USER MOD reduce.3.24.130724 H: found=0, std=0, add=1309, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1309 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 138 GLN : amide:sc= 0.0779 K(o=0.74,f=0.11) USER MOD Set 1.2: A 140 LYS NZ :NH3+ -150:sc= 0.661 (180deg=-1.1) USER MOD Set 2.1: A 126 SER OG : rot -167:sc= 0.405 USER MOD Set 2.2: A 131 SER OG : rot 180:sc= 0.376 USER MOD Set 3.1: A 105 GLN :FLIP amide:sc= -0.0297 F(o=-1.2,f=0.012) USER MOD Set 3.2: A 112 GLN : amide:sc= 0.0419 K(o=0.012,f=-1.2) USER MOD Set 4.1: A 107 THR OG1 : rot 180:sc= 0.312 USER MOD Set 4.2: A 110 ASN : amide:sc= -0.792 X(o=-0.48,f=0.006) USER MOD Set 5.1: A 103 GLN : amide:sc= -0.192 K(o=0.79,f=-1.5) USER MOD Set 5.2: A 115 ASN : amide:sc= 0.979 K(o=0.79,f=-1.5) USER MOD Set 6.1: A 70 ASN :FLIP amide:sc= -0.0617 F(o=-3!,f=-0.1) USER MOD Set 6.2: A 81 THR OG1 : rot 180:sc= -0.0386 USER MOD Set 7.1: A 34 GLN : amide:sc= 0.634 K(o=0.15,f=-3.6!) USER MOD Set 7.2: A 53 THR OG1 : rot 149:sc= -0.481 USER MOD Single : A 1 MET CE :methyl 145:sc= -0.174 (180deg=-0.77) USER MOD Single : A 1 MET N :NH3+ -125:sc= 0.0758 (180deg=-0.111) USER MOD Single : A 3 GLN : amide:sc= -0.661 X(o=-0.66,f=-0.51) USER MOD Single : A 4 GLN : amide:sc= -0.397 K(o=-0.4,f=-1.2) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ -175:sc= 0.959 (180deg=0.943) USER MOD Single : A 12 HIS : no HD1:sc= -0.0836 K(o=-0.084,f=-0.64) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.141 USER MOD Single : A 16 THR OG1 : rot 180:sc=-0.00267 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 19 GLN : amide:sc= -0.0307 K(o=-0.031,f=-0.54) USER MOD Single : A 21 MET CE :methyl 164:sc= -0.0993 (180deg=-0.505) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0.0607 USER MOD Single : A 23 GLN :FLIP amide:sc= -0.126 F(o=-0.82,f=-0.13) USER MOD Single : A 25 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 26 GLN : amide:sc= -0.23 X(o=-0.23,f=-0.17) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.812 USER MOD Single : A 30 LYS NZ :NH3+ -138:sc= 0.89 (180deg=0.0375) USER MOD Single : A 32 THR OG1 : rot 72:sc= 0.612 USER MOD Single : A 33 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 35 ASN : amide:sc= 1.09 K(o=1.1,f=-0.07) USER MOD Single : A 38 ASN :FLIP amide:sc= -0.113 F(o=-2.8!,f=-0.11) USER MOD Single : A 40 LYS NZ :NH3+ -125:sc= 1.17 (180deg=-0.436) USER MOD Single : A 41 SER OG : rot -145:sc= 0.95 USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 165:sc= 0.789 (180deg=0.432) USER MOD Single : A 59 SER OG : rot -38:sc= 0.45 USER MOD Single : A 60 GLN : amide:sc= 0.775 K(o=0.78,f=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 MET CE :methyl -159:sc= 0 (180deg=-0.573) USER MOD Single : A 67 SER OG : rot 180:sc= -0.955 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 78:sc= 0.107 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 GLN :FLIP amide:sc= -1.83 F(o=-2.8!,f=-1.8) USER MOD Single : A 88 SER OG : rot 131:sc= 0.0569 USER MOD Single : A 89 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 98 THR OG1 : rot 180:sc= -0.128 USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 GLN : amide:sc= -1.1 X(o=-1.1,f=-0.6) USER MOD Single : A 118 ASN : amide:sc= -0.0652 X(o=-0.065,f=-0.055) USER MOD Single : A 119 GLN :FLIP amide:sc= 0.0331 F(o=-0.59,f=0.033) USER MOD Single : A 122 ASN :FLIP amide:sc= -0.0287 F(o=-1,f=-0.029) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 146 GLN : amide:sc= 0.267 X(o=0.27,f=-0.0087) USER MOD Single : A 153 HIS : no HD1:sc= 0.0168 K(o=0.017,f=-4!) USER MOD Single : A 156 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 159 MET CE :methyl 165:sc= -0.0913 (180deg=-0.408) USER MOD Single : A 160 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 163 HIS : no HD1:sc=-0.00578 X(o=-0.0058,f=-0.0058) USER MOD Single : A 164 HIS : no HD1:sc=-0.00222 X(o=-0.0022,f=-0.0046) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.311 X(o=-0.31,f=-0.76) USER MOD Single : A 167 HIS : no HE2:sc= -0.139 K(o=-0.14,f=-2.8) USER MOD Single : A 168 HIS : no HE2:sc= -0.901 K(o=-0.9,f=-2.7!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 3.233 7.932 -50.430 1.00 74.02 N ATOM 2 CA MET A 1 4.108 6.725 -50.474 1.00 55.12 C ATOM 3 C MET A 1 3.346 5.473 -50.026 1.00 54.45 C ATOM 4 O MET A 1 2.164 5.538 -49.697 1.00 11.12 O ATOM 5 CB MET A 1 5.330 6.912 -49.563 1.00 62.43 C ATOM 6 CG MET A 1 6.254 8.047 -49.971 1.00 34.21 C ATOM 7 SD MET A 1 7.623 8.257 -48.813 1.00 64.23 S ATOM 8 CE MET A 1 8.408 6.647 -48.916 1.00 25.23 C ATOM 0 H1 MET A 1 3.232 8.394 -51.362 1.00 74.02 H new ATOM 0 H2 MET A 1 2.263 7.649 -50.183 1.00 74.02 H new ATOM 0 H3 MET A 1 3.593 8.596 -49.715 1.00 74.02 H new ATOM 0 HA MET A 1 4.433 6.596 -51.506 1.00 55.12 H new ATOM 0 HB2 MET A 1 4.984 7.090 -48.545 1.00 62.43 H new ATOM 0 HB3 MET A 1 5.901 5.984 -49.548 1.00 62.43 H new ATOM 0 HG2 MET A 1 6.649 7.852 -50.968 1.00 34.21 H new ATOM 0 HG3 MET A 1 5.684 8.974 -50.030 1.00 34.21 H new ATOM 0 HE1 MET A 1 9.487 6.761 -48.817 1.00 25.23 H new ATOM 0 HE2 MET A 1 8.035 6.009 -48.115 1.00 25.23 H new ATOM 0 HE3 MET A 1 8.179 6.191 -49.879 1.00 25.23 H new ATOM 20 N VAL A 2 4.037 4.334 -50.012 1.00 40.42 N ATOM 21 CA VAL A 2 3.466 3.087 -49.493 1.00 64.24 C ATOM 22 C VAL A 2 3.836 2.892 -48.015 1.00 5.42 C ATOM 23 O VAL A 2 4.981 2.586 -47.688 1.00 22.31 O ATOM 24 CB VAL A 2 3.954 1.860 -50.308 1.00 60.33 C ATOM 25 CG1 VAL A 2 3.338 0.564 -49.778 1.00 20.14 C ATOM 26 CG2 VAL A 2 3.642 2.044 -51.790 1.00 22.34 C ATOM 0 H VAL A 2 4.994 4.247 -50.354 1.00 40.42 H new ATOM 0 HA VAL A 2 2.383 3.164 -49.588 1.00 64.24 H new ATOM 0 HB VAL A 2 5.035 1.785 -50.191 1.00 60.33 H new ATOM 0 HG11 VAL A 2 3.698 -0.278 -50.369 1.00 20.14 H new ATOM 0 HG12 VAL A 2 3.624 0.425 -48.735 1.00 20.14 H new ATOM 0 HG13 VAL A 2 2.252 0.621 -49.852 1.00 20.14 H new ATOM 0 HG21 VAL A 2 3.991 1.174 -52.346 1.00 22.34 H new ATOM 0 HG22 VAL A 2 2.566 2.153 -51.925 1.00 22.34 H new ATOM 0 HG23 VAL A 2 4.146 2.937 -52.160 1.00 22.34 H new ATOM 36 N GLN A 3 2.868 3.095 -47.127 1.00 3.05 N ATOM 37 CA GLN A 3 3.080 2.915 -45.686 1.00 10.14 C ATOM 38 C GLN A 3 2.348 1.664 -45.178 1.00 72.21 C ATOM 39 O GLN A 3 1.550 1.065 -45.900 1.00 74.41 O ATOM 40 CB GLN A 3 2.588 4.152 -44.916 1.00 14.42 C ATOM 41 CG GLN A 3 3.241 5.463 -45.348 1.00 60.33 C ATOM 42 CD GLN A 3 4.750 5.483 -45.157 1.00 34.35 C ATOM 43 OE1 GLN A 3 5.292 4.816 -44.284 1.00 3.11 O ATOM 44 NE2 GLN A 3 5.435 6.268 -45.964 1.00 71.31 N ATOM 0 H GLN A 3 1.923 3.386 -47.377 1.00 3.05 H new ATOM 0 HA GLN A 3 4.149 2.787 -45.515 1.00 10.14 H new ATOM 0 HB2 GLN A 3 1.509 4.238 -45.042 1.00 14.42 H new ATOM 0 HB3 GLN A 3 2.773 4.001 -43.853 1.00 14.42 H new ATOM 0 HG2 GLN A 3 3.014 5.644 -46.399 1.00 60.33 H new ATOM 0 HG3 GLN A 3 2.800 6.283 -44.781 1.00 60.33 H new ATOM 0 HE21 GLN A 3 4.951 6.810 -46.680 1.00 71.31 H new ATOM 0 HE22 GLN A 3 6.449 6.334 -45.872 1.00 71.31 H new ATOM 53 N GLN A 4 2.616 1.276 -43.934 1.00 3.14 N ATOM 54 CA GLN A 4 1.952 0.113 -43.328 1.00 41.05 C ATOM 55 C GLN A 4 1.895 0.217 -41.795 1.00 1.21 C ATOM 56 O GLN A 4 2.598 1.025 -41.186 1.00 11.20 O ATOM 57 CB GLN A 4 2.643 -1.195 -43.773 1.00 12.53 C ATOM 58 CG GLN A 4 4.162 -1.239 -43.581 1.00 12.54 C ATOM 59 CD GLN A 4 4.590 -1.479 -42.142 1.00 12.52 C ATOM 60 OE1 GLN A 4 4.803 -0.544 -41.375 1.00 63.45 O ATOM 61 NE2 GLN A 4 4.713 -2.735 -41.764 1.00 30.54 N ATOM 0 H GLN A 4 3.285 1.745 -43.323 1.00 3.14 H new ATOM 0 HA GLN A 4 0.921 0.099 -43.683 1.00 41.05 H new ATOM 0 HB2 GLN A 4 2.201 -2.024 -43.221 1.00 12.53 H new ATOM 0 HB3 GLN A 4 2.423 -1.361 -44.828 1.00 12.53 H new ATOM 0 HG2 GLN A 4 4.576 -2.027 -44.210 1.00 12.54 H new ATOM 0 HG3 GLN A 4 4.590 -0.298 -43.926 1.00 12.54 H new ATOM 0 HE21 GLN A 4 4.528 -3.488 -42.427 1.00 30.54 H new ATOM 0 HE22 GLN A 4 4.993 -2.955 -40.808 1.00 30.54 H new ATOM 70 N SER A 5 1.042 -0.598 -41.181 1.00 54.00 N ATOM 71 CA SER A 5 0.906 -0.626 -39.716 1.00 45.30 C ATOM 72 C SER A 5 0.733 -2.062 -39.208 1.00 72.43 C ATOM 73 O SER A 5 -0.058 -2.833 -39.756 1.00 14.30 O ATOM 74 CB SER A 5 -0.289 0.226 -39.271 1.00 22.41 C ATOM 75 OG SER A 5 -0.368 0.303 -37.854 1.00 53.21 O ATOM 0 H SER A 5 0.431 -1.251 -41.671 1.00 54.00 H new ATOM 0 HA SER A 5 1.819 -0.212 -39.289 1.00 45.30 H new ATOM 0 HB2 SER A 5 -0.199 1.229 -39.688 1.00 22.41 H new ATOM 0 HB3 SER A 5 -1.211 -0.201 -39.666 1.00 22.41 H new ATOM 0 HG SER A 5 -1.138 0.853 -37.599 1.00 53.21 H new ATOM 81 N GLU A 6 1.474 -2.418 -38.159 1.00 64.14 N ATOM 82 CA GLU A 6 1.439 -3.777 -37.600 1.00 54.43 C ATOM 83 C GLU A 6 1.398 -3.741 -36.065 1.00 2.54 C ATOM 84 O GLU A 6 1.768 -2.740 -35.449 1.00 33.32 O ATOM 85 CB GLU A 6 2.671 -4.572 -38.065 1.00 43.54 C ATOM 86 CG GLU A 6 2.855 -4.609 -39.579 1.00 15.41 C ATOM 87 CD GLU A 6 4.068 -5.417 -40.004 1.00 21.43 C ATOM 88 OE1 GLU A 6 5.201 -4.902 -39.891 1.00 40.40 O ATOM 89 OE2 GLU A 6 3.893 -6.569 -40.451 1.00 21.51 O ATOM 0 H GLU A 6 2.110 -1.784 -37.675 1.00 64.14 H new ATOM 0 HA GLU A 6 0.534 -4.266 -37.959 1.00 54.43 H new ATOM 0 HB2 GLU A 6 3.562 -4.137 -37.612 1.00 43.54 H new ATOM 0 HB3 GLU A 6 2.591 -5.594 -37.695 1.00 43.54 H new ATOM 0 HG2 GLU A 6 1.962 -5.033 -40.039 1.00 15.41 H new ATOM 0 HG3 GLU A 6 2.953 -3.590 -39.954 1.00 15.41 H new ATOM 96 N VAL A 7 0.949 -4.836 -35.453 1.00 52.21 N ATOM 97 CA VAL A 7 0.893 -4.939 -33.988 1.00 71.35 C ATOM 98 C VAL A 7 1.985 -5.878 -33.442 1.00 60.22 C ATOM 99 O VAL A 7 2.110 -7.032 -33.867 1.00 72.54 O ATOM 100 CB VAL A 7 -0.506 -5.408 -33.500 1.00 54.24 C ATOM 101 CG1 VAL A 7 -0.876 -6.772 -34.084 1.00 3.52 C ATOM 102 CG2 VAL A 7 -0.570 -5.434 -31.972 1.00 11.52 C ATOM 0 H VAL A 7 0.618 -5.666 -35.945 1.00 52.21 H new ATOM 0 HA VAL A 7 1.075 -3.938 -33.597 1.00 71.35 H new ATOM 0 HB VAL A 7 -1.239 -4.686 -33.860 1.00 54.24 H new ATOM 0 HG11 VAL A 7 -1.860 -7.068 -33.721 1.00 3.52 H new ATOM 0 HG12 VAL A 7 -0.894 -6.709 -35.172 1.00 3.52 H new ATOM 0 HG13 VAL A 7 -0.138 -7.512 -33.776 1.00 3.52 H new ATOM 0 HG21 VAL A 7 -1.559 -5.765 -31.655 1.00 11.52 H new ATOM 0 HG22 VAL A 7 0.184 -6.121 -31.588 1.00 11.52 H new ATOM 0 HG23 VAL A 7 -0.380 -4.434 -31.583 1.00 11.52 H new ATOM 112 N ARG A 8 2.789 -5.367 -32.512 1.00 30.04 N ATOM 113 CA ARG A 8 3.846 -6.158 -31.877 1.00 11.42 C ATOM 114 C ARG A 8 3.284 -7.037 -30.744 1.00 50.42 C ATOM 115 O ARG A 8 2.380 -6.623 -30.015 1.00 51.52 O ATOM 116 CB ARG A 8 4.949 -5.230 -31.342 1.00 73.21 C ATOM 117 CG ARG A 8 6.022 -5.947 -30.523 1.00 4.53 C ATOM 118 CD ARG A 8 7.181 -5.023 -30.153 1.00 1.53 C ATOM 119 NE ARG A 8 8.073 -5.635 -29.167 1.00 60.23 N ATOM 120 CZ ARG A 8 9.358 -5.805 -29.327 1.00 34.31 C ATOM 121 NH1 ARG A 8 9.939 -5.512 -30.447 1.00 64.51 N ATOM 122 NH2 ARG A 8 10.065 -6.303 -28.370 1.00 22.55 N ATOM 0 H ARG A 8 2.730 -4.405 -32.179 1.00 30.04 H new ATOM 0 HA ARG A 8 4.273 -6.821 -32.629 1.00 11.42 H new ATOM 0 HB2 ARG A 8 5.425 -4.726 -32.183 1.00 73.21 H new ATOM 0 HB3 ARG A 8 4.491 -4.457 -30.725 1.00 73.21 H new ATOM 0 HG2 ARG A 8 5.575 -6.348 -29.613 1.00 4.53 H new ATOM 0 HG3 ARG A 8 6.403 -6.795 -31.091 1.00 4.53 H new ATOM 0 HD2 ARG A 8 7.748 -4.774 -31.050 1.00 1.53 H new ATOM 0 HD3 ARG A 8 6.787 -4.088 -29.755 1.00 1.53 H new ATOM 0 HE ARG A 8 7.660 -5.952 -28.290 1.00 60.23 H new ATOM 0 HH11 ARG A 8 9.392 -5.141 -31.224 1.00 64.51 H new ATOM 0 HH12 ARG A 8 10.944 -5.652 -30.552 1.00 64.51 H new ATOM 0 HH21 ARG A 8 9.620 -6.563 -27.490 1.00 22.55 H new ATOM 0 HH22 ARG A 8 11.069 -6.436 -28.494 1.00 22.55 H new ATOM 136 N GLN A 9 3.818 -8.254 -30.617 1.00 20.23 N ATOM 137 CA GLN A 9 3.396 -9.188 -29.563 1.00 50.21 C ATOM 138 C GLN A 9 3.553 -8.586 -28.152 1.00 5.41 C ATOM 139 O GLN A 9 4.458 -7.786 -27.894 1.00 22.31 O ATOM 140 CB GLN A 9 4.176 -10.507 -29.668 1.00 64.34 C ATOM 141 CG GLN A 9 5.692 -10.347 -29.612 1.00 11.04 C ATOM 142 CD GLN A 9 6.420 -11.682 -29.613 1.00 62.44 C ATOM 143 OE1 GLN A 9 6.709 -12.247 -28.562 1.00 44.25 O ATOM 144 NE2 GLN A 9 6.706 -12.210 -30.788 1.00 2.45 N ATOM 0 H GLN A 9 4.546 -8.619 -31.231 1.00 20.23 H new ATOM 0 HA GLN A 9 2.335 -9.386 -29.716 1.00 50.21 H new ATOM 0 HB2 GLN A 9 3.862 -11.166 -28.859 1.00 64.34 H new ATOM 0 HB3 GLN A 9 3.909 -11.000 -30.603 1.00 64.34 H new ATOM 0 HG2 GLN A 9 6.023 -9.756 -30.466 1.00 11.04 H new ATOM 0 HG3 GLN A 9 5.962 -9.790 -28.715 1.00 11.04 H new ATOM 0 HE21 GLN A 9 6.453 -11.716 -31.644 1.00 2.45 H new ATOM 0 HE22 GLN A 9 7.180 -13.112 -30.840 1.00 2.45 H new ATOM 153 N MET A 10 2.671 -9.004 -27.244 1.00 35.14 N ATOM 154 CA MET A 10 2.587 -8.436 -25.892 1.00 54.45 C ATOM 155 C MET A 10 3.842 -8.701 -25.040 1.00 51.41 C ATOM 156 O MET A 10 4.733 -9.464 -25.420 1.00 12.42 O ATOM 157 CB MET A 10 1.352 -8.996 -25.171 1.00 34.10 C ATOM 158 CG MET A 10 0.036 -8.703 -25.883 1.00 22.04 C ATOM 159 SD MET A 10 -0.093 -9.526 -27.487 1.00 72.15 S ATOM 160 CE MET A 10 -1.665 -8.893 -28.070 1.00 31.30 C ATOM 0 H MET A 10 1.993 -9.745 -27.422 1.00 35.14 H new ATOM 0 HA MET A 10 2.507 -7.356 -26.012 1.00 54.45 H new ATOM 0 HB2 MET A 10 1.464 -10.075 -25.064 1.00 34.10 H new ATOM 0 HB3 MET A 10 1.310 -8.579 -24.165 1.00 34.10 H new ATOM 0 HG2 MET A 10 -0.793 -9.020 -25.250 1.00 22.04 H new ATOM 0 HG3 MET A 10 -0.064 -7.627 -26.023 1.00 22.04 H new ATOM 0 HE1 MET A 10 -1.884 -9.311 -29.052 1.00 31.30 H new ATOM 0 HE2 MET A 10 -2.453 -9.175 -27.371 1.00 31.30 H new ATOM 0 HE3 MET A 10 -1.616 -7.806 -28.141 1.00 31.30 H new ATOM 170 N LYS A 11 3.888 -8.056 -23.875 1.00 72.21 N ATOM 171 CA LYS A 11 4.997 -8.206 -22.930 1.00 41.34 C ATOM 172 C LYS A 11 4.951 -9.573 -22.226 1.00 0.14 C ATOM 173 O LYS A 11 4.245 -9.753 -21.232 1.00 41.10 O ATOM 174 CB LYS A 11 4.955 -7.072 -21.892 1.00 70.35 C ATOM 175 CG LYS A 11 6.051 -7.149 -20.832 1.00 35.34 C ATOM 176 CD LYS A 11 5.939 -6.007 -19.822 1.00 5.20 C ATOM 177 CE LYS A 11 7.007 -6.101 -18.738 1.00 2.52 C ATOM 178 NZ LYS A 11 6.929 -4.966 -17.778 1.00 25.30 N ATOM 0 H LYS A 11 3.160 -7.416 -23.559 1.00 72.21 H new ATOM 0 HA LYS A 11 5.931 -8.150 -23.489 1.00 41.34 H new ATOM 0 HB2 LYS A 11 5.035 -6.117 -22.411 1.00 70.35 H new ATOM 0 HB3 LYS A 11 3.985 -7.085 -21.396 1.00 70.35 H new ATOM 0 HG2 LYS A 11 5.987 -8.104 -20.311 1.00 35.34 H new ATOM 0 HG3 LYS A 11 7.028 -7.114 -21.315 1.00 35.34 H new ATOM 0 HD2 LYS A 11 6.031 -5.053 -20.341 1.00 5.20 H new ATOM 0 HD3 LYS A 11 4.951 -6.025 -19.361 1.00 5.20 H new ATOM 0 HE2 LYS A 11 6.894 -7.041 -18.198 1.00 2.52 H new ATOM 0 HE3 LYS A 11 7.993 -6.117 -19.201 1.00 2.52 H new ATOM 0 HZ1 LYS A 11 7.723 -5.022 -17.109 1.00 25.30 H new ATOM 0 HZ2 LYS A 11 6.978 -4.067 -18.299 1.00 25.30 H new ATOM 0 HZ3 LYS A 11 6.031 -5.015 -17.255 1.00 25.30 H new ATOM 192 N HIS A 12 5.696 -10.533 -22.761 1.00 34.34 N ATOM 193 CA HIS A 12 5.759 -11.881 -22.189 1.00 22.21 C ATOM 194 C HIS A 12 6.464 -11.877 -20.815 1.00 10.53 C ATOM 195 O HIS A 12 7.468 -11.189 -20.626 1.00 44.24 O ATOM 196 CB HIS A 12 6.492 -12.815 -23.161 1.00 1.30 C ATOM 197 CG HIS A 12 6.445 -14.259 -22.768 1.00 24.35 C ATOM 198 ND1 HIS A 12 7.461 -14.892 -22.086 1.00 24.22 N ATOM 199 CD2 HIS A 12 5.498 -15.202 -22.979 1.00 13.44 C ATOM 200 CE1 HIS A 12 7.144 -16.155 -21.897 1.00 3.32 C ATOM 201 NE2 HIS A 12 5.959 -16.371 -22.427 1.00 63.44 N ATOM 0 H HIS A 12 6.269 -10.406 -23.595 1.00 34.34 H new ATOM 0 HA HIS A 12 4.741 -12.239 -22.036 1.00 22.21 H new ATOM 0 HB2 HIS A 12 6.056 -12.705 -24.154 1.00 1.30 H new ATOM 0 HB3 HIS A 12 7.534 -12.502 -23.234 1.00 1.30 H new ATOM 0 HD2 HIS A 12 4.555 -15.061 -23.487 1.00 13.44 H new ATOM 0 HE1 HIS A 12 7.753 -16.890 -21.392 1.00 3.32 H new ATOM 0 HE2 HIS A 12 5.463 -17.263 -22.427 1.00 63.44 H new ATOM 210 N SER A 13 5.932 -12.647 -19.866 1.00 24.30 N ATOM 211 CA SER A 13 6.511 -12.732 -18.514 1.00 73.45 C ATOM 212 C SER A 13 7.855 -13.478 -18.523 1.00 1.00 C ATOM 213 O SER A 13 8.079 -14.375 -19.343 1.00 43.14 O ATOM 214 CB SER A 13 5.541 -13.429 -17.547 1.00 3.44 C ATOM 215 OG SER A 13 5.419 -14.820 -17.825 1.00 22.51 O ATOM 0 H SER A 13 5.101 -13.223 -20.003 1.00 24.30 H new ATOM 0 HA SER A 13 6.685 -11.711 -18.173 1.00 73.45 H new ATOM 0 HB2 SER A 13 5.889 -13.293 -16.523 1.00 3.44 H new ATOM 0 HB3 SER A 13 4.560 -12.958 -17.615 1.00 3.44 H new ATOM 0 HG SER A 13 4.795 -15.227 -17.188 1.00 22.51 H new ATOM 221 N VAL A 14 8.751 -13.109 -17.608 1.00 23.52 N ATOM 222 CA VAL A 14 10.108 -13.679 -17.574 1.00 54.50 C ATOM 223 C VAL A 14 10.489 -14.211 -16.179 1.00 73.14 C ATOM 224 O VAL A 14 9.694 -14.165 -15.237 1.00 32.11 O ATOM 225 CB VAL A 14 11.165 -12.633 -18.022 1.00 3.43 C ATOM 226 CG1 VAL A 14 10.924 -12.196 -19.468 1.00 21.14 C ATOM 227 CG2 VAL A 14 11.167 -11.426 -17.082 1.00 22.34 C ATOM 0 H VAL A 14 8.567 -12.419 -16.879 1.00 23.52 H new ATOM 0 HA VAL A 14 10.101 -14.518 -18.270 1.00 54.50 H new ATOM 0 HB VAL A 14 12.147 -13.104 -17.972 1.00 3.43 H new ATOM 0 HG11 VAL A 14 11.678 -11.463 -19.757 1.00 21.14 H new ATOM 0 HG12 VAL A 14 10.989 -13.063 -20.126 1.00 21.14 H new ATOM 0 HG13 VAL A 14 9.933 -11.750 -19.553 1.00 21.14 H new ATOM 0 HG21 VAL A 14 11.915 -10.707 -17.415 1.00 22.34 H new ATOM 0 HG22 VAL A 14 10.183 -10.957 -17.090 1.00 22.34 H new ATOM 0 HG23 VAL A 14 11.404 -11.754 -16.070 1.00 22.34 H new ATOM 237 N SER A 15 11.718 -14.713 -16.063 1.00 31.22 N ATOM 238 CA SER A 15 12.256 -15.230 -14.795 1.00 72.24 C ATOM 239 C SER A 15 13.683 -14.711 -14.574 1.00 22.23 C ATOM 240 O SER A 15 14.239 -14.022 -15.435 1.00 51.51 O ATOM 241 CB SER A 15 12.251 -16.768 -14.792 1.00 41.20 C ATOM 242 OG SER A 15 12.717 -17.286 -13.552 1.00 73.22 O ATOM 0 H SER A 15 12.373 -14.775 -16.843 1.00 31.22 H new ATOM 0 HA SER A 15 11.620 -14.878 -13.983 1.00 72.24 H new ATOM 0 HB2 SER A 15 11.241 -17.130 -14.983 1.00 41.20 H new ATOM 0 HB3 SER A 15 12.880 -17.137 -15.602 1.00 41.20 H new ATOM 0 HG SER A 15 12.701 -18.265 -13.580 1.00 73.22 H new ATOM 248 N THR A 16 14.281 -15.034 -13.429 1.00 3.33 N ATOM 249 CA THR A 16 15.627 -14.531 -13.099 1.00 41.12 C ATOM 250 C THR A 16 16.321 -15.351 -12.002 1.00 74.44 C ATOM 251 O THR A 16 15.673 -15.915 -11.118 1.00 24.32 O ATOM 252 CB THR A 16 15.579 -13.047 -12.651 1.00 2.34 C ATOM 253 OG1 THR A 16 16.873 -12.615 -12.180 1.00 1.24 O ATOM 254 CG2 THR A 16 14.535 -12.838 -11.559 1.00 23.25 C ATOM 0 H THR A 16 13.866 -15.635 -12.717 1.00 3.33 H new ATOM 0 HA THR A 16 16.206 -14.627 -14.017 1.00 41.12 H new ATOM 0 HB THR A 16 15.299 -12.448 -13.518 1.00 2.34 H new ATOM 0 HG1 THR A 16 16.824 -11.676 -11.903 1.00 1.24 H new ATOM 0 HG21 THR A 16 14.523 -11.789 -11.264 1.00 23.25 H new ATOM 0 HG22 THR A 16 13.552 -13.120 -11.936 1.00 23.25 H new ATOM 0 HG23 THR A 16 14.783 -13.455 -10.695 1.00 23.25 H new ATOM 262 N LEU A 17 17.652 -15.409 -12.074 1.00 14.11 N ATOM 263 CA LEU A 17 18.480 -16.048 -11.040 1.00 32.31 C ATOM 264 C LEU A 17 19.438 -15.013 -10.430 1.00 30.35 C ATOM 265 O LEU A 17 20.305 -14.475 -11.122 1.00 32.54 O ATOM 266 CB LEU A 17 19.282 -17.220 -11.635 1.00 73.10 C ATOM 267 CG LEU A 17 18.442 -18.362 -12.239 1.00 53.13 C ATOM 268 CD1 LEU A 17 19.341 -19.415 -12.880 1.00 13.21 C ATOM 269 CD2 LEU A 17 17.545 -18.993 -11.177 1.00 12.44 C ATOM 0 H LEU A 17 18.189 -15.016 -12.847 1.00 14.11 H new ATOM 0 HA LEU A 17 17.826 -16.438 -10.261 1.00 32.31 H new ATOM 0 HB2 LEU A 17 19.942 -16.829 -12.410 1.00 73.10 H new ATOM 0 HB3 LEU A 17 19.919 -17.635 -10.854 1.00 73.10 H new ATOM 0 HG LEU A 17 17.805 -17.940 -13.016 1.00 53.13 H new ATOM 0 HD11 LEU A 17 18.726 -20.211 -13.300 1.00 13.21 H new ATOM 0 HD12 LEU A 17 19.931 -18.956 -13.673 1.00 13.21 H new ATOM 0 HD13 LEU A 17 20.009 -19.831 -12.126 1.00 13.21 H new ATOM 0 HD21 LEU A 17 16.961 -19.797 -11.625 1.00 12.44 H new ATOM 0 HD22 LEU A 17 18.161 -19.397 -10.373 1.00 12.44 H new ATOM 0 HD23 LEU A 17 16.872 -18.237 -10.773 1.00 12.44 H new ATOM 281 N ASN A 18 19.281 -14.731 -9.139 1.00 73.12 N ATOM 282 CA ASN A 18 20.050 -13.665 -8.476 1.00 1.01 C ATOM 283 C ASN A 18 21.467 -14.122 -8.076 1.00 72.50 C ATOM 284 O ASN A 18 21.853 -15.273 -8.300 1.00 30.14 O ATOM 285 CB ASN A 18 19.284 -13.155 -7.246 1.00 12.24 C ATOM 286 CG ASN A 18 17.886 -12.673 -7.602 1.00 33.05 C ATOM 287 OD1 ASN A 18 17.637 -12.205 -8.710 1.00 32.02 O ATOM 288 ND2 ASN A 18 16.961 -12.773 -6.666 1.00 12.15 N ATOM 0 H ASN A 18 18.630 -15.222 -8.526 1.00 73.12 H new ATOM 0 HA ASN A 18 20.170 -12.854 -9.194 1.00 1.01 H new ATOM 0 HB2 ASN A 18 19.215 -13.953 -6.506 1.00 12.24 H new ATOM 0 HB3 ASN A 18 19.841 -12.340 -6.785 1.00 12.24 H new ATOM 0 HD21 ASN A 18 16.009 -12.457 -6.854 1.00 12.15 H new ATOM 0 HD22 ASN A 18 17.198 -13.166 -5.755 1.00 12.15 H new ATOM 295 N GLN A 19 22.242 -13.205 -7.492 1.00 65.24 N ATOM 296 CA GLN A 19 23.628 -13.487 -7.089 1.00 73.11 C ATOM 297 C GLN A 19 23.700 -14.140 -5.695 1.00 53.45 C ATOM 298 O GLN A 19 22.679 -14.507 -5.115 1.00 1.40 O ATOM 299 CB GLN A 19 24.448 -12.184 -7.104 1.00 62.31 C ATOM 300 CG GLN A 19 24.500 -11.503 -8.470 1.00 64.43 C ATOM 301 CD GLN A 19 25.162 -12.359 -9.539 1.00 51.12 C ATOM 302 OE1 GLN A 19 26.040 -13.169 -9.254 1.00 12.44 O ATOM 303 NE2 GLN A 19 24.745 -12.181 -10.777 1.00 64.10 N ATOM 0 H GLN A 19 21.934 -12.255 -7.285 1.00 65.24 H new ATOM 0 HA GLN A 19 24.046 -14.195 -7.804 1.00 73.11 H new ATOM 0 HB2 GLN A 19 24.023 -11.490 -6.379 1.00 62.31 H new ATOM 0 HB3 GLN A 19 25.465 -12.402 -6.778 1.00 62.31 H new ATOM 0 HG2 GLN A 19 23.486 -11.258 -8.786 1.00 64.43 H new ATOM 0 HG3 GLN A 19 25.042 -10.562 -8.380 1.00 64.43 H new ATOM 0 HE21 GLN A 19 24.013 -11.499 -10.976 1.00 64.10 H new ATOM 0 HE22 GLN A 19 25.154 -12.726 -11.536 1.00 64.10 H new ATOM 312 N GLU A 20 24.918 -14.286 -5.168 1.00 70.52 N ATOM 313 CA GLU A 20 25.128 -14.905 -3.850 1.00 71.11 C ATOM 314 C GLU A 20 24.626 -13.995 -2.706 1.00 41.31 C ATOM 315 O GLU A 20 24.491 -12.780 -2.875 1.00 55.44 O ATOM 316 CB GLU A 20 26.620 -15.221 -3.649 1.00 71.33 C ATOM 317 CG GLU A 20 26.926 -15.999 -2.368 1.00 22.34 C ATOM 318 CD GLU A 20 28.409 -16.056 -2.044 1.00 24.23 C ATOM 319 OE1 GLU A 20 28.939 -15.057 -1.516 1.00 30.52 O ATOM 320 OE2 GLU A 20 29.050 -17.094 -2.298 1.00 24.02 O ATOM 0 H GLU A 20 25.776 -13.985 -5.631 1.00 70.52 H new ATOM 0 HA GLU A 20 24.551 -15.829 -3.821 1.00 71.11 H new ATOM 0 HB2 GLU A 20 26.977 -15.795 -4.504 1.00 71.33 H new ATOM 0 HB3 GLU A 20 27.180 -14.286 -3.636 1.00 71.33 H new ATOM 0 HG2 GLU A 20 26.396 -15.538 -1.535 1.00 22.34 H new ATOM 0 HG3 GLU A 20 26.543 -17.015 -2.467 1.00 22.34 H new ATOM 327 N MET A 21 24.377 -14.598 -1.538 1.00 31.43 N ATOM 328 CA MET A 21 23.870 -13.874 -0.358 1.00 42.24 C ATOM 329 C MET A 21 24.773 -12.694 0.050 1.00 63.44 C ATOM 330 O MET A 21 25.962 -12.656 -0.278 1.00 33.24 O ATOM 331 CB MET A 21 23.729 -14.844 0.826 1.00 53.31 C ATOM 332 CG MET A 21 22.751 -15.983 0.576 1.00 52.20 C ATOM 333 SD MET A 21 22.705 -17.175 1.929 1.00 11.13 S ATOM 334 CE MET A 21 22.220 -16.133 3.305 1.00 74.43 C ATOM 0 H MET A 21 24.519 -15.596 -1.380 1.00 31.43 H new ATOM 0 HA MET A 21 22.899 -13.461 -0.630 1.00 42.24 H new ATOM 0 HB2 MET A 21 24.708 -15.263 1.058 1.00 53.31 H new ATOM 0 HB3 MET A 21 23.405 -14.286 1.704 1.00 53.31 H new ATOM 0 HG2 MET A 21 21.753 -15.572 0.426 1.00 52.20 H new ATOM 0 HG3 MET A 21 23.026 -16.496 -0.345 1.00 52.20 H new ATOM 0 HE1 MET A 21 21.877 -16.757 4.131 1.00 74.43 H new ATOM 0 HE2 MET A 21 23.074 -15.538 3.630 1.00 74.43 H new ATOM 0 HE3 MET A 21 21.413 -15.470 2.993 1.00 74.43 H new ATOM 344 N THR A 22 24.195 -11.739 0.778 1.00 45.50 N ATOM 345 CA THR A 22 24.924 -10.550 1.245 1.00 3.42 C ATOM 346 C THR A 22 24.456 -10.136 2.652 1.00 43.43 C ATOM 347 O THR A 22 23.642 -10.825 3.270 1.00 70.41 O ATOM 348 CB THR A 22 24.745 -9.359 0.268 1.00 25.05 C ATOM 349 OG1 THR A 22 25.518 -8.232 0.706 1.00 22.52 O ATOM 350 CG2 THR A 22 23.279 -8.957 0.148 1.00 33.53 C ATOM 0 H THR A 22 23.215 -11.763 1.061 1.00 45.50 H new ATOM 0 HA THR A 22 25.981 -10.814 1.284 1.00 3.42 H new ATOM 0 HB THR A 22 25.097 -9.681 -0.712 1.00 25.05 H new ATOM 0 HG1 THR A 22 25.397 -7.489 0.079 1.00 22.52 H new ATOM 0 HG21 THR A 22 23.187 -8.120 -0.544 1.00 33.53 H new ATOM 0 HG22 THR A 22 22.700 -9.801 -0.225 1.00 33.53 H new ATOM 0 HG23 THR A 22 22.901 -8.662 1.127 1.00 33.53 H new ATOM 358 N GLN A 23 24.969 -9.012 3.156 1.00 22.11 N ATOM 359 CA GLN A 23 24.627 -8.536 4.506 1.00 1.35 C ATOM 360 C GLN A 23 23.182 -8.014 4.595 1.00 75.13 C ATOM 361 O GLN A 23 22.519 -7.791 3.580 1.00 40.22 O ATOM 362 CB GLN A 23 25.613 -7.445 4.952 1.00 10.12 C ATOM 363 CG GLN A 23 27.042 -7.946 5.134 1.00 73.23 C ATOM 364 CD GLN A 23 27.159 -9.059 6.170 1.00 43.23 C ATOM 365 OE1 GLN A 23 26.324 -9.031 7.190 1.00 64.41 O flip ATOM 366 NE2 GLN A 23 28.008 -9.937 6.060 1.00 55.23 N flip ATOM 0 H GLN A 23 25.623 -8.412 2.653 1.00 22.11 H new ATOM 0 HA GLN A 23 24.704 -9.392 5.177 1.00 1.35 H new ATOM 0 HB2 GLN A 23 25.610 -6.642 4.215 1.00 10.12 H new ATOM 0 HB3 GLN A 23 25.265 -7.016 5.892 1.00 10.12 H new ATOM 0 HG2 GLN A 23 27.418 -8.308 4.177 1.00 73.23 H new ATOM 0 HG3 GLN A 23 27.678 -7.112 5.432 1.00 73.23 H new ATOM 0 HE21 GLN A 23 28.642 -9.936 5.261 1.00 55.23 H new ATOM 0 HE22 GLN A 23 28.080 -10.668 6.767 1.00 55.23 H new ATOM 375 N LEU A 24 22.709 -7.809 5.826 1.00 53.34 N ATOM 376 CA LEU A 24 21.318 -7.412 6.077 1.00 3.24 C ATOM 377 C LEU A 24 21.097 -5.902 5.884 1.00 12.02 C ATOM 378 O LEU A 24 21.919 -5.078 6.292 1.00 20.43 O ATOM 379 CB LEU A 24 20.914 -7.807 7.505 1.00 15.21 C ATOM 380 CG LEU A 24 19.443 -7.533 7.871 1.00 71.31 C ATOM 381 CD1 LEU A 24 18.510 -8.435 7.072 1.00 62.11 C ATOM 382 CD2 LEU A 24 19.214 -7.712 9.368 1.00 54.41 C ATOM 0 H LEU A 24 23.271 -7.912 6.671 1.00 53.34 H new ATOM 0 HA LEU A 24 20.697 -7.934 5.349 1.00 3.24 H new ATOM 0 HB2 LEU A 24 21.113 -8.870 7.641 1.00 15.21 H new ATOM 0 HB3 LEU A 24 21.552 -7.271 8.207 1.00 15.21 H new ATOM 0 HG LEU A 24 19.218 -6.498 7.615 1.00 71.31 H new ATOM 0 HD11 LEU A 24 17.477 -8.224 7.347 1.00 62.11 H new ATOM 0 HD12 LEU A 24 18.648 -8.249 6.007 1.00 62.11 H new ATOM 0 HD13 LEU A 24 18.738 -9.478 7.290 1.00 62.11 H new ATOM 0 HD21 LEU A 24 18.168 -7.513 9.602 1.00 54.41 H new ATOM 0 HD22 LEU A 24 19.462 -8.734 9.654 1.00 54.41 H new ATOM 0 HD23 LEU A 24 19.848 -7.017 9.919 1.00 54.41 H new ATOM 394 N ASN A 25 19.965 -5.548 5.283 1.00 62.15 N ATOM 395 CA ASN A 25 19.588 -4.142 5.091 1.00 0.35 C ATOM 396 C ASN A 25 18.413 -3.766 6.004 1.00 11.14 C ATOM 397 O ASN A 25 17.568 -4.607 6.320 1.00 32.15 O ATOM 398 CB ASN A 25 19.199 -3.878 3.630 1.00 4.34 C ATOM 399 CG ASN A 25 20.304 -4.219 2.648 1.00 62.51 C ATOM 400 OD1 ASN A 25 21.484 -4.193 2.979 1.00 63.11 O ATOM 401 ND2 ASN A 25 19.929 -4.515 1.422 1.00 72.23 N ATOM 0 H ASN A 25 19.286 -6.216 4.917 1.00 62.15 H new ATOM 0 HA ASN A 25 20.452 -3.529 5.348 1.00 0.35 H new ATOM 0 HB2 ASN A 25 18.311 -4.462 3.386 1.00 4.34 H new ATOM 0 HB3 ASN A 25 18.931 -2.828 3.516 1.00 4.34 H new ATOM 0 HD21 ASN A 25 20.629 -4.732 0.713 1.00 72.23 H new ATOM 0 HD22 ASN A 25 18.938 -4.527 1.181 1.00 72.23 H new ATOM 408 N GLN A 26 18.352 -2.501 6.418 1.00 41.22 N ATOM 409 CA GLN A 26 17.212 -2.004 7.201 1.00 55.41 C ATOM 410 C GLN A 26 15.900 -2.176 6.420 1.00 71.23 C ATOM 411 O GLN A 26 14.847 -2.453 6.998 1.00 20.05 O ATOM 412 CB GLN A 26 17.414 -0.529 7.581 1.00 62.12 C ATOM 413 CG GLN A 26 18.590 -0.284 8.524 1.00 14.53 C ATOM 414 CD GLN A 26 18.474 -1.054 9.831 1.00 74.24 C ATOM 415 OE1 GLN A 26 17.875 -0.585 10.794 1.00 51.25 O ATOM 416 NE2 GLN A 26 19.065 -2.232 9.887 1.00 72.14 N ATOM 0 H GLN A 26 19.071 -1.803 6.228 1.00 41.22 H new ATOM 0 HA GLN A 26 17.150 -2.592 8.117 1.00 55.41 H new ATOM 0 HB2 GLN A 26 17.564 0.052 6.671 1.00 62.12 H new ATOM 0 HB3 GLN A 26 16.503 -0.157 8.050 1.00 62.12 H new ATOM 0 HG2 GLN A 26 19.516 -0.567 8.023 1.00 14.53 H new ATOM 0 HG3 GLN A 26 18.658 0.782 8.741 1.00 14.53 H new ATOM 0 HE21 GLN A 26 19.555 -2.596 9.070 1.00 72.14 H new ATOM 0 HE22 GLN A 26 19.031 -2.779 10.747 1.00 72.14 H new ATOM 425 N GLU A 27 15.979 -2.017 5.100 1.00 43.23 N ATOM 426 CA GLU A 27 14.842 -2.288 4.214 1.00 11.13 C ATOM 427 C GLU A 27 14.442 -3.770 4.275 1.00 40.23 C ATOM 428 O GLU A 27 13.259 -4.102 4.347 1.00 43.24 O ATOM 429 CB GLU A 27 15.185 -1.883 2.772 1.00 75.23 C ATOM 430 CG GLU A 27 14.127 -2.283 1.746 1.00 65.13 C ATOM 431 CD GLU A 27 14.277 -1.549 0.426 1.00 51.12 C ATOM 432 OE1 GLU A 27 15.005 -2.041 -0.462 1.00 43.35 O ATOM 433 OE2 GLU A 27 13.672 -0.466 0.272 1.00 24.00 O ATOM 0 H GLU A 27 16.820 -1.701 4.617 1.00 43.23 H new ATOM 0 HA GLU A 27 13.993 -1.694 4.553 1.00 11.13 H new ATOM 0 HB2 GLU A 27 15.325 -0.803 2.732 1.00 75.23 H new ATOM 0 HB3 GLU A 27 16.136 -2.338 2.494 1.00 75.23 H new ATOM 0 HG2 GLU A 27 14.188 -3.357 1.568 1.00 65.13 H new ATOM 0 HG3 GLU A 27 13.137 -2.084 2.156 1.00 65.13 H new ATOM 440 N THR A 28 15.437 -4.656 4.262 1.00 65.53 N ATOM 441 CA THR A 28 15.194 -6.100 4.403 1.00 70.12 C ATOM 442 C THR A 28 14.455 -6.403 5.717 1.00 24.34 C ATOM 443 O THR A 28 13.622 -7.312 5.786 1.00 71.43 O ATOM 444 CB THR A 28 16.516 -6.907 4.375 1.00 33.42 C ATOM 445 OG1 THR A 28 17.326 -6.499 3.262 1.00 63.01 O ATOM 446 CG2 THR A 28 16.248 -8.406 4.286 1.00 63.24 C ATOM 0 H THR A 28 16.420 -4.404 4.156 1.00 65.53 H new ATOM 0 HA THR A 28 14.578 -6.402 3.556 1.00 70.12 H new ATOM 0 HB THR A 28 17.046 -6.704 5.305 1.00 33.42 H new ATOM 0 HG1 THR A 28 18.159 -7.015 3.257 1.00 63.01 H new ATOM 0 HG21 THR A 28 17.195 -8.945 4.268 1.00 63.24 H new ATOM 0 HG22 THR A 28 15.666 -8.724 5.151 1.00 63.24 H new ATOM 0 HG23 THR A 28 15.690 -8.622 3.375 1.00 63.24 H new ATOM 454 N VAL A 29 14.769 -5.635 6.759 1.00 54.11 N ATOM 455 CA VAL A 29 14.060 -5.735 8.038 1.00 2.52 C ATOM 456 C VAL A 29 12.585 -5.316 7.883 1.00 23.10 C ATOM 457 O VAL A 29 11.681 -5.993 8.383 1.00 62.12 O ATOM 458 CB VAL A 29 14.733 -4.864 9.130 1.00 52.34 C ATOM 459 CG1 VAL A 29 14.008 -4.998 10.469 1.00 1.33 C ATOM 460 CG2 VAL A 29 16.212 -5.222 9.275 1.00 71.30 C ATOM 0 H VAL A 29 15.511 -4.935 6.745 1.00 54.11 H new ATOM 0 HA VAL A 29 14.105 -6.779 8.349 1.00 2.52 H new ATOM 0 HB VAL A 29 14.663 -3.823 8.816 1.00 52.34 H new ATOM 0 HG11 VAL A 29 14.503 -4.376 11.215 1.00 1.33 H new ATOM 0 HG12 VAL A 29 12.973 -4.675 10.356 1.00 1.33 H new ATOM 0 HG13 VAL A 29 14.030 -6.039 10.792 1.00 1.33 H new ATOM 0 HG21 VAL A 29 16.663 -4.598 10.047 1.00 71.30 H new ATOM 0 HG22 VAL A 29 16.307 -6.271 9.555 1.00 71.30 H new ATOM 0 HG23 VAL A 29 16.722 -5.052 8.327 1.00 71.30 H new ATOM 470 N LYS A 30 12.347 -4.207 7.175 1.00 71.33 N ATOM 471 CA LYS A 30 10.977 -3.753 6.896 1.00 62.20 C ATOM 472 C LYS A 30 10.204 -4.804 6.085 1.00 0.54 C ATOM 473 O LYS A 30 9.021 -5.034 6.324 1.00 51.23 O ATOM 474 CB LYS A 30 10.976 -2.413 6.141 1.00 24.21 C ATOM 475 CG LYS A 30 11.620 -1.254 6.901 1.00 61.24 C ATOM 476 CD LYS A 30 10.960 -1.014 8.259 1.00 45.52 C ATOM 477 CE LYS A 30 9.502 -0.578 8.130 1.00 64.55 C ATOM 478 NZ LYS A 30 9.372 0.747 7.466 1.00 30.04 N ATOM 0 H LYS A 30 13.077 -3.610 6.787 1.00 71.33 H new ATOM 0 HA LYS A 30 10.481 -3.612 7.856 1.00 62.20 H new ATOM 0 HB2 LYS A 30 11.499 -2.544 5.194 1.00 24.21 H new ATOM 0 HB3 LYS A 30 9.946 -2.146 5.902 1.00 24.21 H new ATOM 0 HG2 LYS A 30 12.680 -1.462 7.046 1.00 61.24 H new ATOM 0 HG3 LYS A 30 11.552 -0.347 6.301 1.00 61.24 H new ATOM 0 HD2 LYS A 30 11.012 -1.927 8.851 1.00 45.52 H new ATOM 0 HD3 LYS A 30 11.518 -0.250 8.801 1.00 45.52 H new ATOM 0 HE2 LYS A 30 8.950 -1.325 7.560 1.00 64.55 H new ATOM 0 HE3 LYS A 30 9.048 -0.533 9.120 1.00 64.55 H new ATOM 0 HZ1 LYS A 30 8.654 1.314 7.960 1.00 30.04 H new ATOM 0 HZ2 LYS A 30 10.286 1.242 7.497 1.00 30.04 H new ATOM 0 HZ3 LYS A 30 9.085 0.612 6.476 1.00 30.04 H new ATOM 492 N ILE A 31 10.880 -5.431 5.122 1.00 25.14 N ATOM 493 CA ILE A 31 10.288 -6.522 4.337 1.00 64.45 C ATOM 494 C ILE A 31 9.851 -7.681 5.248 1.00 33.45 C ATOM 495 O ILE A 31 8.731 -8.188 5.141 1.00 53.15 O ATOM 496 CB ILE A 31 11.285 -7.056 3.270 1.00 0.53 C ATOM 497 CG1 ILE A 31 11.655 -5.941 2.273 1.00 54.01 C ATOM 498 CG2 ILE A 31 10.701 -8.265 2.537 1.00 21.33 C ATOM 499 CD1 ILE A 31 12.669 -6.357 1.226 1.00 21.54 C ATOM 0 H ILE A 31 11.840 -5.204 4.864 1.00 25.14 H new ATOM 0 HA ILE A 31 9.414 -6.114 3.830 1.00 64.45 H new ATOM 0 HB ILE A 31 12.193 -7.377 3.780 1.00 0.53 H new ATOM 0 HG12 ILE A 31 10.749 -5.602 1.771 1.00 54.01 H new ATOM 0 HG13 ILE A 31 12.050 -5.089 2.827 1.00 54.01 H new ATOM 0 HG21 ILE A 31 11.416 -8.621 1.796 1.00 21.33 H new ATOM 0 HG22 ILE A 31 10.495 -9.060 3.253 1.00 21.33 H new ATOM 0 HG23 ILE A 31 9.775 -7.976 2.039 1.00 21.33 H new ATOM 0 HD11 ILE A 31 12.875 -5.516 0.564 1.00 21.54 H new ATOM 0 HD12 ILE A 31 13.592 -6.667 1.716 1.00 21.54 H new ATOM 0 HD13 ILE A 31 12.271 -7.188 0.644 1.00 21.54 H new ATOM 511 N THR A 32 10.744 -8.094 6.145 1.00 21.22 N ATOM 512 CA THR A 32 10.444 -9.159 7.113 1.00 31.33 C ATOM 513 C THR A 32 9.212 -8.800 7.959 1.00 3.11 C ATOM 514 O THR A 32 8.278 -9.599 8.100 1.00 61.14 O ATOM 515 CB THR A 32 11.649 -9.424 8.054 1.00 0.21 C ATOM 516 OG1 THR A 32 12.824 -9.718 7.280 1.00 71.44 O ATOM 517 CG2 THR A 32 11.367 -10.583 9.010 1.00 73.44 C ATOM 0 H THR A 32 11.685 -7.709 6.225 1.00 21.22 H new ATOM 0 HA THR A 32 10.238 -10.063 6.540 1.00 31.33 H new ATOM 0 HB THR A 32 11.812 -8.523 8.645 1.00 0.21 H new ATOM 0 HG1 THR A 32 13.140 -8.900 6.842 1.00 71.44 H new ATOM 0 HG21 THR A 32 12.232 -10.742 9.655 1.00 73.44 H new ATOM 0 HG22 THR A 32 10.497 -10.346 9.622 1.00 73.44 H new ATOM 0 HG23 THR A 32 11.172 -11.489 8.436 1.00 73.44 H new ATOM 525 N GLN A 33 9.215 -7.586 8.508 1.00 21.21 N ATOM 526 CA GLN A 33 8.078 -7.070 9.281 1.00 53.22 C ATOM 527 C GLN A 33 6.793 -7.028 8.429 1.00 14.13 C ATOM 528 O GLN A 33 5.722 -7.431 8.882 1.00 11.45 O ATOM 529 CB GLN A 33 8.410 -5.666 9.818 1.00 63.44 C ATOM 530 CG GLN A 33 7.312 -5.050 10.678 1.00 14.24 C ATOM 531 CD GLN A 33 7.658 -3.648 11.162 1.00 41.42 C ATOM 532 OE1 GLN A 33 8.377 -2.907 10.501 1.00 75.15 O ATOM 533 NE2 GLN A 33 7.139 -3.264 12.312 1.00 3.41 N ATOM 0 H GLN A 33 9.996 -6.935 8.433 1.00 21.21 H new ATOM 0 HA GLN A 33 7.898 -7.744 10.118 1.00 53.22 H new ATOM 0 HB2 GLN A 33 9.327 -5.721 10.404 1.00 63.44 H new ATOM 0 HB3 GLN A 33 8.610 -5.005 8.975 1.00 63.44 H new ATOM 0 HG2 GLN A 33 6.386 -5.013 10.105 1.00 14.24 H new ATOM 0 HG3 GLN A 33 7.129 -5.692 11.540 1.00 14.24 H new ATOM 0 HE21 GLN A 33 6.544 -3.901 12.841 1.00 3.41 H new ATOM 0 HE22 GLN A 33 7.333 -2.330 12.672 1.00 3.41 H new ATOM 542 N GLN A 34 6.923 -6.560 7.187 1.00 51.51 N ATOM 543 CA GLN A 34 5.789 -6.432 6.264 1.00 4.12 C ATOM 544 C GLN A 34 5.063 -7.768 6.066 1.00 4.02 C ATOM 545 O GLN A 34 3.847 -7.847 6.218 1.00 43.21 O ATOM 546 CB GLN A 34 6.264 -5.893 4.907 1.00 70.31 C ATOM 547 CG GLN A 34 5.142 -5.707 3.890 1.00 44.51 C ATOM 548 CD GLN A 34 5.629 -5.150 2.562 1.00 35.10 C ATOM 549 OE1 GLN A 34 5.684 -3.942 2.364 1.00 44.32 O ATOM 550 NE2 GLN A 34 5.980 -6.023 1.641 1.00 44.14 N ATOM 0 H GLN A 34 7.814 -6.259 6.791 1.00 51.51 H new ATOM 0 HA GLN A 34 5.085 -5.729 6.709 1.00 4.12 H new ATOM 0 HB2 GLN A 34 6.764 -4.937 5.061 1.00 70.31 H new ATOM 0 HB3 GLN A 34 7.006 -6.577 4.495 1.00 70.31 H new ATOM 0 HG2 GLN A 34 4.653 -6.666 3.718 1.00 44.51 H new ATOM 0 HG3 GLN A 34 4.390 -5.036 4.305 1.00 44.51 H new ATOM 0 HE21 GLN A 34 5.923 -7.022 1.837 1.00 44.14 H new ATOM 0 HE22 GLN A 34 6.309 -5.700 0.731 1.00 44.14 H new ATOM 559 N ASN A 35 5.815 -8.814 5.726 1.00 5.23 N ATOM 560 CA ASN A 35 5.225 -10.143 5.508 1.00 63.12 C ATOM 561 C ASN A 35 4.491 -10.659 6.757 1.00 54.31 C ATOM 562 O ASN A 35 3.376 -11.177 6.658 1.00 42.21 O ATOM 563 CB ASN A 35 6.297 -11.151 5.077 1.00 31.12 C ATOM 564 CG ASN A 35 6.770 -10.918 3.654 1.00 63.23 C ATOM 565 OD1 ASN A 35 6.188 -11.432 2.705 1.00 45.32 O ATOM 566 ND2 ASN A 35 7.831 -10.153 3.491 1.00 53.32 N ATOM 0 H ASN A 35 6.826 -8.773 5.595 1.00 5.23 H new ATOM 0 HA ASN A 35 4.492 -10.038 4.708 1.00 63.12 H new ATOM 0 HB2 ASN A 35 7.148 -11.085 5.755 1.00 31.12 H new ATOM 0 HB3 ASN A 35 5.898 -12.162 5.164 1.00 31.12 H new ATOM 0 HD21 ASN A 35 8.191 -9.973 2.554 1.00 53.32 H new ATOM 0 HD22 ASN A 35 8.292 -9.741 4.302 1.00 53.32 H new ATOM 573 N ARG A 36 5.110 -10.513 7.930 1.00 52.10 N ATOM 574 CA ARG A 36 4.489 -10.973 9.180 1.00 32.44 C ATOM 575 C ARG A 36 3.195 -10.198 9.489 1.00 41.25 C ATOM 576 O ARG A 36 2.159 -10.799 9.772 1.00 62.31 O ATOM 577 CB ARG A 36 5.477 -10.863 10.350 1.00 62.20 C ATOM 578 CG ARG A 36 6.758 -11.668 10.137 1.00 61.41 C ATOM 579 CD ARG A 36 7.621 -11.715 11.394 1.00 13.22 C ATOM 580 NE ARG A 36 6.980 -12.464 12.473 1.00 51.32 N ATOM 581 CZ ARG A 36 7.488 -12.620 13.666 1.00 70.35 C ATOM 582 NH1 ARG A 36 8.620 -12.076 13.987 1.00 75.02 N ATOM 583 NH2 ARG A 36 6.848 -13.326 14.538 1.00 4.13 N ATOM 0 H ARG A 36 6.029 -10.086 8.044 1.00 52.10 H new ATOM 0 HA ARG A 36 4.223 -12.022 9.048 1.00 32.44 H new ATOM 0 HB2 ARG A 36 5.736 -9.815 10.501 1.00 62.20 H new ATOM 0 HB3 ARG A 36 4.989 -11.205 11.262 1.00 62.20 H new ATOM 0 HG2 ARG A 36 6.502 -12.684 9.835 1.00 61.41 H new ATOM 0 HG3 ARG A 36 7.331 -11.228 9.321 1.00 61.41 H new ATOM 0 HD2 ARG A 36 8.582 -12.172 11.157 1.00 13.22 H new ATOM 0 HD3 ARG A 36 7.826 -10.699 11.731 1.00 13.22 H new ATOM 0 HE ARG A 36 6.075 -12.894 12.281 1.00 51.32 H new ATOM 0 HH11 ARG A 36 9.129 -11.516 13.303 1.00 75.02 H new ATOM 0 HH12 ARG A 36 9.002 -12.208 14.923 1.00 75.02 H new ATOM 0 HH21 ARG A 36 5.956 -13.755 14.292 1.00 4.13 H new ATOM 0 HH22 ARG A 36 7.235 -13.455 15.473 1.00 4.13 H new ATOM 597 N LEU A 37 3.253 -8.864 9.425 1.00 44.33 N ATOM 598 CA LEU A 37 2.057 -8.028 9.631 1.00 34.41 C ATOM 599 C LEU A 37 0.978 -8.346 8.581 1.00 23.35 C ATOM 600 O LEU A 37 -0.213 -8.427 8.890 1.00 42.02 O ATOM 601 CB LEU A 37 2.418 -6.533 9.561 1.00 54.31 C ATOM 602 CG LEU A 37 3.458 -6.048 10.585 1.00 31.43 C ATOM 603 CD1 LEU A 37 3.670 -4.540 10.467 1.00 31.25 C ATOM 604 CD2 LEU A 37 3.045 -6.424 12.005 1.00 51.34 C ATOM 0 H LEU A 37 4.107 -8.339 9.234 1.00 44.33 H new ATOM 0 HA LEU A 37 1.663 -8.253 10.622 1.00 34.41 H new ATOM 0 HB2 LEU A 37 2.792 -6.315 8.561 1.00 54.31 H new ATOM 0 HB3 LEU A 37 1.506 -5.951 9.694 1.00 54.31 H new ATOM 0 HG LEU A 37 4.403 -6.546 10.366 1.00 31.43 H new ATOM 0 HD11 LEU A 37 4.409 -4.218 11.200 1.00 31.25 H new ATOM 0 HD12 LEU A 37 4.025 -4.300 9.465 1.00 31.25 H new ATOM 0 HD13 LEU A 37 2.728 -4.025 10.652 1.00 31.25 H new ATOM 0 HD21 LEU A 37 3.798 -6.069 12.709 1.00 51.34 H new ATOM 0 HD22 LEU A 37 2.085 -5.964 12.238 1.00 51.34 H new ATOM 0 HD23 LEU A 37 2.957 -7.508 12.083 1.00 51.34 H new ATOM 616 N ASN A 38 1.418 -8.530 7.339 1.00 42.33 N ATOM 617 CA ASN A 38 0.524 -8.852 6.221 1.00 64.24 C ATOM 618 C ASN A 38 -0.257 -10.150 6.500 1.00 14.12 C ATOM 619 O ASN A 38 -1.474 -10.209 6.322 1.00 33.31 O ATOM 620 CB ASN A 38 1.347 -8.992 4.930 1.00 41.42 C ATOM 621 CG ASN A 38 0.495 -8.939 3.676 1.00 13.32 C ATOM 622 OD1 ASN A 38 0.363 -7.761 3.098 1.00 15.54 O flip ATOM 623 ND2 ASN A 38 -0.021 -9.949 3.215 1.00 42.14 N flip ATOM 0 H ASN A 38 2.401 -8.461 7.076 1.00 42.33 H new ATOM 0 HA ASN A 38 -0.198 -8.044 6.104 1.00 64.24 H new ATOM 0 HB2 ASN A 38 2.091 -8.196 4.891 1.00 41.42 H new ATOM 0 HB3 ASN A 38 1.892 -9.936 4.953 1.00 41.42 H new ATOM 0 HD21 ASN A 38 0.101 -10.845 3.687 1.00 42.14 H new ATOM 0 HD22 ASN A 38 -0.573 -9.895 2.359 1.00 42.14 H new ATOM 630 N ALA A 39 0.458 -11.175 6.967 1.00 44.32 N ATOM 631 CA ALA A 39 -0.149 -12.473 7.291 1.00 72.31 C ATOM 632 C ALA A 39 -1.038 -12.396 8.547 1.00 53.10 C ATOM 633 O ALA A 39 -1.956 -13.202 8.720 1.00 74.23 O ATOM 634 CB ALA A 39 0.939 -13.525 7.478 1.00 72.20 C ATOM 0 H ALA A 39 1.464 -11.133 7.131 1.00 44.32 H new ATOM 0 HA ALA A 39 -0.789 -12.757 6.456 1.00 72.31 H new ATOM 0 HB1 ALA A 39 0.480 -14.484 7.718 1.00 72.20 H new ATOM 0 HB2 ALA A 39 1.516 -13.619 6.558 1.00 72.20 H new ATOM 0 HB3 ALA A 39 1.599 -13.225 8.292 1.00 72.20 H new ATOM 640 N LYS A 40 -0.752 -11.439 9.429 1.00 62.12 N ATOM 641 CA LYS A 40 -1.559 -11.225 10.642 1.00 12.43 C ATOM 642 C LYS A 40 -2.804 -10.362 10.363 1.00 70.32 C ATOM 643 O LYS A 40 -3.724 -10.304 11.180 1.00 5.50 O ATOM 644 CB LYS A 40 -0.710 -10.564 11.740 1.00 2.11 C ATOM 645 CG LYS A 40 0.347 -11.484 12.343 1.00 35.14 C ATOM 646 CD LYS A 40 1.203 -10.754 13.374 1.00 12.44 C ATOM 647 CE LYS A 40 2.143 -11.698 14.115 1.00 41.43 C ATOM 648 NZ LYS A 40 1.400 -12.703 14.926 1.00 42.42 N ATOM 0 H LYS A 40 0.033 -10.795 9.331 1.00 62.12 H new ATOM 0 HA LYS A 40 -1.898 -12.205 10.979 1.00 12.43 H new ATOM 0 HB2 LYS A 40 -0.218 -9.685 11.325 1.00 2.11 H new ATOM 0 HB3 LYS A 40 -1.369 -10.215 12.535 1.00 2.11 H new ATOM 0 HG2 LYS A 40 -0.139 -12.339 12.812 1.00 35.14 H new ATOM 0 HG3 LYS A 40 0.985 -11.875 11.550 1.00 35.14 H new ATOM 0 HD2 LYS A 40 1.787 -9.980 12.876 1.00 12.44 H new ATOM 0 HD3 LYS A 40 0.555 -10.252 14.092 1.00 12.44 H new ATOM 0 HE2 LYS A 40 2.781 -12.212 13.396 1.00 41.43 H new ATOM 0 HE3 LYS A 40 2.798 -11.120 14.766 1.00 41.43 H new ATOM 0 HZ1 LYS A 40 1.722 -12.659 15.914 1.00 42.42 H new ATOM 0 HZ2 LYS A 40 0.381 -12.498 14.884 1.00 42.42 H new ATOM 0 HZ3 LYS A 40 1.577 -13.655 14.547 1.00 42.42 H new ATOM 662 N SER A 41 -2.828 -9.694 9.211 1.00 73.44 N ATOM 663 CA SER A 41 -3.954 -8.820 8.837 1.00 52.22 C ATOM 664 C SER A 41 -5.264 -9.600 8.659 1.00 23.42 C ATOM 665 O SER A 41 -5.287 -10.674 8.055 1.00 24.33 O ATOM 666 CB SER A 41 -3.647 -8.065 7.538 1.00 3.42 C ATOM 667 OG SER A 41 -4.743 -7.245 7.147 1.00 62.13 O ATOM 0 H SER A 41 -2.083 -9.737 8.516 1.00 73.44 H new ATOM 0 HA SER A 41 -4.082 -8.115 9.658 1.00 52.22 H new ATOM 0 HB2 SER A 41 -2.759 -7.448 7.674 1.00 3.42 H new ATOM 0 HB3 SER A 41 -3.422 -8.778 6.745 1.00 3.42 H new ATOM 0 HG SER A 41 -4.804 -7.225 6.169 1.00 62.13 H new ATOM 673 N SER A 42 -6.356 -9.043 9.181 1.00 41.14 N ATOM 674 CA SER A 42 -7.695 -9.622 8.993 1.00 25.32 C ATOM 675 C SER A 42 -8.543 -8.756 8.049 1.00 71.05 C ATOM 676 O SER A 42 -9.741 -8.982 7.888 1.00 33.31 O ATOM 677 CB SER A 42 -8.414 -9.770 10.343 1.00 43.40 C ATOM 678 OG SER A 42 -7.682 -10.601 11.233 1.00 3.44 O ATOM 0 H SER A 42 -6.344 -8.189 9.739 1.00 41.14 H new ATOM 0 HA SER A 42 -7.570 -10.608 8.544 1.00 25.32 H new ATOM 0 HB2 SER A 42 -8.553 -8.787 10.792 1.00 43.40 H new ATOM 0 HB3 SER A 42 -9.407 -10.191 10.184 1.00 43.40 H new ATOM 0 HG SER A 42 -8.164 -10.674 12.083 1.00 3.44 H new ATOM 684 N SER A 43 -7.904 -7.765 7.424 1.00 0.40 N ATOM 685 CA SER A 43 -8.584 -6.862 6.479 1.00 50.41 C ATOM 686 C SER A 43 -7.570 -6.157 5.570 1.00 15.53 C ATOM 687 O SER A 43 -6.713 -5.408 6.047 1.00 74.53 O ATOM 688 CB SER A 43 -9.421 -5.809 7.226 1.00 0.43 C ATOM 689 OG SER A 43 -10.041 -4.904 6.322 1.00 61.43 O ATOM 0 H SER A 43 -6.913 -7.563 7.553 1.00 0.40 H new ATOM 0 HA SER A 43 -9.248 -7.472 5.866 1.00 50.41 H new ATOM 0 HB2 SER A 43 -10.183 -6.306 7.826 1.00 0.43 H new ATOM 0 HB3 SER A 43 -8.783 -5.257 7.916 1.00 0.43 H new ATOM 0 HG SER A 43 -10.567 -4.248 6.825 1.00 61.43 H new ATOM 695 N GLY A 44 -7.666 -6.400 4.263 1.00 75.33 N ATOM 696 CA GLY A 44 -6.726 -5.812 3.309 1.00 24.55 C ATOM 697 C GLY A 44 -5.280 -6.270 3.510 1.00 5.01 C ATOM 698 O GLY A 44 -5.008 -7.183 4.291 1.00 20.44 O ATOM 0 H GLY A 44 -8.380 -6.995 3.843 1.00 75.33 H new ATOM 0 HA2 GLY A 44 -7.041 -6.067 2.297 1.00 24.55 H new ATOM 0 HA3 GLY A 44 -6.769 -4.726 3.392 1.00 24.55 H new ATOM 702 N VAL A 45 -4.345 -5.630 2.809 1.00 54.21 N ATOM 703 CA VAL A 45 -2.924 -6.000 2.895 1.00 73.43 C ATOM 704 C VAL A 45 -2.067 -4.870 3.487 1.00 2.25 C ATOM 705 O VAL A 45 -2.283 -3.692 3.197 1.00 63.02 O ATOM 706 CB VAL A 45 -2.355 -6.393 1.505 1.00 4.12 C ATOM 707 CG1 VAL A 45 -3.020 -7.665 0.987 1.00 21.11 C ATOM 708 CG2 VAL A 45 -2.517 -5.251 0.501 1.00 53.52 C ATOM 0 H VAL A 45 -4.540 -4.855 2.176 1.00 54.21 H new ATOM 0 HA VAL A 45 -2.875 -6.861 3.562 1.00 73.43 H new ATOM 0 HB VAL A 45 -1.289 -6.588 1.623 1.00 4.12 H new ATOM 0 HG11 VAL A 45 -2.606 -7.921 0.012 1.00 21.11 H new ATOM 0 HG12 VAL A 45 -2.836 -8.482 1.685 1.00 21.11 H new ATOM 0 HG13 VAL A 45 -4.094 -7.502 0.893 1.00 21.11 H new ATOM 0 HG21 VAL A 45 -2.110 -5.554 -0.464 1.00 53.52 H new ATOM 0 HG22 VAL A 45 -3.575 -5.012 0.390 1.00 53.52 H new ATOM 0 HG23 VAL A 45 -1.982 -4.372 0.860 1.00 53.52 H new ATOM 718 N TYR A 46 -1.099 -5.240 4.327 1.00 35.33 N ATOM 719 CA TYR A 46 -0.145 -4.274 4.889 1.00 23.30 C ATOM 720 C TYR A 46 1.094 -4.121 3.993 1.00 13.50 C ATOM 721 O TYR A 46 1.818 -5.087 3.755 1.00 3.14 O ATOM 722 CB TYR A 46 0.303 -4.695 6.301 1.00 33.53 C ATOM 723 CG TYR A 46 -0.701 -4.394 7.398 1.00 20.14 C ATOM 724 CD1 TYR A 46 -0.984 -3.081 7.760 1.00 24.12 C ATOM 725 CD2 TYR A 46 -1.358 -5.413 8.077 1.00 63.53 C ATOM 726 CE1 TYR A 46 -1.891 -2.795 8.763 1.00 34.21 C ATOM 727 CE2 TYR A 46 -2.265 -5.136 9.081 1.00 2.51 C ATOM 728 CZ TYR A 46 -2.529 -3.825 9.420 1.00 3.34 C ATOM 729 OH TYR A 46 -3.432 -3.543 10.417 1.00 34.11 O ATOM 0 H TYR A 46 -0.952 -6.201 4.635 1.00 35.33 H new ATOM 0 HA TYR A 46 -0.661 -3.316 4.945 1.00 23.30 H new ATOM 0 HB2 TYR A 46 0.509 -5.765 6.299 1.00 33.53 H new ATOM 0 HB3 TYR A 46 1.240 -4.191 6.536 1.00 33.53 H new ATOM 0 HD1 TYR A 46 -0.486 -2.271 7.248 1.00 24.12 H new ATOM 0 HD2 TYR A 46 -1.156 -6.441 7.815 1.00 63.53 H new ATOM 0 HE1 TYR A 46 -2.099 -1.769 9.031 1.00 34.21 H new ATOM 0 HE2 TYR A 46 -2.765 -5.942 9.598 1.00 2.51 H new ATOM 0 HH TYR A 46 -3.793 -4.380 10.777 1.00 34.11 H new ATOM 739 N LEU A 47 1.312 -2.908 3.494 1.00 52.40 N ATOM 740 CA LEU A 47 2.542 -2.550 2.775 1.00 25.21 C ATOM 741 C LEU A 47 3.348 -1.530 3.592 1.00 72.11 C ATOM 742 O LEU A 47 2.836 -0.469 3.949 1.00 31.12 O ATOM 743 CB LEU A 47 2.208 -1.966 1.392 1.00 3.13 C ATOM 744 CG LEU A 47 1.613 -2.960 0.382 1.00 75.42 C ATOM 745 CD1 LEU A 47 1.178 -2.242 -0.892 1.00 63.41 C ATOM 746 CD2 LEU A 47 2.623 -4.061 0.058 1.00 3.33 C ATOM 0 H LEU A 47 0.644 -2.141 3.574 1.00 52.40 H new ATOM 0 HA LEU A 47 3.139 -3.452 2.637 1.00 25.21 H new ATOM 0 HB2 LEU A 47 1.505 -1.144 1.524 1.00 3.13 H new ATOM 0 HB3 LEU A 47 3.118 -1.542 0.966 1.00 3.13 H new ATOM 0 HG LEU A 47 0.732 -3.419 0.832 1.00 75.42 H new ATOM 0 HD11 LEU A 47 0.760 -2.965 -1.592 1.00 63.41 H new ATOM 0 HD12 LEU A 47 0.423 -1.494 -0.649 1.00 63.41 H new ATOM 0 HD13 LEU A 47 2.040 -1.753 -1.346 1.00 63.41 H new ATOM 0 HD21 LEU A 47 2.186 -4.756 -0.659 1.00 3.33 H new ATOM 0 HD22 LEU A 47 3.521 -3.616 -0.370 1.00 3.33 H new ATOM 0 HD23 LEU A 47 2.883 -4.597 0.971 1.00 3.33 H new ATOM 758 N LEU A 48 4.599 -1.848 3.902 1.00 33.21 N ATOM 759 CA LEU A 48 5.424 -0.978 4.746 1.00 43.32 C ATOM 760 C LEU A 48 6.421 -0.147 3.926 1.00 52.51 C ATOM 761 O LEU A 48 7.257 -0.694 3.208 1.00 51.25 O ATOM 762 CB LEU A 48 6.186 -1.807 5.786 1.00 63.34 C ATOM 763 CG LEU A 48 5.310 -2.569 6.793 1.00 44.14 C ATOM 764 CD1 LEU A 48 6.176 -3.263 7.834 1.00 10.31 C ATOM 765 CD2 LEU A 48 4.308 -1.630 7.461 1.00 14.35 C ATOM 0 H LEU A 48 5.067 -2.697 3.586 1.00 33.21 H new ATOM 0 HA LEU A 48 4.745 -0.288 5.248 1.00 43.32 H new ATOM 0 HB2 LEU A 48 6.816 -2.526 5.262 1.00 63.34 H new ATOM 0 HB3 LEU A 48 6.851 -1.143 6.338 1.00 63.34 H new ATOM 0 HG LEU A 48 4.749 -3.330 6.251 1.00 44.14 H new ATOM 0 HD11 LEU A 48 5.539 -3.798 8.539 1.00 10.31 H new ATOM 0 HD12 LEU A 48 6.843 -3.969 7.340 1.00 10.31 H new ATOM 0 HD13 LEU A 48 6.767 -2.520 8.370 1.00 10.31 H new ATOM 0 HD21 LEU A 48 3.699 -2.192 8.169 1.00 14.35 H new ATOM 0 HD22 LEU A 48 4.844 -0.842 7.989 1.00 14.35 H new ATOM 0 HD23 LEU A 48 3.664 -1.185 6.702 1.00 14.35 H new ATOM 777 N PRO A 49 6.355 1.196 4.029 1.00 31.35 N ATOM 778 CA PRO A 49 7.346 2.081 3.404 1.00 73.35 C ATOM 779 C PRO A 49 8.774 1.755 3.870 1.00 25.13 C ATOM 780 O PRO A 49 9.048 1.624 5.069 1.00 23.21 O ATOM 781 CB PRO A 49 6.924 3.492 3.851 1.00 71.04 C ATOM 782 CG PRO A 49 5.972 3.280 4.982 1.00 12.12 C ATOM 783 CD PRO A 49 5.312 1.951 4.737 1.00 3.23 C ATOM 0 HA PRO A 49 7.367 1.973 2.320 1.00 73.35 H new ATOM 0 HB2 PRO A 49 7.786 4.078 4.168 1.00 71.04 H new ATOM 0 HB3 PRO A 49 6.450 4.038 3.035 1.00 71.04 H new ATOM 0 HG2 PRO A 49 6.497 3.283 5.937 1.00 12.12 H new ATOM 0 HG3 PRO A 49 5.232 4.080 5.022 1.00 12.12 H new ATOM 0 HD2 PRO A 49 5.023 1.465 5.669 1.00 3.23 H new ATOM 0 HD3 PRO A 49 4.408 2.053 4.137 1.00 3.23 H new ATOM 791 N GLY A 50 9.676 1.619 2.912 1.00 34.12 N ATOM 792 CA GLY A 50 11.023 1.153 3.207 1.00 32.42 C ATOM 793 C GLY A 50 11.174 -0.349 2.999 1.00 31.34 C ATOM 794 O GLY A 50 12.078 -0.964 3.553 1.00 44.14 O ATOM 0 H GLY A 50 9.502 1.823 1.928 1.00 34.12 H new ATOM 0 HA2 GLY A 50 11.735 1.679 2.570 1.00 32.42 H new ATOM 0 HA3 GLY A 50 11.273 1.402 4.238 1.00 32.42 H new ATOM 798 N ALA A 51 10.259 -0.939 2.225 1.00 63.24 N ATOM 799 CA ALA A 51 10.315 -2.367 1.887 1.00 52.21 C ATOM 800 C ALA A 51 9.857 -2.625 0.439 1.00 31.21 C ATOM 801 O ALA A 51 8.660 -2.666 0.156 1.00 54.35 O ATOM 802 CB ALA A 51 9.452 -3.164 2.861 1.00 50.31 C ATOM 0 H ALA A 51 9.464 -0.447 1.817 1.00 63.24 H new ATOM 0 HA ALA A 51 11.352 -2.692 1.969 1.00 52.21 H new ATOM 0 HB1 ALA A 51 9.498 -4.223 2.605 1.00 50.31 H new ATOM 0 HB2 ALA A 51 9.821 -3.020 3.876 1.00 50.31 H new ATOM 0 HB3 ALA A 51 8.420 -2.820 2.798 1.00 50.31 H new ATOM 808 N LYS A 52 10.809 -2.803 -0.478 1.00 51.32 N ATOM 809 CA LYS A 52 10.477 -3.061 -1.888 1.00 41.43 C ATOM 810 C LYS A 52 9.986 -4.507 -2.101 1.00 14.35 C ATOM 811 O LYS A 52 10.728 -5.359 -2.590 1.00 71.23 O ATOM 812 CB LYS A 52 11.688 -2.793 -2.794 1.00 63.31 C ATOM 813 CG LYS A 52 12.255 -1.381 -2.691 1.00 34.31 C ATOM 814 CD LYS A 52 13.425 -1.184 -3.654 1.00 53.43 C ATOM 815 CE LYS A 52 14.120 0.149 -3.429 1.00 11.41 C ATOM 816 NZ LYS A 52 14.671 0.254 -2.053 1.00 13.34 N ATOM 0 H LYS A 52 11.809 -2.775 -0.277 1.00 51.32 H new ATOM 0 HA LYS A 52 9.670 -2.379 -2.155 1.00 41.43 H new ATOM 0 HB2 LYS A 52 12.475 -3.506 -2.547 1.00 63.31 H new ATOM 0 HB3 LYS A 52 11.400 -2.981 -3.828 1.00 63.31 H new ATOM 0 HG2 LYS A 52 11.473 -0.655 -2.912 1.00 34.31 H new ATOM 0 HG3 LYS A 52 12.586 -1.193 -1.670 1.00 34.31 H new ATOM 0 HD2 LYS A 52 14.142 -1.995 -3.526 1.00 53.43 H new ATOM 0 HD3 LYS A 52 13.064 -1.237 -4.681 1.00 53.43 H new ATOM 0 HE2 LYS A 52 14.925 0.267 -4.154 1.00 11.41 H new ATOM 0 HE3 LYS A 52 13.414 0.962 -3.602 1.00 11.41 H new ATOM 0 HZ1 LYS A 52 15.345 1.045 -2.008 1.00 13.34 H new ATOM 0 HZ2 LYS A 52 13.896 0.422 -1.380 1.00 13.34 H new ATOM 0 HZ3 LYS A 52 15.158 -0.631 -1.806 1.00 13.34 H new ATOM 830 N THR A 53 8.742 -4.780 -1.711 1.00 25.23 N ATOM 831 CA THR A 53 8.133 -6.107 -1.921 1.00 3.31 C ATOM 832 C THR A 53 6.613 -6.028 -2.113 1.00 52.14 C ATOM 833 O THR A 53 5.923 -5.291 -1.410 1.00 51.54 O ATOM 834 CB THR A 53 8.436 -7.094 -0.760 1.00 14.00 C ATOM 835 OG1 THR A 53 8.485 -6.405 0.499 1.00 62.42 O ATOM 836 CG2 THR A 53 9.741 -7.844 -1.004 1.00 75.35 C ATOM 0 H THR A 53 8.131 -4.107 -1.248 1.00 25.23 H new ATOM 0 HA THR A 53 8.591 -6.485 -2.835 1.00 3.31 H new ATOM 0 HB THR A 53 7.625 -7.821 -0.724 1.00 14.00 H new ATOM 0 HG1 THR A 53 8.183 -7.005 1.212 1.00 62.42 H new ATOM 0 HG21 THR A 53 9.928 -8.528 -0.176 1.00 75.35 H new ATOM 0 HG22 THR A 53 9.667 -8.410 -1.932 1.00 75.35 H new ATOM 0 HG23 THR A 53 10.562 -7.131 -1.078 1.00 75.35 H new ATOM 844 N PRO A 54 6.081 -6.796 -3.084 1.00 21.11 N ATOM 845 CA PRO A 54 4.633 -6.867 -3.354 1.00 34.33 C ATOM 846 C PRO A 54 3.862 -7.762 -2.362 1.00 3.04 C ATOM 847 O PRO A 54 4.365 -8.793 -1.908 1.00 72.31 O ATOM 848 CB PRO A 54 4.589 -7.468 -4.764 1.00 72.54 C ATOM 849 CG PRO A 54 5.798 -8.342 -4.827 1.00 23.03 C ATOM 850 CD PRO A 54 6.857 -7.643 -4.016 1.00 52.55 C ATOM 0 HA PRO A 54 4.155 -5.892 -3.256 1.00 34.33 H new ATOM 0 HB2 PRO A 54 3.675 -8.040 -4.925 1.00 72.54 H new ATOM 0 HB3 PRO A 54 4.618 -6.692 -5.529 1.00 72.54 H new ATOM 0 HG2 PRO A 54 5.586 -9.331 -4.422 1.00 23.03 H new ATOM 0 HG3 PRO A 54 6.125 -8.483 -5.857 1.00 23.03 H new ATOM 0 HD2 PRO A 54 7.487 -8.354 -3.481 1.00 52.55 H new ATOM 0 HD3 PRO A 54 7.515 -7.046 -4.647 1.00 52.55 H new ATOM 858 N ALA A 55 2.626 -7.370 -2.046 1.00 25.15 N ATOM 859 CA ALA A 55 1.748 -8.156 -1.169 1.00 40.11 C ATOM 860 C ALA A 55 0.552 -8.717 -1.952 1.00 54.31 C ATOM 861 O ALA A 55 -0.031 -8.021 -2.790 1.00 53.10 O ATOM 862 CB ALA A 55 1.261 -7.300 -0.003 1.00 23.10 C ATOM 0 H ALA A 55 2.205 -6.505 -2.387 1.00 25.15 H new ATOM 0 HA ALA A 55 2.322 -8.995 -0.775 1.00 40.11 H new ATOM 0 HB1 ALA A 55 0.611 -7.895 0.639 1.00 23.10 H new ATOM 0 HB2 ALA A 55 2.117 -6.949 0.573 1.00 23.10 H new ATOM 0 HB3 ALA A 55 0.706 -6.444 -0.387 1.00 23.10 H new ATOM 868 N ARG A 56 0.183 -9.967 -1.675 1.00 52.12 N ATOM 869 CA ARG A 56 -0.886 -10.638 -2.426 1.00 1.21 C ATOM 870 C ARG A 56 -2.277 -10.244 -1.900 1.00 13.53 C ATOM 871 O ARG A 56 -2.734 -10.757 -0.880 1.00 62.05 O ATOM 872 CB ARG A 56 -0.727 -12.165 -2.355 1.00 41.53 C ATOM 873 CG ARG A 56 -1.467 -12.905 -3.467 1.00 45.14 C ATOM 874 CD ARG A 56 -1.649 -14.391 -3.167 1.00 34.11 C ATOM 875 NE ARG A 56 -2.730 -14.627 -2.206 1.00 13.22 N ATOM 876 CZ ARG A 56 -3.901 -15.123 -2.526 1.00 53.13 C ATOM 877 NH1 ARG A 56 -4.151 -15.489 -3.745 1.00 73.52 N ATOM 878 NH2 ARG A 56 -4.811 -15.268 -1.618 1.00 12.12 N ATOM 0 H ARG A 56 0.604 -10.536 -0.941 1.00 52.12 H new ATOM 0 HA ARG A 56 -0.802 -10.314 -3.463 1.00 1.21 H new ATOM 0 HB2 ARG A 56 0.333 -12.415 -2.405 1.00 41.53 H new ATOM 0 HB3 ARG A 56 -1.092 -12.516 -1.390 1.00 41.53 H new ATOM 0 HG2 ARG A 56 -2.445 -12.446 -3.615 1.00 45.14 H new ATOM 0 HG3 ARG A 56 -0.917 -12.792 -4.401 1.00 45.14 H new ATOM 0 HD2 ARG A 56 -1.864 -14.924 -4.093 1.00 34.11 H new ATOM 0 HD3 ARG A 56 -0.718 -14.798 -2.773 1.00 34.11 H new ATOM 0 HE ARG A 56 -2.561 -14.391 -1.228 1.00 13.22 H new ATOM 0 HH11 ARG A 56 -3.434 -15.392 -4.464 1.00 73.52 H new ATOM 0 HH12 ARG A 56 -5.065 -15.874 -3.985 1.00 73.52 H new ATOM 0 HH21 ARG A 56 -4.617 -14.997 -0.654 1.00 12.12 H new ATOM 0 HH22 ARG A 56 -5.722 -15.654 -1.866 1.00 12.12 H new ATOM 892 N LEU A 57 -2.940 -9.325 -2.594 1.00 41.21 N ATOM 893 CA LEU A 57 -4.291 -8.898 -2.219 1.00 61.34 C ATOM 894 C LEU A 57 -5.356 -9.653 -3.033 1.00 13.44 C ATOM 895 O LEU A 57 -5.479 -9.475 -4.249 1.00 74.25 O ATOM 896 CB LEU A 57 -4.442 -7.382 -2.409 1.00 41.25 C ATOM 897 CG LEU A 57 -5.836 -6.805 -2.088 1.00 71.20 C ATOM 898 CD1 LEU A 57 -6.230 -7.088 -0.639 1.00 13.31 C ATOM 899 CD2 LEU A 57 -5.870 -5.305 -2.369 1.00 41.34 C ATOM 0 H LEU A 57 -2.567 -8.859 -3.421 1.00 41.21 H new ATOM 0 HA LEU A 57 -4.443 -9.136 -1.166 1.00 61.34 H new ATOM 0 HB2 LEU A 57 -3.707 -6.880 -1.779 1.00 41.25 H new ATOM 0 HB3 LEU A 57 -4.197 -7.137 -3.442 1.00 41.25 H new ATOM 0 HG LEU A 57 -6.562 -7.298 -2.735 1.00 71.20 H new ATOM 0 HD11 LEU A 57 -7.217 -6.670 -0.442 1.00 13.31 H new ATOM 0 HD12 LEU A 57 -6.252 -8.165 -0.472 1.00 13.31 H new ATOM 0 HD13 LEU A 57 -5.502 -6.632 0.032 1.00 13.31 H new ATOM 0 HD21 LEU A 57 -6.861 -4.914 -2.137 1.00 41.34 H new ATOM 0 HD22 LEU A 57 -5.127 -4.802 -1.750 1.00 41.34 H new ATOM 0 HD23 LEU A 57 -5.646 -5.127 -3.421 1.00 41.34 H new ATOM 911 N GLU A 58 -6.116 -10.500 -2.348 1.00 35.11 N ATOM 912 CA GLU A 58 -7.169 -11.297 -2.984 1.00 74.21 C ATOM 913 C GLU A 58 -8.486 -10.501 -3.035 1.00 31.12 C ATOM 914 O GLU A 58 -9.276 -10.519 -2.085 1.00 42.05 O ATOM 915 CB GLU A 58 -7.355 -12.607 -2.202 1.00 54.21 C ATOM 916 CG GLU A 58 -8.244 -13.639 -2.888 1.00 54.22 C ATOM 917 CD GLU A 58 -8.442 -14.882 -2.034 1.00 42.22 C ATOM 918 OE1 GLU A 58 -7.537 -15.745 -2.009 1.00 14.04 O ATOM 919 OE2 GLU A 58 -9.493 -14.987 -1.367 1.00 44.12 O ATOM 0 H GLU A 58 -6.024 -10.656 -1.344 1.00 35.11 H new ATOM 0 HA GLU A 58 -6.879 -11.532 -4.008 1.00 74.21 H new ATOM 0 HB2 GLU A 58 -6.375 -13.051 -2.026 1.00 54.21 H new ATOM 0 HB3 GLU A 58 -7.779 -12.374 -1.225 1.00 54.21 H new ATOM 0 HG2 GLU A 58 -9.214 -13.193 -3.108 1.00 54.22 H new ATOM 0 HG3 GLU A 58 -7.800 -13.922 -3.842 1.00 54.22 H new ATOM 926 N SER A 59 -8.709 -9.791 -4.141 1.00 4.42 N ATOM 927 CA SER A 59 -9.818 -8.824 -4.240 1.00 34.20 C ATOM 928 C SER A 59 -11.032 -9.382 -4.997 1.00 32.45 C ATOM 929 O SER A 59 -11.062 -10.548 -5.397 1.00 2.55 O ATOM 930 CB SER A 59 -9.337 -7.546 -4.942 1.00 64.12 C ATOM 931 OG SER A 59 -9.116 -7.768 -6.329 1.00 32.34 O ATOM 0 H SER A 59 -8.140 -9.863 -4.984 1.00 4.42 H new ATOM 0 HA SER A 59 -10.135 -8.608 -3.220 1.00 34.20 H new ATOM 0 HB2 SER A 59 -10.077 -6.757 -4.812 1.00 64.12 H new ATOM 0 HB3 SER A 59 -8.415 -7.198 -4.476 1.00 64.12 H new ATOM 0 HG SER A 59 -8.723 -8.656 -6.460 1.00 32.34 H new ATOM 937 N GLN A 60 -12.034 -8.521 -5.192 1.00 54.21 N ATOM 938 CA GLN A 60 -13.274 -8.891 -5.888 1.00 25.22 C ATOM 939 C GLN A 60 -13.046 -9.125 -7.391 1.00 34.20 C ATOM 940 O GLN A 60 -13.695 -9.979 -8.000 1.00 74.44 O ATOM 941 CB GLN A 60 -14.332 -7.795 -5.684 1.00 61.41 C ATOM 942 CG GLN A 60 -14.698 -7.558 -4.223 1.00 23.40 C ATOM 943 CD GLN A 60 -15.660 -6.396 -4.036 1.00 32.03 C ATOM 944 OE1 GLN A 60 -16.875 -6.563 -4.059 1.00 53.10 O ATOM 945 NE2 GLN A 60 -15.128 -5.205 -3.850 1.00 24.12 N ATOM 0 H GLN A 60 -12.012 -7.552 -4.875 1.00 54.21 H new ATOM 0 HA GLN A 60 -13.625 -9.830 -5.460 1.00 25.22 H new ATOM 0 HB2 GLN A 60 -13.963 -6.863 -6.112 1.00 61.41 H new ATOM 0 HB3 GLN A 60 -15.233 -8.065 -6.235 1.00 61.41 H new ATOM 0 HG2 GLN A 60 -15.146 -8.464 -3.814 1.00 23.40 H new ATOM 0 HG3 GLN A 60 -13.789 -7.366 -3.652 1.00 23.40 H new ATOM 0 HE21 GLN A 60 -14.114 -5.096 -3.836 1.00 24.12 H new ATOM 0 HE22 GLN A 60 -15.730 -4.392 -3.720 1.00 24.12 H new ATOM 954 N ILE A 61 -12.133 -8.360 -7.992 1.00 41.04 N ATOM 955 CA ILE A 61 -11.822 -8.512 -9.422 1.00 53.22 C ATOM 956 C ILE A 61 -10.936 -9.739 -9.669 1.00 42.43 C ATOM 957 O ILE A 61 -10.982 -10.356 -10.735 1.00 44.32 O ATOM 958 CB ILE A 61 -11.111 -7.257 -9.997 1.00 11.41 C ATOM 959 CG1 ILE A 61 -9.721 -7.064 -9.360 1.00 11.32 C ATOM 960 CG2 ILE A 61 -11.970 -6.013 -9.786 1.00 14.22 C ATOM 961 CD1 ILE A 61 -8.925 -5.926 -9.962 1.00 41.41 C ATOM 0 H ILE A 61 -11.597 -7.633 -7.518 1.00 41.04 H new ATOM 0 HA ILE A 61 -12.777 -8.641 -9.932 1.00 53.22 H new ATOM 0 HB ILE A 61 -10.973 -7.410 -11.067 1.00 11.41 H new ATOM 0 HG12 ILE A 61 -9.843 -6.884 -8.292 1.00 11.32 H new ATOM 0 HG13 ILE A 61 -9.152 -7.988 -9.465 1.00 11.32 H new ATOM 0 HG21 ILE A 61 -11.457 -5.143 -10.195 1.00 14.22 H new ATOM 0 HG22 ILE A 61 -12.927 -6.141 -10.293 1.00 14.22 H new ATOM 0 HG23 ILE A 61 -12.141 -5.866 -8.720 1.00 14.22 H new ATOM 0 HD11 ILE A 61 -7.959 -5.853 -9.462 1.00 41.41 H new ATOM 0 HD12 ILE A 61 -8.770 -6.113 -11.025 1.00 41.41 H new ATOM 0 HD13 ILE A 61 -9.472 -4.992 -9.834 1.00 41.41 H new ATOM 973 N GLY A 62 -10.133 -10.077 -8.667 1.00 14.13 N ATOM 974 CA GLY A 62 -9.198 -11.187 -8.775 1.00 35.44 C ATOM 975 C GLY A 62 -8.030 -11.040 -7.808 1.00 24.24 C ATOM 976 O GLY A 62 -8.098 -10.264 -6.851 1.00 40.01 O ATOM 0 H GLY A 62 -10.112 -9.595 -7.768 1.00 14.13 H new ATOM 0 HA2 GLY A 62 -9.720 -12.123 -8.575 1.00 35.44 H new ATOM 0 HA3 GLY A 62 -8.820 -11.245 -9.796 1.00 35.44 H new ATOM 980 N THR A 63 -6.948 -11.765 -8.059 1.00 71.03 N ATOM 981 CA THR A 63 -5.771 -11.712 -7.183 1.00 33.41 C ATOM 982 C THR A 63 -4.663 -10.842 -7.789 1.00 50.13 C ATOM 983 O THR A 63 -4.153 -11.128 -8.872 1.00 65.42 O ATOM 984 CB THR A 63 -5.208 -13.124 -6.898 1.00 12.12 C ATOM 985 OG1 THR A 63 -6.241 -13.969 -6.364 1.00 34.42 O ATOM 986 CG2 THR A 63 -4.048 -13.057 -5.909 1.00 53.35 C ATOM 0 H THR A 63 -6.855 -12.395 -8.856 1.00 71.03 H new ATOM 0 HA THR A 63 -6.102 -11.268 -6.244 1.00 33.41 H new ATOM 0 HB THR A 63 -4.845 -13.539 -7.838 1.00 12.12 H new ATOM 0 HG1 THR A 63 -5.876 -14.861 -6.188 1.00 34.42 H new ATOM 0 HG21 THR A 63 -3.669 -14.062 -5.724 1.00 53.35 H new ATOM 0 HG22 THR A 63 -3.252 -12.439 -6.324 1.00 53.35 H new ATOM 0 HG23 THR A 63 -4.394 -12.622 -4.971 1.00 53.35 H new ATOM 994 N LEU A 64 -4.289 -9.782 -7.078 1.00 63.22 N ATOM 995 CA LEU A 64 -3.241 -8.867 -7.540 1.00 43.21 C ATOM 996 C LEU A 64 -2.213 -8.590 -6.432 1.00 41.35 C ATOM 997 O LEU A 64 -2.521 -8.682 -5.246 1.00 41.21 O ATOM 998 CB LEU A 64 -3.873 -7.560 -8.070 1.00 32.50 C ATOM 999 CG LEU A 64 -4.975 -6.924 -7.190 1.00 63.31 C ATOM 1000 CD1 LEU A 64 -4.400 -6.290 -5.927 1.00 74.50 C ATOM 1001 CD2 LEU A 64 -5.773 -5.896 -7.990 1.00 42.05 C ATOM 0 H LEU A 64 -4.695 -9.532 -6.177 1.00 63.22 H new ATOM 0 HA LEU A 64 -2.703 -9.342 -8.360 1.00 43.21 H new ATOM 0 HB2 LEU A 64 -3.078 -6.827 -8.206 1.00 32.50 H new ATOM 0 HB3 LEU A 64 -4.295 -7.759 -9.055 1.00 32.50 H new ATOM 0 HG LEU A 64 -5.645 -7.725 -6.877 1.00 63.31 H new ATOM 0 HD11 LEU A 64 -5.208 -5.855 -5.338 1.00 74.50 H new ATOM 0 HD12 LEU A 64 -3.890 -7.052 -5.337 1.00 74.50 H new ATOM 0 HD13 LEU A 64 -3.691 -5.509 -6.202 1.00 74.50 H new ATOM 0 HD21 LEU A 64 -6.544 -5.459 -7.355 1.00 42.05 H new ATOM 0 HD22 LEU A 64 -5.104 -5.110 -8.342 1.00 42.05 H new ATOM 0 HD23 LEU A 64 -6.241 -6.384 -8.845 1.00 42.05 H new ATOM 1013 N ARG A 65 -0.983 -8.274 -6.826 1.00 2.54 N ATOM 1014 CA ARG A 65 0.091 -7.996 -5.865 1.00 44.13 C ATOM 1015 C ARG A 65 0.583 -6.549 -5.986 1.00 45.42 C ATOM 1016 O ARG A 65 1.144 -6.157 -7.006 1.00 14.41 O ATOM 1017 CB ARG A 65 1.249 -8.985 -6.065 1.00 53.33 C ATOM 1018 CG ARG A 65 0.831 -10.439 -5.864 1.00 54.41 C ATOM 1019 CD ARG A 65 1.990 -11.414 -6.043 1.00 50.14 C ATOM 1020 NE ARG A 65 1.530 -12.799 -5.959 1.00 40.32 N ATOM 1021 CZ ARG A 65 2.280 -13.817 -5.641 1.00 4.51 C ATOM 1022 NH1 ARG A 65 3.536 -13.668 -5.369 1.00 35.24 N ATOM 1023 NH2 ARG A 65 1.757 -14.997 -5.597 1.00 13.13 N ATOM 0 H ARG A 65 -0.700 -8.203 -7.804 1.00 2.54 H new ATOM 0 HA ARG A 65 -0.309 -8.125 -4.859 1.00 44.13 H new ATOM 0 HB2 ARG A 65 1.653 -8.864 -7.070 1.00 53.33 H new ATOM 0 HB3 ARG A 65 2.051 -8.743 -5.367 1.00 53.33 H new ATOM 0 HG2 ARG A 65 0.413 -10.558 -4.865 1.00 54.41 H new ATOM 0 HG3 ARG A 65 0.040 -10.687 -6.572 1.00 54.41 H new ATOM 0 HD2 ARG A 65 2.467 -11.244 -7.008 1.00 50.14 H new ATOM 0 HD3 ARG A 65 2.745 -11.231 -5.278 1.00 50.14 H new ATOM 0 HE ARG A 65 0.548 -12.983 -6.165 1.00 40.32 H new ATOM 0 HH11 ARG A 65 3.958 -12.740 -5.401 1.00 35.24 H new ATOM 0 HH12 ARG A 65 4.104 -14.479 -5.123 1.00 35.24 H new ATOM 0 HH21 ARG A 65 0.768 -15.125 -5.810 1.00 13.13 H new ATOM 0 HH22 ARG A 65 2.333 -15.801 -5.350 1.00 13.13 H new ATOM 1037 N MET A 66 0.361 -5.760 -4.934 1.00 44.15 N ATOM 1038 CA MET A 66 0.745 -4.340 -4.928 1.00 71.22 C ATOM 1039 C MET A 66 2.076 -4.119 -4.192 1.00 23.45 C ATOM 1040 O MET A 66 2.351 -4.764 -3.180 1.00 62.32 O ATOM 1041 CB MET A 66 -0.364 -3.494 -4.289 1.00 61.21 C ATOM 1042 CG MET A 66 -1.663 -3.487 -5.088 1.00 61.12 C ATOM 1043 SD MET A 66 -2.924 -2.423 -4.356 1.00 13.14 S ATOM 1044 CE MET A 66 -4.256 -2.584 -5.547 1.00 31.53 C ATOM 0 H MET A 66 -0.083 -6.077 -4.072 1.00 44.15 H new ATOM 0 HA MET A 66 0.882 -4.026 -5.963 1.00 71.22 H new ATOM 0 HB2 MET A 66 -0.566 -3.872 -3.287 1.00 61.21 H new ATOM 0 HB3 MET A 66 -0.010 -2.469 -4.178 1.00 61.21 H new ATOM 0 HG2 MET A 66 -1.458 -3.153 -6.105 1.00 61.12 H new ATOM 0 HG3 MET A 66 -2.048 -4.505 -5.158 1.00 61.12 H new ATOM 0 HE1 MET A 66 -4.933 -1.735 -5.452 1.00 31.53 H new ATOM 0 HE2 MET A 66 -3.842 -2.607 -6.555 1.00 31.53 H new ATOM 0 HE3 MET A 66 -4.803 -3.508 -5.358 1.00 31.53 H new ATOM 1054 N SER A 67 2.897 -3.204 -4.709 1.00 3.44 N ATOM 1055 CA SER A 67 4.224 -2.928 -4.132 1.00 70.22 C ATOM 1056 C SER A 67 4.510 -1.422 -4.044 1.00 1.31 C ATOM 1057 O SER A 67 4.046 -0.635 -4.874 1.00 14.43 O ATOM 1058 CB SER A 67 5.315 -3.608 -4.971 1.00 32.30 C ATOM 1059 OG SER A 67 5.299 -3.145 -6.313 1.00 13.31 O ATOM 0 H SER A 67 2.671 -2.638 -5.527 1.00 3.44 H new ATOM 0 HA SER A 67 4.228 -3.331 -3.119 1.00 70.22 H new ATOM 0 HB2 SER A 67 6.292 -3.412 -4.528 1.00 32.30 H new ATOM 0 HB3 SER A 67 5.168 -4.688 -4.955 1.00 32.30 H new ATOM 0 HG SER A 67 6.005 -3.594 -6.822 1.00 13.31 H new ATOM 1065 N LEU A 68 5.281 -1.028 -3.026 1.00 35.22 N ATOM 1066 CA LEU A 68 5.660 0.378 -2.822 1.00 2.24 C ATOM 1067 C LEU A 68 7.084 0.664 -3.337 1.00 11.44 C ATOM 1068 O LEU A 68 8.067 0.174 -2.777 1.00 52.04 O ATOM 1069 CB LEU A 68 5.584 0.744 -1.331 1.00 52.11 C ATOM 1070 CG LEU A 68 4.212 0.566 -0.664 1.00 75.04 C ATOM 1071 CD1 LEU A 68 4.286 0.948 0.813 1.00 44.12 C ATOM 1072 CD2 LEU A 68 3.145 1.394 -1.381 1.00 43.21 C ATOM 0 H LEU A 68 5.658 -1.666 -2.325 1.00 35.22 H new ATOM 0 HA LEU A 68 4.956 0.986 -3.390 1.00 2.24 H new ATOM 0 HB2 LEU A 68 6.310 0.137 -0.791 1.00 52.11 H new ATOM 0 HB3 LEU A 68 5.890 1.784 -1.216 1.00 52.11 H new ATOM 0 HG LEU A 68 3.930 -0.484 -0.738 1.00 75.04 H new ATOM 0 HD11 LEU A 68 3.306 0.817 1.272 1.00 44.12 H new ATOM 0 HD12 LEU A 68 5.012 0.310 1.318 1.00 44.12 H new ATOM 0 HD13 LEU A 68 4.593 1.990 0.904 1.00 44.12 H new ATOM 0 HD21 LEU A 68 2.183 1.251 -0.890 1.00 43.21 H new ATOM 0 HD22 LEU A 68 3.418 2.449 -1.345 1.00 43.21 H new ATOM 0 HD23 LEU A 68 3.073 1.073 -2.420 1.00 43.21 H new ATOM 1084 N VAL A 69 7.191 1.458 -4.399 1.00 14.23 N ATOM 1085 CA VAL A 69 8.496 1.887 -4.928 1.00 25.33 C ATOM 1086 C VAL A 69 8.503 3.395 -5.228 1.00 3.12 C ATOM 1087 O VAL A 69 7.448 4.022 -5.290 1.00 61.14 O ATOM 1088 CB VAL A 69 8.875 1.104 -6.213 1.00 71.44 C ATOM 1089 CG1 VAL A 69 9.162 -0.364 -5.897 1.00 10.42 C ATOM 1090 CG2 VAL A 69 7.770 1.226 -7.262 1.00 64.44 C ATOM 0 H VAL A 69 6.391 1.822 -4.916 1.00 14.23 H new ATOM 0 HA VAL A 69 9.236 1.673 -4.157 1.00 25.33 H new ATOM 0 HB VAL A 69 9.786 1.543 -6.620 1.00 71.44 H new ATOM 0 HG11 VAL A 69 9.425 -0.889 -6.815 1.00 10.42 H new ATOM 0 HG12 VAL A 69 9.991 -0.429 -5.192 1.00 10.42 H new ATOM 0 HG13 VAL A 69 8.275 -0.822 -5.458 1.00 10.42 H new ATOM 0 HG21 VAL A 69 8.054 0.670 -8.156 1.00 64.44 H new ATOM 0 HG22 VAL A 69 6.842 0.819 -6.861 1.00 64.44 H new ATOM 0 HG23 VAL A 69 7.625 2.276 -7.518 1.00 64.44 H new ATOM 1100 N ASN A 70 9.698 3.970 -5.407 1.00 44.02 N ATOM 1101 CA ASN A 70 9.847 5.409 -5.698 1.00 25.50 C ATOM 1102 C ASN A 70 9.324 6.281 -4.540 1.00 54.10 C ATOM 1103 O ASN A 70 8.885 7.415 -4.749 1.00 14.43 O ATOM 1104 CB ASN A 70 9.125 5.781 -7.007 1.00 15.53 C ATOM 1105 CG ASN A 70 9.713 5.078 -8.218 1.00 24.21 C ATOM 1106 OD1 ASN A 70 9.190 3.916 -8.544 1.00 24.44 O flip ATOM 1107 ND2 ASN A 70 10.629 5.579 -8.861 1.00 55.44 N flip ATOM 0 H ASN A 70 10.581 3.462 -5.356 1.00 44.02 H new ATOM 0 HA ASN A 70 10.913 5.606 -5.814 1.00 25.50 H new ATOM 0 HB2 ASN A 70 8.069 5.526 -6.920 1.00 15.53 H new ATOM 0 HB3 ASN A 70 9.181 6.859 -7.155 1.00 15.53 H new ATOM 0 HD21 ASN A 70 11.013 6.482 -8.583 1.00 55.44 H new ATOM 0 HD22 ASN A 70 11.007 5.093 -9.674 1.00 55.44 H new ATOM 1114 N ILE A 71 9.401 5.756 -3.318 1.00 21.35 N ATOM 1115 CA ILE A 71 8.897 6.460 -2.133 1.00 11.20 C ATOM 1116 C ILE A 71 9.744 7.708 -1.821 1.00 31.53 C ATOM 1117 O ILE A 71 10.903 7.599 -1.413 1.00 50.42 O ATOM 1118 CB ILE A 71 8.885 5.525 -0.897 1.00 44.45 C ATOM 1119 CG1 ILE A 71 8.154 4.208 -1.223 1.00 41.13 C ATOM 1120 CG2 ILE A 71 8.230 6.222 0.295 1.00 32.00 C ATOM 1121 CD1 ILE A 71 8.152 3.208 -0.087 1.00 62.51 C ATOM 0 H ILE A 71 9.809 4.842 -3.119 1.00 21.35 H new ATOM 0 HA ILE A 71 7.877 6.774 -2.355 1.00 11.20 H new ATOM 0 HB ILE A 71 9.916 5.289 -0.633 1.00 44.45 H new ATOM 0 HG12 ILE A 71 7.123 4.434 -1.496 1.00 41.13 H new ATOM 0 HG13 ILE A 71 8.622 3.751 -2.095 1.00 41.13 H new ATOM 0 HG21 ILE A 71 8.230 5.551 1.154 1.00 32.00 H new ATOM 0 HG22 ILE A 71 8.788 7.125 0.540 1.00 32.00 H new ATOM 0 HG23 ILE A 71 7.203 6.487 0.042 1.00 32.00 H new ATOM 0 HD11 ILE A 71 7.619 2.309 -0.395 1.00 62.51 H new ATOM 0 HD12 ILE A 71 9.179 2.950 0.173 1.00 62.51 H new ATOM 0 HD13 ILE A 71 7.657 3.644 0.781 1.00 62.51 H new ATOM 1133 N THR A 72 9.158 8.891 -2.018 1.00 52.55 N ATOM 1134 CA THR A 72 9.870 10.165 -1.806 1.00 24.02 C ATOM 1135 C THR A 72 8.965 11.253 -1.203 1.00 13.54 C ATOM 1136 O THR A 72 7.744 11.211 -1.353 1.00 32.42 O ATOM 1137 CB THR A 72 10.485 10.708 -3.126 1.00 75.01 C ATOM 1138 OG1 THR A 72 9.580 10.505 -4.228 1.00 72.41 O ATOM 1139 CG2 THR A 72 11.828 10.048 -3.421 1.00 72.53 C ATOM 0 H THR A 72 8.191 8.999 -2.324 1.00 52.55 H new ATOM 0 HA THR A 72 10.666 9.938 -1.097 1.00 24.02 H new ATOM 0 HB THR A 72 10.651 11.778 -2.999 1.00 75.01 H new ATOM 0 HG1 THR A 72 9.983 10.854 -5.050 1.00 72.41 H new ATOM 0 HG21 THR A 72 12.234 10.448 -4.350 1.00 72.53 H new ATOM 0 HG22 THR A 72 12.521 10.252 -2.605 1.00 72.53 H new ATOM 0 HG23 THR A 72 11.690 8.971 -3.519 1.00 72.53 H new ATOM 1147 N PRO A 73 9.568 12.244 -0.509 1.00 14.40 N ATOM 1148 CA PRO A 73 8.830 13.376 0.096 1.00 52.35 C ATOM 1149 C PRO A 73 8.007 14.187 -0.928 1.00 3.24 C ATOM 1150 O PRO A 73 8.294 14.170 -2.129 1.00 54.04 O ATOM 1151 CB PRO A 73 9.948 14.247 0.700 1.00 32.42 C ATOM 1152 CG PRO A 73 11.103 13.320 0.883 1.00 0.40 C ATOM 1153 CD PRO A 73 11.018 12.334 -0.245 1.00 61.33 C ATOM 0 HA PRO A 73 8.093 13.028 0.820 1.00 52.35 H new ATOM 0 HB2 PRO A 73 10.206 15.073 0.038 1.00 32.42 H new ATOM 0 HB3 PRO A 73 9.638 14.684 1.649 1.00 32.42 H new ATOM 0 HG2 PRO A 73 12.048 13.863 0.858 1.00 0.40 H new ATOM 0 HG3 PRO A 73 11.051 12.816 1.848 1.00 0.40 H new ATOM 0 HD2 PRO A 73 11.566 12.678 -1.122 1.00 61.33 H new ATOM 0 HD3 PRO A 73 11.437 11.367 0.034 1.00 61.33 H new ATOM 1161 N ASP A 74 6.991 14.902 -0.444 1.00 23.33 N ATOM 1162 CA ASP A 74 6.107 15.691 -1.315 1.00 52.43 C ATOM 1163 C ASP A 74 5.595 16.964 -0.613 1.00 4.55 C ATOM 1164 O ASP A 74 5.681 17.095 0.611 1.00 0.13 O ATOM 1165 CB ASP A 74 4.926 14.822 -1.772 1.00 43.43 C ATOM 1166 CG ASP A 74 3.941 15.578 -2.648 1.00 65.04 C ATOM 1167 OD1 ASP A 74 4.273 15.863 -3.817 1.00 64.34 O ATOM 1168 OD2 ASP A 74 2.837 15.907 -2.168 1.00 62.34 O ATOM 0 H ASP A 74 6.756 14.954 0.547 1.00 23.33 H new ATOM 0 HA ASP A 74 6.685 16.010 -2.182 1.00 52.43 H new ATOM 0 HB2 ASP A 74 5.306 13.961 -2.321 1.00 43.43 H new ATOM 0 HB3 ASP A 74 4.404 14.437 -0.896 1.00 43.43 H new ATOM 1173 N ALA A 75 5.070 17.903 -1.406 1.00 23.33 N ATOM 1174 CA ALA A 75 4.479 19.142 -0.884 1.00 41.34 C ATOM 1175 C ALA A 75 3.377 18.859 0.153 1.00 30.10 C ATOM 1176 O ALA A 75 3.372 19.436 1.243 1.00 1.55 O ATOM 1177 CB ALA A 75 3.923 19.974 -2.033 1.00 25.30 C ATOM 0 H ALA A 75 5.042 17.828 -2.423 1.00 23.33 H new ATOM 0 HA ALA A 75 5.266 19.701 -0.378 1.00 41.34 H new ATOM 0 HB1 ALA A 75 3.486 20.892 -1.639 1.00 25.30 H new ATOM 0 HB2 ALA A 75 4.728 20.223 -2.725 1.00 25.30 H new ATOM 0 HB3 ALA A 75 3.157 19.403 -2.558 1.00 25.30 H new ATOM 1183 N ASP A 76 2.440 17.978 -0.194 1.00 11.42 N ATOM 1184 CA ASP A 76 1.388 17.559 0.738 1.00 0.54 C ATOM 1185 C ASP A 76 1.961 16.660 1.841 1.00 61.55 C ATOM 1186 O ASP A 76 1.625 16.805 3.020 1.00 32.21 O ATOM 1187 CB ASP A 76 0.275 16.813 -0.007 1.00 53.33 C ATOM 1188 CG ASP A 76 -0.526 17.715 -0.926 1.00 41.11 C ATOM 1189 OD1 ASP A 76 -0.154 17.855 -2.106 1.00 43.00 O ATOM 1190 OD2 ASP A 76 -1.554 18.268 -0.478 1.00 1.14 O ATOM 0 H ASP A 76 2.386 17.539 -1.113 1.00 11.42 H new ATOM 0 HA ASP A 76 0.972 18.456 1.197 1.00 0.54 H new ATOM 0 HB2 ASP A 76 0.714 16.005 -0.592 1.00 53.33 H new ATOM 0 HB3 ASP A 76 -0.396 16.353 0.718 1.00 53.33 H new ATOM 1195 N GLY A 77 2.821 15.729 1.446 1.00 52.13 N ATOM 1196 CA GLY A 77 3.445 14.830 2.406 1.00 71.12 C ATOM 1197 C GLY A 77 4.443 13.876 1.763 1.00 63.04 C ATOM 1198 O GLY A 77 5.656 14.080 1.850 1.00 2.15 O ATOM 0 H GLY A 77 3.100 15.578 0.476 1.00 52.13 H new ATOM 0 HA2 GLY A 77 3.953 15.418 3.170 1.00 71.12 H new ATOM 0 HA3 GLY A 77 2.671 14.252 2.911 1.00 71.12 H new ATOM 1202 N THR A 78 3.935 12.835 1.103 1.00 3.43 N ATOM 1203 CA THR A 78 4.795 11.811 0.488 1.00 11.45 C ATOM 1204 C THR A 78 4.143 11.196 -0.759 1.00 41.04 C ATOM 1205 O THR A 78 2.944 10.921 -0.773 1.00 33.04 O ATOM 1206 CB THR A 78 5.127 10.673 1.491 1.00 75.24 C ATOM 1207 OG1 THR A 78 5.770 11.213 2.654 1.00 60.33 O ATOM 1208 CG2 THR A 78 6.032 9.615 0.861 1.00 32.23 C ATOM 0 H THR A 78 2.936 12.674 0.978 1.00 3.43 H new ATOM 0 HA THR A 78 5.715 12.317 0.197 1.00 11.45 H new ATOM 0 HB THR A 78 4.187 10.199 1.772 1.00 75.24 H new ATOM 0 HG1 THR A 78 5.098 11.622 3.239 1.00 60.33 H new ATOM 0 HG21 THR A 78 6.243 8.835 1.592 1.00 32.23 H new ATOM 0 HG22 THR A 78 5.533 9.177 -0.003 1.00 32.23 H new ATOM 0 HG23 THR A 78 6.967 10.078 0.544 1.00 32.23 H new ATOM 1216 N THR A 79 4.937 10.984 -1.808 1.00 23.12 N ATOM 1217 CA THR A 79 4.451 10.341 -3.041 1.00 14.43 C ATOM 1218 C THR A 79 5.257 9.080 -3.369 1.00 72.42 C ATOM 1219 O THR A 79 6.472 9.033 -3.167 1.00 73.24 O ATOM 1220 CB THR A 79 4.502 11.293 -4.261 1.00 2.44 C ATOM 1221 OG1 THR A 79 5.822 11.839 -4.419 1.00 44.34 O ATOM 1222 CG2 THR A 79 3.491 12.425 -4.123 1.00 3.15 C ATOM 0 H THR A 79 5.922 11.247 -1.834 1.00 23.12 H new ATOM 0 HA THR A 79 3.412 10.074 -2.848 1.00 14.43 H new ATOM 0 HB THR A 79 4.246 10.709 -5.145 1.00 2.44 H new ATOM 0 HG1 THR A 79 5.838 12.437 -5.195 1.00 44.34 H new ATOM 0 HG21 THR A 79 3.552 13.076 -4.995 1.00 3.15 H new ATOM 0 HG22 THR A 79 2.486 12.009 -4.050 1.00 3.15 H new ATOM 0 HG23 THR A 79 3.711 13.002 -3.224 1.00 3.15 H new ATOM 1230 N LEU A 80 4.571 8.059 -3.875 1.00 4.34 N ATOM 1231 CA LEU A 80 5.210 6.786 -4.216 1.00 24.11 C ATOM 1232 C LEU A 80 4.503 6.097 -5.397 1.00 3.53 C ATOM 1233 O LEU A 80 3.314 6.308 -5.633 1.00 52.30 O ATOM 1234 CB LEU A 80 5.249 5.867 -2.974 1.00 24.12 C ATOM 1235 CG LEU A 80 3.916 5.691 -2.209 1.00 45.33 C ATOM 1236 CD1 LEU A 80 2.978 4.720 -2.927 1.00 13.50 C ATOM 1237 CD2 LEU A 80 4.174 5.225 -0.775 1.00 33.13 C ATOM 0 H LEU A 80 3.568 8.086 -4.060 1.00 4.34 H new ATOM 0 HA LEU A 80 6.233 6.989 -4.532 1.00 24.11 H new ATOM 0 HB2 LEU A 80 5.596 4.882 -3.288 1.00 24.12 H new ATOM 0 HB3 LEU A 80 5.992 6.261 -2.280 1.00 24.12 H new ATOM 0 HG LEU A 80 3.425 6.664 -2.178 1.00 45.33 H new ATOM 0 HD11 LEU A 80 2.052 4.622 -2.360 1.00 13.50 H new ATOM 0 HD12 LEU A 80 2.754 5.100 -3.924 1.00 13.50 H new ATOM 0 HD13 LEU A 80 3.458 3.745 -3.010 1.00 13.50 H new ATOM 0 HD21 LEU A 80 3.224 5.107 -0.254 1.00 33.13 H new ATOM 0 HD22 LEU A 80 4.699 4.270 -0.792 1.00 33.13 H new ATOM 0 HD23 LEU A 80 4.783 5.965 -0.256 1.00 33.13 H new ATOM 1249 N THR A 81 5.246 5.289 -6.145 1.00 35.15 N ATOM 1250 CA THR A 81 4.677 4.520 -7.258 1.00 45.02 C ATOM 1251 C THR A 81 4.060 3.211 -6.752 1.00 53.41 C ATOM 1252 O THR A 81 4.776 2.262 -6.424 1.00 4.52 O ATOM 1253 CB THR A 81 5.741 4.175 -8.333 1.00 53.55 C ATOM 1254 OG1 THR A 81 6.409 5.364 -8.785 1.00 73.33 O ATOM 1255 CG2 THR A 81 5.109 3.471 -9.531 1.00 31.13 C ATOM 0 H THR A 81 6.246 5.146 -6.005 1.00 35.15 H new ATOM 0 HA THR A 81 3.911 5.150 -7.709 1.00 45.02 H new ATOM 0 HB THR A 81 6.465 3.504 -7.870 1.00 53.55 H new ATOM 0 HG1 THR A 81 7.077 5.127 -9.461 1.00 73.33 H new ATOM 0 HG21 THR A 81 5.880 3.242 -10.267 1.00 31.13 H new ATOM 0 HG22 THR A 81 4.636 2.546 -9.201 1.00 31.13 H new ATOM 0 HG23 THR A 81 4.359 4.121 -9.981 1.00 31.13 H new ATOM 1263 N LEU A 82 2.734 3.172 -6.669 1.00 31.11 N ATOM 1264 CA LEU A 82 2.021 1.959 -6.264 1.00 55.15 C ATOM 1265 C LEU A 82 1.857 1.027 -7.476 1.00 2.31 C ATOM 1266 O LEU A 82 1.031 1.270 -8.357 1.00 30.53 O ATOM 1267 CB LEU A 82 0.650 2.336 -5.651 1.00 34.50 C ATOM 1268 CG LEU A 82 -0.125 1.213 -4.917 1.00 4.41 C ATOM 1269 CD1 LEU A 82 -0.811 0.264 -5.899 1.00 33.11 C ATOM 1270 CD2 LEU A 82 0.799 0.435 -3.981 1.00 62.14 C ATOM 0 H LEU A 82 2.128 3.966 -6.876 1.00 31.11 H new ATOM 0 HA LEU A 82 2.595 1.430 -5.504 1.00 55.15 H new ATOM 0 HB2 LEU A 82 0.807 3.154 -4.948 1.00 34.50 H new ATOM 0 HB3 LEU A 82 0.015 2.719 -6.450 1.00 34.50 H new ATOM 0 HG LEU A 82 -0.901 1.693 -4.321 1.00 4.41 H new ATOM 0 HD11 LEU A 82 -1.344 -0.509 -5.346 1.00 33.11 H new ATOM 0 HD12 LEU A 82 -1.517 0.823 -6.512 1.00 33.11 H new ATOM 0 HD13 LEU A 82 -0.062 -0.200 -6.540 1.00 33.11 H new ATOM 0 HD21 LEU A 82 0.232 -0.348 -3.477 1.00 62.14 H new ATOM 0 HD22 LEU A 82 1.606 -0.016 -4.559 1.00 62.14 H new ATOM 0 HD23 LEU A 82 1.220 1.113 -3.238 1.00 62.14 H new ATOM 1282 N ARG A 83 2.674 -0.019 -7.535 1.00 1.24 N ATOM 1283 CA ARG A 83 2.621 -0.971 -8.651 1.00 12.51 C ATOM 1284 C ARG A 83 1.625 -2.108 -8.378 1.00 22.10 C ATOM 1285 O ARG A 83 1.593 -2.668 -7.286 1.00 1.34 O ATOM 1286 CB ARG A 83 4.013 -1.554 -8.930 1.00 43.21 C ATOM 1287 CG ARG A 83 5.038 -0.525 -9.399 1.00 64.42 C ATOM 1288 CD ARG A 83 6.330 -1.189 -9.869 1.00 55.24 C ATOM 1289 NE ARG A 83 7.301 -0.215 -10.363 1.00 51.22 N ATOM 1290 CZ ARG A 83 7.389 0.173 -11.607 1.00 12.31 C ATOM 1291 NH1 ARG A 83 6.575 -0.282 -12.508 1.00 43.52 N ATOM 1292 NH2 ARG A 83 8.296 1.026 -11.949 1.00 0.43 N ATOM 0 H ARG A 83 3.379 -0.233 -6.830 1.00 1.24 H new ATOM 0 HA ARG A 83 2.279 -0.423 -9.529 1.00 12.51 H new ATOM 0 HB2 ARG A 83 4.383 -2.032 -8.023 1.00 43.21 H new ATOM 0 HB3 ARG A 83 3.924 -2.333 -9.687 1.00 43.21 H new ATOM 0 HG2 ARG A 83 4.615 0.065 -10.212 1.00 64.42 H new ATOM 0 HG3 ARG A 83 5.259 0.166 -8.585 1.00 64.42 H new ATOM 0 HD2 ARG A 83 6.769 -1.751 -9.045 1.00 55.24 H new ATOM 0 HD3 ARG A 83 6.102 -1.906 -10.658 1.00 55.24 H new ATOM 0 HE ARG A 83 7.954 0.189 -9.691 1.00 51.22 H new ATOM 0 HH11 ARG A 83 5.852 -0.953 -12.250 1.00 43.52 H new ATOM 0 HH12 ARG A 83 6.658 0.032 -13.475 1.00 43.52 H new ATOM 0 HH21 ARG A 83 8.940 1.394 -11.249 1.00 0.43 H new ATOM 0 HH22 ARG A 83 8.368 1.332 -12.919 1.00 0.43 H new ATOM 1306 N ILE A 84 0.810 -2.435 -9.383 1.00 72.33 N ATOM 1307 CA ILE A 84 -0.165 -3.525 -9.279 1.00 43.53 C ATOM 1308 C ILE A 84 0.156 -4.639 -10.286 1.00 53.42 C ATOM 1309 O ILE A 84 -0.153 -4.523 -11.473 1.00 21.15 O ATOM 1310 CB ILE A 84 -1.625 -3.047 -9.532 1.00 32.41 C ATOM 1311 CG1 ILE A 84 -1.962 -1.792 -8.703 1.00 64.22 C ATOM 1312 CG2 ILE A 84 -2.614 -4.172 -9.222 1.00 74.24 C ATOM 1313 CD1 ILE A 84 -1.470 -0.494 -9.315 1.00 41.22 C ATOM 0 H ILE A 84 0.806 -1.957 -10.284 1.00 72.33 H new ATOM 0 HA ILE A 84 -0.092 -3.898 -8.258 1.00 43.53 H new ATOM 0 HB ILE A 84 -1.710 -2.781 -10.586 1.00 32.41 H new ATOM 0 HG12 ILE A 84 -3.043 -1.734 -8.575 1.00 64.22 H new ATOM 0 HG13 ILE A 84 -1.529 -1.899 -7.709 1.00 64.22 H new ATOM 0 HG21 ILE A 84 -3.631 -3.823 -9.403 1.00 74.24 H new ATOM 0 HG22 ILE A 84 -2.404 -5.028 -9.863 1.00 74.24 H new ATOM 0 HG23 ILE A 84 -2.513 -4.468 -8.178 1.00 74.24 H new ATOM 0 HD11 ILE A 84 -1.747 0.340 -8.671 1.00 41.22 H new ATOM 0 HD12 ILE A 84 -0.385 -0.528 -9.418 1.00 41.22 H new ATOM 0 HD13 ILE A 84 -1.923 -0.360 -10.297 1.00 41.22 H new ATOM 1325 N GLN A 85 0.801 -5.701 -9.817 1.00 34.34 N ATOM 1326 CA GLN A 85 1.094 -6.864 -10.661 1.00 35.31 C ATOM 1327 C GLN A 85 0.003 -7.938 -10.527 1.00 51.32 C ATOM 1328 O GLN A 85 -0.127 -8.583 -9.485 1.00 74.43 O ATOM 1329 CB GLN A 85 2.472 -7.457 -10.313 1.00 53.00 C ATOM 1330 CG GLN A 85 3.652 -6.657 -10.865 1.00 11.23 C ATOM 1331 CD GLN A 85 3.773 -5.259 -10.277 1.00 21.22 C ATOM 1332 OE1 GLN A 85 4.230 -4.322 -11.081 1.00 30.33 O flip ATOM 1333 NE2 GLN A 85 3.449 -5.018 -9.119 1.00 31.20 N flip ATOM 0 H GLN A 85 1.133 -5.785 -8.856 1.00 34.34 H new ATOM 0 HA GLN A 85 1.111 -6.525 -11.697 1.00 35.31 H new ATOM 0 HB2 GLN A 85 2.565 -7.521 -9.229 1.00 53.00 H new ATOM 0 HB3 GLN A 85 2.525 -8.475 -10.698 1.00 53.00 H new ATOM 0 HG2 GLN A 85 4.574 -7.205 -10.669 1.00 11.23 H new ATOM 0 HG3 GLN A 85 3.551 -6.579 -11.948 1.00 11.23 H new ATOM 0 HE21 GLN A 85 3.098 -5.766 -8.521 1.00 31.20 H new ATOM 0 HE22 GLN A 85 3.530 -4.069 -8.754 1.00 31.20 H new ATOM 1342 N GLY A 86 -0.788 -8.110 -11.582 1.00 12.24 N ATOM 1343 CA GLY A 86 -1.824 -9.135 -11.591 1.00 51.23 C ATOM 1344 C GLY A 86 -1.258 -10.552 -11.515 1.00 52.03 C ATOM 1345 O GLY A 86 -0.361 -10.914 -12.280 1.00 4.44 O ATOM 0 H GLY A 86 -0.731 -7.556 -12.437 1.00 12.24 H new ATOM 0 HA2 GLY A 86 -2.497 -8.972 -10.749 1.00 51.23 H new ATOM 0 HA3 GLY A 86 -2.419 -9.035 -12.499 1.00 51.23 H new ATOM 1349 N GLU A 87 -1.788 -11.361 -10.597 1.00 20.00 N ATOM 1350 CA GLU A 87 -1.313 -12.738 -10.415 1.00 40.42 C ATOM 1351 C GLU A 87 -1.782 -13.641 -11.572 1.00 61.13 C ATOM 1352 O GLU A 87 -1.291 -14.761 -11.751 1.00 2.32 O ATOM 1353 CB GLU A 87 -1.798 -13.278 -9.060 1.00 5.51 C ATOM 1354 CG GLU A 87 -1.191 -14.618 -8.672 1.00 31.45 C ATOM 1355 CD GLU A 87 -1.448 -14.975 -7.216 1.00 44.30 C ATOM 1356 OE1 GLU A 87 -0.787 -14.386 -6.339 1.00 1.31 O ATOM 1357 OE2 GLU A 87 -2.303 -15.841 -6.942 1.00 23.01 O ATOM 0 H GLU A 87 -2.544 -11.090 -9.968 1.00 20.00 H new ATOM 0 HA GLU A 87 -0.223 -12.739 -10.423 1.00 40.42 H new ATOM 0 HB2 GLU A 87 -1.565 -12.548 -8.285 1.00 5.51 H new ATOM 0 HB3 GLU A 87 -2.883 -13.377 -9.088 1.00 5.51 H new ATOM 0 HG2 GLU A 87 -1.603 -15.398 -9.312 1.00 31.45 H new ATOM 0 HG3 GLU A 87 -0.116 -14.592 -8.852 1.00 31.45 H new ATOM 1364 N SER A 88 -2.735 -13.141 -12.357 1.00 21.11 N ATOM 1365 CA SER A 88 -3.193 -13.825 -13.573 1.00 15.21 C ATOM 1366 C SER A 88 -2.690 -13.095 -14.830 1.00 52.23 C ATOM 1367 O SER A 88 -2.581 -11.868 -14.850 1.00 15.51 O ATOM 1368 CB SER A 88 -4.728 -13.926 -13.592 1.00 24.45 C ATOM 1369 OG SER A 88 -5.342 -12.645 -13.558 1.00 70.33 O ATOM 0 H SER A 88 -3.210 -12.257 -12.173 1.00 21.11 H new ATOM 0 HA SER A 88 -2.779 -14.833 -13.571 1.00 15.21 H new ATOM 0 HB2 SER A 88 -5.046 -14.458 -14.489 1.00 24.45 H new ATOM 0 HB3 SER A 88 -5.064 -14.513 -12.737 1.00 24.45 H new ATOM 0 HG SER A 88 -6.016 -12.586 -14.267 1.00 70.33 H new ATOM 1375 N ASN A 89 -2.371 -13.857 -15.877 1.00 54.41 N ATOM 1376 CA ASN A 89 -1.817 -13.286 -17.115 1.00 14.41 C ATOM 1377 C ASN A 89 -2.914 -12.687 -18.010 1.00 14.13 C ATOM 1378 O ASN A 89 -2.628 -11.901 -18.916 1.00 71.05 O ATOM 1379 CB ASN A 89 -1.034 -14.359 -17.878 1.00 3.54 C ATOM 1380 CG ASN A 89 0.131 -14.904 -17.067 1.00 72.43 C ATOM 1381 OD1 ASN A 89 0.730 -14.198 -16.263 1.00 52.30 O ATOM 1382 ND2 ASN A 89 0.454 -16.166 -17.261 1.00 75.23 N ATOM 0 H ASN A 89 -2.485 -14.870 -15.897 1.00 54.41 H new ATOM 0 HA ASN A 89 -1.145 -12.474 -16.837 1.00 14.41 H new ATOM 0 HB2 ASN A 89 -1.704 -15.177 -18.143 1.00 3.54 H new ATOM 0 HB3 ASN A 89 -0.660 -13.939 -18.812 1.00 3.54 H new ATOM 0 HD21 ASN A 89 1.222 -16.583 -16.735 1.00 75.23 H new ATOM 0 HD22 ASN A 89 -0.064 -16.727 -17.937 1.00 75.23 H new ATOM 1389 N ASP A 90 -4.160 -13.075 -17.756 1.00 24.44 N ATOM 1390 CA ASP A 90 -5.315 -12.512 -18.467 1.00 73.10 C ATOM 1391 C ASP A 90 -5.565 -11.044 -18.062 1.00 21.04 C ATOM 1392 O ASP A 90 -5.314 -10.655 -16.921 1.00 51.23 O ATOM 1393 CB ASP A 90 -6.563 -13.370 -18.202 1.00 64.14 C ATOM 1394 CG ASP A 90 -6.714 -13.742 -16.737 1.00 50.51 C ATOM 1395 OD1 ASP A 90 -6.163 -14.788 -16.332 1.00 25.53 O ATOM 1396 OD2 ASP A 90 -7.378 -12.999 -15.984 1.00 41.40 O ATOM 0 H ASP A 90 -4.402 -13.781 -17.060 1.00 24.44 H new ATOM 0 HA ASP A 90 -5.097 -12.523 -19.535 1.00 73.10 H new ATOM 0 HB2 ASP A 90 -7.450 -12.826 -18.529 1.00 64.14 H new ATOM 0 HB3 ASP A 90 -6.508 -14.279 -18.800 1.00 64.14 H new ATOM 1401 N PRO A 91 -6.065 -10.207 -18.996 1.00 61.31 N ATOM 1402 CA PRO A 91 -6.304 -8.776 -18.726 1.00 32.13 C ATOM 1403 C PRO A 91 -7.427 -8.538 -17.695 1.00 53.22 C ATOM 1404 O PRO A 91 -8.582 -8.906 -17.920 1.00 5.14 O ATOM 1405 CB PRO A 91 -6.694 -8.215 -20.105 1.00 72.31 C ATOM 1406 CG PRO A 91 -7.224 -9.389 -20.859 1.00 42.34 C ATOM 1407 CD PRO A 91 -6.438 -10.579 -20.376 1.00 14.44 C ATOM 0 HA PRO A 91 -5.430 -8.295 -18.288 1.00 32.13 H new ATOM 0 HB2 PRO A 91 -7.446 -7.431 -20.015 1.00 72.31 H new ATOM 0 HB3 PRO A 91 -5.834 -7.776 -20.611 1.00 72.31 H new ATOM 0 HG2 PRO A 91 -8.290 -9.523 -20.674 1.00 42.34 H new ATOM 0 HG3 PRO A 91 -7.102 -9.250 -21.933 1.00 42.34 H new ATOM 0 HD2 PRO A 91 -7.035 -11.491 -20.399 1.00 14.44 H new ATOM 0 HD3 PRO A 91 -5.559 -10.758 -20.995 1.00 14.44 H new ATOM 1415 N LEU A 92 -7.078 -7.937 -16.559 1.00 15.13 N ATOM 1416 CA LEU A 92 -8.052 -7.630 -15.502 1.00 20.11 C ATOM 1417 C LEU A 92 -8.816 -6.327 -15.802 1.00 73.11 C ATOM 1418 O LEU A 92 -8.336 -5.470 -16.545 1.00 73.44 O ATOM 1419 CB LEU A 92 -7.331 -7.513 -14.149 1.00 14.20 C ATOM 1420 CG LEU A 92 -6.610 -8.786 -13.672 1.00 22.02 C ATOM 1421 CD1 LEU A 92 -5.907 -8.542 -12.338 1.00 23.23 C ATOM 1422 CD2 LEU A 92 -7.587 -9.959 -13.566 1.00 21.44 C ATOM 0 H LEU A 92 -6.124 -7.650 -16.342 1.00 15.13 H new ATOM 0 HA LEU A 92 -8.777 -8.443 -15.463 1.00 20.11 H new ATOM 0 HB2 LEU A 92 -6.602 -6.706 -14.214 1.00 14.20 H new ATOM 0 HB3 LEU A 92 -8.060 -7.224 -13.392 1.00 14.20 H new ATOM 0 HG LEU A 92 -5.853 -9.044 -14.412 1.00 22.02 H new ATOM 0 HD11 LEU A 92 -5.404 -9.455 -12.020 1.00 23.23 H new ATOM 0 HD12 LEU A 92 -5.173 -7.745 -12.454 1.00 23.23 H new ATOM 0 HD13 LEU A 92 -6.642 -8.252 -11.587 1.00 23.23 H new ATOM 0 HD21 LEU A 92 -7.054 -10.847 -13.227 1.00 21.44 H new ATOM 0 HD22 LEU A 92 -8.374 -9.714 -12.853 1.00 21.44 H new ATOM 0 HD23 LEU A 92 -8.030 -10.153 -14.543 1.00 21.44 H new ATOM 1434 N PRO A 93 -10.030 -6.159 -15.245 1.00 5.23 N ATOM 1435 CA PRO A 93 -10.807 -4.918 -15.411 1.00 1.41 C ATOM 1436 C PRO A 93 -10.265 -3.761 -14.553 1.00 21.53 C ATOM 1437 O PRO A 93 -9.253 -3.901 -13.866 1.00 14.31 O ATOM 1438 CB PRO A 93 -12.208 -5.327 -14.948 1.00 41.14 C ATOM 1439 CG PRO A 93 -11.968 -6.407 -13.945 1.00 72.13 C ATOM 1440 CD PRO A 93 -10.748 -7.156 -14.422 1.00 41.13 C ATOM 0 HA PRO A 93 -10.770 -4.542 -16.433 1.00 1.41 H new ATOM 0 HB2 PRO A 93 -12.742 -4.486 -14.506 1.00 41.14 H new ATOM 0 HB3 PRO A 93 -12.813 -5.686 -15.781 1.00 41.14 H new ATOM 0 HG2 PRO A 93 -11.805 -5.988 -12.952 1.00 72.13 H new ATOM 0 HG3 PRO A 93 -12.830 -7.071 -13.873 1.00 72.13 H new ATOM 0 HD2 PRO A 93 -10.138 -7.502 -13.588 1.00 41.13 H new ATOM 0 HD3 PRO A 93 -11.020 -8.036 -15.005 1.00 41.13 H new ATOM 1448 N ALA A 94 -10.941 -2.611 -14.601 1.00 22.13 N ATOM 1449 CA ALA A 94 -10.559 -1.461 -13.771 1.00 2.33 C ATOM 1450 C ALA A 94 -11.039 -1.645 -12.323 1.00 3.14 C ATOM 1451 O ALA A 94 -11.984 -2.398 -12.061 1.00 72.02 O ATOM 1452 CB ALA A 94 -11.112 -0.165 -14.360 1.00 61.21 C ATOM 0 H ALA A 94 -11.750 -2.449 -15.200 1.00 22.13 H new ATOM 0 HA ALA A 94 -9.471 -1.398 -13.761 1.00 2.33 H new ATOM 0 HB1 ALA A 94 -10.818 0.675 -13.731 1.00 61.21 H new ATOM 0 HB2 ALA A 94 -10.714 -0.023 -15.365 1.00 61.21 H new ATOM 0 HB3 ALA A 94 -12.200 -0.221 -14.406 1.00 61.21 H new ATOM 1458 N PHE A 95 -10.409 -0.936 -11.387 1.00 70.30 N ATOM 1459 CA PHE A 95 -10.703 -1.123 -9.961 1.00 12.33 C ATOM 1460 C PHE A 95 -10.429 0.139 -9.131 1.00 14.35 C ATOM 1461 O PHE A 95 -9.549 0.948 -9.449 1.00 72.11 O ATOM 1462 CB PHE A 95 -9.912 -2.317 -9.397 1.00 60.02 C ATOM 1463 CG PHE A 95 -8.413 -2.202 -9.545 1.00 44.12 C ATOM 1464 CD1 PHE A 95 -7.792 -2.533 -10.743 1.00 2.21 C ATOM 1465 CD2 PHE A 95 -7.624 -1.780 -8.481 1.00 14.21 C ATOM 1466 CE1 PHE A 95 -6.421 -2.443 -10.878 1.00 60.45 C ATOM 1467 CE2 PHE A 95 -6.251 -1.690 -8.614 1.00 22.30 C ATOM 1468 CZ PHE A 95 -5.650 -2.022 -9.813 1.00 41.32 C ATOM 0 H PHE A 95 -9.698 -0.232 -11.585 1.00 70.30 H new ATOM 0 HA PHE A 95 -11.770 -1.331 -9.884 1.00 12.33 H new ATOM 0 HB2 PHE A 95 -10.152 -2.429 -8.340 1.00 60.02 H new ATOM 0 HB3 PHE A 95 -10.245 -3.226 -9.898 1.00 60.02 H new ATOM 0 HD1 PHE A 95 -8.389 -2.865 -11.579 1.00 2.21 H new ATOM 0 HD2 PHE A 95 -8.088 -1.520 -7.541 1.00 14.21 H new ATOM 0 HE1 PHE A 95 -5.952 -2.702 -11.816 1.00 60.45 H new ATOM 0 HE2 PHE A 95 -5.648 -1.360 -7.781 1.00 22.30 H new ATOM 0 HZ PHE A 95 -4.577 -1.952 -9.917 1.00 41.32 H new ATOM 1478 N SER A 96 -11.207 0.296 -8.068 1.00 60.24 N ATOM 1479 CA SER A 96 -11.045 1.404 -7.122 1.00 4.34 C ATOM 1480 C SER A 96 -11.094 0.884 -5.685 1.00 13.33 C ATOM 1481 O SER A 96 -11.547 -0.232 -5.439 1.00 31.21 O ATOM 1482 CB SER A 96 -12.145 2.455 -7.328 1.00 70.03 C ATOM 1483 OG SER A 96 -13.433 1.908 -7.095 1.00 72.43 O ATOM 0 H SER A 96 -11.970 -0.339 -7.833 1.00 60.24 H new ATOM 0 HA SER A 96 -10.076 1.868 -7.303 1.00 4.34 H new ATOM 0 HB2 SER A 96 -11.978 3.296 -6.655 1.00 70.03 H new ATOM 0 HB3 SER A 96 -12.092 2.845 -8.344 1.00 70.03 H new ATOM 0 HG SER A 96 -14.112 2.601 -7.232 1.00 72.43 H new ATOM 1489 N GLY A 97 -10.620 1.682 -4.735 1.00 30.31 N ATOM 1490 CA GLY A 97 -10.640 1.260 -3.341 1.00 24.41 C ATOM 1491 C GLY A 97 -10.174 2.338 -2.371 1.00 11.55 C ATOM 1492 O GLY A 97 -10.199 3.529 -2.683 1.00 73.21 O ATOM 0 H GLY A 97 -10.224 2.608 -4.900 1.00 30.31 H new ATOM 0 HA2 GLY A 97 -11.653 0.958 -3.076 1.00 24.41 H new ATOM 0 HA3 GLY A 97 -10.005 0.381 -3.227 1.00 24.41 H new ATOM 1496 N THR A 98 -9.744 1.914 -1.187 1.00 34.15 N ATOM 1497 CA THR A 98 -9.295 2.843 -0.143 1.00 22.24 C ATOM 1498 C THR A 98 -8.007 2.348 0.528 1.00 41.02 C ATOM 1499 O THR A 98 -7.799 1.142 0.694 1.00 23.11 O ATOM 1500 CB THR A 98 -10.388 3.045 0.937 1.00 52.22 C ATOM 1501 OG1 THR A 98 -11.618 3.463 0.323 1.00 3.33 O ATOM 1502 CG2 THR A 98 -9.966 4.082 1.972 1.00 73.12 C ATOM 0 H THR A 98 -9.695 0.930 -0.921 1.00 34.15 H new ATOM 0 HA THR A 98 -9.097 3.797 -0.632 1.00 22.24 H new ATOM 0 HB THR A 98 -10.531 2.090 1.443 1.00 52.22 H new ATOM 0 HG1 THR A 98 -12.303 3.586 1.013 1.00 3.33 H new ATOM 0 HG21 THR A 98 -10.756 4.198 2.714 1.00 73.12 H new ATOM 0 HG22 THR A 98 -9.051 3.753 2.465 1.00 73.12 H new ATOM 0 HG23 THR A 98 -9.789 5.037 1.478 1.00 73.12 H new ATOM 1510 N VAL A 99 -7.146 3.284 0.916 1.00 42.30 N ATOM 1511 CA VAL A 99 -5.871 2.949 1.553 1.00 41.04 C ATOM 1512 C VAL A 99 -5.737 3.586 2.950 1.00 10.44 C ATOM 1513 O VAL A 99 -5.941 4.788 3.122 1.00 40.14 O ATOM 1514 CB VAL A 99 -4.674 3.382 0.665 1.00 25.22 C ATOM 1515 CG1 VAL A 99 -4.712 4.881 0.369 1.00 52.02 C ATOM 1516 CG2 VAL A 99 -3.349 2.990 1.314 1.00 72.12 C ATOM 0 H VAL A 99 -7.307 4.285 0.801 1.00 42.30 H new ATOM 0 HA VAL A 99 -5.856 1.866 1.672 1.00 41.04 H new ATOM 0 HB VAL A 99 -4.759 2.856 -0.286 1.00 25.22 H new ATOM 0 HG11 VAL A 99 -3.860 5.150 -0.255 1.00 52.02 H new ATOM 0 HG12 VAL A 99 -5.636 5.125 -0.154 1.00 52.02 H new ATOM 0 HG13 VAL A 99 -4.667 5.438 1.305 1.00 52.02 H new ATOM 0 HG21 VAL A 99 -2.524 3.303 0.674 1.00 72.12 H new ATOM 0 HG22 VAL A 99 -3.261 3.478 2.285 1.00 72.12 H new ATOM 0 HG23 VAL A 99 -3.315 1.909 1.447 1.00 72.12 H new ATOM 1526 N GLU A 100 -5.407 2.758 3.939 1.00 31.30 N ATOM 1527 CA GLU A 100 -5.150 3.222 5.306 1.00 33.42 C ATOM 1528 C GLU A 100 -3.663 3.573 5.478 1.00 13.14 C ATOM 1529 O GLU A 100 -2.813 2.683 5.468 1.00 5.11 O ATOM 1530 CB GLU A 100 -5.514 2.122 6.322 1.00 50.41 C ATOM 1531 CG GLU A 100 -6.897 1.510 6.138 1.00 40.45 C ATOM 1532 CD GLU A 100 -8.024 2.466 6.485 1.00 61.14 C ATOM 1533 OE1 GLU A 100 -8.228 2.733 7.685 1.00 42.01 O ATOM 1534 OE2 GLU A 100 -8.718 2.933 5.557 1.00 4.10 O ATOM 0 H GLU A 100 -5.310 1.750 3.819 1.00 31.30 H new ATOM 0 HA GLU A 100 -5.762 4.106 5.484 1.00 33.42 H new ATOM 0 HB2 GLU A 100 -4.770 1.328 6.258 1.00 50.41 H new ATOM 0 HB3 GLU A 100 -5.448 2.540 7.327 1.00 50.41 H new ATOM 0 HG2 GLU A 100 -7.009 1.186 5.103 1.00 40.45 H new ATOM 0 HG3 GLU A 100 -6.979 0.620 6.761 1.00 40.45 H new ATOM 1541 N TYR A 101 -3.341 4.852 5.626 1.00 21.33 N ATOM 1542 CA TYR A 101 -1.946 5.259 5.836 1.00 1.43 C ATOM 1543 C TYR A 101 -1.772 6.036 7.148 1.00 63.14 C ATOM 1544 O TYR A 101 -2.446 7.039 7.396 1.00 22.10 O ATOM 1545 CB TYR A 101 -1.412 6.065 4.639 1.00 43.35 C ATOM 1546 CG TYR A 101 -2.134 7.373 4.356 1.00 10.04 C ATOM 1547 CD1 TYR A 101 -3.366 7.392 3.706 1.00 32.12 C ATOM 1548 CD2 TYR A 101 -1.569 8.593 4.719 1.00 31.23 C ATOM 1549 CE1 TYR A 101 -4.002 8.585 3.418 1.00 35.11 C ATOM 1550 CE2 TYR A 101 -2.205 9.787 4.441 1.00 24.21 C ATOM 1551 CZ TYR A 101 -3.420 9.778 3.793 1.00 2.23 C ATOM 1552 OH TYR A 101 -4.045 10.969 3.496 1.00 45.11 O ATOM 0 H TYR A 101 -4.012 5.620 5.606 1.00 21.33 H new ATOM 0 HA TYR A 101 -1.353 4.348 5.916 1.00 1.43 H new ATOM 0 HB2 TYR A 101 -0.358 6.282 4.811 1.00 43.35 H new ATOM 0 HB3 TYR A 101 -1.468 5.439 3.748 1.00 43.35 H new ATOM 0 HD1 TYR A 101 -3.832 6.460 3.423 1.00 32.12 H new ATOM 0 HD2 TYR A 101 -0.616 8.606 5.227 1.00 31.23 H new ATOM 0 HE1 TYR A 101 -4.951 8.583 2.902 1.00 35.11 H new ATOM 0 HE2 TYR A 101 -1.752 10.723 4.731 1.00 24.21 H new ATOM 0 HH TYR A 101 -3.504 11.715 3.830 1.00 45.11 H new ATOM 1562 N GLY A 102 -0.868 5.544 7.991 1.00 23.44 N ATOM 1563 CA GLY A 102 -0.623 6.159 9.288 1.00 34.33 C ATOM 1564 C GLY A 102 0.626 5.614 9.970 1.00 63.20 C ATOM 1565 O GLY A 102 1.633 5.350 9.310 1.00 24.41 O ATOM 0 H GLY A 102 -0.295 4.723 7.798 1.00 23.44 H new ATOM 0 HA2 GLY A 102 -0.522 7.237 9.161 1.00 34.33 H new ATOM 0 HA3 GLY A 102 -1.486 5.993 9.933 1.00 34.33 H new ATOM 1569 N GLN A 103 0.564 5.425 11.288 1.00 2.00 N ATOM 1570 CA GLN A 103 1.722 4.959 12.067 1.00 43.10 C ATOM 1571 C GLN A 103 1.382 3.718 12.914 1.00 54.24 C ATOM 1572 O GLN A 103 0.213 3.397 13.135 1.00 60.52 O ATOM 1573 CB GLN A 103 2.225 6.088 12.978 1.00 4.53 C ATOM 1574 CG GLN A 103 2.687 7.334 12.223 1.00 3.20 C ATOM 1575 CD GLN A 103 3.119 8.457 13.151 1.00 0.45 C ATOM 1576 OE1 GLN A 103 2.616 8.590 14.262 1.00 5.33 O ATOM 1577 NE2 GLN A 103 4.053 9.272 12.706 1.00 65.32 N ATOM 0 H GLN A 103 -0.276 5.587 11.844 1.00 2.00 H new ATOM 0 HA GLN A 103 2.503 4.676 11.362 1.00 43.10 H new ATOM 0 HB2 GLN A 103 1.428 6.368 13.667 1.00 4.53 H new ATOM 0 HB3 GLN A 103 3.052 5.713 13.581 1.00 4.53 H new ATOM 0 HG2 GLN A 103 3.517 7.070 11.568 1.00 3.20 H new ATOM 0 HG3 GLN A 103 1.878 7.687 11.584 1.00 3.20 H new ATOM 0 HE21 GLN A 103 4.451 9.133 11.777 1.00 65.32 H new ATOM 0 HE22 GLN A 103 4.379 10.042 13.290 1.00 65.32 H new ATOM 1586 N ILE A 104 2.421 3.023 13.387 1.00 32.22 N ATOM 1587 CA ILE A 104 2.250 1.836 14.240 1.00 0.14 C ATOM 1588 C ILE A 104 3.118 1.934 15.506 1.00 20.31 C ATOM 1589 O ILE A 104 4.347 1.928 15.433 1.00 72.15 O ATOM 1590 CB ILE A 104 2.615 0.529 13.481 1.00 54.12 C ATOM 1591 CG1 ILE A 104 1.730 0.357 12.236 1.00 71.44 C ATOM 1592 CG2 ILE A 104 2.485 -0.684 14.407 1.00 23.31 C ATOM 1593 CD1 ILE A 104 2.049 -0.884 11.424 1.00 51.44 C ATOM 0 H ILE A 104 3.394 3.261 13.194 1.00 32.22 H new ATOM 0 HA ILE A 104 1.197 1.802 14.521 1.00 0.14 H new ATOM 0 HB ILE A 104 3.652 0.602 13.153 1.00 54.12 H new ATOM 0 HG12 ILE A 104 0.686 0.318 12.547 1.00 71.44 H new ATOM 0 HG13 ILE A 104 1.841 1.235 11.599 1.00 71.44 H new ATOM 0 HG21 ILE A 104 2.744 -1.590 13.859 1.00 23.31 H new ATOM 0 HG22 ILE A 104 3.159 -0.568 15.256 1.00 23.31 H new ATOM 0 HG23 ILE A 104 1.459 -0.759 14.767 1.00 23.31 H new ATOM 0 HD11 ILE A 104 1.383 -0.936 10.562 1.00 51.44 H new ATOM 0 HD12 ILE A 104 3.083 -0.839 11.082 1.00 51.44 H new ATOM 0 HD13 ILE A 104 1.910 -1.770 12.044 1.00 51.44 H new ATOM 1605 N GLN A 105 2.473 2.018 16.669 1.00 23.41 N ATOM 1606 CA GLN A 105 3.195 2.090 17.950 1.00 24.24 C ATOM 1607 C GLN A 105 3.401 0.697 18.569 1.00 32.22 C ATOM 1608 O GLN A 105 4.138 0.548 19.544 1.00 43.03 O ATOM 1609 CB GLN A 105 2.432 2.980 18.941 1.00 54.02 C ATOM 1610 CG GLN A 105 1.034 2.464 19.277 1.00 74.13 C ATOM 1611 CD GLN A 105 0.315 3.297 20.329 1.00 53.11 C ATOM 1612 OE1 GLN A 105 0.580 4.590 20.366 1.00 21.43 O flip ATOM 1613 NE2 GLN A 105 -0.484 2.782 21.099 1.00 22.34 N flip ATOM 0 H GLN A 105 1.457 2.038 16.756 1.00 23.41 H new ATOM 0 HA GLN A 105 4.175 2.520 17.746 1.00 24.24 H new ATOM 0 HB2 GLN A 105 3.010 3.063 19.861 1.00 54.02 H new ATOM 0 HB3 GLN A 105 2.349 3.984 18.525 1.00 54.02 H new ATOM 0 HG2 GLN A 105 0.434 2.446 18.367 1.00 74.13 H new ATOM 0 HG3 GLN A 105 1.110 1.435 19.629 1.00 74.13 H new ATOM 0 HE21 GLN A 105 -0.669 1.780 21.047 1.00 22.34 H new ATOM 0 HE22 GLN A 105 -0.965 3.354 21.793 1.00 22.34 H new ATOM 1622 N GLY A 106 2.755 -0.315 17.995 1.00 32.25 N ATOM 1623 CA GLY A 106 2.789 -1.657 18.573 1.00 22.33 C ATOM 1624 C GLY A 106 3.924 -2.527 18.042 1.00 30.41 C ATOM 1625 O GLY A 106 4.694 -2.104 17.178 1.00 5.23 O ATOM 0 H GLY A 106 2.207 -0.234 17.139 1.00 32.25 H new ATOM 0 HA2 GLY A 106 2.883 -1.574 19.656 1.00 22.33 H new ATOM 0 HA3 GLY A 106 1.839 -2.153 18.373 1.00 22.33 H new ATOM 1629 N THR A 107 4.017 -3.749 18.558 1.00 23.22 N ATOM 1630 CA THR A 107 5.072 -4.692 18.162 1.00 32.34 C ATOM 1631 C THR A 107 4.677 -5.483 16.906 1.00 52.23 C ATOM 1632 O THR A 107 3.732 -5.124 16.205 1.00 41.34 O ATOM 1633 CB THR A 107 5.381 -5.697 19.300 1.00 21.13 C ATOM 1634 OG1 THR A 107 4.270 -6.591 19.493 1.00 70.33 O ATOM 1635 CG2 THR A 107 5.680 -4.970 20.609 1.00 0.24 C ATOM 0 H THR A 107 3.372 -4.117 19.257 1.00 23.22 H new ATOM 0 HA THR A 107 5.959 -4.095 17.949 1.00 32.34 H new ATOM 0 HB THR A 107 6.262 -6.269 19.008 1.00 21.13 H new ATOM 0 HG1 THR A 107 4.479 -7.221 20.214 1.00 70.33 H new ATOM 0 HG21 THR A 107 5.893 -5.700 21.390 1.00 0.24 H new ATOM 0 HG22 THR A 107 6.544 -4.319 20.475 1.00 0.24 H new ATOM 0 HG23 THR A 107 4.816 -4.371 20.898 1.00 0.24 H new ATOM 1643 N ILE A 108 5.405 -6.563 16.622 1.00 74.13 N ATOM 1644 CA ILE A 108 5.115 -7.403 15.453 1.00 72.22 C ATOM 1645 C ILE A 108 3.863 -8.261 15.678 1.00 44.11 C ATOM 1646 O ILE A 108 3.135 -8.576 14.737 1.00 44.44 O ATOM 1647 CB ILE A 108 6.310 -8.332 15.112 1.00 21.15 C ATOM 1648 CG1 ILE A 108 7.610 -7.520 14.987 1.00 53.41 C ATOM 1649 CG2 ILE A 108 6.040 -9.121 13.828 1.00 34.43 C ATOM 1650 CD1 ILE A 108 7.550 -6.411 13.957 1.00 74.45 C ATOM 0 H ILE A 108 6.198 -6.878 17.181 1.00 74.13 H new ATOM 0 HA ILE A 108 4.940 -6.726 14.617 1.00 72.22 H new ATOM 0 HB ILE A 108 6.428 -9.045 15.928 1.00 21.15 H new ATOM 0 HG12 ILE A 108 7.850 -7.087 15.958 1.00 53.41 H new ATOM 0 HG13 ILE A 108 8.425 -8.197 14.730 1.00 53.41 H new ATOM 0 HG21 ILE A 108 6.892 -9.765 13.610 1.00 34.43 H new ATOM 0 HG22 ILE A 108 5.147 -9.733 13.958 1.00 34.43 H new ATOM 0 HG23 ILE A 108 5.888 -8.428 13.000 1.00 34.43 H new ATOM 0 HD11 ILE A 108 8.505 -5.887 13.931 1.00 74.45 H new ATOM 0 HD12 ILE A 108 7.343 -6.837 12.975 1.00 74.45 H new ATOM 0 HD13 ILE A 108 6.759 -5.710 14.223 1.00 74.45 H new ATOM 1662 N ASP A 109 3.620 -8.641 16.931 1.00 72.21 N ATOM 1663 CA ASP A 109 2.469 -9.483 17.273 1.00 72.33 C ATOM 1664 C ASP A 109 1.265 -8.636 17.720 1.00 52.25 C ATOM 1665 O ASP A 109 0.125 -8.900 17.325 1.00 21.34 O ATOM 1666 CB ASP A 109 2.853 -10.482 18.369 1.00 13.01 C ATOM 1667 CG ASP A 109 1.801 -11.561 18.560 1.00 51.15 C ATOM 1668 OD1 ASP A 109 1.685 -12.444 17.683 1.00 12.24 O ATOM 1669 OD2 ASP A 109 1.088 -11.536 19.586 1.00 50.13 O ATOM 0 H ASP A 109 4.202 -8.381 17.727 1.00 72.21 H new ATOM 0 HA ASP A 109 2.176 -10.031 16.377 1.00 72.33 H new ATOM 0 HB2 ASP A 109 3.806 -10.947 18.116 1.00 13.01 H new ATOM 0 HB3 ASP A 109 2.998 -9.949 19.309 1.00 13.01 H new ATOM 1674 N ASN A 110 1.515 -7.630 18.559 1.00 43.44 N ATOM 1675 CA ASN A 110 0.452 -6.724 19.016 1.00 41.11 C ATOM 1676 C ASN A 110 0.692 -5.288 18.523 1.00 71.24 C ATOM 1677 O ASN A 110 1.443 -4.518 19.123 1.00 35.33 O ATOM 1678 CB ASN A 110 0.303 -6.771 20.547 1.00 63.42 C ATOM 1679 CG ASN A 110 1.617 -6.587 21.286 1.00 13.43 C ATOM 1680 OD1 ASN A 110 2.302 -7.551 21.602 1.00 32.32 O ATOM 1681 ND2 ASN A 110 1.973 -5.357 21.578 1.00 4.15 N ATOM 0 H ASN A 110 2.439 -7.420 18.936 1.00 43.44 H new ATOM 0 HA ASN A 110 -0.486 -7.068 18.581 1.00 41.11 H new ATOM 0 HB2 ASN A 110 -0.394 -5.994 20.861 1.00 63.42 H new ATOM 0 HB3 ASN A 110 -0.136 -7.727 20.833 1.00 63.42 H new ATOM 0 HD21 ASN A 110 2.843 -5.184 22.082 1.00 4.15 H new ATOM 0 HD22 ASN A 110 1.380 -4.575 21.301 1.00 4.15 H new ATOM 1688 N PHE A 111 0.048 -4.941 17.414 1.00 54.30 N ATOM 1689 CA PHE A 111 0.208 -3.621 16.797 1.00 22.20 C ATOM 1690 C PHE A 111 -1.128 -2.874 16.689 1.00 45.30 C ATOM 1691 O PHE A 111 -2.179 -3.478 16.459 1.00 12.12 O ATOM 1692 CB PHE A 111 0.866 -3.752 15.413 1.00 52.12 C ATOM 1693 CG PHE A 111 0.317 -4.877 14.571 1.00 13.33 C ATOM 1694 CD1 PHE A 111 0.819 -6.164 14.707 1.00 2.41 C ATOM 1695 CD2 PHE A 111 -0.692 -4.652 13.644 1.00 50.32 C ATOM 1696 CE1 PHE A 111 0.329 -7.201 13.940 1.00 75.23 C ATOM 1697 CE2 PHE A 111 -1.188 -5.689 12.873 1.00 12.13 C ATOM 1698 CZ PHE A 111 -0.676 -6.965 13.021 1.00 14.13 C ATOM 0 H PHE A 111 -0.595 -5.558 16.918 1.00 54.30 H new ATOM 0 HA PHE A 111 0.859 -3.033 17.444 1.00 22.20 H new ATOM 0 HB2 PHE A 111 0.740 -2.814 14.873 1.00 52.12 H new ATOM 0 HB3 PHE A 111 1.938 -3.902 15.545 1.00 52.12 H new ATOM 0 HD1 PHE A 111 1.604 -6.356 15.423 1.00 2.41 H new ATOM 0 HD2 PHE A 111 -1.094 -3.657 13.523 1.00 50.32 H new ATOM 0 HE1 PHE A 111 0.731 -8.197 14.058 1.00 75.23 H new ATOM 0 HE2 PHE A 111 -1.974 -5.502 12.157 1.00 12.13 H new ATOM 0 HZ PHE A 111 -1.061 -7.775 12.420 1.00 14.13 H new ATOM 1708 N GLN A 112 -1.068 -1.555 16.870 1.00 12.23 N ATOM 1709 CA GLN A 112 -2.251 -0.688 16.788 1.00 14.21 C ATOM 1710 C GLN A 112 -2.087 0.370 15.684 1.00 42.14 C ATOM 1711 O GLN A 112 -1.089 1.096 15.658 1.00 43.13 O ATOM 1712 CB GLN A 112 -2.481 0.017 18.136 1.00 51.02 C ATOM 1713 CG GLN A 112 -2.812 -0.928 19.286 1.00 13.20 C ATOM 1714 CD GLN A 112 -2.834 -0.225 20.635 1.00 41.01 C ATOM 1715 OE1 GLN A 112 -1.830 -0.166 21.336 1.00 72.13 O ATOM 1716 NE2 GLN A 112 -3.974 0.325 21.000 1.00 3.24 N ATOM 0 H GLN A 112 -0.203 -1.055 17.077 1.00 12.23 H new ATOM 0 HA GLN A 112 -3.110 -1.314 16.547 1.00 14.21 H new ATOM 0 HB2 GLN A 112 -1.587 0.586 18.393 1.00 51.02 H new ATOM 0 HB3 GLN A 112 -3.294 0.734 18.024 1.00 51.02 H new ATOM 0 HG2 GLN A 112 -3.783 -1.388 19.105 1.00 13.20 H new ATOM 0 HG3 GLN A 112 -2.078 -1.733 19.312 1.00 13.20 H new ATOM 0 HE21 GLN A 112 -4.791 0.257 20.393 1.00 3.24 H new ATOM 0 HE22 GLN A 112 -4.040 0.819 21.890 1.00 3.24 H new ATOM 1725 N GLU A 113 -3.063 0.453 14.778 1.00 11.44 N ATOM 1726 CA GLU A 113 -3.049 1.468 13.717 1.00 24.35 C ATOM 1727 C GLU A 113 -3.388 2.853 14.289 1.00 4.32 C ATOM 1728 O GLU A 113 -4.558 3.179 14.514 1.00 10.14 O ATOM 1729 CB GLU A 113 -4.038 1.120 12.589 1.00 2.45 C ATOM 1730 CG GLU A 113 -3.815 -0.249 11.935 1.00 55.24 C ATOM 1731 CD GLU A 113 -4.499 -1.388 12.679 1.00 54.32 C ATOM 1732 OE1 GLU A 113 -3.896 -1.946 13.617 1.00 0.13 O ATOM 1733 OE2 GLU A 113 -5.654 -1.726 12.333 1.00 21.11 O ATOM 0 H GLU A 113 -3.872 -0.168 14.756 1.00 11.44 H new ATOM 0 HA GLU A 113 -2.043 1.486 13.299 1.00 24.35 H new ATOM 0 HB2 GLU A 113 -5.051 1.154 12.990 1.00 2.45 H new ATOM 0 HB3 GLU A 113 -3.974 1.889 11.819 1.00 2.45 H new ATOM 0 HG2 GLU A 113 -4.185 -0.219 10.910 1.00 55.24 H new ATOM 0 HG3 GLU A 113 -2.745 -0.449 11.882 1.00 55.24 H new ATOM 1740 N ILE A 114 -2.361 3.657 14.538 1.00 53.45 N ATOM 1741 CA ILE A 114 -2.543 4.995 15.116 1.00 11.44 C ATOM 1742 C ILE A 114 -2.296 6.096 14.075 1.00 42.32 C ATOM 1743 O ILE A 114 -1.513 5.914 13.141 1.00 0.02 O ATOM 1744 CB ILE A 114 -1.597 5.228 16.321 1.00 12.44 C ATOM 1745 CG1 ILE A 114 -0.125 5.168 15.875 1.00 41.02 C ATOM 1746 CG2 ILE A 114 -1.876 4.206 17.426 1.00 12.31 C ATOM 1747 CD1 ILE A 114 0.861 5.529 16.963 1.00 53.50 C ATOM 0 H ILE A 114 -1.389 3.410 14.350 1.00 53.45 H new ATOM 0 HA ILE A 114 -3.578 5.045 15.456 1.00 11.44 H new ATOM 0 HB ILE A 114 -1.787 6.223 16.722 1.00 12.44 H new ATOM 0 HG12 ILE A 114 0.095 4.162 15.518 1.00 41.02 H new ATOM 0 HG13 ILE A 114 0.016 5.844 15.031 1.00 41.02 H new ATOM 0 HG21 ILE A 114 -1.203 4.384 18.265 1.00 12.31 H new ATOM 0 HG22 ILE A 114 -2.908 4.306 17.762 1.00 12.31 H new ATOM 0 HG23 ILE A 114 -1.716 3.199 17.040 1.00 12.31 H new ATOM 0 HD11 ILE A 114 1.876 5.463 16.571 1.00 53.50 H new ATOM 0 HD12 ILE A 114 0.669 6.546 17.305 1.00 53.50 H new ATOM 0 HD13 ILE A 114 0.750 4.838 17.799 1.00 53.50 H new ATOM 1759 N ASN A 115 -2.975 7.234 14.238 1.00 30.04 N ATOM 1760 CA ASN A 115 -2.772 8.401 13.367 1.00 34.35 C ATOM 1761 C ASN A 115 -3.001 8.056 11.884 1.00 23.30 C ATOM 1762 O ASN A 115 -2.420 8.675 10.990 1.00 41.11 O ATOM 1763 CB ASN A 115 -1.355 8.958 13.575 1.00 33.20 C ATOM 1764 CG ASN A 115 -1.091 9.321 15.026 1.00 44.02 C ATOM 1765 OD1 ASN A 115 -1.995 9.722 15.753 1.00 31.41 O ATOM 1766 ND2 ASN A 115 0.143 9.188 15.464 1.00 1.25 N ATOM 0 H ASN A 115 -3.674 7.375 14.968 1.00 30.04 H new ATOM 0 HA ASN A 115 -3.507 9.159 13.639 1.00 34.35 H new ATOM 0 HB2 ASN A 115 -0.624 8.219 13.248 1.00 33.20 H new ATOM 0 HB3 ASN A 115 -1.218 9.841 12.950 1.00 33.20 H new ATOM 0 HD21 ASN A 115 0.369 9.421 16.431 1.00 1.25 H new ATOM 0 HD22 ASN A 115 0.874 8.852 14.836 1.00 1.25 H new ATOM 1773 N VAL A 116 -3.867 7.078 11.635 1.00 24.31 N ATOM 1774 CA VAL A 116 -4.134 6.598 10.273 1.00 41.00 C ATOM 1775 C VAL A 116 -5.294 7.354 9.599 1.00 42.05 C ATOM 1776 O VAL A 116 -6.354 7.557 10.193 1.00 51.14 O ATOM 1777 CB VAL A 116 -4.431 5.072 10.266 1.00 42.33 C ATOM 1778 CG1 VAL A 116 -5.572 4.728 11.219 1.00 51.22 C ATOM 1779 CG2 VAL A 116 -4.739 4.579 8.852 1.00 54.32 C ATOM 0 H VAL A 116 -4.401 6.597 12.359 1.00 24.31 H new ATOM 0 HA VAL A 116 -3.229 6.792 9.697 1.00 41.00 H new ATOM 0 HB VAL A 116 -3.535 4.559 10.616 1.00 42.33 H new ATOM 0 HG11 VAL A 116 -5.757 3.654 11.193 1.00 51.22 H new ATOM 0 HG12 VAL A 116 -5.302 5.025 12.232 1.00 51.22 H new ATOM 0 HG13 VAL A 116 -6.474 5.259 10.914 1.00 51.22 H new ATOM 0 HG21 VAL A 116 -4.943 3.509 8.876 1.00 54.32 H new ATOM 0 HG22 VAL A 116 -5.611 5.106 8.465 1.00 54.32 H new ATOM 0 HG23 VAL A 116 -3.883 4.771 8.205 1.00 54.32 H new ATOM 1789 N GLN A 117 -5.070 7.785 8.359 1.00 43.23 N ATOM 1790 CA GLN A 117 -6.115 8.410 7.538 1.00 71.52 C ATOM 1791 C GLN A 117 -6.401 7.552 6.298 1.00 51.14 C ATOM 1792 O GLN A 117 -5.536 6.804 5.837 1.00 52.01 O ATOM 1793 CB GLN A 117 -5.711 9.836 7.114 1.00 70.20 C ATOM 1794 CG GLN A 117 -5.742 10.866 8.247 1.00 3.24 C ATOM 1795 CD GLN A 117 -4.689 10.629 9.323 1.00 35.40 C ATOM 1796 OE1 GLN A 117 -4.913 10.905 10.497 1.00 73.24 O ATOM 1797 NE2 GLN A 117 -3.525 10.151 8.931 1.00 61.12 N ATOM 0 H GLN A 117 -4.165 7.713 7.894 1.00 43.23 H new ATOM 0 HA GLN A 117 -7.021 8.479 8.141 1.00 71.52 H new ATOM 0 HB2 GLN A 117 -4.706 9.806 6.694 1.00 70.20 H new ATOM 0 HB3 GLN A 117 -6.379 10.168 6.319 1.00 70.20 H new ATOM 0 HG2 GLN A 117 -5.599 11.861 7.825 1.00 3.24 H new ATOM 0 HG3 GLN A 117 -6.729 10.854 8.709 1.00 3.24 H new ATOM 0 HE21 GLN A 117 -3.369 9.931 7.947 1.00 61.12 H new ATOM 0 HE22 GLN A 117 -2.780 10.001 9.611 1.00 61.12 H new ATOM 1806 N ASN A 118 -7.609 7.666 5.756 1.00 73.31 N ATOM 1807 CA ASN A 118 -8.013 6.858 4.598 1.00 33.13 C ATOM 1808 C ASN A 118 -8.092 7.694 3.310 1.00 45.02 C ATOM 1809 O ASN A 118 -8.668 8.782 3.292 1.00 72.24 O ATOM 1810 CB ASN A 118 -9.357 6.168 4.876 1.00 51.13 C ATOM 1811 CG ASN A 118 -10.427 7.121 5.377 1.00 70.50 C ATOM 1812 OD1 ASN A 118 -11.158 7.725 4.599 1.00 61.01 O ATOM 1813 ND2 ASN A 118 -10.538 7.251 6.684 1.00 45.55 N ATOM 0 H ASN A 118 -8.327 8.306 6.095 1.00 73.31 H new ATOM 0 HA ASN A 118 -7.246 6.099 4.443 1.00 33.13 H new ATOM 0 HB2 ASN A 118 -9.707 5.687 3.962 1.00 51.13 H new ATOM 0 HB3 ASN A 118 -9.207 5.380 5.614 1.00 51.13 H new ATOM 0 HD21 ASN A 118 -11.248 7.869 7.077 1.00 45.55 H new ATOM 0 HD22 ASN A 118 -9.914 6.734 7.303 1.00 45.55 H new ATOM 1820 N GLN A 119 -7.504 7.177 2.230 1.00 40.32 N ATOM 1821 CA GLN A 119 -7.537 7.851 0.922 1.00 25.02 C ATOM 1822 C GLN A 119 -8.156 6.945 -0.158 1.00 33.30 C ATOM 1823 O GLN A 119 -7.925 5.735 -0.175 1.00 43.11 O ATOM 1824 CB GLN A 119 -6.118 8.265 0.507 1.00 74.25 C ATOM 1825 CG GLN A 119 -6.050 9.062 -0.796 1.00 25.23 C ATOM 1826 CD GLN A 119 -4.632 9.434 -1.199 1.00 24.11 C ATOM 1827 OE1 GLN A 119 -3.772 9.679 -0.229 1.00 71.32 O flip ATOM 1828 NE2 GLN A 119 -4.314 9.522 -2.377 1.00 40.40 N flip ATOM 0 H GLN A 119 -6.997 6.292 2.231 1.00 40.32 H new ATOM 0 HA GLN A 119 -8.160 8.740 1.017 1.00 25.02 H new ATOM 0 HB2 GLN A 119 -5.678 8.860 1.307 1.00 74.25 H new ATOM 0 HB3 GLN A 119 -5.507 7.369 0.403 1.00 74.25 H new ATOM 0 HG2 GLN A 119 -6.506 8.478 -1.595 1.00 25.23 H new ATOM 0 HG3 GLN A 119 -6.641 9.972 -0.689 1.00 25.23 H new ATOM 0 HE21 GLN A 119 -5.000 9.327 -3.106 1.00 40.40 H new ATOM 0 HE22 GLN A 119 -3.363 9.791 -2.630 1.00 40.40 H new ATOM 1837 N LEU A 120 -8.932 7.540 -1.059 1.00 31.10 N ATOM 1838 CA LEU A 120 -9.603 6.792 -2.133 1.00 61.32 C ATOM 1839 C LEU A 120 -8.689 6.611 -3.358 1.00 71.25 C ATOM 1840 O LEU A 120 -8.501 7.536 -4.152 1.00 4.05 O ATOM 1841 CB LEU A 120 -10.898 7.510 -2.550 1.00 13.02 C ATOM 1842 CG LEU A 120 -11.963 7.654 -1.448 1.00 11.43 C ATOM 1843 CD1 LEU A 120 -13.168 8.443 -1.961 1.00 5.51 C ATOM 1844 CD2 LEU A 120 -12.393 6.283 -0.930 1.00 0.53 C ATOM 0 H LEU A 120 -9.116 8.543 -1.072 1.00 31.10 H new ATOM 0 HA LEU A 120 -9.843 5.802 -1.744 1.00 61.32 H new ATOM 0 HB2 LEU A 120 -10.640 8.505 -2.913 1.00 13.02 H new ATOM 0 HB3 LEU A 120 -11.339 6.969 -3.388 1.00 13.02 H new ATOM 0 HG LEU A 120 -11.523 8.207 -0.618 1.00 11.43 H new ATOM 0 HD11 LEU A 120 -13.909 8.533 -1.167 1.00 5.51 H new ATOM 0 HD12 LEU A 120 -12.846 9.437 -2.272 1.00 5.51 H new ATOM 0 HD13 LEU A 120 -13.609 7.922 -2.811 1.00 5.51 H new ATOM 0 HD21 LEU A 120 -13.146 6.408 -0.152 1.00 0.53 H new ATOM 0 HD22 LEU A 120 -12.812 5.699 -1.750 1.00 0.53 H new ATOM 0 HD23 LEU A 120 -11.529 5.762 -0.518 1.00 0.53 H new ATOM 1856 N ILE A 121 -8.127 5.413 -3.512 1.00 12.32 N ATOM 1857 CA ILE A 121 -7.232 5.114 -4.639 1.00 70.55 C ATOM 1858 C ILE A 121 -7.999 4.557 -5.854 1.00 43.53 C ATOM 1859 O ILE A 121 -8.930 3.761 -5.712 1.00 31.42 O ATOM 1860 CB ILE A 121 -6.118 4.110 -4.230 1.00 11.44 C ATOM 1861 CG1 ILE A 121 -6.728 2.840 -3.604 1.00 5.34 C ATOM 1862 CG2 ILE A 121 -5.129 4.771 -3.270 1.00 12.50 C ATOM 1863 CD1 ILE A 121 -5.718 1.752 -3.300 1.00 51.41 C ATOM 0 H ILE A 121 -8.273 4.631 -2.873 1.00 12.32 H new ATOM 0 HA ILE A 121 -6.773 6.061 -4.923 1.00 70.55 H new ATOM 0 HB ILE A 121 -5.576 3.813 -5.128 1.00 11.44 H new ATOM 0 HG12 ILE A 121 -7.240 3.113 -2.681 1.00 5.34 H new ATOM 0 HG13 ILE A 121 -7.483 2.441 -4.282 1.00 5.34 H new ATOM 0 HG21 ILE A 121 -4.356 4.054 -2.994 1.00 12.50 H new ATOM 0 HG22 ILE A 121 -4.669 5.631 -3.757 1.00 12.50 H new ATOM 0 HG23 ILE A 121 -5.656 5.100 -2.374 1.00 12.50 H new ATOM 0 HD11 ILE A 121 -6.228 0.894 -2.862 1.00 51.41 H new ATOM 0 HD12 ILE A 121 -5.222 1.448 -4.222 1.00 51.41 H new ATOM 0 HD13 ILE A 121 -4.976 2.130 -2.597 1.00 51.41 H new ATOM 1875 N ASN A 122 -7.603 4.986 -7.055 1.00 0.04 N ATOM 1876 CA ASN A 122 -8.237 4.527 -8.304 1.00 35.41 C ATOM 1877 C ASN A 122 -7.175 4.065 -9.319 1.00 72.02 C ATOM 1878 O ASN A 122 -6.065 4.591 -9.342 1.00 2.22 O ATOM 1879 CB ASN A 122 -9.077 5.655 -8.928 1.00 24.15 C ATOM 1880 CG ASN A 122 -10.127 6.237 -7.988 1.00 52.41 C ATOM 1881 OD1 ASN A 122 -10.659 5.433 -7.091 1.00 70.25 O flip ATOM 1882 ND2 ASN A 122 -10.461 7.415 -8.071 1.00 30.05 N flip ATOM 0 H ASN A 122 -6.844 5.653 -7.194 1.00 0.04 H new ATOM 0 HA ASN A 122 -8.885 3.686 -8.058 1.00 35.41 H new ATOM 0 HB2 ASN A 122 -8.410 6.454 -9.252 1.00 24.15 H new ATOM 0 HB3 ASN A 122 -9.574 5.274 -9.820 1.00 24.15 H new ATOM 0 HD21 ASN A 122 -10.034 8.018 -8.774 1.00 30.05 H new ATOM 0 HD22 ASN A 122 -11.165 7.791 -7.437 1.00 30.05 H new ATOM 1889 N ALA A 123 -7.514 3.086 -10.156 1.00 50.42 N ATOM 1890 CA ALA A 123 -6.586 2.606 -11.193 1.00 64.32 C ATOM 1891 C ALA A 123 -7.295 2.387 -12.543 1.00 33.23 C ATOM 1892 O ALA A 123 -8.462 1.994 -12.585 1.00 75.43 O ATOM 1893 CB ALA A 123 -5.905 1.323 -10.733 1.00 4.41 C ATOM 0 H ALA A 123 -8.416 2.609 -10.142 1.00 50.42 H new ATOM 0 HA ALA A 123 -5.831 3.378 -11.345 1.00 64.32 H new ATOM 0 HB1 ALA A 123 -5.221 0.976 -11.507 1.00 4.41 H new ATOM 0 HB2 ALA A 123 -5.348 1.515 -9.816 1.00 4.41 H new ATOM 0 HB3 ALA A 123 -6.659 0.558 -10.546 1.00 4.41 H new ATOM 1899 N PRO A 124 -6.596 2.664 -13.668 1.00 71.43 N ATOM 1900 CA PRO A 124 -7.143 2.470 -15.028 1.00 13.21 C ATOM 1901 C PRO A 124 -7.434 0.996 -15.373 1.00 31.10 C ATOM 1902 O PRO A 124 -7.000 0.077 -14.677 1.00 72.11 O ATOM 1903 CB PRO A 124 -6.036 3.022 -15.948 1.00 4.44 C ATOM 1904 CG PRO A 124 -5.179 3.866 -15.063 1.00 24.03 C ATOM 1905 CD PRO A 124 -5.226 3.211 -13.711 1.00 25.12 C ATOM 0 HA PRO A 124 -8.106 2.970 -15.134 1.00 13.21 H new ATOM 0 HB2 PRO A 124 -5.460 2.214 -16.400 1.00 4.44 H new ATOM 0 HB3 PRO A 124 -6.458 3.609 -16.764 1.00 4.44 H new ATOM 0 HG2 PRO A 124 -4.157 3.916 -15.439 1.00 24.03 H new ATOM 0 HG3 PRO A 124 -5.552 4.889 -15.016 1.00 24.03 H new ATOM 0 HD2 PRO A 124 -4.473 2.429 -13.613 1.00 25.12 H new ATOM 0 HD3 PRO A 124 -5.049 3.926 -12.907 1.00 25.12 H new ATOM 1913 N ALA A 125 -8.161 0.782 -16.471 1.00 4.31 N ATOM 1914 CA ALA A 125 -8.536 -0.568 -16.908 1.00 51.54 C ATOM 1915 C ALA A 125 -7.375 -1.293 -17.608 1.00 12.52 C ATOM 1916 O ALA A 125 -6.761 -0.760 -18.536 1.00 33.20 O ATOM 1917 CB ALA A 125 -9.744 -0.496 -17.839 1.00 62.25 C ATOM 0 H ALA A 125 -8.504 1.528 -17.077 1.00 4.31 H new ATOM 0 HA ALA A 125 -8.791 -1.143 -16.018 1.00 51.54 H new ATOM 0 HB1 ALA A 125 -10.017 -1.501 -18.159 1.00 62.25 H new ATOM 0 HB2 ALA A 125 -10.583 -0.043 -17.311 1.00 62.25 H new ATOM 0 HB3 ALA A 125 -9.495 0.108 -18.712 1.00 62.25 H new ATOM 1923 N SER A 126 -7.080 -2.516 -17.167 1.00 12.25 N ATOM 1924 CA SER A 126 -6.046 -3.335 -17.817 1.00 0.23 C ATOM 1925 C SER A 126 -6.599 -3.994 -19.089 1.00 41.22 C ATOM 1926 O SER A 126 -6.923 -5.182 -19.102 1.00 60.32 O ATOM 1927 CB SER A 126 -5.501 -4.414 -16.863 1.00 70.11 C ATOM 1928 OG SER A 126 -4.847 -3.842 -15.738 1.00 44.32 O ATOM 0 H SER A 126 -7.535 -2.962 -16.370 1.00 12.25 H new ATOM 0 HA SER A 126 -5.224 -2.672 -18.087 1.00 0.23 H new ATOM 0 HB2 SER A 126 -6.321 -5.047 -16.524 1.00 70.11 H new ATOM 0 HB3 SER A 126 -4.804 -5.056 -17.401 1.00 70.11 H new ATOM 0 HG SER A 126 -4.343 -4.536 -15.264 1.00 44.32 H new ATOM 1934 N VAL A 127 -6.736 -3.202 -20.150 1.00 1.41 N ATOM 1935 CA VAL A 127 -7.239 -3.702 -21.437 1.00 1.51 C ATOM 1936 C VAL A 127 -6.211 -4.625 -22.114 1.00 60.24 C ATOM 1937 O VAL A 127 -6.567 -5.555 -22.837 1.00 61.24 O ATOM 1938 CB VAL A 127 -7.592 -2.529 -22.394 1.00 20.13 C ATOM 1939 CG1 VAL A 127 -8.182 -3.046 -23.710 1.00 15.31 C ATOM 1940 CG2 VAL A 127 -8.552 -1.552 -21.714 1.00 74.11 C ATOM 0 H VAL A 127 -6.506 -2.208 -20.148 1.00 1.41 H new ATOM 0 HA VAL A 127 -8.144 -4.274 -21.229 1.00 1.51 H new ATOM 0 HB VAL A 127 -6.670 -1.997 -22.630 1.00 20.13 H new ATOM 0 HG11 VAL A 127 -8.419 -2.203 -24.359 1.00 15.31 H new ATOM 0 HG12 VAL A 127 -7.457 -3.692 -24.205 1.00 15.31 H new ATOM 0 HG13 VAL A 127 -9.091 -3.612 -23.504 1.00 15.31 H new ATOM 0 HG21 VAL A 127 -8.788 -0.738 -22.399 1.00 74.11 H new ATOM 0 HG22 VAL A 127 -9.469 -2.074 -21.441 1.00 74.11 H new ATOM 0 HG23 VAL A 127 -8.084 -1.147 -20.817 1.00 74.11 H new ATOM 1950 N LEU A 128 -4.933 -4.355 -21.864 1.00 31.31 N ATOM 1951 CA LEU A 128 -3.840 -5.170 -22.404 1.00 14.30 C ATOM 1952 C LEU A 128 -3.380 -6.224 -21.384 1.00 71.00 C ATOM 1953 O LEU A 128 -3.619 -6.090 -20.182 1.00 71.21 O ATOM 1954 CB LEU A 128 -2.660 -4.265 -22.796 1.00 12.01 C ATOM 1955 CG LEU A 128 -2.994 -3.155 -23.811 1.00 72.40 C ATOM 1956 CD1 LEU A 128 -1.772 -2.280 -24.086 1.00 41.13 C ATOM 1957 CD2 LEU A 128 -3.534 -3.753 -25.111 1.00 34.11 C ATOM 0 H LEU A 128 -4.624 -3.573 -21.287 1.00 31.31 H new ATOM 0 HA LEU A 128 -4.206 -5.692 -23.288 1.00 14.30 H new ATOM 0 HB2 LEU A 128 -2.262 -3.802 -21.893 1.00 12.01 H new ATOM 0 HB3 LEU A 128 -1.867 -4.888 -23.210 1.00 12.01 H new ATOM 0 HG LEU A 128 -3.770 -2.525 -23.377 1.00 72.40 H new ATOM 0 HD11 LEU A 128 -2.034 -1.504 -24.806 1.00 41.13 H new ATOM 0 HD12 LEU A 128 -1.440 -1.816 -23.157 1.00 41.13 H new ATOM 0 HD13 LEU A 128 -0.968 -2.895 -24.492 1.00 41.13 H new ATOM 0 HD21 LEU A 128 -3.763 -2.951 -25.813 1.00 34.11 H new ATOM 0 HD22 LEU A 128 -2.784 -4.413 -25.547 1.00 34.11 H new ATOM 0 HD23 LEU A 128 -4.440 -4.321 -24.901 1.00 34.11 H new ATOM 1969 N ALA A 129 -2.716 -7.270 -21.871 1.00 11.21 N ATOM 1970 CA ALA A 129 -2.215 -8.345 -21.006 1.00 23.11 C ATOM 1971 C ALA A 129 -0.691 -8.509 -21.139 1.00 1.45 C ATOM 1972 O ALA A 129 -0.131 -8.281 -22.214 1.00 40.01 O ATOM 1973 CB ALA A 129 -2.922 -9.655 -21.343 1.00 40.43 C ATOM 0 H ALA A 129 -2.510 -7.399 -22.862 1.00 11.21 H new ATOM 0 HA ALA A 129 -2.430 -8.077 -19.972 1.00 23.11 H new ATOM 0 HB1 ALA A 129 -2.545 -10.448 -20.697 1.00 40.43 H new ATOM 0 HB2 ALA A 129 -3.995 -9.540 -21.188 1.00 40.43 H new ATOM 0 HB3 ALA A 129 -2.732 -9.914 -22.385 1.00 40.43 H new ATOM 1979 N PRO A 130 0.014 -8.892 -20.050 1.00 33.33 N ATOM 1980 CA PRO A 130 -0.575 -9.132 -18.721 1.00 23.21 C ATOM 1981 C PRO A 130 -0.804 -7.833 -17.928 1.00 73.22 C ATOM 1982 O PRO A 130 -0.364 -6.753 -18.335 1.00 64.11 O ATOM 1983 CB PRO A 130 0.474 -10.021 -18.013 1.00 14.00 C ATOM 1984 CG PRO A 130 1.586 -10.226 -19.002 1.00 13.53 C ATOM 1985 CD PRO A 130 1.457 -9.130 -20.027 1.00 35.24 C ATOM 0 HA PRO A 130 -1.561 -9.591 -18.796 1.00 23.21 H new ATOM 0 HB2 PRO A 130 0.843 -9.541 -17.107 1.00 14.00 H new ATOM 0 HB3 PRO A 130 0.038 -10.974 -17.714 1.00 14.00 H new ATOM 0 HG2 PRO A 130 2.557 -10.182 -18.508 1.00 13.53 H new ATOM 0 HG3 PRO A 130 1.511 -11.207 -19.472 1.00 13.53 H new ATOM 0 HD2 PRO A 130 2.012 -8.237 -19.739 1.00 35.24 H new ATOM 0 HD3 PRO A 130 1.834 -9.439 -21.002 1.00 35.24 H new ATOM 1993 N SER A 131 -1.487 -7.942 -16.792 1.00 44.41 N ATOM 1994 CA SER A 131 -1.768 -6.770 -15.949 1.00 51.31 C ATOM 1995 C SER A 131 -0.526 -6.343 -15.145 1.00 23.24 C ATOM 1996 O SER A 131 -0.277 -6.839 -14.048 1.00 72.43 O ATOM 1997 CB SER A 131 -2.945 -7.048 -14.997 1.00 34.15 C ATOM 1998 OG SER A 131 -3.253 -5.911 -14.203 1.00 15.33 O ATOM 0 H SER A 131 -1.857 -8.821 -16.430 1.00 44.41 H new ATOM 0 HA SER A 131 -2.041 -5.950 -16.613 1.00 51.31 H new ATOM 0 HB2 SER A 131 -3.822 -7.337 -15.576 1.00 34.15 H new ATOM 0 HB3 SER A 131 -2.699 -7.890 -14.349 1.00 34.15 H new ATOM 0 HG SER A 131 -4.005 -6.120 -13.611 1.00 15.33 H new ATOM 2004 N ASP A 132 0.271 -5.446 -15.726 1.00 21.53 N ATOM 2005 CA ASP A 132 1.433 -4.863 -15.043 1.00 42.32 C ATOM 2006 C ASP A 132 1.258 -3.340 -14.921 1.00 42.03 C ATOM 2007 O ASP A 132 1.726 -2.571 -15.767 1.00 34.04 O ATOM 2008 CB ASP A 132 2.721 -5.216 -15.805 1.00 34.22 C ATOM 2009 CG ASP A 132 3.979 -4.605 -15.201 1.00 42.43 C ATOM 2010 OD1 ASP A 132 4.051 -4.445 -13.966 1.00 60.03 O ATOM 2011 OD2 ASP A 132 4.912 -4.284 -15.970 1.00 21.12 O ATOM 0 H ASP A 132 0.133 -5.103 -16.677 1.00 21.53 H new ATOM 0 HA ASP A 132 1.510 -5.278 -14.038 1.00 42.32 H new ATOM 0 HB2 ASP A 132 2.831 -6.300 -15.831 1.00 34.22 H new ATOM 0 HB3 ASP A 132 2.625 -4.880 -16.838 1.00 34.22 H new ATOM 2016 N VAL A 133 0.553 -2.918 -13.875 1.00 24.52 N ATOM 2017 CA VAL A 133 0.178 -1.510 -13.700 1.00 20.21 C ATOM 2018 C VAL A 133 1.072 -0.802 -12.665 1.00 0.11 C ATOM 2019 O VAL A 133 1.687 -1.445 -11.812 1.00 70.04 O ATOM 2020 CB VAL A 133 -1.310 -1.394 -13.262 1.00 31.31 C ATOM 2021 CG1 VAL A 133 -1.768 0.067 -13.219 1.00 23.51 C ATOM 2022 CG2 VAL A 133 -2.210 -2.217 -14.187 1.00 44.42 C ATOM 0 H VAL A 133 0.226 -3.532 -13.129 1.00 24.52 H new ATOM 0 HA VAL A 133 0.317 -1.019 -14.663 1.00 20.21 H new ATOM 0 HB VAL A 133 -1.392 -1.796 -12.252 1.00 31.31 H new ATOM 0 HG11 VAL A 133 -2.812 0.112 -12.909 1.00 23.51 H new ATOM 0 HG12 VAL A 133 -1.154 0.620 -12.508 1.00 23.51 H new ATOM 0 HG13 VAL A 133 -1.664 0.510 -14.209 1.00 23.51 H new ATOM 0 HG21 VAL A 133 -3.247 -2.123 -13.864 1.00 44.42 H new ATOM 0 HG22 VAL A 133 -2.114 -1.851 -15.209 1.00 44.42 H new ATOM 0 HG23 VAL A 133 -1.911 -3.265 -14.148 1.00 44.42 H new ATOM 2032 N ASP A 134 1.159 0.523 -12.762 1.00 35.44 N ATOM 2033 CA ASP A 134 1.882 1.336 -11.777 1.00 30.43 C ATOM 2034 C ASP A 134 1.255 2.741 -11.664 1.00 11.34 C ATOM 2035 O ASP A 134 1.353 3.559 -12.580 1.00 65.23 O ATOM 2036 CB ASP A 134 3.380 1.415 -12.136 1.00 51.43 C ATOM 2037 CG ASP A 134 3.641 2.000 -13.517 1.00 20.41 C ATOM 2038 OD1 ASP A 134 3.253 1.368 -14.522 1.00 62.34 O ATOM 2039 OD2 ASP A 134 4.245 3.088 -13.607 1.00 34.24 O ATOM 0 H ASP A 134 0.736 1.063 -13.517 1.00 35.44 H new ATOM 0 HA ASP A 134 1.797 0.857 -10.802 1.00 30.43 H new ATOM 0 HB2 ASP A 134 3.893 2.021 -11.390 1.00 51.43 H new ATOM 0 HB3 ASP A 134 3.811 0.415 -12.086 1.00 51.43 H new ATOM 2044 N ILE A 135 0.584 3.008 -10.545 1.00 44.50 N ATOM 2045 CA ILE A 135 -0.094 4.296 -10.334 1.00 52.02 C ATOM 2046 C ILE A 135 0.563 5.111 -9.201 1.00 51.13 C ATOM 2047 O ILE A 135 0.893 4.569 -8.144 1.00 13.02 O ATOM 2048 CB ILE A 135 -1.604 4.094 -10.018 1.00 3.53 C ATOM 2049 CG1 ILE A 135 -1.787 3.214 -8.764 1.00 30.53 C ATOM 2050 CG2 ILE A 135 -2.329 3.484 -11.222 1.00 1.10 C ATOM 2051 CD1 ILE A 135 -3.232 2.984 -8.372 1.00 13.05 C ATOM 0 H ILE A 135 0.492 2.353 -9.768 1.00 44.50 H new ATOM 0 HA ILE A 135 0.004 4.855 -11.264 1.00 52.02 H new ATOM 0 HB ILE A 135 -2.045 5.070 -9.813 1.00 3.53 H new ATOM 0 HG12 ILE A 135 -1.312 2.249 -8.939 1.00 30.53 H new ATOM 0 HG13 ILE A 135 -1.265 3.680 -7.928 1.00 30.53 H new ATOM 0 HG21 ILE A 135 -3.384 3.350 -10.982 1.00 1.10 H new ATOM 0 HG22 ILE A 135 -2.234 4.150 -12.080 1.00 1.10 H new ATOM 0 HG23 ILE A 135 -1.886 2.517 -11.462 1.00 1.10 H new ATOM 0 HD11 ILE A 135 -3.272 2.356 -7.482 1.00 13.05 H new ATOM 0 HD12 ILE A 135 -3.709 3.941 -8.163 1.00 13.05 H new ATOM 0 HD13 ILE A 135 -3.756 2.488 -9.189 1.00 13.05 H new ATOM 2063 N PRO A 136 0.781 6.426 -9.410 1.00 13.31 N ATOM 2064 CA PRO A 136 1.355 7.302 -8.376 1.00 14.51 C ATOM 2065 C PRO A 136 0.359 7.635 -7.249 1.00 32.52 C ATOM 2066 O PRO A 136 -0.700 8.227 -7.484 1.00 33.42 O ATOM 2067 CB PRO A 136 1.745 8.564 -9.152 1.00 13.30 C ATOM 2068 CG PRO A 136 0.819 8.595 -10.326 1.00 0.11 C ATOM 2069 CD PRO A 136 0.504 7.157 -10.665 1.00 3.23 C ATOM 0 HA PRO A 136 2.192 6.826 -7.865 1.00 14.51 H new ATOM 0 HB2 PRO A 136 1.633 9.457 -8.537 1.00 13.30 H new ATOM 0 HB3 PRO A 136 2.787 8.526 -9.471 1.00 13.30 H new ATOM 0 HG2 PRO A 136 -0.091 9.145 -10.087 1.00 0.11 H new ATOM 0 HG3 PRO A 136 1.284 9.100 -11.173 1.00 0.11 H new ATOM 0 HD2 PRO A 136 -0.534 7.038 -10.976 1.00 3.23 H new ATOM 0 HD3 PRO A 136 1.125 6.794 -11.484 1.00 3.23 H new ATOM 2077 N LEU A 137 0.711 7.253 -6.026 1.00 43.34 N ATOM 2078 CA LEU A 137 -0.131 7.505 -4.850 1.00 43.32 C ATOM 2079 C LEU A 137 0.370 8.750 -4.094 1.00 53.14 C ATOM 2080 O LEU A 137 1.533 8.816 -3.688 1.00 70.22 O ATOM 2081 CB LEU A 137 -0.126 6.267 -3.929 1.00 72.02 C ATOM 2082 CG LEU A 137 -1.417 6.017 -3.119 1.00 61.12 C ATOM 2083 CD1 LEU A 137 -1.297 4.735 -2.297 1.00 3.03 C ATOM 2084 CD2 LEU A 137 -1.749 7.201 -2.212 1.00 10.21 C ATOM 0 H LEU A 137 1.581 6.763 -5.817 1.00 43.34 H new ATOM 0 HA LEU A 137 -1.154 7.693 -5.175 1.00 43.32 H new ATOM 0 HB2 LEU A 137 0.072 5.386 -4.540 1.00 72.02 H new ATOM 0 HB3 LEU A 137 0.705 6.363 -3.230 1.00 72.02 H new ATOM 0 HG LEU A 137 -2.234 5.903 -3.831 1.00 61.12 H new ATOM 0 HD11 LEU A 137 -2.217 4.577 -1.734 1.00 3.03 H new ATOM 0 HD12 LEU A 137 -1.130 3.889 -2.964 1.00 3.03 H new ATOM 0 HD13 LEU A 137 -0.459 4.823 -1.606 1.00 3.03 H new ATOM 0 HD21 LEU A 137 -2.663 6.989 -1.658 1.00 10.21 H new ATOM 0 HD22 LEU A 137 -0.930 7.364 -1.512 1.00 10.21 H new ATOM 0 HD23 LEU A 137 -1.891 8.095 -2.819 1.00 10.21 H new ATOM 2096 N GLN A 138 -0.511 9.731 -3.912 1.00 33.10 N ATOM 2097 CA GLN A 138 -0.147 10.993 -3.258 1.00 23.33 C ATOM 2098 C GLN A 138 -0.712 11.066 -1.830 1.00 44.20 C ATOM 2099 O GLN A 138 -1.910 11.271 -1.630 1.00 41.41 O ATOM 2100 CB GLN A 138 -0.659 12.175 -4.094 1.00 1.22 C ATOM 2101 CG GLN A 138 -0.031 13.514 -3.726 1.00 55.42 C ATOM 2102 CD GLN A 138 -0.596 14.669 -4.537 1.00 64.15 C ATOM 2103 OE1 GLN A 138 -1.077 14.493 -5.653 1.00 14.32 O ATOM 2104 NE2 GLN A 138 -0.514 15.867 -3.999 1.00 0.24 N ATOM 0 H GLN A 138 -1.486 9.679 -4.208 1.00 33.10 H new ATOM 0 HA GLN A 138 0.940 11.042 -3.188 1.00 23.33 H new ATOM 0 HB2 GLN A 138 -0.466 11.972 -5.147 1.00 1.22 H new ATOM 0 HB3 GLN A 138 -1.740 12.248 -3.977 1.00 1.22 H new ATOM 0 HG2 GLN A 138 -0.192 13.707 -2.665 1.00 55.42 H new ATOM 0 HG3 GLN A 138 1.047 13.460 -3.880 1.00 55.42 H new ATOM 0 HE21 GLN A 138 -0.109 15.982 -3.070 1.00 0.24 H new ATOM 0 HE22 GLN A 138 -0.855 16.680 -4.511 1.00 0.24 H new ATOM 2113 N LEU A 139 0.158 10.890 -0.841 1.00 33.34 N ATOM 2114 CA LEU A 139 -0.242 10.924 0.570 1.00 75.41 C ATOM 2115 C LEU A 139 -0.110 12.341 1.151 1.00 44.42 C ATOM 2116 O LEU A 139 0.934 12.984 1.018 1.00 1.12 O ATOM 2117 CB LEU A 139 0.620 9.943 1.374 1.00 11.53 C ATOM 2118 CG LEU A 139 0.556 8.480 0.903 1.00 63.33 C ATOM 2119 CD1 LEU A 139 1.593 7.626 1.631 1.00 50.32 C ATOM 2120 CD2 LEU A 139 -0.847 7.909 1.102 1.00 12.25 C ATOM 0 H LEU A 139 1.153 10.721 -0.988 1.00 33.34 H new ATOM 0 HA LEU A 139 -1.289 10.629 0.638 1.00 75.41 H new ATOM 0 HB2 LEU A 139 1.657 10.277 1.333 1.00 11.53 H new ATOM 0 HB3 LEU A 139 0.313 9.986 2.419 1.00 11.53 H new ATOM 0 HG LEU A 139 0.787 8.459 -0.162 1.00 63.33 H new ATOM 0 HD11 LEU A 139 1.527 6.596 1.280 1.00 50.32 H new ATOM 0 HD12 LEU A 139 2.591 8.015 1.429 1.00 50.32 H new ATOM 0 HD13 LEU A 139 1.401 7.657 2.704 1.00 50.32 H new ATOM 0 HD21 LEU A 139 -0.870 6.874 0.762 1.00 12.25 H new ATOM 0 HD22 LEU A 139 -1.110 7.950 2.159 1.00 12.25 H new ATOM 0 HD23 LEU A 139 -1.563 8.495 0.527 1.00 12.25 H new ATOM 2132 N LYS A 140 -1.167 12.816 1.807 1.00 4.14 N ATOM 2133 CA LYS A 140 -1.203 14.187 2.336 1.00 75.02 C ATOM 2134 C LYS A 140 -1.060 14.221 3.866 1.00 30.24 C ATOM 2135 O LYS A 140 -1.551 13.334 4.567 1.00 52.11 O ATOM 2136 CB LYS A 140 -2.519 14.867 1.938 1.00 13.02 C ATOM 2137 CG LYS A 140 -2.743 14.955 0.432 1.00 41.11 C ATOM 2138 CD LYS A 140 -4.052 15.666 0.098 1.00 34.40 C ATOM 2139 CE LYS A 140 -4.244 15.835 -1.404 1.00 45.25 C ATOM 2140 NZ LYS A 140 -3.212 16.718 -2.010 1.00 1.03 N ATOM 0 H LYS A 140 -2.013 12.275 1.987 1.00 4.14 H new ATOM 0 HA LYS A 140 -0.356 14.721 1.906 1.00 75.02 H new ATOM 0 HB2 LYS A 140 -3.348 14.320 2.387 1.00 13.02 H new ATOM 0 HB3 LYS A 140 -2.537 15.873 2.357 1.00 13.02 H new ATOM 0 HG2 LYS A 140 -1.911 15.487 -0.029 1.00 41.11 H new ATOM 0 HG3 LYS A 140 -2.755 13.952 0.006 1.00 41.11 H new ATOM 0 HD2 LYS A 140 -4.887 15.099 0.508 1.00 34.40 H new ATOM 0 HD3 LYS A 140 -4.065 16.645 0.577 1.00 34.40 H new ATOM 0 HE2 LYS A 140 -4.210 14.857 -1.885 1.00 45.25 H new ATOM 0 HE3 LYS A 140 -5.233 16.251 -1.597 1.00 45.25 H new ATOM 0 HZ1 LYS A 140 -3.615 17.209 -2.834 1.00 1.03 H new ATOM 0 HZ2 LYS A 140 -2.899 17.419 -1.308 1.00 1.03 H new ATOM 0 HZ3 LYS A 140 -2.399 16.145 -2.312 1.00 1.03 H new ATOM 2154 N GLY A 141 -0.388 15.257 4.373 1.00 50.32 N ATOM 2155 CA GLY A 141 -0.275 15.457 5.817 1.00 1.31 C ATOM 2156 C GLY A 141 0.570 14.401 6.526 1.00 71.44 C ATOM 2157 O GLY A 141 0.368 14.133 7.712 1.00 10.53 O ATOM 0 H GLY A 141 0.082 15.965 3.809 1.00 50.32 H new ATOM 0 HA2 GLY A 141 0.158 16.440 6.005 1.00 1.31 H new ATOM 0 HA3 GLY A 141 -1.274 15.460 6.252 1.00 1.31 H new ATOM 2161 N ILE A 142 1.519 13.802 5.811 1.00 2.34 N ATOM 2162 CA ILE A 142 2.402 12.791 6.401 1.00 2.33 C ATOM 2163 C ILE A 142 3.737 12.684 5.641 1.00 62.41 C ATOM 2164 O ILE A 142 3.772 12.446 4.432 1.00 55.11 O ATOM 2165 CB ILE A 142 1.707 11.401 6.462 1.00 23.04 C ATOM 2166 CG1 ILE A 142 2.612 10.365 7.158 1.00 72.23 C ATOM 2167 CG2 ILE A 142 1.306 10.929 5.062 1.00 4.11 C ATOM 2168 CD1 ILE A 142 1.935 9.029 7.404 1.00 65.23 C ATOM 0 H ILE A 142 1.698 13.996 4.826 1.00 2.34 H new ATOM 0 HA ILE A 142 2.618 13.116 7.419 1.00 2.33 H new ATOM 0 HB ILE A 142 0.797 11.503 7.054 1.00 23.04 H new ATOM 0 HG12 ILE A 142 3.501 10.205 6.548 1.00 72.23 H new ATOM 0 HG13 ILE A 142 2.949 10.772 8.111 1.00 72.23 H new ATOM 0 HG21 ILE A 142 0.822 9.955 5.131 1.00 4.11 H new ATOM 0 HG22 ILE A 142 0.615 11.647 4.620 1.00 4.11 H new ATOM 0 HG23 ILE A 142 2.195 10.849 4.437 1.00 4.11 H new ATOM 0 HD11 ILE A 142 2.633 8.352 7.896 1.00 65.23 H new ATOM 0 HD12 ILE A 142 1.062 9.175 8.040 1.00 65.23 H new ATOM 0 HD13 ILE A 142 1.623 8.599 6.452 1.00 65.23 H new ATOM 2180 N SER A 143 4.838 12.885 6.360 1.00 15.45 N ATOM 2181 CA SER A 143 6.183 12.797 5.771 1.00 75.53 C ATOM 2182 C SER A 143 6.694 11.350 5.763 1.00 34.14 C ATOM 2183 O SER A 143 6.376 10.568 6.658 1.00 4.55 O ATOM 2184 CB SER A 143 7.168 13.681 6.548 1.00 75.13 C ATOM 2185 OG SER A 143 6.766 15.045 6.545 1.00 74.54 O ATOM 0 H SER A 143 4.831 13.111 7.355 1.00 15.45 H new ATOM 0 HA SER A 143 6.114 13.148 4.741 1.00 75.53 H new ATOM 0 HB2 SER A 143 7.243 13.326 7.576 1.00 75.13 H new ATOM 0 HB3 SER A 143 8.161 13.593 6.107 1.00 75.13 H new ATOM 0 HG SER A 143 7.415 15.578 7.050 1.00 74.54 H new ATOM 2191 N VAL A 144 7.499 11.007 4.755 1.00 4.43 N ATOM 2192 CA VAL A 144 8.068 9.656 4.631 1.00 62.33 C ATOM 2193 C VAL A 144 8.832 9.235 5.903 1.00 72.45 C ATOM 2194 O VAL A 144 8.808 8.067 6.296 1.00 5.44 O ATOM 2195 CB VAL A 144 9.001 9.544 3.390 1.00 25.43 C ATOM 2196 CG1 VAL A 144 10.175 10.516 3.489 1.00 63.32 C ATOM 2197 CG2 VAL A 144 9.497 8.109 3.203 1.00 35.10 C ATOM 0 H VAL A 144 7.774 11.646 4.009 1.00 4.43 H new ATOM 0 HA VAL A 144 7.227 8.975 4.498 1.00 62.33 H new ATOM 0 HB VAL A 144 8.415 9.817 2.512 1.00 25.43 H new ATOM 0 HG11 VAL A 144 10.808 10.413 2.607 1.00 63.32 H new ATOM 0 HG12 VAL A 144 9.798 11.537 3.548 1.00 63.32 H new ATOM 0 HG13 VAL A 144 10.758 10.292 4.382 1.00 63.32 H new ATOM 0 HG21 VAL A 144 10.147 8.060 2.329 1.00 35.10 H new ATOM 0 HG22 VAL A 144 10.054 7.798 4.087 1.00 35.10 H new ATOM 0 HG23 VAL A 144 8.644 7.445 3.059 1.00 35.10 H new ATOM 2207 N ASP A 145 9.486 10.198 6.552 1.00 44.12 N ATOM 2208 CA ASP A 145 10.195 9.951 7.814 1.00 30.21 C ATOM 2209 C ASP A 145 9.243 9.417 8.905 1.00 12.22 C ATOM 2210 O ASP A 145 9.654 8.675 9.801 1.00 11.22 O ATOM 2211 CB ASP A 145 10.859 11.249 8.285 1.00 41.43 C ATOM 2212 CG ASP A 145 11.671 11.064 9.553 1.00 64.42 C ATOM 2213 OD1 ASP A 145 11.106 11.219 10.658 1.00 13.14 O ATOM 2214 OD2 ASP A 145 12.880 10.764 9.451 1.00 31.50 O ATOM 0 H ASP A 145 9.541 11.163 6.225 1.00 44.12 H new ATOM 0 HA ASP A 145 10.954 9.189 7.638 1.00 30.21 H new ATOM 0 HB2 ASP A 145 11.507 11.628 7.495 1.00 41.43 H new ATOM 0 HB3 ASP A 145 10.091 12.004 8.457 1.00 41.43 H new ATOM 2219 N GLN A 146 7.973 9.801 8.820 1.00 33.12 N ATOM 2220 CA GLN A 146 6.966 9.425 9.822 1.00 52.52 C ATOM 2221 C GLN A 146 5.953 8.407 9.269 1.00 64.24 C ATOM 2222 O GLN A 146 4.935 8.124 9.905 1.00 34.31 O ATOM 2223 CB GLN A 146 6.235 10.688 10.299 1.00 74.02 C ATOM 2224 CG GLN A 146 7.147 11.712 10.972 1.00 33.42 C ATOM 2225 CD GLN A 146 7.697 11.228 12.304 1.00 45.11 C ATOM 2226 OE1 GLN A 146 7.099 11.445 13.350 1.00 71.30 O ATOM 2227 NE2 GLN A 146 8.845 10.582 12.284 1.00 32.43 N ATOM 0 H GLN A 146 7.609 10.378 8.062 1.00 33.12 H new ATOM 0 HA GLN A 146 7.479 8.948 10.657 1.00 52.52 H new ATOM 0 HB2 GLN A 146 5.745 11.157 9.446 1.00 74.02 H new ATOM 0 HB3 GLN A 146 5.450 10.400 10.998 1.00 74.02 H new ATOM 0 HG2 GLN A 146 7.977 11.946 10.305 1.00 33.42 H new ATOM 0 HG3 GLN A 146 6.593 12.638 11.128 1.00 33.42 H new ATOM 0 HE21 GLN A 146 9.321 10.415 11.397 1.00 32.43 H new ATOM 0 HE22 GLN A 146 9.258 10.248 13.155 1.00 32.43 H new ATOM 2236 N LEU A 147 6.240 7.853 8.093 1.00 4.22 N ATOM 2237 CA LEU A 147 5.357 6.864 7.461 1.00 25.51 C ATOM 2238 C LEU A 147 5.442 5.497 8.163 1.00 33.44 C ATOM 2239 O LEU A 147 6.485 4.837 8.145 1.00 53.41 O ATOM 2240 CB LEU A 147 5.698 6.718 5.966 1.00 71.04 C ATOM 2241 CG LEU A 147 4.675 7.323 4.989 1.00 0.14 C ATOM 2242 CD1 LEU A 147 5.181 7.224 3.553 1.00 31.55 C ATOM 2243 CD2 LEU A 147 3.318 6.628 5.123 1.00 41.31 C ATOM 0 H LEU A 147 7.078 8.070 7.554 1.00 4.22 H new ATOM 0 HA LEU A 147 4.333 7.225 7.559 1.00 25.51 H new ATOM 0 HB2 LEU A 147 6.666 7.185 5.785 1.00 71.04 H new ATOM 0 HB3 LEU A 147 5.808 5.658 5.739 1.00 71.04 H new ATOM 0 HG LEU A 147 4.548 8.376 5.241 1.00 0.14 H new ATOM 0 HD11 LEU A 147 4.444 7.657 2.877 1.00 31.55 H new ATOM 0 HD12 LEU A 147 6.122 7.767 3.460 1.00 31.55 H new ATOM 0 HD13 LEU A 147 5.340 6.177 3.294 1.00 31.55 H new ATOM 0 HD21 LEU A 147 2.611 7.072 4.423 1.00 41.31 H new ATOM 0 HD22 LEU A 147 3.429 5.567 4.902 1.00 41.31 H new ATOM 0 HD23 LEU A 147 2.946 6.749 6.140 1.00 41.31 H new ATOM 2255 N GLY A 148 4.338 5.076 8.778 1.00 2.33 N ATOM 2256 CA GLY A 148 4.297 3.788 9.461 1.00 31.31 C ATOM 2257 C GLY A 148 3.887 2.640 8.544 1.00 20.11 C ATOM 2258 O GLY A 148 4.645 1.686 8.360 1.00 14.12 O ATOM 0 H GLY A 148 3.467 5.605 8.816 1.00 2.33 H new ATOM 0 HA2 GLY A 148 5.279 3.575 9.883 1.00 31.31 H new ATOM 0 HA3 GLY A 148 3.598 3.847 10.295 1.00 31.31 H new ATOM 2262 N PHE A 149 2.693 2.733 7.955 1.00 64.11 N ATOM 2263 CA PHE A 149 2.174 1.656 7.098 1.00 24.24 C ATOM 2264 C PHE A 149 1.249 2.182 5.988 1.00 44.22 C ATOM 2265 O PHE A 149 0.676 3.269 6.091 1.00 61.12 O ATOM 2266 CB PHE A 149 1.416 0.619 7.944 1.00 35.42 C ATOM 2267 CG PHE A 149 0.110 1.124 8.512 1.00 32.42 C ATOM 2268 CD1 PHE A 149 0.090 1.971 9.614 1.00 23.14 C ATOM 2269 CD2 PHE A 149 -1.100 0.753 7.942 1.00 4.55 C ATOM 2270 CE1 PHE A 149 -1.105 2.434 10.129 1.00 14.34 C ATOM 2271 CE2 PHE A 149 -2.296 1.212 8.453 1.00 31.15 C ATOM 2272 CZ PHE A 149 -2.298 2.053 9.548 1.00 75.11 C ATOM 0 H PHE A 149 2.069 3.534 8.052 1.00 64.11 H new ATOM 0 HA PHE A 149 3.036 1.191 6.620 1.00 24.24 H new ATOM 0 HB2 PHE A 149 1.218 -0.260 7.331 1.00 35.42 H new ATOM 0 HB3 PHE A 149 2.057 0.297 8.765 1.00 35.42 H new ATOM 0 HD1 PHE A 149 1.020 2.271 10.073 1.00 23.14 H new ATOM 0 HD2 PHE A 149 -1.105 0.095 7.086 1.00 4.55 H new ATOM 0 HE1 PHE A 149 -1.106 3.093 10.985 1.00 14.34 H new ATOM 0 HE2 PHE A 149 -3.229 0.914 7.998 1.00 31.15 H new ATOM 0 HZ PHE A 149 -3.233 2.413 9.950 1.00 75.11 H new ATOM 2282 N VAL A 150 1.121 1.384 4.929 1.00 75.44 N ATOM 2283 CA VAL A 150 0.195 1.643 3.819 1.00 60.32 C ATOM 2284 C VAL A 150 -0.704 0.409 3.598 1.00 51.44 C ATOM 2285 O VAL A 150 -0.248 -0.626 3.116 1.00 33.31 O ATOM 2286 CB VAL A 150 0.966 1.974 2.512 1.00 3.20 C ATOM 2287 CG1 VAL A 150 0.005 2.202 1.345 1.00 24.11 C ATOM 2288 CG2 VAL A 150 1.877 3.187 2.717 1.00 51.34 C ATOM 0 H VAL A 150 1.663 0.528 4.813 1.00 75.44 H new ATOM 0 HA VAL A 150 -0.420 2.505 4.078 1.00 60.32 H new ATOM 0 HB VAL A 150 1.590 1.116 2.262 1.00 3.20 H new ATOM 0 HG11 VAL A 150 0.574 2.432 0.444 1.00 24.11 H new ATOM 0 HG12 VAL A 150 -0.587 1.302 1.180 1.00 24.11 H new ATOM 0 HG13 VAL A 150 -0.658 3.035 1.577 1.00 24.11 H new ATOM 0 HG21 VAL A 150 2.409 3.403 1.790 1.00 51.34 H new ATOM 0 HG22 VAL A 150 1.275 4.050 3.000 1.00 51.34 H new ATOM 0 HG23 VAL A 150 2.597 2.972 3.507 1.00 51.34 H new ATOM 2298 N ARG A 151 -1.975 0.518 3.968 1.00 42.11 N ATOM 2299 CA ARG A 151 -2.883 -0.640 3.985 1.00 14.34 C ATOM 2300 C ARG A 151 -3.947 -0.563 2.874 1.00 1.43 C ATOM 2301 O ARG A 151 -4.882 0.234 2.949 1.00 74.22 O ATOM 2302 CB ARG A 151 -3.563 -0.717 5.359 1.00 34.11 C ATOM 2303 CG ARG A 151 -4.400 -1.968 5.591 1.00 21.02 C ATOM 2304 CD ARG A 151 -5.086 -1.925 6.956 1.00 43.21 C ATOM 2305 NE ARG A 151 -5.679 -3.209 7.309 1.00 13.02 N ATOM 2306 CZ ARG A 151 -6.095 -3.523 8.506 1.00 62.21 C ATOM 2307 NH1 ARG A 151 -6.112 -2.641 9.458 1.00 2.32 N ATOM 2308 NH2 ARG A 151 -6.519 -4.720 8.731 1.00 12.41 N ATOM 0 H ARG A 151 -2.407 1.394 4.262 1.00 42.11 H new ATOM 0 HA ARG A 151 -2.293 -1.538 3.800 1.00 14.34 H new ATOM 0 HB2 ARG A 151 -2.796 -0.662 6.131 1.00 34.11 H new ATOM 0 HB3 ARG A 151 -4.202 0.158 5.482 1.00 34.11 H new ATOM 0 HG2 ARG A 151 -5.151 -2.058 4.806 1.00 21.02 H new ATOM 0 HG3 ARG A 151 -3.765 -2.851 5.527 1.00 21.02 H new ATOM 0 HD2 ARG A 151 -4.361 -1.639 7.718 1.00 43.21 H new ATOM 0 HD3 ARG A 151 -5.860 -1.158 6.949 1.00 43.21 H new ATOM 0 HE ARG A 151 -5.775 -3.908 6.572 1.00 13.02 H new ATOM 0 HH11 ARG A 151 -5.798 -1.688 9.276 1.00 2.32 H new ATOM 0 HH12 ARG A 151 -6.440 -2.901 10.388 1.00 2.32 H new ATOM 0 HH21 ARG A 151 -6.527 -5.408 7.978 1.00 12.41 H new ATOM 0 HH22 ARG A 151 -6.847 -4.978 9.662 1.00 12.41 H new ATOM 2322 N ILE A 152 -3.813 -1.410 1.857 1.00 4.12 N ATOM 2323 CA ILE A 152 -4.743 -1.410 0.716 1.00 34.33 C ATOM 2324 C ILE A 152 -5.978 -2.290 0.991 1.00 53.24 C ATOM 2325 O ILE A 152 -5.842 -3.431 1.435 1.00 34.22 O ATOM 2326 CB ILE A 152 -4.047 -1.920 -0.574 1.00 42.03 C ATOM 2327 CG1 ILE A 152 -2.747 -1.137 -0.842 1.00 53.45 C ATOM 2328 CG2 ILE A 152 -4.990 -1.821 -1.775 1.00 12.43 C ATOM 2329 CD1 ILE A 152 -2.953 0.341 -1.117 1.00 3.21 C ATOM 0 H ILE A 152 -3.072 -2.108 1.794 1.00 4.12 H new ATOM 0 HA ILE A 152 -5.063 -0.378 0.576 1.00 34.33 H new ATOM 0 HB ILE A 152 -3.790 -2.969 -0.426 1.00 42.03 H new ATOM 0 HG12 ILE A 152 -2.087 -1.246 0.019 1.00 53.45 H new ATOM 0 HG13 ILE A 152 -2.236 -1.585 -1.694 1.00 53.45 H new ATOM 0 HG21 ILE A 152 -4.481 -2.184 -2.668 1.00 12.43 H new ATOM 0 HG22 ILE A 152 -5.877 -2.427 -1.592 1.00 12.43 H new ATOM 0 HG23 ILE A 152 -5.284 -0.782 -1.922 1.00 12.43 H new ATOM 0 HD11 ILE A 152 -1.988 0.816 -1.295 1.00 3.21 H new ATOM 0 HD12 ILE A 152 -3.585 0.463 -1.997 1.00 3.21 H new ATOM 0 HD13 ILE A 152 -3.434 0.807 -0.257 1.00 3.21 H new ATOM 2341 N HIS A 153 -7.178 -1.757 0.720 1.00 1.31 N ATOM 2342 CA HIS A 153 -8.427 -2.522 0.894 1.00 11.41 C ATOM 2343 C HIS A 153 -9.599 -1.890 0.111 1.00 15.13 C ATOM 2344 O HIS A 153 -9.436 -0.861 -0.543 1.00 20.53 O ATOM 2345 CB HIS A 153 -8.783 -2.636 2.387 1.00 64.00 C ATOM 2346 CG HIS A 153 -9.131 -1.331 3.042 1.00 62.24 C ATOM 2347 ND1 HIS A 153 -10.366 -1.073 3.596 1.00 70.04 N ATOM 2348 CD2 HIS A 153 -8.396 -0.210 3.246 1.00 21.14 C ATOM 2349 CE1 HIS A 153 -10.378 0.140 4.106 1.00 0.23 C ATOM 2350 NE2 HIS A 153 -9.199 0.685 3.906 1.00 3.30 N ATOM 0 H HIS A 153 -7.313 -0.804 0.381 1.00 1.31 H new ATOM 0 HA HIS A 153 -8.259 -3.521 0.490 1.00 11.41 H new ATOM 0 HB2 HIS A 153 -9.625 -3.320 2.496 1.00 64.00 H new ATOM 0 HB3 HIS A 153 -7.940 -3.081 2.916 1.00 64.00 H new ATOM 0 HD2 HIS A 153 -7.371 -0.052 2.945 1.00 21.14 H new ATOM 0 HE1 HIS A 153 -11.214 0.608 4.604 1.00 0.23 H new ATOM 0 HE2 HIS A 153 -8.925 1.624 4.195 1.00 3.30 H new ATOM 2359 N ASP A 154 -10.776 -2.528 0.186 1.00 24.35 N ATOM 2360 CA ASP A 154 -12.006 -2.039 -0.476 1.00 70.13 C ATOM 2361 C ASP A 154 -11.907 -2.055 -2.017 1.00 30.25 C ATOM 2362 O ASP A 154 -12.680 -1.380 -2.698 1.00 45.35 O ATOM 2363 CB ASP A 154 -12.362 -0.622 0.010 1.00 53.35 C ATOM 2364 CG ASP A 154 -12.718 -0.566 1.489 1.00 20.33 C ATOM 2365 OD1 ASP A 154 -12.997 -1.629 2.086 1.00 41.41 O ATOM 2366 OD2 ASP A 154 -12.729 0.545 2.059 1.00 31.41 O ATOM 0 H ASP A 154 -10.908 -3.396 0.705 1.00 24.35 H new ATOM 0 HA ASP A 154 -12.800 -2.732 -0.195 1.00 70.13 H new ATOM 0 HB2 ASP A 154 -11.519 0.042 -0.179 1.00 53.35 H new ATOM 0 HB3 ASP A 154 -13.202 -0.245 -0.574 1.00 53.35 H new ATOM 2371 N ILE A 155 -10.980 -2.843 -2.561 1.00 73.42 N ATOM 2372 CA ILE A 155 -10.798 -2.930 -4.020 1.00 43.23 C ATOM 2373 C ILE A 155 -12.027 -3.552 -4.712 1.00 43.15 C ATOM 2374 O ILE A 155 -12.380 -4.712 -4.472 1.00 60.12 O ATOM 2375 CB ILE A 155 -9.527 -3.743 -4.383 1.00 12.34 C ATOM 2376 CG1 ILE A 155 -8.273 -3.076 -3.790 1.00 44.42 C ATOM 2377 CG2 ILE A 155 -9.389 -3.893 -5.900 1.00 3.34 C ATOM 2378 CD1 ILE A 155 -8.020 -1.669 -4.298 1.00 50.31 C ATOM 0 H ILE A 155 -10.344 -3.430 -2.021 1.00 73.42 H new ATOM 0 HA ILE A 155 -10.678 -1.909 -4.382 1.00 43.23 H new ATOM 0 HB ILE A 155 -9.627 -4.739 -3.952 1.00 12.34 H new ATOM 0 HG12 ILE A 155 -8.369 -3.047 -2.705 1.00 44.42 H new ATOM 0 HG13 ILE A 155 -7.404 -3.694 -4.017 1.00 44.42 H new ATOM 0 HG21 ILE A 155 -8.491 -4.466 -6.129 1.00 3.34 H new ATOM 0 HG22 ILE A 155 -10.262 -4.413 -6.295 1.00 3.34 H new ATOM 0 HG23 ILE A 155 -9.316 -2.907 -6.358 1.00 3.34 H new ATOM 0 HD11 ILE A 155 -7.119 -1.270 -3.832 1.00 50.31 H new ATOM 0 HD12 ILE A 155 -7.890 -1.691 -5.380 1.00 50.31 H new ATOM 0 HD13 ILE A 155 -8.869 -1.033 -4.048 1.00 50.31 H new ATOM 2390 N GLN A 156 -12.666 -2.770 -5.578 1.00 44.13 N ATOM 2391 CA GLN A 156 -13.902 -3.179 -6.256 1.00 44.24 C ATOM 2392 C GLN A 156 -13.818 -2.945 -7.777 1.00 73.21 C ATOM 2393 O GLN A 156 -13.084 -2.070 -8.237 1.00 54.43 O ATOM 2394 CB GLN A 156 -15.079 -2.389 -5.667 1.00 44.04 C ATOM 2395 CG GLN A 156 -14.950 -0.882 -5.859 1.00 1.15 C ATOM 2396 CD GLN A 156 -16.022 -0.102 -5.123 1.00 44.11 C ATOM 2397 OE1 GLN A 156 -17.096 0.157 -5.653 1.00 74.22 O ATOM 2398 NE2 GLN A 156 -15.737 0.278 -3.893 1.00 5.13 N ATOM 0 H GLN A 156 -12.346 -1.836 -5.832 1.00 44.13 H new ATOM 0 HA GLN A 156 -14.049 -4.247 -6.096 1.00 44.24 H new ATOM 0 HB2 GLN A 156 -16.005 -2.729 -6.131 1.00 44.04 H new ATOM 0 HB3 GLN A 156 -15.157 -2.607 -4.602 1.00 44.04 H new ATOM 0 HG2 GLN A 156 -13.969 -0.559 -5.512 1.00 1.15 H new ATOM 0 HG3 GLN A 156 -15.004 -0.650 -6.923 1.00 1.15 H new ATOM 0 HE21 GLN A 156 -14.832 0.044 -3.484 1.00 5.13 H new ATOM 0 HE22 GLN A 156 -16.421 0.805 -3.351 1.00 5.13 H new ATOM 2407 N PRO A 157 -14.572 -3.725 -8.580 1.00 61.31 N ATOM 2408 CA PRO A 157 -14.577 -3.582 -10.050 1.00 42.13 C ATOM 2409 C PRO A 157 -15.336 -2.332 -10.541 1.00 61.41 C ATOM 2410 O PRO A 157 -16.546 -2.201 -10.333 1.00 45.21 O ATOM 2411 CB PRO A 157 -15.283 -4.861 -10.519 1.00 54.33 C ATOM 2412 CG PRO A 157 -16.184 -5.232 -9.387 1.00 21.33 C ATOM 2413 CD PRO A 157 -15.466 -4.814 -8.127 1.00 21.51 C ATOM 0 HA PRO A 157 -13.569 -3.454 -10.445 1.00 42.13 H new ATOM 0 HB2 PRO A 157 -15.848 -4.689 -11.435 1.00 54.33 H new ATOM 0 HB3 PRO A 157 -14.566 -5.654 -10.731 1.00 54.33 H new ATOM 0 HG2 PRO A 157 -17.146 -4.727 -9.473 1.00 21.33 H new ATOM 0 HG3 PRO A 157 -16.385 -6.303 -9.384 1.00 21.33 H new ATOM 0 HD2 PRO A 157 -16.164 -4.469 -7.364 1.00 21.51 H new ATOM 0 HD3 PRO A 157 -14.903 -5.641 -7.693 1.00 21.51 H new ATOM 2421 N VAL A 158 -14.621 -1.418 -11.197 1.00 31.21 N ATOM 2422 CA VAL A 158 -15.241 -0.225 -11.791 1.00 1.14 C ATOM 2423 C VAL A 158 -15.216 -0.298 -13.330 1.00 21.22 C ATOM 2424 O VAL A 158 -14.163 -0.440 -13.946 1.00 72.22 O ATOM 2425 CB VAL A 158 -14.560 1.084 -11.297 1.00 71.22 C ATOM 2426 CG1 VAL A 158 -13.058 1.059 -11.544 1.00 21.34 C ATOM 2427 CG2 VAL A 158 -15.190 2.312 -11.952 1.00 1.44 C ATOM 0 H VAL A 158 -13.612 -1.477 -11.333 1.00 31.21 H new ATOM 0 HA VAL A 158 -16.280 -0.204 -11.462 1.00 1.14 H new ATOM 0 HB VAL A 158 -14.722 1.148 -10.221 1.00 71.22 H new ATOM 0 HG11 VAL A 158 -12.615 1.989 -11.187 1.00 21.34 H new ATOM 0 HG12 VAL A 158 -12.616 0.218 -11.011 1.00 21.34 H new ATOM 0 HG13 VAL A 158 -12.867 0.953 -12.612 1.00 21.34 H new ATOM 0 HG21 VAL A 158 -14.695 3.212 -11.589 1.00 1.44 H new ATOM 0 HG22 VAL A 158 -15.075 2.246 -13.034 1.00 1.44 H new ATOM 0 HG23 VAL A 158 -16.250 2.355 -11.701 1.00 1.44 H new ATOM 2437 N MET A 159 -16.395 -0.225 -13.942 1.00 20.42 N ATOM 2438 CA MET A 159 -16.519 -0.345 -15.399 1.00 10.32 C ATOM 2439 C MET A 159 -17.859 0.216 -15.894 1.00 12.54 C ATOM 2440 O MET A 159 -18.694 0.647 -15.096 1.00 21.44 O ATOM 2441 CB MET A 159 -16.394 -1.820 -15.811 1.00 3.12 C ATOM 2442 CG MET A 159 -17.443 -2.726 -15.172 1.00 45.31 C ATOM 2443 SD MET A 159 -17.376 -4.425 -15.782 1.00 43.31 S ATOM 2444 CE MET A 159 -15.716 -4.898 -15.305 1.00 51.01 C ATOM 0 H MET A 159 -17.280 -0.083 -13.455 1.00 20.42 H new ATOM 0 HA MET A 159 -15.717 0.236 -15.855 1.00 10.32 H new ATOM 0 HB2 MET A 159 -16.475 -1.893 -16.895 1.00 3.12 H new ATOM 0 HB3 MET A 159 -15.402 -2.181 -15.541 1.00 3.12 H new ATOM 0 HG2 MET A 159 -17.303 -2.728 -14.091 1.00 45.31 H new ATOM 0 HG3 MET A 159 -18.434 -2.316 -15.364 1.00 45.31 H new ATOM 0 HE1 MET A 159 -15.614 -5.981 -15.368 1.00 51.01 H new ATOM 0 HE2 MET A 159 -14.997 -4.426 -15.975 1.00 51.01 H new ATOM 0 HE3 MET A 159 -15.525 -4.575 -14.282 1.00 51.01 H new ATOM 2454 N GLN A 160 -18.061 0.202 -17.213 1.00 64.25 N ATOM 2455 CA GLN A 160 -19.342 0.603 -17.804 1.00 64.24 C ATOM 2456 C GLN A 160 -20.479 -0.301 -17.302 1.00 25.30 C ATOM 2457 O GLN A 160 -20.365 -1.532 -17.312 1.00 53.24 O ATOM 2458 CB GLN A 160 -19.268 0.575 -19.338 1.00 22.22 C ATOM 2459 CG GLN A 160 -18.823 -0.760 -19.912 1.00 63.33 C ATOM 2460 CD GLN A 160 -18.765 -0.762 -21.427 1.00 32.23 C ATOM 2461 OE1 GLN A 160 -19.536 -0.080 -22.097 1.00 41.13 O ATOM 2462 NE2 GLN A 160 -17.853 -1.526 -21.976 1.00 73.23 N ATOM 0 H GLN A 160 -17.356 -0.082 -17.893 1.00 64.25 H new ATOM 0 HA GLN A 160 -19.553 1.626 -17.491 1.00 64.24 H new ATOM 0 HB2 GLN A 160 -20.249 0.824 -19.743 1.00 22.22 H new ATOM 0 HB3 GLN A 160 -18.579 1.350 -19.672 1.00 22.22 H new ATOM 0 HG2 GLN A 160 -17.839 -1.010 -19.516 1.00 63.33 H new ATOM 0 HG3 GLN A 160 -19.508 -1.539 -19.579 1.00 63.33 H new ATOM 0 HE21 GLN A 160 -17.229 -2.079 -21.388 1.00 73.23 H new ATOM 0 HE22 GLN A 160 -17.767 -1.568 -22.991 1.00 73.23 H new ATOM 2471 N LEU A 161 -21.570 0.312 -16.854 1.00 24.33 N ATOM 2472 CA LEU A 161 -22.667 -0.429 -16.222 1.00 12.21 C ATOM 2473 C LEU A 161 -23.484 -1.252 -17.231 1.00 40.32 C ATOM 2474 O LEU A 161 -24.483 -0.779 -17.780 1.00 2.14 O ATOM 2475 CB LEU A 161 -23.599 0.524 -15.445 1.00 74.11 C ATOM 2476 CG LEU A 161 -23.003 1.162 -14.171 1.00 73.20 C ATOM 2477 CD1 LEU A 161 -21.870 2.130 -14.508 1.00 11.42 C ATOM 2478 CD2 LEU A 161 -24.095 1.864 -13.362 1.00 45.43 C ATOM 0 H LEU A 161 -21.722 1.319 -16.915 1.00 24.33 H new ATOM 0 HA LEU A 161 -22.205 -1.129 -15.526 1.00 12.21 H new ATOM 0 HB2 LEU A 161 -23.910 1.324 -16.117 1.00 74.11 H new ATOM 0 HB3 LEU A 161 -24.498 -0.026 -15.166 1.00 74.11 H new ATOM 0 HG LEU A 161 -22.581 0.362 -13.563 1.00 73.20 H new ATOM 0 HD11 LEU A 161 -21.474 2.561 -13.588 1.00 11.42 H new ATOM 0 HD12 LEU A 161 -21.077 1.594 -15.029 1.00 11.42 H new ATOM 0 HD13 LEU A 161 -22.250 2.927 -15.147 1.00 11.42 H new ATOM 0 HD21 LEU A 161 -23.657 2.308 -12.468 1.00 45.43 H new ATOM 0 HD22 LEU A 161 -24.552 2.646 -13.969 1.00 45.43 H new ATOM 0 HD23 LEU A 161 -24.856 1.139 -13.072 1.00 45.43 H new ATOM 2490 N GLU A 162 -23.040 -2.480 -17.490 1.00 4.41 N ATOM 2491 CA GLU A 162 -23.827 -3.435 -18.276 1.00 62.40 C ATOM 2492 C GLU A 162 -24.884 -4.092 -17.381 1.00 14.13 C ATOM 2493 O GLU A 162 -24.558 -4.629 -16.319 1.00 35.55 O ATOM 2494 CB GLU A 162 -22.924 -4.513 -18.894 1.00 63.31 C ATOM 2495 CG GLU A 162 -21.822 -3.966 -19.796 1.00 44.24 C ATOM 2496 CD GLU A 162 -21.027 -5.070 -20.478 1.00 4.41 C ATOM 2497 OE1 GLU A 162 -20.274 -5.787 -19.785 1.00 31.43 O ATOM 2498 OE2 GLU A 162 -21.153 -5.230 -21.713 1.00 14.12 O ATOM 0 H GLU A 162 -22.141 -2.839 -17.169 1.00 4.41 H new ATOM 0 HA GLU A 162 -24.318 -2.895 -19.085 1.00 62.40 H new ATOM 0 HB2 GLU A 162 -22.467 -5.092 -18.091 1.00 63.31 H new ATOM 0 HB3 GLU A 162 -23.542 -5.201 -19.471 1.00 63.31 H new ATOM 0 HG2 GLU A 162 -22.264 -3.320 -20.554 1.00 44.24 H new ATOM 0 HG3 GLU A 162 -21.146 -3.348 -19.205 1.00 44.24 H new ATOM 2505 N HIS A 163 -26.142 -4.048 -17.809 1.00 41.14 N ATOM 2506 CA HIS A 163 -27.256 -4.563 -17.005 1.00 53.04 C ATOM 2507 C HIS A 163 -27.052 -6.044 -16.634 1.00 63.23 C ATOM 2508 O HIS A 163 -27.025 -6.920 -17.499 1.00 43.25 O ATOM 2509 CB HIS A 163 -28.580 -4.362 -17.750 1.00 12.53 C ATOM 2510 CG HIS A 163 -28.866 -2.920 -18.052 1.00 23.51 C ATOM 2511 ND1 HIS A 163 -29.008 -1.961 -17.071 1.00 75.14 N ATOM 2512 CD2 HIS A 163 -29.010 -2.266 -19.231 1.00 4.32 C ATOM 2513 CE1 HIS A 163 -29.224 -0.787 -17.629 1.00 20.03 C ATOM 2514 NE2 HIS A 163 -29.229 -0.944 -18.937 1.00 60.54 N ATOM 0 H HIS A 163 -26.421 -3.661 -18.710 1.00 41.14 H new ATOM 0 HA HIS A 163 -27.289 -4.000 -16.072 1.00 53.04 H new ATOM 0 HB2 HIS A 163 -28.556 -4.926 -18.683 1.00 12.53 H new ATOM 0 HB3 HIS A 163 -29.394 -4.771 -17.151 1.00 12.53 H new ATOM 0 HD2 HIS A 163 -28.961 -2.704 -20.217 1.00 4.32 H new ATOM 0 HE1 HIS A 163 -29.372 0.145 -17.104 1.00 20.03 H new ATOM 0 HE2 HIS A 163 -29.373 -0.202 -19.622 1.00 60.54 H new ATOM 2523 N HIS A 164 -26.917 -6.302 -15.332 1.00 40.40 N ATOM 2524 CA HIS A 164 -26.574 -7.637 -14.820 1.00 5.25 C ATOM 2525 C HIS A 164 -27.748 -8.620 -14.954 1.00 10.21 C ATOM 2526 O HIS A 164 -28.874 -8.315 -14.558 1.00 24.53 O ATOM 2527 CB HIS A 164 -26.143 -7.533 -13.350 1.00 54.23 C ATOM 2528 CG HIS A 164 -24.931 -6.672 -13.132 1.00 41.11 C ATOM 2529 ND1 HIS A 164 -23.673 -7.188 -12.900 1.00 55.33 N ATOM 2530 CD2 HIS A 164 -24.788 -5.325 -13.103 1.00 45.13 C ATOM 2531 CE1 HIS A 164 -22.814 -6.200 -12.739 1.00 12.23 C ATOM 2532 NE2 HIS A 164 -23.464 -5.063 -12.859 1.00 43.34 N ATOM 0 H HIS A 164 -27.041 -5.599 -14.604 1.00 40.40 H new ATOM 0 HA HIS A 164 -25.750 -8.023 -15.420 1.00 5.25 H new ATOM 0 HB2 HIS A 164 -26.971 -7.132 -12.766 1.00 54.23 H new ATOM 0 HB3 HIS A 164 -25.939 -8.534 -12.969 1.00 54.23 H new ATOM 0 HD2 HIS A 164 -25.570 -4.594 -13.245 1.00 45.13 H new ATOM 0 HE1 HIS A 164 -21.757 -6.307 -12.542 1.00 12.23 H new ATOM 0 HE2 HIS A 164 -23.049 -4.134 -12.783 1.00 43.34 H new ATOM 2541 N HIS A 165 -27.480 -9.798 -15.514 1.00 4.11 N ATOM 2542 CA HIS A 165 -28.522 -10.813 -15.711 1.00 72.13 C ATOM 2543 C HIS A 165 -28.389 -11.972 -14.712 1.00 42.33 C ATOM 2544 O HIS A 165 -27.661 -12.941 -14.951 1.00 33.23 O ATOM 2545 CB HIS A 165 -28.475 -11.359 -17.141 1.00 62.43 C ATOM 2546 CG HIS A 165 -28.642 -10.311 -18.194 1.00 70.40 C ATOM 2547 ND1 HIS A 165 -27.938 -10.317 -19.375 1.00 4.52 N ATOM 2548 CD2 HIS A 165 -29.454 -9.230 -18.251 1.00 14.10 C ATOM 2549 CE1 HIS A 165 -28.305 -9.293 -20.112 1.00 60.52 C ATOM 2550 NE2 HIS A 165 -29.227 -8.617 -19.457 1.00 12.20 N ATOM 0 H HIS A 165 -26.554 -10.076 -15.840 1.00 4.11 H new ATOM 0 HA HIS A 165 -29.482 -10.326 -15.538 1.00 72.13 H new ATOM 0 HB2 HIS A 165 -27.523 -11.867 -17.295 1.00 62.43 H new ATOM 0 HB3 HIS A 165 -29.258 -12.108 -17.260 1.00 62.43 H new ATOM 0 HD2 HIS A 165 -30.150 -8.910 -17.490 1.00 14.10 H new ATOM 0 HE1 HIS A 165 -27.917 -9.047 -21.089 1.00 60.52 H new ATOM 0 HE2 HIS A 165 -29.696 -7.775 -19.792 1.00 12.20 H new ATOM 2559 N HIS A 166 -29.089 -11.865 -13.589 1.00 23.12 N ATOM 2560 CA HIS A 166 -29.151 -12.953 -12.612 1.00 73.14 C ATOM 2561 C HIS A 166 -30.153 -14.021 -13.074 1.00 13.01 C ATOM 2562 O HIS A 166 -31.302 -13.702 -13.387 1.00 51.34 O ATOM 2563 CB HIS A 166 -29.536 -12.415 -11.226 1.00 1.15 C ATOM 2564 CG HIS A 166 -30.836 -11.666 -11.202 1.00 4.42 C ATOM 2565 ND1 HIS A 166 -32.056 -12.275 -11.015 1.00 12.30 N ATOM 2566 CD2 HIS A 166 -31.100 -10.347 -11.341 1.00 1.42 C ATOM 2567 CE1 HIS A 166 -33.008 -11.368 -11.041 1.00 72.24 C ATOM 2568 NE2 HIS A 166 -32.458 -10.189 -11.236 1.00 62.32 N ATOM 0 H HIS A 166 -29.623 -11.036 -13.329 1.00 23.12 H new ATOM 0 HA HIS A 166 -28.164 -13.410 -12.536 1.00 73.14 H new ATOM 0 HB2 HIS A 166 -29.596 -13.250 -10.527 1.00 1.15 H new ATOM 0 HB3 HIS A 166 -28.743 -11.758 -10.870 1.00 1.15 H new ATOM 0 HD2 HIS A 166 -30.375 -9.563 -11.504 1.00 1.42 H new ATOM 0 HE1 HIS A 166 -34.064 -11.559 -10.922 1.00 72.24 H new ATOM 0 HE2 HIS A 166 -32.959 -9.303 -11.299 1.00 62.32 H new ATOM 2577 N HIS A 167 -29.703 -15.278 -13.132 1.00 51.33 N ATOM 2578 CA HIS A 167 -30.523 -16.389 -13.636 1.00 71.21 C ATOM 2579 C HIS A 167 -30.769 -16.248 -15.144 1.00 74.14 C ATOM 2580 O HIS A 167 -31.753 -15.645 -15.572 1.00 51.40 O ATOM 2581 CB HIS A 167 -31.865 -16.495 -12.884 1.00 21.32 C ATOM 2582 CG HIS A 167 -32.751 -17.601 -13.385 1.00 61.04 C ATOM 2583 ND1 HIS A 167 -33.468 -17.519 -14.560 1.00 2.10 N ATOM 2584 CD2 HIS A 167 -33.034 -18.818 -12.864 1.00 21.31 C ATOM 2585 CE1 HIS A 167 -34.151 -18.630 -14.737 1.00 41.24 C ATOM 2586 NE2 HIS A 167 -33.908 -19.438 -13.725 1.00 33.30 N ATOM 0 H HIS A 167 -28.768 -15.555 -12.834 1.00 51.33 H new ATOM 0 HA HIS A 167 -29.965 -17.308 -13.456 1.00 71.21 H new ATOM 0 HB2 HIS A 167 -31.666 -16.652 -11.824 1.00 21.32 H new ATOM 0 HB3 HIS A 167 -32.397 -15.547 -12.971 1.00 21.32 H new ATOM 0 HD1 HIS A 167 -33.469 -16.720 -15.194 1.00 2.10 H new ATOM 0 HD2 HIS A 167 -32.645 -19.226 -11.943 1.00 21.31 H new ATOM 0 HE1 HIS A 167 -34.802 -18.844 -15.572 1.00 41.24 H new ATOM 2595 N HIS A 168 -29.849 -16.780 -15.938 1.00 14.10 N ATOM 2596 CA HIS A 168 -29.991 -16.790 -17.403 1.00 55.25 C ATOM 2597 C HIS A 168 -31.092 -17.775 -17.872 1.00 21.34 C ATOM 2598 O HIS A 168 -32.218 -17.320 -18.171 1.00 36.69 O ATOM 2599 CB HIS A 168 -28.638 -17.114 -18.066 1.00 22.43 C ATOM 2600 CG HIS A 168 -27.947 -18.322 -17.502 1.00 11.54 C ATOM 2601 ND1 HIS A 168 -28.287 -19.611 -17.842 1.00 71.12 N ATOM 2602 CD2 HIS A 168 -26.933 -18.434 -16.611 1.00 11.33 C ATOM 2603 CE1 HIS A 168 -27.524 -20.458 -17.194 1.00 5.44 C ATOM 2604 NE2 HIS A 168 -26.693 -19.774 -16.439 1.00 35.22 N ATOM 2605 OXT HIS A 168 -30.834 -18.999 -17.933 1.00 36.69 O ATOM 0 H HIS A 168 -28.991 -17.214 -15.598 1.00 14.10 H new ATOM 0 HA HIS A 168 -30.305 -15.794 -17.715 1.00 55.25 H new ATOM 0 HB2 HIS A 168 -28.797 -17.266 -19.134 1.00 22.43 H new ATOM 0 HB3 HIS A 168 -27.980 -16.252 -17.962 1.00 22.43 H new ATOM 0 HD1 HIS A 168 -29.023 -19.869 -18.500 1.00 71.12 H new ATOM 0 HD2 HIS A 168 -26.412 -17.621 -16.127 1.00 11.33 H new ATOM 0 HE1 HIS A 168 -27.570 -21.534 -17.268 1.00 5.44 H new TER 2614 HIS A 168