USER MOD reduce.3.24.130724 H: found=0, std=0, add=1122, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1124 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: B 262 SER OG : rot 180:sc= 0.234 USER MOD Set 1.2: B 266 SER OG : rot 180:sc= 0 USER MOD Set 1.3: B 268 THR OG1 : rot -134:sc= 0.238 USER MOD Set 2.1: A 89 ASN : amide:sc= -1.88 K(o=-1.9,f=-5.6!) USER MOD Set 2.2: A 92 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 73 SER OG : rot 65:sc= 1.2 USER MOD Set 3.2: A 75 ASN : amide:sc= 0.94 K(o=2.1,f=0.37) USER MOD Set 4.1: A 17 ASN : amide:sc= -1.38 K(o=-1.4,f=-11!) USER MOD Set 4.2: A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -141:sc= -0.529 (180deg=-1.49) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 TYR OH : rot 180:sc= -1.3 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -1 MET N :NH3+ -163:sc=-0.00191 (180deg=-0.414) USER MOD Single : A 10 ASN : amide:sc= -0.269 K(o=-0.27,f=-2.1) USER MOD Single : A 16 ASN : amide:sc= -1.58 K(o=-1.6,f=-4.5!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -150:sc= -2.46 USER MOD Single : A 27 ASN : amide:sc= -0.0015 X(o=-0.0015,f=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0.00436 USER MOD Single : A 32 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 41 ASN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 43 SER OG : rot 71:sc= 0.169 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 22:sc= 0.939 USER MOD Single : A 49 THR OG1 : rot -89:sc= 0.402 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00966) USER MOD Single : A 61 ASN : amide:sc= -0.948 K(o=-0.95,f=-2!) USER MOD Single : A 64 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.0436) USER MOD Single : A 67 ASN : amide:sc= -1.38 K(o=-1.4,f=0.011) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 LYS NZ :NH3+ -137:sc= 0 (180deg=-0.242) USER MOD Single : A 80 LYS NZ :NH3+ -134:sc= 0 (180deg=-0.139) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0614) USER MOD Single : A 90 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0346) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 242 THR OG1 : rot 101:sc= 0.877 USER MOD Single : B 243 THR OG1 : rot 180:sc= 0 USER MOD Single : B 244 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 246 LYS NZ :NH3+ -141:sc= 0 (180deg=-0.0617) USER MOD Single : B 247 ASN : amide:sc= -0.198 K(o=-0.2,f=-2.3!) USER MOD Single : B 249 SER OG : rot 180:sc= 0.118 USER MOD Single : B 257 SER OG : rot 180:sc= 3.7e-05 USER MOD Single : B 258 SER OG : rot 180:sc= 0 USER MOD Single : B 259 GLN : amide:sc= -0.488 K(o=-0.49,f=-2) USER MOD Single : B 265 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 267 SER OG : rot 180:sc= 0 USER MOD Single : B 271 SER OG : rot 180:sc= 0 USER MOD Single : B 275 THR OG1 : rot 180:sc= 0.00421 USER MOD Single : B 277 GLN : amide:sc= -0.426 X(o=-0.43,f=-0.75) USER MOD Single : B 279 SER OG : rot 180:sc= 0 USER MOD Single : B 280 THR OG1 : rot 180:sc= 0 USER MOD Single : B 283 GLN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : B 288 SER OG : rot -107:sc= 0.397 USER MOD Single : B 289 HIS : no HD1:sc= 0 X(o=0,f=-0.029) USER MOD Single : B 290 SER OG : rot 180:sc= 0 USER MOD Single : B 291 SER OG : rot 180:sc= -0.227 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -1 120.404 -10.580 -2.576 1.00 4.63 N ATOM 2 CA MET A -1 121.741 -10.814 -1.953 1.00 3.90 C ATOM 3 C MET A -1 121.952 -9.853 -0.780 1.00 3.08 C ATOM 4 O MET A -1 122.090 -10.270 0.356 1.00 3.36 O ATOM 5 CB MET A -1 122.757 -10.537 -3.063 1.00 4.53 C ATOM 6 CG MET A -1 122.666 -11.630 -4.130 1.00 5.34 C ATOM 7 SD MET A -1 124.027 -11.438 -5.307 1.00 6.18 S ATOM 8 CE MET A -1 123.510 -12.730 -6.463 1.00 6.75 C ATOM 0 H1 MET A -1 120.147 -11.398 -3.164 1.00 4.63 H new ATOM 0 H2 MET A -1 119.691 -10.452 -1.830 1.00 4.63 H new ATOM 0 H3 MET A -1 120.442 -9.726 -3.168 1.00 4.63 H new ATOM 0 HA MET A -1 121.839 -11.825 -1.559 1.00 3.90 H new ATOM 0 HB2 MET A -1 122.565 -9.562 -3.510 1.00 4.53 H new ATOM 0 HB3 MET A -1 123.764 -10.504 -2.647 1.00 4.53 H new ATOM 0 HG2 MET A -1 122.711 -12.614 -3.663 1.00 5.34 H new ATOM 0 HG3 MET A -1 121.710 -11.567 -4.650 1.00 5.34 H new ATOM 0 HE1 MET A -1 124.222 -12.788 -7.286 1.00 6.75 H new ATOM 0 HE2 MET A -1 123.475 -13.689 -5.945 1.00 6.75 H new ATOM 0 HE3 MET A -1 122.521 -12.493 -6.855 1.00 6.75 H new ATOM 20 N GLY A 0 121.977 -8.570 -1.050 1.00 2.52 N ATOM 21 CA GLY A 0 122.177 -7.568 0.039 1.00 2.00 C ATOM 22 C GLY A 0 122.675 -6.252 -0.562 1.00 1.49 C ATOM 23 O GLY A 0 123.644 -6.227 -1.298 1.00 1.77 O ATOM 0 H GLY A 0 121.867 -8.174 -1.983 1.00 2.52 H new ATOM 0 HA2 GLY A 0 121.241 -7.405 0.573 1.00 2.00 H new ATOM 0 HA3 GLY A 0 122.898 -7.944 0.765 1.00 2.00 H new ATOM 27 N MET A 1 122.016 -5.161 -0.252 1.00 1.21 N ATOM 28 CA MET A 1 122.435 -3.837 -0.807 1.00 0.86 C ATOM 29 C MET A 1 122.564 -2.807 0.319 1.00 0.75 C ATOM 30 O MET A 1 122.064 -3.006 1.411 1.00 0.80 O ATOM 31 CB MET A 1 121.317 -3.439 -1.771 1.00 1.12 C ATOM 32 CG MET A 1 121.304 -4.394 -2.966 1.00 1.69 C ATOM 33 SD MET A 1 120.114 -3.808 -4.198 1.00 2.41 S ATOM 34 CE MET A 1 118.632 -3.938 -3.167 1.00 2.50 C ATOM 0 H MET A 1 121.203 -5.132 0.364 1.00 1.21 H new ATOM 0 HA MET A 1 123.404 -3.887 -1.304 1.00 0.86 H new ATOM 0 HB2 MET A 1 120.355 -3.468 -1.259 1.00 1.12 H new ATOM 0 HB3 MET A 1 121.466 -2.415 -2.113 1.00 1.12 H new ATOM 0 HG2 MET A 1 122.299 -4.455 -3.407 1.00 1.69 H new ATOM 0 HG3 MET A 1 121.039 -5.399 -2.638 1.00 1.69 H new ATOM 0 HE1 MET A 1 117.801 -4.304 -3.770 1.00 2.50 H new ATOM 0 HE2 MET A 1 118.819 -4.632 -2.347 1.00 2.50 H new ATOM 0 HE3 MET A 1 118.383 -2.957 -2.762 1.00 2.50 H new ATOM 44 N SER A 2 123.231 -1.710 0.056 1.00 0.64 N ATOM 45 CA SER A 2 123.390 -0.649 1.098 1.00 0.57 C ATOM 46 C SER A 2 122.302 0.415 0.933 1.00 0.49 C ATOM 47 O SER A 2 121.530 0.381 -0.007 1.00 0.49 O ATOM 48 CB SER A 2 124.772 -0.047 0.847 1.00 0.54 C ATOM 49 OG SER A 2 125.765 -1.037 1.080 1.00 0.64 O ATOM 0 H SER A 2 123.674 -1.503 -0.839 1.00 0.64 H new ATOM 0 HA SER A 2 123.299 -1.045 2.109 1.00 0.57 H new ATOM 0 HB2 SER A 2 124.841 0.320 -0.177 1.00 0.54 H new ATOM 0 HB3 SER A 2 124.934 0.808 1.503 1.00 0.54 H new ATOM 0 HG SER A 2 126.653 -0.654 0.918 1.00 0.64 H new ATOM 55 N VAL A 3 122.239 1.358 1.842 1.00 0.47 N ATOM 56 CA VAL A 3 121.178 2.418 1.768 1.00 0.45 C ATOM 57 C VAL A 3 121.400 3.310 0.535 1.00 0.33 C ATOM 58 O VAL A 3 120.463 3.872 0.001 1.00 0.31 O ATOM 59 CB VAL A 3 121.314 3.230 3.065 1.00 0.55 C ATOM 60 CG1 VAL A 3 120.273 4.360 3.093 1.00 0.58 C ATOM 61 CG2 VAL A 3 121.086 2.315 4.273 1.00 0.70 C ATOM 0 H VAL A 3 122.876 1.441 2.634 1.00 0.47 H new ATOM 0 HA VAL A 3 120.180 1.990 1.670 1.00 0.45 H new ATOM 0 HB VAL A 3 122.316 3.657 3.106 1.00 0.55 H new ATOM 0 HG11 VAL A 3 120.378 4.929 4.017 1.00 0.58 H new ATOM 0 HG12 VAL A 3 120.430 5.020 2.240 1.00 0.58 H new ATOM 0 HG13 VAL A 3 119.271 3.933 3.042 1.00 0.58 H new ATOM 0 HG21 VAL A 3 121.183 2.894 5.191 1.00 0.70 H new ATOM 0 HG22 VAL A 3 120.086 1.884 4.220 1.00 0.70 H new ATOM 0 HG23 VAL A 3 121.826 1.515 4.268 1.00 0.70 H new ATOM 71 N ALA A 4 122.630 3.446 0.086 1.00 0.30 N ATOM 72 CA ALA A 4 122.920 4.335 -1.092 1.00 0.32 C ATOM 73 C ALA A 4 122.061 3.928 -2.297 1.00 0.33 C ATOM 74 O ALA A 4 121.691 4.751 -3.114 1.00 0.40 O ATOM 75 CB ALA A 4 124.404 4.123 -1.405 1.00 0.37 C ATOM 0 H ALA A 4 123.445 2.980 0.484 1.00 0.30 H new ATOM 0 HA ALA A 4 122.693 5.379 -0.876 1.00 0.32 H new ATOM 0 HB1 ALA A 4 124.688 4.742 -2.256 1.00 0.37 H new ATOM 0 HB2 ALA A 4 125.002 4.402 -0.538 1.00 0.37 H new ATOM 0 HB3 ALA A 4 124.579 3.074 -1.644 1.00 0.37 H new ATOM 81 N ASP A 5 121.747 2.661 -2.402 1.00 0.35 N ATOM 82 CA ASP A 5 120.819 2.195 -3.482 1.00 0.44 C ATOM 83 C ASP A 5 119.396 2.705 -3.218 1.00 0.38 C ATOM 84 O ASP A 5 118.636 2.945 -4.139 1.00 0.41 O ATOM 85 CB ASP A 5 120.857 0.665 -3.425 1.00 0.55 C ATOM 86 CG ASP A 5 122.250 0.170 -3.817 1.00 0.63 C ATOM 87 OD1 ASP A 5 123.079 0.032 -2.933 1.00 0.98 O ATOM 88 OD2 ASP A 5 122.464 -0.062 -4.996 1.00 1.17 O ATOM 0 H ASP A 5 122.094 1.926 -1.785 1.00 0.35 H new ATOM 0 HA ASP A 5 121.117 2.569 -4.461 1.00 0.44 H new ATOM 0 HB2 ASP A 5 120.608 0.322 -2.421 1.00 0.55 H new ATOM 0 HB3 ASP A 5 120.109 0.247 -4.099 1.00 0.55 H new ATOM 93 N PHE A 6 119.036 2.872 -1.967 1.00 0.33 N ATOM 94 CA PHE A 6 117.650 3.321 -1.624 1.00 0.30 C ATOM 95 C PHE A 6 117.584 4.846 -1.420 1.00 0.23 C ATOM 96 O PHE A 6 116.583 5.362 -0.957 1.00 0.26 O ATOM 97 CB PHE A 6 117.308 2.592 -0.325 1.00 0.37 C ATOM 98 CG PHE A 6 117.166 1.098 -0.494 1.00 0.46 C ATOM 99 CD1 PHE A 6 118.299 0.260 -0.363 1.00 0.53 C ATOM 100 CD2 PHE A 6 115.899 0.534 -0.786 1.00 0.50 C ATOM 101 CE1 PHE A 6 118.168 -1.141 -0.522 1.00 0.63 C ATOM 102 CE2 PHE A 6 115.767 -0.867 -0.946 1.00 0.60 C ATOM 103 CZ PHE A 6 116.901 -1.704 -0.813 1.00 0.66 C ATOM 0 H PHE A 6 119.647 2.715 -1.165 1.00 0.33 H new ATOM 0 HA PHE A 6 116.948 3.094 -2.426 1.00 0.30 H new ATOM 0 HB2 PHE A 6 118.085 2.794 0.412 1.00 0.37 H new ATOM 0 HB3 PHE A 6 116.377 2.995 0.075 1.00 0.37 H new ATOM 0 HD1 PHE A 6 119.265 0.690 -0.141 1.00 0.53 H new ATOM 0 HD2 PHE A 6 115.034 1.173 -0.887 1.00 0.50 H new ATOM 0 HE1 PHE A 6 119.033 -1.780 -0.422 1.00 0.63 H new ATOM 0 HE2 PHE A 6 114.802 -1.297 -1.169 1.00 0.60 H new ATOM 0 HZ PHE A 6 116.800 -2.773 -0.933 1.00 0.66 H new ATOM 113 N TYR A 7 118.633 5.570 -1.754 1.00 0.21 N ATOM 114 CA TYR A 7 118.562 7.069 -1.694 1.00 0.23 C ATOM 115 C TYR A 7 117.584 7.590 -2.755 1.00 0.23 C ATOM 116 O TYR A 7 117.590 7.144 -3.888 1.00 0.25 O ATOM 117 CB TYR A 7 119.987 7.553 -2.015 1.00 0.30 C ATOM 118 CG TYR A 7 120.901 7.703 -0.808 1.00 0.63 C ATOM 119 CD1 TYR A 7 120.654 6.983 0.390 1.00 1.35 C ATOM 120 CD2 TYR A 7 122.023 8.566 -0.889 1.00 1.16 C ATOM 121 CE1 TYR A 7 121.528 7.127 1.496 1.00 1.83 C ATOM 122 CE2 TYR A 7 122.892 8.710 0.217 1.00 1.65 C ATOM 123 CZ TYR A 7 122.647 7.991 1.408 1.00 1.83 C ATOM 124 OH TYR A 7 123.502 8.129 2.481 1.00 2.41 O ATOM 0 H TYR A 7 119.528 5.190 -2.063 1.00 0.21 H new ATOM 0 HA TYR A 7 118.215 7.424 -0.724 1.00 0.23 H new ATOM 0 HB2 TYR A 7 120.444 6.852 -2.713 1.00 0.30 H new ATOM 0 HB3 TYR A 7 119.922 8.514 -2.525 1.00 0.30 H new ATOM 0 HD1 TYR A 7 119.800 6.325 0.459 1.00 1.35 H new ATOM 0 HD2 TYR A 7 122.215 9.115 -1.799 1.00 1.16 H new ATOM 0 HE1 TYR A 7 121.341 6.578 2.407 1.00 1.83 H new ATOM 0 HE2 TYR A 7 123.744 9.370 0.151 1.00 1.65 H new ATOM 0 HH TYR A 7 124.216 8.759 2.251 1.00 2.41 H new ATOM 134 N GLY A 8 116.749 8.532 -2.389 1.00 0.21 N ATOM 135 CA GLY A 8 115.698 9.030 -3.333 1.00 0.22 C ATOM 136 C GLY A 8 114.466 8.106 -3.308 1.00 0.23 C ATOM 137 O GLY A 8 113.497 8.356 -4.001 1.00 0.26 O ATOM 0 H GLY A 8 116.750 8.980 -1.473 1.00 0.21 H new ATOM 0 HA2 GLY A 8 115.405 10.043 -3.058 1.00 0.22 H new ATOM 0 HA3 GLY A 8 116.103 9.078 -4.344 1.00 0.22 H new ATOM 141 N SER A 9 114.490 7.047 -2.525 1.00 0.23 N ATOM 142 CA SER A 9 113.299 6.142 -2.444 1.00 0.25 C ATOM 143 C SER A 9 112.209 6.769 -1.570 1.00 0.23 C ATOM 144 O SER A 9 112.481 7.284 -0.501 1.00 0.22 O ATOM 145 CB SER A 9 113.817 4.855 -1.799 1.00 0.27 C ATOM 146 OG SER A 9 112.780 3.883 -1.795 1.00 1.30 O ATOM 0 H SER A 9 115.281 6.774 -1.942 1.00 0.23 H new ATOM 0 HA SER A 9 112.858 5.962 -3.424 1.00 0.25 H new ATOM 0 HB2 SER A 9 114.680 4.481 -2.349 1.00 0.27 H new ATOM 0 HB3 SER A 9 114.150 5.053 -0.780 1.00 0.27 H new ATOM 0 HG SER A 9 113.108 3.056 -1.384 1.00 1.30 H new ATOM 152 N ASN A 10 110.978 6.728 -2.020 1.00 0.24 N ATOM 153 CA ASN A 10 109.840 7.182 -1.160 1.00 0.25 C ATOM 154 C ASN A 10 109.412 6.046 -0.235 1.00 0.24 C ATOM 155 O ASN A 10 109.017 4.985 -0.683 1.00 0.25 O ATOM 156 CB ASN A 10 108.710 7.533 -2.131 1.00 0.29 C ATOM 157 CG ASN A 10 107.759 8.537 -1.473 1.00 1.06 C ATOM 158 OD1 ASN A 10 107.521 8.477 -0.282 1.00 2.09 O ATOM 159 ND2 ASN A 10 107.203 9.463 -2.204 1.00 1.24 N ATOM 0 H ASN A 10 110.712 6.399 -2.948 1.00 0.24 H new ATOM 0 HA ASN A 10 110.109 8.033 -0.533 1.00 0.25 H new ATOM 0 HB2 ASN A 10 109.123 7.955 -3.047 1.00 0.29 H new ATOM 0 HB3 ASN A 10 108.165 6.632 -2.412 1.00 0.29 H new ATOM 0 HD21 ASN A 10 106.568 10.137 -1.777 1.00 1.24 H new ATOM 0 HD22 ASN A 10 107.403 9.513 -3.203 1.00 1.24 H new ATOM 166 N VAL A 11 109.487 6.265 1.051 1.00 0.22 N ATOM 167 CA VAL A 11 109.110 5.195 2.022 1.00 0.22 C ATOM 168 C VAL A 11 108.403 5.817 3.226 1.00 0.22 C ATOM 169 O VAL A 11 108.485 7.011 3.452 1.00 0.24 O ATOM 170 CB VAL A 11 110.428 4.519 2.441 1.00 0.21 C ATOM 171 CG1 VAL A 11 111.090 3.874 1.218 1.00 0.21 C ATOM 172 CG2 VAL A 11 111.390 5.552 3.049 1.00 0.21 C ATOM 0 H VAL A 11 109.794 7.142 1.473 1.00 0.22 H new ATOM 0 HA VAL A 11 108.424 4.468 1.587 1.00 0.22 H new ATOM 0 HB VAL A 11 110.205 3.756 3.187 1.00 0.21 H new ATOM 0 HG11 VAL A 11 112.023 3.397 1.519 1.00 0.21 H new ATOM 0 HG12 VAL A 11 110.420 3.126 0.794 1.00 0.21 H new ATOM 0 HG13 VAL A 11 111.299 4.640 0.471 1.00 0.21 H new ATOM 0 HG21 VAL A 11 112.317 5.058 3.340 1.00 0.21 H new ATOM 0 HG22 VAL A 11 111.607 6.325 2.312 1.00 0.21 H new ATOM 0 HG23 VAL A 11 110.929 6.006 3.927 1.00 0.21 H new ATOM 182 N GLU A 12 107.710 5.018 3.997 1.00 0.22 N ATOM 183 CA GLU A 12 107.050 5.548 5.225 1.00 0.23 C ATOM 184 C GLU A 12 107.774 5.017 6.465 1.00 0.21 C ATOM 185 O GLU A 12 108.291 3.916 6.465 1.00 0.24 O ATOM 186 CB GLU A 12 105.614 5.014 5.162 1.00 0.26 C ATOM 187 CG GLU A 12 104.807 5.530 6.360 1.00 0.29 C ATOM 188 CD GLU A 12 103.419 4.883 6.364 1.00 0.36 C ATOM 189 OE1 GLU A 12 102.846 4.742 5.296 1.00 0.78 O ATOM 190 OE2 GLU A 12 102.953 4.538 7.437 1.00 1.06 O ATOM 0 H GLU A 12 107.574 4.021 3.828 1.00 0.22 H new ATOM 0 HA GLU A 12 107.072 6.636 5.281 1.00 0.23 H new ATOM 0 HB2 GLU A 12 105.141 5.329 4.232 1.00 0.26 H new ATOM 0 HB3 GLU A 12 105.623 3.924 5.162 1.00 0.26 H new ATOM 0 HG2 GLU A 12 105.329 5.300 7.289 1.00 0.29 H new ATOM 0 HG3 GLU A 12 104.713 6.615 6.308 1.00 0.29 H new ATOM 197 N VAL A 13 107.817 5.795 7.515 1.00 0.26 N ATOM 198 CA VAL A 13 108.614 5.399 8.716 1.00 0.24 C ATOM 199 C VAL A 13 107.805 5.673 9.987 1.00 0.21 C ATOM 200 O VAL A 13 107.347 6.777 10.216 1.00 0.21 O ATOM 201 CB VAL A 13 109.881 6.271 8.672 1.00 0.24 C ATOM 202 CG1 VAL A 13 110.789 5.934 9.864 1.00 0.23 C ATOM 203 CG2 VAL A 13 110.644 6.015 7.363 1.00 0.28 C ATOM 0 H VAL A 13 107.334 6.690 7.594 1.00 0.26 H new ATOM 0 HA VAL A 13 108.864 4.338 8.718 1.00 0.24 H new ATOM 0 HB VAL A 13 109.590 7.320 8.724 1.00 0.24 H new ATOM 0 HG11 VAL A 13 111.684 6.555 9.827 1.00 0.23 H new ATOM 0 HG12 VAL A 13 110.254 6.124 10.794 1.00 0.23 H new ATOM 0 HG13 VAL A 13 111.074 4.883 9.818 1.00 0.23 H new ATOM 0 HG21 VAL A 13 111.540 6.635 7.337 1.00 0.28 H new ATOM 0 HG22 VAL A 13 110.928 4.964 7.307 1.00 0.28 H new ATOM 0 HG23 VAL A 13 110.006 6.264 6.515 1.00 0.28 H new ATOM 213 N LEU A 14 107.630 4.667 10.810 1.00 0.22 N ATOM 214 CA LEU A 14 106.951 4.877 12.123 1.00 0.21 C ATOM 215 C LEU A 14 108.009 5.083 13.211 1.00 0.20 C ATOM 216 O LEU A 14 108.919 4.288 13.359 1.00 0.20 O ATOM 217 CB LEU A 14 106.157 3.587 12.369 1.00 0.25 C ATOM 218 CG LEU A 14 105.360 3.703 13.674 1.00 0.28 C ATOM 219 CD1 LEU A 14 104.158 4.624 13.464 1.00 0.30 C ATOM 220 CD2 LEU A 14 104.869 2.315 14.093 1.00 0.34 C ATOM 0 H LEU A 14 107.929 3.709 10.627 1.00 0.22 H new ATOM 0 HA LEU A 14 106.302 5.752 12.132 1.00 0.21 H new ATOM 0 HB2 LEU A 14 105.480 3.402 11.535 1.00 0.25 H new ATOM 0 HB3 LEU A 14 106.837 2.736 12.423 1.00 0.25 H new ATOM 0 HG LEU A 14 106.000 4.117 14.453 1.00 0.28 H new ATOM 0 HD11 LEU A 14 103.594 4.704 14.393 1.00 0.30 H new ATOM 0 HD12 LEU A 14 104.505 5.613 13.164 1.00 0.30 H new ATOM 0 HD13 LEU A 14 103.516 4.213 12.685 1.00 0.30 H new ATOM 0 HD21 LEU A 14 104.302 2.394 15.021 1.00 0.34 H new ATOM 0 HD22 LEU A 14 104.230 1.904 13.311 1.00 0.34 H new ATOM 0 HD23 LEU A 14 105.725 1.657 14.246 1.00 0.34 H new ATOM 232 N LEU A 15 107.891 6.142 13.972 1.00 0.21 N ATOM 233 CA LEU A 15 108.958 6.480 14.964 1.00 0.22 C ATOM 234 C LEU A 15 108.641 5.874 16.335 1.00 0.23 C ATOM 235 O LEU A 15 107.568 5.343 16.558 1.00 0.24 O ATOM 236 CB LEU A 15 108.967 8.009 15.039 1.00 0.24 C ATOM 237 CG LEU A 15 109.421 8.591 13.697 1.00 0.25 C ATOM 238 CD1 LEU A 15 109.170 10.099 13.684 1.00 0.28 C ATOM 239 CD2 LEU A 15 110.916 8.324 13.505 1.00 0.25 C ATOM 0 H LEU A 15 107.102 6.788 13.949 1.00 0.21 H new ATOM 0 HA LEU A 15 109.927 6.080 14.667 1.00 0.22 H new ATOM 0 HB2 LEU A 15 107.971 8.376 15.287 1.00 0.24 H new ATOM 0 HB3 LEU A 15 109.635 8.339 15.834 1.00 0.24 H new ATOM 0 HG LEU A 15 108.860 8.121 12.889 1.00 0.25 H new ATOM 0 HD11 LEU A 15 109.493 10.513 12.729 1.00 0.28 H new ATOM 0 HD12 LEU A 15 108.106 10.292 13.822 1.00 0.28 H new ATOM 0 HD13 LEU A 15 109.732 10.568 14.492 1.00 0.28 H new ATOM 0 HD21 LEU A 15 111.240 8.738 12.550 1.00 0.25 H new ATOM 0 HD22 LEU A 15 111.476 8.794 14.313 1.00 0.25 H new ATOM 0 HD23 LEU A 15 111.098 7.249 13.515 1.00 0.25 H new ATOM 251 N ASN A 16 109.577 5.955 17.255 1.00 0.24 N ATOM 252 CA ASN A 16 109.383 5.348 18.618 1.00 0.27 C ATOM 253 C ASN A 16 108.126 5.903 19.309 1.00 0.28 C ATOM 254 O ASN A 16 107.575 5.279 20.198 1.00 0.31 O ATOM 255 CB ASN A 16 110.645 5.722 19.418 1.00 0.29 C ATOM 256 CG ASN A 16 110.807 7.249 19.483 1.00 0.30 C ATOM 257 OD1 ASN A 16 109.942 7.943 19.977 1.00 0.36 O ATOM 258 ND2 ASN A 16 111.888 7.798 19.001 1.00 0.34 N ATOM 0 H ASN A 16 110.475 6.419 17.120 1.00 0.24 H new ATOM 0 HA ASN A 16 109.243 4.269 18.551 1.00 0.27 H new ATOM 0 HB2 ASN A 16 110.578 5.314 20.427 1.00 0.29 H new ATOM 0 HB3 ASN A 16 111.524 5.276 18.952 1.00 0.29 H new ATOM 0 HD21 ASN A 16 112.006 8.810 19.039 1.00 0.34 H new ATOM 0 HD22 ASN A 16 112.615 7.215 18.586 1.00 0.34 H new ATOM 265 N ASN A 17 107.675 7.066 18.904 1.00 0.29 N ATOM 266 CA ASN A 17 106.481 7.690 19.560 1.00 0.33 C ATOM 267 C ASN A 17 105.187 7.315 18.813 1.00 0.33 C ATOM 268 O ASN A 17 104.196 8.015 18.900 1.00 0.36 O ATOM 269 CB ASN A 17 106.734 9.207 19.502 1.00 0.35 C ATOM 270 CG ASN A 17 106.804 9.699 18.046 1.00 0.34 C ATOM 271 OD1 ASN A 17 106.759 8.915 17.118 1.00 0.51 O ATOM 272 ND2 ASN A 17 106.913 10.977 17.810 1.00 0.72 N ATOM 0 H ASN A 17 108.083 7.612 18.145 1.00 0.29 H new ATOM 0 HA ASN A 17 106.352 7.342 20.585 1.00 0.33 H new ATOM 0 HB2 ASN A 17 105.938 9.732 20.029 1.00 0.35 H new ATOM 0 HB3 ASN A 17 107.666 9.444 20.015 1.00 0.35 H new ATOM 0 HD21 ASN A 17 106.960 11.316 16.849 1.00 0.72 H new ATOM 0 HD22 ASN A 17 106.951 11.638 18.586 1.00 0.72 H new ATOM 279 N ASP A 18 105.194 6.218 18.075 1.00 0.31 N ATOM 280 CA ASP A 18 103.951 5.732 17.378 1.00 0.33 C ATOM 281 C ASP A 18 103.416 6.803 16.415 1.00 0.31 C ATOM 282 O ASP A 18 102.230 6.862 16.144 1.00 0.35 O ATOM 283 CB ASP A 18 102.923 5.436 18.482 1.00 0.39 C ATOM 284 CG ASP A 18 103.442 4.313 19.384 1.00 0.43 C ATOM 285 OD1 ASP A 18 103.991 3.359 18.857 1.00 0.67 O ATOM 286 OD2 ASP A 18 103.281 4.425 20.588 1.00 1.00 O ATOM 0 H ASP A 18 106.018 5.635 17.926 1.00 0.31 H new ATOM 0 HA ASP A 18 104.157 4.843 16.782 1.00 0.33 H new ATOM 0 HB2 ASP A 18 102.740 6.334 19.072 1.00 0.39 H new ATOM 0 HB3 ASP A 18 101.971 5.147 18.037 1.00 0.39 H new ATOM 291 N SER A 19 104.282 7.648 15.899 1.00 0.27 N ATOM 292 CA SER A 19 103.858 8.612 14.841 1.00 0.27 C ATOM 293 C SER A 19 104.401 8.160 13.484 1.00 0.24 C ATOM 294 O SER A 19 105.472 7.588 13.399 1.00 0.30 O ATOM 295 CB SER A 19 104.477 9.948 15.250 1.00 0.29 C ATOM 296 OG SER A 19 104.002 10.311 16.540 1.00 0.32 O ATOM 0 H SER A 19 105.264 7.708 16.168 1.00 0.27 H new ATOM 0 HA SER A 19 102.774 8.682 14.748 1.00 0.27 H new ATOM 0 HB2 SER A 19 105.564 9.871 15.259 1.00 0.29 H new ATOM 0 HB3 SER A 19 104.218 10.719 14.524 1.00 0.29 H new ATOM 0 HG SER A 19 104.399 11.167 16.806 1.00 0.32 H new ATOM 302 N LYS A 20 103.672 8.412 12.425 1.00 0.25 N ATOM 303 CA LYS A 20 104.105 7.933 11.077 1.00 0.25 C ATOM 304 C LYS A 20 104.547 9.109 10.204 1.00 0.27 C ATOM 305 O LYS A 20 104.002 10.195 10.291 1.00 0.38 O ATOM 306 CB LYS A 20 102.860 7.275 10.479 1.00 0.37 C ATOM 307 CG LYS A 20 102.561 5.971 11.219 1.00 0.89 C ATOM 308 CD LYS A 20 101.326 5.307 10.606 1.00 0.92 C ATOM 309 CE LYS A 20 100.959 4.063 11.418 1.00 1.08 C ATOM 310 NZ LYS A 20 99.496 3.882 11.203 1.00 1.63 N ATOM 0 H LYS A 20 102.794 8.930 12.437 1.00 0.25 H new ATOM 0 HA LYS A 20 104.951 7.248 11.139 1.00 0.25 H new ATOM 0 HB2 LYS A 20 102.008 7.951 10.554 1.00 0.37 H new ATOM 0 HB3 LYS A 20 103.016 7.075 9.419 1.00 0.37 H new ATOM 0 HG2 LYS A 20 103.417 5.300 11.155 1.00 0.89 H new ATOM 0 HG3 LYS A 20 102.392 6.172 12.277 1.00 0.89 H new ATOM 0 HD2 LYS A 20 100.491 6.007 10.596 1.00 0.92 H new ATOM 0 HD3 LYS A 20 101.524 5.033 9.570 1.00 0.92 H new ATOM 0 HE2 LYS A 20 101.519 3.191 11.080 1.00 1.08 H new ATOM 0 HE3 LYS A 20 101.189 4.199 12.475 1.00 1.08 H new ATOM 0 HZ1 LYS A 20 99.169 3.047 11.729 1.00 1.63 H new ATOM 0 HZ2 LYS A 20 98.989 4.725 11.541 1.00 1.63 H new ATOM 0 HZ3 LYS A 20 99.308 3.748 10.189 1.00 1.63 H new ATOM 324 N ALA A 21 105.530 8.895 9.365 1.00 0.24 N ATOM 325 CA ALA A 21 105.972 9.972 8.426 1.00 0.31 C ATOM 326 C ALA A 21 106.596 9.357 7.169 1.00 0.28 C ATOM 327 O ALA A 21 107.439 8.484 7.252 1.00 0.35 O ATOM 328 CB ALA A 21 107.014 10.776 9.205 1.00 0.38 C ATOM 0 H ALA A 21 106.047 8.019 9.290 1.00 0.24 H new ATOM 0 HA ALA A 21 105.142 10.596 8.094 1.00 0.31 H new ATOM 0 HB1 ALA A 21 107.388 11.588 8.581 1.00 0.38 H new ATOM 0 HB2 ALA A 21 106.557 11.190 10.104 1.00 0.38 H new ATOM 0 HB3 ALA A 21 107.841 10.124 9.486 1.00 0.38 H new ATOM 334 N ARG A 22 106.185 9.810 6.007 1.00 0.29 N ATOM 335 CA ARG A 22 106.718 9.229 4.734 1.00 0.28 C ATOM 336 C ARG A 22 107.278 10.333 3.837 1.00 0.30 C ATOM 337 O ARG A 22 106.753 11.429 3.795 1.00 0.38 O ATOM 338 CB ARG A 22 105.519 8.533 4.064 1.00 0.33 C ATOM 339 CG ARG A 22 104.399 9.545 3.780 1.00 0.39 C ATOM 340 CD ARG A 22 103.235 8.839 3.075 1.00 0.46 C ATOM 341 NE ARG A 22 102.489 8.119 4.159 1.00 1.03 N ATOM 342 CZ ARG A 22 101.610 7.177 3.879 1.00 1.50 C ATOM 343 NH1 ARG A 22 101.350 6.823 2.640 1.00 2.17 N ATOM 344 NH2 ARG A 22 100.982 6.583 4.855 1.00 1.74 N ATOM 0 H ARG A 22 105.502 10.558 5.886 1.00 0.29 H new ATOM 0 HA ARG A 22 107.534 8.530 4.916 1.00 0.28 H new ATOM 0 HB2 ARG A 22 105.837 8.063 3.133 1.00 0.33 H new ATOM 0 HB3 ARG A 22 105.144 7.739 4.710 1.00 0.33 H new ATOM 0 HG2 ARG A 22 104.055 9.993 4.712 1.00 0.39 H new ATOM 0 HG3 ARG A 22 104.777 10.356 3.157 1.00 0.39 H new ATOM 0 HD2 ARG A 22 102.592 9.556 2.565 1.00 0.46 H new ATOM 0 HD3 ARG A 22 103.598 8.143 2.319 1.00 0.46 H new ATOM 0 HE ARG A 22 102.665 8.363 5.133 1.00 1.03 H new ATOM 0 HH11 ARG A 22 101.833 7.280 1.867 1.00 2.17 H new ATOM 0 HH12 ARG A 22 100.665 6.091 2.452 1.00 2.17 H new ATOM 0 HH21 ARG A 22 101.173 6.849 5.821 1.00 1.74 H new ATOM 0 HH22 ARG A 22 100.299 5.853 4.653 1.00 1.74 H new ATOM 358 N GLY A 23 108.339 10.045 3.124 1.00 0.25 N ATOM 359 CA GLY A 23 108.997 11.097 2.289 1.00 0.25 C ATOM 360 C GLY A 23 110.071 10.446 1.414 1.00 0.21 C ATOM 361 O GLY A 23 110.386 9.282 1.577 1.00 0.21 O ATOM 0 H GLY A 23 108.778 9.125 3.084 1.00 0.25 H new ATOM 0 HA2 GLY A 23 108.257 11.598 1.665 1.00 0.25 H new ATOM 0 HA3 GLY A 23 109.444 11.859 2.928 1.00 0.25 H new ATOM 365 N VAL A 24 110.635 11.188 0.490 1.00 0.21 N ATOM 366 CA VAL A 24 111.644 10.593 -0.444 1.00 0.22 C ATOM 367 C VAL A 24 113.051 10.839 0.105 1.00 0.22 C ATOM 368 O VAL A 24 113.466 11.967 0.284 1.00 0.19 O ATOM 369 CB VAL A 24 111.448 11.328 -1.782 1.00 0.22 C ATOM 370 CG1 VAL A 24 112.385 10.740 -2.844 1.00 0.23 C ATOM 371 CG2 VAL A 24 109.999 11.169 -2.258 1.00 0.24 C ATOM 0 H VAL A 24 110.441 12.178 0.342 1.00 0.21 H new ATOM 0 HA VAL A 24 111.521 9.516 -0.561 1.00 0.22 H new ATOM 0 HB VAL A 24 111.674 12.384 -1.636 1.00 0.22 H new ATOM 0 HG11 VAL A 24 112.240 11.265 -3.788 1.00 0.23 H new ATOM 0 HG12 VAL A 24 113.419 10.854 -2.520 1.00 0.23 H new ATOM 0 HG13 VAL A 24 112.162 9.682 -2.980 1.00 0.23 H new ATOM 0 HG21 VAL A 24 109.868 11.692 -3.205 1.00 0.24 H new ATOM 0 HG22 VAL A 24 109.774 10.111 -2.393 1.00 0.24 H new ATOM 0 HG23 VAL A 24 109.323 11.591 -1.514 1.00 0.24 H new ATOM 381 N ILE A 25 113.784 9.787 0.370 1.00 0.27 N ATOM 382 CA ILE A 25 115.096 9.933 1.086 1.00 0.27 C ATOM 383 C ILE A 25 116.087 10.740 0.235 1.00 0.29 C ATOM 384 O ILE A 25 116.106 10.638 -0.975 1.00 0.35 O ATOM 385 CB ILE A 25 115.600 8.494 1.306 1.00 0.36 C ATOM 386 CG1 ILE A 25 114.622 7.743 2.218 1.00 0.39 C ATOM 387 CG2 ILE A 25 116.988 8.508 1.961 1.00 0.48 C ATOM 388 CD1 ILE A 25 114.927 6.245 2.173 1.00 0.44 C ATOM 0 H ILE A 25 113.533 8.830 0.122 1.00 0.27 H new ATOM 0 HA ILE A 25 114.991 10.470 2.029 1.00 0.27 H new ATOM 0 HB ILE A 25 115.667 7.995 0.339 1.00 0.36 H new ATOM 0 HG12 ILE A 25 114.706 8.111 3.240 1.00 0.39 H new ATOM 0 HG13 ILE A 25 113.596 7.926 1.897 1.00 0.39 H new ATOM 0 HG21 ILE A 25 117.330 7.484 2.110 1.00 0.48 H new ATOM 0 HG22 ILE A 25 117.690 9.035 1.315 1.00 0.48 H new ATOM 0 HG23 ILE A 25 116.931 9.015 2.924 1.00 0.48 H new ATOM 0 HD11 ILE A 25 114.231 5.712 2.822 1.00 0.44 H new ATOM 0 HD12 ILE A 25 114.820 5.882 1.151 1.00 0.44 H new ATOM 0 HD13 ILE A 25 115.947 6.071 2.515 1.00 0.44 H new ATOM 400 N THR A 26 116.903 11.543 0.874 1.00 0.27 N ATOM 401 CA THR A 26 117.927 12.334 0.129 1.00 0.36 C ATOM 402 C THR A 26 119.343 12.008 0.620 1.00 0.44 C ATOM 403 O THR A 26 120.294 12.135 -0.130 1.00 0.60 O ATOM 404 CB THR A 26 117.586 13.799 0.402 1.00 0.34 C ATOM 405 OG1 THR A 26 117.377 13.986 1.793 1.00 0.28 O ATOM 406 CG2 THR A 26 116.319 14.186 -0.363 1.00 0.31 C ATOM 0 H THR A 26 116.902 11.684 1.884 1.00 0.27 H new ATOM 0 HA THR A 26 117.912 12.103 -0.936 1.00 0.36 H new ATOM 0 HB THR A 26 118.412 14.429 0.071 1.00 0.34 H new ATOM 0 HG1 THR A 26 116.733 14.712 1.932 1.00 0.28 H new ATOM 0 HG21 THR A 26 116.080 15.231 -0.166 1.00 0.31 H new ATOM 0 HG22 THR A 26 116.482 14.047 -1.432 1.00 0.31 H new ATOM 0 HG23 THR A 26 115.491 13.556 -0.038 1.00 0.31 H new ATOM 414 N ASN A 27 119.507 11.590 1.864 1.00 0.34 N ATOM 415 CA ASN A 27 120.893 11.294 2.354 1.00 0.37 C ATOM 416 C ASN A 27 120.878 10.411 3.607 1.00 0.31 C ATOM 417 O ASN A 27 119.885 10.302 4.297 1.00 0.25 O ATOM 418 CB ASN A 27 121.501 12.663 2.676 1.00 0.38 C ATOM 419 CG ASN A 27 123.016 12.616 2.461 1.00 0.46 C ATOM 420 OD1 ASN A 27 123.778 12.690 3.405 1.00 1.00 O ATOM 421 ND2 ASN A 27 123.487 12.497 1.249 1.00 1.09 N ATOM 0 H ASN A 27 118.758 11.446 2.541 1.00 0.34 H new ATOM 0 HA ASN A 27 121.466 10.745 1.607 1.00 0.37 H new ATOM 0 HB2 ASN A 27 121.057 13.428 2.039 1.00 0.38 H new ATOM 0 HB3 ASN A 27 121.278 12.938 3.707 1.00 0.38 H new ATOM 0 HD21 ASN A 27 124.495 12.466 1.094 1.00 1.09 H new ATOM 0 HD22 ASN A 27 122.847 12.435 0.457 1.00 1.09 H new ATOM 428 N PHE A 28 121.995 9.780 3.886 1.00 0.35 N ATOM 429 CA PHE A 28 122.185 9.062 5.187 1.00 0.32 C ATOM 430 C PHE A 28 123.670 9.085 5.561 1.00 0.34 C ATOM 431 O PHE A 28 124.520 8.699 4.780 1.00 0.40 O ATOM 432 CB PHE A 28 121.705 7.626 4.946 1.00 0.43 C ATOM 433 CG PHE A 28 121.909 6.709 6.133 1.00 0.46 C ATOM 434 CD1 PHE A 28 121.089 6.837 7.280 1.00 0.56 C ATOM 435 CD2 PHE A 28 122.926 5.722 6.097 1.00 0.52 C ATOM 436 CE1 PHE A 28 121.286 5.978 8.390 1.00 0.65 C ATOM 437 CE2 PHE A 28 123.121 4.863 7.206 1.00 0.53 C ATOM 438 CZ PHE A 28 122.301 4.992 8.352 1.00 0.57 C ATOM 0 H PHE A 28 122.796 9.732 3.256 1.00 0.35 H new ATOM 0 HA PHE A 28 121.631 9.524 6.004 1.00 0.32 H new ATOM 0 HB2 PHE A 28 120.646 7.645 4.690 1.00 0.43 H new ATOM 0 HB3 PHE A 28 122.233 7.215 4.086 1.00 0.43 H new ATOM 0 HD1 PHE A 28 120.314 7.589 7.309 1.00 0.56 H new ATOM 0 HD2 PHE A 28 123.553 5.625 5.223 1.00 0.52 H new ATOM 0 HE1 PHE A 28 120.661 6.076 9.266 1.00 0.65 H new ATOM 0 HE2 PHE A 28 123.895 4.110 7.177 1.00 0.53 H new ATOM 0 HZ PHE A 28 122.450 4.338 9.198 1.00 0.57 H new ATOM 448 N ASP A 29 123.982 9.534 6.752 1.00 0.30 N ATOM 449 CA ASP A 29 125.409 9.624 7.176 1.00 0.32 C ATOM 450 C ASP A 29 125.747 8.422 8.049 1.00 0.35 C ATOM 451 O ASP A 29 125.042 8.131 8.988 1.00 0.35 O ATOM 452 CB ASP A 29 125.503 10.921 7.982 1.00 0.29 C ATOM 453 CG ASP A 29 126.969 11.223 8.300 1.00 0.33 C ATOM 454 OD1 ASP A 29 127.436 10.773 9.334 1.00 1.07 O ATOM 455 OD2 ASP A 29 127.600 11.899 7.505 1.00 1.15 O ATOM 0 H ASP A 29 123.305 9.843 7.450 1.00 0.30 H new ATOM 0 HA ASP A 29 126.103 9.626 6.336 1.00 0.32 H new ATOM 0 HB2 ASP A 29 125.066 11.744 7.417 1.00 0.29 H new ATOM 0 HB3 ASP A 29 124.932 10.829 8.906 1.00 0.29 H new ATOM 460 N SER A 30 126.812 7.723 7.747 1.00 0.41 N ATOM 461 CA SER A 30 127.134 6.476 8.512 1.00 0.47 C ATOM 462 C SER A 30 127.512 6.810 9.958 1.00 0.44 C ATOM 463 O SER A 30 127.017 6.204 10.890 1.00 0.47 O ATOM 464 CB SER A 30 128.319 5.842 7.782 1.00 0.54 C ATOM 465 OG SER A 30 127.982 5.656 6.414 1.00 1.32 O ATOM 0 H SER A 30 127.472 7.960 7.006 1.00 0.41 H new ATOM 0 HA SER A 30 126.279 5.802 8.558 1.00 0.47 H new ATOM 0 HB2 SER A 30 129.198 6.481 7.868 1.00 0.54 H new ATOM 0 HB3 SER A 30 128.573 4.886 8.239 1.00 0.54 H new ATOM 0 HG SER A 30 128.740 5.251 5.942 1.00 1.32 H new ATOM 471 N SER A 31 128.380 7.775 10.149 1.00 0.42 N ATOM 472 CA SER A 31 128.902 8.067 11.528 1.00 0.43 C ATOM 473 C SER A 31 127.756 8.432 12.481 1.00 0.41 C ATOM 474 O SER A 31 127.695 7.949 13.597 1.00 0.46 O ATOM 475 CB SER A 31 129.849 9.257 11.359 1.00 0.45 C ATOM 476 OG SER A 31 130.828 8.942 10.378 1.00 1.18 O ATOM 0 H SER A 31 128.751 8.374 9.412 1.00 0.42 H new ATOM 0 HA SER A 31 129.404 7.200 11.958 1.00 0.43 H new ATOM 0 HB2 SER A 31 129.289 10.143 11.059 1.00 0.45 H new ATOM 0 HB3 SER A 31 130.331 9.491 12.308 1.00 0.45 H new ATOM 0 HG SER A 31 131.435 9.703 10.266 1.00 1.18 H new ATOM 482 N ASN A 32 126.853 9.275 12.047 1.00 0.36 N ATOM 483 CA ASN A 32 125.727 9.704 12.935 1.00 0.39 C ATOM 484 C ASN A 32 124.405 9.019 12.545 1.00 0.37 C ATOM 485 O ASN A 32 123.414 9.152 13.240 1.00 0.40 O ATOM 486 CB ASN A 32 125.619 11.216 12.730 1.00 0.41 C ATOM 487 CG ASN A 32 126.875 11.902 13.275 1.00 0.51 C ATOM 488 OD1 ASN A 32 127.416 11.493 14.283 1.00 1.34 O ATOM 489 ND2 ASN A 32 127.362 12.937 12.646 1.00 0.98 N ATOM 0 H ASN A 32 126.846 9.686 11.114 1.00 0.36 H new ATOM 0 HA ASN A 32 125.915 9.432 13.974 1.00 0.39 H new ATOM 0 HB2 ASN A 32 125.501 11.441 11.670 1.00 0.41 H new ATOM 0 HB3 ASN A 32 124.734 11.599 13.238 1.00 0.41 H new ATOM 0 HD21 ASN A 32 128.197 13.403 13.001 1.00 0.98 H new ATOM 0 HD22 ASN A 32 126.907 13.280 11.800 1.00 0.98 H new ATOM 496 N SER A 33 124.373 8.287 11.444 1.00 0.35 N ATOM 497 CA SER A 33 123.082 7.694 10.940 1.00 0.37 C ATOM 498 C SER A 33 121.977 8.760 10.880 1.00 0.32 C ATOM 499 O SER A 33 121.007 8.709 11.618 1.00 0.37 O ATOM 500 CB SER A 33 122.729 6.582 11.931 1.00 0.46 C ATOM 501 OG SER A 33 123.844 5.711 12.077 1.00 1.19 O ATOM 0 H SER A 33 125.191 8.075 10.872 1.00 0.35 H new ATOM 0 HA SER A 33 123.182 7.306 9.926 1.00 0.37 H new ATOM 0 HB2 SER A 33 122.459 7.011 12.896 1.00 0.46 H new ATOM 0 HB3 SER A 33 121.862 6.025 11.576 1.00 0.46 H new ATOM 0 HG SER A 33 123.622 4.999 12.712 1.00 1.19 H new ATOM 507 N ILE A 34 122.121 9.723 10.002 1.00 0.26 N ATOM 508 CA ILE A 34 121.142 10.857 9.955 1.00 0.22 C ATOM 509 C ILE A 34 120.504 10.918 8.566 1.00 0.18 C ATOM 510 O ILE A 34 121.193 10.985 7.567 1.00 0.19 O ATOM 511 CB ILE A 34 121.963 12.129 10.236 1.00 0.23 C ATOM 512 CG1 ILE A 34 122.730 11.995 11.571 1.00 0.28 C ATOM 513 CG2 ILE A 34 121.031 13.347 10.295 1.00 0.22 C ATOM 514 CD1 ILE A 34 121.764 11.841 12.760 1.00 0.31 C ATOM 0 H ILE A 34 122.874 9.774 9.316 1.00 0.26 H new ATOM 0 HA ILE A 34 120.337 10.743 10.681 1.00 0.22 H new ATOM 0 HB ILE A 34 122.684 12.263 9.430 1.00 0.23 H new ATOM 0 HG12 ILE A 34 123.394 11.132 11.526 1.00 0.28 H new ATOM 0 HG13 ILE A 34 123.358 12.873 11.722 1.00 0.28 H new ATOM 0 HG21 ILE A 34 121.617 14.244 10.494 1.00 0.22 H new ATOM 0 HG22 ILE A 34 120.513 13.456 9.342 1.00 0.22 H new ATOM 0 HG23 ILE A 34 120.300 13.207 11.091 1.00 0.22 H new ATOM 0 HD11 ILE A 34 122.336 11.749 13.684 1.00 0.31 H new ATOM 0 HD12 ILE A 34 121.117 12.716 12.819 1.00 0.31 H new ATOM 0 HD13 ILE A 34 121.154 10.948 12.620 1.00 0.31 H new ATOM 526 N LEU A 35 119.197 10.902 8.501 1.00 0.17 N ATOM 527 CA LEU A 35 118.509 10.709 7.189 1.00 0.15 C ATOM 528 C LEU A 35 117.702 11.951 6.819 1.00 0.12 C ATOM 529 O LEU A 35 116.813 12.362 7.541 1.00 0.14 O ATOM 530 CB LEU A 35 117.578 9.517 7.411 1.00 0.18 C ATOM 531 CG LEU A 35 117.024 9.044 6.067 1.00 0.17 C ATOM 532 CD1 LEU A 35 118.051 8.141 5.384 1.00 0.26 C ATOM 533 CD2 LEU A 35 115.729 8.260 6.297 1.00 0.19 C ATOM 0 H LEU A 35 118.575 11.015 9.302 1.00 0.17 H new ATOM 0 HA LEU A 35 119.214 10.539 6.375 1.00 0.15 H new ATOM 0 HB2 LEU A 35 118.119 8.706 7.899 1.00 0.18 H new ATOM 0 HB3 LEU A 35 116.760 9.799 8.074 1.00 0.18 H new ATOM 0 HG LEU A 35 116.819 9.907 5.433 1.00 0.17 H new ATOM 0 HD11 LEU A 35 117.658 7.803 4.425 1.00 0.26 H new ATOM 0 HD12 LEU A 35 118.974 8.698 5.221 1.00 0.26 H new ATOM 0 HD13 LEU A 35 118.255 7.278 6.018 1.00 0.26 H new ATOM 0 HD21 LEU A 35 115.333 7.922 5.339 1.00 0.19 H new ATOM 0 HD22 LEU A 35 115.934 7.396 6.930 1.00 0.19 H new ATOM 0 HD23 LEU A 35 114.997 8.902 6.786 1.00 0.19 H new ATOM 545 N GLN A 36 118.012 12.547 5.695 1.00 0.13 N ATOM 546 CA GLN A 36 117.187 13.682 5.193 1.00 0.14 C ATOM 547 C GLN A 36 116.086 13.147 4.280 1.00 0.11 C ATOM 548 O GLN A 36 116.341 12.335 3.412 1.00 0.14 O ATOM 549 CB GLN A 36 118.159 14.559 4.404 1.00 0.20 C ATOM 550 CG GLN A 36 119.150 15.217 5.366 1.00 0.26 C ATOM 551 CD GLN A 36 120.178 16.026 4.572 1.00 0.34 C ATOM 552 OE1 GLN A 36 120.576 15.635 3.491 1.00 1.02 O ATOM 553 NE2 GLN A 36 120.629 17.147 5.065 1.00 0.78 N ATOM 0 H GLN A 36 118.804 12.294 5.104 1.00 0.13 H new ATOM 0 HA GLN A 36 116.703 14.238 5.996 1.00 0.14 H new ATOM 0 HB2 GLN A 36 118.694 13.957 3.670 1.00 0.20 H new ATOM 0 HB3 GLN A 36 117.611 15.322 3.852 1.00 0.20 H new ATOM 0 HG2 GLN A 36 118.620 15.867 6.062 1.00 0.26 H new ATOM 0 HG3 GLN A 36 119.653 14.456 5.962 1.00 0.26 H new ATOM 0 HE21 GLN A 36 120.296 17.476 5.971 1.00 0.78 H new ATOM 0 HE22 GLN A 36 121.314 17.694 4.544 1.00 0.78 H new ATOM 562 N LEU A 37 114.868 13.591 4.475 1.00 0.14 N ATOM 563 CA LEU A 37 113.753 13.174 3.570 1.00 0.12 C ATOM 564 C LEU A 37 113.175 14.397 2.854 1.00 0.16 C ATOM 565 O LEU A 37 112.753 15.350 3.484 1.00 0.22 O ATOM 566 CB LEU A 37 112.697 12.560 4.494 1.00 0.17 C ATOM 567 CG LEU A 37 113.030 11.092 4.765 1.00 0.30 C ATOM 568 CD1 LEU A 37 112.232 10.602 5.975 1.00 0.30 C ATOM 569 CD2 LEU A 37 112.657 10.251 3.542 1.00 0.54 C ATOM 0 H LEU A 37 114.598 14.227 5.225 1.00 0.14 H new ATOM 0 HA LEU A 37 114.086 12.474 2.804 1.00 0.12 H new ATOM 0 HB2 LEU A 37 112.658 13.112 5.433 1.00 0.17 H new ATOM 0 HB3 LEU A 37 111.711 12.639 4.036 1.00 0.17 H new ATOM 0 HG LEU A 37 114.097 10.994 4.966 1.00 0.30 H new ATOM 0 HD11 LEU A 37 112.469 9.556 6.168 1.00 0.30 H new ATOM 0 HD12 LEU A 37 112.492 11.200 6.848 1.00 0.30 H new ATOM 0 HD13 LEU A 37 111.166 10.701 5.772 1.00 0.30 H new ATOM 0 HD21 LEU A 37 112.894 9.205 3.734 1.00 0.54 H new ATOM 0 HD22 LEU A 37 111.590 10.351 3.343 1.00 0.54 H new ATOM 0 HD23 LEU A 37 113.221 10.598 2.676 1.00 0.54 H new ATOM 581 N ARG A 38 113.154 14.375 1.544 1.00 0.15 N ATOM 582 CA ARG A 38 112.513 15.492 0.782 1.00 0.23 C ATOM 583 C ARG A 38 111.082 15.110 0.402 1.00 0.19 C ATOM 584 O ARG A 38 110.862 14.290 -0.472 1.00 0.15 O ATOM 585 CB ARG A 38 113.370 15.676 -0.476 1.00 0.30 C ATOM 586 CG ARG A 38 114.438 16.744 -0.219 1.00 0.70 C ATOM 587 CD ARG A 38 115.059 17.178 -1.550 1.00 0.71 C ATOM 588 NE ARG A 38 113.964 17.892 -2.279 1.00 1.24 N ATOM 589 CZ ARG A 38 113.602 19.120 -1.954 1.00 1.91 C ATOM 590 NH1 ARG A 38 114.176 19.768 -0.966 1.00 2.79 N ATOM 591 NH2 ARG A 38 112.649 19.701 -2.629 1.00 2.08 N ATOM 0 H ARG A 38 113.553 13.632 0.969 1.00 0.15 H new ATOM 0 HA ARG A 38 112.459 16.409 1.368 1.00 0.23 H new ATOM 0 HB2 ARG A 38 113.843 14.732 -0.747 1.00 0.30 H new ATOM 0 HB3 ARG A 38 112.742 15.971 -1.316 1.00 0.30 H new ATOM 0 HG2 ARG A 38 113.994 17.603 0.284 1.00 0.70 H new ATOM 0 HG3 ARG A 38 115.209 16.350 0.443 1.00 0.70 H new ATOM 0 HD2 ARG A 38 115.917 17.831 -1.390 1.00 0.71 H new ATOM 0 HD3 ARG A 38 115.415 16.318 -2.118 1.00 0.71 H new ATOM 0 HE ARG A 38 113.486 17.419 -3.046 1.00 1.24 H new ATOM 0 HH11 ARG A 38 114.921 19.323 -0.429 1.00 2.79 H new ATOM 0 HH12 ARG A 38 113.877 20.716 -0.736 1.00 2.79 H new ATOM 0 HH21 ARG A 38 112.194 19.207 -3.397 1.00 2.08 H new ATOM 0 HH22 ARG A 38 112.359 20.649 -2.389 1.00 2.08 H new ATOM 605 N LEU A 39 110.111 15.700 1.051 1.00 0.35 N ATOM 606 CA LEU A 39 108.693 15.291 0.819 1.00 0.43 C ATOM 607 C LEU A 39 108.107 16.015 -0.398 1.00 0.38 C ATOM 608 O LEU A 39 108.513 17.115 -0.735 1.00 0.36 O ATOM 609 CB LEU A 39 107.956 15.685 2.108 1.00 0.63 C ATOM 610 CG LEU A 39 106.557 15.044 2.167 1.00 0.66 C ATOM 611 CD1 LEU A 39 106.644 13.528 1.966 1.00 0.73 C ATOM 612 CD2 LEU A 39 105.956 15.309 3.543 1.00 0.81 C ATOM 0 H LEU A 39 110.239 16.448 1.732 1.00 0.35 H new ATOM 0 HA LEU A 39 108.601 14.226 0.606 1.00 0.43 H new ATOM 0 HB2 LEU A 39 108.539 15.372 2.974 1.00 0.63 H new ATOM 0 HB3 LEU A 39 107.864 16.770 2.161 1.00 0.63 H new ATOM 0 HG LEU A 39 105.942 15.475 1.377 1.00 0.66 H new ATOM 0 HD11 LEU A 39 105.644 13.097 2.012 1.00 0.73 H new ATOM 0 HD12 LEU A 39 107.087 13.315 0.993 1.00 0.73 H new ATOM 0 HD13 LEU A 39 107.263 13.092 2.750 1.00 0.73 H new ATOM 0 HD21 LEU A 39 104.964 14.860 3.599 1.00 0.81 H new ATOM 0 HD22 LEU A 39 106.596 14.872 4.310 1.00 0.81 H new ATOM 0 HD23 LEU A 39 105.878 16.384 3.705 1.00 0.81 H new ATOM 624 N ALA A 40 107.150 15.397 -1.052 1.00 0.40 N ATOM 625 CA ALA A 40 106.628 15.936 -2.353 1.00 0.36 C ATOM 626 C ALA A 40 105.900 17.279 -2.170 1.00 0.42 C ATOM 627 O ALA A 40 105.508 17.902 -3.139 1.00 0.42 O ATOM 628 CB ALA A 40 105.652 14.874 -2.866 1.00 0.48 C ATOM 0 H ALA A 40 106.704 14.535 -0.738 1.00 0.40 H new ATOM 0 HA ALA A 40 107.445 16.128 -3.049 1.00 0.36 H new ATOM 0 HB1 ALA A 40 105.228 15.198 -3.817 1.00 0.48 H new ATOM 0 HB2 ALA A 40 106.181 13.931 -3.007 1.00 0.48 H new ATOM 0 HB3 ALA A 40 104.851 14.735 -2.140 1.00 0.48 H new ATOM 634 N ASN A 41 105.712 17.732 -0.949 1.00 0.51 N ATOM 635 CA ASN A 41 105.119 19.090 -0.730 1.00 0.62 C ATOM 636 C ASN A 41 106.211 20.176 -0.745 1.00 0.62 C ATOM 637 O ASN A 41 106.063 21.207 -0.117 1.00 0.75 O ATOM 638 CB ASN A 41 104.455 19.019 0.650 1.00 0.76 C ATOM 639 CG ASN A 41 103.277 18.044 0.605 1.00 1.62 C ATOM 640 OD1 ASN A 41 102.567 17.974 -0.378 1.00 2.25 O ATOM 641 ND2 ASN A 41 103.038 17.282 1.638 1.00 2.36 N ATOM 0 H ASN A 41 105.944 17.219 -0.098 1.00 0.51 H new ATOM 0 HA ASN A 41 104.410 19.352 -1.515 1.00 0.62 H new ATOM 0 HB2 ASN A 41 105.180 18.695 1.397 1.00 0.76 H new ATOM 0 HB3 ASN A 41 104.110 20.008 0.950 1.00 0.76 H new ATOM 0 HD21 ASN A 41 102.255 16.628 1.619 1.00 2.36 H new ATOM 0 HD22 ASN A 41 103.634 17.340 2.464 1.00 2.36 H new ATOM 648 N ASP A 42 107.310 19.958 -1.455 1.00 0.52 N ATOM 649 CA ASP A 42 108.374 21.012 -1.593 1.00 0.60 C ATOM 650 C ASP A 42 108.987 21.340 -0.225 1.00 0.67 C ATOM 651 O ASP A 42 109.434 22.449 0.004 1.00 0.80 O ATOM 652 CB ASP A 42 107.671 22.251 -2.173 1.00 0.71 C ATOM 653 CG ASP A 42 108.713 23.186 -2.789 1.00 1.18 C ATOM 654 OD1 ASP A 42 109.094 22.951 -3.923 1.00 2.02 O ATOM 655 OD2 ASP A 42 109.111 24.122 -2.116 1.00 1.38 O ATOM 0 H ASP A 42 107.510 19.087 -1.946 1.00 0.52 H new ATOM 0 HA ASP A 42 109.186 20.674 -2.237 1.00 0.60 H new ATOM 0 HB2 ASP A 42 106.945 21.950 -2.928 1.00 0.71 H new ATOM 0 HB3 ASP A 42 107.119 22.770 -1.389 1.00 0.71 H new ATOM 660 N SER A 43 109.015 20.387 0.688 1.00 0.62 N ATOM 661 CA SER A 43 109.594 20.661 2.039 1.00 0.69 C ATOM 662 C SER A 43 110.703 19.657 2.362 1.00 0.61 C ATOM 663 O SER A 43 110.576 18.474 2.098 1.00 0.51 O ATOM 664 CB SER A 43 108.425 20.496 3.008 1.00 0.76 C ATOM 665 OG SER A 43 107.393 21.410 2.660 1.00 0.81 O ATOM 0 H SER A 43 108.663 19.440 0.551 1.00 0.62 H new ATOM 0 HA SER A 43 110.042 21.653 2.100 1.00 0.69 H new ATOM 0 HB2 SER A 43 108.049 19.474 2.971 1.00 0.76 H new ATOM 0 HB3 SER A 43 108.757 20.677 4.030 1.00 0.76 H new ATOM 0 HG SER A 43 106.969 21.122 1.825 1.00 0.81 H new ATOM 671 N THR A 44 111.787 20.124 2.932 1.00 0.66 N ATOM 672 CA THR A 44 112.873 19.195 3.376 1.00 0.58 C ATOM 673 C THR A 44 112.740 18.907 4.876 1.00 0.40 C ATOM 674 O THR A 44 112.247 19.728 5.629 1.00 0.35 O ATOM 675 CB THR A 44 114.195 19.922 3.066 1.00 0.65 C ATOM 676 OG1 THR A 44 115.283 19.100 3.466 1.00 0.61 O ATOM 677 CG2 THR A 44 114.277 21.263 3.813 1.00 0.63 C ATOM 0 H THR A 44 111.967 21.112 3.109 1.00 0.66 H new ATOM 0 HA THR A 44 112.824 18.233 2.865 1.00 0.58 H new ATOM 0 HB THR A 44 114.239 20.119 1.995 1.00 0.65 H new ATOM 0 HG1 THR A 44 116.128 19.557 3.270 1.00 0.61 H new ATOM 0 HG21 THR A 44 115.220 21.755 3.576 1.00 0.63 H new ATOM 0 HG22 THR A 44 113.448 21.901 3.507 1.00 0.63 H new ATOM 0 HG23 THR A 44 114.221 21.085 4.887 1.00 0.63 H new ATOM 685 N LYS A 45 113.174 17.750 5.313 1.00 0.36 N ATOM 686 CA LYS A 45 113.093 17.417 6.768 1.00 0.31 C ATOM 687 C LYS A 45 114.225 16.462 7.161 1.00 0.26 C ATOM 688 O LYS A 45 114.321 15.362 6.650 1.00 0.23 O ATOM 689 CB LYS A 45 111.733 16.742 6.945 1.00 0.46 C ATOM 690 CG LYS A 45 111.431 16.582 8.437 1.00 0.91 C ATOM 691 CD LYS A 45 110.180 15.718 8.616 1.00 1.14 C ATOM 692 CE LYS A 45 108.942 16.520 8.208 1.00 1.54 C ATOM 693 NZ LYS A 45 107.812 15.555 8.304 1.00 1.97 N ATOM 0 H LYS A 45 113.581 17.023 4.725 1.00 0.36 H new ATOM 0 HA LYS A 45 113.195 18.300 7.399 1.00 0.31 H new ATOM 0 HB2 LYS A 45 110.955 17.338 6.468 1.00 0.46 H new ATOM 0 HB3 LYS A 45 111.733 15.767 6.457 1.00 0.46 H new ATOM 0 HG2 LYS A 45 112.279 16.121 8.943 1.00 0.91 H new ATOM 0 HG3 LYS A 45 111.279 17.559 8.895 1.00 0.91 H new ATOM 0 HD2 LYS A 45 110.258 14.816 8.009 1.00 1.14 H new ATOM 0 HD3 LYS A 45 110.092 15.397 9.654 1.00 1.14 H new ATOM 0 HE2 LYS A 45 108.789 17.374 8.868 1.00 1.54 H new ATOM 0 HE3 LYS A 45 109.041 16.913 7.196 1.00 1.54 H new ATOM 0 HZ1 LYS A 45 106.926 16.031 8.039 1.00 1.97 H new ATOM 0 HZ2 LYS A 45 107.982 14.756 7.660 1.00 1.97 H new ATOM 0 HZ3 LYS A 45 107.738 15.203 9.280 1.00 1.97 H new ATOM 707 N SER A 46 115.078 16.878 8.065 1.00 0.26 N ATOM 708 CA SER A 46 116.201 15.996 8.510 1.00 0.23 C ATOM 709 C SER A 46 115.808 15.237 9.780 1.00 0.24 C ATOM 710 O SER A 46 115.461 15.832 10.785 1.00 0.28 O ATOM 711 CB SER A 46 117.364 16.947 8.792 1.00 0.24 C ATOM 712 OG SER A 46 117.049 17.754 9.920 1.00 0.29 O ATOM 0 H SER A 46 115.044 17.793 8.515 1.00 0.26 H new ATOM 0 HA SER A 46 116.459 15.247 7.761 1.00 0.23 H new ATOM 0 HB2 SER A 46 118.275 16.379 8.980 1.00 0.24 H new ATOM 0 HB3 SER A 46 117.554 17.576 7.922 1.00 0.24 H new ATOM 0 HG SER A 46 116.356 17.313 10.454 1.00 0.29 H new ATOM 718 N ILE A 47 115.863 13.927 9.740 1.00 0.22 N ATOM 719 CA ILE A 47 115.507 13.113 10.944 1.00 0.25 C ATOM 720 C ILE A 47 116.625 12.103 11.221 1.00 0.23 C ATOM 721 O ILE A 47 117.133 11.471 10.313 1.00 0.20 O ATOM 722 CB ILE A 47 114.194 12.397 10.587 1.00 0.26 C ATOM 723 CG1 ILE A 47 113.105 13.431 10.267 1.00 0.29 C ATOM 724 CG2 ILE A 47 113.732 11.540 11.771 1.00 0.31 C ATOM 725 CD1 ILE A 47 111.899 12.729 9.639 1.00 0.31 C ATOM 0 H ILE A 47 116.140 13.385 8.922 1.00 0.22 H new ATOM 0 HA ILE A 47 115.388 13.721 11.840 1.00 0.25 H new ATOM 0 HB ILE A 47 114.365 11.763 9.717 1.00 0.26 H new ATOM 0 HG12 ILE A 47 112.803 13.950 11.177 1.00 0.29 H new ATOM 0 HG13 ILE A 47 113.495 14.186 9.584 1.00 0.29 H new ATOM 0 HG21 ILE A 47 112.801 11.035 11.513 1.00 0.31 H new ATOM 0 HG22 ILE A 47 114.496 10.798 12.003 1.00 0.31 H new ATOM 0 HG23 ILE A 47 113.570 12.177 12.640 1.00 0.31 H new ATOM 0 HD11 ILE A 47 111.127 13.465 9.413 1.00 0.31 H new ATOM 0 HD12 ILE A 47 112.206 12.231 8.720 1.00 0.31 H new ATOM 0 HD13 ILE A 47 111.503 11.991 10.337 1.00 0.31 H new ATOM 737 N VAL A 48 117.009 11.947 12.464 1.00 0.27 N ATOM 738 CA VAL A 48 118.083 10.959 12.799 1.00 0.28 C ATOM 739 C VAL A 48 117.465 9.554 12.893 1.00 0.29 C ATOM 740 O VAL A 48 116.502 9.338 13.598 1.00 0.31 O ATOM 741 CB VAL A 48 118.649 11.420 14.156 1.00 0.32 C ATOM 742 CG1 VAL A 48 119.764 10.467 14.612 1.00 0.35 C ATOM 743 CG2 VAL A 48 119.206 12.850 14.032 1.00 0.32 C ATOM 0 H VAL A 48 116.627 12.459 13.259 1.00 0.27 H new ATOM 0 HA VAL A 48 118.871 10.911 12.047 1.00 0.28 H new ATOM 0 HB VAL A 48 117.848 11.410 14.895 1.00 0.32 H new ATOM 0 HG11 VAL A 48 120.158 10.801 15.572 1.00 0.35 H new ATOM 0 HG12 VAL A 48 119.362 9.459 14.716 1.00 0.35 H new ATOM 0 HG13 VAL A 48 120.565 10.464 13.873 1.00 0.35 H new ATOM 0 HG21 VAL A 48 119.605 13.170 14.995 1.00 0.32 H new ATOM 0 HG22 VAL A 48 120.001 12.868 13.286 1.00 0.32 H new ATOM 0 HG23 VAL A 48 118.407 13.526 13.727 1.00 0.32 H new ATOM 753 N THR A 49 118.024 8.602 12.183 1.00 0.28 N ATOM 754 CA THR A 49 117.368 7.255 12.048 1.00 0.29 C ATOM 755 C THR A 49 117.171 6.574 13.406 1.00 0.32 C ATOM 756 O THR A 49 116.302 5.739 13.563 1.00 0.33 O ATOM 757 CB THR A 49 118.326 6.430 11.184 1.00 0.29 C ATOM 758 OG1 THR A 49 119.631 6.486 11.741 1.00 0.32 O ATOM 759 CG2 THR A 49 118.348 6.997 9.763 1.00 0.28 C ATOM 0 H THR A 49 118.911 8.698 11.688 1.00 0.28 H new ATOM 0 HA THR A 49 116.375 7.349 11.609 1.00 0.29 H new ATOM 0 HB THR A 49 117.990 5.394 11.154 1.00 0.29 H new ATOM 0 HG1 THR A 49 120.111 7.257 11.373 1.00 0.32 H new ATOM 0 HG21 THR A 49 119.030 6.410 9.148 1.00 0.28 H new ATOM 0 HG22 THR A 49 117.345 6.952 9.338 1.00 0.28 H new ATOM 0 HG23 THR A 49 118.685 8.033 9.790 1.00 0.28 H new ATOM 767 N LYS A 50 117.970 6.920 14.383 1.00 0.33 N ATOM 768 CA LYS A 50 117.884 6.238 15.719 1.00 0.36 C ATOM 769 C LYS A 50 116.468 6.348 16.301 1.00 0.36 C ATOM 770 O LYS A 50 116.059 5.522 17.098 1.00 0.39 O ATOM 771 CB LYS A 50 118.896 6.965 16.615 1.00 0.39 C ATOM 772 CG LYS A 50 119.024 6.240 17.959 1.00 1.29 C ATOM 773 CD LYS A 50 119.745 7.148 18.959 1.00 1.79 C ATOM 774 CE LYS A 50 119.996 6.378 20.258 1.00 2.80 C ATOM 775 NZ LYS A 50 120.856 7.277 21.077 1.00 3.28 N ATOM 0 H LYS A 50 118.682 7.647 14.317 1.00 0.33 H new ATOM 0 HA LYS A 50 118.103 5.173 15.640 1.00 0.36 H new ATOM 0 HB2 LYS A 50 119.867 7.006 16.121 1.00 0.39 H new ATOM 0 HB3 LYS A 50 118.577 7.994 16.777 1.00 0.39 H new ATOM 0 HG2 LYS A 50 118.037 5.975 18.337 1.00 1.29 H new ATOM 0 HG3 LYS A 50 119.577 5.309 17.832 1.00 1.29 H new ATOM 0 HD2 LYS A 50 120.690 7.491 18.539 1.00 1.79 H new ATOM 0 HD3 LYS A 50 119.144 8.035 19.160 1.00 1.79 H new ATOM 0 HE2 LYS A 50 119.061 6.152 20.770 1.00 2.80 H new ATOM 0 HE3 LYS A 50 120.491 5.427 20.064 1.00 2.80 H new ATOM 0 HZ1 LYS A 50 121.072 6.818 21.985 1.00 3.28 H new ATOM 0 HZ2 LYS A 50 121.742 7.469 20.567 1.00 3.28 H new ATOM 0 HZ3 LYS A 50 120.356 8.172 21.251 1.00 3.28 H new ATOM 789 N ASP A 51 115.724 7.355 15.915 1.00 0.34 N ATOM 790 CA ASP A 51 114.308 7.460 16.396 1.00 0.35 C ATOM 791 C ASP A 51 113.356 6.618 15.526 1.00 0.31 C ATOM 792 O ASP A 51 112.153 6.650 15.719 1.00 0.32 O ATOM 793 CB ASP A 51 113.944 8.956 16.334 1.00 0.36 C ATOM 794 CG ASP A 51 114.077 9.506 14.907 1.00 0.33 C ATOM 795 OD1 ASP A 51 113.637 8.843 13.983 1.00 0.34 O ATOM 796 OD2 ASP A 51 114.619 10.590 14.765 1.00 0.54 O ATOM 0 H ASP A 51 116.030 8.103 15.293 1.00 0.34 H new ATOM 0 HA ASP A 51 114.209 7.072 17.410 1.00 0.35 H new ATOM 0 HB2 ASP A 51 112.923 9.098 16.687 1.00 0.36 H new ATOM 0 HB3 ASP A 51 114.594 9.518 17.004 1.00 0.36 H new ATOM 801 N ILE A 52 113.873 5.866 14.573 1.00 0.31 N ATOM 802 CA ILE A 52 112.985 4.963 13.766 1.00 0.29 C ATOM 803 C ILE A 52 112.603 3.731 14.595 1.00 0.25 C ATOM 804 O ILE A 52 113.455 3.037 15.120 1.00 0.30 O ATOM 805 CB ILE A 52 113.810 4.556 12.532 1.00 0.35 C ATOM 806 CG1 ILE A 52 114.136 5.799 11.695 1.00 0.41 C ATOM 807 CG2 ILE A 52 113.008 3.569 11.669 1.00 0.38 C ATOM 808 CD1 ILE A 52 115.134 5.431 10.592 1.00 0.49 C ATOM 0 H ILE A 52 114.862 5.840 14.323 1.00 0.31 H new ATOM 0 HA ILE A 52 112.058 5.456 13.474 1.00 0.29 H new ATOM 0 HB ILE A 52 114.734 4.083 12.866 1.00 0.35 H new ATOM 0 HG12 ILE A 52 113.224 6.202 11.254 1.00 0.41 H new ATOM 0 HG13 ILE A 52 114.554 6.579 12.332 1.00 0.41 H new ATOM 0 HG21 ILE A 52 113.598 3.285 10.797 1.00 0.38 H new ATOM 0 HG22 ILE A 52 112.775 2.680 12.255 1.00 0.38 H new ATOM 0 HG23 ILE A 52 112.082 4.041 11.342 1.00 0.38 H new ATOM 0 HD11 ILE A 52 115.364 6.316 9.999 1.00 0.49 H new ATOM 0 HD12 ILE A 52 116.050 5.049 11.043 1.00 0.49 H new ATOM 0 HD13 ILE A 52 114.699 4.666 9.949 1.00 0.49 H new ATOM 820 N LYS A 53 111.327 3.463 14.710 1.00 0.21 N ATOM 821 CA LYS A 53 110.875 2.176 15.317 1.00 0.20 C ATOM 822 C LYS A 53 110.695 1.117 14.222 1.00 0.21 C ATOM 823 O LYS A 53 110.870 -0.062 14.462 1.00 0.26 O ATOM 824 CB LYS A 53 109.536 2.491 15.990 1.00 0.22 C ATOM 825 CG LYS A 53 109.087 1.291 16.827 1.00 0.26 C ATOM 826 CD LYS A 53 109.929 1.215 18.102 1.00 0.89 C ATOM 827 CE LYS A 53 109.427 0.065 18.978 1.00 1.07 C ATOM 828 NZ LYS A 53 110.494 -0.137 19.997 1.00 1.89 N ATOM 0 H LYS A 53 110.576 4.084 14.408 1.00 0.21 H new ATOM 0 HA LYS A 53 111.597 1.780 16.031 1.00 0.20 H new ATOM 0 HB2 LYS A 53 109.634 3.373 16.623 1.00 0.22 H new ATOM 0 HB3 LYS A 53 108.784 2.723 15.236 1.00 0.22 H new ATOM 0 HG2 LYS A 53 108.031 1.386 17.081 1.00 0.26 H new ATOM 0 HG3 LYS A 53 109.195 0.372 16.252 1.00 0.26 H new ATOM 0 HD2 LYS A 53 110.978 1.062 17.849 1.00 0.89 H new ATOM 0 HD3 LYS A 53 109.867 2.156 18.648 1.00 0.89 H new ATOM 0 HE2 LYS A 53 108.475 0.313 19.447 1.00 1.07 H new ATOM 0 HE3 LYS A 53 109.267 -0.839 18.390 1.00 1.07 H new ATOM 0 HZ1 LYS A 53 110.222 -0.911 20.636 1.00 1.89 H new ATOM 0 HZ2 LYS A 53 111.387 -0.378 19.522 1.00 1.89 H new ATOM 0 HZ3 LYS A 53 110.619 0.737 20.546 1.00 1.89 H new ATOM 842 N ASP A 54 110.351 1.537 13.023 1.00 0.19 N ATOM 843 CA ASP A 54 110.114 0.564 11.906 1.00 0.23 C ATOM 844 C ASP A 54 110.116 1.299 10.560 1.00 0.20 C ATOM 845 O ASP A 54 109.877 2.491 10.497 1.00 0.18 O ATOM 846 CB ASP A 54 108.734 -0.050 12.175 1.00 0.27 C ATOM 847 CG ASP A 54 108.874 -1.305 13.041 1.00 0.34 C ATOM 848 OD1 ASP A 54 109.807 -2.060 12.813 1.00 0.86 O ATOM 849 OD2 ASP A 54 108.046 -1.492 13.916 1.00 0.79 O ATOM 0 H ASP A 54 110.224 2.517 12.771 1.00 0.19 H new ATOM 0 HA ASP A 54 110.891 -0.199 11.862 1.00 0.23 H new ATOM 0 HB2 ASP A 54 108.096 0.677 12.676 1.00 0.27 H new ATOM 0 HB3 ASP A 54 108.250 -0.302 11.232 1.00 0.27 H new ATOM 854 N LEU A 55 110.385 0.590 9.487 1.00 0.22 N ATOM 855 CA LEU A 55 110.436 1.240 8.139 1.00 0.21 C ATOM 856 C LEU A 55 109.643 0.420 7.115 1.00 0.22 C ATOM 857 O LEU A 55 109.529 -0.786 7.227 1.00 0.25 O ATOM 858 CB LEU A 55 111.919 1.261 7.761 1.00 0.26 C ATOM 859 CG LEU A 55 112.683 2.199 8.698 1.00 0.28 C ATOM 860 CD1 LEU A 55 114.186 1.988 8.514 1.00 0.57 C ATOM 861 CD2 LEU A 55 112.331 3.649 8.363 1.00 0.59 C ATOM 0 H LEU A 55 110.572 -0.413 9.488 1.00 0.22 H new ATOM 0 HA LEU A 55 109.999 2.239 8.154 1.00 0.21 H new ATOM 0 HB2 LEU A 55 112.333 0.255 7.823 1.00 0.26 H new ATOM 0 HB3 LEU A 55 112.035 1.591 6.729 1.00 0.26 H new ATOM 0 HG LEU A 55 112.408 1.985 9.731 1.00 0.28 H new ATOM 0 HD11 LEU A 55 114.731 2.656 9.181 1.00 0.57 H new ATOM 0 HD12 LEU A 55 114.440 0.954 8.748 1.00 0.57 H new ATOM 0 HD13 LEU A 55 114.460 2.204 7.481 1.00 0.57 H new ATOM 0 HD21 LEU A 55 112.874 4.319 9.030 1.00 0.59 H new ATOM 0 HD22 LEU A 55 112.608 3.861 7.330 1.00 0.59 H new ATOM 0 HD23 LEU A 55 111.259 3.802 8.490 1.00 0.59 H new ATOM 873 N ARG A 56 109.098 1.075 6.117 1.00 0.22 N ATOM 874 CA ARG A 56 108.395 0.343 5.017 1.00 0.24 C ATOM 875 C ARG A 56 108.453 1.163 3.721 1.00 0.24 C ATOM 876 O ARG A 56 108.356 2.375 3.748 1.00 0.24 O ATOM 877 CB ARG A 56 106.945 0.184 5.499 1.00 0.26 C ATOM 878 CG ARG A 56 106.283 1.561 5.655 1.00 0.27 C ATOM 879 CD ARG A 56 104.870 1.400 6.218 1.00 0.44 C ATOM 880 NE ARG A 56 105.051 0.823 7.588 1.00 0.77 N ATOM 881 CZ ARG A 56 105.459 1.564 8.602 1.00 1.18 C ATOM 882 NH1 ARG A 56 105.738 2.839 8.455 1.00 1.93 N ATOM 883 NH2 ARG A 56 105.592 1.015 9.779 1.00 1.32 N ATOM 0 H ARG A 56 109.110 2.090 6.017 1.00 0.22 H new ATOM 0 HA ARG A 56 108.853 -0.623 4.803 1.00 0.24 H new ATOM 0 HB2 ARG A 56 106.382 -0.420 4.787 1.00 0.26 H new ATOM 0 HB3 ARG A 56 106.927 -0.346 6.451 1.00 0.26 H new ATOM 0 HG2 ARG A 56 106.879 2.187 6.319 1.00 0.27 H new ATOM 0 HG3 ARG A 56 106.244 2.066 4.690 1.00 0.27 H new ATOM 0 HD2 ARG A 56 104.353 2.358 6.261 1.00 0.44 H new ATOM 0 HD3 ARG A 56 104.270 0.741 5.590 1.00 0.44 H new ATOM 0 HE ARG A 56 104.854 -0.166 7.742 1.00 0.77 H new ATOM 0 HH11 ARG A 56 105.641 3.280 7.540 1.00 1.93 H new ATOM 0 HH12 ARG A 56 106.051 3.388 9.255 1.00 1.93 H new ATOM 0 HH21 ARG A 56 105.382 0.025 9.907 1.00 1.32 H new ATOM 0 HH22 ARG A 56 105.906 1.576 10.571 1.00 1.32 H new ATOM 897 N ILE A 57 108.612 0.515 2.596 1.00 0.25 N ATOM 898 CA ILE A 57 108.567 1.250 1.292 1.00 0.25 C ATOM 899 C ILE A 57 107.116 1.367 0.802 1.00 0.29 C ATOM 900 O ILE A 57 106.373 0.402 0.811 1.00 0.32 O ATOM 901 CB ILE A 57 109.401 0.420 0.305 1.00 0.27 C ATOM 902 CG1 ILE A 57 110.823 0.218 0.852 1.00 0.27 C ATOM 903 CG2 ILE A 57 109.484 1.171 -1.029 1.00 0.29 C ATOM 904 CD1 ILE A 57 111.558 -0.821 0.002 1.00 0.31 C ATOM 0 H ILE A 57 108.771 -0.490 2.522 1.00 0.25 H new ATOM 0 HA ILE A 57 108.961 2.262 1.388 1.00 0.25 H new ATOM 0 HB ILE A 57 108.929 -0.553 0.166 1.00 0.27 H new ATOM 0 HG12 ILE A 57 111.366 1.163 0.839 1.00 0.27 H new ATOM 0 HG13 ILE A 57 110.781 -0.111 1.890 1.00 0.27 H new ATOM 0 HG21 ILE A 57 110.074 0.590 -1.737 1.00 0.29 H new ATOM 0 HG22 ILE A 57 108.480 1.317 -1.427 1.00 0.29 H new ATOM 0 HG23 ILE A 57 109.957 2.141 -0.872 1.00 0.29 H new ATOM 0 HD11 ILE A 57 112.566 -0.963 0.392 1.00 0.31 H new ATOM 0 HD12 ILE A 57 111.019 -1.768 0.038 1.00 0.31 H new ATOM 0 HD13 ILE A 57 111.613 -0.474 -1.030 1.00 0.31 H new ATOM 916 N LEU A 58 106.713 2.542 0.379 1.00 0.29 N ATOM 917 CA LEU A 58 105.307 2.731 -0.104 1.00 0.35 C ATOM 918 C LEU A 58 105.194 2.303 -1.576 1.00 0.38 C ATOM 919 O LEU A 58 106.194 2.205 -2.261 1.00 0.48 O ATOM 920 CB LEU A 58 105.026 4.229 0.036 1.00 0.35 C ATOM 921 CG LEU A 58 105.012 4.614 1.516 1.00 0.35 C ATOM 922 CD1 LEU A 58 105.122 6.135 1.647 1.00 0.37 C ATOM 923 CD2 LEU A 58 103.704 4.140 2.153 1.00 0.38 C ATOM 0 H LEU A 58 107.296 3.378 0.347 1.00 0.29 H new ATOM 0 HA LEU A 58 104.596 2.131 0.464 1.00 0.35 H new ATOM 0 HB2 LEU A 58 105.788 4.803 -0.492 1.00 0.35 H new ATOM 0 HB3 LEU A 58 104.068 4.474 -0.423 1.00 0.35 H new ATOM 0 HG LEU A 58 105.854 4.144 2.023 1.00 0.35 H new ATOM 0 HD11 LEU A 58 105.112 6.411 2.701 1.00 0.37 H new ATOM 0 HD12 LEU A 58 106.053 6.473 1.192 1.00 0.37 H new ATOM 0 HD13 LEU A 58 104.279 6.606 1.141 1.00 0.37 H new ATOM 0 HD21 LEU A 58 103.693 4.414 3.208 1.00 0.38 H new ATOM 0 HD22 LEU A 58 102.861 4.611 1.647 1.00 0.38 H new ATOM 0 HD23 LEU A 58 103.625 3.057 2.058 1.00 0.38 H new ATOM 935 N PRO A 59 103.974 2.059 -2.022 1.00 0.57 N ATOM 936 CA PRO A 59 103.750 1.679 -3.444 1.00 0.61 C ATOM 937 C PRO A 59 104.106 2.847 -4.371 1.00 0.70 C ATOM 938 O PRO A 59 104.021 4.000 -3.988 1.00 1.28 O ATOM 939 CB PRO A 59 102.253 1.363 -3.514 1.00 1.02 C ATOM 940 CG PRO A 59 101.647 2.036 -2.324 1.00 1.17 C ATOM 941 CD PRO A 59 102.713 2.111 -1.265 1.00 0.91 C ATOM 0 HA PRO A 59 104.367 0.838 -3.760 1.00 0.61 H new ATOM 0 HB2 PRO A 59 101.816 1.736 -4.440 1.00 1.02 H new ATOM 0 HB3 PRO A 59 102.077 0.288 -3.489 1.00 1.02 H new ATOM 0 HG2 PRO A 59 101.293 3.033 -2.585 1.00 1.17 H new ATOM 0 HG3 PRO A 59 100.785 1.476 -1.963 1.00 1.17 H new ATOM 0 HD2 PRO A 59 102.634 3.030 -0.684 1.00 0.91 H new ATOM 0 HD3 PRO A 59 102.636 1.282 -0.562 1.00 0.91 H new ATOM 949 N LYS A 60 104.503 2.553 -5.586 1.00 1.27 N ATOM 950 CA LYS A 60 104.889 3.641 -6.539 1.00 1.53 C ATOM 951 C LYS A 60 103.638 4.281 -7.147 1.00 2.15 C ATOM 952 O LYS A 60 102.799 3.605 -7.713 1.00 2.94 O ATOM 953 CB LYS A 60 105.722 2.953 -7.624 1.00 2.51 C ATOM 954 CG LYS A 60 106.363 4.010 -8.527 1.00 3.00 C ATOM 955 CD LYS A 60 107.134 3.321 -9.654 1.00 4.00 C ATOM 956 CE LYS A 60 107.855 4.374 -10.498 1.00 4.78 C ATOM 957 NZ LYS A 60 106.830 4.862 -11.463 1.00 5.50 N ATOM 0 H LYS A 60 104.576 1.606 -5.959 1.00 1.27 H new ATOM 0 HA LYS A 60 105.447 4.437 -6.046 1.00 1.53 H new ATOM 0 HB2 LYS A 60 106.494 2.335 -7.166 1.00 2.51 H new ATOM 0 HB3 LYS A 60 105.091 2.289 -8.215 1.00 2.51 H new ATOM 0 HG2 LYS A 60 105.595 4.662 -8.943 1.00 3.00 H new ATOM 0 HG3 LYS A 60 107.035 4.641 -7.945 1.00 3.00 H new ATOM 0 HD2 LYS A 60 107.855 2.617 -9.238 1.00 4.00 H new ATOM 0 HD3 LYS A 60 106.450 2.746 -10.278 1.00 4.00 H new ATOM 0 HE2 LYS A 60 108.232 5.187 -9.877 1.00 4.78 H new ATOM 0 HE3 LYS A 60 108.713 3.945 -11.016 1.00 4.78 H new ATOM 0 HZ1 LYS A 60 107.267 5.538 -12.121 1.00 5.50 H new ATOM 0 HZ2 LYS A 60 106.446 4.057 -11.998 1.00 5.50 H new ATOM 0 HZ3 LYS A 60 106.061 5.332 -10.944 1.00 5.50 H new ATOM 971 N ASN A 61 103.512 5.588 -7.035 1.00 2.52 N ATOM 972 CA ASN A 61 102.308 6.312 -7.580 1.00 3.53 C ATOM 973 C ASN A 61 101.014 5.770 -6.957 1.00 4.11 C ATOM 974 O ASN A 61 101.002 4.724 -6.336 1.00 4.54 O ATOM 975 CB ASN A 61 102.323 6.068 -9.095 1.00 4.19 C ATOM 976 CG ASN A 61 101.396 7.071 -9.783 1.00 4.77 C ATOM 977 OD1 ASN A 61 100.417 6.692 -10.394 1.00 5.06 O ATOM 978 ND2 ASN A 61 101.666 8.346 -9.710 1.00 5.40 N ATOM 0 H ASN A 61 104.200 6.191 -6.584 1.00 2.52 H new ATOM 0 HA ASN A 61 102.345 7.376 -7.345 1.00 3.53 H new ATOM 0 HB2 ASN A 61 103.337 6.171 -9.480 1.00 4.19 H new ATOM 0 HB3 ASN A 61 102.001 5.050 -9.313 1.00 4.19 H new ATOM 0 HD21 ASN A 61 101.055 9.024 -10.166 1.00 5.40 H new ATOM 0 HD22 ASN A 61 102.488 8.665 -9.197 1.00 5.40 H new ATOM 985 N GLU A 62 99.920 6.486 -7.121 1.00 4.62 N ATOM 986 CA GLU A 62 98.600 6.045 -6.547 1.00 5.56 C ATOM 987 C GLU A 62 98.726 5.722 -5.051 1.00 6.20 C ATOM 988 O GLU A 62 98.020 4.877 -4.530 1.00 6.54 O ATOM 989 CB GLU A 62 98.208 4.788 -7.336 1.00 6.11 C ATOM 990 CG GLU A 62 97.893 5.165 -8.787 1.00 6.65 C ATOM 991 CD GLU A 62 96.600 5.983 -8.843 1.00 6.79 C ATOM 992 OE1 GLU A 62 95.672 5.645 -8.126 1.00 6.60 O ATOM 993 OE2 GLU A 62 96.558 6.936 -9.605 1.00 7.38 O ATOM 0 H GLU A 62 99.885 7.367 -7.634 1.00 4.62 H new ATOM 0 HA GLU A 62 97.849 6.831 -6.631 1.00 5.56 H new ATOM 0 HB2 GLU A 62 99.020 4.061 -7.307 1.00 6.11 H new ATOM 0 HB3 GLU A 62 97.340 4.315 -6.877 1.00 6.11 H new ATOM 0 HG2 GLU A 62 98.717 5.741 -9.209 1.00 6.65 H new ATOM 0 HG3 GLU A 62 97.790 4.264 -9.392 1.00 6.65 H new ATOM 1000 N ILE A 63 99.620 6.392 -4.363 1.00 6.68 N ATOM 1001 CA ILE A 63 99.810 6.120 -2.898 1.00 7.52 C ATOM 1002 C ILE A 63 98.569 6.578 -2.121 1.00 8.41 C ATOM 1003 O ILE A 63 97.988 5.820 -1.363 1.00 8.89 O ATOM 1004 CB ILE A 63 101.052 6.930 -2.481 1.00 7.85 C ATOM 1005 CG1 ILE A 63 102.272 6.457 -3.281 1.00 8.00 C ATOM 1006 CG2 ILE A 63 101.329 6.730 -0.987 1.00 8.64 C ATOM 1007 CD1 ILE A 63 103.422 7.451 -3.100 1.00 8.51 C ATOM 0 H ILE A 63 100.227 7.115 -4.750 1.00 6.68 H new ATOM 0 HA ILE A 63 99.946 5.059 -2.689 1.00 7.52 H new ATOM 0 HB ILE A 63 100.866 7.985 -2.681 1.00 7.85 H new ATOM 0 HG12 ILE A 63 102.578 5.466 -2.945 1.00 8.00 H new ATOM 0 HG13 ILE A 63 102.016 6.370 -4.337 1.00 8.00 H new ATOM 0 HG21 ILE A 63 102.209 7.306 -0.700 1.00 8.64 H new ATOM 0 HG22 ILE A 63 100.469 7.068 -0.409 1.00 8.64 H new ATOM 0 HG23 ILE A 63 101.506 5.673 -0.788 1.00 8.64 H new ATOM 0 HD11 ILE A 63 104.288 7.113 -3.669 1.00 8.51 H new ATOM 0 HD12 ILE A 63 103.113 8.433 -3.458 1.00 8.51 H new ATOM 0 HD13 ILE A 63 103.685 7.515 -2.044 1.00 8.51 H new ATOM 1019 N MET A 64 98.163 7.811 -2.305 1.00 8.85 N ATOM 1020 CA MET A 64 96.952 8.325 -1.591 1.00 9.91 C ATOM 1021 C MET A 64 95.664 7.860 -2.302 1.00 10.15 C ATOM 1022 O MET A 64 94.832 7.227 -1.680 1.00 10.43 O ATOM 1023 CB MET A 64 97.075 9.855 -1.616 1.00 10.37 C ATOM 1024 CG MET A 64 97.709 10.346 -0.311 1.00 11.24 C ATOM 1025 SD MET A 64 97.963 12.136 -0.400 1.00 11.99 S ATOM 1026 CE MET A 64 99.512 12.191 0.535 1.00 12.43 C ATOM 0 H MET A 64 98.619 8.485 -2.920 1.00 8.85 H new ATOM 0 HA MET A 64 96.894 7.948 -0.570 1.00 9.91 H new ATOM 0 HB2 MET A 64 97.683 10.166 -2.466 1.00 10.37 H new ATOM 0 HB3 MET A 64 96.091 10.306 -1.745 1.00 10.37 H new ATOM 0 HG2 MET A 64 97.065 10.101 0.534 1.00 11.24 H new ATOM 0 HG3 MET A 64 98.660 9.841 -0.144 1.00 11.24 H new ATOM 0 HE1 MET A 64 99.858 13.222 0.605 1.00 12.43 H new ATOM 0 HE2 MET A 64 99.347 11.795 1.537 1.00 12.43 H new ATOM 0 HE3 MET A 64 100.265 11.589 0.027 1.00 12.43 H new ATOM 1036 N PRO A 65 95.527 8.179 -3.580 1.00 10.26 N ATOM 1037 CA PRO A 65 94.296 7.791 -4.319 1.00 10.76 C ATOM 1038 C PRO A 65 94.297 6.285 -4.599 1.00 11.57 C ATOM 1039 O PRO A 65 95.334 5.692 -4.835 1.00 12.01 O ATOM 1040 CB PRO A 65 94.380 8.587 -5.619 1.00 10.98 C ATOM 1041 CG PRO A 65 95.834 8.876 -5.811 1.00 10.82 C ATOM 1042 CD PRO A 65 96.472 8.910 -4.447 1.00 10.24 C ATOM 0 HA PRO A 65 93.382 7.999 -3.763 1.00 10.76 H new ATOM 0 HB2 PRO A 65 93.978 8.016 -6.456 1.00 10.98 H new ATOM 0 HB3 PRO A 65 93.801 9.508 -5.554 1.00 10.98 H new ATOM 0 HG2 PRO A 65 96.298 8.110 -6.433 1.00 10.82 H new ATOM 0 HG3 PRO A 65 95.971 9.829 -6.323 1.00 10.82 H new ATOM 0 HD2 PRO A 65 97.453 8.434 -4.455 1.00 10.24 H new ATOM 0 HD3 PRO A 65 96.617 9.934 -4.102 1.00 10.24 H new ATOM 1050 N LYS A 66 93.141 5.667 -4.572 1.00 11.94 N ATOM 1051 CA LYS A 66 93.058 4.200 -4.853 1.00 12.90 C ATOM 1052 C LYS A 66 92.342 3.958 -6.186 1.00 13.38 C ATOM 1053 O LYS A 66 91.239 4.427 -6.399 1.00 13.67 O ATOM 1054 CB LYS A 66 92.246 3.618 -3.695 1.00 13.27 C ATOM 1055 CG LYS A 66 93.047 3.739 -2.396 1.00 13.95 C ATOM 1056 CD LYS A 66 92.288 3.048 -1.262 1.00 14.45 C ATOM 1057 CE LYS A 66 93.025 3.277 0.060 1.00 15.14 C ATOM 1058 NZ LYS A 66 92.559 4.611 0.533 1.00 15.83 N ATOM 0 H LYS A 66 92.249 6.117 -4.367 1.00 11.94 H new ATOM 0 HA LYS A 66 94.042 3.738 -4.931 1.00 12.90 H new ATOM 0 HB2 LYS A 66 91.298 4.147 -3.600 1.00 13.27 H new ATOM 0 HB3 LYS A 66 92.009 2.572 -3.892 1.00 13.27 H new ATOM 0 HG2 LYS A 66 94.030 3.285 -2.519 1.00 13.95 H new ATOM 0 HG3 LYS A 66 93.209 4.789 -2.153 1.00 13.95 H new ATOM 0 HD2 LYS A 66 91.273 3.440 -1.197 1.00 14.45 H new ATOM 0 HD3 LYS A 66 92.205 1.980 -1.464 1.00 14.45 H new ATOM 0 HE2 LYS A 66 92.789 2.497 0.784 1.00 15.14 H new ATOM 0 HE3 LYS A 66 94.106 3.264 -0.083 1.00 15.14 H new ATOM 0 HZ1 LYS A 66 93.357 5.128 0.955 1.00 15.83 H new ATOM 0 HZ2 LYS A 66 92.182 5.152 -0.271 1.00 15.83 H new ATOM 0 HZ3 LYS A 66 91.813 4.485 1.246 1.00 15.83 H new ATOM 1072 N ASN A 67 92.966 3.229 -7.079 1.00 13.62 N ATOM 1073 CA ASN A 67 92.329 2.936 -8.399 1.00 14.23 C ATOM 1074 C ASN A 67 92.633 1.497 -8.826 1.00 14.71 C ATOM 1075 O ASN A 67 93.484 0.841 -8.254 1.00 14.96 O ATOM 1076 CB ASN A 67 92.959 3.931 -9.375 1.00 14.36 C ATOM 1077 CG ASN A 67 92.497 5.348 -9.031 1.00 14.64 C ATOM 1078 OD1 ASN A 67 93.305 6.241 -8.867 1.00 14.84 O ATOM 1079 ND2 ASN A 67 91.220 5.595 -8.917 1.00 14.82 N ATOM 0 H ASN A 67 93.893 2.823 -6.949 1.00 13.62 H new ATOM 0 HA ASN A 67 91.244 3.033 -8.364 1.00 14.23 H new ATOM 0 HB2 ASN A 67 94.046 3.869 -9.323 1.00 14.36 H new ATOM 0 HB3 ASN A 67 92.675 3.683 -10.398 1.00 14.36 H new ATOM 0 HD21 ASN A 67 90.901 6.537 -8.690 1.00 14.82 H new ATOM 0 HD22 ASN A 67 90.541 4.846 -9.055 1.00 14.82 H new ATOM 1086 N GLY A 68 91.941 1.007 -9.826 1.00 15.01 N ATOM 1087 CA GLY A 68 92.173 -0.392 -10.300 1.00 15.64 C ATOM 1088 C GLY A 68 92.454 -0.385 -11.803 1.00 16.20 C ATOM 1089 O GLY A 68 91.975 -1.233 -12.534 1.00 16.62 O ATOM 0 H GLY A 68 91.222 1.520 -10.336 1.00 15.01 H new ATOM 0 HA2 GLY A 68 93.014 -0.833 -9.765 1.00 15.64 H new ATOM 0 HA3 GLY A 68 91.300 -1.009 -10.086 1.00 15.64 H new ATOM 1093 N THR A 69 93.226 0.569 -12.268 1.00 16.37 N ATOM 1094 CA THR A 69 93.551 0.640 -13.726 1.00 17.07 C ATOM 1095 C THR A 69 95.065 0.549 -13.936 1.00 17.57 C ATOM 1096 O THR A 69 95.841 0.905 -13.067 1.00 17.69 O ATOM 1097 CB THR A 69 93.027 2.004 -14.185 1.00 17.33 C ATOM 1098 OG1 THR A 69 93.566 3.020 -13.350 1.00 17.17 O ATOM 1099 CG2 THR A 69 91.500 2.025 -14.099 1.00 17.77 C ATOM 0 H THR A 69 93.646 1.303 -11.697 1.00 16.37 H new ATOM 0 HA THR A 69 93.102 -0.179 -14.288 1.00 17.07 H new ATOM 0 HB THR A 69 93.330 2.181 -15.217 1.00 17.33 H new ATOM 0 HG1 THR A 69 93.234 3.894 -13.643 1.00 17.17 H new ATOM 0 HG21 THR A 69 91.130 2.997 -14.426 1.00 17.77 H new ATOM 0 HG22 THR A 69 91.089 1.246 -14.740 1.00 17.77 H new ATOM 0 HG23 THR A 69 91.191 1.848 -13.069 1.00 17.77 H new ATOM 1107 N LYS A 70 95.485 0.074 -15.084 1.00 17.99 N ATOM 1108 CA LYS A 70 96.953 -0.054 -15.361 1.00 18.63 C ATOM 1109 C LYS A 70 97.603 1.332 -15.442 1.00 19.09 C ATOM 1110 O LYS A 70 98.715 1.530 -14.990 1.00 19.41 O ATOM 1111 CB LYS A 70 97.053 -0.772 -16.712 1.00 19.08 C ATOM 1112 CG LYS A 70 98.510 -1.154 -16.984 1.00 19.29 C ATOM 1113 CD LYS A 70 98.617 -1.810 -18.361 1.00 19.79 C ATOM 1114 CE LYS A 70 100.045 -2.317 -18.576 1.00 20.23 C ATOM 1115 NZ LYS A 70 99.917 -3.415 -19.574 1.00 20.45 N ATOM 0 H LYS A 70 94.875 -0.231 -15.842 1.00 17.99 H new ATOM 0 HA LYS A 70 97.468 -0.602 -14.573 1.00 18.63 H new ATOM 0 HB2 LYS A 70 96.427 -1.664 -16.708 1.00 19.08 H new ATOM 0 HB3 LYS A 70 96.681 -0.126 -17.507 1.00 19.08 H new ATOM 0 HG2 LYS A 70 99.143 -0.268 -16.941 1.00 19.29 H new ATOM 0 HG3 LYS A 70 98.867 -1.838 -16.215 1.00 19.29 H new ATOM 0 HD2 LYS A 70 97.911 -2.637 -18.437 1.00 19.79 H new ATOM 0 HD3 LYS A 70 98.353 -1.093 -19.139 1.00 19.79 H new ATOM 0 HE2 LYS A 70 100.695 -1.523 -18.944 1.00 20.23 H new ATOM 0 HE3 LYS A 70 100.480 -2.679 -17.644 1.00 20.23 H new ATOM 0 HZ1 LYS A 70 100.856 -3.814 -19.774 1.00 20.45 H new ATOM 0 HZ2 LYS A 70 99.298 -4.159 -19.194 1.00 20.45 H new ATOM 0 HZ3 LYS A 70 99.507 -3.039 -20.453 1.00 20.45 H new ATOM 1129 N SER A 71 96.912 2.294 -16.019 1.00 19.27 N ATOM 1130 CA SER A 71 97.479 3.678 -16.174 1.00 19.86 C ATOM 1131 C SER A 71 98.863 3.630 -16.859 1.00 20.33 C ATOM 1132 O SER A 71 99.861 3.987 -16.258 1.00 20.36 O ATOM 1133 CB SER A 71 97.587 4.239 -14.750 1.00 19.99 C ATOM 1134 OG SER A 71 97.477 5.656 -14.794 1.00 20.04 O ATOM 0 H SER A 71 95.970 2.177 -16.393 1.00 19.27 H new ATOM 0 HA SER A 71 96.848 4.305 -16.804 1.00 19.86 H new ATOM 0 HB2 SER A 71 96.801 3.821 -14.121 1.00 19.99 H new ATOM 0 HB3 SER A 71 98.539 3.950 -14.304 1.00 19.99 H new ATOM 0 HG SER A 71 97.544 6.018 -13.886 1.00 20.04 H new ATOM 1140 N PRO A 72 98.880 3.185 -18.102 1.00 20.79 N ATOM 1141 CA PRO A 72 100.163 3.060 -18.846 1.00 21.38 C ATOM 1142 C PRO A 72 100.781 4.442 -19.094 1.00 21.55 C ATOM 1143 O PRO A 72 101.990 4.591 -19.124 1.00 21.57 O ATOM 1144 CB PRO A 72 99.765 2.396 -20.166 1.00 21.91 C ATOM 1145 CG PRO A 72 98.297 2.640 -20.309 1.00 21.60 C ATOM 1146 CD PRO A 72 97.731 2.765 -18.921 1.00 20.93 C ATOM 0 HA PRO A 72 100.912 2.486 -18.300 1.00 21.38 H new ATOM 0 HB2 PRO A 72 100.317 2.824 -21.003 1.00 21.91 H new ATOM 0 HB3 PRO A 72 99.986 1.329 -20.151 1.00 21.91 H new ATOM 0 HG2 PRO A 72 98.112 3.548 -20.883 1.00 21.60 H new ATOM 0 HG3 PRO A 72 97.821 1.820 -20.846 1.00 21.60 H new ATOM 0 HD2 PRO A 72 96.925 3.498 -18.883 1.00 20.93 H new ATOM 0 HD3 PRO A 72 97.317 1.819 -18.572 1.00 20.93 H new ATOM 1154 N SER A 73 99.960 5.449 -19.271 1.00 21.78 N ATOM 1155 CA SER A 73 100.488 6.823 -19.534 1.00 22.09 C ATOM 1156 C SER A 73 100.027 7.789 -18.437 1.00 22.31 C ATOM 1157 O SER A 73 98.922 7.686 -17.935 1.00 22.42 O ATOM 1158 CB SER A 73 99.893 7.223 -20.884 1.00 22.22 C ATOM 1159 OG SER A 73 98.487 7.012 -20.860 1.00 22.31 O ATOM 0 H SER A 73 98.943 5.377 -19.244 1.00 21.78 H new ATOM 0 HA SER A 73 101.578 6.851 -19.543 1.00 22.09 H new ATOM 0 HB2 SER A 73 100.111 8.270 -21.095 1.00 22.22 H new ATOM 0 HB3 SER A 73 100.347 6.636 -21.682 1.00 22.22 H new ATOM 0 HG SER A 73 98.078 7.609 -20.199 1.00 22.31 H new ATOM 1165 N THR A 74 100.868 8.724 -18.067 1.00 22.49 N ATOM 1166 CA THR A 74 100.485 9.715 -17.011 1.00 22.84 C ATOM 1167 C THR A 74 99.401 10.659 -17.542 1.00 23.10 C ATOM 1168 O THR A 74 98.518 11.070 -16.814 1.00 23.16 O ATOM 1169 CB THR A 74 101.767 10.493 -16.697 1.00 23.02 C ATOM 1170 OG1 THR A 74 102.821 9.576 -16.432 1.00 23.04 O ATOM 1171 CG2 THR A 74 101.543 11.381 -15.471 1.00 23.31 C ATOM 0 H THR A 74 101.805 8.844 -18.451 1.00 22.49 H new ATOM 0 HA THR A 74 100.081 9.230 -16.123 1.00 22.84 H new ATOM 0 HB THR A 74 102.031 11.117 -17.551 1.00 23.02 H new ATOM 0 HG1 THR A 74 103.643 10.071 -16.232 1.00 23.04 H new ATOM 0 HG21 THR A 74 102.456 11.933 -15.250 1.00 23.31 H new ATOM 0 HG22 THR A 74 100.734 12.083 -15.673 1.00 23.31 H new ATOM 0 HG23 THR A 74 101.278 10.760 -14.615 1.00 23.31 H new ATOM 1179 N ASN A 75 99.468 11.003 -18.811 1.00 23.37 N ATOM 1180 CA ASN A 75 98.451 11.929 -19.426 1.00 23.76 C ATOM 1181 C ASN A 75 98.334 13.230 -18.614 1.00 23.95 C ATOM 1182 O ASN A 75 97.245 13.706 -18.340 1.00 23.99 O ATOM 1183 CB ASN A 75 97.126 11.156 -19.416 1.00 23.98 C ATOM 1184 CG ASN A 75 97.234 9.938 -20.337 1.00 24.18 C ATOM 1185 OD1 ASN A 75 96.945 8.829 -19.933 1.00 24.31 O ATOM 1186 ND2 ASN A 75 97.643 10.098 -21.566 1.00 24.31 N ATOM 0 H ASN A 75 100.190 10.679 -19.454 1.00 23.37 H new ATOM 0 HA ASN A 75 98.735 12.221 -20.437 1.00 23.76 H new ATOM 0 HB2 ASN A 75 96.887 10.837 -18.401 1.00 23.98 H new ATOM 0 HB3 ASN A 75 96.313 11.803 -19.746 1.00 23.98 H new ATOM 0 HD21 ASN A 75 97.720 9.292 -22.187 1.00 24.31 H new ATOM 0 HD22 ASN A 75 97.886 11.029 -21.906 1.00 24.31 H new ATOM 1193 N SER A 76 99.450 13.802 -18.232 1.00 24.18 N ATOM 1194 CA SER A 76 99.420 15.074 -17.448 1.00 24.49 C ATOM 1195 C SER A 76 99.697 16.268 -18.368 1.00 24.83 C ATOM 1196 O SER A 76 100.454 16.166 -19.317 1.00 24.83 O ATOM 1197 CB SER A 76 100.533 14.927 -16.411 1.00 24.46 C ATOM 1198 OG SER A 76 101.791 14.904 -17.073 1.00 24.45 O ATOM 0 H SER A 76 100.383 13.441 -18.431 1.00 24.18 H new ATOM 0 HA SER A 76 98.450 15.250 -16.982 1.00 24.49 H new ATOM 0 HB2 SER A 76 100.497 15.754 -15.702 1.00 24.46 H new ATOM 0 HB3 SER A 76 100.394 14.010 -15.838 1.00 24.46 H new ATOM 0 HG SER A 76 102.507 14.812 -16.411 1.00 24.45 H new ATOM 1204 N THR A 77 99.089 17.396 -18.090 1.00 25.23 N ATOM 1205 CA THR A 77 99.289 18.600 -18.952 1.00 25.70 C ATOM 1206 C THR A 77 99.432 19.856 -18.084 1.00 26.16 C ATOM 1207 O THR A 77 98.921 20.911 -18.416 1.00 26.44 O ATOM 1208 CB THR A 77 98.029 18.679 -19.819 1.00 25.98 C ATOM 1209 OG1 THR A 77 96.880 18.639 -18.984 1.00 25.90 O ATOM 1210 CG2 THR A 77 97.999 17.498 -20.790 1.00 26.02 C ATOM 0 H THR A 77 98.460 17.534 -17.299 1.00 25.23 H new ATOM 0 HA THR A 77 100.194 18.532 -19.556 1.00 25.70 H new ATOM 0 HB THR A 77 98.035 19.610 -20.386 1.00 25.98 H new ATOM 0 HG1 THR A 77 96.072 18.691 -19.536 1.00 25.90 H new ATOM 0 HG21 THR A 77 97.102 17.556 -21.406 1.00 26.02 H new ATOM 0 HG22 THR A 77 98.881 17.530 -21.430 1.00 26.02 H new ATOM 0 HG23 THR A 77 97.993 16.564 -20.227 1.00 26.02 H new ATOM 1218 N LYS A 78 100.123 19.746 -16.975 1.00 26.33 N ATOM 1219 CA LYS A 78 100.290 20.927 -16.066 1.00 26.88 C ATOM 1220 C LYS A 78 101.161 21.993 -16.738 1.00 27.09 C ATOM 1221 O LYS A 78 102.240 21.707 -17.223 1.00 27.17 O ATOM 1222 CB LYS A 78 100.981 20.383 -14.813 1.00 27.15 C ATOM 1223 CG LYS A 78 100.973 21.453 -13.719 1.00 27.08 C ATOM 1224 CD LYS A 78 101.725 20.936 -12.492 1.00 27.59 C ATOM 1225 CE LYS A 78 101.551 21.921 -11.332 1.00 27.61 C ATOM 1226 NZ LYS A 78 102.447 23.064 -11.661 1.00 28.15 N ATOM 0 H LYS A 78 100.579 18.890 -16.659 1.00 26.33 H new ATOM 0 HA LYS A 78 99.335 21.397 -15.828 1.00 26.88 H new ATOM 0 HB2 LYS A 78 100.469 19.486 -14.463 1.00 27.15 H new ATOM 0 HB3 LYS A 78 102.006 20.094 -15.046 1.00 27.15 H new ATOM 0 HG2 LYS A 78 101.440 22.367 -14.086 1.00 27.08 H new ATOM 0 HG3 LYS A 78 99.947 21.705 -13.450 1.00 27.08 H new ATOM 0 HD2 LYS A 78 101.347 19.954 -12.208 1.00 27.59 H new ATOM 0 HD3 LYS A 78 102.783 20.816 -12.725 1.00 27.59 H new ATOM 0 HE2 LYS A 78 100.514 22.245 -11.241 1.00 27.61 H new ATOM 0 HE3 LYS A 78 101.826 21.464 -10.381 1.00 27.61 H new ATOM 0 HZ1 LYS A 78 102.957 23.363 -10.805 1.00 28.15 H new ATOM 0 HZ2 LYS A 78 103.131 22.771 -12.387 1.00 28.15 H new ATOM 0 HZ3 LYS A 78 101.879 23.858 -12.020 1.00 28.15 H new ATOM 1240 N LEU A 79 100.693 23.225 -16.766 1.00 27.25 N ATOM 1241 CA LEU A 79 101.462 24.344 -17.420 1.00 27.55 C ATOM 1242 C LEU A 79 101.843 23.986 -18.865 1.00 27.61 C ATOM 1243 O LEU A 79 101.545 22.909 -19.347 1.00 27.79 O ATOM 1244 CB LEU A 79 102.720 24.543 -16.565 1.00 28.03 C ATOM 1245 CG LEU A 79 102.322 25.019 -15.165 1.00 27.88 C ATOM 1246 CD1 LEU A 79 103.539 24.955 -14.240 1.00 28.02 C ATOM 1247 CD2 LEU A 79 101.818 26.463 -15.240 1.00 28.01 C ATOM 0 H LEU A 79 99.801 23.506 -16.359 1.00 27.25 H new ATOM 0 HA LEU A 79 100.863 25.253 -17.475 1.00 27.55 H new ATOM 0 HB2 LEU A 79 103.277 23.609 -16.497 1.00 28.03 H new ATOM 0 HB3 LEU A 79 103.379 25.274 -17.034 1.00 28.03 H new ATOM 0 HG LEU A 79 101.532 24.377 -14.775 1.00 27.88 H new ATOM 0 HD11 LEU A 79 103.257 25.294 -13.243 1.00 28.02 H new ATOM 0 HD12 LEU A 79 103.901 23.928 -14.185 1.00 28.02 H new ATOM 0 HD13 LEU A 79 104.328 25.597 -14.632 1.00 28.02 H new ATOM 0 HD21 LEU A 79 101.535 26.802 -14.243 1.00 28.01 H new ATOM 0 HD22 LEU A 79 102.608 27.104 -15.630 1.00 28.01 H new ATOM 0 HD23 LEU A 79 100.952 26.512 -15.900 1.00 28.01 H new ATOM 1259 N LYS A 80 102.503 24.893 -19.557 1.00 27.57 N ATOM 1260 CA LYS A 80 102.914 24.644 -20.984 1.00 27.73 C ATOM 1261 C LYS A 80 101.715 24.190 -21.831 1.00 28.02 C ATOM 1262 O LYS A 80 101.419 23.012 -21.920 1.00 28.27 O ATOM 1263 CB LYS A 80 103.978 23.542 -20.919 1.00 27.65 C ATOM 1264 CG LYS A 80 104.633 23.381 -22.293 1.00 27.97 C ATOM 1265 CD LYS A 80 105.661 22.248 -22.240 1.00 27.99 C ATOM 1266 CE LYS A 80 106.391 22.159 -23.582 1.00 28.17 C ATOM 1267 NZ LYS A 80 107.432 23.223 -23.525 1.00 28.49 N ATOM 0 H LYS A 80 102.777 25.804 -19.190 1.00 27.57 H new ATOM 0 HA LYS A 80 103.298 25.550 -21.453 1.00 27.73 H new ATOM 0 HB2 LYS A 80 104.732 23.793 -20.173 1.00 27.65 H new ATOM 0 HB3 LYS A 80 103.523 22.601 -20.609 1.00 27.65 H new ATOM 0 HG2 LYS A 80 103.875 23.163 -23.046 1.00 27.97 H new ATOM 0 HG3 LYS A 80 105.117 24.312 -22.588 1.00 27.97 H new ATOM 0 HD2 LYS A 80 106.375 22.428 -21.436 1.00 27.99 H new ATOM 0 HD3 LYS A 80 105.165 21.303 -22.020 1.00 27.99 H new ATOM 0 HE2 LYS A 80 106.839 21.175 -23.723 1.00 28.17 H new ATOM 0 HE3 LYS A 80 105.707 22.320 -24.415 1.00 28.17 H new ATOM 0 HZ1 LYS A 80 107.428 23.761 -24.415 1.00 28.49 H new ATOM 0 HZ2 LYS A 80 107.229 23.865 -22.732 1.00 28.49 H new ATOM 0 HZ3 LYS A 80 108.366 22.787 -23.388 1.00 28.49 H new ATOM 1281 N SER A 81 101.028 25.121 -22.448 1.00 28.09 N ATOM 1282 CA SER A 81 99.839 24.761 -23.281 1.00 28.48 C ATOM 1283 C SER A 81 100.099 25.106 -24.749 1.00 28.38 C ATOM 1284 O SER A 81 100.691 26.123 -25.061 1.00 28.25 O ATOM 1285 CB SER A 81 98.695 25.609 -22.726 1.00 28.79 C ATOM 1286 OG SER A 81 97.484 25.245 -23.374 1.00 28.72 O ATOM 0 H SER A 81 101.241 26.118 -22.410 1.00 28.09 H new ATOM 0 HA SER A 81 99.613 23.695 -23.240 1.00 28.48 H new ATOM 0 HB2 SER A 81 98.605 25.459 -21.650 1.00 28.79 H new ATOM 0 HB3 SER A 81 98.902 26.667 -22.884 1.00 28.79 H new ATOM 0 HG SER A 81 96.748 25.786 -23.019 1.00 28.72 H new ATOM 1292 N ALA A 82 99.658 24.262 -25.652 1.00 28.52 N ATOM 1293 CA ALA A 82 99.865 24.530 -27.108 1.00 28.54 C ATOM 1294 C ALA A 82 98.521 24.792 -27.792 1.00 29.12 C ATOM 1295 O ALA A 82 97.498 24.907 -27.141 1.00 29.40 O ATOM 1296 CB ALA A 82 100.507 23.255 -27.657 1.00 28.19 C ATOM 0 H ALA A 82 99.162 23.396 -25.440 1.00 28.52 H new ATOM 0 HA ALA A 82 100.487 25.408 -27.283 1.00 28.54 H new ATOM 0 HB1 ALA A 82 100.692 23.371 -28.725 1.00 28.19 H new ATOM 0 HB2 ALA A 82 101.451 23.073 -27.143 1.00 28.19 H new ATOM 0 HB3 ALA A 82 99.837 22.411 -27.495 1.00 28.19 H new ATOM 1302 N GLU A 83 98.518 24.885 -29.100 1.00 29.39 N ATOM 1303 CA GLU A 83 97.243 25.140 -29.840 1.00 30.04 C ATOM 1304 C GLU A 83 96.654 23.827 -30.376 1.00 30.47 C ATOM 1305 O GLU A 83 95.938 23.822 -31.361 1.00 30.32 O ATOM 1306 CB GLU A 83 97.633 26.062 -30.997 1.00 30.25 C ATOM 1307 CG GLU A 83 98.073 27.420 -30.445 1.00 30.48 C ATOM 1308 CD GLU A 83 98.383 28.367 -31.606 1.00 29.99 C ATOM 1309 OE1 GLU A 83 99.429 28.206 -32.213 1.00 29.60 O ATOM 1310 OE2 GLU A 83 97.568 29.236 -31.870 1.00 30.09 O ATOM 0 H GLU A 83 99.346 24.795 -29.688 1.00 29.39 H new ATOM 0 HA GLU A 83 96.482 25.584 -29.198 1.00 30.04 H new ATOM 0 HB2 GLU A 83 98.441 25.614 -31.576 1.00 30.25 H new ATOM 0 HB3 GLU A 83 96.789 26.190 -31.674 1.00 30.25 H new ATOM 0 HG2 GLU A 83 97.287 27.841 -29.818 1.00 30.48 H new ATOM 0 HG3 GLU A 83 98.954 27.300 -29.815 1.00 30.48 H new ATOM 1317 N THR A 84 96.950 22.718 -29.738 1.00 31.09 N ATOM 1318 CA THR A 84 96.412 21.405 -30.207 1.00 31.62 C ATOM 1319 C THR A 84 95.685 20.693 -29.062 1.00 32.19 C ATOM 1320 O THR A 84 96.140 20.699 -27.932 1.00 32.57 O ATOM 1321 CB THR A 84 97.642 20.606 -30.643 1.00 32.02 C ATOM 1322 OG1 THR A 84 98.424 21.392 -31.530 1.00 31.73 O ATOM 1323 CG2 THR A 84 97.198 19.324 -31.350 1.00 32.34 C ATOM 0 H THR A 84 97.543 22.668 -28.910 1.00 31.09 H new ATOM 0 HA THR A 84 95.692 21.518 -31.018 1.00 31.62 H new ATOM 0 HB THR A 84 98.236 20.346 -29.767 1.00 32.02 H new ATOM 0 HG1 THR A 84 99.213 20.883 -31.809 1.00 31.73 H new ATOM 0 HG21 THR A 84 98.076 18.757 -31.660 1.00 32.34 H new ATOM 0 HG22 THR A 84 96.598 18.721 -30.668 1.00 32.34 H new ATOM 0 HG23 THR A 84 96.603 19.579 -32.227 1.00 32.34 H new ATOM 1331 N TYR A 85 94.561 20.083 -29.349 1.00 32.32 N ATOM 1332 CA TYR A 85 93.792 19.365 -28.285 1.00 32.95 C ATOM 1333 C TYR A 85 93.705 17.871 -28.613 1.00 33.15 C ATOM 1334 O TYR A 85 93.479 17.490 -29.747 1.00 32.93 O ATOM 1335 CB TYR A 85 92.402 20.000 -28.305 1.00 32.97 C ATOM 1336 CG TYR A 85 92.406 21.472 -27.963 1.00 33.11 C ATOM 1337 CD1 TYR A 85 92.447 21.884 -26.609 1.00 33.29 C ATOM 1338 CD2 TYR A 85 92.369 22.439 -28.997 1.00 33.14 C ATOM 1339 CE1 TYR A 85 92.451 23.264 -26.288 1.00 33.49 C ATOM 1340 CE2 TYR A 85 92.372 23.819 -28.676 1.00 33.36 C ATOM 1341 CZ TYR A 85 92.414 24.230 -27.321 1.00 33.52 C ATOM 1342 OH TYR A 85 92.418 25.575 -27.009 1.00 33.79 O ATOM 0 H TYR A 85 94.141 20.051 -30.278 1.00 32.32 H new ATOM 0 HA TYR A 85 94.264 19.448 -27.306 1.00 32.95 H new ATOM 0 HB2 TYR A 85 91.965 19.866 -29.294 1.00 32.97 H new ATOM 0 HB3 TYR A 85 91.760 19.473 -27.599 1.00 32.97 H new ATOM 0 HD1 TYR A 85 92.475 21.146 -25.821 1.00 33.29 H new ATOM 0 HD2 TYR A 85 92.339 22.125 -30.030 1.00 33.14 H new ATOM 0 HE1 TYR A 85 92.482 23.578 -25.255 1.00 33.49 H new ATOM 0 HE2 TYR A 85 92.342 24.557 -29.464 1.00 33.36 H new ATOM 0 HH TYR A 85 92.391 26.102 -27.835 1.00 33.79 H new ATOM 1352 N SER A 86 93.881 17.027 -27.625 1.00 33.64 N ATOM 1353 CA SER A 86 93.800 15.553 -27.861 1.00 33.95 C ATOM 1354 C SER A 86 92.821 14.912 -26.873 1.00 34.31 C ATOM 1355 O SER A 86 92.773 15.277 -25.712 1.00 34.38 O ATOM 1356 CB SER A 86 95.219 15.036 -27.619 1.00 34.22 C ATOM 1357 OG SER A 86 95.270 13.648 -27.922 1.00 34.09 O ATOM 0 H SER A 86 94.078 17.298 -26.662 1.00 33.64 H new ATOM 0 HA SER A 86 93.443 15.314 -28.863 1.00 33.95 H new ATOM 0 HB2 SER A 86 95.929 15.582 -28.241 1.00 34.22 H new ATOM 0 HB3 SER A 86 95.508 15.205 -26.582 1.00 34.22 H new ATOM 0 HG SER A 86 96.178 13.313 -27.770 1.00 34.09 H new ATOM 1363 N SER A 87 92.042 13.961 -27.330 1.00 34.62 N ATOM 1364 CA SER A 87 91.061 13.284 -26.426 1.00 35.06 C ATOM 1365 C SER A 87 91.210 11.763 -26.528 1.00 35.40 C ATOM 1366 O SER A 87 91.371 11.223 -27.605 1.00 35.72 O ATOM 1367 CB SER A 87 89.688 13.723 -26.934 1.00 35.25 C ATOM 1368 OG SER A 87 88.682 13.210 -26.071 1.00 35.42 O ATOM 0 H SER A 87 92.044 13.624 -28.293 1.00 34.62 H new ATOM 0 HA SER A 87 91.213 13.548 -25.379 1.00 35.06 H new ATOM 0 HB2 SER A 87 89.632 14.811 -26.971 1.00 35.25 H new ATOM 0 HB3 SER A 87 89.531 13.361 -27.950 1.00 35.25 H new ATOM 0 HG SER A 87 87.800 13.491 -26.393 1.00 35.42 H new ATOM 1374 N LYS A 88 91.154 11.075 -25.406 1.00 35.42 N ATOM 1375 CA LYS A 88 91.306 9.577 -25.386 1.00 35.83 C ATOM 1376 C LYS A 88 92.625 9.138 -26.057 1.00 36.08 C ATOM 1377 O LYS A 88 93.621 8.936 -25.385 1.00 36.15 O ATOM 1378 CB LYS A 88 90.078 9.021 -26.125 1.00 35.84 C ATOM 1379 CG LYS A 88 88.817 9.321 -25.313 1.00 35.86 C ATOM 1380 CD LYS A 88 87.590 8.792 -26.059 1.00 35.97 C ATOM 1381 CE LYS A 88 87.511 7.272 -25.902 1.00 36.03 C ATOM 1382 NZ LYS A 88 86.834 7.056 -24.592 1.00 36.18 N ATOM 0 H LYS A 88 91.007 11.495 -24.488 1.00 35.42 H new ATOM 0 HA LYS A 88 91.356 9.194 -24.367 1.00 35.83 H new ATOM 0 HB2 LYS A 88 90.002 9.470 -27.115 1.00 35.84 H new ATOM 0 HB3 LYS A 88 90.183 7.946 -26.270 1.00 35.84 H new ATOM 0 HG2 LYS A 88 88.886 8.856 -24.330 1.00 35.86 H new ATOM 0 HG3 LYS A 88 88.723 10.395 -25.152 1.00 35.86 H new ATOM 0 HD2 LYS A 88 86.685 9.256 -25.667 1.00 35.97 H new ATOM 0 HD3 LYS A 88 87.652 9.056 -27.115 1.00 35.97 H new ATOM 0 HE2 LYS A 88 86.947 6.819 -26.718 1.00 36.03 H new ATOM 0 HE3 LYS A 88 88.504 6.822 -25.913 1.00 36.03 H new ATOM 0 HZ1 LYS A 88 87.230 6.212 -24.131 1.00 36.18 H new ATOM 0 HZ2 LYS A 88 86.984 7.885 -23.983 1.00 36.18 H new ATOM 0 HZ3 LYS A 88 85.815 6.920 -24.746 1.00 36.18 H new ATOM 1396 N ASN A 89 92.645 8.989 -27.364 1.00 36.27 N ATOM 1397 CA ASN A 89 93.896 8.553 -28.059 1.00 36.59 C ATOM 1398 C ASN A 89 93.985 9.195 -29.450 1.00 37.05 C ATOM 1399 O ASN A 89 92.979 9.454 -30.086 1.00 37.24 O ATOM 1400 CB ASN A 89 93.793 7.021 -28.160 1.00 36.76 C ATOM 1401 CG ASN A 89 92.556 6.605 -28.977 1.00 36.47 C ATOM 1402 OD1 ASN A 89 91.690 7.411 -29.257 1.00 36.16 O ATOM 1403 ND2 ASN A 89 92.442 5.366 -29.371 1.00 36.63 N ATOM 0 H ASN A 89 91.846 9.152 -27.977 1.00 36.27 H new ATOM 0 HA ASN A 89 94.794 8.857 -27.520 1.00 36.59 H new ATOM 0 HB2 ASN A 89 94.693 6.622 -28.628 1.00 36.76 H new ATOM 0 HB3 ASN A 89 93.735 6.590 -27.161 1.00 36.76 H new ATOM 0 HD21 ASN A 89 91.628 5.076 -29.913 1.00 36.63 H new ATOM 0 HD22 ASN A 89 93.167 4.688 -29.137 1.00 36.63 H new ATOM 1410 N LYS A 90 95.182 9.450 -29.921 1.00 37.29 N ATOM 1411 CA LYS A 90 95.350 10.082 -31.270 1.00 37.80 C ATOM 1412 C LYS A 90 94.881 9.124 -32.369 1.00 37.91 C ATOM 1413 O LYS A 90 94.270 9.534 -33.341 1.00 37.86 O ATOM 1414 CB LYS A 90 96.849 10.363 -31.410 1.00 38.18 C ATOM 1415 CG LYS A 90 97.268 11.426 -30.392 1.00 38.59 C ATOM 1416 CD LYS A 90 98.735 11.799 -30.618 1.00 39.18 C ATOM 1417 CE LYS A 90 99.193 12.761 -29.518 1.00 39.33 C ATOM 1418 NZ LYS A 90 99.581 11.883 -28.379 1.00 39.54 N ATOM 0 H LYS A 90 96.052 9.248 -29.429 1.00 37.29 H new ATOM 0 HA LYS A 90 94.759 10.993 -31.366 1.00 37.80 H new ATOM 0 HB2 LYS A 90 97.418 9.447 -31.250 1.00 38.18 H new ATOM 0 HB3 LYS A 90 97.073 10.704 -32.421 1.00 38.18 H new ATOM 0 HG2 LYS A 90 96.637 12.309 -30.492 1.00 38.59 H new ATOM 0 HG3 LYS A 90 97.129 11.049 -29.379 1.00 38.59 H new ATOM 0 HD2 LYS A 90 99.354 10.902 -30.612 1.00 39.18 H new ATOM 0 HD3 LYS A 90 98.856 12.264 -31.596 1.00 39.18 H new ATOM 0 HE2 LYS A 90 100.033 13.371 -29.851 1.00 39.33 H new ATOM 0 HE3 LYS A 90 98.394 13.446 -29.234 1.00 39.33 H new ATOM 0 HZ1 LYS A 90 99.338 12.350 -27.482 1.00 39.54 H new ATOM 0 HZ2 LYS A 90 99.071 10.979 -28.448 1.00 39.54 H new ATOM 0 HZ3 LYS A 90 100.605 11.705 -28.411 1.00 39.54 H new ATOM 1432 N TRP A 91 95.165 7.853 -32.221 1.00 38.11 N ATOM 1433 CA TRP A 91 94.747 6.855 -33.253 1.00 38.30 C ATOM 1434 C TRP A 91 93.760 5.851 -32.650 1.00 38.52 C ATOM 1435 O TRP A 91 93.958 5.360 -31.553 1.00 38.79 O ATOM 1436 CB TRP A 91 96.039 6.151 -33.668 1.00 38.40 C ATOM 1437 CG TRP A 91 97.016 7.053 -34.352 1.00 38.71 C ATOM 1438 CD1 TRP A 91 98.105 7.608 -33.766 1.00 38.89 C ATOM 1439 CD2 TRP A 91 97.016 7.512 -35.735 1.00 38.95 C ATOM 1440 NE1 TRP A 91 98.776 8.381 -34.699 1.00 39.23 N ATOM 1441 CE2 TRP A 91 98.150 8.358 -35.929 1.00 39.28 C ATOM 1442 CE3 TRP A 91 96.151 7.283 -36.841 1.00 38.98 C ATOM 1443 CZ2 TRP A 91 98.420 8.959 -37.177 1.00 39.62 C ATOM 1444 CZ3 TRP A 91 96.417 7.885 -38.098 1.00 39.32 C ATOM 1445 CH2 TRP A 91 97.550 8.721 -38.266 1.00 39.64 C ATOM 0 H TRP A 91 95.671 7.463 -31.426 1.00 38.11 H new ATOM 0 HA TRP A 91 94.246 7.323 -34.100 1.00 38.30 H new ATOM 0 HB2 TRP A 91 96.510 5.722 -32.784 1.00 38.40 H new ATOM 0 HB3 TRP A 91 95.795 5.322 -34.333 1.00 38.40 H new ATOM 0 HD1 TRP A 91 98.402 7.470 -32.737 1.00 38.89 H new ATOM 0 HE1 TRP A 91 99.629 8.904 -34.501 1.00 39.23 H new ATOM 0 HE3 TRP A 91 95.286 6.647 -36.723 1.00 38.98 H new ATOM 0 HZ2 TRP A 91 99.284 9.595 -37.299 1.00 39.62 H new ATOM 0 HZ3 TRP A 91 95.753 7.706 -38.931 1.00 39.32 H new ATOM 0 HH2 TRP A 91 97.748 9.176 -39.225 1.00 39.64 H new ATOM 1456 N SER A 92 92.701 5.547 -33.361 1.00 38.48 N ATOM 1457 CA SER A 92 91.700 4.562 -32.847 1.00 38.76 C ATOM 1458 C SER A 92 91.465 3.457 -33.881 1.00 39.16 C ATOM 1459 O SER A 92 91.486 3.699 -35.073 1.00 39.15 O ATOM 1460 CB SER A 92 90.423 5.374 -32.632 1.00 38.52 C ATOM 1461 OG SER A 92 90.684 6.425 -31.712 1.00 38.62 O ATOM 0 H SER A 92 92.487 5.940 -34.278 1.00 38.48 H new ATOM 0 HA SER A 92 92.033 4.074 -31.931 1.00 38.76 H new ATOM 0 HB2 SER A 92 90.075 5.783 -33.580 1.00 38.52 H new ATOM 0 HB3 SER A 92 89.629 4.731 -32.252 1.00 38.52 H new ATOM 0 HG SER A 92 89.867 6.949 -31.573 1.00 38.62 H new ATOM 1467 N MET A 93 91.243 2.240 -33.427 1.00 39.58 N ATOM 1468 CA MET A 93 90.990 1.089 -34.362 1.00 40.05 C ATOM 1469 C MET A 93 92.096 0.984 -35.423 1.00 40.20 C ATOM 1470 O MET A 93 91.854 0.571 -36.543 1.00 40.21 O ATOM 1471 CB MET A 93 89.636 1.382 -35.021 1.00 40.53 C ATOM 1472 CG MET A 93 88.529 1.326 -33.966 1.00 40.67 C ATOM 1473 SD MET A 93 88.224 -0.396 -33.499 1.00 41.23 S ATOM 1474 CE MET A 93 87.819 -0.091 -31.761 1.00 41.15 C ATOM 0 H MET A 93 91.226 1.993 -32.437 1.00 39.58 H new ATOM 0 HA MET A 93 90.984 0.139 -33.828 1.00 40.05 H new ATOM 0 HB2 MET A 93 89.654 2.365 -35.492 1.00 40.53 H new ATOM 0 HB3 MET A 93 89.439 0.655 -35.809 1.00 40.53 H new ATOM 0 HG2 MET A 93 88.818 1.906 -33.089 1.00 40.67 H new ATOM 0 HG3 MET A 93 87.616 1.775 -34.358 1.00 40.67 H new ATOM 0 HE1 MET A 93 87.592 -1.037 -31.269 1.00 41.15 H new ATOM 0 HE2 MET A 93 88.668 0.381 -31.267 1.00 41.15 H new ATOM 0 HE3 MET A 93 86.952 0.567 -31.699 1.00 41.15 H new ATOM 1484 N ASP A 94 93.304 1.356 -35.072 1.00 40.38 N ATOM 1485 CA ASP A 94 94.436 1.266 -36.044 1.00 40.61 C ATOM 1486 C ASP A 94 95.195 -0.050 -35.854 1.00 40.70 C ATOM 1487 O ASP A 94 95.799 -0.216 -34.806 1.00 40.74 O ATOM 1488 CB ASP A 94 95.339 2.457 -35.717 1.00 40.80 C ATOM 1489 CG ASP A 94 94.662 3.752 -36.167 1.00 40.39 C ATOM 1490 OD1 ASP A 94 93.940 4.328 -35.371 1.00 40.23 O ATOM 1491 OD2 ASP A 94 94.878 4.147 -37.301 1.00 40.28 O ATOM 1492 OXT ASP A 94 95.158 -0.869 -36.757 1.00 40.77 O ATOM 0 H ASP A 94 93.554 1.719 -34.152 1.00 40.38 H new ATOM 0 HA ASP A 94 94.092 1.288 -37.078 1.00 40.61 H new ATOM 0 HB2 ASP A 94 95.538 2.492 -34.646 1.00 40.80 H new ATOM 0 HB3 ASP A 94 96.301 2.345 -36.217 1.00 40.80 H new TER 1497 ASP A 94 ATOM 1498 N GLY B 240 93.619 -17.577 -18.729 1.00 23.28 N ATOM 1499 CA GLY B 240 92.133 -17.602 -18.617 1.00 22.81 C ATOM 1500 C GLY B 240 91.688 -16.643 -17.511 1.00 22.13 C ATOM 1501 O GLY B 240 92.025 -15.473 -17.522 1.00 21.98 O ATOM 0 HA2 GLY B 240 91.681 -17.314 -19.566 1.00 22.81 H new ATOM 0 HA3 GLY B 240 91.791 -18.613 -18.395 1.00 22.81 H new ATOM 1507 N ALA B 241 90.932 -17.133 -16.558 1.00 21.82 N ATOM 1508 CA ALA B 241 90.456 -16.258 -15.443 1.00 21.26 C ATOM 1509 C ALA B 241 91.264 -16.535 -14.172 1.00 20.57 C ATOM 1510 O ALA B 241 91.661 -17.656 -13.913 1.00 20.66 O ATOM 1511 CB ALA B 241 88.989 -16.640 -15.239 1.00 21.55 C ATOM 0 H ALA B 241 90.624 -18.104 -16.505 1.00 21.82 H new ATOM 0 HA ALA B 241 90.574 -15.198 -15.670 1.00 21.26 H new ATOM 0 HB1 ALA B 241 88.565 -16.040 -14.434 1.00 21.55 H new ATOM 0 HB2 ALA B 241 88.434 -16.457 -16.159 1.00 21.55 H new ATOM 0 HB3 ALA B 241 88.921 -17.696 -14.978 1.00 21.55 H new ATOM 1517 N THR B 242 91.509 -15.518 -13.381 1.00 19.99 N ATOM 1518 CA THR B 242 92.293 -15.706 -12.121 1.00 19.42 C ATOM 1519 C THR B 242 91.529 -15.113 -10.932 1.00 18.74 C ATOM 1520 O THR B 242 90.602 -14.343 -11.104 1.00 18.65 O ATOM 1521 CB THR B 242 93.608 -14.952 -12.342 1.00 19.25 C ATOM 1522 OG1 THR B 242 93.331 -13.597 -12.676 1.00 19.57 O ATOM 1523 CG2 THR B 242 94.399 -15.614 -13.474 1.00 19.39 C ATOM 0 H THR B 242 91.198 -14.562 -13.555 1.00 19.99 H new ATOM 0 HA THR B 242 92.465 -16.759 -11.900 1.00 19.42 H new ATOM 0 HB THR B 242 94.200 -14.983 -11.427 1.00 19.25 H new ATOM 0 HG1 THR B 242 93.454 -13.033 -11.884 1.00 19.57 H new ATOM 0 HG21 THR B 242 95.334 -15.075 -13.628 1.00 19.39 H new ATOM 0 HG22 THR B 242 94.616 -16.649 -13.209 1.00 19.39 H new ATOM 0 HG23 THR B 242 93.811 -15.590 -14.391 1.00 19.39 H new ATOM 1531 N THR B 243 91.915 -15.469 -9.730 1.00 18.40 N ATOM 1532 CA THR B 243 91.213 -14.935 -8.516 1.00 17.87 C ATOM 1533 C THR B 243 91.423 -13.422 -8.401 1.00 17.24 C ATOM 1534 O THR B 243 90.520 -12.689 -8.040 1.00 17.27 O ATOM 1535 CB THR B 243 91.852 -15.656 -7.324 1.00 18.17 C ATOM 1536 OG1 THR B 243 91.850 -17.057 -7.565 1.00 18.50 O ATOM 1537 CG2 THR B 243 91.056 -15.355 -6.053 1.00 18.48 C ATOM 0 H THR B 243 92.687 -16.107 -9.535 1.00 18.40 H new ATOM 0 HA THR B 243 90.137 -15.105 -8.562 1.00 17.87 H new ATOM 0 HB THR B 243 92.877 -15.308 -7.197 1.00 18.17 H new ATOM 0 HG1 THR B 243 92.260 -17.520 -6.805 1.00 18.50 H new ATOM 0 HG21 THR B 243 91.513 -15.869 -5.207 1.00 18.48 H new ATOM 0 HG22 THR B 243 91.058 -14.281 -5.869 1.00 18.48 H new ATOM 0 HG23 THR B 243 90.030 -15.700 -6.176 1.00 18.48 H new ATOM 1545 N LYS B 244 92.610 -12.953 -8.708 1.00 16.81 N ATOM 1546 CA LYS B 244 92.890 -11.487 -8.627 1.00 16.33 C ATOM 1547 C LYS B 244 92.902 -10.874 -10.030 1.00 15.61 C ATOM 1548 O LYS B 244 93.512 -11.405 -10.941 1.00 15.48 O ATOM 1549 CB LYS B 244 94.273 -11.382 -7.984 1.00 16.52 C ATOM 1550 CG LYS B 244 94.199 -11.850 -6.529 1.00 16.61 C ATOM 1551 CD LYS B 244 95.582 -11.743 -5.885 1.00 16.99 C ATOM 1552 CE LYS B 244 95.923 -10.269 -5.646 1.00 17.33 C ATOM 1553 NZ LYS B 244 96.943 -10.282 -4.561 1.00 17.83 N ATOM 0 H LYS B 244 93.398 -13.526 -9.012 1.00 16.81 H new ATOM 0 HA LYS B 244 92.133 -10.953 -8.053 1.00 16.33 H new ATOM 0 HB2 LYS B 244 94.989 -11.990 -8.536 1.00 16.52 H new ATOM 0 HB3 LYS B 244 94.628 -10.353 -8.028 1.00 16.52 H new ATOM 0 HG2 LYS B 244 93.482 -11.243 -5.977 1.00 16.61 H new ATOM 0 HG3 LYS B 244 93.845 -12.880 -6.485 1.00 16.61 H new ATOM 0 HD2 LYS B 244 95.598 -12.288 -4.941 1.00 16.99 H new ATOM 0 HD3 LYS B 244 96.332 -12.200 -6.531 1.00 16.99 H new ATOM 0 HE2 LYS B 244 96.314 -9.802 -6.550 1.00 17.33 H new ATOM 0 HE3 LYS B 244 95.040 -9.702 -5.351 1.00 17.33 H new ATOM 0 HZ1 LYS B 244 97.228 -9.306 -4.340 1.00 17.83 H new ATOM 0 HZ2 LYS B 244 96.540 -10.726 -3.711 1.00 17.83 H new ATOM 0 HZ3 LYS B 244 97.775 -10.823 -4.873 1.00 17.83 H new ATOM 1567 N GLU B 245 92.233 -9.760 -10.207 1.00 15.28 N ATOM 1568 CA GLU B 245 92.204 -9.097 -11.551 1.00 14.73 C ATOM 1569 C GLU B 245 93.589 -8.542 -11.899 1.00 14.23 C ATOM 1570 O GLU B 245 93.990 -8.534 -13.048 1.00 14.20 O ATOM 1571 CB GLU B 245 91.188 -7.957 -11.424 1.00 14.64 C ATOM 1572 CG GLU B 245 89.787 -8.541 -11.220 1.00 15.09 C ATOM 1573 CD GLU B 245 88.760 -7.406 -11.167 1.00 15.05 C ATOM 1574 OE1 GLU B 245 88.880 -6.483 -11.956 1.00 14.69 O ATOM 1575 OE2 GLU B 245 87.869 -7.481 -10.335 1.00 15.50 O ATOM 0 H GLU B 245 91.705 -9.280 -9.478 1.00 15.28 H new ATOM 0 HA GLU B 245 91.930 -9.795 -12.342 1.00 14.73 H new ATOM 0 HB2 GLU B 245 91.451 -7.313 -10.585 1.00 14.64 H new ATOM 0 HB3 GLU B 245 91.208 -7.337 -12.320 1.00 14.64 H new ATOM 0 HG2 GLU B 245 89.546 -9.226 -12.033 1.00 15.09 H new ATOM 0 HG3 GLU B 245 89.754 -9.119 -10.296 1.00 15.09 H new ATOM 1582 N LYS B 246 94.317 -8.080 -10.911 1.00 14.02 N ATOM 1583 CA LYS B 246 95.676 -7.515 -11.169 1.00 13.74 C ATOM 1584 C LYS B 246 96.749 -8.577 -10.910 1.00 12.91 C ATOM 1585 O LYS B 246 96.737 -9.245 -9.892 1.00 12.83 O ATOM 1586 CB LYS B 246 95.819 -6.355 -10.183 1.00 14.27 C ATOM 1587 CG LYS B 246 97.075 -5.548 -10.518 1.00 14.84 C ATOM 1588 CD LYS B 246 97.253 -4.428 -9.492 1.00 15.50 C ATOM 1589 CE LYS B 246 98.425 -3.536 -9.906 1.00 16.10 C ATOM 1590 NZ LYS B 246 97.850 -2.580 -10.894 1.00 16.68 N ATOM 0 H LYS B 246 94.026 -8.071 -9.934 1.00 14.02 H new ATOM 0 HA LYS B 246 95.797 -7.188 -12.202 1.00 13.74 H new ATOM 0 HB2 LYS B 246 94.939 -5.714 -10.231 1.00 14.27 H new ATOM 0 HB3 LYS B 246 95.881 -6.736 -9.164 1.00 14.27 H new ATOM 0 HG2 LYS B 246 97.949 -6.199 -10.516 1.00 14.84 H new ATOM 0 HG3 LYS B 246 96.993 -5.127 -11.520 1.00 14.84 H new ATOM 0 HD2 LYS B 246 96.340 -3.837 -9.421 1.00 15.50 H new ATOM 0 HD3 LYS B 246 97.436 -4.851 -8.504 1.00 15.50 H new ATOM 0 HE2 LYS B 246 98.845 -3.012 -9.047 1.00 16.10 H new ATOM 0 HE3 LYS B 246 99.231 -4.122 -10.347 1.00 16.10 H new ATOM 0 HZ1 LYS B 246 98.535 -2.419 -11.660 1.00 16.68 H new ATOM 0 HZ2 LYS B 246 96.973 -2.975 -11.290 1.00 16.68 H new ATOM 0 HZ3 LYS B 246 97.640 -1.677 -10.422 1.00 16.68 H new ATOM 1604 N ASN B 247 97.675 -8.733 -11.826 1.00 12.46 N ATOM 1605 CA ASN B 247 98.765 -9.740 -11.641 1.00 11.82 C ATOM 1606 C ASN B 247 100.128 -9.101 -11.930 1.00 10.98 C ATOM 1607 O ASN B 247 101.020 -9.149 -11.108 1.00 10.73 O ATOM 1608 CB ASN B 247 98.464 -10.843 -12.658 1.00 12.05 C ATOM 1609 CG ASN B 247 99.260 -12.102 -12.306 1.00 12.51 C ATOM 1610 OD1 ASN B 247 100.359 -12.020 -11.793 1.00 12.67 O ATOM 1611 ND2 ASN B 247 98.749 -13.274 -12.563 1.00 12.92 N ATOM 0 H ASN B 247 97.722 -8.204 -12.697 1.00 12.46 H new ATOM 0 HA ASN B 247 98.803 -10.125 -10.622 1.00 11.82 H new ATOM 0 HB2 ASN B 247 97.397 -11.065 -12.662 1.00 12.05 H new ATOM 0 HB3 ASN B 247 98.723 -10.506 -13.662 1.00 12.05 H new ATOM 0 HD21 ASN B 247 99.271 -14.120 -12.334 1.00 12.92 H new ATOM 0 HD22 ASN B 247 97.827 -13.345 -12.993 1.00 12.92 H new ATOM 1618 N ILE B 248 100.275 -8.504 -13.100 1.00 10.74 N ATOM 1619 CA ILE B 248 101.569 -7.838 -13.522 1.00 10.12 C ATOM 1620 C ILE B 248 102.811 -8.638 -13.075 1.00 9.27 C ATOM 1621 O ILE B 248 102.728 -9.821 -12.798 1.00 9.18 O ATOM 1622 CB ILE B 248 101.546 -6.418 -12.907 1.00 10.48 C ATOM 1623 CG1 ILE B 248 101.543 -6.479 -11.374 1.00 11.39 C ATOM 1624 CG2 ILE B 248 100.296 -5.670 -13.379 1.00 10.17 C ATOM 1625 CD1 ILE B 248 101.900 -5.104 -10.807 1.00 11.91 C ATOM 0 H ILE B 248 99.534 -8.448 -13.799 1.00 10.74 H new ATOM 0 HA ILE B 248 101.641 -7.793 -14.609 1.00 10.12 H new ATOM 0 HB ILE B 248 102.444 -5.894 -13.235 1.00 10.48 H new ATOM 0 HG12 ILE B 248 100.562 -6.789 -11.014 1.00 11.39 H new ATOM 0 HG13 ILE B 248 102.260 -7.224 -11.028 1.00 11.39 H new ATOM 0 HG21 ILE B 248 100.284 -4.671 -12.944 1.00 10.17 H new ATOM 0 HG22 ILE B 248 100.307 -5.592 -14.466 1.00 10.17 H new ATOM 0 HG23 ILE B 248 99.406 -6.214 -13.064 1.00 10.17 H new ATOM 0 HD11 ILE B 248 101.898 -5.148 -9.718 1.00 11.91 H new ATOM 0 HD12 ILE B 248 102.890 -4.812 -11.156 1.00 11.91 H new ATOM 0 HD13 ILE B 248 101.167 -4.371 -11.142 1.00 11.91 H new ATOM 1637 N SER B 249 103.958 -8.000 -13.010 1.00 8.89 N ATOM 1638 CA SER B 249 105.195 -8.707 -12.562 1.00 8.31 C ATOM 1639 C SER B 249 106.012 -7.806 -11.629 1.00 7.71 C ATOM 1640 O SER B 249 106.191 -8.119 -10.468 1.00 8.02 O ATOM 1641 CB SER B 249 105.973 -8.997 -13.845 1.00 8.69 C ATOM 1642 OG SER B 249 106.183 -7.781 -14.551 1.00 9.03 O ATOM 0 H SER B 249 104.087 -7.017 -13.250 1.00 8.89 H new ATOM 0 HA SER B 249 104.971 -9.618 -12.007 1.00 8.31 H new ATOM 0 HB2 SER B 249 106.929 -9.463 -13.607 1.00 8.69 H new ATOM 0 HB3 SER B 249 105.421 -9.702 -14.467 1.00 8.69 H new ATOM 0 HG SER B 249 106.683 -7.963 -15.374 1.00 9.03 H new ATOM 1648 N VAL B 250 106.502 -6.693 -12.145 1.00 7.13 N ATOM 1649 CA VAL B 250 107.286 -5.689 -11.325 1.00 6.86 C ATOM 1650 C VAL B 250 108.268 -6.374 -10.352 1.00 5.95 C ATOM 1651 O VAL B 250 108.635 -7.520 -10.538 1.00 5.70 O ATOM 1652 CB VAL B 250 106.240 -4.824 -10.577 1.00 7.51 C ATOM 1653 CG1 VAL B 250 105.278 -4.190 -11.584 1.00 7.86 C ATOM 1654 CG2 VAL B 250 105.434 -5.662 -9.576 1.00 8.13 C ATOM 0 H VAL B 250 106.390 -6.430 -13.124 1.00 7.13 H new ATOM 0 HA VAL B 250 107.912 -5.071 -11.969 1.00 6.86 H new ATOM 0 HB VAL B 250 106.777 -4.050 -10.029 1.00 7.51 H new ATOM 0 HG11 VAL B 250 104.544 -3.583 -11.054 1.00 7.86 H new ATOM 0 HG12 VAL B 250 105.838 -3.561 -12.276 1.00 7.86 H new ATOM 0 HG13 VAL B 250 104.765 -4.974 -12.141 1.00 7.86 H new ATOM 0 HG21 VAL B 250 104.709 -5.025 -9.069 1.00 8.13 H new ATOM 0 HG22 VAL B 250 104.910 -6.457 -10.106 1.00 8.13 H new ATOM 0 HG23 VAL B 250 106.109 -6.100 -8.841 1.00 8.13 H new ATOM 1664 N ASP B 251 108.694 -5.678 -9.322 1.00 5.80 N ATOM 1665 CA ASP B 251 109.632 -6.290 -8.329 1.00 5.27 C ATOM 1666 C ASP B 251 109.615 -5.492 -7.018 1.00 4.15 C ATOM 1667 O ASP B 251 110.186 -4.421 -6.922 1.00 3.99 O ATOM 1668 CB ASP B 251 111.023 -6.246 -8.987 1.00 6.01 C ATOM 1669 CG ASP B 251 111.386 -4.810 -9.393 1.00 5.93 C ATOM 1670 OD1 ASP B 251 110.744 -4.290 -10.290 1.00 5.81 O ATOM 1671 OD2 ASP B 251 112.299 -4.261 -8.800 1.00 6.36 O ATOM 0 H ASP B 251 108.431 -4.712 -9.128 1.00 5.80 H new ATOM 0 HA ASP B 251 109.348 -7.312 -8.076 1.00 5.27 H new ATOM 0 HB2 ASP B 251 111.771 -6.634 -8.295 1.00 6.01 H new ATOM 0 HB3 ASP B 251 111.036 -6.892 -9.865 1.00 6.01 H new ATOM 1676 N VAL B 252 108.958 -6.013 -6.010 1.00 3.81 N ATOM 1677 CA VAL B 252 108.887 -5.302 -4.695 1.00 3.15 C ATOM 1678 C VAL B 252 108.465 -6.284 -3.587 1.00 2.37 C ATOM 1679 O VAL B 252 107.310 -6.353 -3.207 1.00 2.65 O ATOM 1680 CB VAL B 252 107.853 -4.174 -4.894 1.00 3.65 C ATOM 1681 CG1 VAL B 252 106.481 -4.750 -5.285 1.00 3.88 C ATOM 1682 CG2 VAL B 252 107.715 -3.365 -3.600 1.00 4.58 C ATOM 0 H VAL B 252 108.465 -6.905 -6.042 1.00 3.81 H new ATOM 0 HA VAL B 252 109.849 -4.892 -4.386 1.00 3.15 H new ATOM 0 HB VAL B 252 108.202 -3.528 -5.699 1.00 3.65 H new ATOM 0 HG11 VAL B 252 105.769 -3.935 -5.420 1.00 3.88 H new ATOM 0 HG12 VAL B 252 106.573 -5.309 -6.216 1.00 3.88 H new ATOM 0 HG13 VAL B 252 106.127 -5.414 -4.497 1.00 3.88 H new ATOM 0 HG21 VAL B 252 106.984 -2.569 -3.744 1.00 4.58 H new ATOM 0 HG22 VAL B 252 107.384 -4.021 -2.795 1.00 4.58 H new ATOM 0 HG23 VAL B 252 108.679 -2.929 -3.339 1.00 4.58 H new ATOM 1692 N ASP B 253 109.402 -7.042 -3.070 1.00 2.01 N ATOM 1693 CA ASP B 253 109.065 -8.057 -2.022 1.00 1.62 C ATOM 1694 C ASP B 253 108.929 -7.384 -0.653 1.00 1.35 C ATOM 1695 O ASP B 253 109.692 -6.499 -0.311 1.00 1.30 O ATOM 1696 CB ASP B 253 110.235 -9.046 -2.021 1.00 2.25 C ATOM 1697 CG ASP B 253 110.275 -9.803 -3.351 1.00 2.54 C ATOM 1698 OD1 ASP B 253 109.219 -10.189 -3.824 1.00 2.29 O ATOM 1699 OD2 ASP B 253 111.362 -9.984 -3.874 1.00 3.47 O ATOM 0 H ASP B 253 110.388 -7.001 -3.329 1.00 2.01 H new ATOM 0 HA ASP B 253 108.117 -8.554 -2.227 1.00 1.62 H new ATOM 0 HB2 ASP B 253 111.173 -8.513 -1.867 1.00 2.25 H new ATOM 0 HB3 ASP B 253 110.128 -9.749 -1.195 1.00 2.25 H new ATOM 1704 N ALA B 254 107.962 -7.802 0.127 1.00 1.31 N ATOM 1705 CA ALA B 254 107.776 -7.211 1.493 1.00 1.24 C ATOM 1706 C ALA B 254 108.956 -7.572 2.408 1.00 0.98 C ATOM 1707 O ALA B 254 109.231 -6.880 3.371 1.00 0.94 O ATOM 1708 CB ALA B 254 106.480 -7.825 2.030 1.00 1.46 C ATOM 0 H ALA B 254 107.291 -8.529 -0.122 1.00 1.31 H new ATOM 0 HA ALA B 254 107.728 -6.123 1.455 1.00 1.24 H new ATOM 0 HB1 ALA B 254 106.280 -7.437 3.029 1.00 1.46 H new ATOM 0 HB2 ALA B 254 105.653 -7.566 1.368 1.00 1.46 H new ATOM 0 HB3 ALA B 254 106.583 -8.909 2.076 1.00 1.46 H new ATOM 1714 N ASP B 255 109.651 -8.648 2.114 1.00 0.86 N ATOM 1715 CA ASP B 255 110.797 -9.068 2.984 1.00 0.73 C ATOM 1716 C ASP B 255 111.973 -8.096 2.828 1.00 0.59 C ATOM 1717 O ASP B 255 112.755 -7.912 3.743 1.00 0.55 O ATOM 1718 CB ASP B 255 111.188 -10.467 2.500 1.00 0.79 C ATOM 1719 CG ASP B 255 112.185 -11.089 3.480 1.00 1.30 C ATOM 1720 OD1 ASP B 255 113.374 -10.899 3.285 1.00 2.11 O ATOM 1721 OD2 ASP B 255 111.742 -11.744 4.409 1.00 1.66 O ATOM 0 H ASP B 255 109.474 -9.252 1.311 1.00 0.86 H new ATOM 0 HA ASP B 255 110.525 -9.068 4.039 1.00 0.73 H new ATOM 0 HB2 ASP B 255 110.301 -11.096 2.419 1.00 0.79 H new ATOM 0 HB3 ASP B 255 111.629 -10.409 1.505 1.00 0.79 H new ATOM 1726 N ALA B 256 112.104 -7.474 1.678 1.00 0.62 N ATOM 1727 CA ALA B 256 113.229 -6.504 1.461 1.00 0.62 C ATOM 1728 C ALA B 256 113.101 -5.313 2.419 1.00 0.54 C ATOM 1729 O ALA B 256 114.085 -4.810 2.930 1.00 0.50 O ATOM 1730 CB ALA B 256 113.093 -6.038 0.010 1.00 0.82 C ATOM 0 H ALA B 256 111.481 -7.596 0.880 1.00 0.62 H new ATOM 0 HA ALA B 256 114.200 -6.962 1.650 1.00 0.62 H new ATOM 0 HB1 ALA B 256 113.885 -5.325 -0.219 1.00 0.82 H new ATOM 0 HB2 ALA B 256 113.174 -6.896 -0.657 1.00 0.82 H new ATOM 0 HB3 ALA B 256 112.123 -5.560 -0.129 1.00 0.82 H new ATOM 1736 N SER B 257 111.892 -4.862 2.664 1.00 0.55 N ATOM 1737 CA SER B 257 111.675 -3.731 3.630 1.00 0.51 C ATOM 1738 C SER B 257 112.291 -4.065 4.993 1.00 0.40 C ATOM 1739 O SER B 257 112.802 -3.201 5.684 1.00 0.37 O ATOM 1740 CB SER B 257 110.155 -3.602 3.761 1.00 0.59 C ATOM 1741 OG SER B 257 109.596 -3.331 2.483 1.00 1.20 O ATOM 0 H SER B 257 111.042 -5.229 2.236 1.00 0.55 H new ATOM 0 HA SER B 257 112.140 -2.808 3.284 1.00 0.51 H new ATOM 0 HB2 SER B 257 109.734 -4.522 4.168 1.00 0.59 H new ATOM 0 HB3 SER B 257 109.905 -2.802 4.457 1.00 0.59 H new ATOM 0 HG SER B 257 108.623 -3.249 2.562 1.00 1.20 H new ATOM 1747 N SER B 258 112.241 -5.317 5.373 1.00 0.36 N ATOM 1748 CA SER B 258 112.816 -5.735 6.692 1.00 0.29 C ATOM 1749 C SER B 258 114.343 -5.624 6.665 1.00 0.26 C ATOM 1750 O SER B 258 114.967 -5.340 7.671 1.00 0.25 O ATOM 1751 CB SER B 258 112.389 -7.193 6.879 1.00 0.32 C ATOM 1752 OG SER B 258 110.974 -7.285 6.776 1.00 1.30 O ATOM 0 H SER B 258 111.826 -6.071 4.826 1.00 0.36 H new ATOM 0 HA SER B 258 112.464 -5.103 7.508 1.00 0.29 H new ATOM 0 HB2 SER B 258 112.862 -7.822 6.125 1.00 0.32 H new ATOM 0 HB3 SER B 258 112.719 -7.559 7.851 1.00 0.32 H new ATOM 0 HG SER B 258 110.697 -8.218 6.894 1.00 1.30 H new ATOM 1758 N GLN B 259 114.948 -5.847 5.521 1.00 0.31 N ATOM 1759 CA GLN B 259 116.444 -5.777 5.425 1.00 0.34 C ATOM 1760 C GLN B 259 116.935 -4.357 5.732 1.00 0.32 C ATOM 1761 O GLN B 259 117.971 -4.173 6.345 1.00 0.34 O ATOM 1762 CB GLN B 259 116.782 -6.154 3.979 1.00 0.46 C ATOM 1763 CG GLN B 259 116.401 -7.616 3.729 1.00 1.18 C ATOM 1764 CD GLN B 259 116.697 -7.981 2.271 1.00 1.45 C ATOM 1765 OE1 GLN B 259 116.530 -7.171 1.382 1.00 1.64 O ATOM 1766 NE2 GLN B 259 117.134 -9.179 1.988 1.00 2.24 N ATOM 0 H GLN B 259 114.471 -6.075 4.649 1.00 0.31 H new ATOM 0 HA GLN B 259 116.924 -6.444 6.141 1.00 0.34 H new ATOM 0 HB2 GLN B 259 116.245 -5.504 3.288 1.00 0.46 H new ATOM 0 HB3 GLN B 259 117.846 -6.008 3.793 1.00 0.46 H new ATOM 0 HG2 GLN B 259 116.961 -8.268 4.399 1.00 1.18 H new ATOM 0 HG3 GLN B 259 115.344 -7.769 3.946 1.00 1.18 H new ATOM 0 HE21 GLN B 259 117.275 -9.860 2.734 1.00 2.24 H new ATOM 0 HE22 GLN B 259 117.335 -9.433 1.021 1.00 2.24 H new ATOM 1775 N LEU B 260 116.198 -3.358 5.309 1.00 0.32 N ATOM 1776 CA LEU B 260 116.611 -1.943 5.587 1.00 0.34 C ATOM 1777 C LEU B 260 116.502 -1.645 7.084 1.00 0.32 C ATOM 1778 O LEU B 260 117.380 -1.037 7.667 1.00 0.36 O ATOM 1779 CB LEU B 260 115.638 -1.066 4.793 1.00 0.38 C ATOM 1780 CG LEU B 260 115.852 -1.285 3.294 1.00 0.44 C ATOM 1781 CD1 LEU B 260 114.704 -0.641 2.515 1.00 0.49 C ATOM 1782 CD2 LEU B 260 117.176 -0.644 2.869 1.00 0.49 C ATOM 0 H LEU B 260 115.329 -3.459 4.784 1.00 0.32 H new ATOM 0 HA LEU B 260 117.645 -1.758 5.298 1.00 0.34 H new ATOM 0 HB2 LEU B 260 114.610 -1.310 5.063 1.00 0.38 H new ATOM 0 HB3 LEU B 260 115.793 -0.016 5.043 1.00 0.38 H new ATOM 0 HG LEU B 260 115.880 -2.354 3.084 1.00 0.44 H new ATOM 0 HD11 LEU B 260 114.856 -0.797 1.447 1.00 0.49 H new ATOM 0 HD12 LEU B 260 113.760 -1.095 2.817 1.00 0.49 H new ATOM 0 HD13 LEU B 260 114.676 0.428 2.725 1.00 0.49 H new ATOM 0 HD21 LEU B 260 117.329 -0.800 1.801 1.00 0.49 H new ATOM 0 HD22 LEU B 260 117.147 0.425 3.079 1.00 0.49 H new ATOM 0 HD23 LEU B 260 117.996 -1.101 3.424 1.00 0.49 H new ATOM 1794 N LEU B 261 115.428 -2.068 7.705 1.00 0.30 N ATOM 1795 CA LEU B 261 115.293 -1.891 9.186 1.00 0.31 C ATOM 1796 C LEU B 261 116.296 -2.795 9.909 1.00 0.33 C ATOM 1797 O LEU B 261 116.834 -2.439 10.942 1.00 0.39 O ATOM 1798 CB LEU B 261 113.856 -2.303 9.520 1.00 0.30 C ATOM 1799 CG LEU B 261 113.531 -1.915 10.965 1.00 0.34 C ATOM 1800 CD1 LEU B 261 113.407 -0.394 11.073 1.00 0.37 C ATOM 1801 CD2 LEU B 261 112.206 -2.561 11.380 1.00 0.34 C ATOM 0 H LEU B 261 114.639 -2.528 7.251 1.00 0.30 H new ATOM 0 HA LEU B 261 115.495 -0.867 9.499 1.00 0.31 H new ATOM 0 HB2 LEU B 261 113.160 -1.816 8.837 1.00 0.30 H new ATOM 0 HB3 LEU B 261 113.735 -3.378 9.386 1.00 0.30 H new ATOM 0 HG LEU B 261 114.330 -2.262 11.620 1.00 0.34 H new ATOM 0 HD11 LEU B 261 113.176 -0.120 12.102 1.00 0.37 H new ATOM 0 HD12 LEU B 261 114.348 0.070 10.777 1.00 0.37 H new ATOM 0 HD13 LEU B 261 112.609 -0.047 10.417 1.00 0.37 H new ATOM 0 HD21 LEU B 261 111.973 -2.286 12.409 1.00 0.34 H new ATOM 0 HD22 LEU B 261 111.410 -2.213 10.722 1.00 0.34 H new ATOM 0 HD23 LEU B 261 112.291 -3.645 11.305 1.00 0.34 H new ATOM 1813 N SER B 262 116.549 -3.964 9.366 1.00 0.32 N ATOM 1814 CA SER B 262 117.549 -4.895 9.984 1.00 0.38 C ATOM 1815 C SER B 262 118.947 -4.265 9.980 1.00 0.41 C ATOM 1816 O SER B 262 119.707 -4.422 10.918 1.00 0.49 O ATOM 1817 CB SER B 262 117.532 -6.149 9.107 1.00 0.39 C ATOM 1818 OG SER B 262 118.332 -7.156 9.713 1.00 1.21 O ATOM 0 H SER B 262 116.104 -4.314 8.518 1.00 0.32 H new ATOM 0 HA SER B 262 117.303 -5.118 11.022 1.00 0.38 H new ATOM 0 HB2 SER B 262 116.510 -6.506 8.983 1.00 0.39 H new ATOM 0 HB3 SER B 262 117.912 -5.916 8.112 1.00 0.39 H new ATOM 0 HG SER B 262 118.322 -7.961 9.155 1.00 1.21 H new ATOM 1824 N LEU B 263 119.287 -3.554 8.928 1.00 0.38 N ATOM 1825 CA LEU B 263 120.647 -2.923 8.849 1.00 0.45 C ATOM 1826 C LEU B 263 120.793 -1.851 9.932 1.00 0.54 C ATOM 1827 O LEU B 263 121.788 -1.796 10.632 1.00 0.64 O ATOM 1828 CB LEU B 263 120.721 -2.286 7.458 1.00 0.44 C ATOM 1829 CG LEU B 263 120.875 -3.380 6.400 1.00 0.40 C ATOM 1830 CD1 LEU B 263 120.456 -2.833 5.033 1.00 0.41 C ATOM 1831 CD2 LEU B 263 122.338 -3.830 6.341 1.00 0.43 C ATOM 0 H LEU B 263 118.684 -3.384 8.123 1.00 0.38 H new ATOM 0 HA LEU B 263 121.444 -3.650 9.004 1.00 0.45 H new ATOM 0 HB2 LEU B 263 119.820 -1.704 7.265 1.00 0.44 H new ATOM 0 HB3 LEU B 263 121.563 -1.596 7.407 1.00 0.44 H new ATOM 0 HG LEU B 263 120.242 -4.228 6.661 1.00 0.40 H new ATOM 0 HD11 LEU B 263 120.566 -3.613 4.280 1.00 0.41 H new ATOM 0 HD12 LEU B 263 119.415 -2.512 5.073 1.00 0.41 H new ATOM 0 HD13 LEU B 263 121.088 -1.984 4.771 1.00 0.41 H new ATOM 0 HD21 LEU B 263 122.449 -4.610 5.587 1.00 0.43 H new ATOM 0 HD22 LEU B 263 122.970 -2.981 6.080 1.00 0.43 H new ATOM 0 HD23 LEU B 263 122.638 -4.220 7.313 1.00 0.43 H new ATOM 1843 N LEU B 264 119.804 -1.003 10.070 1.00 0.53 N ATOM 1844 CA LEU B 264 119.846 0.054 11.136 1.00 0.64 C ATOM 1845 C LEU B 264 119.854 -0.584 12.530 1.00 0.70 C ATOM 1846 O LEU B 264 120.464 -0.070 13.451 1.00 0.82 O ATOM 1847 CB LEU B 264 118.570 0.879 10.940 1.00 0.62 C ATOM 1848 CG LEU B 264 118.638 1.617 9.601 1.00 0.62 C ATOM 1849 CD1 LEU B 264 117.261 2.189 9.263 1.00 0.63 C ATOM 1850 CD2 LEU B 264 119.653 2.758 9.700 1.00 0.75 C ATOM 0 H LEU B 264 118.965 -0.995 9.490 1.00 0.53 H new ATOM 0 HA LEU B 264 120.745 0.665 11.061 1.00 0.64 H new ATOM 0 HB2 LEU B 264 117.696 0.228 10.964 1.00 0.62 H new ATOM 0 HB3 LEU B 264 118.458 1.593 11.755 1.00 0.62 H new ATOM 0 HG LEU B 264 118.945 0.923 8.819 1.00 0.62 H new ATOM 0 HD11 LEU B 264 117.309 2.715 8.309 1.00 0.63 H new ATOM 0 HD12 LEU B 264 116.537 1.377 9.194 1.00 0.63 H new ATOM 0 HD13 LEU B 264 116.954 2.883 10.045 1.00 0.63 H new ATOM 0 HD21 LEU B 264 119.703 3.285 8.747 1.00 0.75 H new ATOM 0 HD22 LEU B 264 119.345 3.452 10.482 1.00 0.75 H new ATOM 0 HD23 LEU B 264 120.635 2.351 9.941 1.00 0.75 H new ATOM 1862 N LYS B 265 119.184 -1.700 12.686 1.00 0.65 N ATOM 1863 CA LYS B 265 119.091 -2.346 14.034 1.00 0.75 C ATOM 1864 C LYS B 265 120.408 -3.045 14.382 1.00 0.83 C ATOM 1865 O LYS B 265 120.880 -2.967 15.502 1.00 0.97 O ATOM 1866 CB LYS B 265 117.955 -3.366 13.920 1.00 0.71 C ATOM 1867 CG LYS B 265 117.603 -3.897 15.312 1.00 1.32 C ATOM 1868 CD LYS B 265 116.717 -5.138 15.177 1.00 1.32 C ATOM 1869 CE LYS B 265 115.316 -4.719 14.723 1.00 2.22 C ATOM 1870 NZ LYS B 265 114.771 -5.911 14.016 1.00 2.66 N ATOM 0 H LYS B 265 118.697 -2.192 11.937 1.00 0.65 H new ATOM 0 HA LYS B 265 118.901 -1.617 14.822 1.00 0.75 H new ATOM 0 HB2 LYS B 265 117.080 -2.902 13.464 1.00 0.71 H new ATOM 0 HB3 LYS B 265 118.255 -4.189 13.271 1.00 0.71 H new ATOM 0 HG2 LYS B 265 118.513 -4.145 15.859 1.00 1.32 H new ATOM 0 HG3 LYS B 265 117.085 -3.128 15.886 1.00 1.32 H new ATOM 0 HD2 LYS B 265 117.152 -5.832 14.457 1.00 1.32 H new ATOM 0 HD3 LYS B 265 116.660 -5.663 16.131 1.00 1.32 H new ATOM 0 HE2 LYS B 265 114.691 -4.443 15.573 1.00 2.22 H new ATOM 0 HE3 LYS B 265 115.357 -3.852 14.063 1.00 2.22 H new ATOM 0 HZ1 LYS B 265 113.811 -5.703 13.674 1.00 2.66 H new ATOM 0 HZ2 LYS B 265 115.383 -6.146 13.209 1.00 2.66 H new ATOM 0 HZ3 LYS B 265 114.738 -6.718 14.671 1.00 2.66 H new ATOM 1884 N SER B 266 121.001 -3.727 13.431 1.00 0.78 N ATOM 1885 CA SER B 266 122.276 -4.460 13.706 1.00 0.88 C ATOM 1886 C SER B 266 122.982 -4.813 12.394 1.00 1.36 C ATOM 1887 O SER B 266 122.421 -4.675 11.322 1.00 2.18 O ATOM 1888 CB SER B 266 121.858 -5.729 14.450 1.00 1.87 C ATOM 1889 OG SER B 266 121.138 -6.577 13.563 1.00 2.62 O ATOM 0 H SER B 266 120.656 -3.807 12.475 1.00 0.78 H new ATOM 0 HA SER B 266 122.975 -3.860 14.289 1.00 0.88 H new ATOM 0 HB2 SER B 266 122.738 -6.247 14.833 1.00 1.87 H new ATOM 0 HB3 SER B 266 121.239 -5.473 15.310 1.00 1.87 H new ATOM 0 HG SER B 266 120.870 -7.392 14.036 1.00 2.62 H new ATOM 1895 N SER B 267 124.210 -5.268 12.477 1.00 1.76 N ATOM 1896 CA SER B 267 124.973 -5.636 11.238 1.00 2.92 C ATOM 1897 C SER B 267 124.314 -6.828 10.531 1.00 3.46 C ATOM 1898 O SER B 267 124.368 -6.939 9.322 1.00 3.74 O ATOM 1899 CB SER B 267 126.376 -6.012 11.720 1.00 3.51 C ATOM 1900 OG SER B 267 127.216 -6.229 10.595 1.00 3.87 O ATOM 0 H SER B 267 124.719 -5.401 13.351 1.00 1.76 H new ATOM 0 HA SER B 267 124.995 -4.816 10.521 1.00 2.92 H new ATOM 0 HB2 SER B 267 126.784 -5.217 12.345 1.00 3.51 H new ATOM 0 HB3 SER B 267 126.333 -6.911 12.335 1.00 3.51 H new ATOM 0 HG SER B 267 128.116 -6.469 10.900 1.00 3.87 H new ATOM 1906 N THR B 268 123.691 -7.714 11.287 1.00 4.12 N ATOM 1907 CA THR B 268 123.069 -8.960 10.706 1.00 4.97 C ATOM 1908 C THR B 268 124.145 -9.886 10.121 1.00 5.40 C ATOM 1909 O THR B 268 124.364 -10.975 10.617 1.00 5.67 O ATOM 1910 CB THR B 268 122.087 -8.500 9.614 1.00 5.80 C ATOM 1911 OG1 THR B 268 121.390 -7.343 10.057 1.00 6.02 O ATOM 1912 CG2 THR B 268 121.085 -9.619 9.326 1.00 6.28 C ATOM 0 H THR B 268 123.586 -7.624 12.298 1.00 4.12 H new ATOM 0 HA THR B 268 122.550 -9.530 11.477 1.00 4.97 H new ATOM 0 HB THR B 268 122.641 -8.264 8.705 1.00 5.80 H new ATOM 0 HG1 THR B 268 120.433 -7.447 9.872 1.00 6.02 H new ATOM 0 HG21 THR B 268 120.389 -9.294 8.553 1.00 6.28 H new ATOM 0 HG22 THR B 268 121.618 -10.506 8.985 1.00 6.28 H new ATOM 0 HG23 THR B 268 120.532 -9.855 10.235 1.00 6.28 H new ATOM 1920 N ALA B 269 124.818 -9.464 9.070 1.00 5.87 N ATOM 1921 CA ALA B 269 125.886 -10.312 8.431 1.00 6.67 C ATOM 1922 C ALA B 269 125.333 -11.694 8.033 1.00 7.23 C ATOM 1923 O ALA B 269 124.182 -11.990 8.292 1.00 7.60 O ATOM 1924 CB ALA B 269 126.989 -10.454 9.488 1.00 6.95 C ATOM 0 H ALA B 269 124.672 -8.559 8.623 1.00 5.87 H new ATOM 0 HA ALA B 269 126.260 -9.855 7.515 1.00 6.67 H new ATOM 0 HB1 ALA B 269 127.800 -11.062 9.088 1.00 6.95 H new ATOM 0 HB2 ALA B 269 127.370 -9.467 9.751 1.00 6.95 H new ATOM 0 HB3 ALA B 269 126.581 -10.934 10.378 1.00 6.95 H new ATOM 1930 N PRO B 270 126.174 -12.503 7.411 1.00 7.61 N ATOM 1931 CA PRO B 270 125.737 -13.853 6.956 1.00 8.45 C ATOM 1932 C PRO B 270 125.318 -14.723 8.149 1.00 9.16 C ATOM 1933 O PRO B 270 124.380 -15.494 8.061 1.00 9.40 O ATOM 1934 CB PRO B 270 126.976 -14.437 6.264 1.00 8.93 C ATOM 1935 CG PRO B 270 127.893 -13.280 6.028 1.00 8.54 C ATOM 1936 CD PRO B 270 127.581 -12.246 7.074 1.00 7.64 C ATOM 0 HA PRO B 270 124.871 -13.810 6.295 1.00 8.45 H new ATOM 0 HB2 PRO B 270 127.453 -15.193 6.888 1.00 8.93 H new ATOM 0 HB3 PRO B 270 126.708 -14.921 5.325 1.00 8.93 H new ATOM 0 HG2 PRO B 270 128.934 -13.594 6.096 1.00 8.54 H new ATOM 0 HG3 PRO B 270 127.748 -12.872 5.028 1.00 8.54 H new ATOM 0 HD2 PRO B 270 128.227 -12.351 7.946 1.00 7.64 H new ATOM 0 HD3 PRO B 270 127.723 -11.235 6.692 1.00 7.64 H new ATOM 1944 N SER B 271 126.007 -14.600 9.258 1.00 9.73 N ATOM 1945 CA SER B 271 125.667 -15.428 10.455 1.00 10.65 C ATOM 1946 C SER B 271 125.884 -14.625 11.741 1.00 11.42 C ATOM 1947 O SER B 271 126.932 -14.040 11.946 1.00 11.68 O ATOM 1948 CB SER B 271 126.626 -16.616 10.398 1.00 11.07 C ATOM 1949 OG SER B 271 126.298 -17.535 11.432 1.00 11.20 O ATOM 0 H SER B 271 126.791 -13.960 9.385 1.00 9.73 H new ATOM 0 HA SER B 271 124.623 -15.743 10.453 1.00 10.65 H new ATOM 0 HB2 SER B 271 126.560 -17.105 9.426 1.00 11.07 H new ATOM 0 HB3 SER B 271 127.654 -16.274 10.513 1.00 11.07 H new ATOM 0 HG SER B 271 126.911 -18.299 11.397 1.00 11.20 H new ATOM 1955 N ASP B 272 124.897 -14.597 12.604 1.00 11.97 N ATOM 1956 CA ASP B 272 125.035 -13.862 13.899 1.00 12.89 C ATOM 1957 C ASP B 272 123.976 -14.356 14.894 1.00 13.60 C ATOM 1958 O ASP B 272 123.294 -13.574 15.534 1.00 13.91 O ATOM 1959 CB ASP B 272 124.812 -12.384 13.547 1.00 13.15 C ATOM 1960 CG ASP B 272 126.157 -11.701 13.279 1.00 12.94 C ATOM 1961 OD1 ASP B 272 127.102 -11.992 13.995 1.00 12.56 O ATOM 1962 OD2 ASP B 272 126.219 -10.899 12.363 1.00 13.33 O ATOM 0 H ASP B 272 123.996 -15.055 12.465 1.00 11.97 H new ATOM 0 HA ASP B 272 126.007 -14.018 14.367 1.00 12.89 H new ATOM 0 HB2 ASP B 272 124.172 -12.303 12.668 1.00 13.15 H new ATOM 0 HB3 ASP B 272 124.296 -11.881 14.364 1.00 13.15 H new ATOM 1967 N LEU B 273 123.838 -15.654 15.026 1.00 14.01 N ATOM 1968 CA LEU B 273 122.806 -16.219 15.951 1.00 14.85 C ATOM 1969 C LEU B 273 123.126 -17.683 16.269 1.00 14.90 C ATOM 1970 O LEU B 273 123.048 -18.108 17.408 1.00 14.86 O ATOM 1971 CB LEU B 273 121.485 -16.111 15.187 1.00 15.54 C ATOM 1972 CG LEU B 273 120.323 -16.445 16.123 1.00 16.23 C ATOM 1973 CD1 LEU B 273 120.109 -15.291 17.105 1.00 16.50 C ATOM 1974 CD2 LEU B 273 119.050 -16.655 15.300 1.00 16.84 C ATOM 0 H LEU B 273 124.398 -16.348 14.531 1.00 14.01 H new ATOM 0 HA LEU B 273 122.769 -15.688 16.902 1.00 14.85 H new ATOM 0 HB2 LEU B 273 121.366 -15.104 14.787 1.00 15.54 H new ATOM 0 HB3 LEU B 273 121.488 -16.793 14.337 1.00 15.54 H new ATOM 0 HG LEU B 273 120.554 -17.355 16.677 1.00 16.23 H new ATOM 0 HD11 LEU B 273 119.281 -15.530 17.772 1.00 16.50 H new ATOM 0 HD12 LEU B 273 121.015 -15.140 17.692 1.00 16.50 H new ATOM 0 HD13 LEU B 273 119.879 -14.380 16.552 1.00 16.50 H new ATOM 0 HD21 LEU B 273 118.221 -16.893 15.966 1.00 16.84 H new ATOM 0 HD22 LEU B 273 118.820 -15.745 14.746 1.00 16.84 H new ATOM 0 HD23 LEU B 273 119.201 -17.477 14.600 1.00 16.84 H new ATOM 1986 N ALA B 274 123.482 -18.454 15.270 1.00 15.15 N ATOM 1987 CA ALA B 274 123.810 -19.896 15.506 1.00 15.41 C ATOM 1988 C ALA B 274 125.186 -20.023 16.167 1.00 15.48 C ATOM 1989 O ALA B 274 125.840 -19.034 16.446 1.00 15.39 O ATOM 1990 CB ALA B 274 123.820 -20.545 14.119 1.00 15.53 C ATOM 0 H ALA B 274 123.560 -18.147 14.300 1.00 15.15 H new ATOM 0 HA ALA B 274 123.090 -20.375 16.169 1.00 15.41 H new ATOM 0 HB1 ALA B 274 124.054 -21.605 14.215 1.00 15.53 H new ATOM 0 HB2 ALA B 274 122.840 -20.430 13.657 1.00 15.53 H new ATOM 0 HB3 ALA B 274 124.573 -20.062 13.497 1.00 15.53 H new ATOM 1996 N THR B 275 125.625 -21.232 16.417 1.00 15.81 N ATOM 1997 CA THR B 275 126.956 -21.435 17.078 1.00 16.09 C ATOM 1998 C THR B 275 128.089 -21.007 16.131 1.00 16.48 C ATOM 1999 O THR B 275 127.893 -20.956 14.931 1.00 16.75 O ATOM 2000 CB THR B 275 127.043 -22.935 17.373 1.00 16.28 C ATOM 2001 OG1 THR B 275 126.791 -23.665 16.180 1.00 16.51 O ATOM 2002 CG2 THR B 275 126.005 -23.310 18.431 1.00 16.39 C ATOM 0 H THR B 275 125.120 -22.089 16.192 1.00 15.81 H new ATOM 0 HA THR B 275 127.054 -20.840 17.986 1.00 16.09 H new ATOM 0 HB THR B 275 128.039 -23.176 17.744 1.00 16.28 H new ATOM 0 HG1 THR B 275 126.848 -24.625 16.366 1.00 16.51 H new ATOM 0 HG21 THR B 275 126.068 -24.378 18.640 1.00 16.39 H new ATOM 0 HG22 THR B 275 126.199 -22.749 19.345 1.00 16.39 H new ATOM 0 HG23 THR B 275 125.007 -23.071 18.063 1.00 16.39 H new ATOM 2010 N PRO B 276 129.247 -20.710 16.696 1.00 16.63 N ATOM 2011 CA PRO B 276 130.409 -20.275 15.869 1.00 17.15 C ATOM 2012 C PRO B 276 130.815 -21.377 14.882 1.00 17.74 C ATOM 2013 O PRO B 276 130.877 -22.541 15.231 1.00 18.02 O ATOM 2014 CB PRO B 276 131.525 -20.019 16.888 1.00 17.32 C ATOM 2015 CG PRO B 276 130.848 -19.939 18.220 1.00 16.97 C ATOM 2016 CD PRO B 276 129.584 -20.747 18.128 1.00 16.50 C ATOM 0 HA PRO B 276 130.186 -19.394 15.267 1.00 17.15 H new ATOM 0 HB2 PRO B 276 132.262 -20.822 16.871 1.00 17.32 H new ATOM 0 HB3 PRO B 276 132.056 -19.094 16.663 1.00 17.32 H new ATOM 0 HG2 PRO B 276 131.497 -20.328 19.005 1.00 16.97 H new ATOM 0 HG3 PRO B 276 130.624 -18.903 18.476 1.00 16.97 H new ATOM 0 HD2 PRO B 276 129.736 -21.768 18.477 1.00 16.50 H new ATOM 0 HD3 PRO B 276 128.789 -20.317 18.737 1.00 16.50 H new ATOM 2024 N GLN B 277 131.090 -21.011 13.653 1.00 18.05 N ATOM 2025 CA GLN B 277 131.509 -22.021 12.635 1.00 18.77 C ATOM 2026 C GLN B 277 132.598 -21.434 11.723 1.00 19.02 C ATOM 2027 O GLN B 277 132.723 -20.228 11.624 1.00 18.98 O ATOM 2028 CB GLN B 277 130.243 -22.325 11.832 1.00 19.16 C ATOM 2029 CG GLN B 277 129.405 -23.368 12.572 1.00 19.36 C ATOM 2030 CD GLN B 277 130.064 -24.741 12.439 1.00 19.89 C ATOM 2031 OE1 GLN B 277 130.090 -25.314 11.368 1.00 19.98 O ATOM 2032 NE2 GLN B 277 130.603 -25.299 13.489 1.00 20.35 N ATOM 0 H GLN B 277 131.041 -20.051 13.311 1.00 18.05 H new ATOM 0 HA GLN B 277 131.926 -22.919 13.091 1.00 18.77 H new ATOM 0 HB2 GLN B 277 129.663 -21.413 11.689 1.00 19.16 H new ATOM 0 HB3 GLN B 277 130.508 -22.693 10.841 1.00 19.16 H new ATOM 0 HG2 GLN B 277 129.314 -23.097 13.624 1.00 19.36 H new ATOM 0 HG3 GLN B 277 128.396 -23.396 12.162 1.00 19.36 H new ATOM 0 HE21 GLN B 277 130.582 -24.819 14.389 1.00 20.35 H new ATOM 0 HE22 GLN B 277 131.045 -26.215 13.409 1.00 20.35 H new ATOM 2041 N PRO B 278 133.357 -22.303 11.082 1.00 19.41 N ATOM 2042 CA PRO B 278 134.435 -21.836 10.170 1.00 19.83 C ATOM 2043 C PRO B 278 133.832 -21.149 8.939 1.00 20.14 C ATOM 2044 O PRO B 278 133.150 -21.772 8.145 1.00 20.20 O ATOM 2045 CB PRO B 278 135.169 -23.119 9.774 1.00 20.31 C ATOM 2046 CG PRO B 278 134.200 -24.228 10.034 1.00 20.23 C ATOM 2047 CD PRO B 278 133.288 -23.772 11.141 1.00 19.65 C ATOM 0 HA PRO B 278 135.097 -21.106 10.635 1.00 19.83 H new ATOM 0 HB2 PRO B 278 135.465 -23.094 8.725 1.00 20.31 H new ATOM 0 HB3 PRO B 278 136.079 -23.247 10.360 1.00 20.31 H new ATOM 0 HG2 PRO B 278 133.628 -24.458 9.135 1.00 20.23 H new ATOM 0 HG3 PRO B 278 134.726 -25.139 10.319 1.00 20.23 H new ATOM 0 HD2 PRO B 278 132.269 -24.129 10.991 1.00 19.65 H new ATOM 0 HD3 PRO B 278 133.618 -24.148 12.109 1.00 19.65 H new ATOM 2055 N SER B 279 134.082 -19.872 8.780 1.00 20.46 N ATOM 2056 CA SER B 279 133.530 -19.132 7.604 1.00 20.92 C ATOM 2057 C SER B 279 134.446 -17.960 7.239 1.00 21.63 C ATOM 2058 O SER B 279 135.250 -17.520 8.039 1.00 21.95 O ATOM 2059 CB SER B 279 132.164 -18.623 8.063 1.00 20.83 C ATOM 2060 OG SER B 279 132.343 -17.640 9.073 1.00 21.09 O ATOM 0 H SER B 279 134.646 -19.309 9.417 1.00 20.46 H new ATOM 0 HA SER B 279 133.453 -19.762 6.718 1.00 20.92 H new ATOM 0 HB2 SER B 279 131.619 -18.199 7.220 1.00 20.83 H new ATOM 0 HB3 SER B 279 131.565 -19.449 8.446 1.00 20.83 H new ATOM 0 HG SER B 279 131.468 -17.311 9.368 1.00 21.09 H new ATOM 2066 N THR B 280 134.326 -17.455 6.035 1.00 21.96 N ATOM 2067 CA THR B 280 135.178 -16.304 5.604 1.00 22.75 C ATOM 2068 C THR B 280 134.298 -15.163 5.083 1.00 23.13 C ATOM 2069 O THR B 280 133.313 -15.391 4.404 1.00 23.33 O ATOM 2070 CB THR B 280 136.056 -16.859 4.482 1.00 23.02 C ATOM 2071 OG1 THR B 280 136.681 -18.057 4.922 1.00 22.73 O ATOM 2072 CG2 THR B 280 137.127 -15.832 4.110 1.00 23.36 C ATOM 0 H THR B 280 133.671 -17.793 5.330 1.00 21.96 H new ATOM 0 HA THR B 280 135.772 -15.899 6.423 1.00 22.75 H new ATOM 0 HB THR B 280 135.438 -17.068 3.608 1.00 23.02 H new ATOM 0 HG1 THR B 280 137.243 -18.416 4.204 1.00 22.73 H new ATOM 0 HG21 THR B 280 137.751 -16.231 3.310 1.00 23.36 H new ATOM 0 HG22 THR B 280 136.648 -14.913 3.773 1.00 23.36 H new ATOM 0 HG23 THR B 280 137.746 -15.620 4.982 1.00 23.36 H new ATOM 2080 N PHE B 281 134.649 -13.939 5.400 1.00 23.34 N ATOM 2081 CA PHE B 281 133.848 -12.771 4.920 1.00 23.83 C ATOM 2082 C PHE B 281 134.753 -11.789 4.152 1.00 24.37 C ATOM 2083 O PHE B 281 135.168 -10.780 4.695 1.00 24.56 O ATOM 2084 CB PHE B 281 133.294 -12.125 6.193 1.00 23.80 C ATOM 2085 CG PHE B 281 132.234 -11.082 5.927 1.00 23.92 C ATOM 2086 CD1 PHE B 281 131.092 -11.413 5.155 1.00 23.95 C ATOM 2087 CD2 PHE B 281 132.380 -9.774 6.450 1.00 24.09 C ATOM 2088 CE1 PHE B 281 130.099 -10.435 4.906 1.00 24.19 C ATOM 2089 CE2 PHE B 281 131.386 -8.797 6.201 1.00 24.30 C ATOM 2090 CZ PHE B 281 130.245 -9.127 5.429 1.00 24.36 C ATOM 0 H PHE B 281 135.459 -13.699 5.972 1.00 23.34 H new ATOM 0 HA PHE B 281 133.051 -13.062 4.236 1.00 23.83 H new ATOM 0 HB2 PHE B 281 132.876 -12.902 6.833 1.00 23.80 H new ATOM 0 HB3 PHE B 281 134.114 -11.666 6.744 1.00 23.80 H new ATOM 0 HD1 PHE B 281 130.980 -12.411 4.757 1.00 23.95 H new ATOM 0 HD2 PHE B 281 133.250 -9.522 7.039 1.00 24.09 H new ATOM 0 HE1 PHE B 281 129.230 -10.687 4.317 1.00 24.19 H new ATOM 0 HE2 PHE B 281 131.498 -7.800 6.600 1.00 24.30 H new ATOM 0 HZ PHE B 281 129.487 -8.382 5.239 1.00 24.36 H new ATOM 2100 N PRO B 282 135.035 -12.113 2.904 1.00 24.69 N ATOM 2101 CA PRO B 282 135.907 -11.240 2.072 1.00 25.32 C ATOM 2102 C PRO B 282 135.211 -9.905 1.787 1.00 25.87 C ATOM 2103 O PRO B 282 134.016 -9.857 1.555 1.00 26.21 O ATOM 2104 CB PRO B 282 136.109 -12.037 0.782 1.00 25.61 C ATOM 2105 CG PRO B 282 134.979 -13.016 0.737 1.00 25.27 C ATOM 2106 CD PRO B 282 134.581 -13.300 2.160 1.00 24.63 C ATOM 0 HA PRO B 282 136.850 -10.995 2.560 1.00 25.32 H new ATOM 0 HB2 PRO B 282 136.097 -11.383 -0.090 1.00 25.61 H new ATOM 0 HB3 PRO B 282 137.072 -12.548 0.783 1.00 25.61 H new ATOM 0 HG2 PRO B 282 134.138 -12.608 0.176 1.00 25.27 H new ATOM 0 HG3 PRO B 282 135.284 -13.933 0.232 1.00 25.27 H new ATOM 0 HD2 PRO B 282 133.504 -13.440 2.252 1.00 24.63 H new ATOM 0 HD3 PRO B 282 135.054 -14.209 2.532 1.00 24.63 H new ATOM 2114 N GLN B 283 135.953 -8.824 1.802 1.00 26.05 N ATOM 2115 CA GLN B 283 135.351 -7.484 1.521 1.00 26.69 C ATOM 2116 C GLN B 283 136.195 -6.732 0.474 1.00 26.91 C ATOM 2117 O GLN B 283 137.071 -5.963 0.830 1.00 26.68 O ATOM 2118 CB GLN B 283 135.371 -6.752 2.866 1.00 26.81 C ATOM 2119 CG GLN B 283 134.577 -5.449 2.751 1.00 26.87 C ATOM 2120 CD GLN B 283 134.547 -4.748 4.110 1.00 27.05 C ATOM 2121 OE1 GLN B 283 134.267 -5.365 5.119 1.00 26.97 O ATOM 2122 NE2 GLN B 283 134.825 -3.475 4.180 1.00 27.38 N ATOM 0 H GLN B 283 136.954 -8.813 1.998 1.00 26.05 H new ATOM 0 HA GLN B 283 134.342 -7.557 1.116 1.00 26.69 H new ATOM 0 HB2 GLN B 283 134.941 -7.385 3.643 1.00 26.81 H new ATOM 0 HB3 GLN B 283 136.399 -6.539 3.161 1.00 26.81 H new ATOM 0 HG2 GLN B 283 135.032 -4.798 2.004 1.00 26.87 H new ATOM 0 HG3 GLN B 283 133.561 -5.658 2.415 1.00 26.87 H new ATOM 0 HE21 GLN B 283 135.060 -2.957 3.333 1.00 27.38 H new ATOM 0 HE22 GLN B 283 134.807 -2.998 5.081 1.00 27.38 H new ATOM 2131 N PRO B 284 135.908 -6.977 -0.791 1.00 27.44 N ATOM 2132 CA PRO B 284 136.665 -6.306 -1.881 1.00 27.79 C ATOM 2133 C PRO B 284 136.348 -4.800 -1.903 1.00 27.80 C ATOM 2134 O PRO B 284 135.271 -4.400 -1.500 1.00 27.80 O ATOM 2135 CB PRO B 284 136.163 -6.987 -3.155 1.00 28.45 C ATOM 2136 CG PRO B 284 134.839 -7.582 -2.792 1.00 28.45 C ATOM 2137 CD PRO B 284 134.875 -7.884 -1.319 1.00 27.85 C ATOM 0 HA PRO B 284 137.745 -6.391 -1.763 1.00 27.79 H new ATOM 0 HB2 PRO B 284 136.061 -6.270 -3.970 1.00 28.45 H new ATOM 0 HB3 PRO B 284 136.860 -7.755 -3.491 1.00 28.45 H new ATOM 0 HG2 PRO B 284 134.030 -6.889 -3.023 1.00 28.45 H new ATOM 0 HG3 PRO B 284 134.655 -8.490 -3.366 1.00 28.45 H new ATOM 0 HD2 PRO B 284 133.908 -7.702 -0.851 1.00 27.85 H new ATOM 0 HD3 PRO B 284 135.128 -8.928 -1.132 1.00 27.85 H new ATOM 2145 N PRO B 285 137.294 -4.006 -2.371 1.00 27.91 N ATOM 2146 CA PRO B 285 137.091 -2.533 -2.416 1.00 28.04 C ATOM 2147 C PRO B 285 136.010 -2.172 -3.443 1.00 28.74 C ATOM 2148 O PRO B 285 135.260 -1.232 -3.259 1.00 29.23 O ATOM 2149 CB PRO B 285 138.453 -1.982 -2.841 1.00 28.16 C ATOM 2150 CG PRO B 285 139.153 -3.125 -3.504 1.00 28.35 C ATOM 2151 CD PRO B 285 138.617 -4.391 -2.893 1.00 28.03 C ATOM 0 HA PRO B 285 136.756 -2.123 -1.463 1.00 28.04 H new ATOM 0 HB2 PRO B 285 138.341 -1.140 -3.524 1.00 28.16 H new ATOM 0 HB3 PRO B 285 139.017 -1.621 -1.981 1.00 28.16 H new ATOM 0 HG2 PRO B 285 138.976 -3.112 -4.580 1.00 28.35 H new ATOM 0 HG3 PRO B 285 140.231 -3.053 -3.357 1.00 28.35 H new ATOM 0 HD2 PRO B 285 138.537 -5.188 -3.632 1.00 28.03 H new ATOM 0 HD3 PRO B 285 139.268 -4.757 -2.099 1.00 28.03 H new ATOM 2159 N VAL B 286 135.931 -2.916 -4.521 1.00 28.85 N ATOM 2160 CA VAL B 286 134.917 -2.615 -5.581 1.00 29.59 C ATOM 2161 C VAL B 286 134.112 -3.879 -5.906 1.00 29.94 C ATOM 2162 O VAL B 286 134.661 -4.961 -6.017 1.00 29.75 O ATOM 2163 CB VAL B 286 135.728 -2.153 -6.803 1.00 29.66 C ATOM 2164 CG1 VAL B 286 134.780 -1.784 -7.949 1.00 30.04 C ATOM 2165 CG2 VAL B 286 136.566 -0.923 -6.436 1.00 29.47 C ATOM 0 H VAL B 286 136.527 -3.721 -4.713 1.00 28.85 H new ATOM 0 HA VAL B 286 134.203 -1.854 -5.267 1.00 29.59 H new ATOM 0 HB VAL B 286 136.384 -2.965 -7.116 1.00 29.66 H new ATOM 0 HG11 VAL B 286 135.361 -1.458 -8.811 1.00 30.04 H new ATOM 0 HG12 VAL B 286 134.183 -2.654 -8.222 1.00 30.04 H new ATOM 0 HG13 VAL B 286 134.120 -0.977 -7.630 1.00 30.04 H new ATOM 0 HG21 VAL B 286 137.138 -0.600 -7.306 1.00 29.47 H new ATOM 0 HG22 VAL B 286 135.907 -0.116 -6.115 1.00 29.47 H new ATOM 0 HG23 VAL B 286 137.249 -1.177 -5.626 1.00 29.47 H new ATOM 2175 N GLU B 287 132.816 -3.746 -6.056 1.00 30.53 N ATOM 2176 CA GLU B 287 131.965 -4.926 -6.404 1.00 30.99 C ATOM 2177 C GLU B 287 131.495 -4.824 -7.857 1.00 31.32 C ATOM 2178 O GLU B 287 131.251 -3.745 -8.363 1.00 31.49 O ATOM 2179 CB GLU B 287 130.774 -4.855 -5.447 1.00 31.55 C ATOM 2180 CG GLU B 287 131.251 -5.086 -4.012 1.00 31.70 C ATOM 2181 CD GLU B 287 130.047 -5.085 -3.067 1.00 31.18 C ATOM 2182 OE1 GLU B 287 129.490 -6.148 -2.849 1.00 30.79 O ATOM 2183 OE2 GLU B 287 129.703 -4.022 -2.578 1.00 31.25 O ATOM 0 H GLU B 287 132.310 -2.867 -5.952 1.00 30.53 H new ATOM 0 HA GLU B 287 132.505 -5.868 -6.309 1.00 30.99 H new ATOM 0 HB2 GLU B 287 130.288 -3.882 -5.527 1.00 31.55 H new ATOM 0 HB3 GLU B 287 130.031 -5.605 -5.719 1.00 31.55 H new ATOM 0 HG2 GLU B 287 131.781 -6.036 -3.942 1.00 31.70 H new ATOM 0 HG3 GLU B 287 131.955 -4.306 -3.722 1.00 31.70 H new ATOM 2190 N SER B 288 131.365 -5.944 -8.528 1.00 31.50 N ATOM 2191 CA SER B 288 130.918 -5.926 -9.955 1.00 31.93 C ATOM 2192 C SER B 288 129.875 -7.019 -10.198 1.00 31.85 C ATOM 2193 O SER B 288 129.966 -8.105 -9.655 1.00 31.73 O ATOM 2194 CB SER B 288 132.182 -6.201 -10.768 1.00 32.21 C ATOM 2195 OG SER B 288 131.881 -6.094 -12.154 1.00 32.60 O ATOM 0 H SER B 288 131.550 -6.872 -8.147 1.00 31.50 H new ATOM 0 HA SER B 288 130.453 -4.979 -10.230 1.00 31.93 H new ATOM 0 HB2 SER B 288 132.964 -5.491 -10.498 1.00 32.21 H new ATOM 0 HB3 SER B 288 132.564 -7.197 -10.543 1.00 32.21 H new ATOM 0 HG SER B 288 131.862 -6.988 -12.555 1.00 32.60 H new ATOM 2201 N HIS B 289 128.886 -6.737 -11.011 1.00 32.01 N ATOM 2202 CA HIS B 289 127.836 -7.760 -11.312 1.00 32.04 C ATOM 2203 C HIS B 289 128.222 -8.571 -12.554 1.00 32.30 C ATOM 2204 O HIS B 289 127.894 -9.738 -12.666 1.00 32.31 O ATOM 2205 CB HIS B 289 126.560 -6.958 -11.573 1.00 32.22 C ATOM 2206 CG HIS B 289 126.062 -6.214 -10.363 1.00 32.50 C ATOM 2207 ND1 HIS B 289 126.440 -4.907 -10.092 1.00 32.51 N ATOM 2208 CD2 HIS B 289 125.216 -6.579 -9.345 1.00 32.85 C ATOM 2209 CE1 HIS B 289 125.828 -4.537 -8.952 1.00 32.87 C ATOM 2210 NE2 HIS B 289 125.070 -5.519 -8.455 1.00 33.08 N ATOM 0 H HIS B 289 128.760 -5.840 -11.480 1.00 32.01 H new ATOM 0 HA HIS B 289 127.711 -8.471 -10.495 1.00 32.04 H new ATOM 0 HB2 HIS B 289 126.746 -6.246 -12.377 1.00 32.22 H new ATOM 0 HB3 HIS B 289 125.779 -7.635 -11.921 1.00 32.22 H new ATOM 0 HD2 HIS B 289 124.737 -7.542 -9.249 1.00 32.85 H new ATOM 0 HE1 HIS B 289 125.936 -3.565 -8.494 1.00 32.87 H new ATOM 0 HE2 HIS B 289 124.506 -5.496 -7.606 1.00 33.08 H new ATOM 2218 N SER B 290 128.916 -7.959 -13.484 1.00 32.59 N ATOM 2219 CA SER B 290 129.335 -8.686 -14.722 1.00 32.94 C ATOM 2220 C SER B 290 130.860 -8.671 -14.853 1.00 33.30 C ATOM 2221 O SER B 290 131.517 -7.736 -14.434 1.00 33.49 O ATOM 2222 CB SER B 290 128.692 -7.910 -15.871 1.00 33.21 C ATOM 2223 OG SER B 290 127.282 -7.889 -15.692 1.00 33.39 O ATOM 0 H SER B 290 129.211 -6.984 -13.438 1.00 32.59 H new ATOM 0 HA SER B 290 129.027 -9.732 -14.712 1.00 32.94 H new ATOM 0 HB2 SER B 290 129.082 -6.892 -15.901 1.00 33.21 H new ATOM 0 HB3 SER B 290 128.942 -8.375 -16.824 1.00 33.21 H new ATOM 0 HG SER B 290 126.866 -7.391 -16.426 1.00 33.39 H new ATOM 2229 N SER B 291 131.424 -9.704 -15.433 1.00 33.47 N ATOM 2230 CA SER B 291 132.908 -9.764 -15.599 1.00 33.90 C ATOM 2231 C SER B 291 133.268 -10.566 -16.852 1.00 34.57 C ATOM 2232 O SER B 291 133.104 -11.775 -16.825 1.00 34.91 O ATOM 2233 CB SER B 291 133.419 -10.471 -14.344 1.00 33.72 C ATOM 2234 OG SER B 291 132.993 -9.752 -13.194 1.00 33.82 O ATOM 2235 OXT SER B 291 133.703 -9.958 -17.816 1.00 34.77 O ATOM 0 H SER B 291 130.917 -10.510 -15.799 1.00 33.47 H new ATOM 0 HA SER B 291 133.351 -8.775 -15.718 1.00 33.90 H new ATOM 0 HB2 SER B 291 133.041 -11.493 -14.309 1.00 33.72 H new ATOM 0 HB3 SER B 291 134.507 -10.534 -14.365 1.00 33.72 H new ATOM 0 HG SER B 291 133.318 -10.204 -12.387 1.00 33.82 H new TER 2241 SER B 291