1.137 6.352 1.00 61.11 H new HETATM 0 HD3 NLE B 97 -2.192 1.654 7.518 1.00 32.42 H new HETATM 0 HD2 NLE B 97 -1.443 3.123 6.925 1.00 32.42 H new HETATM 0 HB3 NLE B 97 -1.533 4.819 8.153 1.00 13.20 H new HETATM 0 HB2 NLE B 97 0.023 4.587 8.926 1.00 13.20 H new HETATM 0 HA NLE B 97 -0.999 4.702 11.166 1.00 53.00 H new ATOM 2722 N ASP B 98 -2.389 7.147 9.459 1.00 2.03 N ATOM 2723 CA ASP B 98 -2.410 8.592 9.263 1.00 61.44 C ATOM 2724 C ASP B 98 -2.382 9.322 10.603 1.00 5.23 C ATOM 2725 O ASP B 98 -1.881 10.442 10.700 1.00 74.22 O ATOM 2726 CB ASP B 98 -3.651 9.003 8.471 1.00 50.02 C ATOM 2727 CG ASP B 98 -3.680 10.489 8.168 1.00 64.50 C ATOM 2728 OD1 ASP B 98 -4.170 11.259 9.021 1.00 0.02 O ATOM 2729 OD2 ASP B 98 -3.211 10.881 7.079 1.00 61.54 O ATOM 0 H ASP B 98 -3.134 6.645 8.976 1.00 2.03 H new ATOM 0 HA ASP B 98 -1.520 8.870 8.698 1.00 61.44 H new ATOM 0 HB2 ASP B 98 -3.683 8.444 7.536 1.00 50.02 H new ATOM 0 HB3 ASP B 98 -4.544 8.733 9.035 1.00 50.02 H new ATOM 2733 N ARG B 99 -2.924 8.679 11.633 1.00 51.34 N ATOM 2734 CA ARG B 99 -2.963 9.268 12.965 1.00 24.31 C ATOM 2735 C ARG B 99 -1.705 8.914 13.754 1.00 53.54 C ATOM 2736 O ARG B 99 -1.352 9.594 14.716 1.00 32.31 O ATOM 2737 CB ARG B 99 -4.203 8.788 13.722 1.00 62.35 C ATOM 2738 CG ARG B 99 -5.510 9.098 13.010 1.00 1.44 C ATOM 2739 CD ARG B 99 -6.242 10.257 13.667 1.00 13.53 C ATOM 2740 NE ARG B 99 -6.786 11.190 12.684 1.00 1.44 N ATOM 2741 CZ ARG B 99 -7.526 12.246 13.002 1.00 33.14 C ATOM 2742 NH1 ARG B 99 -7.807 12.503 14.272 1.00 33.34 N ATOM 2743 NH2 ARG B 99 -7.984 13.048 12.051 1.00 53.42 N ATOM 0 H ARG B 99 -3.342 7.751 11.570 1.00 51.34 H new ATOM 0 HA ARG B 99 -3.009 10.351 12.854 1.00 24.31 H new ATOM 0 HB2 ARG B 99 -4.130 7.711 13.876 1.00 62.35 H new ATOM 0 HB3 ARG B 99 -4.218 9.251 14.709 1.00 62.35 H new ATOM 0 HG2 ARG B 99 -5.309 9.339 11.966 1.00 1.44 H new ATOM 0 HG3 ARG B 99 -6.147 8.214 13.016 1.00 1.44 H new ATOM 0 HD2 ARG B 99 -7.052 9.870 14.286 1.00 13.53 H new ATOM 0 HD3 ARG B 99 -5.559 10.787 14.331 1.00 13.53 H new ATOM 0 HE ARG B 99 -6.586 11.021 11.698 1.00 1.44 H new ATOM 0 HH11 ARG B 99 -7.455 11.889 15.007 1.00 33.34 H new ATOM 0 HH12 ARG B 99 -8.375 13.314 14.514 1.00 33.34 H new ATOM 0 HH21 ARG B 99 -7.768 12.855 11.073 1.00 53.42 H new ATOM 0 HH22 ARG B 99 -8.552 13.859 12.297 1.00 53.42 H new ATOM 2754 N SER B 100 -1.033 7.845 13.337 1.00 60.24 N ATOM 2755 CA SER B 100 0.183 7.398 14.006 1.00 54.22 C ATOM 2756 C SER B 100 1.422 7.867 13.250 1.00 51.12 C ATOM 2757 O SER B 100 2.503 7.296 13.394 1.00 43.02 O ATOM 2758 CB SER B 100 0.192 5.873 14.128 1.00 60.12 C ATOM 2759 OG SER B 100 -0.966 5.409 14.801 1.00 32.34 O ATOM 0 H SER B 100 -1.310 7.273 12.539 1.00 60.24 H new ATOM 0 HA SER B 100 0.201 7.835 15.004 1.00 54.22 H new ATOM 0 HB2 SER B 100 0.243 5.426 13.135 1.00 60.12 H new ATOM 0 HB3 SER B 100 1.083 5.553 14.668 1.00 60.12 H new ATOM 0 HG SER B 100 -1.718 5.378 14.174 1.00 32.34 H new ATOM 2764 N ILE B 101 1.256 8.910 12.444 1.00 31.24 N ATOM 2765 CA ILE B 101 2.361 9.456 11.665 1.00 34.31 C ATOM 2766 C ILE B 101 2.589 10.928 11.994 1.00 3.41 C ATOM 2767 O ILE B 101 3.663 11.452 11.700 1.00 10.31 O ATOM 2768 CB ILE B 101 2.110 9.312 10.153 1.00 63.12 C ATOM 2769 CG1 ILE B 101 0.823 10.038 9.756 1.00 15.05 C ATOM 2770 CG2 ILE B 101 2.035 7.842 9.767 1.00 20.11 C ATOM 2771 CD1 ILE B 101 0.852 10.593 8.348 1.00 62.33 C ATOM 0 H ILE B 101 0.368 9.394 12.313 1.00 31.24 H new ATOM 0 HA ILE B 101 3.249 8.884 11.932 1.00 34.31 H new ATOM 0 HB ILE B 101 2.942 9.767 9.616 1.00 63.12 H new ATOM 0 HG12 ILE B 101 -0.017 9.349 9.849 1.00 15.05 H new ATOM 0 HG13 ILE B 101 0.645 10.854 10.456 1.00 15.05 H new ATOM 0 HG21 ILE B 101 1.857 7.756 8.695 1.00 20.11 H new ATOM 0 HG22 ILE B 101 2.975 7.351 10.019 1.00 20.11 H new ATOM 0 HG23 ILE B 101 1.219 7.365 10.310 1.00 20.11 H new ATOM 0 HD11 ILE B 101 -0.092 11.094 8.135 1.00 62.33 H new ATOM 0 HD12 ILE B 101 1.671 11.307 8.255 1.00 62.33 H new ATOM 0 HD13 ILE B 101 0.999 9.778 7.639 1.00 62.33 H new HETATM 2782 N NH2 B 102 1.587 11.557 12.589 1.00 23.42 N TER 2785 NH2 B 102