USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 924 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 ASN : amide:sc= -0.0089 K(o=0.31,f=-2.8!) USER MOD Set 1.2: A 118 SER OG : rot 58:sc= 0.318 USER MOD Set 2.1: A 61 GLN : amide:sc= 0.913 X(o=2.1,f=1.8) USER MOD Set 2.2: A 108 THR OG1 : rot 96:sc= 1.16 USER MOD Set 3.1: A 103 THR OG1 : rot -10:sc= 0.466 USER MOD Set 3.2: A 105 GLN : amide:sc= 1.17 X(o=1.6,f=1.5) USER MOD Set 4.1: A 99 THR OG1 : rot 180:sc= 0.202 USER MOD Set 4.2: A 106 THR OG1 : rot -102:sc= 0.0731 USER MOD Set 5.1: A 68 SER OG : rot 160:sc= 0.0147 USER MOD Set 5.2: A 95 GLN : amide:sc= -0.939 K(o=-0.92,f=-0.27) USER MOD Set 6.1: A 56 GLN : amide:sc= -1.14 K(o=-1.9,f=-0.88) USER MOD Set 6.2: A 59 GLN : amide:sc= -0.711 K(o=-1.9,f=-0.88) USER MOD Single : A 1 MET CE :methyl -157:sc= -0.129 (180deg=-0.743) USER MOD Single : A 1 MET N :NH3+ -166:sc=-0.00812 (180deg=-0.202) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl -159:sc= -0.2 (180deg=-0.758) USER MOD Single : A 6 THR OG1 : rot 48:sc= 0.334 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 11 ASN : amide:sc= -1.35! K(o=-1.4!,f=-0.082) USER MOD Single : A 13 ASN : amide:sc= -1.24 K(o=-1.2,f=-0.024) USER MOD Single : A 17 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 19 ASN : amide:sc= -0.024 K(o=-0.024,f=-0.93) USER MOD Single : A 20 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 ASN : amide:sc= 0.586 K(o=0.59,f=-8.5!) USER MOD Single : A 33 SER OG : rot -23:sc= 0.292 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -161:sc= 1.17 (180deg=0.731) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.246 X(o=-0.25,f=-0.18) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot -150:sc= -0.618 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 69 ASN : amide:sc= -2.91! C(o=-2.9!,f=-6!) USER MOD Single : A 71 ASN : amide:sc= -1.5! K(o=-1.5!,f=-0.13) USER MOD Single : A 72 THR OG1 : rot -18:sc= 0.72 USER MOD Single : A 74 LYS NZ :NH3+ -164:sc= -0.038 (180deg=-0.263) USER MOD Single : A 78 MET CE :methyl -159:sc= -0.139 (180deg=-0.727) USER MOD Single : A 80 THR OG1 : rot 24:sc= 1.26 USER MOD Single : A 81 ASN : amide:sc= -0.464 K(o=-0.46,f=-2.1!) USER MOD Single : A 83 TYR OH : rot 48:sc= 1.26 USER MOD Single : A 89 ASN : amide:sc= -0.432 X(o=-0.43,f=0) USER MOD Single : A 93 GLN : amide:sc= -1.75! K(o=-1.8!,f=0) USER MOD Single : A 97 ASN : amide:sc= -5.79! K(o=-5.8!,f=-1.1) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= -0.695 X(o=-0.7,f=-0.99) USER MOD Single : A 117 ASN : amide:sc= -0.489 K(o=-0.49,f=-9.1!) USER MOD Single : A 119 THR OG1 : rot 54:sc= 0.0541 USER MOD Single : A 122 HIS : no HD1:sc= -2.05! K(o=-2!,f=-0.3) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 HIS : no HD1:sc= -0.0743 X(o=-0.074,f=-0.072) USER MOD Single : A 125 HIS : no HD1:sc= -0.0115 X(o=-0.011,f=-0.052) USER MOD Single : A 126 HIS : no HD1:sc= -1.32 K(o=-1.3,f=-1.9) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 41.298 0.351 -64.457 1.00 0.00 N ATOM 2 CA MET A 1 41.771 -1.049 -64.353 1.00 52.33 C ATOM 3 C MET A 1 41.552 -1.578 -62.943 1.00 71.33 C ATOM 4 O MET A 1 40.656 -2.387 -62.712 1.00 1.24 O ATOM 5 CB MET A 1 43.257 -1.145 -64.720 1.00 2.44 C ATOM 6 CG MET A 1 43.550 -0.800 -66.172 1.00 75.50 C ATOM 7 SD MET A 1 45.313 -0.808 -66.548 1.00 21.34 S ATOM 8 CE MET A 1 45.889 0.530 -65.504 1.00 13.04 C ATOM 0 H1 MET A 1 41.230 0.621 -65.459 1.00 0.00 H new ATOM 0 H2 MET A 1 40.362 0.435 -64.012 1.00 0.00 H new ATOM 0 H3 MET A 1 41.969 0.981 -63.973 1.00 0.00 H new ATOM 0 HA MET A 1 41.197 -1.656 -65.053 1.00 52.33 H new ATOM 0 HB2 MET A 1 43.826 -0.476 -64.075 1.00 2.44 H new ATOM 0 HB3 MET A 1 43.608 -2.157 -64.518 1.00 2.44 H new ATOM 0 HG2 MET A 1 43.041 -1.514 -66.820 1.00 75.50 H new ATOM 0 HG3 MET A 1 43.139 0.184 -66.397 1.00 75.50 H new ATOM 0 HE1 MET A 1 46.827 0.921 -65.898 1.00 13.04 H new ATOM 0 HE2 MET A 1 45.143 1.325 -65.486 1.00 13.04 H new ATOM 0 HE3 MET A 1 46.048 0.159 -64.492 1.00 13.04 H new ATOM 20 N ALA A 2 42.352 -1.104 -61.998 1.00 12.30 N ATOM 21 CA ALA A 2 42.242 -1.552 -60.618 1.00 21.34 C ATOM 22 C ALA A 2 41.956 -0.381 -59.686 1.00 14.20 C ATOM 23 O ALA A 2 42.307 0.761 -59.986 1.00 72.13 O ATOM 24 CB ALA A 2 43.512 -2.272 -60.194 1.00 74.23 C ATOM 0 H ALA A 2 43.082 -0.411 -62.162 1.00 12.30 H new ATOM 0 HA ALA A 2 41.406 -2.249 -60.551 1.00 21.34 H new ATOM 0 HB1 ALA A 2 43.415 -2.601 -59.159 1.00 74.23 H new ATOM 0 HB2 ALA A 2 43.672 -3.137 -60.837 1.00 74.23 H new ATOM 0 HB3 ALA A 2 44.361 -1.594 -60.281 1.00 74.23 H new ATOM 30 N GLY A 3 41.305 -0.669 -58.568 1.00 50.23 N ATOM 31 CA GLY A 3 41.005 0.359 -57.589 1.00 65.14 C ATOM 32 C GLY A 3 39.536 0.714 -57.569 1.00 23.21 C ATOM 33 O GLY A 3 38.937 0.870 -56.504 1.00 32.24 O ATOM 0 H GLY A 3 40.977 -1.602 -58.319 1.00 50.23 H new ATOM 0 HA2 GLY A 3 41.308 0.016 -56.600 1.00 65.14 H new ATOM 0 HA3 GLY A 3 41.590 1.252 -57.810 1.00 65.14 H new ATOM 37 N THR A 4 38.950 0.834 -58.749 1.00 43.32 N ATOM 38 CA THR A 4 37.543 1.163 -58.873 1.00 31.21 C ATOM 39 C THR A 4 36.770 -0.046 -59.402 1.00 2.41 C ATOM 40 O THR A 4 35.829 0.085 -60.188 1.00 63.23 O ATOM 41 CB THR A 4 37.350 2.367 -59.816 1.00 4.31 C ATOM 42 OG1 THR A 4 38.409 3.312 -59.614 1.00 72.25 O ATOM 43 CG2 THR A 4 36.017 3.053 -59.563 1.00 71.44 C ATOM 0 H THR A 4 39.432 0.707 -59.639 1.00 43.32 H new ATOM 0 HA THR A 4 37.160 1.430 -57.888 1.00 31.21 H new ATOM 0 HB THR A 4 37.364 1.999 -60.842 1.00 4.31 H new ATOM 0 HG1 THR A 4 38.285 4.076 -60.216 1.00 72.25 H new ATOM 0 HG21 THR A 4 35.908 3.898 -60.242 1.00 71.44 H new ATOM 0 HG22 THR A 4 35.206 2.345 -59.732 1.00 71.44 H new ATOM 0 HG23 THR A 4 35.980 3.408 -58.533 1.00 71.44 H new ATOM 51 N MET A 5 37.178 -1.229 -58.962 1.00 11.31 N ATOM 52 CA MET A 5 36.511 -2.461 -59.353 1.00 75.43 C ATOM 53 C MET A 5 35.425 -2.800 -58.332 1.00 15.13 C ATOM 54 O MET A 5 35.672 -2.788 -57.125 1.00 24.32 O ATOM 55 CB MET A 5 37.524 -3.606 -59.461 1.00 22.24 C ATOM 56 CG MET A 5 36.950 -4.886 -60.049 1.00 23.44 C ATOM 57 SD MET A 5 38.181 -6.196 -60.202 1.00 11.43 S ATOM 58 CE MET A 5 39.354 -5.437 -61.325 1.00 45.42 C ATOM 0 H MET A 5 37.970 -1.360 -58.333 1.00 11.31 H new ATOM 0 HA MET A 5 36.049 -2.323 -60.331 1.00 75.43 H new ATOM 0 HB2 MET A 5 38.362 -3.279 -60.077 1.00 22.24 H new ATOM 0 HB3 MET A 5 37.922 -3.820 -58.469 1.00 22.24 H new ATOM 0 HG2 MET A 5 36.131 -5.235 -59.420 1.00 23.44 H new ATOM 0 HG3 MET A 5 36.529 -4.673 -61.031 1.00 23.44 H new ATOM 0 HE1 MET A 5 39.952 -6.212 -61.805 1.00 45.42 H new ATOM 0 HE2 MET A 5 38.816 -4.871 -62.085 1.00 45.42 H new ATOM 0 HE3 MET A 5 40.009 -4.766 -60.769 1.00 45.42 H new ATOM 68 N THR A 6 34.229 -3.101 -58.818 1.00 41.42 N ATOM 69 CA THR A 6 33.074 -3.294 -57.952 1.00 43.12 C ATOM 70 C THR A 6 33.101 -4.639 -57.225 1.00 64.43 C ATOM 71 O THR A 6 32.593 -5.645 -57.730 1.00 60.42 O ATOM 72 CB THR A 6 31.770 -3.164 -58.762 1.00 74.21 C ATOM 73 OG1 THR A 6 31.822 -4.032 -59.901 1.00 54.11 O ATOM 74 CG2 THR A 6 31.564 -1.729 -59.223 1.00 62.12 C ATOM 0 H THR A 6 34.033 -3.217 -59.812 1.00 41.42 H new ATOM 0 HA THR A 6 33.116 -2.513 -57.192 1.00 43.12 H new ATOM 0 HB THR A 6 30.934 -3.447 -58.122 1.00 74.21 H new ATOM 0 HG1 THR A 6 32.122 -4.922 -59.621 1.00 54.11 H new ATOM 0 HG21 THR A 6 30.638 -1.659 -59.793 1.00 62.12 H new ATOM 0 HG22 THR A 6 31.506 -1.073 -58.355 1.00 62.12 H new ATOM 0 HG23 THR A 6 32.401 -1.425 -59.852 1.00 62.12 H new ATOM 82 N PHE A 7 33.717 -4.651 -56.050 1.00 42.33 N ATOM 83 CA PHE A 7 33.731 -5.835 -55.196 1.00 74.33 C ATOM 84 C PHE A 7 33.593 -5.451 -53.727 1.00 63.13 C ATOM 85 O PHE A 7 32.554 -5.676 -53.112 1.00 64.35 O ATOM 86 CB PHE A 7 35.014 -6.653 -55.396 1.00 24.13 C ATOM 87 CG PHE A 7 34.985 -7.560 -56.595 1.00 71.12 C ATOM 88 CD1 PHE A 7 35.692 -7.241 -57.743 1.00 75.04 C ATOM 89 CD2 PHE A 7 34.252 -8.736 -56.568 1.00 54.44 C ATOM 90 CE1 PHE A 7 35.667 -8.079 -58.840 1.00 24.44 C ATOM 91 CE2 PHE A 7 34.224 -9.577 -57.663 1.00 13.11 C ATOM 92 CZ PHE A 7 34.933 -9.248 -58.801 1.00 63.23 C ATOM 0 H PHE A 7 34.217 -3.850 -55.664 1.00 42.33 H new ATOM 0 HA PHE A 7 32.878 -6.449 -55.484 1.00 74.33 H new ATOM 0 HB2 PHE A 7 35.857 -5.969 -55.492 1.00 24.13 H new ATOM 0 HB3 PHE A 7 35.192 -7.254 -54.504 1.00 24.13 H new ATOM 0 HD1 PHE A 7 36.268 -6.328 -57.780 1.00 75.04 H new ATOM 0 HD2 PHE A 7 33.696 -8.998 -55.680 1.00 54.44 H new ATOM 0 HE1 PHE A 7 36.222 -7.820 -59.729 1.00 24.44 H new ATOM 0 HE2 PHE A 7 33.649 -10.490 -57.629 1.00 13.11 H new ATOM 0 HZ PHE A 7 34.914 -9.904 -59.659 1.00 63.23 H new ATOM 102 N GLN A 8 34.643 -4.862 -53.173 1.00 31.11 N ATOM 103 CA GLN A 8 34.668 -4.522 -51.753 1.00 22.32 C ATOM 104 C GLN A 8 34.079 -3.145 -51.490 1.00 73.41 C ATOM 105 O GLN A 8 33.270 -2.980 -50.575 1.00 70.13 O ATOM 106 CB GLN A 8 36.099 -4.582 -51.228 1.00 44.31 C ATOM 107 CG GLN A 8 36.665 -5.990 -51.184 1.00 2.34 C ATOM 108 CD GLN A 8 38.106 -6.029 -50.716 1.00 35.43 C ATOM 109 OE1 GLN A 8 38.877 -5.104 -50.957 1.00 50.31 O ATOM 110 NE2 GLN A 8 38.473 -7.091 -50.021 1.00 14.45 N ATOM 0 H GLN A 8 35.489 -4.609 -53.683 1.00 31.11 H new ATOM 0 HA GLN A 8 34.053 -5.253 -51.228 1.00 22.32 H new ATOM 0 HB2 GLN A 8 36.736 -3.962 -51.858 1.00 44.31 H new ATOM 0 HB3 GLN A 8 36.129 -4.155 -50.226 1.00 44.31 H new ATOM 0 HG2 GLN A 8 36.055 -6.601 -50.519 1.00 2.34 H new ATOM 0 HG3 GLN A 8 36.598 -6.435 -52.177 1.00 2.34 H new ATOM 0 HE21 GLN A 8 37.803 -7.839 -49.841 1.00 14.45 H new ATOM 0 HE22 GLN A 8 39.426 -7.163 -49.664 1.00 14.45 H new ATOM 119 N PHE A 9 34.489 -2.167 -52.303 1.00 73.24 N ATOM 120 CA PHE A 9 34.080 -0.767 -52.135 1.00 4.13 C ATOM 121 C PHE A 9 34.681 -0.171 -50.860 1.00 32.53 C ATOM 122 O PHE A 9 35.057 -0.891 -49.934 1.00 20.24 O ATOM 123 CB PHE A 9 32.551 -0.619 -52.101 1.00 55.13 C ATOM 124 CG PHE A 9 31.844 -1.150 -53.317 1.00 3.12 C ATOM 125 CD1 PHE A 9 31.154 -2.351 -53.263 1.00 54.02 C ATOM 126 CD2 PHE A 9 31.862 -0.447 -54.511 1.00 53.11 C ATOM 127 CE1 PHE A 9 30.499 -2.842 -54.376 1.00 4.52 C ATOM 128 CE2 PHE A 9 31.209 -0.933 -55.626 1.00 31.40 C ATOM 129 CZ PHE A 9 30.526 -2.132 -55.558 1.00 63.11 C ATOM 0 H PHE A 9 35.113 -2.322 -53.095 1.00 73.24 H new ATOM 0 HA PHE A 9 34.458 -0.221 -52.999 1.00 4.13 H new ATOM 0 HB2 PHE A 9 32.169 -1.135 -51.220 1.00 55.13 H new ATOM 0 HB3 PHE A 9 32.304 0.436 -51.985 1.00 55.13 H new ATOM 0 HD1 PHE A 9 31.128 -2.910 -52.339 1.00 54.02 H new ATOM 0 HD2 PHE A 9 32.393 0.492 -54.570 1.00 53.11 H new ATOM 0 HE1 PHE A 9 29.967 -3.780 -54.320 1.00 4.52 H new ATOM 0 HE2 PHE A 9 31.232 -0.376 -56.551 1.00 31.40 H new ATOM 0 HZ PHE A 9 30.014 -2.513 -56.429 1.00 63.11 H new ATOM 139 N ARG A 10 34.791 1.148 -50.821 1.00 62.51 N ATOM 140 CA ARG A 10 35.266 1.832 -49.628 1.00 44.32 C ATOM 141 C ARG A 10 34.179 1.866 -48.562 1.00 21.34 C ATOM 142 O ARG A 10 34.468 1.715 -47.375 1.00 35.21 O ATOM 143 CB ARG A 10 35.730 3.252 -49.962 1.00 21.20 C ATOM 144 CG ARG A 10 37.248 3.426 -50.002 1.00 72.03 C ATOM 145 CD ARG A 10 37.909 2.603 -51.103 1.00 53.43 C ATOM 146 NE ARG A 10 37.939 1.172 -50.797 1.00 61.25 N ATOM 147 CZ ARG A 10 38.385 0.238 -51.635 1.00 52.03 C ATOM 148 NH1 ARG A 10 38.910 0.586 -52.804 1.00 11.40 N1+ ATOM 149 NH2 ARG A 10 38.328 -1.042 -51.290 1.00 60.33 N ATOM 0 H ARG A 10 34.559 1.765 -51.599 1.00 62.51 H new ATOM 0 HA ARG A 10 36.119 1.277 -49.237 1.00 44.32 H new ATOM 0 HB2 ARG A 10 35.318 3.538 -50.930 1.00 21.20 H new ATOM 0 HB3 ARG A 10 35.317 3.939 -49.224 1.00 21.20 H new ATOM 0 HG2 ARG A 10 37.484 4.480 -50.151 1.00 72.03 H new ATOM 0 HG3 ARG A 10 37.668 3.138 -49.038 1.00 72.03 H new ATOM 0 HD2 ARG A 10 37.373 2.759 -52.039 1.00 53.43 H new ATOM 0 HD3 ARG A 10 38.928 2.959 -51.256 1.00 53.43 H new ATOM 0 HE ARG A 10 37.597 0.871 -49.884 1.00 61.25 H new ATOM 0 HH11 ARG A 10 38.972 1.571 -53.062 1.00 11.40 H new ATOM 0 HH12 ARG A 10 39.251 -0.132 -53.444 1.00 11.40 H new ATOM 0 HH21 ARG A 10 37.943 -1.309 -50.384 1.00 60.33 H new ATOM 0 HH22 ARG A 10 38.669 -1.759 -51.931 1.00 60.33 H new ATOM 163 N ASN A 11 32.936 2.053 -49.009 1.00 4.11 N ATOM 164 CA ASN A 11 31.763 2.072 -48.129 1.00 44.33 C ATOM 165 C ASN A 11 31.819 3.264 -47.171 1.00 62.55 C ATOM 166 O ASN A 11 32.339 3.157 -46.061 1.00 3.33 O ATOM 167 CB ASN A 11 31.634 0.762 -47.339 1.00 42.41 C ATOM 168 CG ASN A 11 30.244 0.553 -46.764 1.00 62.50 C ATOM 169 OD1 ASN A 11 30.084 0.001 -45.675 1.00 63.14 O ATOM 170 ND2 ASN A 11 29.226 0.958 -47.509 1.00 43.24 N ATOM 0 H ASN A 11 32.712 2.196 -49.994 1.00 4.11 H new ATOM 0 HA ASN A 11 30.882 2.174 -48.762 1.00 44.33 H new ATOM 0 HB2 ASN A 11 31.882 -0.076 -47.991 1.00 42.41 H new ATOM 0 HB3 ASN A 11 32.362 0.760 -46.527 1.00 42.41 H new ATOM 0 HD21 ASN A 11 28.269 0.816 -47.186 1.00 43.24 H new ATOM 0 HD22 ASN A 11 29.399 1.412 -48.406 1.00 43.24 H new ATOM 177 N PRO A 12 31.323 4.429 -47.613 1.00 71.33 N ATOM 178 CA PRO A 12 31.353 5.664 -46.820 1.00 34.14 C ATOM 179 C PRO A 12 30.504 5.578 -45.551 1.00 51.42 C ATOM 180 O PRO A 12 29.407 5.010 -45.565 1.00 63.23 O ATOM 181 CB PRO A 12 30.775 6.724 -47.770 1.00 5.44 C ATOM 182 CG PRO A 12 30.837 6.116 -49.129 1.00 13.40 C ATOM 183 CD PRO A 12 30.693 4.638 -48.923 1.00 22.12 C ATOM 0 HA PRO A 12 32.362 5.884 -46.471 1.00 34.14 H new ATOM 0 HB2 PRO A 12 29.750 6.976 -47.499 1.00 5.44 H new ATOM 0 HB3 PRO A 12 31.353 7.647 -47.726 1.00 5.44 H new ATOM 0 HG2 PRO A 12 30.041 6.501 -49.766 1.00 13.40 H new ATOM 0 HG3 PRO A 12 31.781 6.352 -49.620 1.00 13.40 H new ATOM 0 HD2 PRO A 12 29.648 4.330 -48.923 1.00 22.12 H new ATOM 0 HD3 PRO A 12 31.193 4.070 -49.707 1.00 22.12 H new ATOM 191 N ASN A 13 31.029 6.151 -44.466 1.00 41.30 N ATOM 192 CA ASN A 13 30.331 6.232 -43.176 1.00 75.43 C ATOM 193 C ASN A 13 30.242 4.872 -42.489 1.00 53.44 C ATOM 194 O ASN A 13 30.596 3.839 -43.061 1.00 60.03 O ATOM 195 CB ASN A 13 28.927 6.836 -43.326 1.00 5.35 C ATOM 196 CG ASN A 13 28.939 8.291 -43.763 1.00 12.51 C ATOM 197 OD1 ASN A 13 28.024 8.749 -44.445 1.00 74.54 O ATOM 198 ND2 ASN A 13 29.966 9.030 -43.368 1.00 31.22 N ATOM 0 H ASN A 13 31.956 6.575 -44.455 1.00 41.30 H new ATOM 0 HA ASN A 13 30.926 6.894 -42.547 1.00 75.43 H new ATOM 0 HB2 ASN A 13 28.364 6.251 -44.053 1.00 5.35 H new ATOM 0 HB3 ASN A 13 28.401 6.754 -42.375 1.00 5.35 H new ATOM 0 HD21 ASN A 13 30.016 10.015 -43.629 1.00 31.22 H new ATOM 0 HD22 ASN A 13 30.706 8.614 -42.803 1.00 31.22 H new ATOM 205 N PHE A 14 29.763 4.886 -41.253 1.00 62.35 N ATOM 206 CA PHE A 14 29.666 3.682 -40.445 1.00 0.14 C ATOM 207 C PHE A 14 28.298 3.614 -39.770 1.00 75.23 C ATOM 208 O PHE A 14 27.705 4.644 -39.437 1.00 23.43 O ATOM 209 CB PHE A 14 30.782 3.678 -39.393 1.00 41.22 C ATOM 210 CG PHE A 14 30.785 2.475 -38.495 1.00 21.33 C ATOM 211 CD1 PHE A 14 30.305 2.560 -37.196 1.00 5.43 C ATOM 212 CD2 PHE A 14 31.260 1.258 -38.949 1.00 23.12 C ATOM 213 CE1 PHE A 14 30.302 1.453 -36.370 1.00 32.32 C ATOM 214 CE2 PHE A 14 31.262 0.149 -38.127 1.00 54.41 C ATOM 215 CZ PHE A 14 30.778 0.246 -36.837 1.00 3.14 C ATOM 0 H PHE A 14 29.432 5.730 -40.785 1.00 62.35 H new ATOM 0 HA PHE A 14 29.780 2.807 -41.085 1.00 0.14 H new ATOM 0 HB2 PHE A 14 31.744 3.739 -39.902 1.00 41.22 H new ATOM 0 HB3 PHE A 14 30.689 4.574 -38.779 1.00 41.22 H new ATOM 0 HD1 PHE A 14 29.929 3.503 -36.826 1.00 5.43 H new ATOM 0 HD2 PHE A 14 31.634 1.174 -39.959 1.00 23.12 H new ATOM 0 HE1 PHE A 14 29.928 1.533 -35.360 1.00 32.32 H new ATOM 0 HE2 PHE A 14 31.642 -0.794 -38.492 1.00 54.41 H new ATOM 0 HZ PHE A 14 30.772 -0.622 -36.195 1.00 3.14 H new ATOM 225 N GLY A 15 27.797 2.402 -39.576 1.00 54.15 N ATOM 226 CA GLY A 15 26.525 2.214 -38.909 1.00 71.23 C ATOM 227 C GLY A 15 26.648 2.294 -37.398 1.00 65.22 C ATOM 228 O GLY A 15 26.417 1.308 -36.698 1.00 42.44 O ATOM 0 H GLY A 15 28.254 1.539 -39.872 1.00 54.15 H new ATOM 0 HA2 GLY A 15 25.821 2.971 -39.254 1.00 71.23 H new ATOM 0 HA3 GLY A 15 26.112 1.244 -39.187 1.00 71.23 H new ATOM 232 N GLY A 16 27.019 3.468 -36.903 1.00 14.53 N ATOM 233 CA GLY A 16 27.153 3.683 -35.474 1.00 0.24 C ATOM 234 C GLY A 16 27.019 5.149 -35.121 1.00 22.35 C ATOM 235 O GLY A 16 28.015 5.838 -34.899 1.00 73.33 O ATOM 0 H GLY A 16 27.232 4.286 -37.474 1.00 14.53 H new ATOM 0 HA2 GLY A 16 26.392 3.109 -34.945 1.00 0.24 H new ATOM 0 HA3 GLY A 16 28.122 3.313 -35.138 1.00 0.24 H new ATOM 239 N ASN A 17 25.786 5.624 -35.073 1.00 43.33 N ATOM 240 CA ASN A 17 25.514 7.040 -34.855 1.00 1.12 C ATOM 241 C ASN A 17 25.316 7.338 -33.375 1.00 62.33 C ATOM 242 O ASN A 17 24.962 6.445 -32.600 1.00 61.32 O ATOM 243 CB ASN A 17 24.269 7.468 -35.636 1.00 21.55 C ATOM 244 CG ASN A 17 24.465 7.424 -37.139 1.00 72.14 C ATOM 245 OD1 ASN A 17 25.570 7.619 -37.646 1.00 51.22 O ATOM 246 ND2 ASN A 17 23.390 7.164 -37.866 1.00 0.34 N ATOM 0 H ASN A 17 24.951 5.048 -35.182 1.00 43.33 H new ATOM 0 HA ASN A 17 26.376 7.605 -35.211 1.00 1.12 H new ATOM 0 HB2 ASN A 17 23.436 6.819 -35.365 1.00 21.55 H new ATOM 0 HB3 ASN A 17 23.993 8.480 -35.341 1.00 21.55 H new ATOM 0 HD21 ASN A 17 23.460 7.120 -38.883 1.00 0.34 H new ATOM 0 HD22 ASN A 17 22.491 7.008 -37.410 1.00 0.34 H new ATOM 253 N PRO A 18 25.559 8.597 -32.962 1.00 24.35 N ATOM 254 CA PRO A 18 25.331 9.040 -31.583 1.00 21.23 C ATOM 255 C PRO A 18 23.880 8.842 -31.158 1.00 14.44 C ATOM 256 O PRO A 18 22.954 9.129 -31.920 1.00 61.41 O ATOM 257 CB PRO A 18 25.679 10.535 -31.611 1.00 45.30 C ATOM 258 CG PRO A 18 25.667 10.915 -33.051 1.00 32.23 C ATOM 259 CD PRO A 18 26.084 9.686 -33.802 1.00 15.21 C ATOM 0 HA PRO A 18 25.928 8.472 -30.870 1.00 21.23 H new ATOM 0 HB2 PRO A 18 24.953 11.118 -31.044 1.00 45.30 H new ATOM 0 HB3 PRO A 18 26.656 10.720 -31.164 1.00 45.30 H new ATOM 0 HG2 PRO A 18 24.675 11.244 -33.360 1.00 32.23 H new ATOM 0 HG3 PRO A 18 26.351 11.741 -33.243 1.00 32.23 H new ATOM 0 HD2 PRO A 18 25.661 9.662 -34.806 1.00 15.21 H new ATOM 0 HD3 PRO A 18 27.167 9.627 -33.911 1.00 15.21 H new ATOM 267 N ASN A 19 23.687 8.361 -29.939 1.00 23.42 N ATOM 268 CA ASN A 19 22.353 8.043 -29.447 1.00 64.52 C ATOM 269 C ASN A 19 22.205 8.444 -27.981 1.00 63.24 C ATOM 270 O ASN A 19 23.159 8.336 -27.207 1.00 74.52 O ATOM 271 CB ASN A 19 22.082 6.544 -29.607 1.00 34.52 C ATOM 272 CG ASN A 19 20.678 6.149 -29.190 1.00 65.20 C ATOM 273 OD1 ASN A 19 19.723 6.912 -29.359 1.00 30.24 O ATOM 274 ND2 ASN A 19 20.548 4.958 -28.627 1.00 44.43 N ATOM 0 H ASN A 19 24.437 8.182 -29.271 1.00 23.42 H new ATOM 0 HA ASN A 19 21.627 8.606 -30.033 1.00 64.52 H new ATOM 0 HB2 ASN A 19 22.239 6.261 -30.648 1.00 34.52 H new ATOM 0 HB3 ASN A 19 22.803 5.984 -29.012 1.00 34.52 H new ATOM 0 HD21 ASN A 19 19.631 4.639 -28.314 1.00 44.43 H new ATOM 0 HD22 ASN A 19 21.365 4.359 -28.507 1.00 44.43 H new ATOM 281 N ASN A 20 21.001 8.897 -27.626 1.00 0.34 N ATOM 282 CA ASN A 20 20.656 9.306 -26.259 1.00 2.02 C ATOM 283 C ASN A 20 21.393 10.574 -25.840 1.00 40.34 C ATOM 284 O ASN A 20 22.588 10.550 -25.549 1.00 74.24 O ATOM 285 CB ASN A 20 20.926 8.190 -25.242 1.00 1.51 C ATOM 286 CG ASN A 20 20.566 8.613 -23.828 1.00 51.11 C ATOM 287 OD1 ASN A 20 19.644 9.402 -23.618 1.00 52.43 O ATOM 288 ND2 ASN A 20 21.295 8.099 -22.850 1.00 2.01 N ATOM 0 H ASN A 20 20.228 8.992 -28.285 1.00 0.34 H new ATOM 0 HA ASN A 20 19.586 9.515 -26.267 1.00 2.02 H new ATOM 0 HB2 ASN A 20 20.351 7.305 -25.514 1.00 1.51 H new ATOM 0 HB3 ASN A 20 21.979 7.911 -25.280 1.00 1.51 H new ATOM 0 HD21 ASN A 20 21.101 8.354 -21.881 1.00 2.01 H new ATOM 0 HD22 ASN A 20 22.051 7.448 -23.065 1.00 2.01 H new ATOM 295 N GLY A 21 20.666 11.679 -25.805 1.00 62.44 N ATOM 296 CA GLY A 21 21.236 12.931 -25.364 1.00 13.55 C ATOM 297 C GLY A 21 20.320 13.644 -24.395 1.00 0.45 C ATOM 298 O GLY A 21 19.915 14.782 -24.632 1.00 25.41 O ATOM 0 H GLY A 21 19.684 11.730 -26.077 1.00 62.44 H new ATOM 0 HA2 GLY A 21 22.199 12.746 -24.888 1.00 13.55 H new ATOM 0 HA3 GLY A 21 21.424 13.570 -26.226 1.00 13.55 H new ATOM 302 N ALA A 22 19.981 12.966 -23.303 1.00 11.14 N ATOM 303 CA ALA A 22 19.071 13.517 -22.304 1.00 24.15 C ATOM 304 C ALA A 22 19.785 14.518 -21.397 1.00 21.32 C ATOM 305 O ALA A 22 20.017 14.259 -20.213 1.00 64.10 O ATOM 306 CB ALA A 22 18.440 12.401 -21.485 1.00 21.11 C ATOM 0 H ALA A 22 20.324 12.030 -23.087 1.00 11.14 H new ATOM 0 HA ALA A 22 18.279 14.051 -22.828 1.00 24.15 H new ATOM 0 HB1 ALA A 22 17.764 12.830 -20.745 1.00 21.11 H new ATOM 0 HB2 ALA A 22 17.881 11.737 -22.145 1.00 21.11 H new ATOM 0 HB3 ALA A 22 19.222 11.835 -20.978 1.00 21.11 H new ATOM 312 N PHE A 23 20.160 15.643 -21.975 1.00 32.04 N ATOM 313 CA PHE A 23 20.804 16.718 -21.243 1.00 53.22 C ATOM 314 C PHE A 23 20.819 17.956 -22.124 1.00 65.32 C ATOM 315 O PHE A 23 21.639 18.068 -23.035 1.00 62.34 O ATOM 316 CB PHE A 23 22.230 16.327 -20.851 1.00 65.22 C ATOM 317 CG PHE A 23 22.691 16.943 -19.557 1.00 71.25 C ATOM 318 CD1 PHE A 23 23.283 18.196 -19.537 1.00 53.43 C ATOM 319 CD2 PHE A 23 22.528 16.265 -18.359 1.00 21.43 C ATOM 320 CE1 PHE A 23 23.701 18.758 -18.344 1.00 0.12 C ATOM 321 CE2 PHE A 23 22.944 16.824 -17.166 1.00 3.24 C ATOM 322 CZ PHE A 23 23.531 18.071 -17.159 1.00 64.54 C ATOM 0 H PHE A 23 20.027 15.838 -22.967 1.00 32.04 H new ATOM 0 HA PHE A 23 20.252 16.919 -20.325 1.00 53.22 H new ATOM 0 HB2 PHE A 23 22.290 15.242 -20.769 1.00 65.22 H new ATOM 0 HB3 PHE A 23 22.911 16.625 -21.648 1.00 65.22 H new ATOM 0 HD1 PHE A 23 23.419 18.738 -20.461 1.00 53.43 H new ATOM 0 HD2 PHE A 23 22.070 15.287 -18.358 1.00 21.43 H new ATOM 0 HE1 PHE A 23 24.161 19.735 -18.340 1.00 0.12 H new ATOM 0 HE2 PHE A 23 22.809 16.285 -16.240 1.00 3.24 H new ATOM 0 HZ PHE A 23 23.857 18.510 -16.228 1.00 64.54 H new ATOM 332 N LEU A 24 19.897 18.873 -21.866 1.00 53.34 N ATOM 333 CA LEU A 24 19.668 19.991 -22.772 1.00 51.34 C ATOM 334 C LEU A 24 20.140 21.314 -22.182 1.00 45.44 C ATOM 335 O LEU A 24 20.053 22.352 -22.837 1.00 10.11 O ATOM 336 CB LEU A 24 18.179 20.086 -23.122 1.00 62.32 C ATOM 337 CG LEU A 24 17.581 18.846 -23.785 1.00 3.14 C ATOM 338 CD1 LEU A 24 16.088 19.031 -24.015 1.00 23.03 C ATOM 339 CD2 LEU A 24 18.293 18.550 -25.094 1.00 11.23 C ATOM 0 H LEU A 24 19.298 18.866 -21.041 1.00 53.34 H new ATOM 0 HA LEU A 24 20.251 19.803 -23.674 1.00 51.34 H new ATOM 0 HB2 LEU A 24 17.621 20.294 -22.209 1.00 62.32 H new ATOM 0 HB3 LEU A 24 18.033 20.938 -23.786 1.00 62.32 H new ATOM 0 HG LEU A 24 17.720 17.995 -23.118 1.00 3.14 H new ATOM 0 HD11 LEU A 24 15.679 18.138 -24.488 1.00 23.03 H new ATOM 0 HD12 LEU A 24 15.590 19.196 -23.059 1.00 23.03 H new ATOM 0 HD13 LEU A 24 15.924 19.892 -24.663 1.00 23.03 H new ATOM 0 HD21 LEU A 24 17.855 17.664 -25.554 1.00 11.23 H new ATOM 0 HD22 LEU A 24 18.184 19.400 -25.768 1.00 11.23 H new ATOM 0 HD23 LEU A 24 19.351 18.373 -24.901 1.00 11.23 H new ATOM 351 N LEU A 25 20.627 21.286 -20.949 1.00 14.23 N ATOM 352 CA LEU A 25 21.075 22.508 -20.293 1.00 22.42 C ATOM 353 C LEU A 25 22.594 22.630 -20.320 1.00 42.44 C ATOM 354 O LEU A 25 23.133 23.494 -21.012 1.00 41.32 O ATOM 355 CB LEU A 25 20.565 22.559 -18.852 1.00 52.44 C ATOM 356 CG LEU A 25 19.043 22.624 -18.703 1.00 3.52 C ATOM 357 CD1 LEU A 25 18.655 22.671 -17.236 1.00 35.34 C ATOM 358 CD2 LEU A 25 18.490 23.839 -19.436 1.00 34.05 C ATOM 0 H LEU A 25 20.722 20.440 -20.387 1.00 14.23 H new ATOM 0 HA LEU A 25 20.661 23.352 -20.845 1.00 22.42 H new ATOM 0 HB2 LEU A 25 20.929 21.678 -18.323 1.00 52.44 H new ATOM 0 HB3 LEU A 25 21.000 23.429 -18.360 1.00 52.44 H new ATOM 0 HG LEU A 25 18.614 21.725 -19.146 1.00 3.52 H new ATOM 0 HD11 LEU A 25 17.570 22.717 -17.148 1.00 35.34 H new ATOM 0 HD12 LEU A 25 19.022 21.776 -16.734 1.00 35.34 H new ATOM 0 HD13 LEU A 25 19.094 23.554 -16.772 1.00 35.34 H new ATOM 0 HD21 LEU A 25 17.407 23.871 -19.321 1.00 34.05 H new ATOM 0 HD22 LEU A 25 18.927 24.746 -19.018 1.00 34.05 H new ATOM 0 HD23 LEU A 25 18.740 23.770 -20.495 1.00 34.05 H new ATOM 370 N ASN A 26 23.266 21.748 -19.578 1.00 73.20 N ATOM 371 CA ASN A 26 24.724 21.793 -19.410 1.00 60.40 C ATOM 372 C ASN A 26 25.134 23.045 -18.640 1.00 55.24 C ATOM 373 O ASN A 26 25.227 24.142 -19.193 1.00 70.31 O ATOM 374 CB ASN A 26 25.459 21.712 -20.759 1.00 52.12 C ATOM 375 CG ASN A 26 26.970 21.722 -20.600 1.00 31.52 C ATOM 376 OD1 ASN A 26 27.605 22.775 -20.630 1.00 61.41 O ATOM 377 ND2 ASN A 26 27.556 20.548 -20.422 1.00 0.40 N ATOM 0 H ASN A 26 22.817 20.982 -19.076 1.00 73.20 H new ATOM 0 HA ASN A 26 25.017 20.917 -18.832 1.00 60.40 H new ATOM 0 HB2 ASN A 26 25.158 20.803 -21.279 1.00 52.12 H new ATOM 0 HB3 ASN A 26 25.157 22.552 -21.385 1.00 52.12 H new ATOM 0 HD21 ASN A 26 28.568 20.496 -20.304 1.00 0.40 H new ATOM 0 HD22 ASN A 26 26.996 19.696 -20.403 1.00 0.40 H new ATOM 384 N SER A 27 25.364 22.871 -17.351 1.00 41.42 N ATOM 385 CA SER A 27 25.650 23.984 -16.469 1.00 71.35 C ATOM 386 C SER A 27 27.131 24.350 -16.522 1.00 32.44 C ATOM 387 O SER A 27 27.959 23.733 -15.855 1.00 10.41 O ATOM 388 CB SER A 27 25.236 23.625 -15.043 1.00 30.22 C ATOM 389 OG SER A 27 23.925 23.071 -15.021 1.00 62.34 O ATOM 0 H SER A 27 25.358 21.961 -16.890 1.00 41.42 H new ATOM 0 HA SER A 27 25.079 24.852 -16.799 1.00 71.35 H new ATOM 0 HB2 SER A 27 25.944 22.911 -14.623 1.00 30.22 H new ATOM 0 HB3 SER A 27 25.270 24.515 -14.415 1.00 30.22 H new ATOM 0 HG SER A 27 23.680 22.847 -14.099 1.00 62.34 H new ATOM 395 N ALA A 28 27.457 25.337 -17.348 1.00 11.40 N ATOM 396 CA ALA A 28 28.829 25.801 -17.482 1.00 74.12 C ATOM 397 C ALA A 28 29.278 26.536 -16.225 1.00 32.20 C ATOM 398 O ALA A 28 30.318 26.212 -15.645 1.00 40.33 O ATOM 399 CB ALA A 28 28.973 26.697 -18.702 1.00 11.11 C ATOM 0 H ALA A 28 26.786 25.832 -17.936 1.00 11.40 H new ATOM 0 HA ALA A 28 29.470 24.930 -17.615 1.00 74.12 H new ATOM 0 HB1 ALA A 28 30.006 27.034 -18.786 1.00 11.11 H new ATOM 0 HB2 ALA A 28 28.700 26.139 -19.598 1.00 11.11 H new ATOM 0 HB3 ALA A 28 28.316 27.561 -18.598 1.00 11.11 H new ATOM 405 N GLN A 29 28.481 27.525 -15.813 1.00 51.32 N ATOM 406 CA GLN A 29 28.769 28.338 -14.629 1.00 50.44 C ATOM 407 C GLN A 29 30.091 29.096 -14.804 1.00 51.32 C ATOM 408 O GLN A 29 30.733 29.498 -13.830 1.00 65.31 O ATOM 409 CB GLN A 29 28.811 27.453 -13.376 1.00 25.01 C ATOM 410 CG GLN A 29 28.707 28.220 -12.068 1.00 22.41 C ATOM 411 CD GLN A 29 28.747 27.308 -10.865 1.00 13.34 C ATOM 412 OE1 GLN A 29 27.715 26.822 -10.411 1.00 43.24 O ATOM 413 NE2 GLN A 29 29.937 27.071 -10.336 1.00 45.43 N ATOM 0 H GLN A 29 27.618 27.785 -16.291 1.00 51.32 H new ATOM 0 HA GLN A 29 27.972 29.072 -14.507 1.00 50.44 H new ATOM 0 HB2 GLN A 29 27.996 26.731 -13.427 1.00 25.01 H new ATOM 0 HB3 GLN A 29 29.741 26.884 -13.378 1.00 25.01 H new ATOM 0 HG2 GLN A 29 29.525 28.938 -12.004 1.00 22.41 H new ATOM 0 HG3 GLN A 29 27.779 28.792 -12.057 1.00 22.41 H new ATOM 0 HE21 GLN A 29 30.770 27.495 -10.744 1.00 45.43 H new ATOM 0 HE22 GLN A 29 30.021 26.464 -9.520 1.00 45.43 H new ATOM 422 N ALA A 30 30.482 29.307 -16.051 1.00 32.35 N ATOM 423 CA ALA A 30 31.734 29.975 -16.360 1.00 75.25 C ATOM 424 C ALA A 30 31.547 30.932 -17.519 1.00 2.24 C ATOM 425 O ALA A 30 30.677 30.729 -18.368 1.00 44.53 O ATOM 426 CB ALA A 30 32.813 28.956 -16.689 1.00 53.52 C ATOM 0 H ALA A 30 29.945 29.022 -16.870 1.00 32.35 H new ATOM 0 HA ALA A 30 32.048 30.543 -15.484 1.00 75.25 H new ATOM 0 HB1 ALA A 30 33.745 29.474 -16.918 1.00 53.52 H new ATOM 0 HB2 ALA A 30 32.965 28.298 -15.834 1.00 53.52 H new ATOM 0 HB3 ALA A 30 32.505 28.365 -17.551 1.00 53.52 H new ATOM 432 N GLN A 31 32.361 31.972 -17.546 1.00 62.43 N ATOM 433 CA GLN A 31 32.301 32.965 -18.603 1.00 45.15 C ATOM 434 C GLN A 31 33.388 32.689 -19.634 1.00 11.34 C ATOM 435 O GLN A 31 33.141 32.057 -20.661 1.00 33.30 O ATOM 436 CB GLN A 31 32.477 34.374 -18.027 1.00 15.14 C ATOM 437 CG GLN A 31 31.435 34.743 -16.986 1.00 52.33 C ATOM 438 CD GLN A 31 31.733 36.065 -16.306 1.00 4.22 C ATOM 439 OE1 GLN A 31 31.305 37.122 -16.763 1.00 75.53 O ATOM 440 NE2 GLN A 31 32.462 36.016 -15.203 1.00 5.45 N ATOM 0 H GLN A 31 33.077 32.151 -16.842 1.00 62.43 H new ATOM 0 HA GLN A 31 31.324 32.904 -19.083 1.00 45.15 H new ATOM 0 HB2 GLN A 31 33.468 34.453 -17.580 1.00 15.14 H new ATOM 0 HB3 GLN A 31 32.436 35.097 -18.841 1.00 15.14 H new ATOM 0 HG2 GLN A 31 30.455 34.796 -17.461 1.00 52.33 H new ATOM 0 HG3 GLN A 31 31.383 33.955 -16.234 1.00 52.33 H new ATOM 0 HE21 GLN A 31 32.800 35.119 -14.854 1.00 5.45 H new ATOM 0 HE22 GLN A 31 32.686 36.875 -14.701 1.00 5.45 H new ATOM 449 N ASN A 32 34.594 33.150 -19.328 1.00 32.35 N ATOM 450 CA ASN A 32 35.766 32.945 -20.169 1.00 60.00 C ATOM 451 C ASN A 32 36.945 33.634 -19.505 1.00 24.31 C ATOM 452 O ASN A 32 36.904 34.835 -19.253 1.00 12.35 O ATOM 453 CB ASN A 32 35.554 33.512 -21.579 1.00 55.23 C ATOM 454 CG ASN A 32 36.628 33.072 -22.560 1.00 52.21 C ATOM 455 OD1 ASN A 32 37.771 32.811 -22.182 1.00 64.01 O ATOM 456 ND2 ASN A 32 36.266 32.991 -23.830 1.00 12.22 N ATOM 0 H ASN A 32 34.788 33.682 -18.480 1.00 32.35 H new ATOM 0 HA ASN A 32 35.950 31.876 -20.275 1.00 60.00 H new ATOM 0 HB2 ASN A 32 34.579 33.196 -21.950 1.00 55.23 H new ATOM 0 HB3 ASN A 32 35.538 34.601 -21.529 1.00 55.23 H new ATOM 0 HD21 ASN A 32 36.944 32.704 -24.536 1.00 12.22 H new ATOM 0 HD22 ASN A 32 35.309 33.216 -24.103 1.00 12.22 H new ATOM 463 N SER A 33 37.989 32.882 -19.215 1.00 43.41 N ATOM 464 CA SER A 33 39.106 33.409 -18.460 1.00 24.32 C ATOM 465 C SER A 33 40.119 34.094 -19.374 1.00 0.13 C ATOM 466 O SER A 33 41.088 34.687 -18.897 1.00 23.01 O ATOM 467 CB SER A 33 39.777 32.284 -17.662 1.00 74.21 C ATOM 468 OG SER A 33 40.762 32.796 -16.784 1.00 5.52 O ATOM 0 H SER A 33 38.086 31.905 -19.491 1.00 43.41 H new ATOM 0 HA SER A 33 38.725 34.159 -17.767 1.00 24.32 H new ATOM 0 HB2 SER A 33 39.024 31.741 -17.091 1.00 74.21 H new ATOM 0 HB3 SER A 33 40.233 31.570 -18.348 1.00 74.21 H new ATOM 0 HG SER A 33 41.075 33.664 -17.114 1.00 5.52 H new ATOM 474 N TYR A 34 39.890 34.035 -20.683 1.00 44.31 N ATOM 475 CA TYR A 34 40.837 34.581 -21.641 1.00 61.24 C ATOM 476 C TYR A 34 40.108 35.238 -22.801 1.00 73.24 C ATOM 477 O TYR A 34 39.670 34.571 -23.738 1.00 62.43 O ATOM 478 CB TYR A 34 41.784 33.487 -22.156 1.00 13.13 C ATOM 479 CG TYR A 34 42.617 32.855 -21.063 1.00 74.24 C ATOM 480 CD1 TYR A 34 43.770 33.473 -20.599 1.00 25.42 C ATOM 481 CD2 TYR A 34 42.237 31.650 -20.481 1.00 64.13 C ATOM 482 CE1 TYR A 34 44.524 32.910 -19.585 1.00 53.30 C ATOM 483 CE2 TYR A 34 42.986 31.081 -19.470 1.00 70.13 C ATOM 484 CZ TYR A 34 44.125 31.715 -19.024 1.00 21.34 C ATOM 485 OH TYR A 34 44.867 31.157 -18.008 1.00 74.43 O ATOM 0 H TYR A 34 39.059 33.616 -21.100 1.00 44.31 H new ATOM 0 HA TYR A 34 41.432 35.339 -21.132 1.00 61.24 H new ATOM 0 HB2 TYR A 34 41.198 32.712 -22.651 1.00 13.13 H new ATOM 0 HB3 TYR A 34 42.447 33.914 -22.908 1.00 13.13 H new ATOM 0 HD1 TYR A 34 44.084 34.409 -21.037 1.00 25.42 H new ATOM 0 HD2 TYR A 34 41.343 31.152 -20.825 1.00 64.13 H new ATOM 0 HE1 TYR A 34 45.419 33.403 -19.235 1.00 53.30 H new ATOM 0 HE2 TYR A 34 42.680 30.143 -19.031 1.00 70.13 H new ATOM 0 HH TYR A 34 44.451 30.317 -17.722 1.00 74.43 H new ATOM 495 N LYS A 35 39.974 36.551 -22.720 1.00 52.32 N ATOM 496 CA LYS A 35 39.329 37.321 -23.773 1.00 32.34 C ATOM 497 C LYS A 35 40.390 37.824 -24.744 1.00 3.52 C ATOM 498 O LYS A 35 40.101 38.524 -25.715 1.00 34.43 O ATOM 499 CB LYS A 35 38.612 38.519 -23.154 1.00 4.45 C ATOM 500 CG LYS A 35 39.584 39.616 -22.749 1.00 64.01 C ATOM 501 CD LYS A 35 38.926 40.747 -21.991 1.00 53.33 C ATOM 502 CE LYS A 35 39.936 41.849 -21.704 1.00 71.43 C ATOM 503 NZ LYS A 35 41.177 41.312 -21.075 1.00 25.44 N1+ ATOM 0 H LYS A 35 40.304 37.109 -21.933 1.00 52.32 H new ATOM 0 HA LYS A 35 38.611 36.693 -24.300 1.00 32.34 H new ATOM 0 HB2 LYS A 35 37.891 38.918 -23.867 1.00 4.45 H new ATOM 0 HB3 LYS A 35 38.049 38.193 -22.280 1.00 4.45 H new ATOM 0 HG2 LYS A 35 40.372 39.184 -22.132 1.00 64.01 H new ATOM 0 HG3 LYS A 35 40.062 40.017 -23.643 1.00 64.01 H new ATOM 0 HD2 LYS A 35 38.095 41.148 -22.572 1.00 53.33 H new ATOM 0 HD3 LYS A 35 38.510 40.373 -21.055 1.00 53.33 H new ATOM 0 HE2 LYS A 35 40.191 42.360 -22.633 1.00 71.43 H new ATOM 0 HE3 LYS A 35 39.486 42.592 -21.045 1.00 71.43 H new ATOM 0 HZ1 LYS A 35 41.692 42.085 -20.607 1.00 25.44 H new ATOM 0 HZ2 LYS A 35 40.925 40.589 -20.372 1.00 25.44 H new ATOM 0 HZ3 LYS A 35 41.781 40.887 -21.807 1.00 25.44 H new ATOM 517 N ASP A 36 41.622 37.441 -24.469 1.00 74.53 N ATOM 518 CA ASP A 36 42.770 37.928 -25.210 1.00 12.22 C ATOM 519 C ASP A 36 43.279 36.851 -26.153 1.00 2.12 C ATOM 520 O ASP A 36 43.205 35.663 -25.837 1.00 1.02 O ATOM 521 CB ASP A 36 43.885 38.344 -24.243 1.00 13.10 C ATOM 522 CG ASP A 36 43.556 39.596 -23.446 1.00 53.20 C ATOM 523 OD1 ASP A 36 44.192 40.642 -23.693 1.00 0.23 O ATOM 524 OD2 ASP A 36 42.666 39.545 -22.570 1.00 61.43 O1- ATOM 0 H ASP A 36 41.856 36.783 -23.725 1.00 74.53 H new ATOM 0 HA ASP A 36 42.466 38.796 -25.795 1.00 12.22 H new ATOM 0 HB2 ASP A 36 44.082 37.524 -23.553 1.00 13.10 H new ATOM 0 HB3 ASP A 36 44.802 38.512 -24.808 1.00 13.10 H new ATOM 529 N PRO A 37 43.781 37.243 -27.335 1.00 13.20 N ATOM 530 CA PRO A 37 44.330 36.293 -28.302 1.00 63.51 C ATOM 531 C PRO A 37 45.598 35.620 -27.785 1.00 54.33 C ATOM 532 O PRO A 37 46.417 36.245 -27.111 1.00 45.11 O ATOM 533 CB PRO A 37 44.641 37.159 -29.528 1.00 21.24 C ATOM 534 CG PRO A 37 44.788 38.543 -28.993 1.00 41.34 C ATOM 535 CD PRO A 37 43.848 38.633 -27.824 1.00 70.22 C ATOM 0 HA PRO A 37 43.637 35.479 -28.513 1.00 63.51 H new ATOM 0 HB2 PRO A 37 45.553 36.828 -30.024 1.00 21.24 H new ATOM 0 HB3 PRO A 37 43.840 37.103 -30.265 1.00 21.24 H new ATOM 0 HG2 PRO A 37 45.815 38.736 -28.684 1.00 41.34 H new ATOM 0 HG3 PRO A 37 44.539 39.284 -29.753 1.00 41.34 H new ATOM 0 HD2 PRO A 37 44.223 39.311 -27.058 1.00 70.22 H new ATOM 0 HD3 PRO A 37 42.867 39.002 -28.124 1.00 70.22 H new ATOM 543 N SER A 38 45.756 34.354 -28.122 1.00 14.04 N ATOM 544 CA SER A 38 46.914 33.582 -27.705 1.00 55.00 C ATOM 545 C SER A 38 47.665 33.099 -28.939 1.00 15.51 C ATOM 546 O SER A 38 48.896 33.084 -28.978 1.00 61.15 O ATOM 547 CB SER A 38 46.467 32.393 -26.853 1.00 62.11 C ATOM 548 OG SER A 38 45.620 32.818 -25.794 1.00 2.22 O ATOM 0 H SER A 38 45.089 33.832 -28.690 1.00 14.04 H new ATOM 0 HA SER A 38 47.576 34.207 -27.105 1.00 55.00 H new ATOM 0 HB2 SER A 38 45.941 31.671 -27.477 1.00 62.11 H new ATOM 0 HB3 SER A 38 47.340 31.885 -26.444 1.00 62.11 H new ATOM 0 HG SER A 38 45.345 32.041 -25.263 1.00 2.22 H new ATOM 554 N TYR A 39 46.900 32.733 -29.958 1.00 43.44 N ATOM 555 CA TYR A 39 47.454 32.329 -31.239 1.00 20.45 C ATOM 556 C TYR A 39 47.313 33.470 -32.235 1.00 62.10 C ATOM 557 O TYR A 39 47.472 33.280 -33.441 1.00 24.30 O ATOM 558 CB TYR A 39 46.743 31.082 -31.761 1.00 32.34 C ATOM 559 CG TYR A 39 47.038 29.834 -30.960 1.00 55.01 C ATOM 560 CD1 TYR A 39 48.235 29.150 -31.132 1.00 1.41 C ATOM 561 CD2 TYR A 39 46.126 29.338 -30.034 1.00 62.40 C ATOM 562 CE1 TYR A 39 48.515 28.010 -30.407 1.00 74.42 C ATOM 563 CE2 TYR A 39 46.402 28.197 -29.305 1.00 23.44 C ATOM 564 CZ TYR A 39 47.597 27.538 -29.496 1.00 40.22 C ATOM 565 OH TYR A 39 47.875 26.402 -28.773 1.00 3.35 O ATOM 0 H TYR A 39 45.881 32.708 -29.919 1.00 43.44 H new ATOM 0 HA TYR A 39 48.510 32.091 -31.110 1.00 20.45 H new ATOM 0 HB2 TYR A 39 45.668 31.260 -31.758 1.00 32.34 H new ATOM 0 HB3 TYR A 39 47.035 30.915 -32.798 1.00 32.34 H new ATOM 0 HD1 TYR A 39 48.958 29.517 -31.845 1.00 1.41 H new ATOM 0 HD2 TYR A 39 45.188 29.852 -29.883 1.00 62.40 H new ATOM 0 HE1 TYR A 39 49.450 27.490 -30.554 1.00 74.42 H new ATOM 0 HE2 TYR A 39 45.685 27.824 -28.589 1.00 23.44 H new ATOM 0 HH TYR A 39 47.125 26.204 -28.174 1.00 3.35 H new ATOM 575 N ASN A 40 46.989 34.652 -31.700 1.00 65.22 N ATOM 576 CA ASN A 40 46.828 35.877 -32.493 1.00 3.22 C ATOM 577 C ASN A 40 45.573 35.799 -33.370 1.00 70.45 C ATOM 578 O ASN A 40 45.271 36.707 -34.140 1.00 15.21 O ATOM 579 CB ASN A 40 48.095 36.143 -33.328 1.00 75.20 C ATOM 580 CG ASN A 40 48.080 37.486 -34.036 1.00 64.02 C ATOM 581 OD1 ASN A 40 48.392 38.522 -33.441 1.00 40.50 O ATOM 582 ND2 ASN A 40 47.757 37.474 -35.320 1.00 70.04 N ATOM 0 H ASN A 40 46.830 34.787 -30.702 1.00 65.22 H new ATOM 0 HA ASN A 40 46.694 36.719 -31.814 1.00 3.22 H new ATOM 0 HB2 ASN A 40 48.967 36.094 -32.676 1.00 75.20 H new ATOM 0 HB3 ASN A 40 48.206 35.351 -34.069 1.00 75.20 H new ATOM 0 HD21 ASN A 40 47.760 38.343 -35.855 1.00 70.04 H new ATOM 0 HD22 ASN A 40 47.505 36.596 -35.774 1.00 70.04 H new ATOM 589 N ASP A 41 44.818 34.723 -33.207 1.00 1.43 N ATOM 590 CA ASP A 41 43.580 34.523 -33.950 1.00 42.41 C ATOM 591 C ASP A 41 42.573 33.821 -33.047 1.00 73.04 C ATOM 592 O ASP A 41 42.261 32.644 -33.227 1.00 20.40 O ATOM 593 CB ASP A 41 43.840 33.695 -35.217 1.00 75.34 C ATOM 594 CG ASP A 41 42.702 33.758 -36.224 1.00 44.10 C ATOM 595 OD1 ASP A 41 41.709 33.015 -36.068 1.00 61.14 O ATOM 596 OD2 ASP A 41 42.808 34.536 -37.196 1.00 31.02 O1- ATOM 0 H ASP A 41 45.043 33.967 -32.560 1.00 1.43 H new ATOM 0 HA ASP A 41 43.180 35.488 -34.260 1.00 42.41 H new ATOM 0 HB2 ASP A 41 44.755 34.049 -35.692 1.00 75.34 H new ATOM 0 HB3 ASP A 41 44.008 32.656 -34.935 1.00 75.34 H new ATOM 601 N ASP A 42 42.106 34.543 -32.034 1.00 64.11 N ATOM 602 CA ASP A 42 41.213 33.967 -31.035 1.00 22.32 C ATOM 603 C ASP A 42 40.016 34.874 -30.788 1.00 12.21 C ATOM 604 O ASP A 42 38.958 34.707 -31.392 1.00 2.23 O ATOM 605 CB ASP A 42 41.948 33.743 -29.707 1.00 70.12 C ATOM 606 CG ASP A 42 43.196 32.897 -29.840 1.00 70.01 C ATOM 607 OD1 ASP A 42 44.279 33.469 -30.089 1.00 24.15 O ATOM 608 OD2 ASP A 42 43.107 31.669 -29.663 1.00 23.10 O1- ATOM 0 H ASP A 42 42.331 35.526 -31.883 1.00 64.11 H new ATOM 0 HA ASP A 42 40.867 33.009 -31.424 1.00 22.32 H new ATOM 0 HB2 ASP A 42 42.218 34.710 -29.283 1.00 70.12 H new ATOM 0 HB3 ASP A 42 41.269 33.265 -29.002 1.00 70.12 H new ATOM 613 N PHE A 43 40.197 35.845 -29.900 1.00 34.33 N ATOM 614 CA PHE A 43 39.120 36.752 -29.523 1.00 42.52 C ATOM 615 C PHE A 43 39.670 38.165 -29.333 1.00 55.15 C ATOM 616 O PHE A 43 39.150 38.956 -28.547 1.00 42.21 O ATOM 617 CB PHE A 43 38.444 36.246 -28.240 1.00 45.40 C ATOM 618 CG PHE A 43 37.128 36.908 -27.939 1.00 60.21 C ATOM 619 CD1 PHE A 43 36.071 36.808 -28.826 1.00 61.42 C ATOM 620 CD2 PHE A 43 36.948 37.625 -26.765 1.00 74.23 C ATOM 621 CE1 PHE A 43 34.859 37.411 -28.551 1.00 3.13 C ATOM 622 CE2 PHE A 43 35.739 38.230 -26.486 1.00 34.35 C ATOM 623 CZ PHE A 43 34.693 38.122 -27.379 1.00 75.22 C ATOM 0 H PHE A 43 41.082 36.024 -29.427 1.00 34.33 H new ATOM 0 HA PHE A 43 38.374 36.783 -30.317 1.00 42.52 H new ATOM 0 HB2 PHE A 43 38.287 35.171 -28.324 1.00 45.40 H new ATOM 0 HB3 PHE A 43 39.119 36.405 -27.399 1.00 45.40 H new ATOM 0 HD1 PHE A 43 36.195 36.252 -29.744 1.00 61.42 H new ATOM 0 HD2 PHE A 43 37.763 37.711 -26.061 1.00 74.23 H new ATOM 0 HE1 PHE A 43 34.042 37.326 -29.252 1.00 3.13 H new ATOM 0 HE2 PHE A 43 35.612 38.787 -25.570 1.00 34.35 H new ATOM 0 HZ PHE A 43 33.746 38.593 -27.162 1.00 75.22 H new ATOM 633 N GLY A 44 40.710 38.494 -30.095 1.00 3.11 N ATOM 634 CA GLY A 44 41.344 39.800 -29.977 1.00 42.15 C ATOM 635 C GLY A 44 40.536 40.902 -30.640 1.00 3.45 C ATOM 636 O GLY A 44 41.071 41.705 -31.402 1.00 74.52 O ATOM 0 H GLY A 44 41.127 37.879 -30.794 1.00 3.11 H new ATOM 0 HA2 GLY A 44 41.482 40.039 -28.923 1.00 42.15 H new ATOM 0 HA3 GLY A 44 42.336 39.761 -30.427 1.00 42.15 H new ATOM 640 N ILE A 45 39.249 40.929 -30.338 1.00 51.24 N ATOM 641 CA ILE A 45 38.329 41.891 -30.923 1.00 71.42 C ATOM 642 C ILE A 45 37.960 42.945 -29.890 1.00 20.41 C ATOM 643 O ILE A 45 37.863 44.132 -30.191 1.00 25.51 O ATOM 644 CB ILE A 45 37.043 41.195 -31.413 1.00 34.42 C ATOM 645 CG1 ILE A 45 37.394 39.935 -32.209 1.00 11.31 C ATOM 646 CG2 ILE A 45 36.215 42.150 -32.268 1.00 54.24 C ATOM 647 CD1 ILE A 45 36.199 39.058 -32.514 1.00 75.24 C ATOM 0 H ILE A 45 38.812 40.284 -29.680 1.00 51.24 H new ATOM 0 HA ILE A 45 38.824 42.359 -31.774 1.00 71.42 H new ATOM 0 HB ILE A 45 36.450 40.906 -30.545 1.00 34.42 H new ATOM 0 HG12 ILE A 45 37.868 40.228 -33.146 1.00 11.31 H new ATOM 0 HG13 ILE A 45 38.127 39.354 -31.649 1.00 11.31 H new ATOM 0 HG21 ILE A 45 35.311 41.644 -32.606 1.00 54.24 H new ATOM 0 HG22 ILE A 45 35.942 43.024 -31.677 1.00 54.24 H new ATOM 0 HG23 ILE A 45 36.800 42.465 -33.132 1.00 54.24 H new ATOM 0 HD11 ILE A 45 36.524 38.185 -33.080 1.00 75.24 H new ATOM 0 HD12 ILE A 45 35.737 38.735 -31.581 1.00 75.24 H new ATOM 0 HD13 ILE A 45 35.474 39.622 -33.101 1.00 75.24 H new ATOM 659 N GLU A 46 37.766 42.490 -28.660 1.00 65.21 N ATOM 660 CA GLU A 46 37.432 43.376 -27.556 1.00 41.54 C ATOM 661 C GLU A 46 38.680 44.119 -27.092 1.00 5.12 C ATOM 662 O GLU A 46 38.601 45.177 -26.462 1.00 43.23 O ATOM 663 CB GLU A 46 36.823 42.567 -26.407 1.00 55.55 C ATOM 664 CG GLU A 46 36.361 43.409 -25.229 1.00 14.53 C ATOM 665 CD GLU A 46 35.619 42.596 -24.193 1.00 0.14 C ATOM 666 OE1 GLU A 46 34.381 42.483 -24.296 1.00 65.32 O ATOM 667 OE2 GLU A 46 36.264 42.075 -23.262 1.00 5.55 O1- ATOM 0 H GLU A 46 37.835 41.506 -28.402 1.00 65.21 H new ATOM 0 HA GLU A 46 36.698 44.110 -27.889 1.00 41.54 H new ATOM 0 HB2 GLU A 46 35.975 41.998 -26.788 1.00 55.55 H new ATOM 0 HB3 GLU A 46 37.560 41.844 -26.056 1.00 55.55 H new ATOM 0 HG2 GLU A 46 37.225 43.883 -24.764 1.00 14.53 H new ATOM 0 HG3 GLU A 46 35.715 44.209 -25.590 1.00 14.53 H new ATOM 674 N THR A 47 39.827 43.558 -27.431 1.00 53.34 N ATOM 675 CA THR A 47 41.107 44.132 -27.068 1.00 11.21 C ATOM 676 C THR A 47 41.920 44.439 -28.335 1.00 2.33 C ATOM 677 O THR A 47 42.653 43.595 -28.854 1.00 31.14 O ATOM 678 CB THR A 47 41.868 43.206 -26.085 1.00 14.13 C ATOM 679 OG1 THR A 47 43.123 43.781 -25.710 1.00 60.32 O ATOM 680 CG2 THR A 47 42.085 41.808 -26.662 1.00 31.14 C ATOM 0 H THR A 47 39.896 42.692 -27.966 1.00 53.34 H new ATOM 0 HA THR A 47 40.945 45.074 -26.544 1.00 11.21 H new ATOM 0 HB THR A 47 41.243 43.106 -25.198 1.00 14.13 H new ATOM 0 HG1 THR A 47 43.585 43.181 -25.088 1.00 60.32 H new ATOM 0 HG21 THR A 47 42.622 41.195 -25.938 1.00 31.14 H new ATOM 0 HG22 THR A 47 41.120 41.351 -26.880 1.00 31.14 H new ATOM 0 HG23 THR A 47 42.668 41.880 -27.580 1.00 31.14 H new ATOM 688 N PRO A 48 41.726 45.646 -28.897 1.00 63.35 N ATOM 689 CA PRO A 48 42.300 46.034 -30.188 1.00 21.13 C ATOM 690 C PRO A 48 43.820 46.167 -30.169 1.00 23.22 C ATOM 691 O PRO A 48 44.358 47.217 -29.819 1.00 30.10 O ATOM 692 CB PRO A 48 41.657 47.399 -30.488 1.00 72.10 C ATOM 693 CG PRO A 48 40.539 47.539 -29.514 1.00 2.42 C ATOM 694 CD PRO A 48 40.936 46.737 -28.310 1.00 3.12 C ATOM 0 HA PRO A 48 42.099 45.270 -30.940 1.00 21.13 H new ATOM 0 HB2 PRO A 48 42.380 48.206 -30.373 1.00 72.10 H new ATOM 0 HB3 PRO A 48 41.291 47.443 -31.514 1.00 72.10 H new ATOM 0 HG2 PRO A 48 40.380 48.585 -29.251 1.00 2.42 H new ATOM 0 HG3 PRO A 48 39.604 47.171 -29.937 1.00 2.42 H new ATOM 0 HD2 PRO A 48 41.521 47.327 -27.605 1.00 3.12 H new ATOM 0 HD3 PRO A 48 40.068 46.362 -27.768 1.00 3.12 H new ATOM 702 N SER A 49 44.503 45.092 -30.530 1.00 1.52 N ATOM 703 CA SER A 49 45.948 45.133 -30.705 1.00 71.45 C ATOM 704 C SER A 49 46.311 45.112 -32.190 1.00 5.40 C ATOM 705 O SER A 49 46.761 46.115 -32.742 1.00 55.33 O ATOM 706 CB SER A 49 46.607 43.959 -29.981 1.00 4.01 C ATOM 707 OG SER A 49 46.416 44.051 -28.582 1.00 52.25 O ATOM 0 H SER A 49 44.081 44.180 -30.708 1.00 1.52 H new ATOM 0 HA SER A 49 46.319 46.062 -30.272 1.00 71.45 H new ATOM 0 HB2 SER A 49 46.189 43.021 -30.347 1.00 4.01 H new ATOM 0 HB3 SER A 49 47.674 43.942 -30.205 1.00 4.01 H new ATOM 0 HG SER A 49 46.845 43.288 -28.142 1.00 52.25 H new ATOM 713 N ALA A 50 46.086 43.974 -32.837 1.00 4.34 N ATOM 714 CA ALA A 50 46.426 43.807 -34.246 1.00 71.23 C ATOM 715 C ALA A 50 45.608 44.734 -35.144 1.00 52.43 C ATOM 716 O ALA A 50 46.123 45.288 -36.118 1.00 63.35 O ATOM 717 CB ALA A 50 46.217 42.361 -34.662 1.00 52.42 C ATOM 0 H ALA A 50 45.668 43.150 -32.406 1.00 4.34 H new ATOM 0 HA ALA A 50 47.476 44.074 -34.367 1.00 71.23 H new ATOM 0 HB1 ALA A 50 46.473 42.245 -35.715 1.00 52.42 H new ATOM 0 HB2 ALA A 50 46.854 41.713 -34.060 1.00 52.42 H new ATOM 0 HB3 ALA A 50 45.173 42.086 -34.510 1.00 52.42 H new ATOM 723 N LEU A 51 44.341 44.911 -34.801 1.00 14.24 N ATOM 724 CA LEU A 51 43.422 45.690 -35.623 1.00 65.24 C ATOM 725 C LEU A 51 43.324 47.137 -35.143 1.00 54.11 C ATOM 726 O LEU A 51 42.452 47.885 -35.588 1.00 73.42 O ATOM 727 CB LEU A 51 42.042 45.016 -35.629 1.00 34.13 C ATOM 728 CG LEU A 51 41.490 44.623 -34.252 1.00 14.14 C ATOM 729 CD1 LEU A 51 40.831 45.806 -33.559 1.00 42.24 C ATOM 730 CD2 LEU A 51 40.509 43.467 -34.382 1.00 32.32 C ATOM 0 H LEU A 51 43.922 44.524 -33.955 1.00 14.24 H new ATOM 0 HA LEU A 51 43.810 45.720 -36.641 1.00 65.24 H new ATOM 0 HB2 LEU A 51 41.331 45.690 -36.107 1.00 34.13 H new ATOM 0 HB3 LEU A 51 42.098 44.120 -36.247 1.00 34.13 H new ATOM 0 HG LEU A 51 42.330 44.302 -33.636 1.00 14.14 H new ATOM 0 HD11 LEU A 51 40.451 45.493 -32.587 1.00 42.24 H new ATOM 0 HD12 LEU A 51 41.563 46.602 -33.423 1.00 42.24 H new ATOM 0 HD13 LEU A 51 40.006 46.172 -34.170 1.00 42.24 H new ATOM 0 HD21 LEU A 51 40.127 43.201 -33.396 1.00 32.32 H new ATOM 0 HD22 LEU A 51 39.680 43.764 -35.024 1.00 32.32 H new ATOM 0 HD23 LEU A 51 41.016 42.607 -34.819 1.00 32.32 H new ATOM 742 N ASP A 52 44.233 47.536 -34.254 1.00 2.23 N ATOM 743 CA ASP A 52 44.215 48.889 -33.692 1.00 12.25 C ATOM 744 C ASP A 52 44.294 49.941 -34.791 1.00 34.31 C ATOM 745 O ASP A 52 43.560 50.927 -34.776 1.00 33.15 O ATOM 746 CB ASP A 52 45.370 49.090 -32.709 1.00 5.20 C ATOM 747 CG ASP A 52 45.465 50.524 -32.218 1.00 62.52 C ATOM 748 OD1 ASP A 52 46.246 51.305 -32.797 1.00 12.41 O ATOM 749 OD2 ASP A 52 44.747 50.880 -31.261 1.00 63.02 O1- ATOM 0 H ASP A 52 44.989 46.945 -33.908 1.00 2.23 H new ATOM 0 HA ASP A 52 43.271 49.006 -33.159 1.00 12.25 H new ATOM 0 HB2 ASP A 52 45.239 48.424 -31.856 1.00 5.20 H new ATOM 0 HB3 ASP A 52 46.307 48.810 -33.190 1.00 5.20 H new ATOM 754 N ASN A 53 45.160 49.705 -35.764 1.00 61.25 N ATOM 755 CA ASN A 53 45.373 50.664 -36.847 1.00 42.12 C ATOM 756 C ASN A 53 44.414 50.410 -38.005 1.00 63.01 C ATOM 757 O ASN A 53 44.607 50.916 -39.108 1.00 23.25 O ATOM 758 CB ASN A 53 46.822 50.610 -37.341 1.00 44.53 C ATOM 759 CG ASN A 53 47.785 51.309 -36.399 1.00 73.01 C ATOM 760 OD1 ASN A 53 48.023 52.511 -36.520 1.00 72.42 O ATOM 761 ND2 ASN A 53 48.356 50.563 -35.465 1.00 31.23 N ATOM 0 H ASN A 53 45.728 48.860 -35.830 1.00 61.25 H new ATOM 0 HA ASN A 53 45.174 51.660 -36.451 1.00 42.12 H new ATOM 0 HB2 ASN A 53 47.124 49.569 -37.457 1.00 44.53 H new ATOM 0 HB3 ASN A 53 46.884 51.072 -38.326 1.00 44.53 H new ATOM 0 HD21 ASN A 53 49.020 50.981 -34.813 1.00 31.23 H new ATOM 0 HD22 ASN A 53 48.132 49.570 -35.398 1.00 31.23 H new ATOM 768 N PHE A 54 43.372 49.636 -37.743 1.00 22.14 N ATOM 769 CA PHE A 54 42.394 49.307 -38.765 1.00 43.23 C ATOM 770 C PHE A 54 40.995 49.727 -38.322 1.00 0.30 C ATOM 771 O PHE A 54 40.394 50.627 -38.906 1.00 51.31 O ATOM 772 CB PHE A 54 42.435 47.804 -39.064 1.00 64.13 C ATOM 773 CG PHE A 54 41.568 47.386 -40.217 1.00 32.43 C ATOM 774 CD1 PHE A 54 40.302 46.869 -39.997 1.00 20.25 C ATOM 775 CD2 PHE A 54 42.022 47.506 -41.520 1.00 52.44 C ATOM 776 CE1 PHE A 54 39.506 46.480 -41.055 1.00 74.25 C ATOM 777 CE2 PHE A 54 41.230 47.118 -42.582 1.00 41.13 C ATOM 778 CZ PHE A 54 39.969 46.604 -42.349 1.00 1.54 C ATOM 0 H PHE A 54 43.183 49.224 -36.829 1.00 22.14 H new ATOM 0 HA PHE A 54 42.641 49.853 -39.676 1.00 43.23 H new ATOM 0 HB2 PHE A 54 43.465 47.514 -39.273 1.00 64.13 H new ATOM 0 HB3 PHE A 54 42.125 47.258 -38.173 1.00 64.13 H new ATOM 0 HD1 PHE A 54 39.934 46.769 -38.987 1.00 20.25 H new ATOM 0 HD2 PHE A 54 43.007 47.908 -41.707 1.00 52.44 H new ATOM 0 HE1 PHE A 54 38.521 46.078 -40.870 1.00 74.25 H new ATOM 0 HE2 PHE A 54 41.596 47.216 -43.593 1.00 41.13 H new ATOM 0 HZ PHE A 54 39.347 46.300 -43.178 1.00 1.54 H new ATOM 788 N THR A 55 40.500 49.099 -37.266 1.00 75.41 N ATOM 789 CA THR A 55 39.141 49.332 -36.794 1.00 62.12 C ATOM 790 C THR A 55 38.968 50.757 -36.253 1.00 21.25 C ATOM 791 O THR A 55 37.877 51.326 -36.311 1.00 1.24 O ATOM 792 CB THR A 55 38.771 48.308 -35.705 1.00 4.21 C ATOM 793 OG1 THR A 55 39.144 46.996 -36.145 1.00 21.43 O ATOM 794 CG2 THR A 55 37.279 48.335 -35.402 1.00 4.31 C ATOM 0 H THR A 55 41.023 48.418 -36.715 1.00 75.41 H new ATOM 0 HA THR A 55 38.471 49.212 -37.645 1.00 62.12 H new ATOM 0 HB THR A 55 39.307 48.568 -34.793 1.00 4.21 H new ATOM 0 HG1 THR A 55 38.538 46.334 -35.752 1.00 21.43 H new ATOM 0 HG21 THR A 55 37.051 47.601 -34.629 1.00 4.31 H new ATOM 0 HG22 THR A 55 36.996 49.328 -35.053 1.00 4.31 H new ATOM 0 HG23 THR A 55 36.720 48.095 -36.306 1.00 4.31 H new ATOM 802 N GLN A 56 40.052 51.339 -35.752 1.00 32.54 N ATOM 803 CA GLN A 56 40.002 52.697 -35.223 1.00 40.22 C ATOM 804 C GLN A 56 39.796 53.708 -36.344 1.00 42.31 C ATOM 805 O GLN A 56 39.182 54.754 -36.144 1.00 33.50 O ATOM 806 CB GLN A 56 41.270 53.026 -34.430 1.00 24.31 C ATOM 807 CG GLN A 56 41.122 52.807 -32.930 1.00 3.12 C ATOM 808 CD GLN A 56 40.805 51.371 -32.563 1.00 23.51 C ATOM 809 OE1 GLN A 56 39.645 50.961 -32.550 1.00 22.43 O ATOM 810 NE2 GLN A 56 41.833 50.603 -32.235 1.00 51.20 N ATOM 0 H GLN A 56 40.969 50.896 -35.701 1.00 32.54 H new ATOM 0 HA GLN A 56 39.152 52.759 -34.544 1.00 40.22 H new ATOM 0 HB2 GLN A 56 42.090 52.411 -34.800 1.00 24.31 H new ATOM 0 HB3 GLN A 56 41.544 54.065 -34.612 1.00 24.31 H new ATOM 0 HG2 GLN A 56 42.045 53.107 -32.433 1.00 3.12 H new ATOM 0 HG3 GLN A 56 40.331 53.455 -32.551 1.00 3.12 H new ATOM 0 HE21 GLN A 56 42.780 50.981 -32.259 1.00 51.20 H new ATOM 0 HE22 GLN A 56 41.678 49.633 -31.959 1.00 51.20 H new ATOM 819 N ALA A 57 40.283 53.377 -37.532 1.00 43.12 N ATOM 820 CA ALA A 57 40.090 54.230 -38.694 1.00 74.22 C ATOM 821 C ALA A 57 38.651 54.137 -39.178 1.00 13.44 C ATOM 822 O ALA A 57 38.116 55.071 -39.778 1.00 44.41 O ATOM 823 CB ALA A 57 41.057 53.841 -39.803 1.00 32.32 C ATOM 0 H ALA A 57 40.814 52.525 -37.715 1.00 43.12 H new ATOM 0 HA ALA A 57 40.293 55.263 -38.411 1.00 74.22 H new ATOM 0 HB1 ALA A 57 40.900 54.488 -40.666 1.00 32.32 H new ATOM 0 HB2 ALA A 57 42.082 53.951 -39.448 1.00 32.32 H new ATOM 0 HB3 ALA A 57 40.883 52.804 -40.091 1.00 32.32 H new ATOM 829 N ILE A 58 38.022 53.004 -38.885 1.00 52.41 N ATOM 830 CA ILE A 58 36.644 52.763 -39.284 1.00 43.42 C ATOM 831 C ILE A 58 35.688 53.628 -38.464 1.00 42.32 C ATOM 832 O ILE A 58 34.599 53.962 -38.918 1.00 2.22 O ATOM 833 CB ILE A 58 36.263 51.276 -39.115 1.00 4.31 C ATOM 834 CG1 ILE A 58 37.321 50.375 -39.757 1.00 33.32 C ATOM 835 CG2 ILE A 58 34.893 51.001 -39.722 1.00 22.11 C ATOM 836 CD1 ILE A 58 36.935 48.912 -39.794 1.00 75.03 C ATOM 0 H ILE A 58 38.450 52.235 -38.369 1.00 52.41 H new ATOM 0 HA ILE A 58 36.558 53.028 -40.338 1.00 43.42 H new ATOM 0 HB ILE A 58 36.219 51.053 -38.049 1.00 4.31 H new ATOM 0 HG12 ILE A 58 37.508 50.718 -40.775 1.00 33.32 H new ATOM 0 HG13 ILE A 58 38.257 50.481 -39.208 1.00 33.32 H new ATOM 0 HG21 ILE A 58 34.643 49.948 -39.593 1.00 22.11 H new ATOM 0 HG22 ILE A 58 34.144 51.616 -39.223 1.00 22.11 H new ATOM 0 HG23 ILE A 58 34.911 51.242 -40.785 1.00 22.11 H new ATOM 0 HD11 ILE A 58 37.733 48.337 -40.263 1.00 75.03 H new ATOM 0 HD12 ILE A 58 36.777 48.552 -38.778 1.00 75.03 H new ATOM 0 HD13 ILE A 58 36.016 48.792 -40.368 1.00 75.03 H new ATOM 848 N GLN A 59 36.113 54.012 -37.264 1.00 20.32 N ATOM 849 CA GLN A 59 35.289 54.843 -36.390 1.00 43.14 C ATOM 850 C GLN A 59 34.860 56.126 -37.104 1.00 30.01 C ATOM 851 O GLN A 59 33.749 56.614 -36.902 1.00 22.32 O ATOM 852 CB GLN A 59 36.038 55.188 -35.101 1.00 0.24 C ATOM 853 CG GLN A 59 36.343 53.977 -34.232 1.00 33.03 C ATOM 854 CD GLN A 59 37.029 54.344 -32.931 1.00 32.54 C ATOM 855 OE1 GLN A 59 36.824 55.431 -32.385 1.00 24.13 O ATOM 856 NE2 GLN A 59 37.843 53.437 -32.417 1.00 51.23 N ATOM 0 H GLN A 59 37.022 53.762 -36.874 1.00 20.32 H new ATOM 0 HA GLN A 59 34.397 54.272 -36.133 1.00 43.14 H new ATOM 0 HB2 GLN A 59 36.973 55.687 -35.356 1.00 0.24 H new ATOM 0 HB3 GLN A 59 35.445 55.898 -34.525 1.00 0.24 H new ATOM 0 HG2 GLN A 59 35.414 53.451 -34.012 1.00 33.03 H new ATOM 0 HG3 GLN A 59 36.976 53.286 -34.789 1.00 33.03 H new ATOM 0 HE21 GLN A 59 37.987 52.549 -32.899 1.00 51.23 H new ATOM 0 HE22 GLN A 59 38.327 53.625 -31.539 1.00 51.23 H new ATOM 865 N SER A 60 35.737 56.642 -37.962 1.00 51.04 N ATOM 866 CA SER A 60 35.460 57.860 -38.719 1.00 11.41 C ATOM 867 C SER A 60 34.261 57.670 -39.651 1.00 54.31 C ATOM 868 O SER A 60 33.339 58.488 -39.663 1.00 71.15 O ATOM 869 CB SER A 60 36.702 58.273 -39.522 1.00 73.34 C ATOM 870 OG SER A 60 36.493 59.487 -40.230 1.00 3.51 O ATOM 0 H SER A 60 36.652 56.232 -38.151 1.00 51.04 H new ATOM 0 HA SER A 60 35.213 58.653 -38.013 1.00 11.41 H new ATOM 0 HB2 SER A 60 37.550 58.387 -38.847 1.00 73.34 H new ATOM 0 HB3 SER A 60 36.960 57.482 -40.226 1.00 73.34 H new ATOM 0 HG SER A 60 37.305 59.719 -40.728 1.00 3.51 H new ATOM 876 N GLN A 61 34.258 56.583 -40.418 1.00 30.10 N ATOM 877 CA GLN A 61 33.198 56.362 -41.399 1.00 24.42 C ATOM 878 C GLN A 61 31.891 55.970 -40.715 1.00 14.32 C ATOM 879 O GLN A 61 30.812 56.206 -41.253 1.00 1.12 O ATOM 880 CB GLN A 61 33.608 55.301 -42.431 1.00 64.21 C ATOM 881 CG GLN A 61 33.939 53.946 -41.834 1.00 32.32 C ATOM 882 CD GLN A 61 34.331 52.925 -42.885 1.00 64.01 C ATOM 883 OE1 GLN A 61 33.489 52.194 -43.400 1.00 52.54 O ATOM 884 NE2 GLN A 61 35.613 52.876 -43.215 1.00 61.52 N ATOM 0 H GLN A 61 34.967 55.850 -40.381 1.00 30.10 H new ATOM 0 HA GLN A 61 33.037 57.302 -41.927 1.00 24.42 H new ATOM 0 HB2 GLN A 61 32.799 55.180 -43.152 1.00 64.21 H new ATOM 0 HB3 GLN A 61 34.475 55.664 -42.983 1.00 64.21 H new ATOM 0 HG2 GLN A 61 34.754 54.057 -41.119 1.00 32.32 H new ATOM 0 HG3 GLN A 61 33.077 53.577 -41.279 1.00 32.32 H new ATOM 0 HE21 GLN A 61 36.280 53.501 -42.763 1.00 61.52 H new ATOM 0 HE22 GLN A 61 35.933 52.213 -43.921 1.00 61.52 H new ATOM 893 N ILE A 62 31.993 55.402 -39.518 1.00 25.21 N ATOM 894 CA ILE A 62 30.812 54.999 -38.771 1.00 60.23 C ATOM 895 C ILE A 62 30.149 56.219 -38.145 1.00 4.22 C ATOM 896 O ILE A 62 28.988 56.512 -38.411 1.00 73.53 O ATOM 897 CB ILE A 62 31.158 53.984 -37.657 1.00 31.41 C ATOM 898 CG1 ILE A 62 31.797 52.724 -38.249 1.00 75.12 C ATOM 899 CG2 ILE A 62 29.914 53.620 -36.858 1.00 11.33 C ATOM 900 CD1 ILE A 62 32.247 51.728 -37.202 1.00 54.33 C ATOM 0 H ILE A 62 32.878 55.212 -39.048 1.00 25.21 H new ATOM 0 HA ILE A 62 30.130 54.520 -39.473 1.00 60.23 H new ATOM 0 HB ILE A 62 31.878 54.452 -36.985 1.00 31.41 H new ATOM 0 HG12 ILE A 62 31.081 52.241 -38.915 1.00 75.12 H new ATOM 0 HG13 ILE A 62 32.654 53.012 -38.857 1.00 75.12 H new ATOM 0 HG21 ILE A 62 30.178 52.905 -36.079 1.00 11.33 H new ATOM 0 HG22 ILE A 62 29.500 54.518 -36.400 1.00 11.33 H new ATOM 0 HG23 ILE A 62 29.172 53.176 -37.522 1.00 11.33 H new ATOM 0 HD11 ILE A 62 32.690 50.861 -37.692 1.00 54.33 H new ATOM 0 HD12 ILE A 62 32.986 52.194 -36.551 1.00 54.33 H new ATOM 0 HD13 ILE A 62 31.389 51.411 -36.609 1.00 54.33 H new ATOM 912 N LEU A 63 30.913 56.949 -37.345 1.00 64.35 N ATOM 913 CA LEU A 63 30.387 58.091 -36.607 1.00 53.53 C ATOM 914 C LEU A 63 29.870 59.179 -37.545 1.00 34.31 C ATOM 915 O LEU A 63 28.903 59.872 -37.228 1.00 74.53 O ATOM 916 CB LEU A 63 31.463 58.659 -35.682 1.00 24.15 C ATOM 917 CG LEU A 63 31.921 57.715 -34.569 1.00 14.34 C ATOM 918 CD1 LEU A 63 32.981 58.377 -33.708 1.00 52.54 C ATOM 919 CD2 LEU A 63 30.739 57.282 -33.714 1.00 61.01 C ATOM 0 H LEU A 63 31.905 56.770 -37.189 1.00 64.35 H new ATOM 0 HA LEU A 63 29.545 57.742 -36.009 1.00 53.53 H new ATOM 0 HB2 LEU A 63 32.329 58.935 -36.283 1.00 24.15 H new ATOM 0 HB3 LEU A 63 31.085 59.575 -35.228 1.00 24.15 H new ATOM 0 HG LEU A 63 32.356 56.829 -35.032 1.00 14.34 H new ATOM 0 HD11 LEU A 63 33.293 57.689 -32.922 1.00 52.54 H new ATOM 0 HD12 LEU A 63 33.841 58.637 -34.325 1.00 52.54 H new ATOM 0 HD13 LEU A 63 32.571 59.281 -33.257 1.00 52.54 H new ATOM 0 HD21 LEU A 63 31.085 56.611 -32.928 1.00 61.01 H new ATOM 0 HD22 LEU A 63 30.275 58.159 -33.264 1.00 61.01 H new ATOM 0 HD23 LEU A 63 30.009 56.765 -34.337 1.00 61.01 H new ATOM 931 N GLY A 64 30.507 59.319 -38.699 1.00 54.14 N ATOM 932 CA GLY A 64 30.077 60.314 -39.660 1.00 43.53 C ATOM 933 C GLY A 64 28.841 59.882 -40.428 1.00 42.50 C ATOM 934 O GLY A 64 28.083 60.719 -40.922 1.00 45.41 O ATOM 0 H GLY A 64 31.312 58.763 -38.986 1.00 54.14 H new ATOM 0 HA2 GLY A 64 29.870 61.250 -39.141 1.00 43.53 H new ATOM 0 HA3 GLY A 64 30.887 60.511 -40.362 1.00 43.53 H new ATOM 938 N GLY A 65 28.629 58.574 -40.514 1.00 25.24 N ATOM 939 CA GLY A 65 27.525 58.045 -41.291 1.00 5.50 C ATOM 940 C GLY A 65 26.285 57.794 -40.457 1.00 33.53 C ATOM 941 O GLY A 65 25.176 57.741 -40.992 1.00 11.34 O ATOM 0 H GLY A 65 29.205 57.868 -40.057 1.00 25.24 H new ATOM 0 HA2 GLY A 65 27.283 58.744 -42.092 1.00 5.50 H new ATOM 0 HA3 GLY A 65 27.834 57.113 -41.764 1.00 5.50 H new ATOM 945 N LEU A 66 26.472 57.666 -39.144 1.00 53.33 N ATOM 946 CA LEU A 66 25.377 57.340 -38.225 1.00 72.23 C ATOM 947 C LEU A 66 24.253 58.373 -38.267 1.00 34.12 C ATOM 948 O LEU A 66 23.153 58.113 -37.784 1.00 33.03 O ATOM 949 CB LEU A 66 25.893 57.206 -36.789 1.00 31.31 C ATOM 950 CG LEU A 66 26.756 55.972 -36.518 1.00 64.21 C ATOM 951 CD1 LEU A 66 27.236 55.961 -35.074 1.00 22.03 C ATOM 952 CD2 LEU A 66 25.985 54.698 -36.831 1.00 65.03 C ATOM 0 H LEU A 66 27.377 57.784 -38.688 1.00 53.33 H new ATOM 0 HA LEU A 66 24.968 56.386 -38.558 1.00 72.23 H new ATOM 0 HB2 LEU A 66 26.473 58.096 -36.544 1.00 31.31 H new ATOM 0 HB3 LEU A 66 25.038 57.187 -36.113 1.00 31.31 H new ATOM 0 HG LEU A 66 27.627 56.016 -37.171 1.00 64.21 H new ATOM 0 HD11 LEU A 66 27.848 55.076 -34.901 1.00 22.03 H new ATOM 0 HD12 LEU A 66 27.828 56.855 -34.881 1.00 22.03 H new ATOM 0 HD13 LEU A 66 26.376 55.944 -34.405 1.00 22.03 H new ATOM 0 HD21 LEU A 66 26.617 53.832 -36.632 1.00 65.03 H new ATOM 0 HD22 LEU A 66 25.094 54.649 -36.205 1.00 65.03 H new ATOM 0 HD23 LEU A 66 25.692 54.699 -37.881 1.00 65.03 H new ATOM 964 N LEU A 67 24.525 59.540 -38.839 1.00 53.21 N ATOM 965 CA LEU A 67 23.506 60.573 -38.972 1.00 64.45 C ATOM 966 C LEU A 67 22.318 60.042 -39.776 1.00 60.43 C ATOM 967 O LEU A 67 21.160 60.259 -39.416 1.00 44.24 O ATOM 968 CB LEU A 67 24.090 61.816 -39.647 1.00 51.43 C ATOM 969 CG LEU A 67 25.273 62.461 -38.921 1.00 3.00 C ATOM 970 CD1 LEU A 67 25.760 63.681 -39.682 1.00 70.32 C ATOM 971 CD2 LEU A 67 24.893 62.838 -37.498 1.00 22.21 C ATOM 0 H LEU A 67 25.438 59.794 -39.216 1.00 53.21 H new ATOM 0 HA LEU A 67 23.160 60.850 -37.976 1.00 64.45 H new ATOM 0 HB2 LEU A 67 24.407 61.547 -40.655 1.00 51.43 H new ATOM 0 HB3 LEU A 67 23.299 62.559 -39.749 1.00 51.43 H new ATOM 0 HG LEU A 67 26.083 61.734 -38.875 1.00 3.00 H new ATOM 0 HD11 LEU A 67 26.601 64.128 -39.153 1.00 70.32 H new ATOM 0 HD12 LEU A 67 26.077 63.384 -40.682 1.00 70.32 H new ATOM 0 HD13 LEU A 67 24.952 64.408 -39.759 1.00 70.32 H new ATOM 0 HD21 LEU A 67 25.749 63.295 -37.002 1.00 22.21 H new ATOM 0 HD22 LEU A 67 24.065 63.547 -37.518 1.00 22.21 H new ATOM 0 HD23 LEU A 67 24.592 61.944 -36.953 1.00 22.21 H new ATOM 983 N SER A 68 22.620 59.305 -40.837 1.00 40.32 N ATOM 984 CA SER A 68 21.596 58.747 -41.708 1.00 11.31 C ATOM 985 C SER A 68 20.859 57.601 -41.013 1.00 75.02 C ATOM 986 O SER A 68 19.706 57.301 -41.329 1.00 75.11 O ATOM 987 CB SER A 68 22.242 58.253 -43.005 1.00 0.14 C ATOM 988 OG SER A 68 23.007 59.281 -43.616 1.00 4.11 O ATOM 0 H SER A 68 23.575 59.079 -41.116 1.00 40.32 H new ATOM 0 HA SER A 68 20.869 59.525 -41.940 1.00 11.31 H new ATOM 0 HB2 SER A 68 22.881 57.396 -42.794 1.00 0.14 H new ATOM 0 HB3 SER A 68 21.469 57.912 -43.694 1.00 0.14 H new ATOM 0 HG SER A 68 23.652 58.883 -44.238 1.00 4.11 H new ATOM 994 N ASN A 69 21.528 56.982 -40.054 1.00 22.22 N ATOM 995 CA ASN A 69 20.976 55.834 -39.340 1.00 3.21 C ATOM 996 C ASN A 69 20.014 56.280 -38.243 1.00 33.23 C ATOM 997 O ASN A 69 19.149 55.515 -37.813 1.00 41.32 O ATOM 998 CB ASN A 69 22.101 55.008 -38.710 1.00 53.44 C ATOM 999 CG ASN A 69 23.092 54.481 -39.729 1.00 25.14 C ATOM 1000 OD1 ASN A 69 24.029 55.175 -40.112 1.00 41.35 O ATOM 1001 ND2 ASN A 69 22.905 53.246 -40.161 1.00 2.13 N ATOM 0 H ASN A 69 22.462 57.255 -39.748 1.00 22.22 H new ATOM 0 HA ASN A 69 20.432 55.226 -40.063 1.00 3.21 H new ATOM 0 HB2 ASN A 69 22.630 55.622 -37.981 1.00 53.44 H new ATOM 0 HB3 ASN A 69 21.667 54.169 -38.166 1.00 53.44 H new ATOM 0 HD21 ASN A 69 23.552 52.839 -40.836 1.00 2.13 H new ATOM 0 HD22 ASN A 69 22.114 52.700 -39.819 1.00 2.13 H new ATOM 1008 N ILE A 70 20.168 57.518 -37.791 1.00 71.41 N ATOM 1009 CA ILE A 70 19.392 58.019 -36.661 1.00 54.25 C ATOM 1010 C ILE A 70 18.219 58.890 -37.108 1.00 15.54 C ATOM 1011 O ILE A 70 17.143 58.827 -36.519 1.00 23.53 O ATOM 1012 CB ILE A 70 20.285 58.826 -35.686 1.00 3.10 C ATOM 1013 CG1 ILE A 70 21.426 57.951 -35.150 1.00 23.53 C ATOM 1014 CG2 ILE A 70 19.464 59.392 -34.532 1.00 12.32 C ATOM 1015 CD1 ILE A 70 20.961 56.712 -34.413 1.00 42.43 C ATOM 0 H ILE A 70 20.821 58.193 -38.188 1.00 71.41 H new ATOM 0 HA ILE A 70 18.993 57.143 -36.149 1.00 54.25 H new ATOM 0 HB ILE A 70 20.716 59.661 -36.239 1.00 3.10 H new ATOM 0 HG12 ILE A 70 22.060 57.648 -35.984 1.00 23.53 H new ATOM 0 HG13 ILE A 70 22.044 58.549 -34.480 1.00 23.53 H new ATOM 0 HG21 ILE A 70 20.116 59.954 -33.863 1.00 12.32 H new ATOM 0 HG22 ILE A 70 18.691 60.053 -34.925 1.00 12.32 H new ATOM 0 HG23 ILE A 70 18.997 58.575 -33.982 1.00 12.32 H new ATOM 0 HD11 ILE A 70 21.827 56.148 -34.066 1.00 42.43 H new ATOM 0 HD12 ILE A 70 20.352 57.005 -33.557 1.00 42.43 H new ATOM 0 HD13 ILE A 70 20.368 56.090 -35.084 1.00 42.43 H new ATOM 1027 N ASN A 71 18.425 59.686 -38.154 1.00 10.14 N ATOM 1028 CA ASN A 71 17.451 60.710 -38.545 1.00 44.34 C ATOM 1029 C ASN A 71 16.086 60.137 -38.934 1.00 55.34 C ATOM 1030 O ASN A 71 15.199 60.005 -38.091 1.00 20.43 O ATOM 1031 CB ASN A 71 17.989 61.554 -39.702 1.00 33.10 C ATOM 1032 CG ASN A 71 18.935 62.651 -39.254 1.00 24.15 C ATOM 1033 OD1 ASN A 71 19.877 62.995 -39.967 1.00 2.11 O ATOM 1034 ND2 ASN A 71 18.677 63.225 -38.089 1.00 61.43 N ATOM 0 H ASN A 71 19.254 59.645 -38.747 1.00 10.14 H new ATOM 0 HA ASN A 71 17.303 61.330 -37.660 1.00 44.34 H new ATOM 0 HB2 ASN A 71 18.506 60.904 -40.408 1.00 33.10 H new ATOM 0 HB3 ASN A 71 17.151 62.002 -40.236 1.00 33.10 H new ATOM 0 HD21 ASN A 71 19.270 63.983 -37.752 1.00 61.43 H new ATOM 0 HD22 ASN A 71 17.885 62.909 -37.529 1.00 61.43 H new ATOM 1041 N THR A 72 15.923 59.789 -40.206 1.00 12.11 N ATOM 1042 CA THR A 72 14.629 59.361 -40.742 1.00 23.30 C ATOM 1043 C THR A 72 14.818 58.809 -42.150 1.00 44.31 C ATOM 1044 O THR A 72 15.660 59.305 -42.898 1.00 44.23 O ATOM 1045 CB THR A 72 13.606 60.535 -40.813 1.00 2.13 C ATOM 1046 OG1 THR A 72 13.443 61.163 -39.536 1.00 14.23 O ATOM 1047 CG2 THR A 72 12.247 60.058 -41.304 1.00 53.31 C ATOM 0 H THR A 72 16.677 59.794 -40.893 1.00 12.11 H new ATOM 0 HA THR A 72 14.237 58.599 -40.069 1.00 23.30 H new ATOM 0 HB THR A 72 14.010 61.259 -41.521 1.00 2.13 H new ATOM 0 HG1 THR A 72 13.771 60.565 -38.833 1.00 14.23 H new ATOM 0 HG21 THR A 72 11.557 60.901 -41.342 1.00 53.31 H new ATOM 0 HG22 THR A 72 12.350 59.629 -42.301 1.00 53.31 H new ATOM 0 HG23 THR A 72 11.859 59.302 -40.622 1.00 53.31 H new ATOM 1055 N GLY A 73 14.053 57.783 -42.495 1.00 3.13 N ATOM 1056 CA GLY A 73 14.083 57.246 -43.839 1.00 42.41 C ATOM 1057 C GLY A 73 13.916 55.746 -43.852 1.00 24.53 C ATOM 1058 O GLY A 73 12.906 55.229 -44.329 1.00 71.02 O ATOM 0 H GLY A 73 13.408 57.310 -41.862 1.00 3.13 H new ATOM 0 HA2 GLY A 73 13.290 57.704 -44.430 1.00 42.41 H new ATOM 0 HA3 GLY A 73 15.028 57.510 -44.314 1.00 42.41 H new ATOM 1062 N LYS A 74 14.916 55.054 -43.322 1.00 31.51 N ATOM 1063 CA LYS A 74 14.899 53.596 -43.244 1.00 51.44 C ATOM 1064 C LYS A 74 13.635 53.100 -42.540 1.00 44.43 C ATOM 1065 O LYS A 74 13.147 53.731 -41.599 1.00 24.01 O ATOM 1066 CB LYS A 74 16.133 53.075 -42.484 1.00 23.21 C ATOM 1067 CG LYS A 74 16.164 53.430 -40.995 1.00 4.23 C ATOM 1068 CD LYS A 74 16.466 54.900 -40.739 1.00 20.20 C ATOM 1069 CE LYS A 74 16.372 55.235 -39.260 1.00 35.24 C ATOM 1070 NZ LYS A 74 14.985 55.093 -38.744 1.00 22.45 N1+ ATOM 0 H LYS A 74 15.757 55.482 -42.936 1.00 31.51 H new ATOM 0 HA LYS A 74 14.914 53.215 -44.265 1.00 51.44 H new ATOM 0 HB2 LYS A 74 16.175 51.991 -42.586 1.00 23.21 H new ATOM 0 HB3 LYS A 74 17.030 53.474 -42.958 1.00 23.21 H new ATOM 0 HG2 LYS A 74 15.202 53.179 -40.547 1.00 4.23 H new ATOM 0 HG3 LYS A 74 16.916 52.818 -40.497 1.00 4.23 H new ATOM 0 HD2 LYS A 74 17.465 55.137 -41.105 1.00 20.20 H new ATOM 0 HD3 LYS A 74 15.766 55.520 -41.299 1.00 20.20 H new ATOM 0 HE2 LYS A 74 17.037 54.580 -38.697 1.00 35.24 H new ATOM 0 HE3 LYS A 74 16.717 56.256 -39.097 1.00 35.24 H new ATOM 0 HZ1 LYS A 74 14.904 55.579 -37.828 1.00 22.45 H new ATOM 0 HZ2 LYS A 74 14.318 55.516 -39.420 1.00 22.45 H new ATOM 0 HZ3 LYS A 74 14.762 54.085 -38.622 1.00 22.45 H new ATOM 1084 N PRO A 75 13.079 51.972 -43.000 1.00 62.34 N ATOM 1085 CA PRO A 75 11.934 51.330 -42.354 1.00 2.31 C ATOM 1086 C PRO A 75 12.344 50.538 -41.113 1.00 25.45 C ATOM 1087 O PRO A 75 11.537 50.319 -40.205 1.00 34.43 O ATOM 1088 CB PRO A 75 11.382 50.383 -43.435 1.00 60.25 C ATOM 1089 CG PRO A 75 12.173 50.664 -44.673 1.00 23.21 C ATOM 1090 CD PRO A 75 13.473 51.257 -44.216 1.00 65.03 C ATOM 0 HA PRO A 75 11.205 52.061 -42.005 1.00 2.31 H new ATOM 0 HB2 PRO A 75 11.488 49.341 -43.132 1.00 60.25 H new ATOM 0 HB3 PRO A 75 10.319 50.559 -43.603 1.00 60.25 H new ATOM 0 HG2 PRO A 75 12.341 49.750 -45.243 1.00 23.21 H new ATOM 0 HG3 PRO A 75 11.640 51.354 -45.327 1.00 23.21 H new ATOM 0 HD2 PRO A 75 14.221 50.490 -44.013 1.00 65.03 H new ATOM 0 HD3 PRO A 75 13.899 51.928 -44.962 1.00 65.03 H new ATOM 1098 N GLY A 76 13.600 50.110 -41.075 1.00 12.10 N ATOM 1099 CA GLY A 76 14.086 49.351 -39.947 1.00 14.01 C ATOM 1100 C GLY A 76 15.559 49.022 -40.057 1.00 13.34 C ATOM 1101 O GLY A 76 16.159 49.172 -41.121 1.00 72.12 O ATOM 0 H GLY A 76 14.289 50.277 -41.808 1.00 12.10 H new ATOM 0 HA2 GLY A 76 13.911 49.916 -39.031 1.00 14.01 H new ATOM 0 HA3 GLY A 76 13.516 48.426 -39.864 1.00 14.01 H new ATOM 1105 N ARG A 77 16.142 48.589 -38.950 1.00 2.44 N ATOM 1106 CA ARG A 77 17.547 48.206 -38.910 1.00 13.33 C ATOM 1107 C ARG A 77 17.664 46.753 -38.454 1.00 22.11 C ATOM 1108 O ARG A 77 16.895 46.302 -37.603 1.00 0.25 O ATOM 1109 CB ARG A 77 18.319 49.139 -37.966 1.00 21.41 C ATOM 1110 CG ARG A 77 17.765 49.164 -36.550 1.00 30.43 C ATOM 1111 CD ARG A 77 18.297 50.340 -35.742 1.00 20.32 C ATOM 1112 NE ARG A 77 19.745 50.284 -35.551 1.00 45.02 N ATOM 1113 CZ ARG A 77 20.331 50.067 -34.374 1.00 1.11 C ATOM 1114 NH1 ARG A 77 19.602 49.745 -33.313 1.00 21.40 N1+ ATOM 1115 NH2 ARG A 77 21.651 50.142 -34.271 1.00 14.15 N ATOM 0 H ARG A 77 15.658 48.493 -38.057 1.00 2.44 H new ATOM 0 HA ARG A 77 17.980 48.297 -39.906 1.00 13.33 H new ATOM 0 HB2 ARG A 77 19.363 48.827 -37.934 1.00 21.41 H new ATOM 0 HB3 ARG A 77 18.301 50.150 -38.373 1.00 21.41 H new ATOM 0 HG2 ARG A 77 16.677 49.215 -36.589 1.00 30.43 H new ATOM 0 HG3 ARG A 77 18.022 48.233 -36.045 1.00 30.43 H new ATOM 0 HD2 ARG A 77 18.037 51.270 -36.247 1.00 20.32 H new ATOM 0 HD3 ARG A 77 17.807 50.358 -34.769 1.00 20.32 H new ATOM 0 HE ARG A 77 20.342 50.419 -36.367 1.00 45.02 H new ATOM 0 HH11 ARG A 77 18.589 49.663 -33.396 1.00 21.40 H new ATOM 0 HH12 ARG A 77 20.055 49.580 -32.414 1.00 21.40 H new ATOM 0 HH21 ARG A 77 22.215 50.365 -35.091 1.00 14.15 H new ATOM 0 HH22 ARG A 77 22.103 49.976 -33.372 1.00 14.15 H new ATOM 1129 N MET A 78 18.605 46.017 -39.024 1.00 12.00 N ATOM 1130 CA MET A 78 18.751 44.601 -38.711 1.00 2.03 C ATOM 1131 C MET A 78 19.790 44.394 -37.619 1.00 70.13 C ATOM 1132 O MET A 78 20.994 44.490 -37.856 1.00 44.34 O ATOM 1133 CB MET A 78 19.138 43.807 -39.963 1.00 63.14 C ATOM 1134 CG MET A 78 19.321 42.317 -39.709 1.00 52.15 C ATOM 1135 SD MET A 78 19.793 41.407 -41.195 1.00 73.31 S ATOM 1136 CE MET A 78 18.385 41.734 -42.253 1.00 35.54 C ATOM 0 H MET A 78 19.277 46.373 -39.703 1.00 12.00 H new ATOM 0 HA MET A 78 17.790 44.236 -38.349 1.00 2.03 H new ATOM 0 HB2 MET A 78 18.369 43.945 -40.723 1.00 63.14 H new ATOM 0 HB3 MET A 78 20.064 44.214 -40.369 1.00 63.14 H new ATOM 0 HG2 MET A 78 20.084 42.175 -38.944 1.00 52.15 H new ATOM 0 HG3 MET A 78 18.393 41.904 -39.315 1.00 52.15 H new ATOM 0 HE1 MET A 78 18.331 40.974 -43.032 1.00 35.54 H new ATOM 0 HE2 MET A 78 17.471 41.711 -41.660 1.00 35.54 H new ATOM 0 HE3 MET A 78 18.495 42.717 -42.712 1.00 35.54 H new ATOM 1146 N VAL A 79 19.319 44.109 -36.416 1.00 63.22 N ATOM 1147 CA VAL A 79 20.206 43.878 -35.294 1.00 53.31 C ATOM 1148 C VAL A 79 20.270 42.392 -34.965 1.00 34.33 C ATOM 1149 O VAL A 79 19.314 41.819 -34.437 1.00 23.05 O ATOM 1150 CB VAL A 79 19.759 44.660 -34.039 1.00 51.15 C ATOM 1151 CG1 VAL A 79 20.737 44.441 -32.894 1.00 62.34 C ATOM 1152 CG2 VAL A 79 19.620 46.144 -34.348 1.00 20.14 C ATOM 0 H VAL A 79 18.326 44.033 -36.194 1.00 63.22 H new ATOM 0 HA VAL A 79 21.194 44.234 -35.586 1.00 53.31 H new ATOM 0 HB VAL A 79 18.783 44.283 -33.734 1.00 51.15 H new ATOM 0 HG11 VAL A 79 20.404 45.000 -32.019 1.00 62.34 H new ATOM 0 HG12 VAL A 79 20.781 43.379 -32.651 1.00 62.34 H new ATOM 0 HG13 VAL A 79 21.727 44.786 -33.190 1.00 62.34 H new ATOM 0 HG21 VAL A 79 19.304 46.675 -33.450 1.00 20.14 H new ATOM 0 HG22 VAL A 79 20.580 46.537 -34.683 1.00 20.14 H new ATOM 0 HG23 VAL A 79 18.876 46.284 -35.132 1.00 20.14 H new ATOM 1162 N THR A 80 21.387 41.769 -35.310 1.00 24.24 N ATOM 1163 CA THR A 80 21.625 40.379 -34.969 1.00 43.31 C ATOM 1164 C THR A 80 22.966 40.234 -34.259 1.00 22.22 C ATOM 1165 O THR A 80 23.827 41.104 -34.369 1.00 20.53 O ATOM 1166 CB THR A 80 21.576 39.463 -36.215 1.00 4.42 C ATOM 1167 OG1 THR A 80 22.329 40.030 -37.295 1.00 23.43 O ATOM 1168 CG2 THR A 80 20.142 39.235 -36.667 1.00 23.11 C ATOM 0 H THR A 80 22.146 42.210 -35.829 1.00 24.24 H new ATOM 0 HA THR A 80 20.826 40.063 -34.298 1.00 43.31 H new ATOM 0 HB THR A 80 22.017 38.506 -35.935 1.00 4.42 H new ATOM 0 HG1 THR A 80 23.000 40.648 -36.937 1.00 23.43 H new ATOM 0 HG21 THR A 80 20.136 38.588 -37.544 1.00 23.11 H new ATOM 0 HG22 THR A 80 19.578 38.762 -35.863 1.00 23.11 H new ATOM 0 HG23 THR A 80 19.683 40.191 -36.918 1.00 23.11 H new ATOM 1176 N ASN A 81 23.130 39.141 -33.529 1.00 12.13 N ATOM 1177 CA ASN A 81 24.335 38.911 -32.732 1.00 13.33 C ATOM 1178 C ASN A 81 25.569 38.813 -33.625 1.00 53.52 C ATOM 1179 O ASN A 81 26.593 39.437 -33.354 1.00 72.31 O ATOM 1180 CB ASN A 81 24.174 37.623 -31.908 1.00 31.34 C ATOM 1181 CG ASN A 81 25.293 37.391 -30.898 1.00 23.22 C ATOM 1182 OD1 ASN A 81 26.436 37.797 -31.092 1.00 55.05 O ATOM 1183 ND2 ASN A 81 24.964 36.720 -29.804 1.00 51.02 N ATOM 0 H ASN A 81 22.440 38.392 -33.469 1.00 12.13 H new ATOM 0 HA ASN A 81 24.471 39.757 -32.058 1.00 13.33 H new ATOM 0 HB2 ASN A 81 23.222 37.659 -31.379 1.00 31.34 H new ATOM 0 HB3 ASN A 81 24.129 36.772 -32.588 1.00 31.34 H new ATOM 0 HD21 ASN A 81 25.669 36.527 -29.093 1.00 51.02 H new ATOM 0 HD22 ASN A 81 24.006 36.397 -29.673 1.00 51.02 H new ATOM 1190 N ASP A 82 25.458 38.047 -34.702 1.00 32.11 N ATOM 1191 CA ASP A 82 26.612 37.754 -35.543 1.00 24.13 C ATOM 1192 C ASP A 82 26.967 38.925 -36.462 1.00 61.51 C ATOM 1193 O ASP A 82 28.119 39.080 -36.856 1.00 75.51 O ATOM 1194 CB ASP A 82 26.364 36.490 -36.365 1.00 23.52 C ATOM 1195 CG ASP A 82 27.633 35.960 -36.999 1.00 72.21 C ATOM 1196 OD1 ASP A 82 28.609 35.706 -36.262 1.00 63.25 O ATOM 1197 OD2 ASP A 82 27.648 35.761 -38.231 1.00 30.43 O1- ATOM 0 H ASP A 82 24.586 37.619 -35.013 1.00 32.11 H new ATOM 0 HA ASP A 82 27.463 37.590 -34.881 1.00 24.13 H new ATOM 0 HB2 ASP A 82 25.932 35.721 -35.724 1.00 23.52 H new ATOM 0 HB3 ASP A 82 25.633 36.704 -37.144 1.00 23.52 H new ATOM 1202 N TYR A 83 25.987 39.759 -36.787 1.00 2.10 N ATOM 1203 CA TYR A 83 26.225 40.905 -37.659 1.00 61.22 C ATOM 1204 C TYR A 83 25.305 42.069 -37.326 1.00 25.13 C ATOM 1205 O TYR A 83 24.110 41.891 -37.091 1.00 35.42 O ATOM 1206 CB TYR A 83 26.055 40.519 -39.134 1.00 22.35 C ATOM 1207 CG TYR A 83 27.321 39.985 -39.761 1.00 63.34 C ATOM 1208 CD1 TYR A 83 28.349 40.845 -40.117 1.00 54.31 C ATOM 1209 CD2 TYR A 83 27.497 38.626 -39.986 1.00 61.31 C ATOM 1210 CE1 TYR A 83 29.516 40.371 -40.679 1.00 54.50 C ATOM 1211 CE2 TYR A 83 28.661 38.141 -40.552 1.00 43.02 C ATOM 1212 CZ TYR A 83 29.669 39.018 -40.892 1.00 0.23 C ATOM 1213 OH TYR A 83 30.837 38.543 -41.447 1.00 35.22 O ATOM 0 H TYR A 83 25.025 39.665 -36.463 1.00 2.10 H new ATOM 0 HA TYR A 83 27.254 41.223 -37.489 1.00 61.22 H new ATOM 0 HB2 TYR A 83 25.271 39.766 -39.217 1.00 22.35 H new ATOM 0 HB3 TYR A 83 25.720 41.392 -39.695 1.00 22.35 H new ATOM 0 HD1 TYR A 83 28.234 41.906 -39.951 1.00 54.31 H new ATOM 0 HD2 TYR A 83 26.711 37.937 -39.714 1.00 61.31 H new ATOM 0 HE1 TYR A 83 30.305 41.056 -40.951 1.00 54.50 H new ATOM 0 HE2 TYR A 83 28.780 37.082 -40.727 1.00 43.02 H new ATOM 0 HH TYR A 83 31.604 38.938 -40.982 1.00 35.22 H new ATOM 1223 N ILE A 84 25.871 43.264 -37.298 1.00 71.04 N ATOM 1224 CA ILE A 84 25.090 44.473 -37.095 1.00 33.43 C ATOM 1225 C ILE A 84 24.814 45.125 -38.440 1.00 24.33 C ATOM 1226 O ILE A 84 25.676 45.795 -38.999 1.00 13.30 O ATOM 1227 CB ILE A 84 25.813 45.478 -36.169 1.00 35.11 C ATOM 1228 CG1 ILE A 84 26.121 44.835 -34.813 1.00 70.51 C ATOM 1229 CG2 ILE A 84 24.974 46.735 -35.979 1.00 63.41 C ATOM 1230 CD1 ILE A 84 24.888 44.334 -34.091 1.00 21.15 C ATOM 0 H ILE A 84 26.872 43.423 -37.414 1.00 71.04 H new ATOM 0 HA ILE A 84 24.154 44.192 -36.611 1.00 33.43 H new ATOM 0 HB ILE A 84 26.754 45.759 -36.642 1.00 35.11 H new ATOM 0 HG12 ILE A 84 26.809 44.003 -34.962 1.00 70.51 H new ATOM 0 HG13 ILE A 84 26.632 45.562 -34.182 1.00 70.51 H new ATOM 0 HG21 ILE A 84 25.501 47.429 -35.324 1.00 63.41 H new ATOM 0 HG22 ILE A 84 24.803 47.208 -36.946 1.00 63.41 H new ATOM 0 HG23 ILE A 84 24.017 46.469 -35.531 1.00 63.41 H new ATOM 0 HD11 ILE A 84 25.179 43.891 -33.139 1.00 21.15 H new ATOM 0 HD12 ILE A 84 24.208 45.167 -33.911 1.00 21.15 H new ATOM 0 HD13 ILE A 84 24.388 43.583 -34.703 1.00 21.15 H new ATOM 1242 N VAL A 85 23.626 44.900 -38.969 1.00 45.21 N ATOM 1243 CA VAL A 85 23.267 45.424 -40.275 1.00 41.00 C ATOM 1244 C VAL A 85 22.352 46.633 -40.125 1.00 52.13 C ATOM 1245 O VAL A 85 21.126 46.511 -40.121 1.00 43.50 O ATOM 1246 CB VAL A 85 22.574 44.350 -41.145 1.00 62.43 C ATOM 1247 CG1 VAL A 85 22.342 44.861 -42.558 1.00 1.04 C ATOM 1248 CG2 VAL A 85 23.389 43.063 -41.168 1.00 64.33 C ATOM 0 H VAL A 85 22.892 44.357 -38.514 1.00 45.21 H new ATOM 0 HA VAL A 85 24.188 45.725 -40.775 1.00 41.00 H new ATOM 0 HB VAL A 85 21.604 44.133 -40.699 1.00 62.43 H new ATOM 0 HG11 VAL A 85 21.853 44.087 -43.149 1.00 1.04 H new ATOM 0 HG12 VAL A 85 21.708 45.747 -42.525 1.00 1.04 H new ATOM 0 HG13 VAL A 85 23.298 45.116 -43.014 1.00 1.04 H new ATOM 0 HG21 VAL A 85 22.882 42.322 -41.786 1.00 64.33 H new ATOM 0 HG22 VAL A 85 24.377 43.265 -41.581 1.00 64.33 H new ATOM 0 HG23 VAL A 85 23.492 42.679 -40.153 1.00 64.33 H new ATOM 1258 N ASP A 86 22.954 47.798 -39.975 1.00 31.13 N ATOM 1259 CA ASP A 86 22.193 49.017 -39.775 1.00 20.21 C ATOM 1260 C ASP A 86 21.904 49.667 -41.118 1.00 24.31 C ATOM 1261 O ASP A 86 22.818 49.943 -41.900 1.00 74.51 O ATOM 1262 CB ASP A 86 22.949 49.987 -38.866 1.00 4.42 C ATOM 1263 CG ASP A 86 22.019 50.938 -38.134 1.00 33.31 C ATOM 1264 OD1 ASP A 86 22.058 50.961 -36.886 1.00 21.44 O ATOM 1265 OD2 ASP A 86 21.242 51.654 -38.794 1.00 45.22 O1- ATOM 0 H ASP A 86 23.966 47.926 -39.988 1.00 31.13 H new ATOM 0 HA ASP A 86 21.250 48.765 -39.289 1.00 20.21 H new ATOM 0 HB2 ASP A 86 23.531 49.421 -38.139 1.00 4.42 H new ATOM 0 HB3 ASP A 86 23.657 50.563 -39.462 1.00 4.42 H new ATOM 1270 N ILE A 87 20.633 49.894 -41.391 1.00 70.13 N ATOM 1271 CA ILE A 87 20.214 50.427 -42.673 1.00 11.31 C ATOM 1272 C ILE A 87 19.994 51.930 -42.576 1.00 5.45 C ATOM 1273 O ILE A 87 19.136 52.395 -41.830 1.00 31.44 O ATOM 1274 CB ILE A 87 18.925 49.737 -43.168 1.00 73.15 C ATOM 1275 CG1 ILE A 87 19.140 48.221 -43.245 1.00 41.53 C ATOM 1276 CG2 ILE A 87 18.513 50.290 -44.526 1.00 33.35 C ATOM 1277 CD1 ILE A 87 17.889 47.438 -43.582 1.00 31.30 C ATOM 0 H ILE A 87 19.870 49.716 -40.738 1.00 70.13 H new ATOM 0 HA ILE A 87 21.008 50.228 -43.393 1.00 11.31 H new ATOM 0 HB ILE A 87 18.122 49.941 -42.460 1.00 73.15 H new ATOM 0 HG12 ILE A 87 19.902 48.010 -43.996 1.00 41.53 H new ATOM 0 HG13 ILE A 87 19.529 47.871 -42.289 1.00 41.53 H new ATOM 0 HG21 ILE A 87 17.602 49.793 -44.860 1.00 33.35 H new ATOM 0 HG22 ILE A 87 18.332 51.362 -44.443 1.00 33.35 H new ATOM 0 HG23 ILE A 87 19.310 50.112 -45.248 1.00 33.35 H new ATOM 0 HD11 ILE A 87 18.124 46.374 -43.618 1.00 31.30 H new ATOM 0 HD12 ILE A 87 17.131 47.617 -42.819 1.00 31.30 H new ATOM 0 HD13 ILE A 87 17.510 47.758 -44.552 1.00 31.30 H new ATOM 1289 N ALA A 88 20.777 52.683 -43.329 1.00 34.53 N ATOM 1290 CA ALA A 88 20.695 54.129 -43.299 1.00 21.21 C ATOM 1291 C ALA A 88 20.130 54.674 -44.603 1.00 23.43 C ATOM 1292 O ALA A 88 20.866 54.965 -45.546 1.00 54.14 O ATOM 1293 CB ALA A 88 22.065 54.729 -43.029 1.00 40.44 C ATOM 0 H ALA A 88 21.479 52.313 -43.970 1.00 34.53 H new ATOM 0 HA ALA A 88 20.019 54.412 -42.492 1.00 21.21 H new ATOM 0 HB1 ALA A 88 21.989 55.816 -43.009 1.00 40.44 H new ATOM 0 HB2 ALA A 88 22.435 54.374 -42.067 1.00 40.44 H new ATOM 0 HB3 ALA A 88 22.756 54.428 -43.817 1.00 40.44 H new ATOM 1299 N ASN A 89 18.818 54.768 -44.670 1.00 52.24 N ATOM 1300 CA ASN A 89 18.167 55.436 -45.783 1.00 21.13 C ATOM 1301 C ASN A 89 17.835 56.854 -45.363 1.00 22.12 C ATOM 1302 O ASN A 89 16.961 57.071 -44.529 1.00 62.21 O ATOM 1303 CB ASN A 89 16.898 54.692 -46.210 1.00 44.43 C ATOM 1304 CG ASN A 89 16.186 55.356 -47.381 1.00 51.24 C ATOM 1305 OD1 ASN A 89 14.962 55.305 -47.482 1.00 34.21 O ATOM 1306 ND2 ASN A 89 16.943 55.968 -48.282 1.00 52.10 N ATOM 0 H ASN A 89 18.180 54.391 -43.969 1.00 52.24 H new ATOM 0 HA ASN A 89 18.839 55.447 -46.641 1.00 21.13 H new ATOM 0 HB2 ASN A 89 17.157 53.669 -46.482 1.00 44.43 H new ATOM 0 HB3 ASN A 89 16.215 54.633 -45.362 1.00 44.43 H new ATOM 0 HD21 ASN A 89 16.512 56.416 -49.091 1.00 52.10 H new ATOM 0 HD22 ASN A 89 17.956 55.991 -48.166 1.00 52.10 H new ATOM 1313 N ARG A 90 18.571 57.807 -45.906 1.00 34.23 N ATOM 1314 CA ARG A 90 18.417 59.202 -45.530 1.00 61.53 C ATOM 1315 C ARG A 90 18.997 60.099 -46.612 1.00 14.51 C ATOM 1316 O ARG A 90 19.935 59.708 -47.311 1.00 31.12 O ATOM 1317 CB ARG A 90 19.114 59.460 -44.185 1.00 1.00 C ATOM 1318 CG ARG A 90 19.199 60.928 -43.789 1.00 75.44 C ATOM 1319 CD ARG A 90 17.827 61.545 -43.580 1.00 14.21 C ATOM 1320 NE ARG A 90 17.916 62.988 -43.382 1.00 45.22 N ATOM 1321 CZ ARG A 90 17.075 63.699 -42.639 1.00 45.51 C ATOM 1322 NH1 ARG A 90 16.037 63.106 -42.055 1.00 34.45 N1+ ATOM 1323 NH2 ARG A 90 17.263 65.004 -42.506 1.00 21.12 N ATOM 0 H ARG A 90 19.286 57.639 -46.614 1.00 34.23 H new ATOM 0 HA ARG A 90 17.357 59.430 -45.423 1.00 61.53 H new ATOM 0 HB2 ARG A 90 18.582 58.916 -43.404 1.00 1.00 H new ATOM 0 HB3 ARG A 90 20.123 59.049 -44.228 1.00 1.00 H new ATOM 0 HG2 ARG A 90 19.782 61.022 -42.873 1.00 75.44 H new ATOM 0 HG3 ARG A 90 19.731 61.481 -44.563 1.00 75.44 H new ATOM 0 HD2 ARG A 90 17.196 61.333 -44.443 1.00 14.21 H new ATOM 0 HD3 ARG A 90 17.348 61.086 -42.715 1.00 14.21 H new ATOM 0 HE ARG A 90 18.676 63.485 -43.846 1.00 45.22 H new ATOM 0 HH11 ARG A 90 15.886 62.105 -42.178 1.00 34.45 H new ATOM 0 HH12 ARG A 90 15.392 63.653 -41.485 1.00 34.45 H new ATOM 0 HH21 ARG A 90 18.049 65.456 -42.973 1.00 21.12 H new ATOM 0 HH22 ARG A 90 16.621 65.556 -41.937 1.00 21.12 H new ATOM 1337 N ASP A 91 18.390 61.275 -46.777 1.00 14.33 N ATOM 1338 CA ASP A 91 18.888 62.316 -47.678 1.00 71.02 C ATOM 1339 C ASP A 91 18.694 61.918 -49.138 1.00 43.52 C ATOM 1340 O ASP A 91 19.040 62.664 -50.051 1.00 61.51 O ATOM 1341 CB ASP A 91 20.365 62.618 -47.385 1.00 34.34 C ATOM 1342 CG ASP A 91 20.794 63.997 -47.848 1.00 2.00 C ATOM 1343 OD1 ASP A 91 21.721 64.090 -48.678 1.00 21.24 O ATOM 1344 OD2 ASP A 91 20.212 64.996 -47.366 1.00 32.31 O1- ATOM 0 H ASP A 91 17.534 61.534 -46.287 1.00 14.33 H new ATOM 0 HA ASP A 91 18.310 63.223 -47.502 1.00 71.02 H new ATOM 0 HB2 ASP A 91 20.542 62.530 -46.313 1.00 34.34 H new ATOM 0 HB3 ASP A 91 20.987 61.868 -47.873 1.00 34.34 H new ATOM 1349 N GLY A 92 18.115 60.743 -49.344 1.00 75.32 N ATOM 1350 CA GLY A 92 17.857 60.264 -50.684 1.00 62.34 C ATOM 1351 C GLY A 92 18.665 59.032 -51.022 1.00 52.21 C ATOM 1352 O GLY A 92 18.273 58.238 -51.878 1.00 23.30 O ATOM 0 H GLY A 92 17.818 60.111 -48.601 1.00 75.32 H new ATOM 0 HA2 GLY A 92 16.796 60.039 -50.788 1.00 62.34 H new ATOM 0 HA3 GLY A 92 18.087 61.053 -51.400 1.00 62.34 H new ATOM 1356 N GLN A 93 19.781 58.855 -50.330 1.00 55.42 N ATOM 1357 CA GLN A 93 20.700 57.767 -50.631 1.00 43.03 C ATOM 1358 C GLN A 93 20.448 56.553 -49.741 1.00 53.23 C ATOM 1359 O GLN A 93 19.835 56.655 -48.673 1.00 62.41 O ATOM 1360 CB GLN A 93 22.150 58.235 -50.471 1.00 32.14 C ATOM 1361 CG GLN A 93 22.615 59.205 -51.549 1.00 62.32 C ATOM 1362 CD GLN A 93 23.159 58.516 -52.794 1.00 5.43 C ATOM 1363 OE1 GLN A 93 24.028 59.053 -53.482 1.00 25.23 O ATOM 1364 NE2 GLN A 93 22.659 57.326 -53.100 1.00 33.20 N ATOM 0 H GLN A 93 20.072 59.451 -49.555 1.00 55.42 H new ATOM 0 HA GLN A 93 20.527 57.469 -51.665 1.00 43.03 H new ATOM 0 HB2 GLN A 93 22.261 58.711 -49.497 1.00 32.14 H new ATOM 0 HB3 GLN A 93 22.804 57.363 -50.476 1.00 32.14 H new ATOM 0 HG2 GLN A 93 21.781 59.846 -51.834 1.00 62.32 H new ATOM 0 HG3 GLN A 93 23.388 59.852 -51.135 1.00 62.32 H new ATOM 0 HE21 GLN A 93 21.940 56.908 -52.510 1.00 33.20 H new ATOM 0 HE22 GLN A 93 22.994 56.829 -53.926 1.00 33.20 H new ATOM 1373 N LEU A 94 20.911 55.402 -50.206 1.00 22.14 N ATOM 1374 CA LEU A 94 20.839 54.169 -49.439 1.00 50.31 C ATOM 1375 C LEU A 94 22.221 53.814 -48.922 1.00 43.43 C ATOM 1376 O LEU A 94 23.145 53.578 -49.702 1.00 52.24 O ATOM 1377 CB LEU A 94 20.288 53.015 -50.290 1.00 41.23 C ATOM 1378 CG LEU A 94 18.762 52.903 -50.364 1.00 41.02 C ATOM 1379 CD1 LEU A 94 18.181 52.634 -48.982 1.00 1.43 C ATOM 1380 CD2 LEU A 94 18.151 54.158 -50.962 1.00 42.11 C ATOM 0 H LEU A 94 21.346 55.297 -51.123 1.00 22.14 H new ATOM 0 HA LEU A 94 20.159 54.324 -48.601 1.00 50.31 H new ATOM 0 HB2 LEU A 94 20.674 53.121 -51.304 1.00 41.23 H new ATOM 0 HB3 LEU A 94 20.682 52.079 -49.895 1.00 41.23 H new ATOM 0 HG LEU A 94 18.516 52.065 -51.016 1.00 41.02 H new ATOM 0 HD11 LEU A 94 17.096 52.557 -49.052 1.00 1.43 H new ATOM 0 HD12 LEU A 94 18.586 51.700 -48.592 1.00 1.43 H new ATOM 0 HD13 LEU A 94 18.444 53.452 -48.311 1.00 1.43 H new ATOM 0 HD21 LEU A 94 17.067 54.051 -51.003 1.00 42.11 H new ATOM 0 HD22 LEU A 94 18.408 55.018 -50.344 1.00 42.11 H new ATOM 0 HD23 LEU A 94 18.539 54.307 -51.970 1.00 42.11 H new ATOM 1392 N GLN A 95 22.368 53.803 -47.614 1.00 22.34 N ATOM 1393 CA GLN A 95 23.645 53.493 -47.002 1.00 52.10 C ATOM 1394 C GLN A 95 23.509 52.284 -46.090 1.00 55.53 C ATOM 1395 O GLN A 95 22.628 52.236 -45.235 1.00 20.22 O ATOM 1396 CB GLN A 95 24.149 54.696 -46.209 1.00 54.30 C ATOM 1397 CG GLN A 95 24.193 55.984 -47.017 1.00 4.25 C ATOM 1398 CD GLN A 95 24.673 57.169 -46.204 1.00 5.40 C ATOM 1399 OE1 GLN A 95 24.246 58.303 -46.422 1.00 14.41 O ATOM 1400 NE2 GLN A 95 25.574 56.919 -45.268 1.00 5.31 N ATOM 0 H GLN A 95 21.619 54.005 -46.952 1.00 22.34 H new ATOM 0 HA GLN A 95 24.365 53.260 -47.786 1.00 52.10 H new ATOM 0 HB2 GLN A 95 23.506 54.843 -45.341 1.00 54.30 H new ATOM 0 HB3 GLN A 95 25.149 54.479 -45.832 1.00 54.30 H new ATOM 0 HG2 GLN A 95 24.851 55.847 -47.875 1.00 4.25 H new ATOM 0 HG3 GLN A 95 23.198 56.196 -47.409 1.00 4.25 H new ATOM 0 HE21 GLN A 95 25.903 55.965 -45.118 1.00 5.31 H new ATOM 0 HE22 GLN A 95 25.940 57.680 -44.696 1.00 5.31 H new ATOM 1409 N LEU A 96 24.365 51.304 -46.284 1.00 75.11 N ATOM 1410 CA LEU A 96 24.339 50.105 -45.467 1.00 53.33 C ATOM 1411 C LEU A 96 25.557 50.067 -44.559 1.00 12.32 C ATOM 1412 O LEU A 96 26.688 50.135 -45.032 1.00 51.50 O ATOM 1413 CB LEU A 96 24.300 48.855 -46.348 1.00 11.23 C ATOM 1414 CG LEU A 96 24.114 47.537 -45.598 1.00 54.15 C ATOM 1415 CD1 LEU A 96 22.781 47.526 -44.870 1.00 12.31 C ATOM 1416 CD2 LEU A 96 24.208 46.361 -46.557 1.00 11.35 C ATOM 0 H LEU A 96 25.090 51.312 -47.001 1.00 75.11 H new ATOM 0 HA LEU A 96 23.439 50.123 -44.853 1.00 53.33 H new ATOM 0 HB2 LEU A 96 23.489 48.963 -47.068 1.00 11.23 H new ATOM 0 HB3 LEU A 96 25.228 48.803 -46.918 1.00 11.23 H new ATOM 0 HG LEU A 96 24.911 47.443 -44.860 1.00 54.15 H new ATOM 0 HD11 LEU A 96 22.663 46.581 -44.341 1.00 12.31 H new ATOM 0 HD12 LEU A 96 22.750 48.348 -44.155 1.00 12.31 H new ATOM 0 HD13 LEU A 96 21.972 47.641 -45.591 1.00 12.31 H new ATOM 0 HD21 LEU A 96 24.073 45.430 -46.006 1.00 11.35 H new ATOM 0 HD22 LEU A 96 23.432 46.448 -47.317 1.00 11.35 H new ATOM 0 HD23 LEU A 96 25.187 46.360 -47.037 1.00 11.35 H new ATOM 1428 N ASN A 97 25.322 50.006 -43.254 1.00 24.34 N ATOM 1429 CA ASN A 97 26.406 49.913 -42.279 1.00 24.31 C ATOM 1430 C ASN A 97 26.368 48.557 -41.590 1.00 43.41 C ATOM 1431 O ASN A 97 25.539 48.321 -40.713 1.00 33.42 O ATOM 1432 CB ASN A 97 26.302 51.025 -41.221 1.00 32.34 C ATOM 1433 CG ASN A 97 26.673 52.409 -41.731 1.00 4.11 C ATOM 1434 OD1 ASN A 97 27.180 53.240 -40.982 1.00 11.22 O ATOM 1435 ND2 ASN A 97 26.412 52.678 -42.999 1.00 2.51 N ATOM 0 H ASN A 97 24.388 50.019 -42.844 1.00 24.34 H new ATOM 0 HA ASN A 97 27.349 50.031 -42.813 1.00 24.31 H new ATOM 0 HB2 ASN A 97 25.282 51.053 -40.839 1.00 32.34 H new ATOM 0 HB3 ASN A 97 26.950 50.774 -40.382 1.00 32.34 H new ATOM 0 HD21 ASN A 97 26.632 53.598 -43.381 1.00 2.51 H new ATOM 0 HD22 ASN A 97 25.990 51.966 -43.595 1.00 2.51 H new ATOM 1442 N VAL A 98 27.250 47.658 -42.001 1.00 45.14 N ATOM 1443 CA VAL A 98 27.281 46.317 -41.433 1.00 72.02 C ATOM 1444 C VAL A 98 28.574 46.075 -40.650 1.00 15.31 C ATOM 1445 O VAL A 98 29.674 46.094 -41.205 1.00 42.35 O ATOM 1446 CB VAL A 98 27.087 45.229 -42.523 1.00 44.14 C ATOM 1447 CG1 VAL A 98 28.110 45.365 -43.641 1.00 50.42 C ATOM 1448 CG2 VAL A 98 27.138 43.835 -41.908 1.00 24.02 C ATOM 0 H VAL A 98 27.951 47.831 -42.722 1.00 45.14 H new ATOM 0 HA VAL A 98 26.445 46.243 -40.738 1.00 72.02 H new ATOM 0 HB VAL A 98 26.101 45.376 -42.963 1.00 44.14 H new ATOM 0 HG11 VAL A 98 27.942 44.586 -44.385 1.00 50.42 H new ATOM 0 HG12 VAL A 98 28.008 46.343 -44.111 1.00 50.42 H new ATOM 0 HG13 VAL A 98 29.114 45.263 -43.230 1.00 50.42 H new ATOM 0 HG21 VAL A 98 27.000 43.087 -42.689 1.00 24.02 H new ATOM 0 HG22 VAL A 98 28.105 43.684 -41.428 1.00 24.02 H new ATOM 0 HG23 VAL A 98 26.346 43.735 -41.166 1.00 24.02 H new ATOM 1458 N THR A 99 28.431 45.874 -39.349 1.00 13.53 N ATOM 1459 CA THR A 99 29.567 45.622 -38.480 1.00 63.52 C ATOM 1460 C THR A 99 29.825 44.123 -38.335 1.00 34.14 C ATOM 1461 O THR A 99 28.936 43.364 -37.934 1.00 52.04 O ATOM 1462 CB THR A 99 29.344 46.241 -37.086 1.00 15.12 C ATOM 1463 OG1 THR A 99 29.039 47.634 -37.219 1.00 32.14 O ATOM 1464 CG2 THR A 99 30.576 46.076 -36.207 1.00 64.32 C ATOM 0 H THR A 99 27.531 45.881 -38.870 1.00 13.53 H new ATOM 0 HA THR A 99 30.438 46.088 -38.941 1.00 63.52 H new ATOM 0 HB THR A 99 28.511 45.721 -36.614 1.00 15.12 H new ATOM 0 HG1 THR A 99 28.896 48.024 -36.331 1.00 32.14 H new ATOM 0 HG21 THR A 99 30.389 46.522 -35.230 1.00 64.32 H new ATOM 0 HG22 THR A 99 30.797 45.016 -36.085 1.00 64.32 H new ATOM 0 HG23 THR A 99 31.426 46.572 -36.675 1.00 64.32 H new ATOM 1472 N ASP A 100 31.041 43.715 -38.678 1.00 61.11 N ATOM 1473 CA ASP A 100 31.471 42.326 -38.547 1.00 23.41 C ATOM 1474 C ASP A 100 31.748 41.982 -37.079 1.00 63.40 C ATOM 1475 O ASP A 100 31.989 42.873 -36.266 1.00 62.23 O ATOM 1476 CB ASP A 100 32.725 42.107 -39.400 1.00 14.41 C ATOM 1477 CG ASP A 100 33.248 40.690 -39.332 1.00 53.52 C ATOM 1478 OD1 ASP A 100 32.707 39.808 -40.024 1.00 4.12 O ATOM 1479 OD2 ASP A 100 34.211 40.461 -38.580 1.00 11.31 O1- ATOM 0 H ASP A 100 31.757 44.336 -39.055 1.00 61.11 H new ATOM 0 HA ASP A 100 30.677 41.667 -38.898 1.00 23.41 H new ATOM 0 HB2 ASP A 100 32.500 42.355 -40.437 1.00 14.41 H new ATOM 0 HB3 ASP A 100 33.506 42.792 -39.070 1.00 14.41 H new ATOM 1484 N ARG A 101 31.714 40.696 -36.744 1.00 1.22 N ATOM 1485 CA ARG A 101 31.895 40.257 -35.359 1.00 70.42 C ATOM 1486 C ARG A 101 33.160 39.417 -35.172 1.00 41.44 C ATOM 1487 O ARG A 101 33.423 38.933 -34.075 1.00 3.54 O ATOM 1488 CB ARG A 101 30.679 39.456 -34.898 1.00 70.04 C ATOM 1489 CG ARG A 101 29.547 40.310 -34.356 1.00 12.41 C ATOM 1490 CD ARG A 101 29.899 40.896 -33.001 1.00 13.24 C ATOM 1491 NE ARG A 101 28.778 41.630 -32.413 1.00 14.53 N ATOM 1492 CZ ARG A 101 28.440 41.562 -31.123 1.00 32.32 C ATOM 1493 NH1 ARG A 101 29.075 40.725 -30.314 1.00 20.33 N1+ ATOM 1494 NH2 ARG A 101 27.444 42.300 -30.647 1.00 52.25 N ATOM 0 H ARG A 101 31.563 39.938 -37.410 1.00 1.22 H new ATOM 0 HA ARG A 101 32.003 41.156 -34.752 1.00 70.42 H new ATOM 0 HB2 ARG A 101 30.307 38.866 -35.735 1.00 70.04 H new ATOM 0 HB3 ARG A 101 30.991 38.752 -34.126 1.00 70.04 H new ATOM 0 HG2 ARG A 101 29.328 41.115 -35.057 1.00 12.41 H new ATOM 0 HG3 ARG A 101 28.643 39.707 -34.270 1.00 12.41 H new ATOM 0 HD2 ARG A 101 30.201 40.095 -32.327 1.00 13.24 H new ATOM 0 HD3 ARG A 101 30.754 41.564 -33.106 1.00 13.24 H new ATOM 0 HE ARG A 101 28.222 42.228 -33.024 1.00 14.53 H new ATOM 0 HH11 ARG A 101 29.822 40.133 -30.677 1.00 20.33 H new ATOM 0 HH12 ARG A 101 28.817 40.673 -29.329 1.00 20.33 H new ATOM 0 HH21 ARG A 101 26.930 42.925 -31.268 1.00 52.25 H new ATOM 0 HH22 ARG A 101 27.193 42.242 -29.660 1.00 52.25 H new ATOM 1508 N LYS A 102 33.937 39.239 -36.230 1.00 25.22 N ATOM 1509 CA LYS A 102 35.168 38.452 -36.144 1.00 51.24 C ATOM 1510 C LYS A 102 36.387 39.367 -36.223 1.00 24.03 C ATOM 1511 O LYS A 102 37.418 39.123 -35.596 1.00 61.52 O ATOM 1512 CB LYS A 102 35.226 37.419 -37.273 1.00 63.24 C ATOM 1513 CG LYS A 102 33.997 36.527 -37.362 1.00 64.00 C ATOM 1514 CD LYS A 102 33.803 35.688 -36.108 1.00 42.35 C ATOM 1515 CE LYS A 102 34.990 34.774 -35.844 1.00 32.33 C ATOM 1516 NZ LYS A 102 34.690 33.766 -34.794 1.00 73.14 N1+ ATOM 0 H LYS A 102 33.743 39.624 -37.154 1.00 25.22 H new ATOM 0 HA LYS A 102 35.173 37.930 -35.187 1.00 51.24 H new ATOM 0 HB2 LYS A 102 35.353 37.940 -38.222 1.00 63.24 H new ATOM 0 HB3 LYS A 102 36.107 36.793 -37.133 1.00 63.24 H new ATOM 0 HG2 LYS A 102 33.113 37.144 -37.524 1.00 64.00 H new ATOM 0 HG3 LYS A 102 34.089 35.869 -38.226 1.00 64.00 H new ATOM 0 HD2 LYS A 102 33.654 36.345 -35.251 1.00 42.35 H new ATOM 0 HD3 LYS A 102 32.899 35.088 -36.210 1.00 42.35 H new ATOM 0 HE2 LYS A 102 35.269 34.265 -36.767 1.00 32.33 H new ATOM 0 HE3 LYS A 102 35.848 35.372 -35.538 1.00 32.33 H new ATOM 0 HZ1 LYS A 102 35.524 33.163 -34.644 1.00 73.14 H new ATOM 0 HZ2 LYS A 102 34.449 34.251 -33.906 1.00 73.14 H new ATOM 0 HZ3 LYS A 102 33.887 33.178 -35.097 1.00 73.14 H new ATOM 1530 N THR A 103 36.254 40.408 -37.024 1.00 32.11 N ATOM 1531 CA THR A 103 37.286 41.423 -37.175 1.00 65.25 C ATOM 1532 C THR A 103 36.734 42.797 -36.814 1.00 51.12 C ATOM 1533 O THR A 103 37.477 43.713 -36.460 1.00 72.12 O ATOM 1534 CB THR A 103 37.817 41.453 -38.620 1.00 3.51 C ATOM 1535 OG1 THR A 103 36.718 41.422 -39.546 1.00 71.14 O ATOM 1536 CG2 THR A 103 38.741 40.276 -38.888 1.00 15.44 C ATOM 0 H THR A 103 35.424 40.576 -37.592 1.00 32.11 H new ATOM 0 HA THR A 103 38.105 41.171 -36.501 1.00 65.25 H new ATOM 0 HB THR A 103 38.384 42.374 -38.753 1.00 3.51 H new ATOM 0 HG1 THR A 103 35.888 41.227 -39.062 1.00 71.14 H new ATOM 0 HG21 THR A 103 39.101 40.323 -39.916 1.00 15.44 H new ATOM 0 HG22 THR A 103 39.589 40.316 -38.204 1.00 15.44 H new ATOM 0 HG23 THR A 103 38.196 39.344 -38.736 1.00 15.44 H new ATOM 1544 N GLY A 104 35.417 42.930 -36.908 1.00 65.24 N ATOM 1545 CA GLY A 104 34.774 44.191 -36.612 1.00 42.41 C ATOM 1546 C GLY A 104 34.794 45.128 -37.797 1.00 24.42 C ATOM 1547 O GLY A 104 34.536 46.326 -37.657 1.00 13.23 O ATOM 0 H GLY A 104 34.782 42.182 -37.186 1.00 65.24 H new ATOM 0 HA2 GLY A 104 33.742 44.010 -36.310 1.00 42.41 H new ATOM 0 HA3 GLY A 104 35.275 44.664 -35.767 1.00 42.41 H new ATOM 1551 N GLN A 105 35.100 44.576 -38.966 1.00 51.35 N ATOM 1552 CA GLN A 105 35.105 45.345 -40.201 1.00 72.04 C ATOM 1553 C GLN A 105 33.703 45.848 -40.519 1.00 12.40 C ATOM 1554 O GLN A 105 32.851 45.088 -40.978 1.00 64.30 O ATOM 1555 CB GLN A 105 35.634 44.498 -41.364 1.00 71.44 C ATOM 1556 CG GLN A 105 37.090 44.089 -41.212 1.00 11.23 C ATOM 1557 CD GLN A 105 37.567 43.206 -42.346 1.00 44.43 C ATOM 1558 OE1 GLN A 105 38.048 43.693 -43.367 1.00 42.45 O ATOM 1559 NE2 GLN A 105 37.448 41.901 -42.171 1.00 23.32 N ATOM 0 H GLN A 105 35.349 43.594 -39.082 1.00 51.35 H new ATOM 0 HA GLN A 105 35.765 46.202 -40.066 1.00 72.04 H new ATOM 0 HB2 GLN A 105 35.022 43.601 -41.456 1.00 71.44 H new ATOM 0 HB3 GLN A 105 35.519 45.059 -42.292 1.00 71.44 H new ATOM 0 HG2 GLN A 105 37.712 44.983 -41.166 1.00 11.23 H new ATOM 0 HG3 GLN A 105 37.219 43.562 -40.267 1.00 11.23 H new ATOM 0 HE21 GLN A 105 37.043 41.537 -41.308 1.00 23.32 H new ATOM 0 HE22 GLN A 105 37.761 41.258 -42.898 1.00 23.32 H new ATOM 1568 N THR A 106 33.458 47.115 -40.239 1.00 25.35 N ATOM 1569 CA THR A 106 32.179 47.721 -40.553 1.00 43.25 C ATOM 1570 C THR A 106 32.186 48.227 -41.988 1.00 44.11 C ATOM 1571 O THR A 106 32.883 49.185 -42.317 1.00 33.22 O ATOM 1572 CB THR A 106 31.851 48.876 -39.588 1.00 61.32 C ATOM 1573 OG1 THR A 106 31.894 48.401 -38.232 1.00 1.35 O ATOM 1574 CG2 THR A 106 30.473 49.459 -39.879 1.00 5.13 C ATOM 0 H THR A 106 34.128 47.743 -39.795 1.00 25.35 H new ATOM 0 HA THR A 106 31.407 46.960 -40.438 1.00 43.25 H new ATOM 0 HB THR A 106 32.594 49.661 -39.730 1.00 61.32 H new ATOM 0 HG1 THR A 106 30.981 48.260 -37.906 1.00 1.35 H new ATOM 0 HG21 THR A 106 30.268 50.272 -39.183 1.00 5.13 H new ATOM 0 HG22 THR A 106 30.447 49.840 -40.900 1.00 5.13 H new ATOM 0 HG23 THR A 106 29.717 48.682 -39.762 1.00 5.13 H new ATOM 1582 N SER A 107 31.437 47.556 -42.841 1.00 30.10 N ATOM 1583 CA SER A 107 31.363 47.930 -44.239 1.00 71.15 C ATOM 1584 C SER A 107 30.284 48.990 -44.432 1.00 42.21 C ATOM 1585 O SER A 107 29.088 48.699 -44.350 1.00 53.14 O ATOM 1586 CB SER A 107 31.077 46.700 -45.108 1.00 62.32 C ATOM 1587 OG SER A 107 31.208 46.995 -46.489 1.00 35.01 O ATOM 0 H SER A 107 30.870 46.747 -42.589 1.00 30.10 H new ATOM 0 HA SER A 107 32.322 48.346 -44.548 1.00 71.15 H new ATOM 0 HB2 SER A 107 31.764 45.897 -44.840 1.00 62.32 H new ATOM 0 HB3 SER A 107 30.069 46.338 -44.907 1.00 62.32 H new ATOM 0 HG SER A 107 31.021 46.189 -47.015 1.00 35.01 H new ATOM 1593 N THR A 108 30.719 50.224 -44.634 1.00 61.34 N ATOM 1594 CA THR A 108 29.810 51.327 -44.882 1.00 45.01 C ATOM 1595 C THR A 108 29.617 51.510 -46.383 1.00 51.14 C ATOM 1596 O THR A 108 30.435 52.142 -47.054 1.00 24.12 O ATOM 1597 CB THR A 108 30.347 52.629 -44.262 1.00 51.54 C ATOM 1598 OG1 THR A 108 30.799 52.375 -42.925 1.00 42.23 O ATOM 1599 CG2 THR A 108 29.271 53.707 -44.243 1.00 12.31 C ATOM 0 H THR A 108 31.705 50.486 -44.630 1.00 61.34 H new ATOM 0 HA THR A 108 28.851 51.095 -44.418 1.00 45.01 H new ATOM 0 HB THR A 108 31.179 52.984 -44.871 1.00 51.54 H new ATOM 0 HG1 THR A 108 31.766 52.217 -42.931 1.00 42.23 H new ATOM 0 HG21 THR A 108 29.676 54.617 -43.800 1.00 12.31 H new ATOM 0 HG22 THR A 108 28.945 53.913 -45.262 1.00 12.31 H new ATOM 0 HG23 THR A 108 28.422 53.363 -43.653 1.00 12.31 H new ATOM 1607 N ILE A 109 28.550 50.929 -46.910 1.00 13.34 N ATOM 1608 CA ILE A 109 28.307 50.931 -48.345 1.00 55.11 C ATOM 1609 C ILE A 109 27.243 51.952 -48.731 1.00 14.15 C ATOM 1610 O ILE A 109 26.083 51.830 -48.339 1.00 1.14 O ATOM 1611 CB ILE A 109 27.856 49.537 -48.836 1.00 61.20 C ATOM 1612 CG1 ILE A 109 28.893 48.476 -48.456 1.00 73.01 C ATOM 1613 CG2 ILE A 109 27.636 49.550 -50.343 1.00 4.42 C ATOM 1614 CD1 ILE A 109 28.486 47.065 -48.822 1.00 12.41 C ATOM 0 H ILE A 109 27.836 50.448 -46.363 1.00 13.34 H new ATOM 0 HA ILE A 109 29.250 51.199 -48.821 1.00 55.11 H new ATOM 0 HB ILE A 109 26.912 49.288 -48.351 1.00 61.20 H new ATOM 0 HG12 ILE A 109 29.837 48.711 -48.948 1.00 73.01 H new ATOM 0 HG13 ILE A 109 29.073 48.525 -47.382 1.00 73.01 H new ATOM 0 HG21 ILE A 109 27.319 48.561 -50.673 1.00 4.42 H new ATOM 0 HG22 ILE A 109 26.866 50.280 -50.592 1.00 4.42 H new ATOM 0 HG23 ILE A 109 28.566 49.819 -50.844 1.00 4.42 H new ATOM 0 HD11 ILE A 109 29.271 46.371 -48.522 1.00 12.41 H new ATOM 0 HD12 ILE A 109 27.559 46.809 -48.309 1.00 12.41 H new ATOM 0 HD13 ILE A 109 28.335 46.998 -49.899 1.00 12.41 H new ATOM 1626 N GLN A 110 27.651 52.968 -49.479 1.00 42.43 N ATOM 1627 CA GLN A 110 26.716 53.916 -50.057 1.00 3.53 C ATOM 1628 C GLN A 110 26.379 53.492 -51.484 1.00 10.22 C ATOM 1629 O GLN A 110 27.270 53.348 -52.326 1.00 61.10 O ATOM 1630 CB GLN A 110 27.298 55.331 -50.036 1.00 51.25 C ATOM 1631 CG GLN A 110 27.548 55.863 -48.634 1.00 2.41 C ATOM 1632 CD GLN A 110 27.885 57.341 -48.615 1.00 4.14 C ATOM 1633 OE1 GLN A 110 26.995 58.182 -48.542 1.00 23.33 O ATOM 1634 NE2 GLN A 110 29.165 57.673 -48.674 1.00 32.10 N ATOM 0 H GLN A 110 28.629 53.155 -49.699 1.00 42.43 H new ATOM 0 HA GLN A 110 25.802 53.923 -49.462 1.00 3.53 H new ATOM 0 HB2 GLN A 110 28.236 55.338 -50.591 1.00 51.25 H new ATOM 0 HB3 GLN A 110 26.615 56.004 -50.555 1.00 51.25 H new ATOM 0 HG2 GLN A 110 26.663 55.689 -48.022 1.00 2.41 H new ATOM 0 HG3 GLN A 110 28.365 55.303 -48.179 1.00 2.41 H new ATOM 0 HE21 GLN A 110 29.878 56.946 -48.734 1.00 32.10 H new ATOM 0 HE22 GLN A 110 29.438 58.656 -48.659 1.00 32.10 H new ATOM 1643 N VAL A 111 25.098 53.261 -51.741 1.00 22.34 N ATOM 1644 CA VAL A 111 24.648 52.760 -53.039 1.00 74.24 C ATOM 1645 C VAL A 111 24.891 53.774 -54.159 1.00 21.00 C ATOM 1646 O VAL A 111 24.437 54.920 -54.093 1.00 75.11 O ATOM 1647 CB VAL A 111 23.152 52.369 -53.001 1.00 73.33 C ATOM 1648 CG1 VAL A 111 22.669 51.921 -54.370 1.00 13.23 C ATOM 1649 CG2 VAL A 111 22.917 51.272 -51.974 1.00 44.35 C ATOM 0 H VAL A 111 24.348 53.412 -51.067 1.00 22.34 H new ATOM 0 HA VAL A 111 25.240 51.870 -53.252 1.00 74.24 H new ATOM 0 HB VAL A 111 22.580 53.251 -52.712 1.00 73.33 H new ATOM 0 HG11 VAL A 111 21.614 51.652 -54.314 1.00 13.23 H new ATOM 0 HG12 VAL A 111 22.799 52.733 -55.085 1.00 13.23 H new ATOM 0 HG13 VAL A 111 23.247 51.056 -54.695 1.00 13.23 H new ATOM 0 HG21 VAL A 111 21.860 51.008 -51.959 1.00 44.35 H new ATOM 0 HG22 VAL A 111 23.507 50.394 -52.238 1.00 44.35 H new ATOM 0 HG23 VAL A 111 23.216 51.627 -50.988 1.00 44.35 H new ATOM 1659 N SER A 112 25.605 53.331 -55.185 1.00 13.43 N ATOM 1660 CA SER A 112 25.922 54.164 -56.334 1.00 25.44 C ATOM 1661 C SER A 112 24.880 53.967 -57.436 1.00 41.43 C ATOM 1662 O SER A 112 23.879 53.278 -57.234 1.00 54.32 O ATOM 1663 CB SER A 112 27.314 53.804 -56.851 1.00 73.52 C ATOM 1664 OG SER A 112 28.263 53.807 -55.798 1.00 50.04 O ATOM 0 H SER A 112 25.980 52.384 -55.243 1.00 13.43 H new ATOM 0 HA SER A 112 25.909 55.212 -56.034 1.00 25.44 H new ATOM 0 HB2 SER A 112 27.289 52.820 -57.320 1.00 73.52 H new ATOM 0 HB3 SER A 112 27.616 54.516 -57.619 1.00 73.52 H new ATOM 0 HG SER A 112 29.146 53.572 -56.153 1.00 50.04 H new ATOM 1670 N GLY A 113 25.106 54.578 -58.593 1.00 3.12 N ATOM 1671 CA GLY A 113 24.209 54.375 -59.711 1.00 51.54 C ATOM 1672 C GLY A 113 24.923 53.789 -60.909 1.00 51.43 C ATOM 1673 O GLY A 113 25.998 53.205 -60.766 1.00 53.21 O ATOM 0 H GLY A 113 25.889 55.206 -58.775 1.00 3.12 H new ATOM 0 HA2 GLY A 113 23.399 53.710 -59.410 1.00 51.54 H new ATOM 0 HA3 GLY A 113 23.754 55.326 -59.989 1.00 51.54 H new ATOM 1677 N LEU A 114 24.347 53.970 -62.092 1.00 24.32 N ATOM 1678 CA LEU A 114 24.939 53.451 -63.322 1.00 41.32 C ATOM 1679 C LEU A 114 24.692 54.395 -64.489 1.00 21.34 C ATOM 1680 O LEU A 114 25.635 54.940 -65.061 1.00 34.33 O ATOM 1681 CB LEU A 114 24.371 52.065 -63.657 1.00 64.43 C ATOM 1682 CG LEU A 114 24.833 50.923 -62.747 1.00 3.52 C ATOM 1683 CD1 LEU A 114 24.106 49.635 -63.102 1.00 71.24 C ATOM 1684 CD2 LEU A 114 26.337 50.725 -62.862 1.00 25.04 C ATOM 0 H LEU A 114 23.470 54.473 -62.227 1.00 24.32 H new ATOM 0 HA LEU A 114 26.013 53.367 -63.158 1.00 41.32 H new ATOM 0 HB2 LEU A 114 23.283 52.119 -63.618 1.00 64.43 H new ATOM 0 HB3 LEU A 114 24.642 51.820 -64.684 1.00 64.43 H new ATOM 0 HG LEU A 114 24.595 51.187 -61.717 1.00 3.52 H new ATOM 0 HD11 LEU A 114 24.445 48.833 -62.446 1.00 71.24 H new ATOM 0 HD12 LEU A 114 23.033 49.777 -62.976 1.00 71.24 H new ATOM 0 HD13 LEU A 114 24.318 49.371 -64.138 1.00 71.24 H new ATOM 0 HD21 LEU A 114 26.648 49.910 -62.209 1.00 25.04 H new ATOM 0 HD22 LEU A 114 26.594 50.482 -63.893 1.00 25.04 H new ATOM 0 HD23 LEU A 114 26.848 51.641 -62.567 1.00 25.04 H new ATOM 1696 N GLN A 115 23.415 54.593 -64.815 1.00 45.34 N ATOM 1697 CA GLN A 115 23.011 55.375 -65.982 1.00 40.42 C ATOM 1698 C GLN A 115 23.527 54.704 -67.254 1.00 4.04 C ATOM 1699 O GLN A 115 24.622 55.004 -67.732 1.00 53.53 O ATOM 1700 CB GLN A 115 23.516 56.826 -65.878 1.00 34.14 C ATOM 1701 CG GLN A 115 22.795 57.826 -66.778 1.00 25.34 C ATOM 1702 CD GLN A 115 23.106 57.648 -68.253 1.00 62.34 C ATOM 1703 OE1 GLN A 115 22.399 56.936 -68.968 1.00 30.31 O ATOM 1704 NE2 GLN A 115 24.169 58.286 -68.717 1.00 61.02 N ATOM 0 H GLN A 115 22.633 54.217 -64.279 1.00 45.34 H new ATOM 0 HA GLN A 115 21.922 55.412 -66.021 1.00 40.42 H new ATOM 0 HB2 GLN A 115 23.419 57.155 -64.843 1.00 34.14 H new ATOM 0 HB3 GLN A 115 24.579 56.843 -66.120 1.00 34.14 H new ATOM 0 HG2 GLN A 115 21.720 57.729 -66.627 1.00 25.34 H new ATOM 0 HG3 GLN A 115 23.069 58.837 -66.477 1.00 25.34 H new ATOM 0 HE21 GLN A 115 24.729 58.866 -68.092 1.00 61.02 H new ATOM 0 HE22 GLN A 115 24.428 58.197 -69.699 1.00 61.02 H new ATOM 1713 N ASN A 116 22.744 53.764 -67.769 1.00 43.54 N ATOM 1714 CA ASN A 116 23.109 53.036 -68.978 1.00 10.42 C ATOM 1715 C ASN A 116 21.931 52.201 -69.457 1.00 30.14 C ATOM 1716 O ASN A 116 21.672 51.113 -68.939 1.00 42.14 O ATOM 1717 CB ASN A 116 24.323 52.132 -68.728 1.00 13.45 C ATOM 1718 CG ASN A 116 24.924 51.567 -70.006 1.00 41.32 C ATOM 1719 OD1 ASN A 116 24.231 51.336 -71.000 1.00 22.52 O ATOM 1720 ND2 ASN A 116 26.228 51.341 -69.985 1.00 63.44 N ATOM 0 H ASN A 116 21.849 53.487 -67.366 1.00 43.54 H new ATOM 0 HA ASN A 116 23.374 53.761 -69.747 1.00 10.42 H new ATOM 0 HB2 ASN A 116 25.086 52.699 -68.195 1.00 13.45 H new ATOM 0 HB3 ASN A 116 24.027 51.308 -68.079 1.00 13.45 H new ATOM 0 HD21 ASN A 116 26.693 50.963 -70.810 1.00 63.44 H new ATOM 0 HD22 ASN A 116 26.767 51.545 -69.144 1.00 63.44 H new ATOM 1727 N ASN A 117 21.208 52.723 -70.432 1.00 33.24 N ATOM 1728 CA ASN A 117 20.061 52.022 -70.990 1.00 2.33 C ATOM 1729 C ASN A 117 20.390 51.427 -72.357 1.00 51.41 C ATOM 1730 O ASN A 117 19.961 50.316 -72.673 1.00 1.42 O ATOM 1731 CB ASN A 117 18.844 52.956 -71.080 1.00 61.13 C ATOM 1732 CG ASN A 117 19.171 54.335 -71.643 1.00 30.42 C ATOM 1733 OD1 ASN A 117 20.086 54.496 -72.452 1.00 34.24 O ATOM 1734 ND2 ASN A 117 18.437 55.343 -71.204 1.00 5.04 N ATOM 0 H ASN A 117 21.394 53.632 -70.856 1.00 33.24 H new ATOM 0 HA ASN A 117 19.812 51.200 -70.319 1.00 2.33 H new ATOM 0 HB2 ASN A 117 18.084 52.489 -71.706 1.00 61.13 H new ATOM 0 HB3 ASN A 117 18.412 53.072 -70.086 1.00 61.13 H new ATOM 0 HD21 ASN A 117 18.621 56.290 -71.535 1.00 5.04 H new ATOM 0 HD22 ASN A 117 17.687 55.174 -70.534 1.00 5.04 H new ATOM 1741 N SER A 118 21.172 52.163 -73.145 1.00 14.15 N ATOM 1742 CA SER A 118 21.548 51.750 -74.495 1.00 75.22 C ATOM 1743 C SER A 118 20.309 51.624 -75.383 1.00 42.11 C ATOM 1744 O SER A 118 19.662 50.576 -75.432 1.00 3.43 O ATOM 1745 CB SER A 118 22.337 50.434 -74.475 1.00 22.31 C ATOM 1746 OG SER A 118 23.516 50.560 -73.696 1.00 43.44 O ATOM 0 H SER A 118 21.563 53.063 -72.865 1.00 14.15 H new ATOM 0 HA SER A 118 22.196 52.520 -74.913 1.00 75.22 H new ATOM 0 HB2 SER A 118 21.713 49.638 -74.070 1.00 22.31 H new ATOM 0 HB3 SER A 118 22.599 50.147 -75.494 1.00 22.31 H new ATOM 0 HG SER A 118 23.278 50.822 -72.782 1.00 43.44 H new ATOM 1752 N THR A 119 19.973 52.709 -76.066 1.00 1.13 N ATOM 1753 CA THR A 119 18.806 52.740 -76.929 1.00 11.34 C ATOM 1754 C THR A 119 19.064 52.000 -78.237 1.00 73.20 C ATOM 1755 O THR A 119 19.488 52.587 -79.232 1.00 53.00 O ATOM 1756 CB THR A 119 18.383 54.191 -77.215 1.00 14.15 C ATOM 1757 OG1 THR A 119 19.550 55.006 -77.405 1.00 61.21 O ATOM 1758 CG2 THR A 119 17.554 54.746 -76.069 1.00 31.13 C ATOM 0 H THR A 119 20.497 53.583 -76.037 1.00 1.13 H new ATOM 0 HA THR A 119 17.995 52.233 -76.407 1.00 11.34 H new ATOM 0 HB THR A 119 17.776 54.203 -78.120 1.00 14.15 H new ATOM 0 HG1 THR A 119 20.114 54.612 -78.103 1.00 61.21 H new ATOM 0 HG21 THR A 119 17.266 55.773 -76.293 1.00 31.13 H new ATOM 0 HG22 THR A 119 16.659 54.138 -75.940 1.00 31.13 H new ATOM 0 HG23 THR A 119 18.142 54.726 -75.151 1.00 31.13 H new ATOM 1766 N ASP A 120 18.834 50.698 -78.214 1.00 14.24 N ATOM 1767 CA ASP A 120 19.063 49.854 -79.376 1.00 62.41 C ATOM 1768 C ASP A 120 17.740 49.549 -80.076 1.00 11.22 C ATOM 1769 O ASP A 120 17.452 50.098 -81.142 1.00 34.13 O ATOM 1770 CB ASP A 120 19.761 48.562 -78.950 1.00 21.11 C ATOM 1771 CG ASP A 120 20.060 47.651 -80.117 1.00 5.01 C ATOM 1772 OD1 ASP A 120 20.981 47.958 -80.899 1.00 42.22 O ATOM 1773 OD2 ASP A 120 19.376 46.619 -80.259 1.00 22.14 O1- ATOM 0 H ASP A 120 18.486 50.198 -77.396 1.00 14.24 H new ATOM 0 HA ASP A 120 19.707 50.381 -80.080 1.00 62.41 H new ATOM 0 HB2 ASP A 120 20.691 48.808 -78.438 1.00 21.11 H new ATOM 0 HB3 ASP A 120 19.133 48.033 -78.233 1.00 21.11 H new ATOM 1778 N PHE A 121 16.939 48.687 -79.447 1.00 13.21 N ATOM 1779 CA PHE A 121 15.588 48.351 -79.913 1.00 25.12 C ATOM 1780 C PHE A 121 15.595 47.636 -81.268 1.00 43.12 C ATOM 1781 O PHE A 121 15.544 46.407 -81.318 1.00 24.43 O ATOM 1782 CB PHE A 121 14.700 49.601 -79.986 1.00 11.52 C ATOM 1783 CG PHE A 121 14.619 50.360 -78.692 1.00 23.13 C ATOM 1784 CD1 PHE A 121 14.106 49.761 -77.552 1.00 75.24 C ATOM 1785 CD2 PHE A 121 15.054 51.672 -78.620 1.00 41.35 C ATOM 1786 CE1 PHE A 121 14.032 50.461 -76.362 1.00 60.15 C ATOM 1787 CE2 PHE A 121 14.982 52.375 -77.434 1.00 43.42 C ATOM 1788 CZ PHE A 121 14.471 51.770 -76.302 1.00 30.42 C ATOM 0 H PHE A 121 17.209 48.198 -78.594 1.00 13.21 H new ATOM 0 HA PHE A 121 15.174 47.661 -79.178 1.00 25.12 H new ATOM 0 HB2 PHE A 121 15.083 50.263 -80.762 1.00 11.52 H new ATOM 0 HB3 PHE A 121 13.695 49.305 -80.287 1.00 11.52 H new ATOM 0 HD1 PHE A 121 13.761 48.738 -77.594 1.00 75.24 H new ATOM 0 HD2 PHE A 121 15.454 52.151 -79.501 1.00 41.35 H new ATOM 0 HE1 PHE A 121 13.631 49.985 -75.479 1.00 60.15 H new ATOM 0 HE2 PHE A 121 15.325 53.398 -77.391 1.00 43.42 H new ATOM 0 HZ PHE A 121 14.415 52.318 -75.373 1.00 30.42 H new ATOM 1798 N HIS A 122 15.677 48.418 -82.351 1.00 74.33 N ATOM 1799 CA HIS A 122 15.565 47.909 -83.726 1.00 33.51 C ATOM 1800 C HIS A 122 14.167 47.372 -84.008 1.00 61.51 C ATOM 1801 O HIS A 122 13.813 46.272 -83.586 1.00 44.21 O ATOM 1802 CB HIS A 122 16.598 46.816 -84.031 1.00 14.54 C ATOM 1803 CG HIS A 122 18.007 47.307 -84.091 1.00 14.41 C ATOM 1804 ND1 HIS A 122 18.588 47.790 -85.241 1.00 72.31 N ATOM 1805 CD2 HIS A 122 18.953 47.384 -83.135 1.00 55.51 C ATOM 1806 CE1 HIS A 122 19.835 48.140 -84.986 1.00 74.34 C ATOM 1807 NE2 HIS A 122 20.082 47.905 -83.713 1.00 72.12 N ATOM 0 H HIS A 122 15.824 49.426 -82.300 1.00 74.33 H new ATOM 0 HA HIS A 122 15.764 48.759 -84.378 1.00 33.51 H new ATOM 0 HB2 HIS A 122 16.527 46.041 -83.268 1.00 14.54 H new ATOM 0 HB3 HIS A 122 16.347 46.349 -84.983 1.00 14.54 H new ATOM 0 HD2 HIS A 122 18.842 47.089 -82.102 1.00 55.51 H new ATOM 0 HE1 HIS A 122 20.534 48.550 -85.700 1.00 74.34 H new ATOM 0 HE2 HIS A 122 20.966 48.081 -83.237 1.00 72.12 H new ATOM 1816 N HIS A 123 13.370 48.152 -84.718 1.00 41.22 N ATOM 1817 CA HIS A 123 12.063 47.689 -85.155 1.00 40.20 C ATOM 1818 C HIS A 123 12.216 46.870 -86.421 1.00 14.21 C ATOM 1819 O HIS A 123 12.220 47.408 -87.530 1.00 55.44 O ATOM 1820 CB HIS A 123 11.100 48.858 -85.390 1.00 64.15 C ATOM 1821 CG HIS A 123 10.679 49.549 -84.132 1.00 33.35 C ATOM 1822 ND1 HIS A 123 11.302 50.678 -83.651 1.00 51.31 N ATOM 1823 CD2 HIS A 123 9.692 49.264 -83.254 1.00 23.32 C ATOM 1824 CE1 HIS A 123 10.719 51.055 -82.531 1.00 62.03 C ATOM 1825 NE2 HIS A 123 9.736 50.217 -82.268 1.00 11.12 N ATOM 0 H HIS A 123 13.602 49.103 -85.003 1.00 41.22 H new ATOM 0 HA HIS A 123 11.637 47.069 -84.366 1.00 40.20 H new ATOM 0 HB2 HIS A 123 11.576 49.583 -86.051 1.00 64.15 H new ATOM 0 HB3 HIS A 123 10.214 48.490 -85.906 1.00 64.15 H new ATOM 0 HD2 HIS A 123 8.998 48.439 -83.317 1.00 23.32 H new ATOM 0 HE1 HIS A 123 10.999 51.907 -81.930 1.00 62.03 H new ATOM 0 HE2 HIS A 123 9.111 50.269 -81.464 1.00 11.12 H new ATOM 1834 N HIS A 124 12.375 45.572 -86.247 1.00 75.21 N ATOM 1835 CA HIS A 124 12.607 44.685 -87.370 1.00 61.31 C ATOM 1836 C HIS A 124 11.323 43.976 -87.765 1.00 45.43 C ATOM 1837 O HIS A 124 10.690 43.301 -86.952 1.00 72.22 O ATOM 1838 CB HIS A 124 13.728 43.672 -87.075 1.00 55.11 C ATOM 1839 CG HIS A 124 13.531 42.842 -85.837 1.00 30.43 C ATOM 1840 ND1 HIS A 124 12.961 41.588 -85.849 1.00 72.32 N ATOM 1841 CD2 HIS A 124 13.861 43.089 -84.548 1.00 11.23 C ATOM 1842 CE1 HIS A 124 12.954 41.099 -84.621 1.00 60.11 C ATOM 1843 NE2 HIS A 124 13.496 41.989 -83.811 1.00 42.31 N ATOM 0 H HIS A 124 12.348 45.109 -85.339 1.00 75.21 H new ATOM 0 HA HIS A 124 12.937 45.296 -88.211 1.00 61.31 H new ATOM 0 HB2 HIS A 124 13.825 43.003 -87.930 1.00 55.11 H new ATOM 0 HB3 HIS A 124 14.670 44.213 -86.984 1.00 55.11 H new ATOM 0 HD2 HIS A 124 14.326 43.987 -84.168 1.00 11.23 H new ATOM 0 HE1 HIS A 124 12.569 40.133 -84.329 1.00 60.11 H new ATOM 0 HE2 HIS A 124 13.623 41.878 -82.805 1.00 42.31 H new ATOM 1852 N HIS A 125 10.934 44.167 -89.009 1.00 33.11 N ATOM 1853 CA HIS A 125 9.745 43.543 -89.555 1.00 42.42 C ATOM 1854 C HIS A 125 10.163 42.659 -90.717 1.00 12.25 C ATOM 1855 O HIS A 125 11.270 42.819 -91.220 1.00 65.23 O ATOM 1856 CB HIS A 125 8.760 44.624 -90.010 1.00 11.44 C ATOM 1857 CG HIS A 125 7.363 44.141 -90.238 1.00 60.43 C ATOM 1858 ND1 HIS A 125 6.603 43.560 -89.249 1.00 71.41 N ATOM 1859 CD2 HIS A 125 6.582 44.175 -91.341 1.00 3.32 C ATOM 1860 CE1 HIS A 125 5.415 43.259 -89.731 1.00 54.41 C ATOM 1861 NE2 HIS A 125 5.377 43.623 -90.996 1.00 54.24 N ATOM 0 H HIS A 125 11.434 44.760 -89.671 1.00 33.11 H new ATOM 0 HA HIS A 125 9.247 42.933 -88.801 1.00 42.42 H new ATOM 0 HB2 HIS A 125 8.739 45.415 -89.261 1.00 11.44 H new ATOM 0 HB3 HIS A 125 9.131 45.069 -90.933 1.00 11.44 H new ATOM 0 HD2 HIS A 125 6.856 44.564 -92.311 1.00 3.32 H new ATOM 0 HE1 HIS A 125 4.610 42.793 -89.183 1.00 54.41 H new ATOM 0 HE2 HIS A 125 4.578 43.512 -91.620 1.00 54.24 H new ATOM 1870 N HIS A 126 9.296 41.729 -91.108 1.00 22.41 N ATOM 1871 CA HIS A 126 9.560 40.754 -92.178 1.00 73.13 C ATOM 1872 C HIS A 126 10.787 39.892 -91.865 1.00 14.44 C ATOM 1873 O HIS A 126 11.513 40.132 -90.896 1.00 61.23 O ATOM 1874 CB HIS A 126 9.672 41.416 -93.581 1.00 23.41 C ATOM 1875 CG HIS A 126 11.019 41.985 -93.969 1.00 43.53 C ATOM 1876 ND1 HIS A 126 12.067 41.211 -94.429 1.00 63.22 N ATOM 1877 CD2 HIS A 126 11.472 43.263 -93.989 1.00 54.42 C ATOM 1878 CE1 HIS A 126 13.096 41.988 -94.708 1.00 42.22 C ATOM 1879 NE2 HIS A 126 12.765 43.235 -94.452 1.00 15.42 N ATOM 0 H HIS A 126 8.373 41.625 -90.687 1.00 22.41 H new ATOM 0 HA HIS A 126 8.692 40.096 -92.215 1.00 73.13 H new ATOM 0 HB2 HIS A 126 9.390 40.674 -94.328 1.00 23.41 H new ATOM 0 HB3 HIS A 126 8.937 42.219 -93.636 1.00 23.41 H new ATOM 0 HD2 HIS A 126 10.918 44.142 -93.695 1.00 54.42 H new ATOM 0 HE1 HIS A 126 14.052 41.655 -95.084 1.00 42.22 H new ATOM 0 HE2 HIS A 126 13.369 44.047 -94.577 1.00 15.42 H new ATOM 1888 N HIS A 127 10.992 38.855 -92.659 1.00 12.35 N ATOM 1889 CA HIS A 127 12.142 37.990 -92.481 1.00 31.34 C ATOM 1890 C HIS A 127 12.984 37.972 -93.747 1.00 12.31 C ATOM 1891 O HIS A 127 13.846 38.858 -93.891 1.00 54.42 O ATOM 1892 CB HIS A 127 11.699 36.572 -92.111 1.00 12.42 C ATOM 1893 CG HIS A 127 12.834 35.666 -91.743 1.00 22.42 C ATOM 1894 ND1 HIS A 127 13.258 34.627 -92.540 1.00 5.05 N ATOM 1895 CD2 HIS A 127 13.629 35.646 -90.650 1.00 4.12 C ATOM 1896 CE1 HIS A 127 14.262 34.005 -91.953 1.00 42.13 C ATOM 1897 NE2 HIS A 127 14.508 34.605 -90.806 1.00 54.43 N ATOM 1898 OXT HIS A 127 12.770 37.084 -94.598 1.00 0.00 O1- ATOM 0 H HIS A 127 10.378 38.593 -93.431 1.00 12.35 H new ATOM 0 HA HIS A 127 12.748 38.381 -91.664 1.00 31.34 H new ATOM 0 HB2 HIS A 127 11.001 36.625 -91.275 1.00 12.42 H new ATOM 0 HB3 HIS A 127 11.157 36.139 -92.952 1.00 12.42 H new ATOM 0 HD2 HIS A 127 13.581 36.324 -89.810 1.00 4.12 H new ATOM 0 HE1 HIS A 127 14.792 33.150 -92.345 1.00 42.13 H new ATOM 0 HE2 HIS A 127 15.235 34.338 -90.142 1.00 54.43 H new TER 1907 HIS A 127