USER MOD reduce.3.24.130724 H: found=0, std=0, add=1101, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1101 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 125 HIS : no HD1:sc= 1.15 K(o=2,f=-5.1!) USER MOD Set 1.2: A 130 ASN : amide:sc= 0.803 K(o=2,f=0.13) USER MOD Set 2.1: A 82 ASN :FLIP amide:sc= -0.554 F(o=-6.6,f=-5.3) USER MOD Set 2.2: A 83 ASN : amide:sc= -2.02 K(o=-5.3,f=-9.4!) USER MOD Set 2.3: A 84 ASN : amide:sc= -2.74 K(o=-5.3,f=-14!) USER MOD Set 3.1: A 46 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 47 HIS :FLIP no HE2:sc= -0.953 F(o=-2.6!,f=-0.95) USER MOD Set 4.1: A 11 ASN : amide:sc= 0.599 K(o=0.48,f=-4.4!) USER MOD Set 4.2: A 74 GLN : amide:sc= -0.117 K(o=0.48,f=-3.4!) USER MOD Single : A 4 TYR OH : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 158:sc= -1.39 (180deg=-2.54!) USER MOD Single : A 13 GLN :FLIP amide:sc= -0.309 F(o=-1.5,f=-0.31) USER MOD Single : A 17 SER OG : rot -160:sc= 0.434 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 32 GLN : amide:sc= -1.16! C(o=-1.2!,f=-7!) USER MOD Single : A 36 MET CE :methyl -156:sc= -0.163 (180deg=-0.783) USER MOD Single : A 37 ASN : amide:sc= -0.776 K(o=-0.78,f=-2.6!) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot -170:sc= -0.835! USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 83:sc= 0.724 USER MOD Single : A 70 LYS NZ :NH3+ 172:sc= 0.838 (180deg=0.646) USER MOD Single : A 94 GLN : amide:sc= 0.0961 K(o=0.096,f=-5.1!) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0.0129 USER MOD Single : A 103 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 75:sc= 0.79 USER MOD Single : A 119 HIS : no HE2:sc= 0.0498 K(o=0.05,f=-0.46) USER MOD Single : A 122 MET CE :methyl -144:sc= -2.2 (180deg=-3.96!) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 100:sc= -0.529 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.168 K(o=-0.17,f=-3.9!) USER MOD Single : A 144 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD ----------------------------------------------------------------- ATOM 44 N VAL A 3 5.686 -3.754 18.280 1.00 40.24 N ATOM 45 CA VAL A 3 6.755 -3.485 17.313 1.00 53.11 C ATOM 46 C VAL A 3 6.884 -4.629 16.292 1.00 72.44 C ATOM 47 O VAL A 3 7.433 -5.692 16.592 1.00 15.42 O ATOM 48 CB VAL A 3 8.119 -3.263 18.017 1.00 74.40 C ATOM 49 CG1 VAL A 3 9.220 -2.968 16.996 1.00 61.11 C ATOM 50 CG2 VAL A 3 8.018 -2.139 19.048 1.00 52.13 C ATOM 0 HA VAL A 3 6.481 -2.570 16.788 1.00 53.11 H new ATOM 0 HB VAL A 3 8.384 -4.182 18.540 1.00 74.40 H new ATOM 0 HG11 VAL A 3 10.166 -2.816 17.515 1.00 61.11 H new ATOM 0 HG12 VAL A 3 9.314 -3.809 16.309 1.00 61.11 H new ATOM 0 HG13 VAL A 3 8.965 -2.068 16.436 1.00 61.11 H new ATOM 0 HG21 VAL A 3 8.986 -2.000 19.530 1.00 52.13 H new ATOM 0 HG22 VAL A 3 7.724 -1.215 18.551 1.00 52.13 H new ATOM 0 HG23 VAL A 3 7.273 -2.400 19.799 1.00 52.13 H new ATOM 60 N TYR A 4 6.357 -4.412 15.089 1.00 1.23 N ATOM 61 CA TYR A 4 6.408 -5.416 14.021 1.00 50.41 C ATOM 62 C TYR A 4 7.650 -5.246 13.139 1.00 23.34 C ATOM 63 O TYR A 4 7.904 -4.171 12.595 1.00 70.44 O ATOM 64 CB TYR A 4 5.149 -5.339 13.144 1.00 64.43 C ATOM 65 CG TYR A 4 3.907 -5.943 13.777 1.00 13.51 C ATOM 66 CD1 TYR A 4 3.223 -5.282 14.787 1.00 22.51 C ATOM 67 CD2 TYR A 4 3.413 -7.175 13.349 1.00 25.42 C ATOM 68 CE1 TYR A 4 2.087 -5.826 15.354 1.00 23.13 C ATOM 69 CE2 TYR A 4 2.278 -7.724 13.915 1.00 23.02 C ATOM 70 CZ TYR A 4 1.619 -7.045 14.917 1.00 21.13 C ATOM 71 OH TYR A 4 0.482 -7.581 15.480 1.00 13.33 O ATOM 0 H TYR A 4 5.887 -3.546 14.826 1.00 1.23 H new ATOM 0 HA TYR A 4 6.459 -6.392 14.504 1.00 50.41 H new ATOM 0 HB2 TYR A 4 4.950 -4.294 12.906 1.00 64.43 H new ATOM 0 HB3 TYR A 4 5.346 -5.848 12.201 1.00 64.43 H new ATOM 0 HD1 TYR A 4 3.585 -4.326 15.136 1.00 22.51 H new ATOM 0 HD2 TYR A 4 3.926 -7.709 12.562 1.00 25.42 H new ATOM 0 HE1 TYR A 4 1.567 -5.296 16.138 1.00 23.13 H new ATOM 0 HE2 TYR A 4 1.909 -8.680 13.574 1.00 23.02 H new ATOM 0 HH TYR A 4 0.285 -8.444 15.060 1.00 13.33 H new ATOM 81 N LYS A 5 8.419 -6.318 13.009 1.00 13.03 N ATOM 82 CA LYS A 5 9.553 -6.354 12.085 1.00 74.42 C ATOM 83 C LYS A 5 9.125 -6.979 10.741 1.00 21.53 C ATOM 84 O LYS A 5 8.137 -7.712 10.685 1.00 62.52 O ATOM 85 CB LYS A 5 10.719 -7.137 12.723 1.00 54.21 C ATOM 86 CG LYS A 5 11.339 -6.434 13.935 1.00 22.14 C ATOM 87 CD LYS A 5 12.454 -7.256 14.592 1.00 32.40 C ATOM 88 CE LYS A 5 11.924 -8.288 15.591 1.00 65.43 C ATOM 89 NZ LYS A 5 11.042 -9.302 14.956 1.00 12.10 N ATOM 0 H LYS A 5 8.280 -7.182 13.534 1.00 13.03 H new ATOM 0 HA LYS A 5 9.892 -5.338 11.886 1.00 74.42 H new ATOM 0 HB2 LYS A 5 10.362 -8.121 13.028 1.00 54.21 H new ATOM 0 HB3 LYS A 5 11.492 -7.297 11.972 1.00 54.21 H new ATOM 0 HG2 LYS A 5 11.740 -5.469 13.624 1.00 22.14 H new ATOM 0 HG3 LYS A 5 10.560 -6.233 14.671 1.00 22.14 H new ATOM 0 HD2 LYS A 5 13.026 -7.768 13.818 1.00 32.40 H new ATOM 0 HD3 LYS A 5 13.142 -6.583 15.103 1.00 32.40 H new ATOM 0 HE2 LYS A 5 12.765 -8.792 16.067 1.00 65.43 H new ATOM 0 HE3 LYS A 5 11.372 -7.775 16.379 1.00 65.43 H new ATOM 0 HZ1 LYS A 5 11.013 -10.156 15.548 1.00 12.10 H new ATOM 0 HZ2 LYS A 5 10.082 -8.915 14.859 1.00 12.10 H new ATOM 0 HZ3 LYS A 5 11.414 -9.545 14.016 1.00 12.10 H new ATOM 103 N PRO A 6 9.867 -6.722 9.635 1.00 62.52 N ATOM 104 CA PRO A 6 9.464 -7.187 8.288 1.00 13.42 C ATOM 105 C PRO A 6 9.498 -8.713 8.145 1.00 23.20 C ATOM 106 O PRO A 6 9.160 -9.258 7.099 1.00 33.23 O ATOM 107 CB PRO A 6 10.493 -6.528 7.358 1.00 74.13 C ATOM 108 CG PRO A 6 11.687 -6.290 8.222 1.00 41.14 C ATOM 109 CD PRO A 6 11.149 -5.987 9.599 1.00 34.30 C ATOM 0 HA PRO A 6 8.432 -6.917 8.063 1.00 13.42 H new ATOM 0 HB2 PRO A 6 10.737 -7.175 6.515 1.00 74.13 H new ATOM 0 HB3 PRO A 6 10.112 -5.595 6.944 1.00 74.13 H new ATOM 0 HG2 PRO A 6 12.336 -7.165 8.240 1.00 41.14 H new ATOM 0 HG3 PRO A 6 12.283 -5.459 7.844 1.00 41.14 H new ATOM 0 HD2 PRO A 6 11.829 -6.327 10.380 1.00 34.30 H new ATOM 0 HD3 PRO A 6 11.003 -4.917 9.747 1.00 34.30 H new ATOM 117 N GLU A 7 9.927 -9.392 9.203 1.00 2.15 N ATOM 118 CA GLU A 7 9.963 -10.855 9.239 1.00 10.12 C ATOM 119 C GLU A 7 8.857 -11.410 10.155 1.00 64.32 C ATOM 120 O GLU A 7 8.612 -12.618 10.195 1.00 74.20 O ATOM 121 CB GLU A 7 11.352 -11.306 9.710 1.00 21.12 C ATOM 122 CG GLU A 7 12.483 -10.712 8.869 1.00 33.21 C ATOM 123 CD GLU A 7 13.863 -10.915 9.470 1.00 74.22 C ATOM 124 OE1 GLU A 7 14.017 -10.734 10.697 1.00 71.22 O ATOM 125 OE2 GLU A 7 14.812 -11.204 8.714 1.00 35.45 O ATOM 0 H GLU A 7 10.259 -8.948 10.059 1.00 2.15 H new ATOM 0 HA GLU A 7 9.778 -11.248 8.239 1.00 10.12 H new ATOM 0 HB2 GLU A 7 11.489 -11.017 10.752 1.00 21.12 H new ATOM 0 HB3 GLU A 7 11.409 -12.394 9.671 1.00 21.12 H new ATOM 0 HG2 GLU A 7 12.459 -11.161 7.876 1.00 33.21 H new ATOM 0 HG3 GLU A 7 12.306 -9.644 8.741 1.00 33.21 H new ATOM 132 N ASP A 8 8.189 -10.513 10.888 1.00 54.15 N ATOM 133 CA ASP A 8 7.055 -10.883 11.747 1.00 62.31 C ATOM 134 C ASP A 8 5.733 -10.786 10.969 1.00 34.21 C ATOM 135 O ASP A 8 4.758 -11.465 11.289 1.00 33.44 O ATOM 136 CB ASP A 8 6.975 -9.960 12.974 1.00 42.13 C ATOM 137 CG ASP A 8 8.283 -9.833 13.737 1.00 35.25 C ATOM 138 OD1 ASP A 8 9.167 -10.704 13.596 1.00 51.14 O ATOM 139 OD2 ASP A 8 8.435 -8.843 14.485 1.00 71.11 O ATOM 0 H ASP A 8 8.415 -9.518 10.904 1.00 54.15 H new ATOM 0 HA ASP A 8 7.213 -11.910 12.075 1.00 62.31 H new ATOM 0 HB2 ASP A 8 6.657 -8.969 12.650 1.00 42.13 H new ATOM 0 HB3 ASP A 8 6.207 -10.336 13.650 1.00 42.13 H new ATOM 144 N VAL A 9 5.716 -9.918 9.956 1.00 23.33 N ATOM 145 CA VAL A 9 4.522 -9.690 9.131 1.00 50.13 C ATOM 146 C VAL A 9 4.022 -10.994 8.482 1.00 40.13 C ATOM 147 O VAL A 9 4.798 -11.713 7.850 1.00 2.15 O ATOM 148 CB VAL A 9 4.807 -8.642 8.022 1.00 62.54 C ATOM 149 CG1 VAL A 9 3.569 -8.399 7.159 1.00 72.44 C ATOM 150 CG2 VAL A 9 5.306 -7.335 8.635 1.00 60.31 C ATOM 0 H VAL A 9 6.522 -9.355 9.683 1.00 23.33 H new ATOM 0 HA VAL A 9 3.745 -9.312 9.795 1.00 50.13 H new ATOM 0 HB VAL A 9 5.589 -9.040 7.376 1.00 62.54 H new ATOM 0 HG11 VAL A 9 3.800 -7.660 6.391 1.00 72.44 H new ATOM 0 HG12 VAL A 9 3.267 -9.333 6.685 1.00 72.44 H new ATOM 0 HG13 VAL A 9 2.756 -8.030 7.785 1.00 72.44 H new ATOM 0 HG21 VAL A 9 5.501 -6.612 7.842 1.00 60.31 H new ATOM 0 HG22 VAL A 9 4.549 -6.938 9.311 1.00 60.31 H new ATOM 0 HG23 VAL A 9 6.225 -7.521 9.190 1.00 60.31 H new ATOM 160 N PRO A 10 2.720 -11.320 8.640 1.00 30.54 N ATOM 161 CA PRO A 10 2.125 -12.531 8.045 1.00 25.24 C ATOM 162 C PRO A 10 2.321 -12.602 6.522 1.00 54.41 C ATOM 163 O PRO A 10 1.717 -11.835 5.769 1.00 61.52 O ATOM 164 CB PRO A 10 0.632 -12.406 8.390 1.00 74.41 C ATOM 165 CG PRO A 10 0.596 -11.522 9.590 1.00 12.33 C ATOM 166 CD PRO A 10 1.730 -10.550 9.419 1.00 72.14 C ATOM 0 HA PRO A 10 2.591 -13.438 8.429 1.00 25.24 H new ATOM 0 HB2 PRO A 10 0.069 -11.974 7.563 1.00 74.41 H new ATOM 0 HB3 PRO A 10 0.191 -13.380 8.602 1.00 74.41 H new ATOM 0 HG2 PRO A 10 -0.358 -11.000 9.662 1.00 12.33 H new ATOM 0 HG3 PRO A 10 0.713 -12.101 10.506 1.00 12.33 H new ATOM 0 HD2 PRO A 10 1.413 -9.651 8.891 1.00 72.14 H new ATOM 0 HD3 PRO A 10 2.134 -10.230 10.379 1.00 72.14 H new ATOM 174 N ASN A 11 3.177 -13.520 6.072 1.00 42.04 N ATOM 175 CA ASN A 11 3.447 -13.683 4.641 1.00 43.33 C ATOM 176 C ASN A 11 2.224 -14.257 3.905 1.00 63.14 C ATOM 177 O ASN A 11 2.168 -15.452 3.599 1.00 62.44 O ATOM 178 CB ASN A 11 4.679 -14.577 4.428 1.00 22.30 C ATOM 179 CG ASN A 11 5.917 -14.027 5.118 1.00 2.41 C ATOM 180 OD1 ASN A 11 6.049 -12.829 5.313 1.00 10.03 O ATOM 181 ND2 ASN A 11 6.834 -14.893 5.492 1.00 32.15 N ATOM 0 H ASN A 11 3.694 -14.160 6.674 1.00 42.04 H new ATOM 0 HA ASN A 11 3.654 -12.699 4.221 1.00 43.33 H new ATOM 0 HB2 ASN A 11 4.469 -15.577 4.806 1.00 22.30 H new ATOM 0 HB3 ASN A 11 4.874 -14.675 3.360 1.00 22.30 H new ATOM 0 HD21 ASN A 11 7.682 -14.569 5.958 1.00 32.15 H new ATOM 0 HD22 ASN A 11 6.697 -15.888 5.316 1.00 32.15 H new ATOM 188 N VAL A 12 1.237 -13.398 3.641 1.00 71.34 N ATOM 189 CA VAL A 12 -0.015 -13.822 3.001 1.00 24.42 C ATOM 190 C VAL A 12 0.196 -14.261 1.541 1.00 34.40 C ATOM 191 O VAL A 12 -0.200 -15.360 1.165 1.00 21.32 O ATOM 192 CB VAL A 12 -1.105 -12.715 3.069 1.00 72.12 C ATOM 193 CG1 VAL A 12 -1.507 -12.445 4.518 1.00 62.33 C ATOM 194 CG2 VAL A 12 -0.634 -11.428 2.391 1.00 5.11 C ATOM 0 H VAL A 12 1.279 -12.403 3.860 1.00 71.34 H new ATOM 0 HA VAL A 12 -0.363 -14.686 3.567 1.00 24.42 H new ATOM 0 HB VAL A 12 -1.980 -13.075 2.528 1.00 72.12 H new ATOM 0 HG11 VAL A 12 -2.271 -11.668 4.545 1.00 62.33 H new ATOM 0 HG12 VAL A 12 -1.903 -13.358 4.962 1.00 62.33 H new ATOM 0 HG13 VAL A 12 -0.634 -12.116 5.082 1.00 62.33 H new ATOM 0 HG21 VAL A 12 -1.419 -10.674 2.456 1.00 5.11 H new ATOM 0 HG22 VAL A 12 0.263 -11.061 2.890 1.00 5.11 H new ATOM 0 HG23 VAL A 12 -0.410 -11.630 1.343 1.00 5.11 H new ATOM 204 N GLN A 13 0.856 -13.422 0.736 1.00 3.41 N ATOM 205 CA GLN A 13 1.090 -13.726 -0.686 1.00 24.20 C ATOM 206 C GLN A 13 1.836 -15.058 -0.877 1.00 14.24 C ATOM 207 O GLN A 13 1.783 -15.662 -1.950 1.00 4.04 O ATOM 208 CB GLN A 13 1.865 -12.582 -1.355 1.00 73.52 C ATOM 209 CG GLN A 13 1.045 -11.308 -1.546 1.00 21.42 C ATOM 210 CD GLN A 13 -0.097 -11.489 -2.537 1.00 72.10 C ATOM 211 OE1 GLN A 13 -1.263 -11.874 -2.053 1.00 2.34 O flip ATOM 212 NE2 GLN A 13 0.069 -11.284 -3.732 1.00 63.12 N flip ATOM 0 H GLN A 13 1.239 -12.527 1.041 1.00 3.41 H new ATOM 0 HA GLN A 13 0.115 -13.827 -1.162 1.00 24.20 H new ATOM 0 HB2 GLN A 13 2.743 -12.350 -0.753 1.00 73.52 H new ATOM 0 HB3 GLN A 13 2.225 -12.920 -2.327 1.00 73.52 H new ATOM 0 HG2 GLN A 13 0.640 -10.994 -0.584 1.00 21.42 H new ATOM 0 HG3 GLN A 13 1.699 -10.508 -1.893 1.00 21.42 H new ATOM 0 HE21 GLN A 13 0.982 -10.987 -4.077 1.00 63.12 H new ATOM 0 HE22 GLN A 13 -0.706 -11.410 -4.383 1.00 63.12 H new ATOM 221 N LEU A 14 2.529 -15.507 0.168 1.00 31.11 N ATOM 222 CA LEU A 14 3.200 -16.808 0.150 1.00 11.21 C ATOM 223 C LEU A 14 2.156 -17.937 0.117 1.00 32.24 C ATOM 224 O LEU A 14 2.193 -18.811 -0.750 1.00 34.45 O ATOM 225 CB LEU A 14 4.123 -16.934 1.382 1.00 11.33 C ATOM 226 CG LEU A 14 5.138 -18.101 1.370 1.00 4.33 C ATOM 227 CD1 LEU A 14 6.225 -17.874 2.420 1.00 22.44 C ATOM 228 CD2 LEU A 14 4.456 -19.450 1.613 1.00 63.10 C ATOM 0 H LEU A 14 2.641 -14.989 1.040 1.00 31.11 H new ATOM 0 HA LEU A 14 3.814 -16.891 -0.747 1.00 11.21 H new ATOM 0 HB2 LEU A 14 4.677 -16.002 1.489 1.00 11.33 H new ATOM 0 HB3 LEU A 14 3.497 -17.036 2.268 1.00 11.33 H new ATOM 0 HG LEU A 14 5.591 -18.126 0.379 1.00 4.33 H new ATOM 0 HD11 LEU A 14 6.931 -18.704 2.398 1.00 22.44 H new ATOM 0 HD12 LEU A 14 6.751 -16.944 2.204 1.00 22.44 H new ATOM 0 HD13 LEU A 14 5.769 -17.811 3.408 1.00 22.44 H new ATOM 0 HD21 LEU A 14 5.203 -20.244 1.597 1.00 63.10 H new ATOM 0 HD22 LEU A 14 3.961 -19.438 2.584 1.00 63.10 H new ATOM 0 HD23 LEU A 14 3.718 -19.631 0.831 1.00 63.10 H new ATOM 240 N ALA A 15 1.213 -17.900 1.057 1.00 42.33 N ATOM 241 CA ALA A 15 0.151 -18.911 1.131 1.00 75.22 C ATOM 242 C ALA A 15 -1.062 -18.520 0.270 1.00 51.31 C ATOM 243 O ALA A 15 -1.376 -19.188 -0.718 1.00 43.35 O ATOM 244 CB ALA A 15 -0.270 -19.125 2.580 1.00 51.34 C ATOM 0 H ALA A 15 1.160 -17.182 1.780 1.00 42.33 H new ATOM 0 HA ALA A 15 0.549 -19.845 0.734 1.00 75.22 H new ATOM 0 HB1 ALA A 15 -1.058 -19.877 2.623 1.00 51.34 H new ATOM 0 HB2 ALA A 15 0.587 -19.464 3.162 1.00 51.34 H new ATOM 0 HB3 ALA A 15 -0.641 -18.187 2.994 1.00 51.34 H new ATOM 250 N ASP A 16 -1.740 -17.439 0.650 1.00 32.32 N ATOM 251 CA ASP A 16 -2.909 -16.951 -0.090 1.00 4.23 C ATOM 252 C ASP A 16 -2.548 -15.801 -1.040 1.00 52.30 C ATOM 253 O ASP A 16 -2.388 -14.653 -0.619 1.00 23.30 O ATOM 254 CB ASP A 16 -4.003 -16.486 0.875 1.00 42.15 C ATOM 255 CG ASP A 16 -4.647 -17.635 1.623 1.00 41.42 C ATOM 256 OD1 ASP A 16 -5.601 -18.237 1.085 1.00 62.13 O ATOM 257 OD2 ASP A 16 -4.211 -17.936 2.750 1.00 55.34 O ATOM 0 H ASP A 16 -1.501 -16.880 1.469 1.00 32.32 H new ATOM 0 HA ASP A 16 -3.277 -17.785 -0.687 1.00 4.23 H new ATOM 0 HB2 ASP A 16 -3.576 -15.785 1.592 1.00 42.15 H new ATOM 0 HB3 ASP A 16 -4.768 -15.946 0.318 1.00 42.15 H new ATOM 262 N SER A 17 -2.425 -16.113 -2.324 1.00 74.24 N ATOM 263 CA SER A 17 -2.229 -15.081 -3.350 1.00 74.50 C ATOM 264 C SER A 17 -3.578 -14.466 -3.761 1.00 32.54 C ATOM 265 O SER A 17 -3.635 -13.529 -4.561 1.00 12.12 O ATOM 266 CB SER A 17 -1.517 -15.667 -4.578 1.00 34.32 C ATOM 267 OG SER A 17 -2.333 -16.607 -5.264 1.00 3.23 O ATOM 0 H SER A 17 -2.456 -17.067 -2.685 1.00 74.24 H new ATOM 0 HA SER A 17 -1.602 -14.296 -2.928 1.00 74.50 H new ATOM 0 HB2 SER A 17 -1.242 -14.860 -5.258 1.00 34.32 H new ATOM 0 HB3 SER A 17 -0.591 -16.150 -4.265 1.00 34.32 H new ATOM 0 HG SER A 17 -1.770 -17.181 -5.824 1.00 3.23 H new ATOM 273 N THR A 18 -4.661 -15.007 -3.196 1.00 25.23 N ATOM 274 CA THR A 18 -6.022 -14.502 -3.432 1.00 20.45 C ATOM 275 C THR A 18 -6.314 -13.244 -2.601 1.00 70.23 C ATOM 276 O THR A 18 -7.016 -12.339 -3.057 1.00 54.31 O ATOM 277 CB THR A 18 -7.081 -15.570 -3.085 1.00 1.21 C ATOM 278 OG1 THR A 18 -6.943 -15.954 -1.709 1.00 33.13 O ATOM 279 CG2 THR A 18 -6.938 -16.797 -3.982 1.00 41.11 C ATOM 0 H THR A 18 -4.622 -15.806 -2.563 1.00 25.23 H new ATOM 0 HA THR A 18 -6.078 -14.255 -4.492 1.00 20.45 H new ATOM 0 HB THR A 18 -8.070 -15.142 -3.250 1.00 1.21 H new ATOM 0 HG1 THR A 18 -7.617 -16.631 -1.489 1.00 33.13 H new ATOM 0 HG21 THR A 18 -7.697 -17.533 -3.715 1.00 41.11 H new ATOM 0 HG22 THR A 18 -7.068 -16.503 -5.024 1.00 41.11 H new ATOM 0 HG23 THR A 18 -5.948 -17.232 -3.848 1.00 41.11 H new ATOM 287 N ARG A 19 -5.805 -13.205 -1.368 1.00 24.41 N ATOM 288 CA ARG A 19 -5.898 -12.000 -0.534 1.00 34.13 C ATOM 289 C ARG A 19 -4.562 -11.248 -0.525 1.00 52.44 C ATOM 290 O ARG A 19 -3.511 -11.817 -0.231 1.00 32.14 O ATOM 291 CB ARG A 19 -6.323 -12.329 0.912 1.00 0.03 C ATOM 292 CG ARG A 19 -5.363 -13.248 1.670 1.00 31.02 C ATOM 293 CD ARG A 19 -5.521 -13.118 3.183 1.00 61.24 C ATOM 294 NE ARG A 19 -6.900 -13.328 3.622 1.00 61.32 N ATOM 295 CZ ARG A 19 -7.243 -13.757 4.805 1.00 40.15 C ATOM 296 NH1 ARG A 19 -6.351 -14.049 5.698 1.00 52.55 N ATOM 297 NH2 ARG A 19 -8.492 -13.891 5.097 1.00 23.04 N ATOM 0 H ARG A 19 -5.326 -13.989 -0.924 1.00 24.41 H new ATOM 0 HA ARG A 19 -6.668 -11.365 -0.972 1.00 34.13 H new ATOM 0 HB2 ARG A 19 -6.425 -11.396 1.467 1.00 0.03 H new ATOM 0 HB3 ARG A 19 -7.308 -12.795 0.889 1.00 0.03 H new ATOM 0 HG2 ARG A 19 -5.542 -14.282 1.374 1.00 31.02 H new ATOM 0 HG3 ARG A 19 -4.337 -13.010 1.391 1.00 31.02 H new ATOM 0 HD2 ARG A 19 -4.872 -13.841 3.676 1.00 61.24 H new ATOM 0 HD3 ARG A 19 -5.190 -12.128 3.496 1.00 61.24 H new ATOM 0 HE ARG A 19 -7.646 -13.125 2.957 1.00 61.32 H new ATOM 0 HH11 ARG A 19 -5.360 -13.945 5.482 1.00 52.55 H new ATOM 0 HH12 ARG A 19 -6.640 -14.383 6.617 1.00 52.55 H new ATOM 0 HH21 ARG A 19 -9.205 -13.662 4.405 1.00 23.04 H new ATOM 0 HH22 ARG A 19 -8.767 -14.226 6.020 1.00 23.04 H new ATOM 311 N LEU A 20 -4.606 -9.968 -0.866 1.00 73.52 N ATOM 312 CA LEU A 20 -3.403 -9.132 -0.895 1.00 52.24 C ATOM 313 C LEU A 20 -3.425 -8.111 0.255 1.00 11.12 C ATOM 314 O LEU A 20 -2.582 -7.219 0.333 1.00 63.32 O ATOM 315 CB LEU A 20 -3.280 -8.428 -2.257 1.00 33.55 C ATOM 316 CG LEU A 20 -3.209 -9.367 -3.483 1.00 40.23 C ATOM 317 CD1 LEU A 20 -4.595 -9.886 -3.870 1.00 65.31 C ATOM 318 CD2 LEU A 20 -2.543 -8.670 -4.664 1.00 55.35 C ATOM 0 H LEU A 20 -5.462 -9.480 -1.128 1.00 73.52 H new ATOM 0 HA LEU A 20 -2.529 -9.769 -0.759 1.00 52.24 H new ATOM 0 HB2 LEU A 20 -4.133 -7.760 -2.380 1.00 33.55 H new ATOM 0 HB3 LEU A 20 -2.386 -7.804 -2.246 1.00 33.55 H new ATOM 0 HG LEU A 20 -2.599 -10.226 -3.205 1.00 40.23 H new ATOM 0 HD11 LEU A 20 -4.509 -10.543 -4.735 1.00 65.31 H new ATOM 0 HD12 LEU A 20 -5.022 -10.440 -3.034 1.00 65.31 H new ATOM 0 HD13 LEU A 20 -5.243 -9.045 -4.116 1.00 65.31 H new ATOM 0 HD21 LEU A 20 -2.505 -9.351 -5.514 1.00 55.35 H new ATOM 0 HD22 LEU A 20 -3.117 -7.784 -4.934 1.00 55.35 H new ATOM 0 HD23 LEU A 20 -1.530 -8.376 -4.389 1.00 55.35 H new ATOM 330 N VAL A 21 -4.397 -8.271 1.155 1.00 1.34 N ATOM 331 CA VAL A 21 -4.563 -7.383 2.311 1.00 73.11 C ATOM 332 C VAL A 21 -4.012 -8.020 3.601 1.00 24.30 C ATOM 333 O VAL A 21 -4.132 -9.229 3.811 1.00 33.04 O ATOM 334 CB VAL A 21 -6.061 -7.038 2.523 1.00 23.11 C ATOM 335 CG1 VAL A 21 -6.267 -6.166 3.760 1.00 10.03 C ATOM 336 CG2 VAL A 21 -6.634 -6.363 1.281 1.00 12.51 C ATOM 0 H VAL A 21 -5.090 -9.017 1.105 1.00 1.34 H new ATOM 0 HA VAL A 21 -3.999 -6.475 2.099 1.00 73.11 H new ATOM 0 HB VAL A 21 -6.598 -7.972 2.689 1.00 23.11 H new ATOM 0 HG11 VAL A 21 -7.328 -5.945 3.877 1.00 10.03 H new ATOM 0 HG12 VAL A 21 -5.908 -6.696 4.642 1.00 10.03 H new ATOM 0 HG13 VAL A 21 -5.713 -5.235 3.645 1.00 10.03 H new ATOM 0 HG21 VAL A 21 -7.685 -6.128 1.447 1.00 12.51 H new ATOM 0 HG22 VAL A 21 -6.084 -5.444 1.080 1.00 12.51 H new ATOM 0 HG23 VAL A 21 -6.543 -7.034 0.427 1.00 12.51 H new ATOM 346 N THR A 22 -3.404 -7.200 4.454 1.00 70.12 N ATOM 347 CA THR A 22 -2.924 -7.654 5.768 1.00 31.22 C ATOM 348 C THR A 22 -3.070 -6.542 6.818 1.00 55.03 C ATOM 349 O THR A 22 -2.287 -5.593 6.844 1.00 55.40 O ATOM 350 CB THR A 22 -1.442 -8.109 5.708 1.00 40.42 C ATOM 351 OG1 THR A 22 -1.287 -9.145 4.728 1.00 14.43 O ATOM 352 CG2 THR A 22 -0.956 -8.621 7.065 1.00 13.20 C ATOM 0 H THR A 22 -3.229 -6.213 4.263 1.00 70.12 H new ATOM 0 HA THR A 22 -3.540 -8.507 6.055 1.00 31.22 H new ATOM 0 HB THR A 22 -0.841 -7.242 5.433 1.00 40.42 H new ATOM 0 HG1 THR A 22 -0.349 -9.426 4.695 1.00 14.43 H new ATOM 0 HG21 THR A 22 0.086 -8.931 6.985 1.00 13.20 H new ATOM 0 HG22 THR A 22 -1.042 -7.826 7.806 1.00 13.20 H new ATOM 0 HG23 THR A 22 -1.565 -9.471 7.372 1.00 13.20 H new ATOM 360 N ASP A 23 -4.084 -6.658 7.676 1.00 41.24 N ATOM 361 CA ASP A 23 -4.364 -5.635 8.689 1.00 14.10 C ATOM 362 C ASP A 23 -3.932 -6.095 10.093 1.00 61.42 C ATOM 363 O ASP A 23 -4.656 -6.820 10.779 1.00 35.43 O ATOM 364 CB ASP A 23 -5.857 -5.267 8.670 1.00 73.45 C ATOM 365 CG ASP A 23 -6.242 -4.281 9.766 1.00 42.14 C ATOM 366 OD1 ASP A 23 -5.815 -3.105 9.704 1.00 74.05 O ATOM 367 OD2 ASP A 23 -6.966 -4.682 10.702 1.00 32.32 O ATOM 0 H ASP A 23 -4.727 -7.450 7.691 1.00 41.24 H new ATOM 0 HA ASP A 23 -3.779 -4.748 8.444 1.00 14.10 H new ATOM 0 HB2 ASP A 23 -6.107 -4.839 7.699 1.00 73.45 H new ATOM 0 HB3 ASP A 23 -6.451 -6.175 8.781 1.00 73.45 H new ATOM 372 N GLU A 24 -2.737 -5.680 10.507 1.00 12.24 N ATOM 373 CA GLU A 24 -2.227 -5.990 11.848 1.00 45.33 C ATOM 374 C GLU A 24 -2.475 -4.809 12.800 1.00 3.21 C ATOM 375 O GLU A 24 -2.797 -4.997 13.975 1.00 2.11 O ATOM 376 CB GLU A 24 -0.727 -6.323 11.792 1.00 71.31 C ATOM 377 CG GLU A 24 -0.375 -7.473 10.849 1.00 60.52 C ATOM 378 CD GLU A 24 -1.075 -8.778 11.208 1.00 15.34 C ATOM 379 OE1 GLU A 24 -0.618 -9.468 12.142 1.00 11.33 O ATOM 380 OE2 GLU A 24 -2.091 -9.117 10.561 1.00 41.21 O ATOM 0 H GLU A 24 -2.100 -5.127 9.934 1.00 12.24 H new ATOM 0 HA GLU A 24 -2.761 -6.862 12.226 1.00 45.33 H new ATOM 0 HB2 GLU A 24 -0.180 -5.433 11.481 1.00 71.31 H new ATOM 0 HB3 GLU A 24 -0.384 -6.573 12.796 1.00 71.31 H new ATOM 0 HG2 GLU A 24 -0.642 -7.193 9.830 1.00 60.52 H new ATOM 0 HG3 GLU A 24 0.703 -7.630 10.865 1.00 60.52 H new ATOM 387 N ALA A 25 -2.312 -3.590 12.280 1.00 74.44 N ATOM 388 CA ALA A 25 -2.598 -2.366 13.039 1.00 51.14 C ATOM 389 C ALA A 25 -4.047 -2.320 13.558 1.00 54.32 C ATOM 390 O ALA A 25 -4.293 -1.965 14.712 1.00 13.20 O ATOM 391 CB ALA A 25 -2.316 -1.140 12.175 1.00 40.53 C ATOM 0 H ALA A 25 -1.981 -3.422 11.330 1.00 74.44 H new ATOM 0 HA ALA A 25 -1.943 -2.366 13.910 1.00 51.14 H new ATOM 0 HB1 ALA A 25 -2.531 -0.236 12.745 1.00 40.53 H new ATOM 0 HB2 ALA A 25 -1.268 -1.140 11.875 1.00 40.53 H new ATOM 0 HB3 ALA A 25 -2.948 -1.168 11.287 1.00 40.53 H new ATOM 397 N GLY A 26 -4.997 -2.690 12.705 1.00 65.00 N ATOM 398 CA GLY A 26 -6.409 -2.596 13.064 1.00 22.42 C ATOM 399 C GLY A 26 -7.026 -1.270 12.640 1.00 63.54 C ATOM 400 O GLY A 26 -7.881 -0.716 13.336 1.00 53.34 O ATOM 0 H GLY A 26 -4.818 -3.054 11.769 1.00 65.00 H new ATOM 0 HA2 GLY A 26 -6.956 -3.415 12.596 1.00 22.42 H new ATOM 0 HA3 GLY A 26 -6.516 -2.716 14.142 1.00 22.42 H new ATOM 404 N LEU A 27 -6.595 -0.765 11.488 1.00 52.33 N ATOM 405 CA LEU A 27 -7.039 0.542 10.984 1.00 32.11 C ATOM 406 C LEU A 27 -8.070 0.388 9.855 1.00 75.32 C ATOM 407 O LEU A 27 -8.768 1.341 9.502 1.00 42.50 O ATOM 408 CB LEU A 27 -5.827 1.344 10.488 1.00 74.11 C ATOM 409 CG LEU A 27 -4.752 1.627 11.552 1.00 41.33 C ATOM 410 CD1 LEU A 27 -3.539 2.314 10.931 1.00 24.44 C ATOM 411 CD2 LEU A 27 -5.329 2.468 12.688 1.00 2.04 C ATOM 0 H LEU A 27 -5.932 -1.242 10.877 1.00 52.33 H new ATOM 0 HA LEU A 27 -7.520 1.077 11.802 1.00 32.11 H new ATOM 0 HB2 LEU A 27 -5.365 0.802 9.663 1.00 74.11 H new ATOM 0 HB3 LEU A 27 -6.179 2.295 10.088 1.00 74.11 H new ATOM 0 HG LEU A 27 -4.423 0.674 11.965 1.00 41.33 H new ATOM 0 HD11 LEU A 27 -2.793 2.503 11.703 1.00 24.44 H new ATOM 0 HD12 LEU A 27 -3.110 1.671 10.163 1.00 24.44 H new ATOM 0 HD13 LEU A 27 -3.846 3.259 10.483 1.00 24.44 H new ATOM 0 HD21 LEU A 27 -4.554 2.658 13.430 1.00 2.04 H new ATOM 0 HD22 LEU A 27 -5.691 3.416 12.291 1.00 2.04 H new ATOM 0 HD23 LEU A 27 -6.155 1.931 13.155 1.00 2.04 H new ATOM 423 N LEU A 28 -8.151 -0.817 9.293 1.00 60.24 N ATOM 424 CA LEU A 28 -9.094 -1.114 8.210 1.00 65.41 C ATOM 425 C LEU A 28 -10.438 -1.631 8.756 1.00 44.54 C ATOM 426 O LEU A 28 -10.735 -1.503 9.946 1.00 34.22 O ATOM 427 CB LEU A 28 -8.478 -2.149 7.249 1.00 2.31 C ATOM 428 CG LEU A 28 -7.183 -1.707 6.544 1.00 62.41 C ATOM 429 CD1 LEU A 28 -6.630 -2.830 5.670 1.00 21.55 C ATOM 430 CD2 LEU A 28 -7.424 -0.445 5.713 1.00 74.35 C ATOM 0 H LEU A 28 -7.572 -1.610 9.570 1.00 60.24 H new ATOM 0 HA LEU A 28 -9.290 -0.188 7.670 1.00 65.41 H new ATOM 0 HB2 LEU A 28 -8.274 -3.062 7.808 1.00 2.31 H new ATOM 0 HB3 LEU A 28 -9.218 -2.399 6.489 1.00 2.31 H new ATOM 0 HG LEU A 28 -6.442 -1.477 7.309 1.00 62.41 H new ATOM 0 HD11 LEU A 28 -5.715 -2.494 5.182 1.00 21.55 H new ATOM 0 HD12 LEU A 28 -6.413 -3.700 6.290 1.00 21.55 H new ATOM 0 HD13 LEU A 28 -7.367 -3.099 4.913 1.00 21.55 H new ATOM 0 HD21 LEU A 28 -6.496 -0.149 5.223 1.00 74.35 H new ATOM 0 HD22 LEU A 28 -8.185 -0.646 4.959 1.00 74.35 H new ATOM 0 HD23 LEU A 28 -7.763 0.360 6.365 1.00 74.35 H new ATOM 442 N SER A 29 -11.249 -2.199 7.866 1.00 21.12 N ATOM 443 CA SER A 29 -12.557 -2.770 8.230 1.00 30.12 C ATOM 444 C SER A 29 -13.035 -3.725 7.134 1.00 11.02 C ATOM 445 O SER A 29 -12.659 -3.561 5.974 1.00 63.15 O ATOM 446 CB SER A 29 -13.596 -1.660 8.439 1.00 35.55 C ATOM 447 OG SER A 29 -14.884 -2.196 8.707 1.00 73.03 O ATOM 0 H SER A 29 -11.025 -2.279 6.874 1.00 21.12 H new ATOM 0 HA SER A 29 -12.443 -3.320 9.164 1.00 30.12 H new ATOM 0 HB2 SER A 29 -13.287 -1.022 9.267 1.00 35.55 H new ATOM 0 HB3 SER A 29 -13.641 -1.030 7.551 1.00 35.55 H new ATOM 0 HG SER A 29 -15.522 -1.464 8.837 1.00 73.03 H new ATOM 453 N ASN A 30 -13.867 -4.707 7.495 1.00 64.10 N ATOM 454 CA ASN A 30 -14.327 -5.740 6.544 1.00 23.34 C ATOM 455 C ASN A 30 -14.821 -5.134 5.218 1.00 1.44 C ATOM 456 O ASN A 30 -14.503 -5.640 4.141 1.00 14.30 O ATOM 457 CB ASN A 30 -15.435 -6.592 7.179 1.00 45.20 C ATOM 458 CG ASN A 30 -15.920 -7.711 6.265 1.00 12.21 C ATOM 459 OD1 ASN A 30 -15.178 -8.230 5.436 1.00 0.43 O ATOM 460 ND2 ASN A 30 -17.170 -8.096 6.410 1.00 55.53 N ATOM 0 H ASN A 30 -14.239 -4.814 8.439 1.00 64.10 H new ATOM 0 HA ASN A 30 -13.469 -6.371 6.314 1.00 23.34 H new ATOM 0 HB2 ASN A 30 -15.066 -7.024 8.109 1.00 45.20 H new ATOM 0 HB3 ASN A 30 -16.277 -5.950 7.437 1.00 45.20 H new ATOM 0 HD21 ASN A 30 -17.545 -8.843 5.825 1.00 55.53 H new ATOM 0 HD22 ASN A 30 -17.764 -7.647 7.107 1.00 55.53 H new ATOM 467 N ALA A 31 -15.591 -4.049 5.299 1.00 75.21 N ATOM 468 CA ALA A 31 -16.061 -3.344 4.100 1.00 42.12 C ATOM 469 C ALA A 31 -14.893 -2.934 3.190 1.00 63.53 C ATOM 470 O ALA A 31 -14.899 -3.201 1.986 1.00 31.35 O ATOM 471 CB ALA A 31 -16.871 -2.116 4.499 1.00 71.34 C ATOM 0 H ALA A 31 -15.903 -3.638 6.179 1.00 75.21 H new ATOM 0 HA ALA A 31 -16.696 -4.029 3.538 1.00 42.12 H new ATOM 0 HB1 ALA A 31 -17.215 -1.600 3.603 1.00 71.34 H new ATOM 0 HB2 ALA A 31 -17.731 -2.425 5.093 1.00 71.34 H new ATOM 0 HB3 ALA A 31 -16.247 -1.444 5.087 1.00 71.34 H new ATOM 477 N GLN A 32 -13.881 -2.301 3.781 1.00 60.52 N ATOM 478 CA GLN A 32 -12.713 -1.829 3.028 1.00 62.03 C ATOM 479 C GLN A 32 -11.826 -2.995 2.564 1.00 44.44 C ATOM 480 O GLN A 32 -11.294 -2.967 1.458 1.00 25.52 O ATOM 481 CB GLN A 32 -11.896 -0.835 3.868 1.00 30.02 C ATOM 482 CG GLN A 32 -12.648 0.452 4.218 1.00 43.41 C ATOM 483 CD GLN A 32 -13.032 1.285 2.996 1.00 41.24 C ATOM 484 OE1 GLN A 32 -13.267 0.765 1.913 1.00 63.00 O ATOM 485 NE2 GLN A 32 -13.103 2.588 3.159 1.00 55.23 N ATOM 0 H GLN A 32 -13.843 -2.101 4.781 1.00 60.52 H new ATOM 0 HA GLN A 32 -13.081 -1.320 2.137 1.00 62.03 H new ATOM 0 HB2 GLN A 32 -11.586 -1.325 4.791 1.00 30.02 H new ATOM 0 HB3 GLN A 32 -10.988 -0.576 3.324 1.00 30.02 H new ATOM 0 HG2 GLN A 32 -13.551 0.196 4.772 1.00 43.41 H new ATOM 0 HG3 GLN A 32 -12.028 1.057 4.880 1.00 43.41 H new ATOM 0 HE21 GLN A 32 -12.903 3.000 4.071 1.00 55.23 H new ATOM 0 HE22 GLN A 32 -13.358 3.187 2.374 1.00 55.23 H new ATOM 494 N GLU A 33 -11.675 -4.015 3.408 1.00 13.42 N ATOM 495 CA GLU A 33 -10.913 -5.217 3.042 1.00 72.33 C ATOM 496 C GLU A 33 -11.579 -5.959 1.877 1.00 62.10 C ATOM 497 O GLU A 33 -10.906 -6.505 1.006 1.00 74.32 O ATOM 498 CB GLU A 33 -10.775 -6.155 4.249 1.00 63.15 C ATOM 499 CG GLU A 33 -9.908 -5.595 5.373 1.00 23.34 C ATOM 500 CD GLU A 33 -9.787 -6.548 6.552 1.00 72.24 C ATOM 501 OE1 GLU A 33 -9.248 -7.662 6.371 1.00 41.23 O ATOM 502 OE2 GLU A 33 -10.219 -6.186 7.668 1.00 12.22 O ATOM 0 H GLU A 33 -12.068 -4.037 4.349 1.00 13.42 H new ATOM 0 HA GLU A 33 -9.920 -4.898 2.725 1.00 72.33 H new ATOM 0 HB2 GLU A 33 -11.768 -6.372 4.643 1.00 63.15 H new ATOM 0 HB3 GLU A 33 -10.351 -7.102 3.914 1.00 63.15 H new ATOM 0 HG2 GLU A 33 -8.913 -5.376 4.984 1.00 23.34 H new ATOM 0 HG3 GLU A 33 -10.331 -4.651 5.716 1.00 23.34 H new ATOM 509 N GLU A 34 -12.909 -5.962 1.868 1.00 4.41 N ATOM 510 CA GLU A 34 -13.682 -6.585 0.792 1.00 42.44 C ATOM 511 C GLU A 34 -13.445 -5.861 -0.545 1.00 51.44 C ATOM 512 O GLU A 34 -13.057 -6.477 -1.540 1.00 51.30 O ATOM 513 CB GLU A 34 -15.174 -6.562 1.149 1.00 64.25 C ATOM 514 CG GLU A 34 -16.071 -7.267 0.140 1.00 55.32 C ATOM 515 CD GLU A 34 -15.762 -8.748 0.017 1.00 0.11 C ATOM 516 OE1 GLU A 34 -16.180 -9.522 0.902 1.00 50.40 O ATOM 517 OE2 GLU A 34 -15.101 -9.147 -0.963 1.00 23.42 O ATOM 0 H GLU A 34 -13.480 -5.537 2.599 1.00 4.41 H new ATOM 0 HA GLU A 34 -13.353 -7.618 0.680 1.00 42.44 H new ATOM 0 HB2 GLU A 34 -15.309 -7.028 2.125 1.00 64.25 H new ATOM 0 HB3 GLU A 34 -15.497 -5.525 1.243 1.00 64.25 H new ATOM 0 HG2 GLU A 34 -17.113 -7.141 0.435 1.00 55.32 H new ATOM 0 HG3 GLU A 34 -15.956 -6.794 -0.835 1.00 55.32 H new ATOM 524 N VAL A 35 -13.676 -4.548 -0.553 1.00 13.31 N ATOM 525 CA VAL A 35 -13.446 -3.724 -1.746 1.00 25.15 C ATOM 526 C VAL A 35 -11.975 -3.788 -2.194 1.00 63.11 C ATOM 527 O VAL A 35 -11.677 -3.929 -3.382 1.00 21.00 O ATOM 528 CB VAL A 35 -13.828 -2.246 -1.481 1.00 3.03 C ATOM 529 CG1 VAL A 35 -13.587 -1.377 -2.717 1.00 61.40 C ATOM 530 CG2 VAL A 35 -15.281 -2.140 -1.023 1.00 24.32 C ATOM 0 H VAL A 35 -14.023 -4.029 0.254 1.00 13.31 H new ATOM 0 HA VAL A 35 -14.078 -4.125 -2.538 1.00 25.15 H new ATOM 0 HB VAL A 35 -13.185 -1.874 -0.683 1.00 3.03 H new ATOM 0 HG11 VAL A 35 -13.865 -0.346 -2.497 1.00 61.40 H new ATOM 0 HG12 VAL A 35 -12.533 -1.418 -2.991 1.00 61.40 H new ATOM 0 HG13 VAL A 35 -14.191 -1.747 -3.545 1.00 61.40 H new ATOM 0 HG21 VAL A 35 -15.530 -1.094 -0.842 1.00 24.32 H new ATOM 0 HG22 VAL A 35 -15.936 -2.541 -1.796 1.00 24.32 H new ATOM 0 HG23 VAL A 35 -15.415 -2.709 -0.103 1.00 24.32 H new ATOM 540 N MET A 36 -11.063 -3.695 -1.227 1.00 4.13 N ATOM 541 CA MET A 36 -9.625 -3.719 -1.508 1.00 71.54 C ATOM 542 C MET A 36 -9.201 -5.072 -2.102 1.00 41.12 C ATOM 543 O MET A 36 -8.539 -5.114 -3.134 1.00 54.25 O ATOM 544 CB MET A 36 -8.828 -3.409 -0.230 1.00 14.13 C ATOM 545 CG MET A 36 -7.336 -3.198 -0.460 1.00 31.24 C ATOM 546 SD MET A 36 -6.476 -2.643 1.025 1.00 74.12 S ATOM 547 CE MET A 36 -7.249 -1.049 1.298 1.00 21.54 C ATOM 0 H MET A 36 -11.294 -3.602 -0.238 1.00 4.13 H new ATOM 0 HA MET A 36 -9.407 -2.949 -2.248 1.00 71.54 H new ATOM 0 HB2 MET A 36 -9.243 -2.515 0.235 1.00 14.13 H new ATOM 0 HB3 MET A 36 -8.963 -4.228 0.477 1.00 14.13 H new ATOM 0 HG2 MET A 36 -6.890 -4.130 -0.806 1.00 31.24 H new ATOM 0 HG3 MET A 36 -7.195 -2.463 -1.253 1.00 31.24 H new ATOM 0 HE1 MET A 36 -6.578 -0.413 1.876 1.00 21.54 H new ATOM 0 HE2 MET A 36 -7.459 -0.577 0.338 1.00 21.54 H new ATOM 0 HE3 MET A 36 -8.181 -1.186 1.846 1.00 21.54 H new ATOM 557 N ASN A 37 -9.603 -6.173 -1.462 1.00 44.35 N ATOM 558 CA ASN A 37 -9.317 -7.523 -1.980 1.00 73.32 C ATOM 559 C ASN A 37 -9.875 -7.705 -3.397 1.00 1.20 C ATOM 560 O ASN A 37 -9.173 -8.176 -4.292 1.00 75.41 O ATOM 561 CB ASN A 37 -9.895 -8.603 -1.052 1.00 62.12 C ATOM 562 CG ASN A 37 -8.985 -8.918 0.121 1.00 23.11 C ATOM 563 OD1 ASN A 37 -7.765 -8.925 -0.008 1.00 13.24 O ATOM 564 ND2 ASN A 37 -9.568 -9.180 1.271 1.00 74.25 N ATOM 0 H ASN A 37 -10.126 -6.162 -0.587 1.00 44.35 H new ATOM 0 HA ASN A 37 -8.233 -7.633 -2.016 1.00 73.32 H new ATOM 0 HB2 ASN A 37 -10.863 -8.273 -0.676 1.00 62.12 H new ATOM 0 HB3 ASN A 37 -10.069 -9.513 -1.626 1.00 62.12 H new ATOM 0 HD21 ASN A 37 -9.003 -9.398 2.091 1.00 74.25 H new ATOM 0 HD22 ASN A 37 -10.585 -9.165 1.342 1.00 74.25 H new ATOM 571 N GLY A 38 -11.137 -7.323 -3.591 1.00 11.43 N ATOM 572 CA GLY A 38 -11.763 -7.431 -4.903 1.00 13.23 C ATOM 573 C GLY A 38 -11.008 -6.668 -5.987 1.00 50.55 C ATOM 574 O GLY A 38 -10.763 -7.196 -7.076 1.00 32.13 O ATOM 0 H GLY A 38 -11.739 -6.940 -2.862 1.00 11.43 H new ATOM 0 HA2 GLY A 38 -11.827 -8.482 -5.184 1.00 13.23 H new ATOM 0 HA3 GLY A 38 -12.784 -7.054 -4.845 1.00 13.23 H new ATOM 578 N ARG A 39 -10.628 -5.427 -5.687 1.00 74.13 N ATOM 579 CA ARG A 39 -9.902 -4.588 -6.644 1.00 13.23 C ATOM 580 C ARG A 39 -8.463 -5.084 -6.869 1.00 54.22 C ATOM 581 O ARG A 39 -8.043 -5.250 -8.008 1.00 21.22 O ATOM 582 CB ARG A 39 -9.903 -3.121 -6.191 1.00 72.11 C ATOM 583 CG ARG A 39 -11.295 -2.497 -6.177 1.00 31.02 C ATOM 584 CD ARG A 39 -11.253 -1.002 -5.884 1.00 22.44 C ATOM 585 NE ARG A 39 -12.593 -0.416 -5.875 1.00 33.12 N ATOM 586 CZ ARG A 39 -12.898 0.739 -6.399 1.00 63.41 C ATOM 587 NH1 ARG A 39 -12.009 1.443 -7.022 1.00 61.53 N ATOM 588 NH2 ARG A 39 -14.111 1.176 -6.320 1.00 62.34 N ATOM 0 H ARG A 39 -10.810 -4.979 -4.789 1.00 74.13 H new ATOM 0 HA ARG A 39 -10.424 -4.660 -7.598 1.00 13.23 H new ATOM 0 HB2 ARG A 39 -9.473 -3.056 -5.192 1.00 72.11 H new ATOM 0 HB3 ARG A 39 -9.259 -2.542 -6.854 1.00 72.11 H new ATOM 0 HG2 ARG A 39 -11.775 -2.663 -7.141 1.00 31.02 H new ATOM 0 HG3 ARG A 39 -11.907 -2.996 -5.426 1.00 31.02 H new ATOM 0 HD2 ARG A 39 -10.775 -0.833 -4.919 1.00 22.44 H new ATOM 0 HD3 ARG A 39 -10.641 -0.501 -6.634 1.00 22.44 H new ATOM 0 HE ARG A 39 -13.341 -0.947 -5.428 1.00 33.12 H new ATOM 0 HH11 ARG A 39 -11.054 1.097 -7.109 1.00 61.53 H new ATOM 0 HH12 ARG A 39 -12.264 2.344 -7.426 1.00 61.53 H new ATOM 0 HH21 ARG A 39 -14.824 0.619 -5.850 1.00 62.34 H new ATOM 0 HH22 ARG A 39 -14.356 2.078 -6.728 1.00 62.34 H new ATOM 602 N LEU A 40 -7.719 -5.327 -5.786 1.00 12.12 N ATOM 603 CA LEU A 40 -6.342 -5.847 -5.887 1.00 53.22 C ATOM 604 C LEU A 40 -6.302 -7.145 -6.703 1.00 21.10 C ATOM 605 O LEU A 40 -5.469 -7.314 -7.595 1.00 12.33 O ATOM 606 CB LEU A 40 -5.752 -6.102 -4.490 1.00 41.14 C ATOM 607 CG LEU A 40 -5.574 -4.859 -3.606 1.00 75.44 C ATOM 608 CD1 LEU A 40 -5.014 -5.245 -2.237 1.00 32.43 C ATOM 609 CD2 LEU A 40 -4.671 -3.840 -4.289 1.00 1.15 C ATOM 0 H LEU A 40 -8.041 -5.174 -4.830 1.00 12.12 H new ATOM 0 HA LEU A 40 -5.743 -5.092 -6.396 1.00 53.22 H new ATOM 0 HB2 LEU A 40 -6.397 -6.808 -3.967 1.00 41.14 H new ATOM 0 HB3 LEU A 40 -4.781 -6.584 -4.608 1.00 41.14 H new ATOM 0 HG LEU A 40 -6.553 -4.403 -3.457 1.00 75.44 H new ATOM 0 HD11 LEU A 40 -4.896 -4.350 -1.627 1.00 32.43 H new ATOM 0 HD12 LEU A 40 -5.701 -5.932 -1.743 1.00 32.43 H new ATOM 0 HD13 LEU A 40 -4.045 -5.729 -2.363 1.00 32.43 H new ATOM 0 HD21 LEU A 40 -4.557 -2.967 -3.647 1.00 1.15 H new ATOM 0 HD22 LEU A 40 -3.693 -4.285 -4.472 1.00 1.15 H new ATOM 0 HD23 LEU A 40 -5.116 -3.538 -5.237 1.00 1.15 H new ATOM 621 N ARG A 41 -7.216 -8.055 -6.387 1.00 22.42 N ATOM 622 CA ARG A 41 -7.345 -9.316 -7.118 1.00 61.41 C ATOM 623 C ARG A 41 -7.696 -9.058 -8.591 1.00 2.34 C ATOM 624 O ARG A 41 -7.143 -9.686 -9.495 1.00 40.12 O ATOM 625 CB ARG A 41 -8.420 -10.181 -6.455 1.00 35.12 C ATOM 626 CG ARG A 41 -8.507 -11.609 -6.982 1.00 31.34 C ATOM 627 CD ARG A 41 -9.521 -12.418 -6.185 1.00 74.22 C ATOM 628 NE ARG A 41 -9.259 -12.341 -4.745 1.00 13.30 N ATOM 629 CZ ARG A 41 -10.139 -11.975 -3.848 1.00 24.14 C ATOM 630 NH1 ARG A 41 -11.339 -11.625 -4.200 1.00 60.42 N ATOM 631 NH2 ARG A 41 -9.805 -11.947 -2.599 1.00 4.15 N ATOM 0 H ARG A 41 -7.884 -7.944 -5.624 1.00 22.42 H new ATOM 0 HA ARG A 41 -6.391 -9.842 -7.088 1.00 61.41 H new ATOM 0 HB2 ARG A 41 -8.228 -10.216 -5.383 1.00 35.12 H new ATOM 0 HB3 ARG A 41 -9.388 -9.699 -6.590 1.00 35.12 H new ATOM 0 HG2 ARG A 41 -8.791 -11.597 -8.034 1.00 31.34 H new ATOM 0 HG3 ARG A 41 -7.528 -12.084 -6.922 1.00 31.34 H new ATOM 0 HD2 ARG A 41 -10.526 -12.050 -6.393 1.00 74.22 H new ATOM 0 HD3 ARG A 41 -9.490 -13.459 -6.506 1.00 74.22 H new ATOM 0 HE ARG A 41 -8.325 -12.590 -4.419 1.00 13.30 H new ATOM 0 HH11 ARG A 41 -11.604 -11.633 -5.185 1.00 60.42 H new ATOM 0 HH12 ARG A 41 -12.016 -11.342 -3.492 1.00 60.42 H new ATOM 0 HH21 ARG A 41 -8.860 -12.209 -2.318 1.00 4.15 H new ATOM 0 HH22 ARG A 41 -10.486 -11.663 -1.895 1.00 4.15 H new ATOM 645 N ALA A 42 -8.616 -8.118 -8.821 1.00 31.21 N ATOM 646 CA ALA A 42 -8.982 -7.707 -10.180 1.00 61.25 C ATOM 647 C ALA A 42 -7.777 -7.113 -10.924 1.00 60.52 C ATOM 648 O ALA A 42 -7.622 -7.312 -12.123 1.00 1.41 O ATOM 649 CB ALA A 42 -10.131 -6.706 -10.142 1.00 2.43 C ATOM 0 H ALA A 42 -9.122 -7.627 -8.084 1.00 31.21 H new ATOM 0 HA ALA A 42 -9.308 -8.594 -10.723 1.00 61.25 H new ATOM 0 HB1 ALA A 42 -10.390 -6.411 -11.159 1.00 2.43 H new ATOM 0 HB2 ALA A 42 -10.997 -7.164 -9.665 1.00 2.43 H new ATOM 0 HB3 ALA A 42 -9.828 -5.826 -9.575 1.00 2.43 H new ATOM 655 N ILE A 43 -6.922 -6.388 -10.201 1.00 52.34 N ATOM 656 CA ILE A 43 -5.690 -5.832 -10.777 1.00 50.55 C ATOM 657 C ILE A 43 -4.704 -6.952 -11.136 1.00 71.33 C ATOM 658 O ILE A 43 -4.064 -6.922 -12.188 1.00 61.43 O ATOM 659 CB ILE A 43 -5.001 -4.839 -9.801 1.00 73.22 C ATOM 660 CG1 ILE A 43 -5.927 -3.652 -9.485 1.00 51.43 C ATOM 661 CG2 ILE A 43 -3.677 -4.341 -10.377 1.00 30.44 C ATOM 662 CD1 ILE A 43 -5.368 -2.691 -8.449 1.00 44.02 C ATOM 0 H ILE A 43 -7.058 -6.170 -9.214 1.00 52.34 H new ATOM 0 HA ILE A 43 -5.974 -5.293 -11.681 1.00 50.55 H new ATOM 0 HB ILE A 43 -4.794 -5.371 -8.873 1.00 73.22 H new ATOM 0 HG12 ILE A 43 -6.124 -3.103 -10.406 1.00 51.43 H new ATOM 0 HG13 ILE A 43 -6.884 -4.035 -9.131 1.00 51.43 H new ATOM 0 HG21 ILE A 43 -3.213 -3.647 -9.676 1.00 30.44 H new ATOM 0 HG22 ILE A 43 -3.011 -5.188 -10.544 1.00 30.44 H new ATOM 0 HG23 ILE A 43 -3.860 -3.832 -11.323 1.00 30.44 H new ATOM 0 HD11 ILE A 43 -6.079 -1.882 -8.282 1.00 44.02 H new ATOM 0 HD12 ILE A 43 -5.197 -3.224 -7.513 1.00 44.02 H new ATOM 0 HD13 ILE A 43 -4.426 -2.277 -8.808 1.00 44.02 H new ATOM 674 N ARG A 44 -4.591 -7.943 -10.254 1.00 51.54 N ATOM 675 CA ARG A 44 -3.724 -9.097 -10.500 1.00 24.34 C ATOM 676 C ARG A 44 -4.263 -9.962 -11.651 1.00 4.12 C ATOM 677 O ARG A 44 -3.507 -10.649 -12.335 1.00 70.31 O ATOM 678 CB ARG A 44 -3.587 -9.949 -9.234 1.00 32.35 C ATOM 679 CG ARG A 44 -2.520 -11.028 -9.362 1.00 41.52 C ATOM 680 CD ARG A 44 -2.496 -11.974 -8.169 1.00 20.33 C ATOM 681 NE ARG A 44 -1.293 -12.799 -8.178 1.00 4.24 N ATOM 682 CZ ARG A 44 -1.227 -14.027 -7.740 1.00 24.02 C ATOM 683 NH1 ARG A 44 -2.292 -14.652 -7.346 1.00 62.12 N ATOM 684 NH2 ARG A 44 -0.083 -14.628 -7.706 1.00 54.10 N ATOM 0 H ARG A 44 -5.087 -7.972 -9.363 1.00 51.54 H new ATOM 0 HA ARG A 44 -2.742 -8.717 -10.783 1.00 24.34 H new ATOM 0 HB2 ARG A 44 -3.344 -9.302 -8.391 1.00 32.35 H new ATOM 0 HB3 ARG A 44 -4.546 -10.417 -9.011 1.00 32.35 H new ATOM 0 HG2 ARG A 44 -2.696 -11.602 -10.272 1.00 41.52 H new ATOM 0 HG3 ARG A 44 -1.543 -10.557 -9.467 1.00 41.52 H new ATOM 0 HD2 ARG A 44 -2.540 -11.399 -7.244 1.00 20.33 H new ATOM 0 HD3 ARG A 44 -3.379 -12.613 -8.189 1.00 20.33 H new ATOM 0 HE ARG A 44 -0.440 -12.386 -8.555 1.00 4.24 H new ATOM 0 HH11 ARG A 44 -3.198 -14.184 -7.376 1.00 62.12 H new ATOM 0 HH12 ARG A 44 -2.224 -15.611 -7.006 1.00 62.12 H new ATOM 0 HH21 ARG A 44 0.758 -14.143 -8.020 1.00 54.10 H new ATOM 0 HH22 ARG A 44 -0.021 -15.587 -7.365 1.00 54.10 H new ATOM 698 N SER A 45 -5.574 -9.937 -11.849 1.00 15.11 N ATOM 699 CA SER A 45 -6.204 -10.665 -12.960 1.00 22.33 C ATOM 700 C SER A 45 -6.201 -9.829 -14.253 1.00 24.13 C ATOM 701 O SER A 45 -6.112 -10.366 -15.356 1.00 31.12 O ATOM 702 CB SER A 45 -7.645 -11.051 -12.595 1.00 3.21 C ATOM 703 OG SER A 45 -8.374 -11.484 -13.734 1.00 10.52 O ATOM 0 H SER A 45 -6.228 -9.423 -11.259 1.00 15.11 H new ATOM 0 HA SER A 45 -5.621 -11.569 -13.136 1.00 22.33 H new ATOM 0 HB2 SER A 45 -7.632 -11.844 -11.848 1.00 3.21 H new ATOM 0 HB3 SER A 45 -8.148 -10.196 -12.144 1.00 3.21 H new ATOM 0 HG SER A 45 -9.286 -11.724 -13.467 1.00 10.52 H new ATOM 709 N SER A 46 -6.299 -8.511 -14.103 1.00 24.11 N ATOM 710 CA SER A 46 -6.330 -7.587 -15.248 1.00 71.10 C ATOM 711 C SER A 46 -4.925 -7.270 -15.763 1.00 34.43 C ATOM 712 O SER A 46 -4.587 -7.565 -16.908 1.00 40.12 O ATOM 713 CB SER A 46 -7.027 -6.274 -14.854 1.00 70.23 C ATOM 714 OG SER A 46 -7.020 -5.335 -15.921 1.00 54.31 O ATOM 0 H SER A 46 -6.359 -8.050 -13.195 1.00 24.11 H new ATOM 0 HA SER A 46 -6.886 -8.082 -16.045 1.00 71.10 H new ATOM 0 HB2 SER A 46 -8.055 -6.482 -14.559 1.00 70.23 H new ATOM 0 HB3 SER A 46 -6.528 -5.843 -13.986 1.00 70.23 H new ATOM 0 HG SER A 46 -7.472 -4.513 -15.637 1.00 54.31 H new ATOM 720 N HIS A 47 -4.114 -6.663 -14.901 1.00 53.30 N ATOM 721 CA HIS A 47 -2.776 -6.192 -15.274 1.00 75.14 C ATOM 722 C HIS A 47 -1.680 -7.145 -14.771 1.00 31.32 C ATOM 723 O HIS A 47 -0.492 -6.900 -14.983 1.00 70.41 O ATOM 724 CB HIS A 47 -2.552 -4.793 -14.683 1.00 20.11 C ATOM 725 CG HIS A 47 -3.729 -3.880 -14.854 1.00 55.01 C ATOM 726 ND1 HIS A 47 -4.684 -3.522 -13.959 1.00 53.45 N flip ATOM 727 CD2 HIS A 47 -4.000 -3.284 -16.053 1.00 71.42 C flip ATOM 728 CE1 HIS A 47 -5.558 -2.697 -14.622 1.00 73.31 C flip ATOM 729 NE2 HIS A 47 -5.103 -2.586 -15.876 1.00 53.32 N flip ATOM 0 H HIS A 47 -4.361 -6.483 -13.928 1.00 53.30 H new ATOM 0 HA HIS A 47 -2.716 -6.158 -16.362 1.00 75.14 H new ATOM 0 HB2 HIS A 47 -2.326 -4.887 -13.621 1.00 20.11 H new ATOM 0 HB3 HIS A 47 -1.680 -4.342 -15.156 1.00 20.11 H new ATOM 0 HD1 HIS A 47 -4.741 -3.810 -12.982 1.00 53.45 H new ATOM 0 HD2 HIS A 47 -3.425 -3.368 -16.963 1.00 71.42 H new ATOM 0 HE1 HIS A 47 -6.441 -2.229 -14.212 1.00 73.31 H new ATOM 737 N ALA A 48 -2.095 -8.218 -14.086 1.00 34.24 N ATOM 738 CA ALA A 48 -1.166 -9.179 -13.467 1.00 53.00 C ATOM 739 C ALA A 48 -0.314 -8.525 -12.365 1.00 15.53 C ATOM 740 O ALA A 48 0.639 -9.124 -11.861 1.00 62.11 O ATOM 741 CB ALA A 48 -0.279 -9.838 -14.524 1.00 23.40 C ATOM 0 H ALA A 48 -3.079 -8.446 -13.944 1.00 34.24 H new ATOM 0 HA ALA A 48 -1.769 -9.954 -12.993 1.00 53.00 H new ATOM 0 HB1 ALA A 48 0.398 -10.543 -14.042 1.00 23.40 H new ATOM 0 HB2 ALA A 48 -0.903 -10.368 -15.244 1.00 23.40 H new ATOM 0 HB3 ALA A 48 0.301 -9.073 -15.041 1.00 23.40 H new ATOM 747 N VAL A 49 -0.678 -7.302 -11.983 1.00 21.12 N ATOM 748 CA VAL A 49 0.052 -6.555 -10.959 1.00 14.15 C ATOM 749 C VAL A 49 -0.291 -7.062 -9.556 1.00 60.51 C ATOM 750 O VAL A 49 -1.416 -6.900 -9.079 1.00 4.43 O ATOM 751 CB VAL A 49 -0.250 -5.035 -11.052 1.00 21.10 C ATOM 752 CG1 VAL A 49 0.359 -4.269 -9.873 1.00 21.21 C ATOM 753 CG2 VAL A 49 0.254 -4.474 -12.381 1.00 63.42 C ATOM 0 H VAL A 49 -1.480 -6.804 -12.370 1.00 21.12 H new ATOM 0 HA VAL A 49 1.115 -6.714 -11.140 1.00 14.15 H new ATOM 0 HB VAL A 49 -1.331 -4.904 -11.005 1.00 21.10 H new ATOM 0 HG11 VAL A 49 0.128 -3.208 -9.970 1.00 21.21 H new ATOM 0 HG12 VAL A 49 -0.058 -4.647 -8.939 1.00 21.21 H new ATOM 0 HG13 VAL A 49 1.440 -4.406 -9.870 1.00 21.21 H new ATOM 0 HG21 VAL A 49 0.035 -3.407 -12.432 1.00 63.42 H new ATOM 0 HG22 VAL A 49 1.331 -4.628 -12.456 1.00 63.42 H new ATOM 0 HG23 VAL A 49 -0.244 -4.986 -13.204 1.00 63.42 H new ATOM 763 N GLU A 50 0.680 -7.692 -8.907 1.00 60.21 N ATOM 764 CA GLU A 50 0.489 -8.200 -7.551 1.00 32.13 C ATOM 765 C GLU A 50 0.689 -7.069 -6.529 1.00 0.21 C ATOM 766 O GLU A 50 1.809 -6.747 -6.132 1.00 73.21 O ATOM 767 CB GLU A 50 1.444 -9.376 -7.306 1.00 22.30 C ATOM 768 CG GLU A 50 1.262 -10.496 -8.333 1.00 32.40 C ATOM 769 CD GLU A 50 2.235 -11.651 -8.162 1.00 5.24 C ATOM 770 OE1 GLU A 50 3.384 -11.539 -8.636 1.00 43.24 O ATOM 771 OE2 GLU A 50 1.844 -12.683 -7.575 1.00 72.04 O ATOM 0 H GLU A 50 1.607 -7.864 -9.296 1.00 60.21 H new ATOM 0 HA GLU A 50 -0.531 -8.566 -7.431 1.00 32.13 H new ATOM 0 HB2 GLU A 50 2.473 -9.019 -7.340 1.00 22.30 H new ATOM 0 HB3 GLU A 50 1.278 -9.774 -6.305 1.00 22.30 H new ATOM 0 HG2 GLU A 50 0.244 -10.878 -8.263 1.00 32.40 H new ATOM 0 HG3 GLU A 50 1.378 -10.081 -9.334 1.00 32.40 H new ATOM 778 N PHE A 51 -0.427 -6.468 -6.126 1.00 53.12 N ATOM 779 CA PHE A 51 -0.437 -5.249 -5.307 1.00 54.44 C ATOM 780 C PHE A 51 -0.885 -5.556 -3.865 1.00 1.34 C ATOM 781 O PHE A 51 -2.072 -5.746 -3.601 1.00 23.41 O ATOM 782 CB PHE A 51 -1.384 -4.240 -5.982 1.00 14.35 C ATOM 783 CG PHE A 51 -1.404 -2.842 -5.408 1.00 73.21 C ATOM 784 CD1 PHE A 51 -0.514 -2.434 -4.420 1.00 62.21 C ATOM 785 CD2 PHE A 51 -2.334 -1.927 -5.880 1.00 51.44 C ATOM 786 CE1 PHE A 51 -0.559 -1.145 -3.922 1.00 50.33 C ATOM 787 CE2 PHE A 51 -2.380 -0.642 -5.386 1.00 22.45 C ATOM 788 CZ PHE A 51 -1.494 -0.248 -4.408 1.00 41.23 C ATOM 0 H PHE A 51 -1.359 -6.812 -6.358 1.00 53.12 H new ATOM 0 HA PHE A 51 0.567 -4.831 -5.240 1.00 54.44 H new ATOM 0 HB2 PHE A 51 -1.114 -4.172 -7.036 1.00 14.35 H new ATOM 0 HB3 PHE A 51 -2.397 -4.641 -5.938 1.00 14.35 H new ATOM 0 HD1 PHE A 51 0.218 -3.130 -4.039 1.00 62.21 H new ATOM 0 HD2 PHE A 51 -3.033 -2.227 -6.647 1.00 51.44 H new ATOM 0 HE1 PHE A 51 0.135 -0.838 -3.154 1.00 50.33 H new ATOM 0 HE2 PHE A 51 -3.111 0.057 -5.766 1.00 22.45 H new ATOM 0 HZ PHE A 51 -1.529 0.760 -4.021 1.00 41.23 H new ATOM 798 N ALA A 52 0.071 -5.608 -2.940 1.00 42.03 N ATOM 799 CA ALA A 52 -0.210 -5.990 -1.547 1.00 55.54 C ATOM 800 C ALA A 52 -0.231 -4.780 -0.601 1.00 32.33 C ATOM 801 O ALA A 52 0.601 -3.880 -0.710 1.00 40.33 O ATOM 802 CB ALA A 52 0.821 -7.010 -1.071 1.00 55.50 C ATOM 0 H ALA A 52 1.050 -5.391 -3.125 1.00 42.03 H new ATOM 0 HA ALA A 52 -1.206 -6.433 -1.525 1.00 55.54 H new ATOM 0 HB1 ALA A 52 0.608 -7.289 -0.039 1.00 55.50 H new ATOM 0 HB2 ALA A 52 0.775 -7.897 -1.703 1.00 55.50 H new ATOM 0 HB3 ALA A 52 1.818 -6.574 -1.130 1.00 55.50 H new ATOM 808 N VAL A 53 -1.181 -4.777 0.339 1.00 3.01 N ATOM 809 CA VAL A 53 -1.325 -3.685 1.314 1.00 14.44 C ATOM 810 C VAL A 53 -1.274 -4.211 2.763 1.00 11.22 C ATOM 811 O VAL A 53 -2.112 -5.016 3.176 1.00 11.20 O ATOM 812 CB VAL A 53 -2.654 -2.912 1.102 1.00 4.14 C ATOM 813 CG1 VAL A 53 -2.777 -1.746 2.086 1.00 4.13 C ATOM 814 CG2 VAL A 53 -2.775 -2.419 -0.343 1.00 14.30 C ATOM 0 H VAL A 53 -1.868 -5.523 0.448 1.00 3.01 H new ATOM 0 HA VAL A 53 -0.486 -3.008 1.152 1.00 14.44 H new ATOM 0 HB VAL A 53 -3.475 -3.602 1.295 1.00 4.14 H new ATOM 0 HG11 VAL A 53 -3.718 -1.223 1.914 1.00 4.13 H new ATOM 0 HG12 VAL A 53 -2.755 -2.128 3.107 1.00 4.13 H new ATOM 0 HG13 VAL A 53 -1.946 -1.056 1.939 1.00 4.13 H new ATOM 0 HG21 VAL A 53 -3.715 -1.880 -0.466 1.00 14.30 H new ATOM 0 HG22 VAL A 53 -1.943 -1.753 -0.571 1.00 14.30 H new ATOM 0 HG23 VAL A 53 -2.754 -3.272 -1.021 1.00 14.30 H new ATOM 824 N VAL A 54 -0.292 -3.740 3.532 1.00 25.22 N ATOM 825 CA VAL A 54 -0.104 -4.172 4.925 1.00 22.02 C ATOM 826 C VAL A 54 -0.202 -2.987 5.902 1.00 73.45 C ATOM 827 O VAL A 54 0.309 -1.903 5.625 1.00 33.05 O ATOM 828 CB VAL A 54 1.277 -4.859 5.115 1.00 53.20 C ATOM 829 CG1 VAL A 54 1.438 -5.379 6.544 1.00 21.14 C ATOM 830 CG2 VAL A 54 1.468 -5.983 4.098 1.00 32.33 C ATOM 0 H VAL A 54 0.393 -3.054 3.214 1.00 25.22 H new ATOM 0 HA VAL A 54 -0.901 -4.883 5.142 1.00 22.02 H new ATOM 0 HB VAL A 54 2.052 -4.113 4.942 1.00 53.20 H new ATOM 0 HG11 VAL A 54 2.413 -5.855 6.650 1.00 21.14 H new ATOM 0 HG12 VAL A 54 1.362 -4.547 7.245 1.00 21.14 H new ATOM 0 HG13 VAL A 54 0.654 -6.106 6.757 1.00 21.14 H new ATOM 0 HG21 VAL A 54 2.441 -6.450 4.250 1.00 32.33 H new ATOM 0 HG22 VAL A 54 0.684 -6.729 4.228 1.00 32.33 H new ATOM 0 HG23 VAL A 54 1.415 -5.574 3.089 1.00 32.33 H new ATOM 840 N THR A 55 -0.861 -3.197 7.043 1.00 50.15 N ATOM 841 CA THR A 55 -0.965 -2.164 8.091 1.00 73.40 C ATOM 842 C THR A 55 -0.306 -2.634 9.394 1.00 11.10 C ATOM 843 O THR A 55 -0.622 -3.706 9.913 1.00 14.24 O ATOM 844 CB THR A 55 -2.436 -1.787 8.402 1.00 2.43 C ATOM 845 OG1 THR A 55 -3.087 -2.850 9.114 1.00 45.32 O ATOM 846 CG2 THR A 55 -3.209 -1.493 7.124 1.00 63.51 C ATOM 0 H THR A 55 -1.333 -4.072 7.271 1.00 50.15 H new ATOM 0 HA THR A 55 -0.449 -1.287 7.701 1.00 73.40 H new ATOM 0 HB THR A 55 -2.422 -0.889 9.020 1.00 2.43 H new ATOM 0 HG1 THR A 55 -4.048 -2.667 9.168 1.00 45.32 H new ATOM 0 HG21 THR A 55 -4.237 -1.232 7.373 1.00 63.51 H new ATOM 0 HG22 THR A 55 -2.740 -0.661 6.598 1.00 63.51 H new ATOM 0 HG23 THR A 55 -3.204 -2.376 6.484 1.00 63.51 H new ATOM 854 N LEU A 56 0.607 -1.827 9.926 1.00 20.22 N ATOM 855 CA LEU A 56 1.321 -2.169 11.163 1.00 32.53 C ATOM 856 C LEU A 56 1.191 -1.056 12.220 1.00 43.02 C ATOM 857 O LEU A 56 1.234 0.133 11.891 1.00 14.32 O ATOM 858 CB LEU A 56 2.803 -2.424 10.863 1.00 14.21 C ATOM 859 CG LEU A 56 3.095 -3.516 9.817 1.00 44.52 C ATOM 860 CD1 LEU A 56 4.577 -3.534 9.459 1.00 51.55 C ATOM 861 CD2 LEU A 56 2.652 -4.889 10.323 1.00 33.33 C ATOM 0 H LEU A 56 0.874 -0.929 9.523 1.00 20.22 H new ATOM 0 HA LEU A 56 0.867 -3.074 11.566 1.00 32.53 H new ATOM 0 HB2 LEU A 56 3.251 -1.491 10.522 1.00 14.21 H new ATOM 0 HB3 LEU A 56 3.301 -2.696 11.794 1.00 14.21 H new ATOM 0 HG LEU A 56 2.524 -3.283 8.918 1.00 44.52 H new ATOM 0 HD11 LEU A 56 4.763 -4.312 8.719 1.00 51.55 H new ATOM 0 HD12 LEU A 56 4.864 -2.566 9.048 1.00 51.55 H new ATOM 0 HD13 LEU A 56 5.165 -3.737 10.354 1.00 51.55 H new ATOM 0 HD21 LEU A 56 2.869 -5.643 9.566 1.00 33.33 H new ATOM 0 HD22 LEU A 56 3.190 -5.130 11.240 1.00 33.33 H new ATOM 0 HD23 LEU A 56 1.581 -4.874 10.524 1.00 33.33 H new ATOM 873 N PRO A 57 1.032 -1.428 13.509 1.00 4.33 N ATOM 874 CA PRO A 57 0.922 -0.454 14.612 1.00 53.23 C ATOM 875 C PRO A 57 2.189 0.403 14.787 1.00 11.22 C ATOM 876 O PRO A 57 2.149 1.627 14.648 1.00 21.24 O ATOM 877 CB PRO A 57 0.697 -1.337 15.857 1.00 60.40 C ATOM 878 CG PRO A 57 0.248 -2.657 15.324 1.00 33.52 C ATOM 879 CD PRO A 57 0.931 -2.815 13.994 1.00 54.40 C ATOM 0 HA PRO A 57 0.123 0.264 14.428 1.00 53.23 H new ATOM 0 HB2 PRO A 57 1.613 -1.438 16.439 1.00 60.40 H new ATOM 0 HB3 PRO A 57 -0.054 -0.903 16.517 1.00 60.40 H new ATOM 0 HG2 PRO A 57 0.520 -3.466 16.002 1.00 33.52 H new ATOM 0 HG3 PRO A 57 -0.836 -2.686 15.213 1.00 33.52 H new ATOM 0 HD2 PRO A 57 1.912 -3.280 14.096 1.00 54.40 H new ATOM 0 HD3 PRO A 57 0.352 -3.440 13.314 1.00 54.40 H new ATOM 887 N SER A 58 3.317 -0.245 15.082 1.00 15.14 N ATOM 888 CA SER A 58 4.574 0.469 15.352 1.00 32.30 C ATOM 889 C SER A 58 5.796 -0.340 14.904 1.00 65.03 C ATOM 890 O SER A 58 5.800 -1.568 14.985 1.00 40.51 O ATOM 891 CB SER A 58 4.692 0.784 16.853 1.00 24.00 C ATOM 892 OG SER A 58 4.659 -0.402 17.637 1.00 41.05 O ATOM 0 H SER A 58 3.390 -1.261 15.141 1.00 15.14 H new ATOM 0 HA SER A 58 4.552 1.396 14.779 1.00 32.30 H new ATOM 0 HB2 SER A 58 5.622 1.321 17.042 1.00 24.00 H new ATOM 0 HB3 SER A 58 3.877 1.443 17.153 1.00 24.00 H new ATOM 0 HG SER A 58 4.738 -0.169 18.586 1.00 41.05 H new ATOM 898 N ILE A 59 6.830 0.355 14.427 1.00 52.25 N ATOM 899 CA ILE A 59 8.089 -0.292 14.018 1.00 30.03 C ATOM 900 C ILE A 59 9.308 0.363 14.693 1.00 4.22 C ATOM 901 O ILE A 59 10.456 0.008 14.414 1.00 42.52 O ATOM 902 CB ILE A 59 8.278 -0.253 12.476 1.00 64.11 C ATOM 903 CG1 ILE A 59 8.354 1.199 11.971 1.00 3.12 C ATOM 904 CG2 ILE A 59 7.146 -1.007 11.778 1.00 12.34 C ATOM 905 CD1 ILE A 59 8.580 1.321 10.475 1.00 72.14 C ATOM 0 H ILE A 59 6.825 1.369 14.312 1.00 52.25 H new ATOM 0 HA ILE A 59 8.020 -1.331 14.341 1.00 30.03 H new ATOM 0 HB ILE A 59 9.220 -0.746 12.235 1.00 64.11 H new ATOM 0 HG12 ILE A 59 7.428 1.712 12.231 1.00 3.12 H new ATOM 0 HG13 ILE A 59 9.161 1.713 12.493 1.00 3.12 H new ATOM 0 HG21 ILE A 59 7.295 -0.969 10.699 1.00 12.34 H new ATOM 0 HG22 ILE A 59 7.143 -2.046 12.108 1.00 12.34 H new ATOM 0 HG23 ILE A 59 6.192 -0.544 12.029 1.00 12.34 H new ATOM 0 HD11 ILE A 59 8.622 2.374 10.198 1.00 72.14 H new ATOM 0 HD12 ILE A 59 9.520 0.838 10.209 1.00 72.14 H new ATOM 0 HD13 ILE A 59 7.761 0.838 9.943 1.00 72.14 H new ATOM 917 N GLY A 60 9.052 1.311 15.595 1.00 51.34 N ATOM 918 CA GLY A 60 10.136 2.016 16.273 1.00 51.42 C ATOM 919 C GLY A 60 10.934 2.933 15.349 1.00 73.14 C ATOM 920 O GLY A 60 10.363 3.648 14.523 1.00 33.24 O ATOM 0 H GLY A 60 8.115 1.605 15.870 1.00 51.34 H new ATOM 0 HA2 GLY A 60 9.721 2.607 17.089 1.00 51.42 H new ATOM 0 HA3 GLY A 60 10.811 1.286 16.720 1.00 51.42 H new ATOM 924 N ASP A 61 12.260 2.905 15.477 1.00 1.31 N ATOM 925 CA ASP A 61 13.139 3.756 14.660 1.00 4.42 C ATOM 926 C ASP A 61 13.513 3.077 13.330 1.00 33.30 C ATOM 927 O ASP A 61 14.452 3.499 12.649 1.00 11.32 O ATOM 928 CB ASP A 61 14.414 4.100 15.442 1.00 11.00 C ATOM 929 CG ASP A 61 14.114 4.668 16.816 1.00 74.14 C ATOM 930 OD1 ASP A 61 13.675 5.833 16.904 1.00 21.23 O ATOM 931 OD2 ASP A 61 14.309 3.948 17.818 1.00 1.53 O ATOM 0 H ASP A 61 12.754 2.304 16.137 1.00 1.31 H new ATOM 0 HA ASP A 61 12.592 4.670 14.429 1.00 4.42 H new ATOM 0 HB2 ASP A 61 15.025 3.204 15.548 1.00 11.00 H new ATOM 0 HB3 ASP A 61 15.002 4.821 14.874 1.00 11.00 H new ATOM 936 N ALA A 62 12.779 2.031 12.963 1.00 42.03 N ATOM 937 CA ALA A 62 13.045 1.293 11.724 1.00 10.13 C ATOM 938 C ALA A 62 12.635 2.105 10.481 1.00 62.31 C ATOM 939 O ALA A 62 11.490 2.547 10.367 1.00 5.20 O ATOM 940 CB ALA A 62 12.317 -0.048 11.748 1.00 74.44 C ATOM 0 H ALA A 62 11.993 1.672 13.504 1.00 42.03 H new ATOM 0 HA ALA A 62 14.119 1.117 11.662 1.00 10.13 H new ATOM 0 HB1 ALA A 62 12.520 -0.589 10.824 1.00 74.44 H new ATOM 0 HB2 ALA A 62 12.666 -0.636 12.597 1.00 74.44 H new ATOM 0 HB3 ALA A 62 11.244 0.122 11.840 1.00 74.44 H new ATOM 946 N PRO A 63 13.564 2.316 9.528 1.00 32.31 N ATOM 947 CA PRO A 63 13.261 3.039 8.281 1.00 53.44 C ATOM 948 C PRO A 63 12.320 2.243 7.360 1.00 4.41 C ATOM 949 O PRO A 63 12.717 1.235 6.770 1.00 74.31 O ATOM 950 CB PRO A 63 14.640 3.222 7.630 1.00 50.44 C ATOM 951 CG PRO A 63 15.473 2.112 8.184 1.00 43.24 C ATOM 952 CD PRO A 63 14.973 1.875 9.585 1.00 63.41 C ATOM 0 HA PRO A 63 12.741 3.979 8.467 1.00 53.44 H new ATOM 0 HB2 PRO A 63 14.575 3.164 6.543 1.00 50.44 H new ATOM 0 HB3 PRO A 63 15.066 4.196 7.873 1.00 50.44 H new ATOM 0 HG2 PRO A 63 15.376 1.211 7.578 1.00 43.24 H new ATOM 0 HG3 PRO A 63 16.529 2.381 8.187 1.00 43.24 H new ATOM 0 HD2 PRO A 63 15.054 0.825 9.868 1.00 63.41 H new ATOM 0 HD3 PRO A 63 15.543 2.447 10.317 1.00 63.41 H new ATOM 960 N LEU A 64 11.072 2.701 7.240 1.00 35.00 N ATOM 961 CA LEU A 64 10.052 1.991 6.452 1.00 72.12 C ATOM 962 C LEU A 64 10.483 1.802 4.984 1.00 43.14 C ATOM 963 O LEU A 64 10.106 0.824 4.333 1.00 53.50 O ATOM 964 CB LEU A 64 8.714 2.740 6.522 1.00 31.35 C ATOM 965 CG LEU A 64 7.532 2.052 5.813 1.00 12.14 C ATOM 966 CD1 LEU A 64 7.300 0.646 6.365 1.00 0.04 C ATOM 967 CD2 LEU A 64 6.265 2.893 5.938 1.00 4.55 C ATOM 0 H LEU A 64 10.740 3.560 7.677 1.00 35.00 H new ATOM 0 HA LEU A 64 9.934 0.998 6.887 1.00 72.12 H new ATOM 0 HB2 LEU A 64 8.452 2.884 7.570 1.00 31.35 H new ATOM 0 HB3 LEU A 64 8.849 3.731 6.088 1.00 31.35 H new ATOM 0 HG LEU A 64 7.783 1.961 4.756 1.00 12.14 H new ATOM 0 HD11 LEU A 64 6.460 0.185 5.846 1.00 0.04 H new ATOM 0 HD12 LEU A 64 8.195 0.043 6.213 1.00 0.04 H new ATOM 0 HD13 LEU A 64 7.079 0.705 7.431 1.00 0.04 H new ATOM 0 HD21 LEU A 64 5.442 2.389 5.431 1.00 4.55 H new ATOM 0 HD22 LEU A 64 6.017 3.022 6.991 1.00 4.55 H new ATOM 0 HD23 LEU A 64 6.430 3.869 5.481 1.00 4.55 H new ATOM 979 N GLU A 65 11.292 2.729 4.483 1.00 23.42 N ATOM 980 CA GLU A 65 11.805 2.658 3.106 1.00 22.21 C ATOM 981 C GLU A 65 12.699 1.422 2.910 1.00 31.33 C ATOM 982 O GLU A 65 12.753 0.838 1.827 1.00 22.42 O ATOM 983 CB GLU A 65 12.599 3.932 2.766 1.00 32.14 C ATOM 984 CG GLU A 65 11.786 5.228 2.825 1.00 15.34 C ATOM 985 CD GLU A 65 11.269 5.555 4.219 1.00 41.20 C ATOM 986 OE1 GLU A 65 12.098 5.683 5.148 1.00 40.25 O ATOM 987 OE2 GLU A 65 10.034 5.661 4.401 1.00 31.20 O ATOM 0 H GLU A 65 11.612 3.544 5.006 1.00 23.42 H new ATOM 0 HA GLU A 65 10.950 2.575 2.435 1.00 22.21 H new ATOM 0 HB2 GLU A 65 13.439 4.015 3.455 1.00 32.14 H new ATOM 0 HB3 GLU A 65 13.017 3.827 1.765 1.00 32.14 H new ATOM 0 HG2 GLU A 65 12.405 6.053 2.473 1.00 15.34 H new ATOM 0 HG3 GLU A 65 10.941 5.149 2.141 1.00 15.34 H new ATOM 994 N ASP A 66 13.400 1.042 3.971 1.00 13.42 N ATOM 995 CA ASP A 66 14.261 -0.146 3.971 1.00 52.30 C ATOM 996 C ASP A 66 13.460 -1.390 4.414 1.00 61.34 C ATOM 997 O ASP A 66 13.697 -2.507 3.949 1.00 31.42 O ATOM 998 CB ASP A 66 15.449 0.101 4.915 1.00 5.24 C ATOM 999 CG ASP A 66 16.519 -0.975 4.827 1.00 1.53 C ATOM 1000 OD1 ASP A 66 17.427 -0.844 3.983 1.00 12.23 O ATOM 1001 OD2 ASP A 66 16.465 -1.946 5.609 1.00 60.41 O ATOM 0 H ASP A 66 13.391 1.545 4.858 1.00 13.42 H new ATOM 0 HA ASP A 66 14.633 -0.330 2.963 1.00 52.30 H new ATOM 0 HB2 ASP A 66 15.895 1.068 4.681 1.00 5.24 H new ATOM 0 HB3 ASP A 66 15.084 0.158 5.940 1.00 5.24 H new ATOM 1006 N PHE A 67 12.502 -1.160 5.311 1.00 0.34 N ATOM 1007 CA PHE A 67 11.614 -2.203 5.850 1.00 52.01 C ATOM 1008 C PHE A 67 10.925 -3.010 4.733 1.00 5.00 C ATOM 1009 O PHE A 67 10.966 -4.245 4.728 1.00 14.40 O ATOM 1010 CB PHE A 67 10.562 -1.514 6.738 1.00 51.53 C ATOM 1011 CG PHE A 67 9.617 -2.430 7.480 1.00 72.23 C ATOM 1012 CD1 PHE A 67 8.553 -3.044 6.827 1.00 12.04 C ATOM 1013 CD2 PHE A 67 9.776 -2.654 8.840 1.00 1.54 C ATOM 1014 CE1 PHE A 67 7.677 -3.859 7.514 1.00 13.41 C ATOM 1015 CE2 PHE A 67 8.902 -3.470 9.529 1.00 23.53 C ATOM 1016 CZ PHE A 67 7.853 -4.073 8.866 1.00 73.23 C ATOM 0 H PHE A 67 12.314 -0.233 5.692 1.00 0.34 H new ATOM 0 HA PHE A 67 12.206 -2.913 6.428 1.00 52.01 H new ATOM 0 HB2 PHE A 67 11.082 -0.893 7.468 1.00 51.53 H new ATOM 0 HB3 PHE A 67 9.971 -0.844 6.113 1.00 51.53 H new ATOM 0 HD1 PHE A 67 8.411 -2.881 5.769 1.00 12.04 H new ATOM 0 HD2 PHE A 67 10.594 -2.184 9.366 1.00 1.54 H new ATOM 0 HE1 PHE A 67 6.855 -4.329 6.995 1.00 13.41 H new ATOM 0 HE2 PHE A 67 9.039 -3.637 10.587 1.00 23.53 H new ATOM 0 HZ PHE A 67 7.170 -4.712 9.405 1.00 73.23 H new ATOM 1026 N THR A 68 10.292 -2.307 3.793 1.00 1.14 N ATOM 1027 CA THR A 68 9.538 -2.961 2.712 1.00 52.12 C ATOM 1028 C THR A 68 10.420 -3.862 1.846 1.00 4.32 C ATOM 1029 O THR A 68 9.951 -4.869 1.325 1.00 32.23 O ATOM 1030 CB THR A 68 8.832 -1.934 1.799 1.00 20.44 C ATOM 1031 OG1 THR A 68 9.792 -1.031 1.232 1.00 21.42 O ATOM 1032 CG2 THR A 68 7.780 -1.153 2.576 1.00 64.45 C ATOM 0 H THR A 68 10.284 -1.288 3.754 1.00 1.14 H new ATOM 0 HA THR A 68 8.790 -3.577 3.212 1.00 52.12 H new ATOM 0 HB THR A 68 8.336 -2.478 0.995 1.00 20.44 H new ATOM 0 HG1 THR A 68 10.204 -1.444 0.444 1.00 21.42 H new ATOM 0 HG21 THR A 68 7.296 -0.436 1.913 1.00 64.45 H new ATOM 0 HG22 THR A 68 7.034 -1.842 2.972 1.00 64.45 H new ATOM 0 HG23 THR A 68 8.256 -0.621 3.400 1.00 64.45 H new ATOM 1040 N LEU A 69 11.695 -3.504 1.700 1.00 3.41 N ATOM 1041 CA LEU A 69 12.641 -4.320 0.929 1.00 41.31 C ATOM 1042 C LEU A 69 12.696 -5.761 1.471 1.00 43.33 C ATOM 1043 O LEU A 69 12.490 -6.724 0.732 1.00 41.44 O ATOM 1044 CB LEU A 69 14.040 -3.684 0.959 1.00 22.51 C ATOM 1045 CG LEU A 69 15.125 -4.419 0.146 1.00 71.42 C ATOM 1046 CD1 LEU A 69 14.752 -4.482 -1.334 1.00 31.21 C ATOM 1047 CD2 LEU A 69 16.486 -3.746 0.330 1.00 31.33 C ATOM 0 H LEU A 69 12.099 -2.658 2.103 1.00 3.41 H new ATOM 0 HA LEU A 69 12.294 -4.359 -0.103 1.00 41.31 H new ATOM 0 HB2 LEU A 69 13.963 -2.662 0.587 1.00 22.51 H new ATOM 0 HB3 LEU A 69 14.369 -3.622 1.996 1.00 22.51 H new ATOM 0 HG LEU A 69 15.192 -5.440 0.521 1.00 71.42 H new ATOM 0 HD11 LEU A 69 15.534 -5.005 -1.884 1.00 31.21 H new ATOM 0 HD12 LEU A 69 13.808 -5.015 -1.449 1.00 31.21 H new ATOM 0 HD13 LEU A 69 14.647 -3.470 -1.726 1.00 31.21 H new ATOM 0 HD21 LEU A 69 17.237 -4.280 -0.252 1.00 31.33 H new ATOM 0 HD22 LEU A 69 16.430 -2.712 -0.011 1.00 31.33 H new ATOM 0 HD23 LEU A 69 16.762 -3.766 1.384 1.00 31.33 H new ATOM 1059 N LYS A 70 12.947 -5.901 2.774 1.00 12.31 N ATOM 1060 CA LYS A 70 13.014 -7.223 3.412 1.00 0.33 C ATOM 1061 C LYS A 70 11.686 -7.991 3.293 1.00 53.23 C ATOM 1062 O LYS A 70 11.670 -9.220 3.193 1.00 72.44 O ATOM 1063 CB LYS A 70 13.404 -7.087 4.893 1.00 12.24 C ATOM 1064 CG LYS A 70 14.839 -6.619 5.113 1.00 21.25 C ATOM 1065 CD LYS A 70 15.308 -6.858 6.549 1.00 23.14 C ATOM 1066 CE LYS A 70 15.380 -8.349 6.879 1.00 20.32 C ATOM 1067 NZ LYS A 70 15.907 -8.601 8.248 1.00 32.34 N ATOM 0 H LYS A 70 13.107 -5.119 3.409 1.00 12.31 H new ATOM 0 HA LYS A 70 13.778 -7.794 2.885 1.00 0.33 H new ATOM 0 HB2 LYS A 70 12.725 -6.383 5.374 1.00 12.24 H new ATOM 0 HB3 LYS A 70 13.267 -8.050 5.385 1.00 12.24 H new ATOM 0 HG2 LYS A 70 15.501 -7.144 4.424 1.00 21.25 H new ATOM 0 HG3 LYS A 70 14.913 -5.557 4.880 1.00 21.25 H new ATOM 0 HD2 LYS A 70 16.290 -6.406 6.691 1.00 23.14 H new ATOM 0 HD3 LYS A 70 14.626 -6.364 7.242 1.00 23.14 H new ATOM 0 HE2 LYS A 70 14.386 -8.787 6.789 1.00 20.32 H new ATOM 0 HE3 LYS A 70 16.016 -8.850 6.149 1.00 20.32 H new ATOM 0 HZ1 LYS A 70 15.811 -9.611 8.476 1.00 32.34 H new ATOM 0 HZ2 LYS A 70 16.910 -8.331 8.289 1.00 32.34 H new ATOM 0 HZ3 LYS A 70 15.368 -8.038 8.937 1.00 32.34 H new ATOM 1081 N LEU A 71 10.573 -7.265 3.313 1.00 10.31 N ATOM 1082 CA LEU A 71 9.245 -7.881 3.209 1.00 70.13 C ATOM 1083 C LEU A 71 8.946 -8.350 1.769 1.00 74.14 C ATOM 1084 O LEU A 71 8.643 -9.521 1.533 1.00 24.21 O ATOM 1085 CB LEU A 71 8.169 -6.892 3.686 1.00 1.24 C ATOM 1086 CG LEU A 71 6.751 -7.476 3.814 1.00 25.44 C ATOM 1087 CD1 LEU A 71 6.720 -8.610 4.838 1.00 31.02 C ATOM 1088 CD2 LEU A 71 5.746 -6.388 4.185 1.00 54.42 C ATOM 0 H LEU A 71 10.559 -6.249 3.400 1.00 10.31 H new ATOM 0 HA LEU A 71 9.232 -8.763 3.850 1.00 70.13 H new ATOM 0 HB2 LEU A 71 8.469 -6.493 4.655 1.00 1.24 H new ATOM 0 HB3 LEU A 71 8.137 -6.052 2.992 1.00 1.24 H new ATOM 0 HG LEU A 71 6.467 -7.885 2.844 1.00 25.44 H new ATOM 0 HD11 LEU A 71 5.707 -9.007 4.911 1.00 31.02 H new ATOM 0 HD12 LEU A 71 7.399 -9.403 4.523 1.00 31.02 H new ATOM 0 HD13 LEU A 71 7.032 -8.230 5.811 1.00 31.02 H new ATOM 0 HD21 LEU A 71 4.751 -6.825 4.270 1.00 54.42 H new ATOM 0 HD22 LEU A 71 6.028 -5.942 5.138 1.00 54.42 H new ATOM 0 HD23 LEU A 71 5.740 -5.619 3.412 1.00 54.42 H new ATOM 1100 N ALA A 72 9.056 -7.432 0.807 1.00 34.04 N ATOM 1101 CA ALA A 72 8.770 -7.728 -0.606 1.00 4.51 C ATOM 1102 C ALA A 72 9.630 -8.886 -1.143 1.00 72.44 C ATOM 1103 O ALA A 72 9.160 -9.697 -1.946 1.00 74.43 O ATOM 1104 CB ALA A 72 8.971 -6.475 -1.460 1.00 30.33 C ATOM 0 H ALA A 72 9.343 -6.468 0.979 1.00 34.04 H new ATOM 0 HA ALA A 72 7.729 -8.043 -0.668 1.00 4.51 H new ATOM 0 HB1 ALA A 72 8.756 -6.707 -2.503 1.00 30.33 H new ATOM 0 HB2 ALA A 72 8.298 -5.689 -1.117 1.00 30.33 H new ATOM 0 HB3 ALA A 72 10.002 -6.134 -1.369 1.00 30.33 H new ATOM 1110 N ARG A 73 10.890 -8.962 -0.701 1.00 2.22 N ATOM 1111 CA ARG A 73 11.800 -10.024 -1.156 1.00 2.24 C ATOM 1112 C ARG A 73 11.330 -11.418 -0.707 1.00 41.03 C ATOM 1113 O ARG A 73 11.264 -12.345 -1.518 1.00 10.41 O ATOM 1114 CB ARG A 73 13.240 -9.770 -0.675 1.00 1.41 C ATOM 1115 CG ARG A 73 13.852 -8.482 -1.223 1.00 14.44 C ATOM 1116 CD ARG A 73 15.343 -8.378 -0.918 1.00 45.52 C ATOM 1117 NE ARG A 73 16.132 -9.308 -1.725 1.00 13.53 N ATOM 1118 CZ ARG A 73 17.433 -9.270 -1.835 1.00 2.13 C ATOM 1119 NH1 ARG A 73 18.140 -8.454 -1.120 1.00 42.13 N ATOM 1120 NH2 ARG A 73 18.032 -10.083 -2.638 1.00 14.03 N ATOM 0 H ARG A 73 11.302 -8.308 -0.035 1.00 2.22 H new ATOM 0 HA ARG A 73 11.787 -10.001 -2.246 1.00 2.24 H new ATOM 0 HB2 ARG A 73 13.248 -9.731 0.414 1.00 1.41 H new ATOM 0 HB3 ARG A 73 13.866 -10.613 -0.969 1.00 1.41 H new ATOM 0 HG2 ARG A 73 13.700 -8.439 -2.301 1.00 14.44 H new ATOM 0 HG3 ARG A 73 13.334 -7.624 -0.794 1.00 14.44 H new ATOM 0 HD2 ARG A 73 15.681 -7.359 -1.104 1.00 45.52 H new ATOM 0 HD3 ARG A 73 15.512 -8.582 0.139 1.00 45.52 H new ATOM 0 HE ARG A 73 15.633 -10.036 -2.237 1.00 13.53 H new ATOM 0 HH11 ARG A 73 17.682 -7.828 -0.458 1.00 42.13 H new ATOM 0 HH12 ARG A 73 19.155 -8.438 -1.219 1.00 42.13 H new ATOM 0 HH21 ARG A 73 17.490 -10.752 -3.184 1.00 14.03 H new ATOM 0 HH22 ARG A 73 19.048 -10.056 -2.727 1.00 14.03 H new ATOM 1134 N GLN A 74 10.990 -11.567 0.576 1.00 53.45 N ATOM 1135 CA GLN A 74 10.543 -12.866 1.103 1.00 24.43 C ATOM 1136 C GLN A 74 9.139 -13.225 0.580 1.00 73.33 C ATOM 1137 O GLN A 74 8.776 -14.398 0.496 1.00 1.42 O ATOM 1138 CB GLN A 74 10.568 -12.868 2.641 1.00 21.22 C ATOM 1139 CG GLN A 74 9.465 -12.041 3.287 1.00 52.33 C ATOM 1140 CD GLN A 74 9.579 -11.985 4.799 1.00 15.24 C ATOM 1141 OE1 GLN A 74 9.073 -12.847 5.509 1.00 43.33 O ATOM 1142 NE2 GLN A 74 10.240 -10.965 5.307 1.00 30.23 N ATOM 0 H GLN A 74 11.014 -10.815 1.265 1.00 53.45 H new ATOM 0 HA GLN A 74 11.237 -13.628 0.748 1.00 24.43 H new ATOM 0 HB2 GLN A 74 10.488 -13.897 2.993 1.00 21.22 H new ATOM 0 HB3 GLN A 74 11.534 -12.490 2.977 1.00 21.22 H new ATOM 0 HG2 GLN A 74 9.496 -11.027 2.887 1.00 52.33 H new ATOM 0 HG3 GLN A 74 8.496 -12.461 3.016 1.00 52.33 H new ATOM 0 HE21 GLN A 74 10.650 -10.264 4.689 1.00 30.23 H new ATOM 0 HE22 GLN A 74 10.342 -10.876 6.318 1.00 30.23 H new ATOM 1151 N TRP A 75 8.355 -12.204 0.227 1.00 75.02 N ATOM 1152 CA TRP A 75 7.037 -12.412 -0.400 1.00 41.21 C ATOM 1153 C TRP A 75 7.163 -12.726 -1.901 1.00 1.21 C ATOM 1154 O TRP A 75 6.167 -12.998 -2.571 1.00 64.33 O ATOM 1155 CB TRP A 75 6.148 -11.171 -0.210 1.00 30.43 C ATOM 1156 CG TRP A 75 5.606 -11.012 1.182 1.00 21.31 C ATOM 1157 CD1 TRP A 75 6.167 -11.458 2.342 1.00 15.44 C ATOM 1158 CD2 TRP A 75 4.390 -10.353 1.559 1.00 72.50 C ATOM 1159 NE1 TRP A 75 5.378 -11.121 3.410 1.00 22.33 N ATOM 1160 CE2 TRP A 75 4.282 -10.441 2.958 1.00 33.40 C ATOM 1161 CE3 TRP A 75 3.383 -9.696 0.848 1.00 44.53 C ATOM 1162 CZ2 TRP A 75 3.211 -9.900 3.661 1.00 61.41 C ATOM 1163 CZ3 TRP A 75 2.318 -9.160 1.547 1.00 54.05 C ATOM 1164 CH2 TRP A 75 2.240 -9.262 2.942 1.00 25.53 C ATOM 0 H TRP A 75 8.605 -11.224 0.362 1.00 75.02 H new ATOM 0 HA TRP A 75 6.578 -13.270 0.092 1.00 41.21 H new ATOM 0 HB2 TRP A 75 6.724 -10.282 -0.468 1.00 30.43 H new ATOM 0 HB3 TRP A 75 5.314 -11.225 -0.909 1.00 30.43 H new ATOM 0 HD1 TRP A 75 7.099 -11.999 2.409 1.00 15.44 H new ATOM 0 HE1 TRP A 75 5.577 -11.342 4.386 1.00 22.33 H new ATOM 0 HE3 TRP A 75 3.436 -9.609 -0.227 1.00 44.53 H new ATOM 0 HZ2 TRP A 75 3.149 -9.981 4.736 1.00 61.41 H new ATOM 0 HZ3 TRP A 75 1.531 -8.653 1.008 1.00 54.05 H new ATOM 0 HH2 TRP A 75 1.397 -8.828 3.459 1.00 25.53 H new ATOM 1175 N GLY A 76 8.385 -12.666 -2.430 1.00 62.40 N ATOM 1176 CA GLY A 76 8.615 -12.960 -3.843 1.00 51.35 C ATOM 1177 C GLY A 76 8.281 -11.791 -4.769 1.00 70.40 C ATOM 1178 O GLY A 76 9.042 -11.483 -5.688 1.00 32.24 O ATOM 0 H GLY A 76 9.224 -12.419 -1.906 1.00 62.40 H new ATOM 0 HA2 GLY A 76 9.660 -13.238 -3.983 1.00 51.35 H new ATOM 0 HA3 GLY A 76 8.014 -13.823 -4.129 1.00 51.35 H new ATOM 1182 N VAL A 77 7.150 -11.132 -4.516 1.00 72.21 N ATOM 1183 CA VAL A 77 6.679 -10.001 -5.331 1.00 2.52 C ATOM 1184 C VAL A 77 7.727 -8.881 -5.488 1.00 71.15 C ATOM 1185 O VAL A 77 7.627 -8.054 -6.397 1.00 33.11 O ATOM 1186 CB VAL A 77 5.395 -9.395 -4.722 1.00 14.24 C ATOM 1187 CG1 VAL A 77 4.254 -10.410 -4.743 1.00 20.13 C ATOM 1188 CG2 VAL A 77 5.651 -8.897 -3.299 1.00 43.54 C ATOM 0 H VAL A 77 6.530 -11.364 -3.740 1.00 72.21 H new ATOM 0 HA VAL A 77 6.482 -10.411 -6.322 1.00 2.52 H new ATOM 0 HB VAL A 77 5.101 -8.541 -5.332 1.00 14.24 H new ATOM 0 HG11 VAL A 77 3.360 -9.962 -4.309 1.00 20.13 H new ATOM 0 HG12 VAL A 77 4.049 -10.706 -5.772 1.00 20.13 H new ATOM 0 HG13 VAL A 77 4.537 -11.288 -4.163 1.00 20.13 H new ATOM 0 HG21 VAL A 77 4.733 -8.475 -2.891 1.00 43.54 H new ATOM 0 HG22 VAL A 77 5.976 -9.730 -2.675 1.00 43.54 H new ATOM 0 HG23 VAL A 77 6.427 -8.131 -3.315 1.00 43.54 H new ATOM 1256 N ASN A 82 10.996 -7.667 -8.327 1.00 32.34 N ATOM 1257 CA ASN A 82 10.579 -8.861 -9.078 1.00 31.11 C ATOM 1258 C ASN A 82 10.086 -8.512 -10.491 1.00 63.31 C ATOM 1259 O ASN A 82 10.793 -8.706 -11.480 1.00 31.14 O ATOM 1260 CB ASN A 82 9.464 -9.574 -8.295 1.00 52.04 C ATOM 1261 CG ASN A 82 9.010 -10.887 -8.915 1.00 3.01 C ATOM 1262 OD1 ASN A 82 7.763 -11.247 -8.675 1.00 53.31 O flip ATOM 1263 ND2 ASN A 82 9.766 -11.573 -9.593 1.00 33.43 N flip ATOM 0 HA ASN A 82 11.444 -9.514 -9.192 1.00 31.11 H new ATOM 0 HB2 ASN A 82 9.813 -9.765 -7.280 1.00 52.04 H new ATOM 0 HB3 ASN A 82 8.606 -8.906 -8.216 1.00 52.04 H new ATOM 0 HD21 ASN A 82 10.724 -11.265 -9.759 1.00 33.43 H new ATOM 0 HD22 ASN A 82 9.437 -12.452 -9.992 1.00 33.43 H new ATOM 1270 N ASN A 83 8.870 -7.989 -10.568 1.00 54.41 N ATOM 1271 CA ASN A 83 8.234 -7.667 -11.847 1.00 31.30 C ATOM 1272 C ASN A 83 7.136 -6.609 -11.635 1.00 1.34 C ATOM 1273 O ASN A 83 7.349 -5.641 -10.913 1.00 44.24 O ATOM 1274 CB ASN A 83 7.661 -8.944 -12.462 1.00 20.40 C ATOM 1275 CG ASN A 83 6.610 -9.583 -11.575 1.00 41.31 C ATOM 1276 OD1 ASN A 83 6.656 -9.477 -10.354 1.00 3.24 O ATOM 1277 ND2 ASN A 83 5.641 -10.220 -12.181 1.00 31.34 N ATOM 0 H ASN A 83 8.296 -7.775 -9.753 1.00 54.41 H new ATOM 0 HA ASN A 83 8.971 -7.252 -12.534 1.00 31.30 H new ATOM 0 HB2 ASN A 83 7.223 -8.713 -13.433 1.00 20.40 H new ATOM 0 HB3 ASN A 83 8.468 -9.655 -12.637 1.00 20.40 H new ATOM 0 HD21 ASN A 83 4.892 -10.648 -11.636 1.00 31.34 H new ATOM 0 HD22 ASN A 83 5.634 -10.289 -13.199 1.00 31.34 H new ATOM 1284 N ASN A 84 5.970 -6.769 -12.258 1.00 1.10 N ATOM 1285 CA ASN A 84 4.864 -5.819 -12.068 1.00 62.21 C ATOM 1286 C ASN A 84 4.200 -5.951 -10.673 1.00 2.12 C ATOM 1287 O ASN A 84 3.035 -5.609 -10.499 1.00 42.42 O ATOM 1288 CB ASN A 84 3.825 -5.976 -13.193 1.00 31.21 C ATOM 1289 CG ASN A 84 3.292 -7.389 -13.327 1.00 22.32 C ATOM 1290 OD1 ASN A 84 3.962 -8.355 -12.998 1.00 41.34 O ATOM 1291 ND2 ASN A 84 2.088 -7.524 -13.838 1.00 4.10 N ATOM 0 H ASN A 84 5.763 -7.539 -12.894 1.00 1.10 H new ATOM 0 HA ASN A 84 5.287 -4.815 -12.116 1.00 62.21 H new ATOM 0 HB2 ASN A 84 2.992 -5.298 -13.006 1.00 31.21 H new ATOM 0 HB3 ASN A 84 4.276 -5.674 -14.139 1.00 31.21 H new ATOM 0 HD21 ASN A 84 1.691 -8.454 -13.969 1.00 4.10 H new ATOM 0 HD22 ASN A 84 1.551 -6.698 -14.104 1.00 4.10 H new ATOM 1298 N GLY A 85 4.962 -6.420 -9.682 1.00 32.33 N ATOM 1299 CA GLY A 85 4.488 -6.453 -8.303 1.00 2.22 C ATOM 1300 C GLY A 85 4.694 -5.120 -7.580 1.00 20.15 C ATOM 1301 O GLY A 85 5.635 -4.379 -7.883 1.00 34.32 O ATOM 0 H GLY A 85 5.907 -6.781 -9.812 1.00 32.33 H new ATOM 0 HA2 GLY A 85 3.428 -6.708 -8.293 1.00 2.22 H new ATOM 0 HA3 GLY A 85 5.011 -7.241 -7.761 1.00 2.22 H new ATOM 1305 N LEU A 86 3.821 -4.816 -6.623 1.00 34.42 N ATOM 1306 CA LEU A 86 3.889 -3.557 -5.869 1.00 71.40 C ATOM 1307 C LEU A 86 3.510 -3.772 -4.395 1.00 52.15 C ATOM 1308 O LEU A 86 2.453 -4.325 -4.088 1.00 75.11 O ATOM 1309 CB LEU A 86 2.957 -2.513 -6.504 1.00 13.53 C ATOM 1310 CG LEU A 86 2.917 -1.135 -5.813 1.00 51.54 C ATOM 1311 CD1 LEU A 86 4.291 -0.472 -5.828 1.00 74.54 C ATOM 1312 CD2 LEU A 86 1.875 -0.234 -6.475 1.00 0.40 C ATOM 0 H LEU A 86 3.052 -5.426 -6.346 1.00 34.42 H new ATOM 0 HA LEU A 86 4.916 -3.194 -5.906 1.00 71.40 H new ATOM 0 HB2 LEU A 86 3.259 -2.369 -7.541 1.00 13.53 H new ATOM 0 HB3 LEU A 86 1.946 -2.919 -6.520 1.00 13.53 H new ATOM 0 HG LEU A 86 2.631 -1.287 -4.772 1.00 51.54 H new ATOM 0 HD11 LEU A 86 4.232 0.498 -5.334 1.00 74.54 H new ATOM 0 HD12 LEU A 86 5.006 -1.105 -5.302 1.00 74.54 H new ATOM 0 HD13 LEU A 86 4.618 -0.335 -6.859 1.00 74.54 H new ATOM 0 HD21 LEU A 86 1.861 0.734 -5.974 1.00 0.40 H new ATOM 0 HD22 LEU A 86 2.129 -0.095 -7.526 1.00 0.40 H new ATOM 0 HD23 LEU A 86 0.891 -0.697 -6.397 1.00 0.40 H new ATOM 1324 N LEU A 87 4.377 -3.332 -3.487 1.00 10.32 N ATOM 1325 CA LEU A 87 4.131 -3.472 -2.047 1.00 33.44 C ATOM 1326 C LEU A 87 3.802 -2.119 -1.393 1.00 12.14 C ATOM 1327 O LEU A 87 4.482 -1.120 -1.632 1.00 15.43 O ATOM 1328 CB LEU A 87 5.355 -4.098 -1.360 1.00 32.34 C ATOM 1329 CG LEU A 87 5.213 -4.331 0.157 1.00 41.00 C ATOM 1330 CD1 LEU A 87 4.076 -5.307 0.457 1.00 34.34 C ATOM 1331 CD2 LEU A 87 6.523 -4.836 0.757 1.00 63.52 C ATOM 0 H LEU A 87 5.258 -2.874 -3.719 1.00 10.32 H new ATOM 0 HA LEU A 87 3.268 -4.125 -1.921 1.00 33.44 H new ATOM 0 HB2 LEU A 87 5.570 -5.053 -1.839 1.00 32.34 H new ATOM 0 HB3 LEU A 87 6.217 -3.453 -1.533 1.00 32.34 H new ATOM 0 HG LEU A 87 4.972 -3.374 0.619 1.00 41.00 H new ATOM 0 HD11 LEU A 87 3.997 -5.454 1.534 1.00 34.34 H new ATOM 0 HD12 LEU A 87 3.138 -4.901 0.077 1.00 34.34 H new ATOM 0 HD13 LEU A 87 4.280 -6.263 -0.026 1.00 34.34 H new ATOM 0 HD21 LEU A 87 6.396 -4.992 1.828 1.00 63.52 H new ATOM 0 HD22 LEU A 87 6.801 -5.777 0.283 1.00 63.52 H new ATOM 0 HD23 LEU A 87 7.308 -4.099 0.588 1.00 63.52 H new ATOM 1343 N LEU A 88 2.758 -2.107 -0.566 1.00 4.10 N ATOM 1344 CA LEU A 88 2.350 -0.912 0.183 1.00 34.45 C ATOM 1345 C LEU A 88 2.220 -1.225 1.682 1.00 42.34 C ATOM 1346 O LEU A 88 1.398 -2.043 2.085 1.00 54.20 O ATOM 1347 CB LEU A 88 1.013 -0.383 -0.360 1.00 42.15 C ATOM 1348 CG LEU A 88 0.352 0.740 0.465 1.00 14.24 C ATOM 1349 CD1 LEU A 88 1.272 1.954 0.577 1.00 3.53 C ATOM 1350 CD2 LEU A 88 -0.995 1.130 -0.142 1.00 30.25 C ATOM 0 H LEU A 88 2.170 -2.922 -0.394 1.00 4.10 H new ATOM 0 HA LEU A 88 3.117 -0.148 0.056 1.00 34.45 H new ATOM 0 HB2 LEU A 88 1.173 -0.017 -1.374 1.00 42.15 H new ATOM 0 HB3 LEU A 88 0.315 -1.217 -0.429 1.00 42.15 H new ATOM 0 HG LEU A 88 0.177 0.362 1.472 1.00 14.24 H new ATOM 0 HD11 LEU A 88 0.780 2.730 1.164 1.00 3.53 H new ATOM 0 HD12 LEU A 88 2.201 1.662 1.067 1.00 3.53 H new ATOM 0 HD13 LEU A 88 1.492 2.337 -0.420 1.00 3.53 H new ATOM 0 HD21 LEU A 88 -1.446 1.924 0.454 1.00 30.25 H new ATOM 0 HD22 LEU A 88 -0.846 1.482 -1.163 1.00 30.25 H new ATOM 0 HD23 LEU A 88 -1.655 0.263 -0.151 1.00 30.25 H new ATOM 1362 N VAL A 89 3.038 -0.572 2.509 1.00 63.43 N ATOM 1363 CA VAL A 89 2.992 -0.777 3.964 1.00 3.12 C ATOM 1364 C VAL A 89 2.721 0.537 4.717 1.00 33.43 C ATOM 1365 O VAL A 89 3.380 1.548 4.475 1.00 51.04 O ATOM 1366 CB VAL A 89 4.311 -1.408 4.491 1.00 41.34 C ATOM 1367 CG1 VAL A 89 4.245 -1.629 6.005 1.00 12.23 C ATOM 1368 CG2 VAL A 89 4.610 -2.722 3.766 1.00 71.34 C ATOM 0 H VAL A 89 3.739 0.102 2.201 1.00 63.43 H new ATOM 0 HA VAL A 89 2.168 -1.465 4.153 1.00 3.12 H new ATOM 0 HB VAL A 89 5.124 -0.711 4.286 1.00 41.34 H new ATOM 0 HG11 VAL A 89 5.180 -2.071 6.349 1.00 12.23 H new ATOM 0 HG12 VAL A 89 4.090 -0.673 6.506 1.00 12.23 H new ATOM 0 HG13 VAL A 89 3.418 -2.300 6.239 1.00 12.23 H new ATOM 0 HG21 VAL A 89 5.537 -3.147 4.150 1.00 71.34 H new ATOM 0 HG22 VAL A 89 3.793 -3.424 3.933 1.00 71.34 H new ATOM 0 HG23 VAL A 89 4.713 -2.533 2.698 1.00 71.34 H new ATOM 1378 N LEU A 90 1.741 0.504 5.621 1.00 54.50 N ATOM 1379 CA LEU A 90 1.387 1.656 6.466 1.00 72.25 C ATOM 1380 C LEU A 90 1.834 1.433 7.921 1.00 71.43 C ATOM 1381 O LEU A 90 1.605 0.367 8.492 1.00 63.41 O ATOM 1382 CB LEU A 90 -0.133 1.887 6.428 1.00 12.04 C ATOM 1383 CG LEU A 90 -0.685 2.878 7.476 1.00 51.13 C ATOM 1384 CD1 LEU A 90 -0.246 4.310 7.192 1.00 3.25 C ATOM 1385 CD2 LEU A 90 -2.206 2.790 7.562 1.00 75.32 C ATOM 0 H LEU A 90 1.167 -0.321 5.792 1.00 54.50 H new ATOM 0 HA LEU A 90 1.903 2.533 6.075 1.00 72.25 H new ATOM 0 HB2 LEU A 90 -0.403 2.248 5.436 1.00 12.04 H new ATOM 0 HB3 LEU A 90 -0.632 0.927 6.564 1.00 12.04 H new ATOM 0 HG LEU A 90 -0.266 2.592 8.441 1.00 51.13 H new ATOM 0 HD11 LEU A 90 -0.656 4.974 7.953 1.00 3.25 H new ATOM 0 HD12 LEU A 90 0.842 4.367 7.209 1.00 3.25 H new ATOM 0 HD13 LEU A 90 -0.610 4.614 6.211 1.00 3.25 H new ATOM 0 HD21 LEU A 90 -2.570 3.498 8.307 1.00 75.32 H new ATOM 0 HD22 LEU A 90 -2.640 3.030 6.591 1.00 75.32 H new ATOM 0 HD23 LEU A 90 -2.496 1.779 7.849 1.00 75.32 H new ATOM 1397 N VAL A 91 2.455 2.447 8.518 1.00 32.41 N ATOM 1398 CA VAL A 91 2.886 2.378 9.920 1.00 40.33 C ATOM 1399 C VAL A 91 2.191 3.455 10.771 1.00 5.23 C ATOM 1400 O VAL A 91 2.536 4.639 10.702 1.00 41.41 O ATOM 1401 CB VAL A 91 4.424 2.531 10.047 1.00 55.22 C ATOM 1402 CG1 VAL A 91 4.861 2.485 11.513 1.00 33.34 C ATOM 1403 CG2 VAL A 91 5.138 1.453 9.235 1.00 35.20 C ATOM 0 H VAL A 91 2.673 3.330 8.056 1.00 32.41 H new ATOM 0 HA VAL A 91 2.599 1.394 10.292 1.00 40.33 H new ATOM 0 HB VAL A 91 4.702 3.505 9.645 1.00 55.22 H new ATOM 0 HG11 VAL A 91 5.944 2.594 11.574 1.00 33.34 H new ATOM 0 HG12 VAL A 91 4.383 3.297 12.061 1.00 33.34 H new ATOM 0 HG13 VAL A 91 4.568 1.531 11.950 1.00 33.34 H new ATOM 0 HG21 VAL A 91 6.216 1.576 9.336 1.00 35.20 H new ATOM 0 HG22 VAL A 91 4.849 0.469 9.603 1.00 35.20 H new ATOM 0 HG23 VAL A 91 4.859 1.544 8.185 1.00 35.20 H new ATOM 1413 N LEU A 92 1.220 3.028 11.580 1.00 33.42 N ATOM 1414 CA LEU A 92 0.435 3.935 12.437 1.00 33.12 C ATOM 1415 C LEU A 92 1.336 4.811 13.329 1.00 22.31 C ATOM 1416 O LEU A 92 1.071 5.997 13.525 1.00 50.12 O ATOM 1417 CB LEU A 92 -0.530 3.109 13.305 1.00 23.10 C ATOM 1418 CG LEU A 92 -1.380 3.904 14.312 1.00 43.21 C ATOM 1419 CD1 LEU A 92 -2.296 4.895 13.599 1.00 24.20 C ATOM 1420 CD2 LEU A 92 -2.192 2.957 15.196 1.00 11.10 C ATOM 0 H LEU A 92 0.952 2.047 11.664 1.00 33.42 H new ATOM 0 HA LEU A 92 -0.129 4.607 11.790 1.00 33.12 H new ATOM 0 HB2 LEU A 92 -1.202 2.561 12.645 1.00 23.10 H new ATOM 0 HB3 LEU A 92 0.051 2.368 13.855 1.00 23.10 H new ATOM 0 HG LEU A 92 -0.702 4.474 14.948 1.00 43.21 H new ATOM 0 HD11 LEU A 92 -2.884 5.442 14.336 1.00 24.20 H new ATOM 0 HD12 LEU A 92 -1.694 5.597 13.022 1.00 24.20 H new ATOM 0 HD13 LEU A 92 -2.965 4.355 12.929 1.00 24.20 H new ATOM 0 HD21 LEU A 92 -2.786 3.538 15.901 1.00 11.10 H new ATOM 0 HD22 LEU A 92 -2.854 2.355 14.573 1.00 11.10 H new ATOM 0 HD23 LEU A 92 -1.516 2.302 15.745 1.00 11.10 H new ATOM 1432 N ASP A 93 2.409 4.216 13.845 1.00 2.30 N ATOM 1433 CA ASP A 93 3.375 4.915 14.708 1.00 71.01 C ATOM 1434 C ASP A 93 3.872 6.243 14.096 1.00 62.34 C ATOM 1435 O ASP A 93 4.158 7.200 14.818 1.00 53.02 O ATOM 1436 CB ASP A 93 4.560 3.979 14.976 1.00 25.23 C ATOM 1437 CG ASP A 93 5.656 4.619 15.807 1.00 74.11 C ATOM 1438 OD1 ASP A 93 5.407 4.940 16.986 1.00 70.00 O ATOM 1439 OD2 ASP A 93 6.770 4.800 15.282 1.00 54.40 O ATOM 0 H ASP A 93 2.639 3.236 13.680 1.00 2.30 H new ATOM 0 HA ASP A 93 2.870 5.175 15.639 1.00 71.01 H new ATOM 0 HB2 ASP A 93 4.200 3.086 15.488 1.00 25.23 H new ATOM 0 HB3 ASP A 93 4.979 3.653 14.024 1.00 25.23 H new ATOM 1444 N GLN A 94 3.965 6.301 12.770 1.00 34.40 N ATOM 1445 CA GLN A 94 4.468 7.498 12.077 1.00 34.44 C ATOM 1446 C GLN A 94 3.461 8.043 11.048 1.00 10.25 C ATOM 1447 O GLN A 94 3.704 9.076 10.426 1.00 71.43 O ATOM 1448 CB GLN A 94 5.800 7.177 11.385 1.00 43.13 C ATOM 1449 CG GLN A 94 6.967 6.984 12.348 1.00 32.44 C ATOM 1450 CD GLN A 94 8.222 6.488 11.653 1.00 62.53 C ATOM 1451 OE1 GLN A 94 9.016 7.269 11.144 1.00 31.10 O ATOM 1452 NE2 GLN A 94 8.418 5.186 11.640 1.00 71.43 N ATOM 0 H GLN A 94 3.700 5.537 12.149 1.00 34.40 H new ATOM 0 HA GLN A 94 4.617 8.273 12.829 1.00 34.44 H new ATOM 0 HB2 GLN A 94 5.680 6.272 10.790 1.00 43.13 H new ATOM 0 HB3 GLN A 94 6.042 7.984 10.693 1.00 43.13 H new ATOM 0 HG2 GLN A 94 7.182 7.929 12.847 1.00 32.44 H new ATOM 0 HG3 GLN A 94 6.680 6.273 13.123 1.00 32.44 H new ATOM 0 HE21 GLN A 94 7.736 4.563 12.073 1.00 71.43 H new ATOM 0 HE22 GLN A 94 9.252 4.800 11.197 1.00 71.43 H new ATOM 1461 N ARG A 95 2.339 7.342 10.874 1.00 65.22 N ATOM 1462 CA ARG A 95 1.305 7.717 9.888 1.00 14.04 C ATOM 1463 C ARG A 95 1.840 7.708 8.445 1.00 33.43 C ATOM 1464 O ARG A 95 1.177 8.184 7.526 1.00 14.14 O ATOM 1465 CB ARG A 95 0.720 9.103 10.198 1.00 43.43 C ATOM 1466 CG ARG A 95 0.244 9.273 11.633 1.00 33.32 C ATOM 1467 CD ARG A 95 -0.544 10.572 11.809 1.00 30.10 C ATOM 1468 NE ARG A 95 -0.933 10.808 13.198 1.00 1.43 N ATOM 1469 CZ ARG A 95 -2.086 11.304 13.571 1.00 22.12 C ATOM 1470 NH1 ARG A 95 -3.032 11.517 12.709 1.00 1.15 N ATOM 1471 NH2 ARG A 95 -2.302 11.561 14.818 1.00 5.40 N ATOM 0 H ARG A 95 2.115 6.501 11.406 1.00 65.22 H new ATOM 0 HA ARG A 95 0.522 6.963 9.968 1.00 14.04 H new ATOM 0 HB2 ARG A 95 1.476 9.859 9.986 1.00 43.43 H new ATOM 0 HB3 ARG A 95 -0.117 9.291 9.525 1.00 43.43 H new ATOM 0 HG2 ARG A 95 -0.381 8.425 11.913 1.00 33.32 H new ATOM 0 HG3 ARG A 95 1.102 9.272 12.305 1.00 33.32 H new ATOM 0 HD2 ARG A 95 0.059 11.409 11.457 1.00 30.10 H new ATOM 0 HD3 ARG A 95 -1.438 10.538 11.186 1.00 30.10 H new ATOM 0 HE ARG A 95 -0.260 10.570 13.927 1.00 1.43 H new ATOM 0 HH11 ARG A 95 -2.883 11.297 11.724 1.00 1.15 H new ATOM 0 HH12 ARG A 95 -3.924 11.904 13.016 1.00 1.15 H new ATOM 0 HH21 ARG A 95 -1.575 11.378 15.510 1.00 5.40 H new ATOM 0 HH22 ARG A 95 -3.199 11.947 15.111 1.00 5.40 H new ATOM 1485 N ARG A 96 3.035 7.163 8.249 1.00 42.13 N ATOM 1486 CA ARG A 96 3.661 7.130 6.924 1.00 1.33 C ATOM 1487 C ARG A 96 3.426 5.783 6.229 1.00 10.12 C ATOM 1488 O ARG A 96 3.148 4.771 6.879 1.00 21.23 O ATOM 1489 CB ARG A 96 5.175 7.369 7.033 1.00 44.02 C ATOM 1490 CG ARG A 96 5.906 6.243 7.760 1.00 42.42 C ATOM 1491 CD ARG A 96 7.375 6.130 7.341 1.00 20.31 C ATOM 1492 NE ARG A 96 8.283 6.920 8.169 1.00 11.34 N ATOM 1493 CZ ARG A 96 9.585 6.912 8.023 1.00 64.21 C ATOM 1494 NH1 ARG A 96 10.134 6.306 7.019 1.00 21.12 N ATOM 1495 NH2 ARG A 96 10.337 7.540 8.861 1.00 14.42 N ATOM 0 H ARG A 96 3.593 6.737 8.988 1.00 42.13 H new ATOM 0 HA ARG A 96 3.202 7.923 6.333 1.00 1.33 H new ATOM 0 HB2 ARG A 96 5.593 7.479 6.032 1.00 44.02 H new ATOM 0 HB3 ARG A 96 5.352 8.308 7.558 1.00 44.02 H new ATOM 0 HG2 ARG A 96 5.850 6.413 8.835 1.00 42.42 H new ATOM 0 HG3 ARG A 96 5.401 5.298 7.560 1.00 42.42 H new ATOM 0 HD2 ARG A 96 7.676 5.083 7.383 1.00 20.31 H new ATOM 0 HD3 ARG A 96 7.473 6.449 6.303 1.00 20.31 H new ATOM 0 HE ARG A 96 7.882 7.509 8.899 1.00 11.34 H new ATOM 0 HH11 ARG A 96 9.552 5.828 6.331 1.00 21.12 H new ATOM 0 HH12 ARG A 96 11.149 6.307 6.916 1.00 21.12 H new ATOM 0 HH21 ARG A 96 9.919 8.046 9.642 1.00 14.42 H new ATOM 0 HH22 ARG A 96 11.350 7.531 8.743 1.00 14.42 H new ATOM 1509 N VAL A 97 3.572 5.776 4.910 1.00 54.43 N ATOM 1510 CA VAL A 97 3.472 4.546 4.115 1.00 60.42 C ATOM 1511 C VAL A 97 4.664 4.428 3.153 1.00 53.22 C ATOM 1512 O VAL A 97 5.469 5.355 3.031 1.00 51.04 O ATOM 1513 CB VAL A 97 2.155 4.468 3.296 1.00 10.13 C ATOM 1514 CG1 VAL A 97 0.937 4.670 4.178 1.00 22.32 C ATOM 1515 CG2 VAL A 97 2.161 5.472 2.151 1.00 12.20 C ATOM 0 H VAL A 97 3.762 6.613 4.359 1.00 54.43 H new ATOM 0 HA VAL A 97 3.477 3.720 4.826 1.00 60.42 H new ATOM 0 HB VAL A 97 2.096 3.466 2.872 1.00 10.13 H new ATOM 0 HG11 VAL A 97 0.034 4.609 3.571 1.00 22.32 H new ATOM 0 HG12 VAL A 97 0.911 3.896 4.946 1.00 22.32 H new ATOM 0 HG13 VAL A 97 0.990 5.650 4.652 1.00 22.32 H new ATOM 0 HG21 VAL A 97 1.227 5.395 1.595 1.00 12.20 H new ATOM 0 HG22 VAL A 97 2.263 6.480 2.552 1.00 12.20 H new ATOM 0 HG23 VAL A 97 2.998 5.260 1.486 1.00 12.20 H new ATOM 1525 N ARG A 98 4.786 3.287 2.485 1.00 44.24 N ATOM 1526 CA ARG A 98 5.869 3.073 1.517 1.00 61.34 C ATOM 1527 C ARG A 98 5.417 2.186 0.349 1.00 20.23 C ATOM 1528 O ARG A 98 4.862 1.106 0.553 1.00 34.44 O ATOM 1529 CB ARG A 98 7.080 2.444 2.223 1.00 4.12 C ATOM 1530 CG ARG A 98 8.209 1.993 1.293 1.00 21.32 C ATOM 1531 CD ARG A 98 8.897 3.149 0.579 1.00 14.24 C ATOM 1532 NE ARG A 98 9.998 2.669 -0.251 1.00 64.24 N ATOM 1533 CZ ARG A 98 10.745 3.421 -1.013 1.00 4.23 C ATOM 1534 NH1 ARG A 98 10.568 4.700 -1.078 1.00 64.14 N ATOM 1535 NH2 ARG A 98 11.686 2.879 -1.709 1.00 35.55 N ATOM 0 H ARG A 98 4.153 2.494 2.591 1.00 44.24 H new ATOM 0 HA ARG A 98 6.150 4.042 1.105 1.00 61.34 H new ATOM 0 HB2 ARG A 98 7.482 3.166 2.934 1.00 4.12 H new ATOM 0 HB3 ARG A 98 6.739 1.584 2.799 1.00 4.12 H new ATOM 0 HG2 ARG A 98 8.949 1.440 1.872 1.00 21.32 H new ATOM 0 HG3 ARG A 98 7.806 1.304 0.551 1.00 21.32 H new ATOM 0 HD2 ARG A 98 8.175 3.680 -0.040 1.00 14.24 H new ATOM 0 HD3 ARG A 98 9.274 3.862 1.312 1.00 14.24 H new ATOM 0 HE ARG A 98 10.199 1.669 -0.234 1.00 64.24 H new ATOM 0 HH11 ARG A 98 9.832 5.142 -0.527 1.00 64.14 H new ATOM 0 HH12 ARG A 98 11.164 5.267 -1.681 1.00 64.14 H new ATOM 0 HH21 ARG A 98 11.841 1.872 -1.661 1.00 35.55 H new ATOM 0 HH22 ARG A 98 12.275 3.457 -2.308 1.00 35.55 H new ATOM 1549 N PHE A 99 5.658 2.669 -0.871 1.00 15.54 N ATOM 1550 CA PHE A 99 5.419 1.894 -2.095 1.00 71.45 C ATOM 1551 C PHE A 99 6.747 1.381 -2.673 1.00 55.15 C ATOM 1552 O PHE A 99 7.664 2.169 -2.924 1.00 25.43 O ATOM 1553 CB PHE A 99 4.723 2.752 -3.167 1.00 23.30 C ATOM 1554 CG PHE A 99 3.266 3.052 -2.914 1.00 45.41 C ATOM 1555 CD1 PHE A 99 2.281 2.178 -3.356 1.00 73.21 C ATOM 1556 CD2 PHE A 99 2.881 4.215 -2.265 1.00 10.33 C ATOM 1557 CE1 PHE A 99 0.944 2.462 -3.157 1.00 43.31 C ATOM 1558 CE2 PHE A 99 1.544 4.499 -2.060 1.00 33.23 C ATOM 1559 CZ PHE A 99 0.575 3.622 -2.508 1.00 2.01 C ATOM 0 H PHE A 99 6.024 3.606 -1.041 1.00 15.54 H new ATOM 0 HA PHE A 99 4.777 1.055 -1.828 1.00 71.45 H new ATOM 0 HB2 PHE A 99 5.260 3.696 -3.257 1.00 23.30 H new ATOM 0 HB3 PHE A 99 4.810 2.243 -4.127 1.00 23.30 H new ATOM 0 HD1 PHE A 99 2.564 1.266 -3.861 1.00 73.21 H new ATOM 0 HD2 PHE A 99 3.634 4.906 -1.916 1.00 10.33 H new ATOM 0 HE1 PHE A 99 0.188 1.776 -3.509 1.00 43.31 H new ATOM 0 HE2 PHE A 99 1.257 5.406 -1.550 1.00 33.23 H new ATOM 0 HZ PHE A 99 -0.470 3.844 -2.350 1.00 2.01 H new ATOM 1569 N GLU A 100 6.858 0.074 -2.888 1.00 73.34 N ATOM 1570 CA GLU A 100 8.039 -0.492 -3.552 1.00 32.24 C ATOM 1571 C GLU A 100 7.650 -1.232 -4.839 1.00 42.22 C ATOM 1572 O GLU A 100 6.908 -2.217 -4.806 1.00 63.21 O ATOM 1573 CB GLU A 100 8.817 -1.423 -2.608 1.00 74.24 C ATOM 1574 CG GLU A 100 10.020 -2.088 -3.280 1.00 61.11 C ATOM 1575 CD GLU A 100 11.091 -2.573 -2.312 1.00 15.32 C ATOM 1576 OE1 GLU A 100 11.032 -2.223 -1.114 1.00 4.44 O ATOM 1577 OE2 GLU A 100 12.023 -3.272 -2.772 1.00 32.54 O ATOM 0 H GLU A 100 6.154 -0.612 -2.617 1.00 73.34 H new ATOM 0 HA GLU A 100 8.691 0.339 -3.821 1.00 32.24 H new ATOM 0 HB2 GLU A 100 9.160 -0.852 -1.745 1.00 74.24 H new ATOM 0 HB3 GLU A 100 8.145 -2.195 -2.233 1.00 74.24 H new ATOM 0 HG2 GLU A 100 9.669 -2.935 -3.870 1.00 61.11 H new ATOM 0 HG3 GLU A 100 10.470 -1.380 -3.976 1.00 61.11 H new ATOM 1584 N THR A 101 8.147 -0.735 -5.972 1.00 64.52 N ATOM 1585 CA THR A 101 7.867 -1.331 -7.284 1.00 64.54 C ATOM 1586 C THR A 101 8.823 -2.472 -7.626 1.00 45.12 C ATOM 1587 O THR A 101 9.945 -2.550 -7.118 1.00 1.24 O ATOM 1588 CB THR A 101 7.975 -0.289 -8.428 1.00 52.35 C ATOM 1589 OG1 THR A 101 9.157 0.514 -8.258 1.00 54.13 O ATOM 1590 CG2 THR A 101 6.745 0.603 -8.499 1.00 14.10 C ATOM 0 H THR A 101 8.751 0.086 -6.010 1.00 64.52 H new ATOM 0 HA THR A 101 6.848 -1.711 -7.206 1.00 64.54 H new ATOM 0 HB THR A 101 8.041 -0.838 -9.367 1.00 52.35 H new ATOM 0 HG1 THR A 101 9.216 1.167 -8.986 1.00 54.13 H new ATOM 0 HG21 THR A 101 6.861 1.318 -9.313 1.00 14.10 H new ATOM 0 HG22 THR A 101 5.861 -0.010 -8.677 1.00 14.10 H new ATOM 0 HG23 THR A 101 6.630 1.140 -7.558 1.00 14.10 H new ATOM 1598 N GLY A 102 8.362 -3.358 -8.496 1.00 41.21 N ATOM 1599 CA GLY A 102 9.244 -4.328 -9.111 1.00 13.20 C ATOM 1600 C GLY A 102 9.736 -3.862 -10.474 1.00 53.12 C ATOM 1601 O GLY A 102 9.372 -2.781 -10.946 1.00 64.11 O ATOM 0 H GLY A 102 7.387 -3.422 -8.788 1.00 41.21 H new ATOM 0 HA2 GLY A 102 10.098 -4.507 -8.458 1.00 13.20 H new ATOM 0 HA3 GLY A 102 8.720 -5.278 -9.219 1.00 13.20 H new ATOM 1605 N TYR A 103 10.538 -4.694 -11.116 1.00 50.12 N ATOM 1606 CA TYR A 103 11.106 -4.394 -12.436 1.00 12.45 C ATOM 1607 C TYR A 103 10.015 -4.247 -13.524 1.00 31.53 C ATOM 1608 O TYR A 103 10.280 -3.776 -14.629 1.00 33.34 O ATOM 1609 CB TYR A 103 12.122 -5.502 -12.788 1.00 32.22 C ATOM 1610 CG TYR A 103 12.280 -5.786 -14.269 1.00 31.14 C ATOM 1611 CD1 TYR A 103 13.056 -4.970 -15.086 1.00 51.24 C ATOM 1612 CD2 TYR A 103 11.645 -6.881 -14.845 1.00 63.42 C ATOM 1613 CE1 TYR A 103 13.194 -5.241 -16.434 1.00 43.33 C ATOM 1614 CE2 TYR A 103 11.777 -7.158 -16.189 1.00 73.35 C ATOM 1615 CZ TYR A 103 12.552 -6.335 -16.981 1.00 32.04 C ATOM 1616 OH TYR A 103 12.693 -6.607 -18.324 1.00 30.24 O ATOM 0 H TYR A 103 10.819 -5.601 -10.743 1.00 50.12 H new ATOM 0 HA TYR A 103 11.612 -3.429 -12.399 1.00 12.45 H new ATOM 0 HB2 TYR A 103 13.094 -5.223 -12.382 1.00 32.22 H new ATOM 0 HB3 TYR A 103 11.820 -6.422 -12.288 1.00 32.22 H new ATOM 0 HD1 TYR A 103 13.557 -4.113 -14.661 1.00 51.24 H new ATOM 0 HD2 TYR A 103 11.037 -7.526 -14.228 1.00 63.42 H new ATOM 0 HE1 TYR A 103 13.801 -4.601 -17.057 1.00 43.33 H new ATOM 0 HE2 TYR A 103 11.277 -8.013 -16.619 1.00 73.35 H new ATOM 0 HH TYR A 103 12.180 -7.410 -18.551 1.00 30.24 H new ATOM 1626 N GLY A 104 8.786 -4.626 -13.193 1.00 74.24 N ATOM 1627 CA GLY A 104 7.683 -4.573 -14.153 1.00 21.14 C ATOM 1628 C GLY A 104 6.958 -3.225 -14.175 1.00 31.01 C ATOM 1629 O GLY A 104 6.462 -2.790 -15.212 1.00 72.33 O ATOM 0 H GLY A 104 8.526 -4.973 -12.270 1.00 74.24 H new ATOM 0 HA2 GLY A 104 8.069 -4.786 -15.150 1.00 21.14 H new ATOM 0 HA3 GLY A 104 6.966 -5.359 -13.915 1.00 21.14 H new ATOM 1633 N LEU A 105 6.901 -2.561 -13.021 1.00 41.35 N ATOM 1634 CA LEU A 105 6.103 -1.335 -12.866 1.00 4.42 C ATOM 1635 C LEU A 105 6.927 -0.047 -13.019 1.00 53.53 C ATOM 1636 O LEU A 105 6.366 1.045 -13.016 1.00 3.01 O ATOM 1637 CB LEU A 105 5.407 -1.335 -11.499 1.00 21.41 C ATOM 1638 CG LEU A 105 4.241 -2.322 -11.355 1.00 25.52 C ATOM 1639 CD1 LEU A 105 3.612 -2.212 -9.972 1.00 2.31 C ATOM 1640 CD2 LEU A 105 3.198 -2.084 -12.446 1.00 63.22 C ATOM 0 H LEU A 105 7.396 -2.848 -12.177 1.00 41.35 H new ATOM 0 HA LEU A 105 5.369 -1.341 -13.672 1.00 4.42 H new ATOM 0 HB2 LEU A 105 6.149 -1.560 -10.733 1.00 21.41 H new ATOM 0 HB3 LEU A 105 5.037 -0.330 -11.299 1.00 21.41 H new ATOM 0 HG LEU A 105 4.631 -3.333 -11.471 1.00 25.52 H new ATOM 0 HD11 LEU A 105 2.787 -2.920 -9.890 1.00 2.31 H new ATOM 0 HD12 LEU A 105 4.361 -2.438 -9.213 1.00 2.31 H new ATOM 0 HD13 LEU A 105 3.237 -1.199 -9.822 1.00 2.31 H new ATOM 0 HD21 LEU A 105 2.379 -2.793 -12.327 1.00 63.22 H new ATOM 0 HD22 LEU A 105 2.812 -1.068 -12.365 1.00 63.22 H new ATOM 0 HD23 LEU A 105 3.658 -2.221 -13.425 1.00 63.22 H new ATOM 1652 N GLU A 106 8.242 -0.170 -13.164 1.00 30.31 N ATOM 1653 CA GLU A 106 9.128 1.006 -13.271 1.00 20.04 C ATOM 1654 C GLU A 106 8.704 1.978 -14.397 1.00 11.45 C ATOM 1655 O GLU A 106 8.949 3.183 -14.314 1.00 21.53 O ATOM 1656 CB GLU A 106 10.589 0.549 -13.458 1.00 43.05 C ATOM 1657 CG GLU A 106 10.767 -0.633 -14.409 1.00 64.01 C ATOM 1658 CD GLU A 106 10.447 -0.306 -15.861 1.00 10.22 C ATOM 1659 OE1 GLU A 106 11.244 0.406 -16.507 1.00 4.31 O ATOM 1660 OE2 GLU A 106 9.402 -0.769 -16.368 1.00 22.34 O ATOM 0 H GLU A 106 8.727 -1.066 -13.211 1.00 30.31 H new ATOM 0 HA GLU A 106 9.040 1.564 -12.339 1.00 20.04 H new ATOM 0 HB2 GLU A 106 11.174 1.390 -13.830 1.00 43.05 H new ATOM 0 HB3 GLU A 106 11.000 0.281 -12.485 1.00 43.05 H new ATOM 0 HG2 GLU A 106 11.796 -0.988 -14.344 1.00 64.01 H new ATOM 0 HG3 GLU A 106 10.126 -1.451 -14.081 1.00 64.01 H new ATOM 1667 N GLY A 107 8.069 1.452 -15.443 1.00 64.54 N ATOM 1668 CA GLY A 107 7.609 2.290 -16.552 1.00 43.10 C ATOM 1669 C GLY A 107 6.302 3.030 -16.266 1.00 32.42 C ATOM 1670 O GLY A 107 5.976 4.013 -16.938 1.00 32.41 O ATOM 0 H GLY A 107 7.862 0.459 -15.547 1.00 64.54 H new ATOM 0 HA2 GLY A 107 8.384 3.019 -16.790 1.00 43.10 H new ATOM 0 HA3 GLY A 107 7.476 1.666 -17.436 1.00 43.10 H new ATOM 1674 N TYR A 108 5.550 2.557 -15.276 1.00 65.42 N ATOM 1675 CA TYR A 108 4.249 3.147 -14.929 1.00 43.50 C ATOM 1676 C TYR A 108 4.319 3.966 -13.633 1.00 54.24 C ATOM 1677 O TYR A 108 3.723 5.039 -13.529 1.00 34.33 O ATOM 1678 CB TYR A 108 3.197 2.042 -14.759 1.00 14.22 C ATOM 1679 CG TYR A 108 3.096 1.099 -15.943 1.00 42.43 C ATOM 1680 CD1 TYR A 108 2.423 1.472 -17.101 1.00 33.42 C ATOM 1681 CD2 TYR A 108 3.682 -0.163 -15.903 1.00 13.20 C ATOM 1682 CE1 TYR A 108 2.334 0.615 -18.182 1.00 43.05 C ATOM 1683 CE2 TYR A 108 3.598 -1.024 -16.981 1.00 32.33 C ATOM 1684 CZ TYR A 108 2.923 -0.630 -18.117 1.00 31.52 C ATOM 1685 OH TYR A 108 2.837 -1.481 -19.196 1.00 12.43 O ATOM 0 H TYR A 108 5.816 1.763 -14.694 1.00 65.42 H new ATOM 0 HA TYR A 108 3.971 3.814 -15.745 1.00 43.50 H new ATOM 0 HB2 TYR A 108 3.434 1.464 -13.866 1.00 14.22 H new ATOM 0 HB3 TYR A 108 2.224 2.504 -14.591 1.00 14.22 H new ATOM 0 HD1 TYR A 108 1.962 2.447 -17.157 1.00 33.42 H new ATOM 0 HD2 TYR A 108 4.211 -0.475 -15.015 1.00 13.20 H new ATOM 0 HE1 TYR A 108 1.806 0.919 -19.073 1.00 43.05 H new ATOM 0 HE2 TYR A 108 4.058 -2.000 -16.934 1.00 32.33 H new ATOM 0 HH TYR A 108 3.304 -2.318 -18.991 1.00 12.43 H new ATOM 1695 N LEU A 109 5.056 3.450 -12.654 1.00 20.13 N ATOM 1696 CA LEU A 109 5.064 4.000 -11.294 1.00 70.43 C ATOM 1697 C LEU A 109 6.494 4.226 -10.765 1.00 15.34 C ATOM 1698 O LEU A 109 7.085 3.337 -10.153 1.00 71.14 O ATOM 1699 CB LEU A 109 4.314 3.036 -10.358 1.00 0.32 C ATOM 1700 CG LEU A 109 2.854 2.735 -10.744 1.00 61.13 C ATOM 1701 CD1 LEU A 109 2.350 1.489 -10.023 1.00 74.22 C ATOM 1702 CD2 LEU A 109 1.956 3.930 -10.438 1.00 62.40 C ATOM 0 H LEU A 109 5.665 2.641 -12.776 1.00 20.13 H new ATOM 0 HA LEU A 109 4.570 4.971 -11.322 1.00 70.43 H new ATOM 0 HB2 LEU A 109 4.862 2.095 -10.320 1.00 0.32 H new ATOM 0 HB3 LEU A 109 4.326 3.453 -9.351 1.00 0.32 H new ATOM 0 HG LEU A 109 2.820 2.547 -11.817 1.00 61.13 H new ATOM 0 HD11 LEU A 109 1.317 1.295 -10.311 1.00 74.22 H new ATOM 0 HD12 LEU A 109 2.969 0.635 -10.297 1.00 74.22 H new ATOM 0 HD13 LEU A 109 2.404 1.645 -8.946 1.00 74.22 H new ATOM 0 HD21 LEU A 109 0.929 3.695 -10.719 1.00 62.40 H new ATOM 0 HD22 LEU A 109 1.999 4.154 -9.372 1.00 62.40 H new ATOM 0 HD23 LEU A 109 2.298 4.796 -11.004 1.00 62.40 H new ATOM 1714 N PRO A 110 7.087 5.406 -11.023 1.00 53.14 N ATOM 1715 CA PRO A 110 8.375 5.783 -10.421 1.00 2.22 C ATOM 1716 C PRO A 110 8.215 6.261 -8.965 1.00 32.42 C ATOM 1717 O PRO A 110 7.121 6.664 -8.556 1.00 64.34 O ATOM 1718 CB PRO A 110 8.848 6.926 -11.325 1.00 54.00 C ATOM 1719 CG PRO A 110 7.587 7.562 -11.812 1.00 33.43 C ATOM 1720 CD PRO A 110 6.574 6.448 -11.936 1.00 74.25 C ATOM 0 HA PRO A 110 9.074 4.949 -10.364 1.00 2.22 H new ATOM 0 HB2 PRO A 110 9.465 7.637 -10.776 1.00 54.00 H new ATOM 0 HB3 PRO A 110 9.451 6.554 -12.153 1.00 54.00 H new ATOM 0 HG2 PRO A 110 7.242 8.326 -11.115 1.00 33.43 H new ATOM 0 HG3 PRO A 110 7.744 8.054 -12.772 1.00 33.43 H new ATOM 0 HD2 PRO A 110 5.577 6.779 -11.646 1.00 74.25 H new ATOM 0 HD3 PRO A 110 6.503 6.083 -12.961 1.00 74.25 H new ATOM 1728 N ASP A 111 9.303 6.222 -8.188 1.00 42.54 N ATOM 1729 CA ASP A 111 9.268 6.619 -6.769 1.00 14.11 C ATOM 1730 C ASP A 111 8.608 7.997 -6.563 1.00 72.33 C ATOM 1731 O ASP A 111 7.901 8.215 -5.575 1.00 55.21 O ATOM 1732 CB ASP A 111 10.685 6.622 -6.179 1.00 21.42 C ATOM 1733 CG ASP A 111 11.330 5.246 -6.205 1.00 2.42 C ATOM 1734 OD1 ASP A 111 11.924 4.886 -7.239 1.00 25.54 O ATOM 1735 OD2 ASP A 111 11.249 4.524 -5.187 1.00 30.53 O ATOM 0 H ASP A 111 10.221 5.920 -8.515 1.00 42.54 H new ATOM 0 HA ASP A 111 8.658 5.882 -6.246 1.00 14.11 H new ATOM 0 HB2 ASP A 111 11.306 7.321 -6.738 1.00 21.42 H new ATOM 0 HB3 ASP A 111 10.646 6.982 -5.151 1.00 21.42 H new ATOM 1740 N GLY A 112 8.841 8.922 -7.494 1.00 52.02 N ATOM 1741 CA GLY A 112 8.214 10.239 -7.420 1.00 50.14 C ATOM 1742 C GLY A 112 6.689 10.173 -7.485 1.00 75.44 C ATOM 1743 O GLY A 112 5.998 10.754 -6.645 1.00 31.13 O ATOM 0 H GLY A 112 9.452 8.785 -8.299 1.00 52.02 H new ATOM 0 HA2 GLY A 112 8.513 10.727 -6.492 1.00 50.14 H new ATOM 0 HA3 GLY A 112 8.582 10.858 -8.238 1.00 50.14 H new ATOM 1747 N LEU A 113 6.162 9.455 -8.477 1.00 61.34 N ATOM 1748 CA LEU A 113 4.711 9.274 -8.620 1.00 74.14 C ATOM 1749 C LEU A 113 4.123 8.559 -7.396 1.00 31.52 C ATOM 1750 O LEU A 113 3.073 8.947 -6.881 1.00 14.35 O ATOM 1751 CB LEU A 113 4.394 8.485 -9.899 1.00 32.42 C ATOM 1752 CG LEU A 113 2.904 8.186 -10.140 1.00 1.41 C ATOM 1753 CD1 LEU A 113 2.088 9.476 -10.174 1.00 11.51 C ATOM 1754 CD2 LEU A 113 2.715 7.395 -11.433 1.00 73.53 C ATOM 0 H LEU A 113 6.715 8.988 -9.195 1.00 61.34 H new ATOM 0 HA LEU A 113 4.253 10.260 -8.692 1.00 74.14 H new ATOM 0 HB2 LEU A 113 4.778 9.042 -10.754 1.00 32.42 H new ATOM 0 HB3 LEU A 113 4.936 7.540 -9.866 1.00 32.42 H new ATOM 0 HG LEU A 113 2.543 7.579 -9.310 1.00 1.41 H new ATOM 0 HD11 LEU A 113 1.038 9.238 -10.346 1.00 11.51 H new ATOM 0 HD12 LEU A 113 2.191 9.997 -9.222 1.00 11.51 H new ATOM 0 HD13 LEU A 113 2.451 10.115 -10.979 1.00 11.51 H new ATOM 0 HD21 LEU A 113 1.655 7.194 -11.585 1.00 73.53 H new ATOM 0 HD22 LEU A 113 3.098 7.974 -12.273 1.00 73.53 H new ATOM 0 HD23 LEU A 113 3.257 6.452 -11.365 1.00 73.53 H new ATOM 1766 N LEU A 114 4.815 7.520 -6.931 1.00 30.44 N ATOM 1767 CA LEU A 114 4.411 6.794 -5.721 1.00 64.44 C ATOM 1768 C LEU A 114 4.327 7.743 -4.515 1.00 3.13 C ATOM 1769 O LEU A 114 3.362 7.711 -3.749 1.00 21.32 O ATOM 1770 CB LEU A 114 5.409 5.662 -5.433 1.00 12.22 C ATOM 1771 CG LEU A 114 5.530 4.603 -6.542 1.00 2.15 C ATOM 1772 CD1 LEU A 114 6.626 3.595 -6.210 1.00 23.51 C ATOM 1773 CD2 LEU A 114 4.191 3.901 -6.763 1.00 34.25 C ATOM 0 H LEU A 114 5.660 7.159 -7.373 1.00 30.44 H new ATOM 0 HA LEU A 114 3.422 6.368 -5.889 1.00 64.44 H new ATOM 0 HB2 LEU A 114 6.392 6.100 -5.261 1.00 12.22 H new ATOM 0 HB3 LEU A 114 5.115 5.166 -4.508 1.00 12.22 H new ATOM 0 HG LEU A 114 5.806 5.107 -7.468 1.00 2.15 H new ATOM 0 HD11 LEU A 114 6.694 2.855 -7.008 1.00 23.51 H new ATOM 0 HD12 LEU A 114 7.580 4.113 -6.113 1.00 23.51 H new ATOM 0 HD13 LEU A 114 6.388 3.095 -5.271 1.00 23.51 H new ATOM 0 HD21 LEU A 114 4.297 3.156 -7.551 1.00 34.25 H new ATOM 0 HD22 LEU A 114 3.880 3.412 -5.840 1.00 34.25 H new ATOM 0 HD23 LEU A 114 3.440 4.634 -7.056 1.00 34.25 H new ATOM 1785 N SER A 115 5.339 8.597 -4.367 1.00 24.10 N ATOM 1786 CA SER A 115 5.365 9.602 -3.291 1.00 62.13 C ATOM 1787 C SER A 115 4.229 10.618 -3.458 1.00 74.41 C ATOM 1788 O SER A 115 3.666 11.103 -2.475 1.00 12.41 O ATOM 1789 CB SER A 115 6.710 10.343 -3.262 1.00 61.14 C ATOM 1790 OG SER A 115 7.794 9.459 -3.003 1.00 10.25 O ATOM 0 H SER A 115 6.156 8.617 -4.977 1.00 24.10 H new ATOM 0 HA SER A 115 5.231 9.071 -2.349 1.00 62.13 H new ATOM 0 HB2 SER A 115 6.870 10.844 -4.217 1.00 61.14 H new ATOM 0 HB3 SER A 115 6.682 11.118 -2.496 1.00 61.14 H new ATOM 0 HG SER A 115 7.981 8.927 -3.805 1.00 10.25 H new ATOM 1796 N ARG A 116 3.895 10.937 -4.711 1.00 44.25 N ATOM 1797 CA ARG A 116 2.797 11.863 -5.002 1.00 70.45 C ATOM 1798 C ARG A 116 1.462 11.301 -4.490 1.00 53.04 C ATOM 1799 O ARG A 116 0.702 11.997 -3.822 1.00 70.44 O ATOM 1800 CB ARG A 116 2.705 12.142 -6.508 1.00 44.52 C ATOM 1801 CG ARG A 116 1.684 13.220 -6.861 1.00 23.41 C ATOM 1802 CD ARG A 116 1.517 13.385 -8.367 1.00 45.02 C ATOM 1803 NE ARG A 116 0.605 14.480 -8.690 1.00 74.11 N ATOM 1804 CZ ARG A 116 -0.685 14.349 -8.848 1.00 63.44 C ATOM 1805 NH1 ARG A 116 -1.255 13.192 -8.724 1.00 54.23 N ATOM 1806 NH2 ARG A 116 -1.401 15.385 -9.131 1.00 42.22 N ATOM 0 H ARG A 116 4.367 10.570 -5.537 1.00 44.25 H new ATOM 0 HA ARG A 116 3.003 12.800 -4.485 1.00 70.45 H new ATOM 0 HB2 ARG A 116 3.685 12.446 -6.875 1.00 44.52 H new ATOM 0 HB3 ARG A 116 2.443 11.219 -7.026 1.00 44.52 H new ATOM 0 HG2 ARG A 116 0.722 12.966 -6.416 1.00 23.41 H new ATOM 0 HG3 ARG A 116 1.996 14.169 -6.426 1.00 23.41 H new ATOM 0 HD2 ARG A 116 2.489 13.574 -8.823 1.00 45.02 H new ATOM 0 HD3 ARG A 116 1.139 12.457 -8.796 1.00 45.02 H new ATOM 0 HE ARG A 116 1.004 15.412 -8.800 1.00 74.11 H new ATOM 0 HH11 ARG A 116 -0.695 12.369 -8.500 1.00 54.23 H new ATOM 0 HH12 ARG A 116 -2.263 13.104 -8.850 1.00 54.23 H new ATOM 0 HH21 ARG A 116 -0.959 16.299 -9.230 1.00 42.22 H new ATOM 0 HH22 ARG A 116 -2.409 15.290 -9.256 1.00 42.22 H new ATOM 1820 N ILE A 117 1.192 10.032 -4.807 1.00 51.22 N ATOM 1821 CA ILE A 117 -0.001 9.337 -4.301 1.00 60.33 C ATOM 1822 C ILE A 117 -0.094 9.449 -2.769 1.00 24.12 C ATOM 1823 O ILE A 117 -1.155 9.754 -2.209 1.00 1.41 O ATOM 1824 CB ILE A 117 0.019 7.837 -4.700 1.00 23.13 C ATOM 1825 CG1 ILE A 117 0.081 7.689 -6.231 1.00 65.25 C ATOM 1826 CG2 ILE A 117 -1.201 7.106 -4.134 1.00 40.23 C ATOM 1827 CD1 ILE A 117 0.184 6.254 -6.711 1.00 54.24 C ATOM 0 H ILE A 117 1.783 9.462 -5.412 1.00 51.22 H new ATOM 0 HA ILE A 117 -0.871 9.816 -4.750 1.00 60.33 H new ATOM 0 HB ILE A 117 0.912 7.381 -4.273 1.00 23.13 H new ATOM 0 HG12 ILE A 117 -0.810 8.143 -6.665 1.00 65.25 H new ATOM 0 HG13 ILE A 117 0.939 8.248 -6.605 1.00 65.25 H new ATOM 0 HG21 ILE A 117 -1.165 6.057 -4.427 1.00 40.23 H new ATOM 0 HG22 ILE A 117 -1.197 7.179 -3.046 1.00 40.23 H new ATOM 0 HG23 ILE A 117 -2.111 7.561 -4.525 1.00 40.23 H new ATOM 0 HD11 ILE A 117 0.223 6.237 -7.800 1.00 54.24 H new ATOM 0 HD12 ILE A 117 1.089 5.800 -6.308 1.00 54.24 H new ATOM 0 HD13 ILE A 117 -0.686 5.693 -6.370 1.00 54.24 H new ATOM 1839 N ILE A 118 1.039 9.212 -2.108 1.00 42.41 N ATOM 1840 CA ILE A 118 1.136 9.306 -0.650 1.00 3.33 C ATOM 1841 C ILE A 118 0.809 10.720 -0.144 1.00 34.40 C ATOM 1842 O ILE A 118 -0.082 10.912 0.681 1.00 35.35 O ATOM 1843 CB ILE A 118 2.562 8.936 -0.160 1.00 23.44 C ATOM 1844 CG1 ILE A 118 2.955 7.530 -0.649 1.00 11.22 C ATOM 1845 CG2 ILE A 118 2.650 9.024 1.365 1.00 42.31 C ATOM 1846 CD1 ILE A 118 4.366 7.119 -0.274 1.00 34.24 C ATOM 0 H ILE A 118 1.913 8.950 -2.565 1.00 42.41 H new ATOM 0 HA ILE A 118 0.407 8.602 -0.250 1.00 3.33 H new ATOM 0 HB ILE A 118 3.266 9.653 -0.582 1.00 23.44 H new ATOM 0 HG12 ILE A 118 2.254 6.804 -0.237 1.00 11.22 H new ATOM 0 HG13 ILE A 118 2.852 7.492 -1.733 1.00 11.22 H new ATOM 0 HG21 ILE A 118 3.658 8.761 1.687 1.00 42.31 H new ATOM 0 HG22 ILE A 118 2.421 10.041 1.685 1.00 42.31 H new ATOM 0 HG23 ILE A 118 1.934 8.333 1.811 1.00 42.31 H new ATOM 0 HD11 ILE A 118 4.566 6.117 -0.654 1.00 34.24 H new ATOM 0 HD12 ILE A 118 5.077 7.821 -0.709 1.00 34.24 H new ATOM 0 HD13 ILE A 118 4.470 7.123 0.811 1.00 34.24 H new ATOM 1858 N HIS A 119 1.526 11.712 -0.656 1.00 2.34 N ATOM 1859 CA HIS A 119 1.454 13.065 -0.105 1.00 4.33 C ATOM 1860 C HIS A 119 0.168 13.804 -0.511 1.00 52.35 C ATOM 1861 O HIS A 119 -0.309 14.673 0.222 1.00 31.13 O ATOM 1862 CB HIS A 119 2.686 13.877 -0.522 1.00 64.40 C ATOM 1863 CG HIS A 119 3.076 14.895 0.500 1.00 72.10 C ATOM 1864 ND1 HIS A 119 2.277 15.963 0.843 1.00 31.11 N ATOM 1865 CD2 HIS A 119 4.165 14.971 1.300 1.00 33.45 C ATOM 1866 CE1 HIS A 119 2.852 16.647 1.812 1.00 72.51 C ATOM 1867 NE2 HIS A 119 3.996 16.068 2.105 1.00 44.13 N ATOM 0 H HIS A 119 2.161 11.610 -1.447 1.00 2.34 H new ATOM 0 HA HIS A 119 1.434 12.964 0.980 1.00 4.33 H new ATOM 0 HB2 HIS A 119 3.523 13.199 -0.692 1.00 64.40 H new ATOM 0 HB3 HIS A 119 2.483 14.377 -1.469 1.00 64.40 H new ATOM 0 HD1 HIS A 119 1.380 16.189 0.414 1.00 31.11 H new ATOM 0 HD2 HIS A 119 5.008 14.295 1.304 1.00 33.45 H new ATOM 0 HE1 HIS A 119 2.452 17.532 2.285 1.00 72.51 H new ATOM 1876 N ASP A 120 -0.387 13.456 -1.668 1.00 0.34 N ATOM 1877 CA ASP A 120 -1.575 14.138 -2.190 1.00 10.12 C ATOM 1878 C ASP A 120 -2.863 13.709 -1.458 1.00 43.15 C ATOM 1879 O ASP A 120 -3.649 14.552 -1.029 1.00 0.24 O ATOM 1880 CB ASP A 120 -1.709 13.878 -3.693 1.00 40.21 C ATOM 1881 CG ASP A 120 -2.871 14.635 -4.313 1.00 14.01 C ATOM 1882 OD1 ASP A 120 -2.780 15.872 -4.442 1.00 55.12 O ATOM 1883 OD2 ASP A 120 -3.883 13.998 -4.668 1.00 3.52 O ATOM 0 H ASP A 120 -0.036 12.707 -2.264 1.00 0.34 H new ATOM 0 HA ASP A 120 -1.444 15.206 -2.014 1.00 10.12 H new ATOM 0 HB2 ASP A 120 -0.784 14.166 -4.192 1.00 40.21 H new ATOM 0 HB3 ASP A 120 -1.843 12.810 -3.863 1.00 40.21 H new ATOM 1888 N ARG A 121 -3.083 12.399 -1.318 1.00 64.10 N ATOM 1889 CA ARG A 121 -4.326 11.894 -0.704 1.00 71.04 C ATOM 1890 C ARG A 121 -4.096 11.216 0.655 1.00 3.30 C ATOM 1891 O ARG A 121 -4.842 11.459 1.605 1.00 43.23 O ATOM 1892 CB ARG A 121 -5.049 10.934 -1.663 1.00 63.30 C ATOM 1893 CG ARG A 121 -5.503 11.613 -2.950 1.00 61.43 C ATOM 1894 CD ARG A 121 -6.360 10.706 -3.825 1.00 43.43 C ATOM 1895 NE ARG A 121 -6.759 11.387 -5.054 1.00 34.30 N ATOM 1896 CZ ARG A 121 -7.957 11.352 -5.569 1.00 45.13 C ATOM 1897 NH1 ARG A 121 -8.902 10.663 -5.019 1.00 20.44 N ATOM 1898 NH2 ARG A 121 -8.208 12.025 -6.641 1.00 2.32 N ATOM 0 H ARG A 121 -2.430 11.673 -1.615 1.00 64.10 H new ATOM 0 HA ARG A 121 -4.954 12.765 -0.517 1.00 71.04 H new ATOM 0 HB2 ARG A 121 -4.385 10.106 -1.910 1.00 63.30 H new ATOM 0 HB3 ARG A 121 -5.916 10.508 -1.158 1.00 63.30 H new ATOM 0 HG2 ARG A 121 -6.069 12.511 -2.702 1.00 61.43 H new ATOM 0 HG3 ARG A 121 -4.628 11.934 -3.515 1.00 61.43 H new ATOM 0 HD2 ARG A 121 -5.804 9.801 -4.071 1.00 43.43 H new ATOM 0 HD3 ARG A 121 -7.247 10.395 -3.273 1.00 43.43 H new ATOM 0 HE ARG A 121 -6.049 11.930 -5.546 1.00 34.30 H new ATOM 0 HH11 ARG A 121 -8.718 10.134 -4.167 1.00 20.44 H new ATOM 0 HH12 ARG A 121 -9.832 10.648 -5.437 1.00 20.44 H new ATOM 0 HH21 ARG A 121 -7.472 12.579 -7.079 1.00 2.32 H new ATOM 0 HH22 ARG A 121 -9.142 12.003 -7.050 1.00 2.32 H new ATOM 1912 N MET A 122 -3.069 10.377 0.759 1.00 4.20 N ATOM 1913 CA MET A 122 -2.813 9.637 2.003 1.00 0.21 C ATOM 1914 C MET A 122 -2.500 10.569 3.191 1.00 1.12 C ATOM 1915 O MET A 122 -3.112 10.446 4.250 1.00 21.41 O ATOM 1916 CB MET A 122 -1.678 8.625 1.810 1.00 15.05 C ATOM 1917 CG MET A 122 -2.066 7.423 0.963 1.00 61.25 C ATOM 1918 SD MET A 122 -0.727 6.227 0.820 1.00 10.34 S ATOM 1919 CE MET A 122 -1.584 4.834 0.095 1.00 13.41 C ATOM 0 H MET A 122 -2.404 10.190 0.009 1.00 4.20 H new ATOM 0 HA MET A 122 -3.732 9.102 2.244 1.00 0.21 H new ATOM 0 HB2 MET A 122 -0.831 9.128 1.344 1.00 15.05 H new ATOM 0 HB3 MET A 122 -1.344 8.277 2.787 1.00 15.05 H new ATOM 0 HG2 MET A 122 -2.938 6.938 1.402 1.00 61.25 H new ATOM 0 HG3 MET A 122 -2.356 7.761 -0.032 1.00 61.25 H new ATOM 0 HE1 MET A 122 -1.178 3.907 0.499 1.00 13.41 H new ATOM 0 HE2 MET A 122 -2.646 4.898 0.331 1.00 13.41 H new ATOM 0 HE3 MET A 122 -1.451 4.848 -0.987 1.00 13.41 H new ATOM 1929 N ILE A 123 -1.555 11.498 3.012 1.00 10.43 N ATOM 1930 CA ILE A 123 -1.171 12.430 4.089 1.00 31.02 C ATOM 1931 C ILE A 123 -2.390 13.183 4.676 1.00 14.33 C ATOM 1932 O ILE A 123 -2.613 13.131 5.888 1.00 63.53 O ATOM 1933 CB ILE A 123 -0.087 13.444 3.620 1.00 45.03 C ATOM 1934 CG1 ILE A 123 1.251 12.728 3.370 1.00 2.22 C ATOM 1935 CG2 ILE A 123 0.090 14.573 4.640 1.00 22.24 C ATOM 1936 CD1 ILE A 123 1.910 12.185 4.622 1.00 42.01 C ATOM 0 H ILE A 123 -1.042 11.628 2.140 1.00 10.43 H new ATOM 0 HA ILE A 123 -0.744 11.815 4.882 1.00 31.02 H new ATOM 0 HB ILE A 123 -0.424 13.887 2.683 1.00 45.03 H new ATOM 0 HG12 ILE A 123 1.085 11.905 2.675 1.00 2.22 H new ATOM 0 HG13 ILE A 123 1.936 13.423 2.884 1.00 2.22 H new ATOM 0 HG21 ILE A 123 0.853 15.266 4.287 1.00 22.24 H new ATOM 0 HG22 ILE A 123 -0.854 15.104 4.762 1.00 22.24 H new ATOM 0 HG23 ILE A 123 0.397 14.153 5.598 1.00 22.24 H new ATOM 0 HD11 ILE A 123 2.847 11.696 4.357 1.00 42.01 H new ATOM 0 HD12 ILE A 123 2.111 13.004 5.312 1.00 42.01 H new ATOM 0 HD13 ILE A 123 1.246 11.464 5.099 1.00 42.01 H new ATOM 1948 N PRO A 124 -3.201 13.896 3.847 1.00 34.34 N ATOM 1949 CA PRO A 124 -4.419 14.577 4.333 1.00 34.45 C ATOM 1950 C PRO A 124 -5.329 13.659 5.168 1.00 4.41 C ATOM 1951 O PRO A 124 -5.790 14.042 6.248 1.00 2.31 O ATOM 1952 CB PRO A 124 -5.122 15.007 3.038 1.00 51.22 C ATOM 1953 CG PRO A 124 -4.013 15.184 2.060 1.00 24.33 C ATOM 1954 CD PRO A 124 -3.000 14.118 2.397 1.00 12.03 C ATOM 0 HA PRO A 124 -4.180 15.403 5.003 1.00 34.45 H new ATOM 0 HB2 PRO A 124 -5.833 14.252 2.701 1.00 51.22 H new ATOM 0 HB3 PRO A 124 -5.681 15.932 3.177 1.00 51.22 H new ATOM 0 HG2 PRO A 124 -4.372 15.074 1.037 1.00 24.33 H new ATOM 0 HG3 PRO A 124 -3.576 16.179 2.139 1.00 24.33 H new ATOM 0 HD2 PRO A 124 -3.171 13.207 1.824 1.00 12.03 H new ATOM 0 HD3 PRO A 124 -1.984 14.446 2.178 1.00 12.03 H new ATOM 1962 N HIS A 125 -5.569 12.443 4.677 1.00 33.25 N ATOM 1963 CA HIS A 125 -6.408 11.474 5.391 1.00 40.15 C ATOM 1964 C HIS A 125 -5.772 11.036 6.718 1.00 41.12 C ATOM 1965 O HIS A 125 -6.425 11.055 7.757 1.00 64.24 O ATOM 1966 CB HIS A 125 -6.698 10.249 4.514 1.00 34.11 C ATOM 1967 CG HIS A 125 -7.763 10.485 3.490 1.00 4.13 C ATOM 1968 ND1 HIS A 125 -9.044 10.817 3.863 1.00 54.13 N ATOM 1969 CD2 HIS A 125 -7.699 10.426 2.140 1.00 44.14 C ATOM 1970 CE1 HIS A 125 -9.723 10.949 2.740 1.00 63.04 C ATOM 1971 NE2 HIS A 125 -8.951 10.721 1.670 1.00 42.31 N ATOM 0 H HIS A 125 -5.196 12.104 3.790 1.00 33.25 H new ATOM 0 HA HIS A 125 -7.349 11.974 5.620 1.00 40.15 H new ATOM 0 HB2 HIS A 125 -5.780 9.949 4.009 1.00 34.11 H new ATOM 0 HB3 HIS A 125 -6.997 9.418 5.153 1.00 34.11 H new ATOM 0 HD2 HIS A 125 -6.828 10.191 1.547 1.00 44.14 H new ATOM 0 HE1 HIS A 125 -10.770 11.208 2.690 1.00 63.04 H new ATOM 0 HE2 HIS A 125 -9.240 10.760 0.693 1.00 42.31 H new ATOM 1979 N PHE A 126 -4.497 10.654 6.682 1.00 33.05 N ATOM 1980 CA PHE A 126 -3.789 10.208 7.891 1.00 71.43 C ATOM 1981 C PHE A 126 -3.725 11.321 8.949 1.00 3.34 C ATOM 1982 O PHE A 126 -3.751 11.053 10.152 1.00 42.44 O ATOM 1983 CB PHE A 126 -2.375 9.724 7.544 1.00 0.52 C ATOM 1984 CG PHE A 126 -2.338 8.550 6.592 1.00 11.33 C ATOM 1985 CD1 PHE A 126 -3.415 7.677 6.483 1.00 52.32 C ATOM 1986 CD2 PHE A 126 -1.220 8.320 5.807 1.00 45.44 C ATOM 1987 CE1 PHE A 126 -3.371 6.604 5.611 1.00 34.20 C ATOM 1988 CE2 PHE A 126 -1.172 7.250 4.938 1.00 52.43 C ATOM 1989 CZ PHE A 126 -2.248 6.390 4.839 1.00 61.43 C ATOM 0 H PHE A 126 -3.930 10.643 5.834 1.00 33.05 H new ATOM 0 HA PHE A 126 -4.352 9.375 8.312 1.00 71.43 H new ATOM 0 HB2 PHE A 126 -1.818 10.551 7.105 1.00 0.52 H new ATOM 0 HB3 PHE A 126 -1.862 9.447 8.465 1.00 0.52 H new ATOM 0 HD1 PHE A 126 -4.296 7.839 7.086 1.00 52.32 H new ATOM 0 HD2 PHE A 126 -0.374 8.988 5.876 1.00 45.44 H new ATOM 0 HE1 PHE A 126 -4.215 5.935 5.535 1.00 34.20 H new ATOM 0 HE2 PHE A 126 -0.292 7.085 4.334 1.00 52.43 H new ATOM 0 HZ PHE A 126 -2.210 5.552 4.159 1.00 61.43 H new ATOM 1999 N ARG A 127 -3.641 12.572 8.496 1.00 20.54 N ATOM 2000 CA ARG A 127 -3.714 13.724 9.401 1.00 31.44 C ATOM 2001 C ARG A 127 -5.130 13.869 9.978 1.00 35.52 C ATOM 2002 O ARG A 127 -5.305 14.156 11.161 1.00 24.12 O ATOM 2003 CB ARG A 127 -3.309 15.019 8.675 1.00 63.13 C ATOM 2004 CG ARG A 127 -1.851 15.052 8.219 1.00 64.51 C ATOM 2005 CD ARG A 127 -1.501 16.367 7.527 1.00 61.25 C ATOM 2006 NE ARG A 127 -1.696 17.518 8.408 1.00 61.24 N ATOM 2007 CZ ARG A 127 -1.754 18.760 8.006 1.00 14.13 C ATOM 2008 NH1 ARG A 127 -1.626 19.062 6.754 1.00 42.41 N ATOM 2009 NH2 ARG A 127 -1.942 19.705 8.868 1.00 54.51 N ATOM 0 H ARG A 127 -3.523 12.815 7.512 1.00 20.54 H new ATOM 0 HA ARG A 127 -3.015 13.551 10.219 1.00 31.44 H new ATOM 0 HB2 ARG A 127 -3.953 15.151 7.806 1.00 63.13 H new ATOM 0 HB3 ARG A 127 -3.490 15.865 9.337 1.00 63.13 H new ATOM 0 HG2 ARG A 127 -1.198 14.910 9.080 1.00 64.51 H new ATOM 0 HG3 ARG A 127 -1.665 14.222 7.537 1.00 64.51 H new ATOM 0 HD2 ARG A 127 -0.463 16.337 7.194 1.00 61.25 H new ATOM 0 HD3 ARG A 127 -2.118 16.483 6.636 1.00 61.25 H new ATOM 0 HE ARG A 127 -1.794 17.338 9.407 1.00 61.24 H new ATOM 0 HH11 ARG A 127 -1.477 18.325 6.064 1.00 42.41 H new ATOM 0 HH12 ARG A 127 -1.674 20.037 6.457 1.00 42.41 H new ATOM 0 HH21 ARG A 127 -2.044 19.480 9.858 1.00 54.51 H new ATOM 0 HH22 ARG A 127 -1.988 20.676 8.559 1.00 54.51 H new ATOM 2023 N SER A 128 -6.138 13.665 9.131 1.00 0.32 N ATOM 2024 CA SER A 128 -7.547 13.743 9.553 1.00 44.02 C ATOM 2025 C SER A 128 -7.961 12.513 10.382 1.00 24.50 C ATOM 2026 O SER A 128 -8.930 12.558 11.143 1.00 14.03 O ATOM 2027 CB SER A 128 -8.459 13.870 8.324 1.00 2.22 C ATOM 2028 OG SER A 128 -9.825 13.993 8.696 1.00 63.01 O ATOM 0 H SER A 128 -6.010 13.443 8.144 1.00 0.32 H new ATOM 0 HA SER A 128 -7.655 14.626 10.183 1.00 44.02 H new ATOM 0 HB2 SER A 128 -8.161 14.739 7.738 1.00 2.22 H new ATOM 0 HB3 SER A 128 -8.333 12.996 7.685 1.00 2.22 H new ATOM 0 HG SER A 128 -10.377 14.073 7.891 1.00 63.01 H new ATOM 2034 N GLY A 129 -7.217 11.416 10.229 1.00 10.44 N ATOM 2035 CA GLY A 129 -7.512 10.185 10.964 1.00 40.22 C ATOM 2036 C GLY A 129 -8.000 9.040 10.074 1.00 33.12 C ATOM 2037 O GLY A 129 -8.193 7.918 10.549 1.00 54.42 O ATOM 0 H GLY A 129 -6.411 11.355 9.607 1.00 10.44 H new ATOM 0 HA2 GLY A 129 -6.615 9.865 11.494 1.00 40.22 H new ATOM 0 HA3 GLY A 129 -8.270 10.395 11.719 1.00 40.22 H new ATOM 2041 N ASN A 130 -8.190 9.314 8.785 1.00 65.42 N ATOM 2042 CA ASN A 130 -8.688 8.307 7.841 1.00 34.22 C ATOM 2043 C ASN A 130 -7.564 7.408 7.299 1.00 5.25 C ATOM 2044 O ASN A 130 -7.103 7.584 6.170 1.00 52.11 O ATOM 2045 CB ASN A 130 -9.397 8.976 6.662 1.00 43.45 C ATOM 2046 CG ASN A 130 -10.606 9.786 7.069 1.00 34.25 C ATOM 2047 OD1 ASN A 130 -11.220 9.545 8.104 1.00 20.31 O ATOM 2048 ND2 ASN A 130 -10.972 10.739 6.239 1.00 41.44 N ATOM 0 H ASN A 130 -8.007 10.226 8.366 1.00 65.42 H new ATOM 0 HA ASN A 130 -9.389 7.684 8.396 1.00 34.22 H new ATOM 0 HB2 ASN A 130 -8.691 9.626 6.145 1.00 43.45 H new ATOM 0 HB3 ASN A 130 -9.705 8.210 5.951 1.00 43.45 H new ATOM 0 HD21 ASN A 130 -11.793 11.308 6.446 1.00 41.44 H new ATOM 0 HD22 ASN A 130 -10.435 10.909 5.388 1.00 41.44 H new ATOM 2055 N TYR A 131 -7.120 6.448 8.101 1.00 5.30 N ATOM 2056 CA TYR A 131 -6.094 5.499 7.655 1.00 31.14 C ATOM 2057 C TYR A 131 -6.653 4.509 6.622 1.00 22.21 C ATOM 2058 O TYR A 131 -5.985 4.173 5.640 1.00 75.44 O ATOM 2059 CB TYR A 131 -5.485 4.768 8.856 1.00 61.40 C ATOM 2060 CG TYR A 131 -4.729 5.705 9.781 1.00 10.32 C ATOM 2061 CD1 TYR A 131 -5.380 6.370 10.814 1.00 61.24 C ATOM 2062 CD2 TYR A 131 -3.371 5.945 9.604 1.00 12.12 C ATOM 2063 CE1 TYR A 131 -4.702 7.240 11.643 1.00 34.44 C ATOM 2064 CE2 TYR A 131 -2.687 6.817 10.426 1.00 52.04 C ATOM 2065 CZ TYR A 131 -3.357 7.461 11.445 1.00 5.33 C ATOM 2066 OH TYR A 131 -2.681 8.336 12.257 1.00 64.34 O ATOM 0 H TYR A 131 -7.447 6.302 9.056 1.00 5.30 H new ATOM 0 HA TYR A 131 -5.303 6.063 7.161 1.00 31.14 H new ATOM 0 HB2 TYR A 131 -6.277 4.271 9.415 1.00 61.40 H new ATOM 0 HB3 TYR A 131 -4.810 3.990 8.500 1.00 61.40 H new ATOM 0 HD1 TYR A 131 -6.435 6.203 10.970 1.00 61.24 H new ATOM 0 HD2 TYR A 131 -2.842 5.440 8.809 1.00 12.12 H new ATOM 0 HE1 TYR A 131 -5.223 7.745 12.443 1.00 34.44 H new ATOM 0 HE2 TYR A 131 -1.633 6.994 10.272 1.00 52.04 H new ATOM 0 HH TYR A 131 -2.189 7.835 12.941 1.00 64.34 H new ATOM 2076 N ALA A 132 -7.887 4.059 6.838 1.00 21.42 N ATOM 2077 CA ALA A 132 -8.569 3.176 5.888 1.00 63.35 C ATOM 2078 C ALA A 132 -8.829 3.888 4.550 1.00 70.44 C ATOM 2079 O ALA A 132 -8.520 3.358 3.480 1.00 0.31 O ATOM 2080 CB ALA A 132 -9.881 2.676 6.483 1.00 63.44 C ATOM 0 H ALA A 132 -8.438 4.291 7.664 1.00 21.42 H new ATOM 0 HA ALA A 132 -7.918 2.324 5.694 1.00 63.35 H new ATOM 0 HB1 ALA A 132 -10.379 2.021 5.768 1.00 63.44 H new ATOM 0 HB2 ALA A 132 -9.677 2.124 7.400 1.00 63.44 H new ATOM 0 HB3 ALA A 132 -10.526 3.526 6.707 1.00 63.44 H new ATOM 2086 N GLU A 133 -9.392 5.094 4.626 1.00 14.30 N ATOM 2087 CA GLU A 133 -9.696 5.892 3.429 1.00 62.32 C ATOM 2088 C GLU A 133 -8.420 6.240 2.643 1.00 61.41 C ATOM 2089 O GLU A 133 -8.397 6.162 1.413 1.00 73.40 O ATOM 2090 CB GLU A 133 -10.436 7.182 3.819 1.00 40.44 C ATOM 2091 CG GLU A 133 -11.657 6.952 4.705 1.00 54.22 C ATOM 2092 CD GLU A 133 -12.610 5.909 4.146 1.00 42.31 C ATOM 2093 OE1 GLU A 133 -13.320 6.212 3.162 1.00 35.32 O ATOM 2094 OE2 GLU A 133 -12.653 4.785 4.690 1.00 62.41 O ATOM 0 H GLU A 133 -9.649 5.544 5.504 1.00 14.30 H new ATOM 0 HA GLU A 133 -10.337 5.289 2.786 1.00 62.32 H new ATOM 0 HB2 GLU A 133 -9.743 7.844 4.338 1.00 40.44 H new ATOM 0 HB3 GLU A 133 -10.750 7.697 2.911 1.00 40.44 H new ATOM 0 HG2 GLU A 133 -11.326 6.640 5.696 1.00 54.22 H new ATOM 0 HG3 GLU A 133 -12.191 7.894 4.830 1.00 54.22 H new ATOM 2101 N GLY A 134 -7.361 6.617 3.365 1.00 72.22 N ATOM 2102 CA GLY A 134 -6.084 6.931 2.728 1.00 1.24 C ATOM 2103 C GLY A 134 -5.526 5.770 1.908 1.00 55.04 C ATOM 2104 O GLY A 134 -5.162 5.935 0.741 1.00 51.02 O ATOM 0 H GLY A 134 -7.364 6.711 4.381 1.00 72.22 H new ATOM 0 HA2 GLY A 134 -6.211 7.798 2.080 1.00 1.24 H new ATOM 0 HA3 GLY A 134 -5.360 7.208 3.494 1.00 1.24 H new ATOM 2108 N LEU A 135 -5.462 4.587 2.519 1.00 34.34 N ATOM 2109 CA LEU A 135 -5.014 3.378 1.817 1.00 10.44 C ATOM 2110 C LEU A 135 -5.965 3.010 0.668 1.00 31.21 C ATOM 2111 O LEU A 135 -5.525 2.625 -0.415 1.00 24.04 O ATOM 2112 CB LEU A 135 -4.898 2.200 2.793 1.00 5.14 C ATOM 2113 CG LEU A 135 -3.851 2.361 3.906 1.00 43.34 C ATOM 2114 CD1 LEU A 135 -3.820 1.122 4.795 1.00 62.33 C ATOM 2115 CD2 LEU A 135 -2.469 2.641 3.316 1.00 51.44 C ATOM 0 H LEU A 135 -5.713 4.437 3.496 1.00 34.34 H new ATOM 0 HA LEU A 135 -4.033 3.591 1.393 1.00 10.44 H new ATOM 0 HB2 LEU A 135 -5.872 2.037 3.255 1.00 5.14 H new ATOM 0 HB3 LEU A 135 -4.661 1.301 2.223 1.00 5.14 H new ATOM 0 HG LEU A 135 -4.134 3.216 4.520 1.00 43.34 H new ATOM 0 HD11 LEU A 135 -3.073 1.254 5.577 1.00 62.33 H new ATOM 0 HD12 LEU A 135 -4.800 0.976 5.250 1.00 62.33 H new ATOM 0 HD13 LEU A 135 -3.565 0.249 4.194 1.00 62.33 H new ATOM 0 HD21 LEU A 135 -1.744 2.751 4.123 1.00 51.44 H new ATOM 0 HD22 LEU A 135 -2.173 1.812 2.673 1.00 51.44 H new ATOM 0 HD23 LEU A 135 -2.503 3.560 2.731 1.00 51.44 H new ATOM 2127 N SER A 136 -7.271 3.139 0.914 1.00 30.25 N ATOM 2128 CA SER A 136 -8.294 2.809 -0.093 1.00 4.52 C ATOM 2129 C SER A 136 -8.096 3.619 -1.383 1.00 13.41 C ATOM 2130 O SER A 136 -7.975 3.053 -2.474 1.00 14.01 O ATOM 2131 CB SER A 136 -9.703 3.061 0.466 1.00 44.11 C ATOM 2132 OG SER A 136 -10.703 2.695 -0.471 1.00 54.51 O ATOM 0 H SER A 136 -7.650 3.470 1.801 1.00 30.25 H new ATOM 0 HA SER A 136 -8.186 1.751 -0.333 1.00 4.52 H new ATOM 0 HB2 SER A 136 -9.838 2.492 1.386 1.00 44.11 H new ATOM 0 HB3 SER A 136 -9.811 4.115 0.723 1.00 44.11 H new ATOM 0 HG SER A 136 -11.589 2.865 -0.087 1.00 54.51 H new ATOM 2138 N GLU A 137 -8.044 4.947 -1.260 1.00 11.22 N ATOM 2139 CA GLU A 137 -7.819 5.812 -2.424 1.00 12.14 C ATOM 2140 C GLU A 137 -6.394 5.656 -2.978 1.00 35.31 C ATOM 2141 O GLU A 137 -6.151 5.901 -4.158 1.00 60.31 O ATOM 2142 CB GLU A 137 -8.098 7.284 -2.083 1.00 13.45 C ATOM 2143 CG GLU A 137 -9.556 7.566 -1.732 1.00 31.14 C ATOM 2144 CD GLU A 137 -9.910 9.038 -1.859 1.00 33.12 C ATOM 2145 OE1 GLU A 137 -10.141 9.497 -2.997 1.00 62.15 O ATOM 2146 OE2 GLU A 137 -9.948 9.747 -0.834 1.00 0.35 O ATOM 0 H GLU A 137 -8.153 5.445 -0.376 1.00 11.22 H new ATOM 0 HA GLU A 137 -8.519 5.496 -3.198 1.00 12.14 H new ATOM 0 HB2 GLU A 137 -7.468 7.579 -1.244 1.00 13.45 H new ATOM 0 HB3 GLU A 137 -7.811 7.905 -2.931 1.00 13.45 H new ATOM 0 HG2 GLU A 137 -10.203 6.982 -2.386 1.00 31.14 H new ATOM 0 HG3 GLU A 137 -9.751 7.235 -0.712 1.00 31.14 H new ATOM 2153 N GLY A 138 -5.456 5.258 -2.118 1.00 61.21 N ATOM 2154 CA GLY A 138 -4.107 4.939 -2.577 1.00 74.35 C ATOM 2155 C GLY A 138 -4.089 3.750 -3.536 1.00 12.23 C ATOM 2156 O GLY A 138 -3.429 3.782 -4.576 1.00 72.54 O ATOM 0 H GLY A 138 -5.603 5.150 -1.114 1.00 61.21 H new ATOM 0 HA2 GLY A 138 -3.679 5.810 -3.073 1.00 74.35 H new ATOM 0 HA3 GLY A 138 -3.475 4.719 -1.717 1.00 74.35 H new ATOM 2160 N VAL A 139 -4.828 2.699 -3.180 1.00 4.44 N ATOM 2161 CA VAL A 139 -5.004 1.536 -4.053 1.00 62.22 C ATOM 2162 C VAL A 139 -5.671 1.941 -5.376 1.00 14.14 C ATOM 2163 O VAL A 139 -5.197 1.591 -6.460 1.00 22.42 O ATOM 2164 CB VAL A 139 -5.862 0.445 -3.368 1.00 21.21 C ATOM 2165 CG1 VAL A 139 -6.160 -0.708 -4.327 1.00 42.35 C ATOM 2166 CG2 VAL A 139 -5.176 -0.067 -2.102 1.00 23.11 C ATOM 0 H VAL A 139 -5.317 2.628 -2.288 1.00 4.44 H new ATOM 0 HA VAL A 139 -4.012 1.133 -4.255 1.00 62.22 H new ATOM 0 HB VAL A 139 -6.812 0.897 -3.084 1.00 21.21 H new ATOM 0 HG11 VAL A 139 -6.764 -1.458 -3.817 1.00 42.35 H new ATOM 0 HG12 VAL A 139 -6.705 -0.330 -5.192 1.00 42.35 H new ATOM 0 HG13 VAL A 139 -5.224 -1.159 -4.656 1.00 42.35 H new ATOM 0 HG21 VAL A 139 -5.796 -0.833 -1.636 1.00 23.11 H new ATOM 0 HG22 VAL A 139 -4.206 -0.493 -2.360 1.00 23.11 H new ATOM 0 HG23 VAL A 139 -5.035 0.759 -1.405 1.00 23.11 H new ATOM 2176 N LEU A 140 -6.777 2.677 -5.274 1.00 11.44 N ATOM 2177 CA LEU A 140 -7.489 3.177 -6.457 1.00 23.20 C ATOM 2178 C LEU A 140 -6.575 4.039 -7.343 1.00 20.21 C ATOM 2179 O LEU A 140 -6.608 3.930 -8.565 1.00 50.34 O ATOM 2180 CB LEU A 140 -8.722 3.985 -6.031 1.00 34.50 C ATOM 2181 CG LEU A 140 -9.515 4.644 -7.178 1.00 32.14 C ATOM 2182 CD1 LEU A 140 -9.996 3.603 -8.188 1.00 74.40 C ATOM 2183 CD2 LEU A 140 -10.694 5.441 -6.627 1.00 42.14 C ATOM 0 H LEU A 140 -7.202 2.942 -4.386 1.00 11.44 H new ATOM 0 HA LEU A 140 -7.808 2.315 -7.042 1.00 23.20 H new ATOM 0 HB2 LEU A 140 -9.394 3.326 -5.480 1.00 34.50 H new ATOM 0 HB3 LEU A 140 -8.402 4.765 -5.339 1.00 34.50 H new ATOM 0 HG LEU A 140 -8.845 5.329 -7.697 1.00 32.14 H new ATOM 0 HD11 LEU A 140 -10.552 4.098 -8.984 1.00 74.40 H new ATOM 0 HD12 LEU A 140 -9.137 3.085 -8.613 1.00 74.40 H new ATOM 0 HD13 LEU A 140 -10.643 2.883 -7.688 1.00 74.40 H new ATOM 0 HD21 LEU A 140 -11.241 5.898 -7.451 1.00 42.14 H new ATOM 0 HD22 LEU A 140 -11.358 4.775 -6.076 1.00 42.14 H new ATOM 0 HD23 LEU A 140 -10.326 6.220 -5.959 1.00 42.14 H new ATOM 2195 N ALA A 141 -5.754 4.882 -6.716 1.00 35.50 N ATOM 2196 CA ALA A 141 -4.820 5.751 -7.447 1.00 45.54 C ATOM 2197 C ALA A 141 -3.904 4.940 -8.379 1.00 21.44 C ATOM 2198 O ALA A 141 -3.793 5.234 -9.572 1.00 62.14 O ATOM 2199 CB ALA A 141 -3.991 6.572 -6.468 1.00 44.13 C ATOM 0 H ALA A 141 -5.714 4.984 -5.702 1.00 35.50 H new ATOM 0 HA ALA A 141 -5.408 6.426 -8.069 1.00 45.54 H new ATOM 0 HB1 ALA A 141 -3.303 7.212 -7.021 1.00 44.13 H new ATOM 0 HB2 ALA A 141 -4.652 7.190 -5.860 1.00 44.13 H new ATOM 0 HB3 ALA A 141 -3.424 5.903 -5.821 1.00 44.13 H new ATOM 2205 N VAL A 142 -3.256 3.916 -7.826 1.00 41.15 N ATOM 2206 CA VAL A 142 -2.426 3.006 -8.620 1.00 22.52 C ATOM 2207 C VAL A 142 -3.267 2.294 -9.693 1.00 10.14 C ATOM 2208 O VAL A 142 -2.875 2.213 -10.862 1.00 21.55 O ATOM 2209 CB VAL A 142 -1.734 1.948 -7.723 1.00 40.35 C ATOM 2210 CG1 VAL A 142 -0.924 0.963 -8.565 1.00 23.44 C ATOM 2211 CG2 VAL A 142 -0.844 2.630 -6.682 1.00 53.11 C ATOM 0 H VAL A 142 -3.289 3.694 -6.831 1.00 41.15 H new ATOM 0 HA VAL A 142 -1.659 3.609 -9.106 1.00 22.52 H new ATOM 0 HB VAL A 142 -2.508 1.385 -7.201 1.00 40.35 H new ATOM 0 HG11 VAL A 142 -0.449 0.231 -7.912 1.00 23.44 H new ATOM 0 HG12 VAL A 142 -1.586 0.451 -9.263 1.00 23.44 H new ATOM 0 HG13 VAL A 142 -0.159 1.504 -9.122 1.00 23.44 H new ATOM 0 HG21 VAL A 142 -0.366 1.873 -6.060 1.00 53.11 H new ATOM 0 HG22 VAL A 142 -0.080 3.221 -7.187 1.00 53.11 H new ATOM 0 HG23 VAL A 142 -1.452 3.283 -6.055 1.00 53.11 H new ATOM 2221 N GLN A 143 -4.428 1.784 -9.280 1.00 5.24 N ATOM 2222 CA GLN A 143 -5.379 1.145 -10.201 1.00 54.24 C ATOM 2223 C GLN A 143 -5.705 2.056 -11.405 1.00 23.54 C ATOM 2224 O GLN A 143 -5.783 1.586 -12.543 1.00 3.10 O ATOM 2225 CB GLN A 143 -6.669 0.766 -9.451 1.00 23.12 C ATOM 2226 CG GLN A 143 -7.708 0.053 -10.315 1.00 42.21 C ATOM 2227 CD GLN A 143 -8.935 -0.390 -9.528 1.00 62.21 C ATOM 2228 OE1 GLN A 143 -9.327 0.234 -8.545 1.00 31.05 O ATOM 2229 NE2 GLN A 143 -9.553 -1.473 -9.957 1.00 30.52 N ATOM 0 H GLN A 143 -4.737 1.800 -8.308 1.00 5.24 H new ATOM 0 HA GLN A 143 -4.912 0.240 -10.590 1.00 54.24 H new ATOM 0 HB2 GLN A 143 -6.411 0.124 -8.608 1.00 23.12 H new ATOM 0 HB3 GLN A 143 -7.115 1.671 -9.038 1.00 23.12 H new ATOM 0 HG2 GLN A 143 -8.020 0.718 -11.120 1.00 42.21 H new ATOM 0 HG3 GLN A 143 -7.248 -0.818 -10.781 1.00 42.21 H new ATOM 0 HE21 GLN A 143 -9.203 -1.969 -10.777 1.00 30.52 H new ATOM 0 HE22 GLN A 143 -10.381 -1.815 -9.469 1.00 30.52 H new ATOM 2238 N GLN A 144 -5.879 3.355 -11.147 1.00 32.44 N ATOM 2239 CA GLN A 144 -6.142 4.339 -12.208 1.00 72.11 C ATOM 2240 C GLN A 144 -4.981 4.401 -13.213 1.00 53.34 C ATOM 2241 O GLN A 144 -5.193 4.351 -14.428 1.00 23.15 O ATOM 2242 CB GLN A 144 -6.365 5.734 -11.603 1.00 25.54 C ATOM 2243 CG GLN A 144 -7.607 5.845 -10.725 1.00 4.51 C ATOM 2244 CD GLN A 144 -7.780 7.231 -10.119 1.00 41.10 C ATOM 2245 OE1 GLN A 144 -6.811 7.938 -9.853 1.00 22.23 O ATOM 2246 NE2 GLN A 144 -9.014 7.632 -9.897 1.00 61.34 N ATOM 0 H GLN A 144 -5.843 3.754 -10.209 1.00 32.44 H new ATOM 0 HA GLN A 144 -7.042 4.021 -12.734 1.00 72.11 H new ATOM 0 HB2 GLN A 144 -5.491 6.005 -11.011 1.00 25.54 H new ATOM 0 HB3 GLN A 144 -6.440 6.461 -12.412 1.00 25.54 H new ATOM 0 HG2 GLN A 144 -8.488 5.600 -11.318 1.00 4.51 H new ATOM 0 HG3 GLN A 144 -7.547 5.108 -9.924 1.00 4.51 H new ATOM 0 HE21 GLN A 144 -9.798 7.022 -10.129 1.00 61.34 H new ATOM 0 HE22 GLN A 144 -9.186 8.553 -9.493 1.00 61.34 H new ATOM 2255 N VAL A 145 -3.760 4.511 -12.694 1.00 31.40 N ATOM 2256 CA VAL A 145 -2.555 4.586 -13.531 1.00 14.12 C ATOM 2257 C VAL A 145 -2.415 3.350 -14.437 1.00 34.13 C ATOM 2258 O VAL A 145 -2.189 3.470 -15.643 1.00 4.11 O ATOM 2259 CB VAL A 145 -1.276 4.732 -12.661 1.00 73.34 C ATOM 2260 CG1 VAL A 145 -0.019 4.782 -13.531 1.00 1.52 C ATOM 2261 CG2 VAL A 145 -1.369 5.973 -11.769 1.00 52.21 C ATOM 0 H VAL A 145 -3.574 4.551 -11.692 1.00 31.40 H new ATOM 0 HA VAL A 145 -2.664 5.470 -14.160 1.00 14.12 H new ATOM 0 HB VAL A 145 -1.203 3.853 -12.020 1.00 73.34 H new ATOM 0 HG11 VAL A 145 0.860 4.884 -12.895 1.00 1.52 H new ATOM 0 HG12 VAL A 145 0.058 3.863 -14.112 1.00 1.52 H new ATOM 0 HG13 VAL A 145 -0.078 5.635 -14.208 1.00 1.52 H new ATOM 0 HG21 VAL A 145 -0.464 6.057 -11.168 1.00 52.21 H new ATOM 0 HG22 VAL A 145 -1.475 6.861 -12.392 1.00 52.21 H new ATOM 0 HG23 VAL A 145 -2.234 5.885 -11.112 1.00 52.21 H new ATOM 2271 N LEU A 146 -2.566 2.167 -13.847 1.00 30.31 N ATOM 2272 CA LEU A 146 -2.442 0.903 -14.586 1.00 31.44 C ATOM 2273 C LEU A 146 -3.554 0.755 -15.638 1.00 62.25 C ATOM 2274 O LEU A 146 -3.282 0.606 -16.832 1.00 60.33 O ATOM 2275 CB LEU A 146 -2.485 -0.278 -13.607 1.00 73.00 C ATOM 2276 CG LEU A 146 -1.415 -0.253 -12.505 1.00 71.24 C ATOM 2277 CD1 LEU A 146 -1.606 -1.421 -11.538 1.00 3.04 C ATOM 2278 CD2 LEU A 146 -0.011 -0.270 -13.114 1.00 41.13 C ATOM 0 H LEU A 146 -2.775 2.052 -12.855 1.00 30.31 H new ATOM 0 HA LEU A 146 -1.486 0.909 -15.109 1.00 31.44 H new ATOM 0 HB2 LEU A 146 -3.468 -0.304 -13.136 1.00 73.00 H new ATOM 0 HB3 LEU A 146 -2.379 -1.203 -14.174 1.00 73.00 H new ATOM 0 HG LEU A 146 -1.527 0.673 -11.941 1.00 71.24 H new ATOM 0 HD11 LEU A 146 -0.837 -1.384 -10.766 1.00 3.04 H new ATOM 0 HD12 LEU A 146 -2.590 -1.352 -11.074 1.00 3.04 H new ATOM 0 HD13 LEU A 146 -1.527 -2.361 -12.083 1.00 3.04 H new ATOM 0 HD21 LEU A 146 0.732 -0.252 -12.316 1.00 41.13 H new ATOM 0 HD22 LEU A 146 0.117 -1.175 -13.708 1.00 41.13 H new ATOM 0 HD23 LEU A 146 0.120 0.604 -13.751 1.00 41.13 H new ATOM 2290 N ASP A 147 -4.805 0.826 -15.182 1.00 43.11 N ATOM 2291 CA ASP A 147 -5.972 0.669 -16.056 1.00 21.25 C ATOM 2292 C ASP A 147 -6.034 1.773 -17.130 1.00 2.22 C ATOM 2293 O ASP A 147 -6.574 1.566 -18.219 1.00 10.33 O ATOM 2294 CB ASP A 147 -7.246 0.658 -15.200 1.00 4.30 C ATOM 2295 CG ASP A 147 -8.514 0.468 -16.012 1.00 2.54 C ATOM 2296 OD1 ASP A 147 -8.798 -0.672 -16.442 1.00 71.14 O ATOM 2297 OD2 ASP A 147 -9.248 1.461 -16.211 1.00 74.51 O ATOM 0 H ASP A 147 -5.039 0.993 -14.203 1.00 43.11 H new ATOM 0 HA ASP A 147 -5.886 -0.279 -16.587 1.00 21.25 H new ATOM 0 HB2 ASP A 147 -7.172 -0.141 -14.462 1.00 4.30 H new ATOM 0 HB3 ASP A 147 -7.313 1.596 -14.649 1.00 4.30 H new