USER MOD reduce.3.24.130724 H: found=0, std=0, add=1284, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1284 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 129 SER OG : rot 79:sc= 0.689 USER MOD Set 1.2: A 154 GLN : amide:sc= -1.44 X(o=-0.75,f=-0.61) USER MOD Set 2.1: A 100 TYR OH : rot 180:sc= 0.266 USER MOD Set 2.2: A 112 TYR OH : rot -148:sc= -1.08 USER MOD Set 2.3: A 138 ASN : amide:sc= -0.353 X(o=-1.2,f=-1.3) USER MOD Set 3.1: A 93 HIS : no HD1:sc= -0.0067 X(o=-0.24,f=-0.25) USER MOD Set 3.2: A 127 HIS : no HD1:sc= -0.23 K(o=-0.24,f=-1) USER MOD Set 4.1: A 84 LYS NZ :NH3+ -111:sc= 1.99 (180deg=0.069) USER MOD Set 4.2: A 88 TYR OH : rot 69:sc= 0.848 USER MOD Set 5.1: A 74 ASN :FLIP amide:sc= -0.766 F(o=-0.95,f=-0.36) USER MOD Set 5.2: A 106 THR OG1 : rot -12:sc= 0.407 USER MOD Set 6.1: A 71 LYS NZ :NH3+ 134:sc= 0.924 (180deg=-0.194) USER MOD Set 6.2: A 72 TYR OH : rot -144:sc= 0.466 USER MOD Set 7.1: A 28 TYR OH : rot 43:sc= -0.352 USER MOD Set 7.2: A 31 ASN : amide:sc= -0.544 X(o=-0.9,f=-0.56) USER MOD Set 8.1: A 3 HIS : no HE2:sc=0.000262 K(o=0.42,f=-1.8) USER MOD Set 8.2: A 16 ASN :FLIP amide:sc= -0.117 F(o=-1.2!,f=0.42) USER MOD Set 8.3: A 19 GLN :FLIP amide:sc= 0.542 F(o=-2.1,f=0.42) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0.583 (180deg=0.437) USER MOD Single : A 4 HIS : no HD1:sc= -0.0279 X(o=-0.028,f=-0.028) USER MOD Single : A 5 HIS : no HD1:sc= -0.13 K(o=-0.13,f=-0.66) USER MOD Single : A 6 HIS : no HD1:sc= -0.0807 X(o=-0.081,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.274 X(o=-0.27,f=-0.27) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0.338 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.0053) USER MOD Single : A 11 MET CE :methyl -164:sc= -0.106 (180deg=-0.452) USER MOD Single : A 13 THR OG1 : rot -164:sc= 0.0978 USER MOD Single : A 20 MET CE :methyl -130:sc= -0.46 (180deg=-3.35!) USER MOD Single : A 24 HIS : no HD1:sc= 0 X(o=0,f=-0.00073) USER MOD Single : A 25 MET CE :methyl -134:sc= -0.341 (180deg=-1.7) USER MOD Single : A 26 GLN : amide:sc= 0.0133 X(o=0.013,f=-0.073) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.17 X(o=0.17,f=0) USER MOD Single : A 47 ASN : amide:sc= -0.0176 X(o=-0.018,f=-0.12) USER MOD Single : A 51 ASN : amide:sc= -0.614 K(o=-0.61,f=-1.1) USER MOD Single : A 52 LYS NZ :NH3+ -166:sc= 0.0924 (180deg=-0.0485) USER MOD Single : A 54 TYR OH : rot -147:sc= -0.0419 USER MOD Single : A 57 THR OG1 : rot 79:sc= 0.795 USER MOD Single : A 61 HIS : no HE2:sc= -0.627 K(o=-0.63,f=-4.9!) USER MOD Single : A 63 MET CE :methyl -116:sc= -0.934 (180deg=-3.57) USER MOD Single : A 64 LYS NZ :NH3+ -171:sc= 0.00618 (180deg=0.00188) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 HIS : no HD1:sc= -0.782 X(o=-0.78,f=-0.5) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 177:sc= 0.277 USER MOD Single : A 82 CYS SG : rot 67:sc= 0.618 USER MOD Single : A 89 ASN : amide:sc= 0.716 K(o=0.72,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 101 ASN : amide:sc= 0.394 X(o=0.39,f=-0.0065) USER MOD Single : A 102 HIS : +bothHN:sc= -0.897 K(o=-0.9,f=-2.2) USER MOD Single : A 108 SER OG : rot -77:sc= 0 USER MOD Single : A 109 SER OG : rot 170:sc= -1.24 USER MOD Single : A 118 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-2.7!) USER MOD Single : A 122 GLN : amide:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 126 GLN : amide:sc= -0.222 X(o=-0.22,f=-0.01) USER MOD Single : A 133 GLN : amide:sc= -0.0258 X(o=-0.026,f=-0.058) USER MOD Single : A 137 GLN : amide:sc= 0.026 X(o=0.026,f=0) USER MOD Single : A 139 GLN : amide:sc= 1.03 K(o=1,f=-2.6!) USER MOD Single : A 147 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 GLN : amide:sc= -0.312 K(o=-0.31,f=-1) USER MOD Single : A 149 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.067) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 THR OG1 : rot -30:sc= 0.0348 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 40:sc= -0.565 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 16.409 10.405 -12.735 1.00 12.53 N ATOM 2 CA MET A 1 16.658 10.952 -14.094 1.00 4.44 C ATOM 3 C MET A 1 16.073 12.380 -14.197 1.00 3.31 C ATOM 4 O MET A 1 14.874 12.548 -14.438 1.00 42.11 O ATOM 5 CB MET A 1 16.048 10.020 -15.180 1.00 33.53 C ATOM 6 CG MET A 1 16.485 8.551 -15.068 1.00 11.33 C ATOM 7 SD MET A 1 18.276 8.346 -15.125 1.00 2.23 S ATOM 8 CE MET A 1 18.449 6.572 -14.926 1.00 74.13 C ATOM 0 H1 MET A 1 16.918 9.505 -12.624 1.00 12.53 H new ATOM 0 H2 MET A 1 16.745 11.083 -12.021 1.00 12.53 H new ATOM 0 H3 MET A 1 15.390 10.244 -12.607 1.00 12.53 H new ATOM 0 HA MET A 1 17.733 11.002 -14.266 1.00 4.44 H new ATOM 0 HB2 MET A 1 14.961 10.070 -15.116 1.00 33.53 H new ATOM 0 HB3 MET A 1 16.327 10.396 -16.164 1.00 33.53 H new ATOM 0 HG2 MET A 1 16.106 8.135 -14.135 1.00 11.33 H new ATOM 0 HG3 MET A 1 16.033 7.980 -15.879 1.00 11.33 H new ATOM 0 HE1 MET A 1 19.506 6.305 -14.943 1.00 74.13 H new ATOM 0 HE2 MET A 1 18.013 6.268 -13.974 1.00 74.13 H new ATOM 0 HE3 MET A 1 17.933 6.063 -15.740 1.00 74.13 H new ATOM 20 N GLY A 2 16.923 13.396 -13.970 1.00 53.40 N ATOM 21 CA GLY A 2 16.485 14.806 -13.951 1.00 72.21 C ATOM 22 C GLY A 2 17.346 15.701 -13.049 1.00 3.12 C ATOM 23 O GLY A 2 17.037 16.890 -12.883 1.00 31.10 O ATOM 0 H GLY A 2 17.920 13.268 -13.797 1.00 53.40 H new ATOM 0 HA2 GLY A 2 16.507 15.199 -14.967 1.00 72.21 H new ATOM 0 HA3 GLY A 2 15.449 14.852 -13.614 1.00 72.21 H new ATOM 27 N HIS A 3 18.409 15.124 -12.440 1.00 25.10 N ATOM 28 CA HIS A 3 19.424 15.895 -11.686 1.00 32.11 C ATOM 29 C HIS A 3 20.157 16.913 -12.605 1.00 42.31 C ATOM 30 O HIS A 3 20.505 16.588 -13.745 1.00 50.40 O ATOM 31 CB HIS A 3 20.442 14.947 -10.989 1.00 10.21 C ATOM 32 CG HIS A 3 19.994 14.434 -9.642 1.00 41.31 C ATOM 33 ND1 HIS A 3 19.155 13.352 -9.467 1.00 54.10 N ATOM 34 CD2 HIS A 3 20.286 14.869 -8.393 1.00 42.54 C ATOM 35 CE1 HIS A 3 18.969 13.144 -8.180 1.00 71.22 C ATOM 36 NE2 HIS A 3 19.644 14.047 -7.505 1.00 31.40 N ATOM 0 H HIS A 3 18.586 14.120 -12.457 1.00 25.10 H new ATOM 0 HA HIS A 3 18.902 16.459 -10.913 1.00 32.11 H new ATOM 0 HB2 HIS A 3 20.634 14.096 -11.643 1.00 10.21 H new ATOM 0 HB3 HIS A 3 21.388 15.475 -10.867 1.00 10.21 H new ATOM 0 HD1 HIS A 3 18.743 12.799 -10.218 1.00 54.10 H new ATOM 0 HD2 HIS A 3 20.912 15.712 -8.142 1.00 42.54 H new ATOM 0 HE1 HIS A 3 18.362 12.361 -7.750 1.00 71.22 H new ATOM 45 N HIS A 4 20.343 18.151 -12.084 1.00 21.35 N ATOM 46 CA HIS A 4 20.947 19.307 -12.800 1.00 64.53 C ATOM 47 C HIS A 4 20.044 19.848 -13.962 1.00 1.01 C ATOM 48 O HIS A 4 20.375 20.855 -14.592 1.00 73.43 O ATOM 49 CB HIS A 4 22.401 18.973 -13.278 1.00 2.34 C ATOM 50 CG HIS A 4 23.206 20.166 -13.731 1.00 54.10 C ATOM 51 ND1 HIS A 4 23.696 21.113 -12.857 1.00 24.43 N ATOM 52 CD2 HIS A 4 23.585 20.575 -14.967 1.00 14.52 C ATOM 53 CE1 HIS A 4 24.333 22.045 -13.528 1.00 1.12 C ATOM 54 NE2 HIS A 4 24.283 21.745 -14.807 1.00 53.51 N ATOM 0 H HIS A 4 20.070 18.381 -11.128 1.00 21.35 H new ATOM 0 HA HIS A 4 21.015 20.125 -12.083 1.00 64.53 H new ATOM 0 HB2 HIS A 4 22.933 18.481 -12.463 1.00 2.34 H new ATOM 0 HB3 HIS A 4 22.344 18.258 -14.099 1.00 2.34 H new ATOM 0 HD2 HIS A 4 23.377 20.074 -15.901 1.00 14.52 H new ATOM 0 HE1 HIS A 4 24.816 22.911 -13.101 1.00 1.12 H new ATOM 0 HE2 HIS A 4 24.697 22.294 -15.560 1.00 53.51 H new ATOM 63 N HIS A 5 18.877 19.211 -14.204 1.00 32.12 N ATOM 64 CA HIS A 5 17.966 19.565 -15.324 1.00 4.03 C ATOM 65 C HIS A 5 17.004 20.734 -14.946 1.00 24.31 C ATOM 66 O HIS A 5 16.263 21.229 -15.806 1.00 24.21 O ATOM 67 CB HIS A 5 17.183 18.291 -15.751 1.00 31.22 C ATOM 68 CG HIS A 5 16.301 18.441 -16.965 1.00 75.14 C ATOM 69 ND1 HIS A 5 15.004 18.901 -16.897 1.00 21.34 N ATOM 70 CD2 HIS A 5 16.541 18.208 -18.275 1.00 34.35 C ATOM 71 CE1 HIS A 5 14.485 18.938 -18.099 1.00 12.31 C ATOM 72 NE2 HIS A 5 15.395 18.523 -18.953 1.00 34.22 N ATOM 0 H HIS A 5 18.537 18.438 -13.632 1.00 32.12 H new ATOM 0 HA HIS A 5 18.558 19.925 -16.166 1.00 4.03 H new ATOM 0 HB2 HIS A 5 17.901 17.493 -15.943 1.00 31.22 H new ATOM 0 HB3 HIS A 5 16.565 17.969 -14.913 1.00 31.22 H new ATOM 0 HD2 HIS A 5 17.462 17.843 -18.705 1.00 34.35 H new ATOM 0 HE1 HIS A 5 13.483 19.255 -18.346 1.00 12.31 H new ATOM 0 HE2 HIS A 5 15.267 18.448 -19.962 1.00 34.22 H new ATOM 81 N HIS A 6 17.040 21.180 -13.663 1.00 43.13 N ATOM 82 CA HIS A 6 16.185 22.290 -13.163 1.00 13.31 C ATOM 83 C HIS A 6 16.394 23.591 -13.995 1.00 75.44 C ATOM 84 O HIS A 6 17.429 24.252 -13.895 1.00 11.44 O ATOM 85 CB HIS A 6 16.459 22.538 -11.653 1.00 24.44 C ATOM 86 CG HIS A 6 15.706 23.698 -11.036 1.00 34.24 C ATOM 87 ND1 HIS A 6 16.302 24.610 -10.193 1.00 5.34 N ATOM 88 CD2 HIS A 6 14.400 24.073 -11.111 1.00 33.21 C ATOM 89 CE1 HIS A 6 15.405 25.473 -9.770 1.00 14.22 C ATOM 90 NE2 HIS A 6 14.244 25.177 -10.312 1.00 22.43 N ATOM 0 H HIS A 6 17.656 20.785 -12.952 1.00 43.13 H new ATOM 0 HA HIS A 6 15.142 21.997 -13.282 1.00 13.31 H new ATOM 0 HB2 HIS A 6 16.209 21.631 -11.102 1.00 24.44 H new ATOM 0 HB3 HIS A 6 17.527 22.708 -11.519 1.00 24.44 H new ATOM 0 HD2 HIS A 6 13.628 23.590 -11.692 1.00 33.21 H new ATOM 0 HE1 HIS A 6 15.591 26.291 -9.089 1.00 14.22 H new ATOM 0 HE2 HIS A 6 13.372 25.684 -10.163 1.00 22.43 H new ATOM 99 N HIS A 7 15.400 23.896 -14.840 1.00 52.43 N ATOM 100 CA HIS A 7 15.361 25.096 -15.705 1.00 64.32 C ATOM 101 C HIS A 7 14.663 26.268 -14.947 1.00 53.43 C ATOM 102 O HIS A 7 14.195 26.084 -13.813 1.00 41.33 O ATOM 103 CB HIS A 7 14.604 24.698 -17.013 1.00 23.23 C ATOM 104 CG HIS A 7 14.589 25.729 -18.119 1.00 14.33 C ATOM 105 ND1 HIS A 7 15.698 26.034 -18.875 1.00 53.41 N ATOM 106 CD2 HIS A 7 13.598 26.526 -18.591 1.00 22.15 C ATOM 107 CE1 HIS A 7 15.395 26.960 -19.757 1.00 61.14 C ATOM 108 NE2 HIS A 7 14.128 27.278 -19.605 1.00 54.41 N ATOM 0 H HIS A 7 14.577 23.303 -14.948 1.00 52.43 H new ATOM 0 HA HIS A 7 16.361 25.444 -15.963 1.00 64.32 H new ATOM 0 HB2 HIS A 7 15.052 23.784 -17.403 1.00 23.23 H new ATOM 0 HB3 HIS A 7 13.573 24.461 -16.753 1.00 23.23 H new ATOM 0 HD2 HIS A 7 12.580 26.561 -18.233 1.00 22.15 H new ATOM 0 HE1 HIS A 7 16.071 27.387 -20.483 1.00 61.14 H new ATOM 0 HE2 HIS A 7 13.622 27.973 -20.154 1.00 54.41 H new ATOM 117 N HIS A 8 14.636 27.474 -15.555 1.00 21.02 N ATOM 118 CA HIS A 8 13.911 28.648 -15.007 1.00 42.24 C ATOM 119 C HIS A 8 12.397 28.329 -14.832 1.00 43.23 C ATOM 120 O HIS A 8 11.632 28.339 -15.804 1.00 52.15 O ATOM 121 CB HIS A 8 14.132 29.881 -15.927 1.00 71.13 C ATOM 122 CG HIS A 8 13.441 31.143 -15.468 1.00 12.42 C ATOM 123 ND1 HIS A 8 13.839 31.861 -14.358 1.00 0.04 N ATOM 124 CD2 HIS A 8 12.376 31.812 -15.975 1.00 31.42 C ATOM 125 CE1 HIS A 8 13.056 32.906 -14.208 1.00 73.44 C ATOM 126 NE2 HIS A 8 12.166 32.898 -15.174 1.00 1.53 N ATOM 0 H HIS A 8 15.113 27.664 -16.436 1.00 21.02 H new ATOM 0 HA HIS A 8 14.309 28.883 -14.020 1.00 42.24 H new ATOM 0 HB2 HIS A 8 15.202 30.075 -16.001 1.00 71.13 H new ATOM 0 HB3 HIS A 8 13.783 29.636 -16.930 1.00 71.13 H new ATOM 0 HD2 HIS A 8 11.802 31.538 -16.848 1.00 31.42 H new ATOM 0 HE1 HIS A 8 13.132 33.645 -13.424 1.00 73.44 H new ATOM 0 HE2 HIS A 8 11.432 33.594 -15.305 1.00 1.53 H new ATOM 135 N SER A 9 11.999 28.030 -13.581 1.00 73.31 N ATOM 136 CA SER A 9 10.652 27.509 -13.250 1.00 53.12 C ATOM 137 C SER A 9 10.393 27.569 -11.727 1.00 73.31 C ATOM 138 O SER A 9 11.334 27.535 -10.930 1.00 45.31 O ATOM 139 CB SER A 9 10.520 26.038 -13.734 1.00 70.22 C ATOM 140 OG SER A 9 9.272 25.458 -13.363 1.00 42.43 O ATOM 0 H SER A 9 12.602 28.142 -12.766 1.00 73.31 H new ATOM 0 HA SER A 9 9.915 28.133 -13.755 1.00 53.12 H new ATOM 0 HB2 SER A 9 10.627 26.003 -14.818 1.00 70.22 H new ATOM 0 HB3 SER A 9 11.333 25.445 -13.315 1.00 70.22 H new ATOM 0 HG SER A 9 9.231 24.534 -13.688 1.00 42.43 H new ATOM 146 N HIS A 10 9.101 27.621 -11.339 1.00 73.34 N ATOM 147 CA HIS A 10 8.667 27.527 -9.918 1.00 42.42 C ATOM 148 C HIS A 10 8.778 26.074 -9.389 1.00 11.04 C ATOM 149 O HIS A 10 8.653 25.828 -8.185 1.00 12.24 O ATOM 150 CB HIS A 10 7.196 27.994 -9.774 1.00 61.53 C ATOM 151 CG HIS A 10 6.922 29.374 -10.313 1.00 5.33 C ATOM 152 ND1 HIS A 10 6.459 29.603 -11.593 1.00 45.11 N ATOM 153 CD2 HIS A 10 7.034 30.600 -9.740 1.00 61.42 C ATOM 154 CE1 HIS A 10 6.303 30.895 -11.778 1.00 13.44 C ATOM 155 NE2 HIS A 10 6.642 31.518 -10.676 1.00 30.34 N ATOM 0 H HIS A 10 8.328 27.729 -11.995 1.00 73.34 H new ATOM 0 HA HIS A 10 9.325 28.170 -9.334 1.00 42.42 H new ATOM 0 HB2 HIS A 10 6.550 27.282 -10.288 1.00 61.53 H new ATOM 0 HB3 HIS A 10 6.922 27.969 -8.719 1.00 61.53 H new ATOM 0 HD2 HIS A 10 7.369 30.811 -8.735 1.00 61.42 H new ATOM 0 HE1 HIS A 10 5.954 31.364 -12.686 1.00 13.44 H new ATOM 0 HE2 HIS A 10 6.618 32.528 -10.538 1.00 30.34 H new ATOM 164 N MET A 11 8.984 25.116 -10.311 1.00 12.23 N ATOM 165 CA MET A 11 9.008 23.666 -10.010 1.00 5.43 C ATOM 166 C MET A 11 10.371 23.031 -10.407 1.00 61.32 C ATOM 167 O MET A 11 10.921 23.343 -11.469 1.00 42.32 O ATOM 168 CB MET A 11 7.849 22.976 -10.786 1.00 2.50 C ATOM 169 CG MET A 11 6.461 23.601 -10.556 1.00 22.25 C ATOM 170 SD MET A 11 5.143 22.778 -11.482 1.00 71.11 S ATOM 171 CE MET A 11 5.651 23.054 -13.180 1.00 31.01 C ATOM 0 H MET A 11 9.140 25.325 -11.297 1.00 12.23 H new ATOM 0 HA MET A 11 8.879 23.523 -8.937 1.00 5.43 H new ATOM 0 HB2 MET A 11 8.074 23.007 -11.852 1.00 2.50 H new ATOM 0 HB3 MET A 11 7.812 21.925 -10.498 1.00 2.50 H new ATOM 0 HG2 MET A 11 6.226 23.564 -9.492 1.00 22.25 H new ATOM 0 HG3 MET A 11 6.492 24.653 -10.840 1.00 22.25 H new ATOM 0 HE1 MET A 11 4.811 22.860 -13.847 1.00 31.01 H new ATOM 0 HE2 MET A 11 5.978 24.087 -13.299 1.00 31.01 H new ATOM 0 HE3 MET A 11 6.473 22.383 -13.427 1.00 31.01 H new ATOM 181 N ASP A 12 10.905 22.146 -9.540 1.00 72.20 N ATOM 182 CA ASP A 12 12.150 21.370 -9.807 1.00 72.12 C ATOM 183 C ASP A 12 11.834 19.971 -10.391 1.00 50.12 C ATOM 184 O ASP A 12 10.717 19.701 -10.834 1.00 32.24 O ATOM 185 CB ASP A 12 12.952 21.215 -8.481 1.00 2.33 C ATOM 186 CG ASP A 12 13.631 22.511 -8.028 1.00 5.14 C ATOM 187 OD1 ASP A 12 12.920 23.470 -7.674 1.00 50.01 O ATOM 188 OD2 ASP A 12 14.877 22.573 -8.023 1.00 2.42 O ATOM 0 H ASP A 12 10.489 21.944 -8.631 1.00 72.20 H new ATOM 0 HA ASP A 12 12.741 21.914 -10.544 1.00 72.12 H new ATOM 0 HB2 ASP A 12 12.279 20.872 -7.695 1.00 2.33 H new ATOM 0 HB3 ASP A 12 13.710 20.442 -8.611 1.00 2.33 H new ATOM 193 N THR A 13 12.862 19.106 -10.438 1.00 52.50 N ATOM 194 CA THR A 13 12.662 17.649 -10.603 1.00 14.32 C ATOM 195 C THR A 13 12.054 17.061 -9.294 1.00 51.23 C ATOM 196 O THR A 13 12.374 17.548 -8.194 1.00 21.22 O ATOM 197 CB THR A 13 13.999 16.894 -10.979 1.00 32.30 C ATOM 198 OG1 THR A 13 13.796 15.466 -10.995 1.00 12.43 O ATOM 199 CG2 THR A 13 15.150 17.213 -10.024 1.00 22.11 C ATOM 0 H THR A 13 13.840 19.387 -10.364 1.00 52.50 H new ATOM 0 HA THR A 13 11.974 17.498 -11.434 1.00 14.32 H new ATOM 0 HB THR A 13 14.272 17.249 -11.973 1.00 32.30 H new ATOM 0 HG1 THR A 13 14.664 15.012 -10.976 1.00 12.43 H new ATOM 0 HG21 THR A 13 16.041 16.666 -10.332 1.00 22.11 H new ATOM 0 HG22 THR A 13 15.355 18.283 -10.046 1.00 22.11 H new ATOM 0 HG23 THR A 13 14.875 16.917 -9.011 1.00 22.11 H new ATOM 207 N PRO A 14 11.153 16.020 -9.380 1.00 1.22 N ATOM 208 CA PRO A 14 10.569 15.345 -8.180 1.00 1.14 C ATOM 209 C PRO A 14 11.646 14.831 -7.198 1.00 3.11 C ATOM 210 O PRO A 14 11.425 14.762 -5.976 1.00 54.22 O ATOM 211 CB PRO A 14 9.768 14.169 -8.789 1.00 23.34 C ATOM 212 CG PRO A 14 9.464 14.586 -10.197 1.00 3.14 C ATOM 213 CD PRO A 14 10.643 15.419 -10.641 1.00 25.03 C ATOM 0 HA PRO A 14 9.963 16.027 -7.584 1.00 1.14 H new ATOM 0 HB2 PRO A 14 10.347 13.246 -8.768 1.00 23.34 H new ATOM 0 HB3 PRO A 14 8.853 13.984 -8.227 1.00 23.34 H new ATOM 0 HG2 PRO A 14 9.333 13.718 -10.843 1.00 3.14 H new ATOM 0 HG3 PRO A 14 8.539 15.161 -10.244 1.00 3.14 H new ATOM 0 HD2 PRO A 14 11.403 14.808 -11.128 1.00 25.03 H new ATOM 0 HD3 PRO A 14 10.344 16.185 -11.356 1.00 25.03 H new ATOM 221 N GLU A 15 12.805 14.484 -7.781 1.00 64.52 N ATOM 222 CA GLU A 15 14.012 14.080 -7.058 1.00 44.33 C ATOM 223 C GLU A 15 14.440 15.121 -5.995 1.00 44.13 C ATOM 224 O GLU A 15 14.691 14.745 -4.865 1.00 60.52 O ATOM 225 CB GLU A 15 15.163 13.842 -8.068 1.00 45.12 C ATOM 226 CG GLU A 15 14.898 12.707 -9.079 1.00 13.53 C ATOM 227 CD GLU A 15 16.020 12.561 -10.115 1.00 20.31 C ATOM 228 OE1 GLU A 15 16.232 13.501 -10.897 1.00 50.15 O ATOM 229 OE2 GLU A 15 16.721 11.529 -10.124 1.00 21.01 O ATOM 0 H GLU A 15 12.927 14.478 -8.794 1.00 64.52 H new ATOM 0 HA GLU A 15 13.786 13.157 -6.525 1.00 44.33 H new ATOM 0 HB2 GLU A 15 15.346 14.766 -8.617 1.00 45.12 H new ATOM 0 HB3 GLU A 15 16.074 13.614 -7.515 1.00 45.12 H new ATOM 0 HG2 GLU A 15 14.782 11.766 -8.540 1.00 13.53 H new ATOM 0 HG3 GLU A 15 13.956 12.898 -9.594 1.00 13.53 H new ATOM 236 N ASN A 16 14.504 16.425 -6.362 1.00 3.11 N ATOM 237 CA ASN A 16 14.910 17.512 -5.419 1.00 11.24 C ATOM 238 C ASN A 16 13.900 17.680 -4.268 1.00 33.02 C ATOM 239 O ASN A 16 14.299 17.841 -3.112 1.00 55.31 O ATOM 240 CB ASN A 16 15.100 18.865 -6.144 1.00 4.13 C ATOM 241 CG ASN A 16 16.225 18.854 -7.169 1.00 63.52 C ATOM 242 OD1 ASN A 16 16.186 19.780 -8.104 1.00 11.02 O flip ATOM 243 ND2 ASN A 16 17.148 18.046 -7.107 1.00 52.14 N flip ATOM 0 H ASN A 16 14.281 16.755 -7.301 1.00 3.11 H new ATOM 0 HA ASN A 16 15.868 17.206 -4.999 1.00 11.24 H new ATOM 0 HB2 ASN A 16 14.169 19.135 -6.642 1.00 4.13 H new ATOM 0 HB3 ASN A 16 15.302 19.639 -5.404 1.00 4.13 H new ATOM 0 HD21 ASN A 16 17.157 17.337 -6.374 1.00 52.14 H new ATOM 0 HD22 ASN A 16 17.906 18.084 -7.789 1.00 52.14 H new ATOM 250 N VAL A 17 12.595 17.626 -4.608 1.00 40.24 N ATOM 251 CA VAL A 17 11.488 17.693 -3.621 1.00 31.21 C ATOM 252 C VAL A 17 11.643 16.595 -2.533 1.00 51.35 C ATOM 253 O VAL A 17 11.499 16.855 -1.333 1.00 5.42 O ATOM 254 CB VAL A 17 10.091 17.569 -4.347 1.00 42.54 C ATOM 255 CG1 VAL A 17 8.911 17.426 -3.349 1.00 14.31 C ATOM 256 CG2 VAL A 17 9.875 18.768 -5.305 1.00 13.32 C ATOM 0 H VAL A 17 12.276 17.535 -5.572 1.00 40.24 H new ATOM 0 HA VAL A 17 11.534 18.663 -3.126 1.00 31.21 H new ATOM 0 HB VAL A 17 10.109 16.650 -4.933 1.00 42.54 H new ATOM 0 HG11 VAL A 17 7.975 17.345 -3.902 1.00 14.31 H new ATOM 0 HG12 VAL A 17 9.054 16.531 -2.743 1.00 14.31 H new ATOM 0 HG13 VAL A 17 8.875 18.302 -2.701 1.00 14.31 H new ATOM 0 HG21 VAL A 17 8.908 18.670 -5.799 1.00 13.32 H new ATOM 0 HG22 VAL A 17 9.899 19.697 -4.736 1.00 13.32 H new ATOM 0 HG23 VAL A 17 10.666 18.781 -6.055 1.00 13.32 H new ATOM 266 N LEU A 18 11.973 15.381 -2.988 1.00 63.54 N ATOM 267 CA LEU A 18 12.296 14.238 -2.114 1.00 64.01 C ATOM 268 C LEU A 18 13.651 14.436 -1.367 1.00 75.10 C ATOM 269 O LEU A 18 13.750 14.130 -0.177 1.00 43.15 O ATOM 270 CB LEU A 18 12.265 12.955 -2.984 1.00 51.14 C ATOM 271 CG LEU A 18 12.733 11.609 -2.340 1.00 21.22 C ATOM 272 CD1 LEU A 18 12.128 11.351 -0.948 1.00 53.44 C ATOM 273 CD2 LEU A 18 12.398 10.444 -3.280 1.00 43.22 C ATOM 0 H LEU A 18 12.025 15.158 -3.982 1.00 63.54 H new ATOM 0 HA LEU A 18 11.555 14.150 -1.320 1.00 64.01 H new ATOM 0 HB2 LEU A 18 11.243 12.817 -3.336 1.00 51.14 H new ATOM 0 HB3 LEU A 18 12.883 13.135 -3.863 1.00 51.14 H new ATOM 0 HG LEU A 18 13.811 11.688 -2.197 1.00 21.22 H new ATOM 0 HD11 LEU A 18 12.496 10.400 -0.562 1.00 53.44 H new ATOM 0 HD12 LEU A 18 12.418 12.154 -0.271 1.00 53.44 H new ATOM 0 HD13 LEU A 18 11.041 11.315 -1.025 1.00 53.44 H new ATOM 0 HD21 LEU A 18 12.725 9.507 -2.829 1.00 43.22 H new ATOM 0 HD22 LEU A 18 11.322 10.410 -3.448 1.00 43.22 H new ATOM 0 HD23 LEU A 18 12.909 10.586 -4.232 1.00 43.22 H new ATOM 285 N GLN A 19 14.668 14.996 -2.052 1.00 51.43 N ATOM 286 CA GLN A 19 16.002 15.262 -1.446 1.00 23.21 C ATOM 287 C GLN A 19 15.917 16.284 -0.294 1.00 43.12 C ATOM 288 O GLN A 19 16.770 16.277 0.597 1.00 2.34 O ATOM 289 CB GLN A 19 17.038 15.737 -2.505 1.00 15.43 C ATOM 290 CG GLN A 19 17.502 14.642 -3.487 1.00 73.21 C ATOM 291 CD GLN A 19 18.451 15.167 -4.563 1.00 51.32 C ATOM 292 OE1 GLN A 19 17.901 15.653 -5.659 1.00 13.25 O flip ATOM 293 NE2 GLN A 19 19.666 15.160 -4.407 1.00 4.33 N flip ATOM 0 H GLN A 19 14.597 15.276 -3.030 1.00 51.43 H new ATOM 0 HA GLN A 19 16.345 14.312 -1.036 1.00 23.21 H new ATOM 0 HB2 GLN A 19 16.604 16.558 -3.076 1.00 15.43 H new ATOM 0 HB3 GLN A 19 17.910 16.135 -1.987 1.00 15.43 H new ATOM 0 HG2 GLN A 19 17.998 13.848 -2.929 1.00 73.21 H new ATOM 0 HG3 GLN A 19 16.629 14.198 -3.966 1.00 73.21 H new ATOM 0 HE21 GLN A 19 20.068 14.779 -3.551 1.00 4.33 H new ATOM 0 HE22 GLN A 19 20.276 15.535 -5.133 1.00 4.33 H new ATOM 302 N MET A 20 14.881 17.153 -0.316 1.00 14.24 N ATOM 303 CA MET A 20 14.641 18.128 0.770 1.00 12.41 C ATOM 304 C MET A 20 14.402 17.423 2.135 1.00 11.01 C ATOM 305 O MET A 20 14.824 17.936 3.173 1.00 20.40 O ATOM 306 CB MET A 20 13.467 19.088 0.438 1.00 25.23 C ATOM 307 CG MET A 20 13.682 19.981 -0.795 1.00 15.01 C ATOM 308 SD MET A 20 12.442 21.296 -0.957 1.00 34.12 S ATOM 309 CE MET A 20 10.896 20.386 -0.957 1.00 65.33 C ATOM 0 H MET A 20 14.199 17.198 -1.073 1.00 14.24 H new ATOM 0 HA MET A 20 15.548 18.727 0.855 1.00 12.41 H new ATOM 0 HB2 MET A 20 12.566 18.495 0.285 1.00 25.23 H new ATOM 0 HB3 MET A 20 13.285 19.727 1.302 1.00 25.23 H new ATOM 0 HG2 MET A 20 14.673 20.431 -0.740 1.00 15.01 H new ATOM 0 HG3 MET A 20 13.663 19.361 -1.691 1.00 15.01 H new ATOM 0 HE1 MET A 20 10.285 20.706 -1.801 1.00 65.33 H new ATOM 0 HE2 MET A 20 11.102 19.319 -1.042 1.00 65.33 H new ATOM 0 HE3 MET A 20 10.360 20.579 -0.028 1.00 65.33 H new ATOM 319 N LEU A 21 13.731 16.245 2.138 1.00 41.34 N ATOM 320 CA LEU A 21 13.623 15.428 3.376 1.00 45.00 C ATOM 321 C LEU A 21 14.846 14.506 3.559 1.00 55.11 C ATOM 322 O LEU A 21 15.236 14.242 4.686 1.00 52.44 O ATOM 323 CB LEU A 21 12.268 14.628 3.478 1.00 45.34 C ATOM 324 CG LEU A 21 11.913 13.523 2.407 1.00 63.32 C ATOM 325 CD1 LEU A 21 12.763 12.238 2.542 1.00 23.12 C ATOM 326 CD2 LEU A 21 10.411 13.164 2.459 1.00 50.21 C ATOM 0 H LEU A 21 13.267 15.846 1.322 1.00 41.34 H new ATOM 0 HA LEU A 21 13.615 16.137 4.204 1.00 45.00 H new ATOM 0 HB2 LEU A 21 12.250 14.147 4.456 1.00 45.34 H new ATOM 0 HB3 LEU A 21 11.460 15.359 3.467 1.00 45.34 H new ATOM 0 HG LEU A 21 12.152 13.963 1.439 1.00 63.32 H new ATOM 0 HD11 LEU A 21 12.466 11.523 1.775 1.00 23.12 H new ATOM 0 HD12 LEU A 21 13.818 12.485 2.419 1.00 23.12 H new ATOM 0 HD13 LEU A 21 12.606 11.800 3.527 1.00 23.12 H new ATOM 0 HD21 LEU A 21 10.193 12.401 1.712 1.00 50.21 H new ATOM 0 HD22 LEU A 21 10.162 12.783 3.450 1.00 50.21 H new ATOM 0 HD23 LEU A 21 9.817 14.054 2.253 1.00 50.21 H new ATOM 338 N GLU A 22 15.439 14.013 2.440 1.00 45.02 N ATOM 339 CA GLU A 22 16.570 13.039 2.482 1.00 24.53 C ATOM 340 C GLU A 22 17.812 13.621 3.176 1.00 1.45 C ATOM 341 O GLU A 22 18.450 12.934 3.969 1.00 41.02 O ATOM 342 CB GLU A 22 16.943 12.539 1.063 1.00 24.22 C ATOM 343 CG GLU A 22 15.871 11.658 0.396 1.00 65.23 C ATOM 344 CD GLU A 22 16.320 11.094 -0.961 1.00 42.45 C ATOM 345 OE1 GLU A 22 16.205 11.801 -1.975 1.00 63.15 O ATOM 346 OE2 GLU A 22 16.797 9.940 -1.015 1.00 42.34 O ATOM 0 H GLU A 22 15.155 14.272 1.495 1.00 45.02 H new ATOM 0 HA GLU A 22 16.221 12.191 3.071 1.00 24.53 H new ATOM 0 HB2 GLU A 22 17.134 13.402 0.426 1.00 24.22 H new ATOM 0 HB3 GLU A 22 17.874 11.975 1.123 1.00 24.22 H new ATOM 0 HG2 GLU A 22 15.621 10.832 1.062 1.00 65.23 H new ATOM 0 HG3 GLU A 22 14.962 12.243 0.258 1.00 65.23 H new ATOM 353 N ALA A 23 18.120 14.897 2.879 1.00 0.34 N ATOM 354 CA ALA A 23 19.214 15.650 3.531 1.00 51.21 C ATOM 355 C ALA A 23 19.000 15.746 5.059 1.00 73.24 C ATOM 356 O ALA A 23 19.954 15.727 5.837 1.00 42.11 O ATOM 357 CB ALA A 23 19.325 17.054 2.917 1.00 61.13 C ATOM 0 H ALA A 23 17.616 15.439 2.177 1.00 0.34 H new ATOM 0 HA ALA A 23 20.145 15.110 3.360 1.00 51.21 H new ATOM 0 HB1 ALA A 23 20.133 17.601 3.403 1.00 61.13 H new ATOM 0 HB2 ALA A 23 19.534 16.969 1.851 1.00 61.13 H new ATOM 0 HB3 ALA A 23 18.386 17.589 3.061 1.00 61.13 H new ATOM 363 N HIS A 24 17.722 15.836 5.454 1.00 2.12 N ATOM 364 CA HIS A 24 17.289 15.884 6.862 1.00 65.10 C ATOM 365 C HIS A 24 17.263 14.452 7.489 1.00 74.22 C ATOM 366 O HIS A 24 17.431 14.292 8.699 1.00 11.05 O ATOM 367 CB HIS A 24 15.886 16.546 6.905 1.00 10.41 C ATOM 368 CG HIS A 24 15.396 16.907 8.275 1.00 64.51 C ATOM 369 ND1 HIS A 24 15.589 18.152 8.835 1.00 53.22 N ATOM 370 CD2 HIS A 24 14.704 16.193 9.191 1.00 72.32 C ATOM 371 CE1 HIS A 24 15.047 18.181 10.030 1.00 53.43 C ATOM 372 NE2 HIS A 24 14.505 17.009 10.266 1.00 51.11 N ATOM 0 H HIS A 24 16.945 15.878 4.794 1.00 2.12 H new ATOM 0 HA HIS A 24 17.993 16.470 7.453 1.00 65.10 H new ATOM 0 HB2 HIS A 24 15.908 17.449 6.294 1.00 10.41 H new ATOM 0 HB3 HIS A 24 15.167 15.868 6.446 1.00 10.41 H new ATOM 0 HD2 HIS A 24 14.372 15.170 9.091 1.00 72.32 H new ATOM 0 HE1 HIS A 24 15.047 19.025 10.704 1.00 53.43 H new ATOM 0 HE2 HIS A 24 14.012 16.749 11.120 1.00 51.11 H new ATOM 381 N MET A 25 17.049 13.429 6.641 1.00 40.32 N ATOM 382 CA MET A 25 17.007 12.003 7.053 1.00 51.51 C ATOM 383 C MET A 25 18.423 11.443 7.356 1.00 64.40 C ATOM 384 O MET A 25 18.562 10.562 8.209 1.00 3.10 O ATOM 385 CB MET A 25 16.304 11.150 5.954 1.00 30.13 C ATOM 386 CG MET A 25 14.772 11.299 5.900 1.00 53.10 C ATOM 387 SD MET A 25 13.947 10.541 7.318 1.00 53.00 S ATOM 388 CE MET A 25 14.419 8.819 7.118 1.00 43.05 C ATOM 0 H MET A 25 16.899 13.564 5.641 1.00 40.32 H new ATOM 0 HA MET A 25 16.433 11.942 7.977 1.00 51.51 H new ATOM 0 HB2 MET A 25 16.716 11.424 4.983 1.00 30.13 H new ATOM 0 HB3 MET A 25 16.547 10.100 6.118 1.00 30.13 H new ATOM 0 HG2 MET A 25 14.515 12.358 5.859 1.00 53.10 H new ATOM 0 HG3 MET A 25 14.399 10.844 4.982 1.00 53.10 H new ATOM 0 HE1 MET A 25 13.543 8.184 7.251 1.00 43.05 H new ATOM 0 HE2 MET A 25 14.828 8.668 6.119 1.00 43.05 H new ATOM 0 HE3 MET A 25 15.172 8.559 7.862 1.00 43.05 H new ATOM 398 N GLN A 26 19.454 11.958 6.635 1.00 3.21 N ATOM 399 CA GLN A 26 20.879 11.534 6.800 1.00 10.25 C ATOM 400 C GLN A 26 21.344 11.521 8.284 1.00 2.21 C ATOM 401 O GLN A 26 21.867 10.516 8.770 1.00 4.13 O ATOM 402 CB GLN A 26 21.841 12.450 5.982 1.00 44.14 C ATOM 403 CG GLN A 26 21.506 12.618 4.487 1.00 22.34 C ATOM 404 CD GLN A 26 21.484 11.314 3.676 1.00 70.44 C ATOM 405 OE1 GLN A 26 22.225 10.374 3.943 1.00 72.51 O ATOM 406 NE2 GLN A 26 20.619 11.242 2.683 1.00 20.35 N ATOM 0 H GLN A 26 19.326 12.677 5.923 1.00 3.21 H new ATOM 0 HA GLN A 26 20.923 10.513 6.422 1.00 10.25 H new ATOM 0 HB2 GLN A 26 21.852 13.437 6.445 1.00 44.14 H new ATOM 0 HB3 GLN A 26 22.851 12.048 6.065 1.00 44.14 H new ATOM 0 HG2 GLN A 26 20.531 13.099 4.400 1.00 22.34 H new ATOM 0 HG3 GLN A 26 22.235 13.294 4.040 1.00 22.34 H new ATOM 0 HE21 GLN A 26 20.012 12.035 2.477 1.00 20.35 H new ATOM 0 HE22 GLN A 26 20.557 10.393 2.121 1.00 20.35 H new ATOM 415 N SER A 27 21.134 12.644 8.995 1.00 33.45 N ATOM 416 CA SER A 27 21.564 12.808 10.411 1.00 15.03 C ATOM 417 C SER A 27 20.349 12.890 11.364 1.00 25.01 C ATOM 418 O SER A 27 20.460 13.422 12.478 1.00 50.01 O ATOM 419 CB SER A 27 22.445 14.079 10.546 1.00 21.44 C ATOM 420 OG SER A 27 23.573 14.036 9.682 1.00 72.10 O ATOM 0 H SER A 27 20.664 13.465 8.613 1.00 33.45 H new ATOM 0 HA SER A 27 22.147 11.932 10.696 1.00 15.03 H new ATOM 0 HB2 SER A 27 21.847 14.961 10.318 1.00 21.44 H new ATOM 0 HB3 SER A 27 22.782 14.180 11.578 1.00 21.44 H new ATOM 0 HG SER A 27 24.102 14.853 9.794 1.00 72.10 H new ATOM 426 N TYR A 28 19.192 12.352 10.921 1.00 52.25 N ATOM 427 CA TYR A 28 17.963 12.323 11.744 1.00 71.03 C ATOM 428 C TYR A 28 18.167 11.473 13.032 1.00 23.31 C ATOM 429 O TYR A 28 18.461 10.276 12.949 1.00 45.15 O ATOM 430 CB TYR A 28 16.759 11.787 10.923 1.00 1.30 C ATOM 431 CG TYR A 28 15.401 12.161 11.527 1.00 15.53 C ATOM 432 CD1 TYR A 28 14.943 13.475 11.452 1.00 33.12 C ATOM 433 CD2 TYR A 28 14.585 11.226 12.175 1.00 2.00 C ATOM 434 CE1 TYR A 28 13.735 13.847 11.993 1.00 74.31 C ATOM 435 CE2 TYR A 28 13.369 11.600 12.717 1.00 11.32 C ATOM 436 CZ TYR A 28 12.952 12.914 12.623 1.00 43.41 C ATOM 437 OH TYR A 28 11.743 13.298 13.155 1.00 64.11 O ATOM 0 H TYR A 28 19.083 11.932 9.998 1.00 52.25 H new ATOM 0 HA TYR A 28 17.744 13.347 12.047 1.00 71.03 H new ATOM 0 HB2 TYR A 28 16.818 12.178 9.907 1.00 1.30 H new ATOM 0 HB3 TYR A 28 16.831 10.702 10.851 1.00 1.30 H new ATOM 0 HD1 TYR A 28 15.551 14.218 10.958 1.00 33.12 H new ATOM 0 HD2 TYR A 28 14.910 10.199 12.253 1.00 2.00 H new ATOM 0 HE1 TYR A 28 13.403 14.872 11.922 1.00 74.31 H new ATOM 0 HE2 TYR A 28 12.748 10.868 13.212 1.00 11.32 H new ATOM 0 HH TYR A 28 11.279 13.886 12.523 1.00 64.11 H new ATOM 447 N LYS A 29 18.001 12.116 14.204 1.00 72.03 N ATOM 448 CA LYS A 29 18.293 11.516 15.527 1.00 53.40 C ATOM 449 C LYS A 29 17.335 10.342 15.859 1.00 64.31 C ATOM 450 O LYS A 29 17.747 9.175 15.838 1.00 32.14 O ATOM 451 CB LYS A 29 18.226 12.620 16.626 1.00 12.13 C ATOM 452 CG LYS A 29 18.756 12.198 18.015 1.00 73.35 C ATOM 453 CD LYS A 29 20.271 11.885 18.005 1.00 4.24 C ATOM 454 CE LYS A 29 20.816 11.492 19.390 1.00 14.23 C ATOM 455 NZ LYS A 29 22.286 11.241 19.361 1.00 44.14 N ATOM 0 H LYS A 29 17.658 13.075 14.263 1.00 72.03 H new ATOM 0 HA LYS A 29 19.299 11.098 15.496 1.00 53.40 H new ATOM 0 HB2 LYS A 29 18.795 13.485 16.285 1.00 12.13 H new ATOM 0 HB3 LYS A 29 17.190 12.942 16.732 1.00 12.13 H new ATOM 0 HG2 LYS A 29 18.558 12.995 18.732 1.00 73.35 H new ATOM 0 HG3 LYS A 29 18.210 11.319 18.356 1.00 73.35 H new ATOM 0 HD2 LYS A 29 20.464 11.075 17.302 1.00 4.24 H new ATOM 0 HD3 LYS A 29 20.814 12.758 17.642 1.00 4.24 H new ATOM 0 HE2 LYS A 29 20.598 12.286 20.104 1.00 14.23 H new ATOM 0 HE3 LYS A 29 20.302 10.597 19.741 1.00 14.23 H new ATOM 0 HZ1 LYS A 29 22.612 10.979 20.313 1.00 44.14 H new ATOM 0 HZ2 LYS A 29 22.493 10.466 18.699 1.00 44.14 H new ATOM 0 HZ3 LYS A 29 22.779 12.102 19.051 1.00 44.14 H new ATOM 469 N GLY A 30 16.062 10.663 16.153 1.00 62.32 N ATOM 470 CA GLY A 30 15.067 9.638 16.486 1.00 1.13 C ATOM 471 C GLY A 30 13.739 10.216 16.953 1.00 4.22 C ATOM 472 O GLY A 30 13.182 9.773 17.959 1.00 32.43 O ATOM 0 H GLY A 30 15.704 11.618 16.166 1.00 62.32 H new ATOM 0 HA2 GLY A 30 14.895 9.011 15.611 1.00 1.13 H new ATOM 0 HA3 GLY A 30 15.469 8.992 17.267 1.00 1.13 H new ATOM 476 N ASN A 31 13.230 11.216 16.215 1.00 52.12 N ATOM 477 CA ASN A 31 11.918 11.859 16.490 1.00 43.11 C ATOM 478 C ASN A 31 10.845 11.295 15.508 1.00 30.31 C ATOM 479 O ASN A 31 9.924 11.995 15.075 1.00 31.51 O ATOM 480 CB ASN A 31 12.102 13.404 16.388 1.00 63.33 C ATOM 481 CG ASN A 31 10.845 14.212 16.743 1.00 42.11 C ATOM 482 OD1 ASN A 31 10.553 14.449 17.910 1.00 34.13 O ATOM 483 ND2 ASN A 31 10.108 14.655 15.739 1.00 51.12 N ATOM 0 H ASN A 31 13.712 11.608 15.406 1.00 52.12 H new ATOM 0 HA ASN A 31 11.561 11.634 17.495 1.00 43.11 H new ATOM 0 HB2 ASN A 31 12.914 13.707 17.050 1.00 63.33 H new ATOM 0 HB3 ASN A 31 12.408 13.656 15.373 1.00 63.33 H new ATOM 0 HD21 ASN A 31 9.272 15.209 15.926 1.00 51.12 H new ATOM 0 HD22 ASN A 31 10.375 14.442 14.778 1.00 51.12 H new ATOM 490 N ASP A 32 10.981 9.988 15.202 1.00 32.03 N ATOM 491 CA ASP A 32 10.103 9.247 14.273 1.00 3.51 C ATOM 492 C ASP A 32 10.255 9.753 12.797 1.00 34.32 C ATOM 493 O ASP A 32 9.713 10.807 12.438 1.00 53.13 O ATOM 494 CB ASP A 32 8.627 9.282 14.746 1.00 22.23 C ATOM 495 CG ASP A 32 7.701 8.486 13.831 1.00 62.43 C ATOM 496 OD1 ASP A 32 7.661 7.253 13.955 1.00 52.54 O ATOM 497 OD2 ASP A 32 7.012 9.089 12.976 1.00 12.32 O ATOM 0 H ASP A 32 11.718 9.407 15.601 1.00 32.03 H new ATOM 0 HA ASP A 32 10.424 8.205 14.282 1.00 3.51 H new ATOM 0 HB2 ASP A 32 8.564 8.882 15.758 1.00 22.23 H new ATOM 0 HB3 ASP A 32 8.287 10.317 14.790 1.00 22.23 H new ATOM 502 N PRO A 33 11.013 9.008 11.925 1.00 21.31 N ATOM 503 CA PRO A 33 11.250 9.412 10.504 1.00 60.41 C ATOM 504 C PRO A 33 9.970 9.457 9.618 1.00 41.40 C ATOM 505 O PRO A 33 9.919 10.247 8.673 1.00 3.00 O ATOM 506 CB PRO A 33 12.264 8.345 10.000 1.00 31.14 C ATOM 507 CG PRO A 33 12.077 7.164 10.905 1.00 33.43 C ATOM 508 CD PRO A 33 11.731 7.742 12.257 1.00 70.12 C ATOM 0 HA PRO A 33 11.614 10.438 10.441 1.00 60.41 H new ATOM 0 HB2 PRO A 33 12.071 8.079 8.961 1.00 31.14 H new ATOM 0 HB3 PRO A 33 13.286 8.720 10.048 1.00 31.14 H new ATOM 0 HG2 PRO A 33 11.282 6.513 10.541 1.00 33.43 H new ATOM 0 HG3 PRO A 33 12.984 6.561 10.956 1.00 33.43 H new ATOM 0 HD2 PRO A 33 11.102 7.064 12.834 1.00 70.12 H new ATOM 0 HD3 PRO A 33 12.624 7.932 12.852 1.00 70.12 H new ATOM 516 N LEU A 34 8.941 8.620 9.929 1.00 74.43 N ATOM 517 CA LEU A 34 7.670 8.585 9.140 1.00 1.31 C ATOM 518 C LEU A 34 6.946 9.945 9.188 1.00 11.04 C ATOM 519 O LEU A 34 6.449 10.430 8.169 1.00 33.00 O ATOM 520 CB LEU A 34 6.726 7.454 9.638 1.00 32.12 C ATOM 521 CG LEU A 34 5.412 7.223 8.807 1.00 74.24 C ATOM 522 CD1 LEU A 34 5.723 6.862 7.333 1.00 53.35 C ATOM 523 CD2 LEU A 34 4.500 6.153 9.465 1.00 64.43 C ATOM 0 H LEU A 34 8.963 7.966 10.711 1.00 74.43 H new ATOM 0 HA LEU A 34 7.938 8.375 8.105 1.00 1.31 H new ATOM 0 HB2 LEU A 34 7.289 6.521 9.653 1.00 32.12 H new ATOM 0 HB3 LEU A 34 6.445 7.673 10.668 1.00 32.12 H new ATOM 0 HG LEU A 34 4.866 8.166 8.806 1.00 74.24 H new ATOM 0 HD11 LEU A 34 4.790 6.710 6.791 1.00 53.35 H new ATOM 0 HD12 LEU A 34 6.283 7.674 6.870 1.00 53.35 H new ATOM 0 HD13 LEU A 34 6.315 5.947 7.300 1.00 53.35 H new ATOM 0 HD21 LEU A 34 3.601 6.020 8.862 1.00 64.43 H new ATOM 0 HD22 LEU A 34 5.037 5.207 9.529 1.00 64.43 H new ATOM 0 HD23 LEU A 34 4.220 6.480 10.467 1.00 64.43 H new ATOM 535 N GLY A 35 6.970 10.569 10.381 1.00 44.34 N ATOM 536 CA GLY A 35 6.366 11.884 10.608 1.00 72.04 C ATOM 537 C GLY A 35 6.949 13.010 9.738 1.00 2.23 C ATOM 538 O GLY A 35 6.304 14.038 9.570 1.00 3.12 O ATOM 0 H GLY A 35 7.410 10.171 11.211 1.00 44.34 H new ATOM 0 HA2 GLY A 35 5.294 11.815 10.421 1.00 72.04 H new ATOM 0 HA3 GLY A 35 6.490 12.151 11.657 1.00 72.04 H new ATOM 542 N GLU A 36 8.174 12.809 9.203 1.00 51.24 N ATOM 543 CA GLU A 36 8.819 13.747 8.247 1.00 21.01 C ATOM 544 C GLU A 36 8.256 13.561 6.820 1.00 50.32 C ATOM 545 O GLU A 36 7.871 14.529 6.153 1.00 2.21 O ATOM 546 CB GLU A 36 10.361 13.522 8.223 1.00 2.12 C ATOM 547 CG GLU A 36 11.053 13.701 9.581 1.00 14.25 C ATOM 548 CD GLU A 36 10.868 15.112 10.167 1.00 43.44 C ATOM 549 OE1 GLU A 36 11.426 16.075 9.606 1.00 53.33 O ATOM 550 OE2 GLU A 36 10.158 15.272 11.182 1.00 1.44 O ATOM 0 H GLU A 36 8.746 11.993 9.420 1.00 51.24 H new ATOM 0 HA GLU A 36 8.602 14.761 8.582 1.00 21.01 H new ATOM 0 HB2 GLU A 36 10.563 12.515 7.857 1.00 2.12 H new ATOM 0 HB3 GLU A 36 10.805 14.216 7.509 1.00 2.12 H new ATOM 0 HG2 GLU A 36 10.658 12.967 10.284 1.00 14.25 H new ATOM 0 HG3 GLU A 36 12.118 13.496 9.470 1.00 14.25 H new ATOM 557 N TRP A 37 8.219 12.291 6.377 1.00 45.14 N ATOM 558 CA TRP A 37 7.738 11.907 5.034 1.00 3.01 C ATOM 559 C TRP A 37 6.262 12.305 4.801 1.00 20.01 C ATOM 560 O TRP A 37 5.930 12.835 3.746 1.00 74.03 O ATOM 561 CB TRP A 37 7.909 10.387 4.821 1.00 20.12 C ATOM 562 CG TRP A 37 9.337 9.940 4.613 1.00 34.12 C ATOM 563 CD1 TRP A 37 10.324 9.837 5.550 1.00 41.12 C ATOM 564 CD2 TRP A 37 9.925 9.528 3.371 1.00 51.13 C ATOM 565 NE1 TRP A 37 11.473 9.359 4.975 1.00 60.34 N ATOM 566 CE2 TRP A 37 11.254 9.163 3.639 1.00 34.53 C ATOM 567 CE3 TRP A 37 9.443 9.417 2.063 1.00 41.41 C ATOM 568 CZ2 TRP A 37 12.111 8.705 2.646 1.00 3.43 C ATOM 569 CZ3 TRP A 37 10.295 8.970 1.078 1.00 33.20 C ATOM 570 CH2 TRP A 37 11.615 8.609 1.375 1.00 23.13 C ATOM 0 H TRP A 37 8.523 11.498 6.942 1.00 45.14 H new ATOM 0 HA TRP A 37 8.343 12.452 4.310 1.00 3.01 H new ATOM 0 HB2 TRP A 37 7.500 9.864 5.685 1.00 20.12 H new ATOM 0 HB3 TRP A 37 7.318 10.085 3.956 1.00 20.12 H new ATOM 0 HD1 TRP A 37 10.216 10.095 6.593 1.00 41.12 H new ATOM 0 HE1 TRP A 37 12.350 9.179 5.464 1.00 60.34 H new ATOM 0 HE3 TRP A 37 8.421 9.677 1.830 1.00 41.41 H new ATOM 0 HZ2 TRP A 37 13.132 8.434 2.870 1.00 3.43 H new ATOM 0 HZ3 TRP A 37 9.940 8.897 0.061 1.00 33.20 H new ATOM 0 HH2 TRP A 37 12.255 8.247 0.584 1.00 23.13 H new ATOM 581 N GLU A 38 5.399 12.063 5.812 1.00 74.40 N ATOM 582 CA GLU A 38 3.946 12.381 5.750 1.00 23.05 C ATOM 583 C GLU A 38 3.694 13.884 5.467 1.00 42.13 C ATOM 584 O GLU A 38 2.722 14.244 4.786 1.00 33.21 O ATOM 585 CB GLU A 38 3.252 11.963 7.069 1.00 20.31 C ATOM 586 CG GLU A 38 3.350 10.456 7.385 1.00 45.43 C ATOM 587 CD GLU A 38 2.587 10.042 8.655 1.00 21.42 C ATOM 588 OE1 GLU A 38 3.174 10.104 9.758 1.00 70.23 O ATOM 589 OE2 GLU A 38 1.392 9.664 8.557 1.00 23.45 O ATOM 0 H GLU A 38 5.685 11.642 6.696 1.00 74.40 H new ATOM 0 HA GLU A 38 3.521 11.815 4.921 1.00 23.05 H new ATOM 0 HB2 GLU A 38 3.693 12.525 7.892 1.00 20.31 H new ATOM 0 HB3 GLU A 38 2.200 12.245 7.018 1.00 20.31 H new ATOM 0 HG2 GLU A 38 2.963 9.890 6.538 1.00 45.43 H new ATOM 0 HG3 GLU A 38 4.400 10.184 7.497 1.00 45.43 H new ATOM 596 N ARG A 39 4.606 14.742 5.978 1.00 25.23 N ATOM 597 CA ARG A 39 4.569 16.204 5.737 1.00 43.24 C ATOM 598 C ARG A 39 4.819 16.526 4.254 1.00 43.22 C ATOM 599 O ARG A 39 4.250 17.464 3.721 1.00 10.40 O ATOM 600 CB ARG A 39 5.611 16.950 6.617 1.00 30.33 C ATOM 601 CG ARG A 39 5.518 16.614 8.112 1.00 62.34 C ATOM 602 CD ARG A 39 4.128 16.883 8.722 1.00 5.40 C ATOM 603 NE ARG A 39 3.983 16.246 10.039 1.00 63.45 N ATOM 604 CZ ARG A 39 3.233 16.689 11.022 1.00 20.42 C ATOM 605 NH1 ARG A 39 2.613 17.823 10.955 1.00 44.05 N ATOM 606 NH2 ARG A 39 3.123 15.986 12.088 1.00 42.02 N ATOM 0 H ARG A 39 5.384 14.444 6.566 1.00 25.23 H new ATOM 0 HA ARG A 39 3.572 16.549 6.011 1.00 43.24 H new ATOM 0 HB2 ARG A 39 6.612 16.707 6.262 1.00 30.33 H new ATOM 0 HB3 ARG A 39 5.479 18.024 6.487 1.00 30.33 H new ATOM 0 HG2 ARG A 39 5.771 15.564 8.256 1.00 62.34 H new ATOM 0 HG3 ARG A 39 6.262 17.198 8.654 1.00 62.34 H new ATOM 0 HD2 ARG A 39 3.974 17.958 8.818 1.00 5.40 H new ATOM 0 HD3 ARG A 39 3.356 16.509 8.049 1.00 5.40 H new ATOM 0 HE ARG A 39 4.509 15.388 10.203 1.00 63.45 H new ATOM 0 HH11 ARG A 39 2.699 18.403 10.120 1.00 44.05 H new ATOM 0 HH12 ARG A 39 2.038 18.137 11.737 1.00 44.05 H new ATOM 0 HH21 ARG A 39 3.614 15.095 12.165 1.00 42.02 H new ATOM 0 HH22 ARG A 39 2.544 16.317 12.860 1.00 42.02 H new ATOM 620 N TYR A 40 5.671 15.725 3.600 1.00 33.13 N ATOM 621 CA TYR A 40 5.990 15.893 2.169 1.00 32.15 C ATOM 622 C TYR A 40 4.918 15.272 1.258 1.00 22.04 C ATOM 623 O TYR A 40 4.708 15.770 0.157 1.00 42.31 O ATOM 624 CB TYR A 40 7.393 15.319 1.853 1.00 34.42 C ATOM 625 CG TYR A 40 8.526 16.264 2.254 1.00 45.22 C ATOM 626 CD1 TYR A 40 8.806 16.537 3.596 1.00 73.25 C ATOM 627 CD2 TYR A 40 9.300 16.903 1.286 1.00 12.42 C ATOM 628 CE1 TYR A 40 9.815 17.411 3.951 1.00 14.52 C ATOM 629 CE2 TYR A 40 10.307 17.767 1.639 1.00 2.04 C ATOM 630 CZ TYR A 40 10.563 18.022 2.966 1.00 64.23 C ATOM 631 OH TYR A 40 11.566 18.900 3.310 1.00 24.35 O ATOM 0 H TYR A 40 6.158 14.945 4.042 1.00 33.13 H new ATOM 0 HA TYR A 40 5.999 16.963 1.960 1.00 32.15 H new ATOM 0 HB2 TYR A 40 7.517 14.369 2.373 1.00 34.42 H new ATOM 0 HB3 TYR A 40 7.462 15.109 0.786 1.00 34.42 H new ATOM 0 HD1 TYR A 40 8.224 16.057 4.368 1.00 73.25 H new ATOM 0 HD2 TYR A 40 9.104 16.715 0.241 1.00 12.42 H new ATOM 0 HE1 TYR A 40 10.017 17.615 4.992 1.00 14.52 H new ATOM 0 HE2 TYR A 40 10.899 18.247 0.874 1.00 2.04 H new ATOM 0 HH TYR A 40 11.940 18.645 4.179 1.00 24.35 H new ATOM 641 N ILE A 41 4.249 14.187 1.718 1.00 73.00 N ATOM 642 CA ILE A 41 3.093 13.595 0.992 1.00 31.35 C ATOM 643 C ILE A 41 1.918 14.612 0.931 1.00 1.20 C ATOM 644 O ILE A 41 1.336 14.819 -0.135 1.00 15.02 O ATOM 645 CB ILE A 41 2.622 12.196 1.604 1.00 10.44 C ATOM 646 CG1 ILE A 41 3.504 10.996 1.088 1.00 14.54 C ATOM 647 CG2 ILE A 41 1.118 11.900 1.311 1.00 63.13 C ATOM 648 CD1 ILE A 41 4.991 11.045 1.422 1.00 40.15 C ATOM 0 H ILE A 41 4.487 13.704 2.584 1.00 73.00 H new ATOM 0 HA ILE A 41 3.427 13.380 -0.023 1.00 31.35 H new ATOM 0 HB ILE A 41 2.753 12.287 2.682 1.00 10.44 H new ATOM 0 HG12 ILE A 41 3.094 10.072 1.496 1.00 14.54 H new ATOM 0 HG13 ILE A 41 3.400 10.939 0.004 1.00 14.54 H new ATOM 0 HG21 ILE A 41 0.845 10.939 1.747 1.00 63.13 H new ATOM 0 HG22 ILE A 41 0.501 12.685 1.748 1.00 63.13 H new ATOM 0 HG23 ILE A 41 0.956 11.869 0.233 1.00 63.13 H new ATOM 0 HD11 ILE A 41 5.485 10.164 1.012 1.00 40.15 H new ATOM 0 HD12 ILE A 41 5.432 11.943 0.989 1.00 40.15 H new ATOM 0 HD13 ILE A 41 5.120 11.063 2.504 1.00 40.15 H new ATOM 660 N GLN A 42 1.585 15.265 2.071 1.00 3.24 N ATOM 661 CA GLN A 42 0.538 16.322 2.082 1.00 71.12 C ATOM 662 C GLN A 42 1.011 17.603 1.333 1.00 24.33 C ATOM 663 O GLN A 42 0.217 18.243 0.632 1.00 50.41 O ATOM 664 CB GLN A 42 0.091 16.689 3.527 1.00 33.21 C ATOM 665 CG GLN A 42 1.204 17.272 4.426 1.00 14.22 C ATOM 666 CD GLN A 42 0.691 18.170 5.550 1.00 45.23 C ATOM 667 OE1 GLN A 42 0.392 17.716 6.648 1.00 13.55 O ATOM 668 NE2 GLN A 42 0.594 19.461 5.275 1.00 50.20 N ATOM 0 H GLN A 42 2.015 15.085 2.979 1.00 3.24 H new ATOM 0 HA GLN A 42 -0.322 15.907 1.557 1.00 71.12 H new ATOM 0 HB2 GLN A 42 -0.723 17.412 3.467 1.00 33.21 H new ATOM 0 HB3 GLN A 42 -0.311 15.796 4.005 1.00 33.21 H new ATOM 0 HG2 GLN A 42 1.772 16.450 4.862 1.00 14.22 H new ATOM 0 HG3 GLN A 42 1.895 17.843 3.806 1.00 14.22 H new ATOM 0 HE21 GLN A 42 0.851 19.806 4.350 1.00 50.20 H new ATOM 0 HE22 GLN A 42 0.262 20.111 5.988 1.00 50.20 H new ATOM 677 N TRP A 43 2.317 17.944 1.477 1.00 23.44 N ATOM 678 CA TRP A 43 2.915 19.161 0.872 1.00 3.41 C ATOM 679 C TRP A 43 2.818 19.126 -0.663 1.00 23.53 C ATOM 680 O TRP A 43 2.443 20.105 -1.290 1.00 70.34 O ATOM 681 CB TRP A 43 4.400 19.325 1.294 1.00 34.54 C ATOM 682 CG TRP A 43 5.064 20.605 0.813 1.00 3.04 C ATOM 683 CD1 TRP A 43 4.994 21.843 1.395 1.00 41.22 C ATOM 684 CD2 TRP A 43 5.898 20.764 -0.350 1.00 11.42 C ATOM 685 NE1 TRP A 43 5.726 22.750 0.668 1.00 0.11 N ATOM 686 CE2 TRP A 43 6.289 22.115 -0.404 1.00 61.12 C ATOM 687 CE3 TRP A 43 6.348 19.895 -1.352 1.00 31.20 C ATOM 688 CZ2 TRP A 43 7.105 22.614 -1.412 1.00 62.34 C ATOM 689 CZ3 TRP A 43 7.160 20.393 -2.349 1.00 40.14 C ATOM 690 CH2 TRP A 43 7.530 21.742 -2.375 1.00 25.03 C ATOM 0 H TRP A 43 2.982 17.386 2.013 1.00 23.44 H new ATOM 0 HA TRP A 43 2.346 20.015 1.241 1.00 3.41 H new ATOM 0 HB2 TRP A 43 4.460 19.288 2.382 1.00 34.54 H new ATOM 0 HB3 TRP A 43 4.966 18.474 0.915 1.00 34.54 H new ATOM 0 HD1 TRP A 43 4.443 22.073 2.295 1.00 41.22 H new ATOM 0 HE1 TRP A 43 5.833 23.739 0.892 1.00 0.11 H new ATOM 0 HE3 TRP A 43 6.064 18.853 -1.344 1.00 31.20 H new ATOM 0 HZ2 TRP A 43 7.393 23.655 -1.434 1.00 62.34 H new ATOM 0 HZ3 TRP A 43 7.517 19.730 -3.123 1.00 40.14 H new ATOM 0 HH2 TRP A 43 8.164 22.102 -3.172 1.00 25.03 H new ATOM 701 N VAL A 44 3.175 17.985 -1.254 1.00 42.43 N ATOM 702 CA VAL A 44 3.095 17.800 -2.713 1.00 30.33 C ATOM 703 C VAL A 44 1.625 17.779 -3.208 1.00 4.15 C ATOM 704 O VAL A 44 1.346 18.197 -4.316 1.00 2.40 O ATOM 705 CB VAL A 44 3.860 16.515 -3.183 1.00 64.14 C ATOM 706 CG1 VAL A 44 3.289 15.244 -2.547 1.00 1.55 C ATOM 707 CG2 VAL A 44 3.872 16.401 -4.717 1.00 42.20 C ATOM 0 H VAL A 44 3.524 17.171 -0.748 1.00 42.43 H new ATOM 0 HA VAL A 44 3.588 18.661 -3.165 1.00 30.33 H new ATOM 0 HB VAL A 44 4.890 16.617 -2.842 1.00 64.14 H new ATOM 0 HG11 VAL A 44 3.848 14.378 -2.900 1.00 1.55 H new ATOM 0 HG12 VAL A 44 3.371 15.311 -1.462 1.00 1.55 H new ATOM 0 HG13 VAL A 44 2.241 15.137 -2.826 1.00 1.55 H new ATOM 0 HG21 VAL A 44 4.410 15.500 -5.011 1.00 42.20 H new ATOM 0 HG22 VAL A 44 2.848 16.349 -5.086 1.00 42.20 H new ATOM 0 HG23 VAL A 44 4.367 17.274 -5.143 1.00 42.20 H new ATOM 717 N GLU A 45 0.682 17.322 -2.366 1.00 22.14 N ATOM 718 CA GLU A 45 -0.753 17.296 -2.731 1.00 33.45 C ATOM 719 C GLU A 45 -1.384 18.712 -2.735 1.00 44.54 C ATOM 720 O GLU A 45 -2.258 19.008 -3.562 1.00 31.21 O ATOM 721 CB GLU A 45 -1.530 16.319 -1.805 1.00 34.21 C ATOM 722 CG GLU A 45 -1.226 14.824 -2.062 1.00 34.54 C ATOM 723 CD GLU A 45 -1.740 14.314 -3.428 1.00 31.41 C ATOM 724 OE1 GLU A 45 -1.169 14.686 -4.483 1.00 11.35 O ATOM 725 OE2 GLU A 45 -2.730 13.553 -3.463 1.00 25.40 O ATOM 0 H GLU A 45 0.882 16.966 -1.431 1.00 22.14 H new ATOM 0 HA GLU A 45 -0.829 16.928 -3.754 1.00 33.45 H new ATOM 0 HB2 GLU A 45 -1.292 16.553 -0.767 1.00 34.21 H new ATOM 0 HB3 GLU A 45 -2.599 16.488 -1.933 1.00 34.21 H new ATOM 0 HG2 GLU A 45 -0.149 14.666 -2.007 1.00 34.54 H new ATOM 0 HG3 GLU A 45 -1.677 14.228 -1.268 1.00 34.54 H new ATOM 732 N GLU A 46 -0.922 19.587 -1.828 1.00 42.01 N ATOM 733 CA GLU A 46 -1.420 20.983 -1.743 1.00 53.04 C ATOM 734 C GLU A 46 -0.681 21.936 -2.728 1.00 72.34 C ATOM 735 O GLU A 46 -1.292 22.845 -3.284 1.00 42.45 O ATOM 736 CB GLU A 46 -1.310 21.497 -0.282 1.00 61.21 C ATOM 737 CG GLU A 46 0.118 21.529 0.280 1.00 72.34 C ATOM 738 CD GLU A 46 0.187 21.861 1.772 1.00 32.13 C ATOM 739 OE1 GLU A 46 0.208 23.056 2.128 1.00 33.23 O ATOM 740 OE2 GLU A 46 0.220 20.925 2.602 1.00 4.05 O ATOM 0 H GLU A 46 -0.204 19.359 -1.140 1.00 42.01 H new ATOM 0 HA GLU A 46 -2.468 20.980 -2.042 1.00 53.04 H new ATOM 0 HB2 GLU A 46 -1.728 22.502 -0.232 1.00 61.21 H new ATOM 0 HB3 GLU A 46 -1.924 20.864 0.359 1.00 61.21 H new ATOM 0 HG2 GLU A 46 0.587 20.560 0.111 1.00 72.34 H new ATOM 0 HG3 GLU A 46 0.700 22.266 -0.274 1.00 72.34 H new ATOM 747 N ASN A 47 0.634 21.721 -2.936 1.00 55.14 N ATOM 748 CA ASN A 47 1.462 22.548 -3.861 1.00 64.33 C ATOM 749 C ASN A 47 1.352 22.074 -5.333 1.00 73.34 C ATOM 750 O ASN A 47 1.422 22.889 -6.260 1.00 65.43 O ATOM 751 CB ASN A 47 2.950 22.548 -3.399 1.00 11.24 C ATOM 752 CG ASN A 47 3.197 23.452 -2.187 1.00 40.32 C ATOM 753 OD1 ASN A 47 3.588 24.602 -2.328 1.00 55.30 O ATOM 754 ND2 ASN A 47 2.946 22.959 -0.992 1.00 54.34 N ATOM 0 H ASN A 47 1.157 20.976 -2.475 1.00 55.14 H new ATOM 0 HA ASN A 47 1.073 23.565 -3.822 1.00 64.33 H new ATOM 0 HB2 ASN A 47 3.249 21.529 -3.153 1.00 11.24 H new ATOM 0 HB3 ASN A 47 3.582 22.875 -4.225 1.00 11.24 H new ATOM 0 HD21 ASN A 47 3.077 23.539 -0.163 1.00 54.34 H new ATOM 0 HD22 ASN A 47 2.621 21.997 -0.895 1.00 54.34 H new ATOM 761 N PHE A 48 1.170 20.761 -5.534 1.00 43.42 N ATOM 762 CA PHE A 48 1.136 20.129 -6.878 1.00 21.54 C ATOM 763 C PHE A 48 -0.183 19.310 -7.047 1.00 63.22 C ATOM 764 O PHE A 48 -0.207 18.099 -6.790 1.00 64.21 O ATOM 765 CB PHE A 48 2.383 19.215 -7.068 1.00 74.20 C ATOM 766 CG PHE A 48 3.736 19.922 -6.960 1.00 41.24 C ATOM 767 CD1 PHE A 48 4.260 20.630 -8.039 1.00 15.13 C ATOM 768 CD2 PHE A 48 4.483 19.884 -5.778 1.00 14.11 C ATOM 769 CE1 PHE A 48 5.485 21.263 -7.944 1.00 33.32 C ATOM 770 CE2 PHE A 48 5.708 20.516 -5.688 1.00 1.43 C ATOM 771 CZ PHE A 48 6.207 21.210 -6.770 1.00 5.53 C ATOM 0 H PHE A 48 1.041 20.097 -4.771 1.00 43.42 H new ATOM 0 HA PHE A 48 1.160 20.906 -7.642 1.00 21.54 H new ATOM 0 HB2 PHE A 48 2.347 18.420 -6.323 1.00 74.20 H new ATOM 0 HB3 PHE A 48 2.318 18.739 -8.046 1.00 74.20 H new ATOM 0 HD1 PHE A 48 3.702 20.685 -8.962 1.00 15.13 H new ATOM 0 HD2 PHE A 48 4.096 19.352 -4.922 1.00 14.11 H new ATOM 0 HE1 PHE A 48 5.879 21.802 -8.793 1.00 33.32 H new ATOM 0 HE2 PHE A 48 6.275 20.467 -4.770 1.00 1.43 H new ATOM 0 HZ PHE A 48 7.161 21.711 -6.698 1.00 5.53 H new ATOM 781 N PRO A 49 -1.315 19.967 -7.457 1.00 11.13 N ATOM 782 CA PRO A 49 -2.653 19.301 -7.533 1.00 54.23 C ATOM 783 C PRO A 49 -2.751 18.202 -8.635 1.00 24.02 C ATOM 784 O PRO A 49 -3.328 17.134 -8.407 1.00 40.35 O ATOM 785 CB PRO A 49 -3.615 20.484 -7.817 1.00 74.20 C ATOM 786 CG PRO A 49 -2.766 21.515 -8.502 1.00 23.31 C ATOM 787 CD PRO A 49 -1.393 21.399 -7.869 1.00 52.20 C ATOM 0 HA PRO A 49 -2.883 18.753 -6.619 1.00 54.23 H new ATOM 0 HB2 PRO A 49 -4.447 20.174 -8.449 1.00 74.20 H new ATOM 0 HB3 PRO A 49 -4.044 20.875 -6.894 1.00 74.20 H new ATOM 0 HG2 PRO A 49 -2.719 21.334 -9.576 1.00 23.31 H new ATOM 0 HG3 PRO A 49 -3.177 22.515 -8.365 1.00 23.31 H new ATOM 0 HD2 PRO A 49 -0.603 21.656 -8.575 1.00 52.20 H new ATOM 0 HD3 PRO A 49 -1.288 22.068 -7.015 1.00 52.20 H new ATOM 795 N GLU A 50 -2.208 18.489 -9.833 1.00 20.44 N ATOM 796 CA GLU A 50 -2.202 17.546 -10.987 1.00 20.54 C ATOM 797 C GLU A 50 -0.790 17.000 -11.293 1.00 50.04 C ATOM 798 O GLU A 50 -0.647 16.032 -12.051 1.00 14.41 O ATOM 799 CB GLU A 50 -2.808 18.241 -12.238 1.00 53.11 C ATOM 800 CG GLU A 50 -4.304 18.582 -12.101 1.00 11.33 C ATOM 801 CD GLU A 50 -5.194 17.334 -11.933 1.00 51.24 C ATOM 802 OE1 GLU A 50 -5.535 16.695 -12.951 1.00 5.31 O ATOM 803 OE2 GLU A 50 -5.545 16.975 -10.786 1.00 63.45 O ATOM 0 H GLU A 50 -1.758 19.381 -10.037 1.00 20.44 H new ATOM 0 HA GLU A 50 -2.817 16.688 -10.717 1.00 20.54 H new ATOM 0 HB2 GLU A 50 -2.253 19.158 -12.436 1.00 53.11 H new ATOM 0 HB3 GLU A 50 -2.671 17.593 -13.103 1.00 53.11 H new ATOM 0 HG2 GLU A 50 -4.444 19.239 -11.243 1.00 11.33 H new ATOM 0 HG3 GLU A 50 -4.627 19.136 -12.983 1.00 11.33 H new ATOM 810 N ASN A 51 0.248 17.624 -10.708 1.00 51.31 N ATOM 811 CA ASN A 51 1.639 17.127 -10.799 1.00 12.55 C ATOM 812 C ASN A 51 1.865 15.967 -9.790 1.00 43.40 C ATOM 813 O ASN A 51 2.591 16.094 -8.793 1.00 14.12 O ATOM 814 CB ASN A 51 2.650 18.283 -10.574 1.00 0.24 C ATOM 815 CG ASN A 51 2.714 19.315 -11.698 1.00 12.42 C ATOM 816 OD1 ASN A 51 1.769 19.512 -12.449 1.00 54.42 O ATOM 817 ND2 ASN A 51 3.832 20.008 -11.813 1.00 35.43 N ATOM 0 H ASN A 51 0.151 18.480 -10.162 1.00 51.31 H new ATOM 0 HA ASN A 51 1.807 16.735 -11.802 1.00 12.55 H new ATOM 0 HB2 ASN A 51 2.393 18.794 -9.646 1.00 0.24 H new ATOM 0 HB3 ASN A 51 3.643 17.855 -10.438 1.00 0.24 H new ATOM 0 HD21 ASN A 51 3.918 20.721 -12.537 1.00 35.43 H new ATOM 0 HD22 ASN A 51 4.610 19.830 -11.178 1.00 35.43 H new ATOM 824 N LYS A 52 1.213 14.830 -10.082 1.00 3.33 N ATOM 825 CA LYS A 52 1.272 13.602 -9.260 1.00 1.11 C ATOM 826 C LYS A 52 2.641 12.905 -9.355 1.00 11.14 C ATOM 827 O LYS A 52 2.989 12.144 -8.468 1.00 72.45 O ATOM 828 CB LYS A 52 0.132 12.632 -9.686 1.00 13.02 C ATOM 829 CG LYS A 52 -1.269 13.052 -9.198 1.00 54.32 C ATOM 830 CD LYS A 52 -1.423 12.861 -7.675 1.00 34.02 C ATOM 831 CE LYS A 52 -2.778 13.333 -7.138 1.00 22.15 C ATOM 832 NZ LYS A 52 -2.869 14.807 -7.121 1.00 41.12 N ATOM 0 H LYS A 52 0.621 14.733 -10.907 1.00 3.33 H new ATOM 0 HA LYS A 52 1.135 13.889 -8.218 1.00 1.11 H new ATOM 0 HB2 LYS A 52 0.119 12.559 -10.773 1.00 13.02 H new ATOM 0 HB3 LYS A 52 0.355 11.636 -9.303 1.00 13.02 H new ATOM 0 HG2 LYS A 52 -1.445 14.097 -9.454 1.00 54.32 H new ATOM 0 HG3 LYS A 52 -2.026 12.465 -9.717 1.00 54.32 H new ATOM 0 HD2 LYS A 52 -1.292 11.806 -7.433 1.00 34.02 H new ATOM 0 HD3 LYS A 52 -0.628 13.406 -7.165 1.00 34.02 H new ATOM 0 HE2 LYS A 52 -3.578 12.925 -7.756 1.00 22.15 H new ATOM 0 HE3 LYS A 52 -2.926 12.946 -6.130 1.00 22.15 H new ATOM 0 HZ1 LYS A 52 -3.683 15.098 -6.543 1.00 41.12 H new ATOM 0 HZ2 LYS A 52 -1.997 15.204 -6.716 1.00 41.12 H new ATOM 0 HZ3 LYS A 52 -2.991 15.159 -8.092 1.00 41.12 H new ATOM 846 N GLU A 53 3.407 13.195 -10.421 1.00 10.23 N ATOM 847 CA GLU A 53 4.753 12.612 -10.652 1.00 51.24 C ATOM 848 C GLU A 53 5.711 12.870 -9.457 1.00 13.23 C ATOM 849 O GLU A 53 6.550 12.023 -9.129 1.00 25.22 O ATOM 850 CB GLU A 53 5.346 13.164 -11.977 1.00 64.20 C ATOM 851 CG GLU A 53 5.489 14.700 -12.024 1.00 40.21 C ATOM 852 CD GLU A 53 6.012 15.222 -13.371 1.00 41.22 C ATOM 853 OE1 GLU A 53 7.227 15.099 -13.637 1.00 10.24 O ATOM 854 OE2 GLU A 53 5.216 15.760 -14.170 1.00 43.52 O ATOM 0 H GLU A 53 3.115 13.842 -11.153 1.00 10.23 H new ATOM 0 HA GLU A 53 4.644 11.531 -10.737 1.00 51.24 H new ATOM 0 HB2 GLU A 53 6.327 12.716 -12.136 1.00 64.20 H new ATOM 0 HB3 GLU A 53 4.712 12.845 -12.804 1.00 64.20 H new ATOM 0 HG2 GLU A 53 4.520 15.154 -11.818 1.00 40.21 H new ATOM 0 HG3 GLU A 53 6.166 15.019 -11.231 1.00 40.21 H new ATOM 861 N TYR A 54 5.547 14.034 -8.792 1.00 2.00 N ATOM 862 CA TYR A 54 6.294 14.367 -7.566 1.00 53.40 C ATOM 863 C TYR A 54 5.835 13.466 -6.391 1.00 23.25 C ATOM 864 O TYR A 54 6.659 12.837 -5.734 1.00 11.43 O ATOM 865 CB TYR A 54 6.118 15.858 -7.187 1.00 72.14 C ATOM 866 CG TYR A 54 6.603 16.891 -8.216 1.00 11.32 C ATOM 867 CD1 TYR A 54 5.874 17.149 -9.373 1.00 41.23 C ATOM 868 CD2 TYR A 54 7.774 17.625 -8.015 1.00 31.40 C ATOM 869 CE1 TYR A 54 6.295 18.086 -10.288 1.00 11.12 C ATOM 870 CE2 TYR A 54 8.193 18.568 -8.929 1.00 40.32 C ATOM 871 CZ TYR A 54 7.445 18.793 -10.063 1.00 50.14 C ATOM 872 OH TYR A 54 7.850 19.727 -10.978 1.00 32.40 O ATOM 0 H TYR A 54 4.898 14.762 -9.089 1.00 2.00 H new ATOM 0 HA TYR A 54 7.351 14.187 -7.763 1.00 53.40 H new ATOM 0 HB2 TYR A 54 5.060 16.038 -6.996 1.00 72.14 H new ATOM 0 HB3 TYR A 54 6.646 16.036 -6.250 1.00 72.14 H new ATOM 0 HD1 TYR A 54 4.960 16.603 -9.556 1.00 41.23 H new ATOM 0 HD2 TYR A 54 8.363 17.450 -7.126 1.00 31.40 H new ATOM 0 HE1 TYR A 54 5.718 18.264 -11.184 1.00 11.12 H new ATOM 0 HE2 TYR A 54 9.101 19.126 -8.757 1.00 40.32 H new ATOM 0 HH TYR A 54 8.829 19.764 -10.996 1.00 32.40 H new ATOM 882 N LEU A 55 4.501 13.403 -6.169 1.00 44.41 N ATOM 883 CA LEU A 55 3.874 12.575 -5.101 1.00 45.52 C ATOM 884 C LEU A 55 4.318 11.096 -5.178 1.00 23.41 C ATOM 885 O LEU A 55 4.758 10.525 -4.187 1.00 34.43 O ATOM 886 CB LEU A 55 2.321 12.655 -5.195 1.00 73.20 C ATOM 887 CG LEU A 55 1.522 11.702 -4.239 1.00 21.43 C ATOM 888 CD1 LEU A 55 1.634 12.114 -2.753 1.00 63.04 C ATOM 889 CD2 LEU A 55 0.059 11.559 -4.683 1.00 33.45 C ATOM 0 H LEU A 55 3.824 13.925 -6.725 1.00 44.41 H new ATOM 0 HA LEU A 55 4.208 12.979 -4.145 1.00 45.52 H new ATOM 0 HB2 LEU A 55 2.017 13.681 -4.989 1.00 73.20 H new ATOM 0 HB3 LEU A 55 2.028 12.436 -6.222 1.00 73.20 H new ATOM 0 HG LEU A 55 1.988 10.720 -4.318 1.00 21.43 H new ATOM 0 HD11 LEU A 55 1.062 11.419 -2.139 1.00 63.04 H new ATOM 0 HD12 LEU A 55 2.680 12.092 -2.447 1.00 63.04 H new ATOM 0 HD13 LEU A 55 1.240 13.122 -2.624 1.00 63.04 H new ATOM 0 HD21 LEU A 55 -0.465 10.892 -3.999 1.00 33.45 H new ATOM 0 HD22 LEU A 55 -0.421 12.538 -4.675 1.00 33.45 H new ATOM 0 HD23 LEU A 55 0.023 11.146 -5.691 1.00 33.45 H new ATOM 901 N ILE A 56 4.197 10.512 -6.383 1.00 43.41 N ATOM 902 CA ILE A 56 4.562 9.110 -6.665 1.00 41.52 C ATOM 903 C ILE A 56 6.044 8.845 -6.322 1.00 34.54 C ATOM 904 O ILE A 56 6.353 7.809 -5.768 1.00 44.10 O ATOM 905 CB ILE A 56 4.271 8.733 -8.169 1.00 24.21 C ATOM 906 CG1 ILE A 56 2.763 8.983 -8.508 1.00 64.23 C ATOM 907 CG2 ILE A 56 4.671 7.262 -8.476 1.00 53.31 C ATOM 908 CD1 ILE A 56 2.420 8.899 -9.984 1.00 0.23 C ATOM 0 H ILE A 56 3.838 11.006 -7.200 1.00 43.41 H new ATOM 0 HA ILE A 56 3.942 8.477 -6.031 1.00 41.52 H new ATOM 0 HB ILE A 56 4.883 9.375 -8.802 1.00 24.21 H new ATOM 0 HG12 ILE A 56 2.158 8.255 -7.967 1.00 64.23 H new ATOM 0 HG13 ILE A 56 2.481 9.969 -8.139 1.00 64.23 H new ATOM 0 HG21 ILE A 56 4.457 7.037 -9.521 1.00 53.31 H new ATOM 0 HG22 ILE A 56 5.736 7.128 -8.287 1.00 53.31 H new ATOM 0 HG23 ILE A 56 4.101 6.589 -7.836 1.00 53.31 H new ATOM 0 HD11 ILE A 56 1.355 9.086 -10.121 1.00 0.23 H new ATOM 0 HD12 ILE A 56 2.993 9.646 -10.534 1.00 0.23 H new ATOM 0 HD13 ILE A 56 2.665 7.905 -10.359 1.00 0.23 H new ATOM 920 N THR A 57 6.930 9.821 -6.624 1.00 35.14 N ATOM 921 CA THR A 57 8.373 9.766 -6.256 1.00 4.03 C ATOM 922 C THR A 57 8.559 9.620 -4.725 1.00 41.15 C ATOM 923 O THR A 57 9.330 8.776 -4.260 1.00 24.33 O ATOM 924 CB THR A 57 9.130 11.042 -6.769 1.00 72.42 C ATOM 925 OG1 THR A 57 9.118 11.071 -8.204 1.00 54.43 O ATOM 926 CG2 THR A 57 10.582 11.133 -6.278 1.00 2.50 C ATOM 0 H THR A 57 6.671 10.669 -7.128 1.00 35.14 H new ATOM 0 HA THR A 57 8.799 8.886 -6.739 1.00 4.03 H new ATOM 0 HB THR A 57 8.598 11.899 -6.356 1.00 72.42 H new ATOM 0 HG1 THR A 57 8.247 11.392 -8.517 1.00 54.43 H new ATOM 0 HG21 THR A 57 11.043 12.039 -6.671 1.00 2.50 H new ATOM 0 HG22 THR A 57 10.597 11.162 -5.188 1.00 2.50 H new ATOM 0 HG23 THR A 57 11.139 10.263 -6.625 1.00 2.50 H new ATOM 934 N LEU A 58 7.822 10.435 -3.962 1.00 75.22 N ATOM 935 CA LEU A 58 7.826 10.380 -2.482 1.00 13.43 C ATOM 936 C LEU A 58 7.284 9.014 -1.961 1.00 43.44 C ATOM 937 O LEU A 58 7.836 8.448 -1.024 1.00 1.42 O ATOM 938 CB LEU A 58 7.006 11.573 -1.893 1.00 61.32 C ATOM 939 CG LEU A 58 7.741 12.957 -1.786 1.00 13.10 C ATOM 940 CD1 LEU A 58 8.887 12.906 -0.770 1.00 42.23 C ATOM 941 CD2 LEU A 58 8.231 13.492 -3.152 1.00 44.43 C ATOM 0 H LEU A 58 7.205 11.152 -4.344 1.00 75.22 H new ATOM 0 HA LEU A 58 8.858 10.469 -2.142 1.00 13.43 H new ATOM 0 HB2 LEU A 58 6.116 11.708 -2.507 1.00 61.32 H new ATOM 0 HB3 LEU A 58 6.666 11.292 -0.896 1.00 61.32 H new ATOM 0 HG LEU A 58 6.996 13.667 -1.426 1.00 13.10 H new ATOM 0 HD11 LEU A 58 9.374 13.880 -0.721 1.00 42.23 H new ATOM 0 HD12 LEU A 58 8.491 12.649 0.212 1.00 42.23 H new ATOM 0 HD13 LEU A 58 9.613 12.153 -1.077 1.00 42.23 H new ATOM 0 HD21 LEU A 58 8.730 14.451 -3.010 1.00 44.43 H new ATOM 0 HD22 LEU A 58 8.930 12.781 -3.592 1.00 44.43 H new ATOM 0 HD23 LEU A 58 7.379 13.622 -3.819 1.00 44.43 H new ATOM 953 N LEU A 59 6.232 8.492 -2.619 1.00 73.13 N ATOM 954 CA LEU A 59 5.538 7.237 -2.218 1.00 41.23 C ATOM 955 C LEU A 59 6.372 5.961 -2.510 1.00 44.50 C ATOM 956 O LEU A 59 6.531 5.106 -1.632 1.00 35.35 O ATOM 957 CB LEU A 59 4.164 7.151 -2.931 1.00 1.21 C ATOM 958 CG LEU A 59 3.115 8.232 -2.537 1.00 14.12 C ATOM 959 CD1 LEU A 59 1.888 8.182 -3.471 1.00 12.30 C ATOM 960 CD2 LEU A 59 2.704 8.091 -1.049 1.00 35.22 C ATOM 0 H LEU A 59 5.831 8.926 -3.450 1.00 73.13 H new ATOM 0 HA LEU A 59 5.400 7.278 -1.138 1.00 41.23 H new ATOM 0 HB2 LEU A 59 4.332 7.213 -4.006 1.00 1.21 H new ATOM 0 HB3 LEU A 59 3.735 6.169 -2.731 1.00 1.21 H new ATOM 0 HG LEU A 59 3.578 9.211 -2.659 1.00 14.12 H new ATOM 0 HD11 LEU A 59 1.172 8.948 -3.172 1.00 12.30 H new ATOM 0 HD12 LEU A 59 2.205 8.362 -4.498 1.00 12.30 H new ATOM 0 HD13 LEU A 59 1.419 7.200 -3.403 1.00 12.30 H new ATOM 0 HD21 LEU A 59 1.971 8.858 -0.800 1.00 35.22 H new ATOM 0 HD22 LEU A 59 2.269 7.105 -0.884 1.00 35.22 H new ATOM 0 HD23 LEU A 59 3.583 8.210 -0.416 1.00 35.22 H new ATOM 972 N GLU A 60 6.887 5.833 -3.747 1.00 24.23 N ATOM 973 CA GLU A 60 7.688 4.657 -4.176 1.00 24.34 C ATOM 974 C GLU A 60 9.008 4.535 -3.381 1.00 21.13 C ATOM 975 O GLU A 60 9.504 3.437 -3.166 1.00 43.43 O ATOM 976 CB GLU A 60 7.971 4.698 -5.707 1.00 23.44 C ATOM 977 CG GLU A 60 8.759 5.920 -6.198 1.00 75.01 C ATOM 978 CD GLU A 60 8.972 5.944 -7.719 1.00 74.22 C ATOM 979 OE1 GLU A 60 8.019 6.272 -8.464 1.00 41.12 O ATOM 980 OE2 GLU A 60 10.093 5.633 -8.180 1.00 54.51 O ATOM 0 H GLU A 60 6.764 6.534 -4.478 1.00 24.23 H new ATOM 0 HA GLU A 60 7.092 3.770 -3.960 1.00 24.34 H new ATOM 0 HB2 GLU A 60 8.521 3.798 -5.982 1.00 23.44 H new ATOM 0 HB3 GLU A 60 7.019 4.664 -6.236 1.00 23.44 H new ATOM 0 HG2 GLU A 60 8.232 6.826 -5.899 1.00 75.01 H new ATOM 0 HG3 GLU A 60 9.730 5.938 -5.703 1.00 75.01 H new ATOM 987 N HIS A 61 9.574 5.679 -2.964 1.00 71.33 N ATOM 988 CA HIS A 61 10.776 5.715 -2.099 1.00 23.44 C ATOM 989 C HIS A 61 10.423 5.621 -0.588 1.00 14.54 C ATOM 990 O HIS A 61 11.286 5.289 0.228 1.00 70.21 O ATOM 991 CB HIS A 61 11.607 6.969 -2.413 1.00 33.13 C ATOM 992 CG HIS A 61 12.243 6.944 -3.787 1.00 15.05 C ATOM 993 ND1 HIS A 61 11.556 7.238 -4.945 1.00 13.21 N ATOM 994 CD2 HIS A 61 13.505 6.659 -4.182 1.00 64.14 C ATOM 995 CE1 HIS A 61 12.358 7.135 -5.978 1.00 52.14 C ATOM 996 NE2 HIS A 61 13.545 6.786 -5.544 1.00 52.42 N ATOM 0 H HIS A 61 9.218 6.602 -3.212 1.00 71.33 H new ATOM 0 HA HIS A 61 11.377 4.833 -2.321 1.00 23.44 H new ATOM 0 HB2 HIS A 61 10.968 7.848 -2.333 1.00 33.13 H new ATOM 0 HB3 HIS A 61 12.389 7.074 -1.661 1.00 33.13 H new ATOM 0 HD1 HIS A 61 10.571 7.497 -4.992 1.00 13.21 H new ATOM 0 HD2 HIS A 61 14.329 6.382 -3.541 1.00 64.14 H new ATOM 0 HE1 HIS A 61 12.087 7.308 -7.009 1.00 52.14 H new ATOM 1005 N LEU A 62 9.155 5.924 -0.231 1.00 35.51 N ATOM 1006 CA LEU A 62 8.622 5.757 1.152 1.00 43.32 C ATOM 1007 C LEU A 62 8.621 4.270 1.560 1.00 34.31 C ATOM 1008 O LEU A 62 9.098 3.903 2.642 1.00 2.00 O ATOM 1009 CB LEU A 62 7.183 6.352 1.234 1.00 10.41 C ATOM 1010 CG LEU A 62 6.413 6.210 2.586 1.00 61.41 C ATOM 1011 CD1 LEU A 62 7.167 6.886 3.741 1.00 21.01 C ATOM 1012 CD2 LEU A 62 4.978 6.761 2.460 1.00 31.13 C ATOM 0 H LEU A 62 8.467 6.292 -0.889 1.00 35.51 H new ATOM 0 HA LEU A 62 9.267 6.294 1.847 1.00 43.32 H new ATOM 0 HB2 LEU A 62 7.245 7.413 0.994 1.00 10.41 H new ATOM 0 HB3 LEU A 62 6.582 5.883 0.455 1.00 10.41 H new ATOM 0 HG LEU A 62 6.349 5.147 2.819 1.00 61.41 H new ATOM 0 HD11 LEU A 62 6.601 6.766 4.665 1.00 21.01 H new ATOM 0 HD12 LEU A 62 8.148 6.425 3.854 1.00 21.01 H new ATOM 0 HD13 LEU A 62 7.288 7.947 3.525 1.00 21.01 H new ATOM 0 HD21 LEU A 62 4.461 6.651 3.413 1.00 31.13 H new ATOM 0 HD22 LEU A 62 5.016 7.816 2.187 1.00 31.13 H new ATOM 0 HD23 LEU A 62 4.441 6.206 1.691 1.00 31.13 H new ATOM 1024 N MET A 63 8.103 3.417 0.657 1.00 61.52 N ATOM 1025 CA MET A 63 8.061 1.955 0.869 1.00 31.41 C ATOM 1026 C MET A 63 9.476 1.339 0.869 1.00 51.21 C ATOM 1027 O MET A 63 9.669 0.287 1.437 1.00 53.33 O ATOM 1028 CB MET A 63 7.149 1.265 -0.180 1.00 2.25 C ATOM 1029 CG MET A 63 7.642 1.366 -1.632 1.00 34.35 C ATOM 1030 SD MET A 63 6.361 0.980 -2.840 1.00 4.44 S ATOM 1031 CE MET A 63 5.166 2.269 -2.484 1.00 30.20 C ATOM 0 H MET A 63 7.705 3.716 -0.233 1.00 61.52 H new ATOM 0 HA MET A 63 7.631 1.780 1.855 1.00 31.41 H new ATOM 0 HB2 MET A 63 7.050 0.212 0.082 1.00 2.25 H new ATOM 0 HB3 MET A 63 6.153 1.703 -0.118 1.00 2.25 H new ATOM 0 HG2 MET A 63 8.013 2.374 -1.814 1.00 34.35 H new ATOM 0 HG3 MET A 63 8.483 0.686 -1.772 1.00 34.35 H new ATOM 0 HE1 MET A 63 4.242 1.818 -2.122 1.00 30.20 H new ATOM 0 HE2 MET A 63 5.567 2.937 -1.722 1.00 30.20 H new ATOM 0 HE3 MET A 63 4.961 2.836 -3.392 1.00 30.20 H new ATOM 1041 N LYS A 64 10.444 2.009 0.207 1.00 30.54 N ATOM 1042 CA LYS A 64 11.873 1.616 0.235 1.00 42.00 C ATOM 1043 C LYS A 64 12.543 1.949 1.595 1.00 25.21 C ATOM 1044 O LYS A 64 13.187 1.086 2.195 1.00 3.32 O ATOM 1045 CB LYS A 64 12.644 2.310 -0.923 1.00 53.42 C ATOM 1046 CG LYS A 64 12.136 2.014 -2.362 1.00 24.32 C ATOM 1047 CD LYS A 64 12.545 0.626 -2.941 1.00 33.11 C ATOM 1048 CE LYS A 64 11.697 -0.557 -2.435 1.00 30.10 C ATOM 1049 NZ LYS A 64 12.057 -1.837 -3.116 1.00 3.55 N ATOM 0 H LYS A 64 10.259 2.836 -0.361 1.00 30.54 H new ATOM 0 HA LYS A 64 11.916 0.535 0.104 1.00 42.00 H new ATOM 0 HB2 LYS A 64 12.607 3.387 -0.762 1.00 53.42 H new ATOM 0 HB3 LYS A 64 13.691 2.015 -0.862 1.00 53.42 H new ATOM 0 HG2 LYS A 64 11.048 2.085 -2.367 1.00 24.32 H new ATOM 0 HG3 LYS A 64 12.509 2.791 -3.028 1.00 24.32 H new ATOM 0 HD2 LYS A 64 12.476 0.666 -4.028 1.00 33.11 H new ATOM 0 HD3 LYS A 64 13.590 0.438 -2.695 1.00 33.11 H new ATOM 0 HE2 LYS A 64 11.835 -0.668 -1.359 1.00 30.10 H new ATOM 0 HE3 LYS A 64 10.641 -0.343 -2.601 1.00 30.10 H new ATOM 0 HZ1 LYS A 64 11.367 -2.572 -2.861 1.00 3.55 H new ATOM 0 HZ2 LYS A 64 12.048 -1.696 -4.146 1.00 3.55 H new ATOM 0 HZ3 LYS A 64 13.007 -2.135 -2.815 1.00 3.55 H new ATOM 1063 N GLU A 65 12.375 3.199 2.078 1.00 23.10 N ATOM 1064 CA GLU A 65 13.013 3.669 3.339 1.00 64.21 C ATOM 1065 C GLU A 65 12.487 2.898 4.571 1.00 74.23 C ATOM 1066 O GLU A 65 13.248 2.572 5.477 1.00 23.04 O ATOM 1067 CB GLU A 65 12.791 5.197 3.534 1.00 54.21 C ATOM 1068 CG GLU A 65 13.424 5.809 4.815 1.00 14.30 C ATOM 1069 CD GLU A 65 14.964 5.677 4.885 1.00 12.42 C ATOM 1070 OE1 GLU A 65 15.670 6.451 4.202 1.00 54.32 O ATOM 1071 OE2 GLU A 65 15.483 4.802 5.618 1.00 31.12 O ATOM 0 H GLU A 65 11.803 3.906 1.617 1.00 23.10 H new ATOM 0 HA GLU A 65 14.082 3.473 3.250 1.00 64.21 H new ATOM 0 HB2 GLU A 65 13.195 5.718 2.666 1.00 54.21 H new ATOM 0 HB3 GLU A 65 11.719 5.391 3.552 1.00 54.21 H new ATOM 0 HG2 GLU A 65 13.158 6.865 4.870 1.00 14.30 H new ATOM 0 HG3 GLU A 65 12.989 5.325 5.689 1.00 14.30 H new ATOM 1078 N PHE A 66 11.174 2.615 4.591 1.00 52.41 N ATOM 1079 CA PHE A 66 10.506 1.927 5.727 1.00 60.14 C ATOM 1080 C PHE A 66 10.275 0.426 5.471 1.00 0.11 C ATOM 1081 O PHE A 66 9.595 -0.244 6.258 1.00 75.13 O ATOM 1082 CB PHE A 66 9.197 2.665 6.072 1.00 42.12 C ATOM 1083 CG PHE A 66 9.464 4.090 6.534 1.00 40.10 C ATOM 1084 CD1 PHE A 66 9.572 5.127 5.617 1.00 34.43 C ATOM 1085 CD2 PHE A 66 9.668 4.377 7.878 1.00 11.43 C ATOM 1086 CE1 PHE A 66 9.871 6.403 6.024 1.00 72.40 C ATOM 1087 CE2 PHE A 66 9.958 5.660 8.285 1.00 12.44 C ATOM 1088 CZ PHE A 66 10.063 6.671 7.356 1.00 11.35 C ATOM 0 H PHE A 66 10.541 2.852 3.827 1.00 52.41 H new ATOM 0 HA PHE A 66 11.175 1.967 6.587 1.00 60.14 H new ATOM 0 HB2 PHE A 66 8.546 2.681 5.198 1.00 42.12 H new ATOM 0 HB3 PHE A 66 8.667 2.121 6.854 1.00 42.12 H new ATOM 0 HD1 PHE A 66 9.418 4.926 4.567 1.00 34.43 H new ATOM 0 HD2 PHE A 66 9.598 3.586 8.610 1.00 11.43 H new ATOM 0 HE1 PHE A 66 9.955 7.196 5.296 1.00 72.40 H new ATOM 0 HE2 PHE A 66 10.103 5.874 9.334 1.00 12.44 H new ATOM 0 HZ PHE A 66 10.297 7.676 7.676 1.00 11.35 H new ATOM 1098 N LEU A 67 10.846 -0.077 4.363 1.00 25.42 N ATOM 1099 CA LEU A 67 10.826 -1.509 4.002 1.00 22.43 C ATOM 1100 C LEU A 67 11.449 -2.415 5.091 1.00 44.44 C ATOM 1101 O LEU A 67 10.759 -3.256 5.689 1.00 0.12 O ATOM 1102 CB LEU A 67 11.584 -1.703 2.652 1.00 52.34 C ATOM 1103 CG LEU A 67 11.192 -2.953 1.816 1.00 13.12 C ATOM 1104 CD1 LEU A 67 9.665 -2.990 1.556 1.00 43.13 C ATOM 1105 CD2 LEU A 67 11.997 -3.009 0.495 1.00 73.14 C ATOM 0 H LEU A 67 11.340 0.503 3.685 1.00 25.42 H new ATOM 0 HA LEU A 67 9.783 -1.810 3.906 1.00 22.43 H new ATOM 0 HB2 LEU A 67 11.423 -0.817 2.038 1.00 52.34 H new ATOM 0 HB3 LEU A 67 12.652 -1.754 2.864 1.00 52.34 H new ATOM 0 HG LEU A 67 11.447 -3.842 2.393 1.00 13.12 H new ATOM 0 HD11 LEU A 67 9.417 -3.874 0.969 1.00 43.13 H new ATOM 0 HD12 LEU A 67 9.135 -3.026 2.508 1.00 43.13 H new ATOM 0 HD13 LEU A 67 9.367 -2.096 1.008 1.00 43.13 H new ATOM 0 HD21 LEU A 67 11.705 -3.893 -0.072 1.00 73.14 H new ATOM 0 HD22 LEU A 67 11.792 -2.115 -0.094 1.00 73.14 H new ATOM 0 HD23 LEU A 67 13.062 -3.058 0.720 1.00 73.14 H new ATOM 1117 N ASP A 68 12.753 -2.216 5.360 1.00 34.35 N ATOM 1118 CA ASP A 68 13.528 -3.049 6.308 1.00 23.31 C ATOM 1119 C ASP A 68 13.495 -2.445 7.727 1.00 62.52 C ATOM 1120 O ASP A 68 14.119 -2.977 8.656 1.00 75.25 O ATOM 1121 CB ASP A 68 14.985 -3.221 5.804 1.00 24.43 C ATOM 1122 CG ASP A 68 15.045 -3.906 4.432 1.00 0.21 C ATOM 1123 OD1 ASP A 68 14.844 -3.219 3.409 1.00 51.13 O ATOM 1124 OD2 ASP A 68 15.258 -5.137 4.365 1.00 41.43 O ATOM 0 H ASP A 68 13.302 -1.473 4.927 1.00 34.35 H new ATOM 0 HA ASP A 68 13.067 -4.035 6.361 1.00 23.31 H new ATOM 0 HB2 ASP A 68 15.464 -2.244 5.742 1.00 24.43 H new ATOM 0 HB3 ASP A 68 15.551 -3.808 6.527 1.00 24.43 H new ATOM 1129 N LYS A 69 12.781 -1.310 7.880 1.00 55.53 N ATOM 1130 CA LYS A 69 12.292 -0.859 9.189 1.00 53.42 C ATOM 1131 C LYS A 69 11.144 -1.814 9.594 1.00 52.24 C ATOM 1132 O LYS A 69 9.968 -1.553 9.318 1.00 65.44 O ATOM 1133 CB LYS A 69 11.781 0.605 9.138 1.00 55.11 C ATOM 1134 CG LYS A 69 12.726 1.628 8.495 1.00 53.04 C ATOM 1135 CD LYS A 69 14.076 1.794 9.212 1.00 43.21 C ATOM 1136 CE LYS A 69 14.875 2.976 8.631 1.00 12.22 C ATOM 1137 NZ LYS A 69 16.197 3.136 9.284 1.00 64.12 N ATOM 0 H LYS A 69 12.533 -0.692 7.108 1.00 55.53 H new ATOM 0 HA LYS A 69 13.103 -0.880 9.917 1.00 53.42 H new ATOM 0 HB2 LYS A 69 10.837 0.620 8.593 1.00 55.11 H new ATOM 0 HB3 LYS A 69 11.566 0.929 10.156 1.00 55.11 H new ATOM 0 HG2 LYS A 69 12.912 1.332 7.463 1.00 53.04 H new ATOM 0 HG3 LYS A 69 12.225 2.596 8.464 1.00 53.04 H new ATOM 0 HD2 LYS A 69 13.908 1.954 10.277 1.00 43.21 H new ATOM 0 HD3 LYS A 69 14.657 0.877 9.116 1.00 43.21 H new ATOM 0 HE2 LYS A 69 15.017 2.825 7.561 1.00 12.22 H new ATOM 0 HE3 LYS A 69 14.300 3.894 8.750 1.00 12.22 H new ATOM 0 HZ1 LYS A 69 16.698 3.943 8.860 1.00 64.12 H new ATOM 0 HZ2 LYS A 69 16.063 3.307 10.301 1.00 64.12 H new ATOM 0 HZ3 LYS A 69 16.758 2.271 9.149 1.00 64.12 H new ATOM 1151 N LYS A 70 11.517 -2.956 10.194 1.00 71.40 N ATOM 1152 CA LYS A 70 10.604 -4.103 10.400 1.00 34.03 C ATOM 1153 C LYS A 70 9.474 -3.824 11.416 1.00 34.13 C ATOM 1154 O LYS A 70 8.498 -4.572 11.472 1.00 10.20 O ATOM 1155 CB LYS A 70 11.415 -5.354 10.809 1.00 51.21 C ATOM 1156 CG LYS A 70 12.429 -5.829 9.739 1.00 5.21 C ATOM 1157 CD LYS A 70 13.146 -7.144 10.133 1.00 11.23 C ATOM 1158 CE LYS A 70 13.969 -7.011 11.428 1.00 73.44 C ATOM 1159 NZ LYS A 70 14.566 -8.310 11.844 1.00 45.32 N ATOM 0 H LYS A 70 12.459 -3.115 10.552 1.00 71.40 H new ATOM 0 HA LYS A 70 10.105 -4.281 9.447 1.00 34.03 H new ATOM 0 HB2 LYS A 70 11.952 -5.139 11.733 1.00 51.21 H new ATOM 0 HB3 LYS A 70 10.723 -6.168 11.025 1.00 51.21 H new ATOM 0 HG2 LYS A 70 11.910 -5.974 8.792 1.00 5.21 H new ATOM 0 HG3 LYS A 70 13.173 -5.049 9.579 1.00 5.21 H new ATOM 0 HD2 LYS A 70 12.405 -7.933 10.259 1.00 11.23 H new ATOM 0 HD3 LYS A 70 13.804 -7.451 9.320 1.00 11.23 H new ATOM 0 HE2 LYS A 70 14.762 -6.278 11.280 1.00 73.44 H new ATOM 0 HE3 LYS A 70 13.330 -6.633 12.226 1.00 73.44 H new ATOM 0 HZ1 LYS A 70 15.112 -8.177 12.719 1.00 45.32 H new ATOM 0 HZ2 LYS A 70 13.808 -9.003 12.010 1.00 45.32 H new ATOM 0 HZ3 LYS A 70 15.196 -8.659 11.093 1.00 45.32 H new ATOM 1173 N LYS A 71 9.610 -2.745 12.203 1.00 23.21 N ATOM 1174 CA LYS A 71 8.564 -2.313 13.154 1.00 40.32 C ATOM 1175 C LYS A 71 7.454 -1.479 12.451 1.00 73.32 C ATOM 1176 O LYS A 71 6.400 -1.236 13.040 1.00 51.22 O ATOM 1177 CB LYS A 71 9.204 -1.523 14.324 1.00 42.42 C ATOM 1178 CG LYS A 71 9.795 -0.152 13.941 1.00 63.22 C ATOM 1179 CD LYS A 71 10.567 0.513 15.106 1.00 54.24 C ATOM 1180 CE LYS A 71 10.907 1.984 14.827 1.00 14.11 C ATOM 1181 NZ LYS A 71 9.684 2.819 14.761 1.00 34.44 N ATOM 0 H LYS A 71 10.438 -2.150 12.202 1.00 23.21 H new ATOM 0 HA LYS A 71 8.082 -3.204 13.556 1.00 40.32 H new ATOM 0 HB2 LYS A 71 8.450 -1.373 15.096 1.00 42.42 H new ATOM 0 HB3 LYS A 71 9.994 -2.132 14.764 1.00 42.42 H new ATOM 0 HG2 LYS A 71 10.465 -0.275 13.090 1.00 63.22 H new ATOM 0 HG3 LYS A 71 8.990 0.509 13.620 1.00 63.22 H new ATOM 0 HD2 LYS A 71 9.970 0.448 16.016 1.00 54.24 H new ATOM 0 HD3 LYS A 71 11.488 -0.040 15.289 1.00 54.24 H new ATOM 0 HE2 LYS A 71 11.565 2.362 15.609 1.00 14.11 H new ATOM 0 HE3 LYS A 71 11.453 2.061 13.887 1.00 14.11 H new ATOM 0 HZ1 LYS A 71 9.825 3.686 15.318 1.00 34.44 H new ATOM 0 HZ2 LYS A 71 9.489 3.071 13.771 1.00 34.44 H new ATOM 0 HZ3 LYS A 71 8.879 2.286 15.148 1.00 34.44 H new ATOM 1195 N TYR A 72 7.715 -1.027 11.205 1.00 22.42 N ATOM 1196 CA TYR A 72 6.712 -0.325 10.349 1.00 63.01 C ATOM 1197 C TYR A 72 5.956 -1.286 9.399 1.00 14.14 C ATOM 1198 O TYR A 72 5.136 -0.817 8.599 1.00 54.42 O ATOM 1199 CB TYR A 72 7.393 0.776 9.486 1.00 35.41 C ATOM 1200 CG TYR A 72 7.869 2.013 10.262 1.00 40.30 C ATOM 1201 CD1 TYR A 72 9.133 2.057 10.847 1.00 51.01 C ATOM 1202 CD2 TYR A 72 7.055 3.144 10.390 1.00 3.22 C ATOM 1203 CE1 TYR A 72 9.572 3.176 11.524 1.00 25.42 C ATOM 1204 CE2 TYR A 72 7.496 4.264 11.065 1.00 40.40 C ATOM 1205 CZ TYR A 72 8.753 4.275 11.628 1.00 23.24 C ATOM 1206 OH TYR A 72 9.193 5.394 12.293 1.00 61.15 O ATOM 0 H TYR A 72 8.625 -1.135 10.757 1.00 22.42 H new ATOM 0 HA TYR A 72 5.993 0.118 11.038 1.00 63.01 H new ATOM 0 HB2 TYR A 72 8.249 0.336 8.974 1.00 35.41 H new ATOM 0 HB3 TYR A 72 6.692 1.097 8.716 1.00 35.41 H new ATOM 0 HD1 TYR A 72 9.782 1.197 10.769 1.00 51.01 H new ATOM 0 HD2 TYR A 72 6.067 3.140 9.954 1.00 3.22 H new ATOM 0 HE1 TYR A 72 10.555 3.188 11.971 1.00 25.42 H new ATOM 0 HE2 TYR A 72 6.857 5.130 11.152 1.00 40.40 H new ATOM 0 HH TYR A 72 8.445 5.802 12.778 1.00 61.15 H new ATOM 1216 N HIS A 73 6.238 -2.611 9.485 1.00 53.43 N ATOM 1217 CA HIS A 73 5.611 -3.649 8.612 1.00 22.14 C ATOM 1218 C HIS A 73 4.085 -3.478 8.452 1.00 35.25 C ATOM 1219 O HIS A 73 3.582 -3.467 7.348 1.00 61.12 O ATOM 1220 CB HIS A 73 5.896 -5.084 9.140 1.00 33.34 C ATOM 1221 CG HIS A 73 7.237 -5.663 8.780 1.00 72.14 C ATOM 1222 ND1 HIS A 73 7.731 -6.809 9.364 1.00 2.42 N ATOM 1223 CD2 HIS A 73 8.158 -5.294 7.859 1.00 12.22 C ATOM 1224 CE1 HIS A 73 8.879 -7.119 8.820 1.00 42.02 C ATOM 1225 NE2 HIS A 73 9.165 -6.217 7.906 1.00 54.52 N ATOM 0 H HIS A 73 6.903 -2.994 10.157 1.00 53.43 H new ATOM 0 HA HIS A 73 6.071 -3.509 7.634 1.00 22.14 H new ATOM 0 HB2 HIS A 73 5.806 -5.075 10.226 1.00 33.34 H new ATOM 0 HB3 HIS A 73 5.121 -5.750 8.761 1.00 33.34 H new ATOM 0 HD2 HIS A 73 8.107 -4.433 7.210 1.00 12.22 H new ATOM 0 HE1 HIS A 73 9.490 -7.972 9.078 1.00 42.02 H new ATOM 0 HE2 HIS A 73 10.004 -6.208 7.326 1.00 54.52 H new ATOM 1234 N ASN A 74 3.379 -3.296 9.565 1.00 24.44 N ATOM 1235 CA ASN A 74 1.893 -3.361 9.606 1.00 60.51 C ATOM 1236 C ASN A 74 1.272 -1.991 9.944 1.00 2.22 C ATOM 1237 O ASN A 74 0.087 -1.914 10.274 1.00 52.01 O ATOM 1238 CB ASN A 74 1.475 -4.434 10.639 1.00 33.11 C ATOM 1239 CG ASN A 74 2.078 -5.815 10.339 1.00 61.13 C ATOM 1240 OD1 ASN A 74 2.152 -6.196 9.070 1.00 14.32 O flip ATOM 1241 ND2 ASN A 74 2.441 -6.555 11.239 1.00 13.45 N flip ATOM 0 H ASN A 74 3.806 -3.099 10.470 1.00 24.44 H new ATOM 0 HA ASN A 74 1.519 -3.635 8.619 1.00 60.51 H new ATOM 0 HB2 ASN A 74 1.786 -4.115 11.634 1.00 33.11 H new ATOM 0 HB3 ASN A 74 0.388 -4.513 10.655 1.00 33.11 H new ATOM 0 HD21 ASN A 74 2.378 -6.247 12.209 1.00 13.45 H new ATOM 0 HD22 ASN A 74 2.808 -7.481 11.021 1.00 13.45 H new ATOM 1248 N ASP A 75 2.081 -0.917 9.826 1.00 5.54 N ATOM 1249 CA ASP A 75 1.652 0.458 10.162 1.00 42.12 C ATOM 1250 C ASP A 75 0.469 0.886 9.250 1.00 65.25 C ATOM 1251 O ASP A 75 0.651 1.008 8.041 1.00 75.23 O ATOM 1252 CB ASP A 75 2.850 1.435 10.009 1.00 15.02 C ATOM 1253 CG ASP A 75 2.565 2.842 10.568 1.00 11.02 C ATOM 1254 OD1 ASP A 75 1.866 3.648 9.912 1.00 74.01 O ATOM 1255 OD2 ASP A 75 3.023 3.143 11.683 1.00 50.24 O ATOM 0 H ASP A 75 3.045 -0.977 9.497 1.00 5.54 H new ATOM 0 HA ASP A 75 1.312 0.487 11.197 1.00 42.12 H new ATOM 0 HB2 ASP A 75 3.718 1.018 10.520 1.00 15.02 H new ATOM 0 HB3 ASP A 75 3.110 1.517 8.954 1.00 15.02 H new ATOM 1260 N PRO A 76 -0.757 1.139 9.815 1.00 41.51 N ATOM 1261 CA PRO A 76 -1.984 1.396 8.997 1.00 61.23 C ATOM 1262 C PRO A 76 -1.846 2.612 8.045 1.00 71.03 C ATOM 1263 O PRO A 76 -2.421 2.617 6.957 1.00 13.15 O ATOM 1264 CB PRO A 76 -3.086 1.630 10.066 1.00 34.32 C ATOM 1265 CG PRO A 76 -2.342 2.006 11.314 1.00 44.41 C ATOM 1266 CD PRO A 76 -1.051 1.219 11.273 1.00 72.51 C ATOM 0 HA PRO A 76 -2.200 0.567 8.323 1.00 61.23 H new ATOM 0 HB2 PRO A 76 -3.770 2.422 9.761 1.00 34.32 H new ATOM 0 HB3 PRO A 76 -3.685 0.732 10.219 1.00 34.32 H new ATOM 0 HG2 PRO A 76 -2.146 3.078 11.345 1.00 44.41 H new ATOM 0 HG3 PRO A 76 -2.922 1.762 12.204 1.00 44.41 H new ATOM 0 HD2 PRO A 76 -0.253 1.723 11.819 1.00 72.51 H new ATOM 0 HD3 PRO A 76 -1.166 0.230 11.717 1.00 72.51 H new ATOM 1274 N ARG A 77 -1.055 3.616 8.468 1.00 63.12 N ATOM 1275 CA ARG A 77 -0.786 4.839 7.678 1.00 52.40 C ATOM 1276 C ARG A 77 0.195 4.546 6.525 1.00 33.11 C ATOM 1277 O ARG A 77 -0.082 4.891 5.379 1.00 11.45 O ATOM 1278 CB ARG A 77 -0.215 5.938 8.599 1.00 22.50 C ATOM 1279 CG ARG A 77 -1.148 6.324 9.768 1.00 13.42 C ATOM 1280 CD ARG A 77 -0.393 7.085 10.861 1.00 41.42 C ATOM 1281 NE ARG A 77 0.683 6.247 11.409 1.00 12.33 N ATOM 1282 CZ ARG A 77 1.659 6.659 12.170 1.00 41.14 C ATOM 1283 NH1 ARG A 77 1.829 7.913 12.443 1.00 10.53 N ATOM 1284 NH2 ARG A 77 2.496 5.804 12.622 1.00 43.44 N ATOM 0 H ARG A 77 -0.581 3.604 9.371 1.00 63.12 H new ATOM 0 HA ARG A 77 -1.724 5.185 7.243 1.00 52.40 H new ATOM 0 HB2 ARG A 77 0.738 5.599 9.005 1.00 22.50 H new ATOM 0 HB3 ARG A 77 -0.009 6.827 8.003 1.00 22.50 H new ATOM 0 HG2 ARG A 77 -1.966 6.939 9.394 1.00 13.42 H new ATOM 0 HG3 ARG A 77 -1.594 5.424 10.192 1.00 13.42 H new ATOM 0 HD2 ARG A 77 0.025 8.005 10.452 1.00 41.42 H new ATOM 0 HD3 ARG A 77 -1.081 7.373 11.656 1.00 41.42 H new ATOM 0 HE ARG A 77 0.665 5.255 11.173 1.00 12.33 H new ATOM 0 HH11 ARG A 77 1.190 8.610 12.060 1.00 10.53 H new ATOM 0 HH12 ARG A 77 2.602 8.204 13.041 1.00 10.53 H new ATOM 0 HH21 ARG A 77 2.394 4.817 12.386 1.00 43.44 H new ATOM 0 HH22 ARG A 77 3.265 6.109 13.218 1.00 43.44 H new ATOM 1298 N PHE A 78 1.336 3.906 6.853 1.00 10.21 N ATOM 1299 CA PHE A 78 2.360 3.481 5.863 1.00 3.31 C ATOM 1300 C PHE A 78 1.749 2.587 4.745 1.00 64.14 C ATOM 1301 O PHE A 78 2.022 2.791 3.554 1.00 23.24 O ATOM 1302 CB PHE A 78 3.516 2.747 6.603 1.00 25.33 C ATOM 1303 CG PHE A 78 4.595 2.138 5.705 1.00 33.33 C ATOM 1304 CD1 PHE A 78 5.265 2.920 4.764 1.00 51.32 C ATOM 1305 CD2 PHE A 78 4.928 0.782 5.790 1.00 61.05 C ATOM 1306 CE1 PHE A 78 6.230 2.370 3.948 1.00 74.04 C ATOM 1307 CE2 PHE A 78 5.899 0.238 4.973 1.00 55.14 C ATOM 1308 CZ PHE A 78 6.545 1.028 4.051 1.00 53.34 C ATOM 0 H PHE A 78 1.579 3.666 7.814 1.00 10.21 H new ATOM 0 HA PHE A 78 2.756 4.368 5.369 1.00 3.31 H new ATOM 0 HB2 PHE A 78 3.992 3.452 7.285 1.00 25.33 H new ATOM 0 HB3 PHE A 78 3.086 1.953 7.213 1.00 25.33 H new ATOM 0 HD1 PHE A 78 5.025 3.969 4.674 1.00 51.32 H new ATOM 0 HD2 PHE A 78 4.419 0.152 6.504 1.00 61.05 H new ATOM 0 HE1 PHE A 78 6.742 2.989 3.226 1.00 74.04 H new ATOM 0 HE2 PHE A 78 6.151 -0.809 5.058 1.00 55.14 H new ATOM 0 HZ PHE A 78 7.299 0.600 3.407 1.00 53.34 H new ATOM 1318 N ILE A 79 0.907 1.616 5.152 1.00 11.51 N ATOM 1319 CA ILE A 79 0.139 0.758 4.216 1.00 13.42 C ATOM 1320 C ILE A 79 -0.904 1.601 3.449 1.00 41.33 C ATOM 1321 O ILE A 79 -1.096 1.389 2.261 1.00 40.13 O ATOM 1322 CB ILE A 79 -0.544 -0.484 4.947 1.00 1.21 C ATOM 1323 CG1 ILE A 79 0.500 -1.623 5.224 1.00 23.34 C ATOM 1324 CG2 ILE A 79 -1.766 -1.063 4.157 1.00 22.30 C ATOM 1325 CD1 ILE A 79 1.664 -1.264 6.135 1.00 42.43 C ATOM 0 H ILE A 79 0.738 1.402 6.135 1.00 11.51 H new ATOM 0 HA ILE A 79 0.847 0.341 3.500 1.00 13.42 H new ATOM 0 HB ILE A 79 -0.922 -0.102 5.896 1.00 1.21 H new ATOM 0 HG12 ILE A 79 -0.027 -2.471 5.661 1.00 23.34 H new ATOM 0 HG13 ILE A 79 0.904 -1.957 4.268 1.00 23.34 H new ATOM 0 HG21 ILE A 79 -2.187 -1.906 4.705 1.00 22.30 H new ATOM 0 HG22 ILE A 79 -2.525 -0.289 4.042 1.00 22.30 H new ATOM 0 HG23 ILE A 79 -1.437 -1.398 3.173 1.00 22.30 H new ATOM 0 HD11 ILE A 79 2.316 -2.130 6.251 1.00 42.43 H new ATOM 0 HD12 ILE A 79 2.228 -0.441 5.697 1.00 42.43 H new ATOM 0 HD13 ILE A 79 1.283 -0.964 7.111 1.00 42.43 H new ATOM 1337 N SER A 80 -1.551 2.567 4.134 1.00 51.13 N ATOM 1338 CA SER A 80 -2.517 3.499 3.487 1.00 74.11 C ATOM 1339 C SER A 80 -1.844 4.360 2.388 1.00 73.44 C ATOM 1340 O SER A 80 -2.483 4.707 1.399 1.00 44.43 O ATOM 1341 CB SER A 80 -3.187 4.424 4.529 1.00 74.45 C ATOM 1342 OG SER A 80 -4.118 5.314 3.929 1.00 70.11 O ATOM 0 H SER A 80 -1.427 2.727 5.134 1.00 51.13 H new ATOM 0 HA SER A 80 -3.280 2.878 3.018 1.00 74.11 H new ATOM 0 HB2 SER A 80 -3.696 3.818 5.278 1.00 74.45 H new ATOM 0 HB3 SER A 80 -2.421 4.998 5.050 1.00 74.45 H new ATOM 0 HG SER A 80 -4.521 5.880 4.620 1.00 70.11 H new ATOM 1348 N TYR A 81 -0.550 4.689 2.574 1.00 2.45 N ATOM 1349 CA TYR A 81 0.255 5.420 1.563 1.00 53.54 C ATOM 1350 C TYR A 81 0.658 4.505 0.398 1.00 31.14 C ATOM 1351 O TYR A 81 0.868 4.977 -0.720 1.00 41.12 O ATOM 1352 CB TYR A 81 1.509 6.064 2.198 1.00 74.21 C ATOM 1353 CG TYR A 81 1.191 7.209 3.166 1.00 20.45 C ATOM 1354 CD1 TYR A 81 0.424 8.296 2.745 1.00 43.54 C ATOM 1355 CD2 TYR A 81 1.644 7.208 4.488 1.00 31.31 C ATOM 1356 CE1 TYR A 81 0.119 9.327 3.604 1.00 60.22 C ATOM 1357 CE2 TYR A 81 1.338 8.240 5.346 1.00 33.01 C ATOM 1358 CZ TYR A 81 0.575 9.297 4.898 1.00 11.13 C ATOM 1359 OH TYR A 81 0.253 10.324 5.758 1.00 41.04 O ATOM 0 H TYR A 81 -0.032 4.459 3.422 1.00 2.45 H new ATOM 0 HA TYR A 81 -0.375 6.217 1.168 1.00 53.54 H new ATOM 0 HB2 TYR A 81 2.071 5.296 2.730 1.00 74.21 H new ATOM 0 HB3 TYR A 81 2.155 6.440 1.404 1.00 74.21 H new ATOM 0 HD1 TYR A 81 0.063 8.329 1.727 1.00 43.54 H new ATOM 0 HD2 TYR A 81 2.245 6.383 4.843 1.00 31.31 H new ATOM 0 HE1 TYR A 81 -0.478 10.159 3.260 1.00 60.22 H new ATOM 0 HE2 TYR A 81 1.694 8.222 6.365 1.00 33.01 H new ATOM 0 HH TYR A 81 0.611 10.129 6.649 1.00 41.04 H new ATOM 1369 N CYS A 82 0.788 3.197 0.681 1.00 10.43 N ATOM 1370 CA CYS A 82 0.947 2.168 -0.366 1.00 60.35 C ATOM 1371 C CYS A 82 -0.362 2.029 -1.194 1.00 70.01 C ATOM 1372 O CYS A 82 -0.319 1.883 -2.414 1.00 65.14 O ATOM 1373 CB CYS A 82 1.358 0.812 0.262 1.00 51.41 C ATOM 1374 SG CYS A 82 2.933 0.858 1.150 1.00 5.32 S ATOM 0 H CYS A 82 0.786 2.824 1.631 1.00 10.43 H new ATOM 0 HA CYS A 82 1.743 2.479 -1.043 1.00 60.35 H new ATOM 0 HB2 CYS A 82 0.575 0.489 0.948 1.00 51.41 H new ATOM 0 HB3 CYS A 82 1.419 0.062 -0.527 1.00 51.41 H new ATOM 0 HG CYS A 82 2.815 1.610 2.204 1.00 5.32 H new ATOM 1380 N LEU A 83 -1.524 2.123 -0.511 1.00 42.11 N ATOM 1381 CA LEU A 83 -2.861 2.095 -1.163 1.00 31.41 C ATOM 1382 C LEU A 83 -3.084 3.381 -2.000 1.00 43.41 C ATOM 1383 O LEU A 83 -3.669 3.341 -3.087 1.00 3.24 O ATOM 1384 CB LEU A 83 -3.992 1.965 -0.103 1.00 54.54 C ATOM 1385 CG LEU A 83 -3.894 0.767 0.897 1.00 64.23 C ATOM 1386 CD1 LEU A 83 -5.112 0.728 1.847 1.00 74.55 C ATOM 1387 CD2 LEU A 83 -3.694 -0.583 0.172 1.00 74.44 C ATOM 0 H LEU A 83 -1.567 2.220 0.503 1.00 42.11 H new ATOM 0 HA LEU A 83 -2.893 1.227 -1.821 1.00 31.41 H new ATOM 0 HB2 LEU A 83 -4.021 2.888 0.476 1.00 54.54 H new ATOM 0 HB3 LEU A 83 -4.943 1.889 -0.630 1.00 54.54 H new ATOM 0 HG LEU A 83 -3.005 0.930 1.506 1.00 64.23 H new ATOM 0 HD11 LEU A 83 -5.014 -0.116 2.530 1.00 74.55 H new ATOM 0 HD12 LEU A 83 -5.157 1.655 2.419 1.00 74.55 H new ATOM 0 HD13 LEU A 83 -6.026 0.618 1.263 1.00 74.55 H new ATOM 0 HD21 LEU A 83 -3.632 -1.385 0.907 1.00 74.44 H new ATOM 0 HD22 LEU A 83 -4.537 -0.766 -0.494 1.00 74.44 H new ATOM 0 HD23 LEU A 83 -2.772 -0.551 -0.409 1.00 74.44 H new ATOM 1399 N LYS A 84 -2.599 4.513 -1.460 1.00 51.31 N ATOM 1400 CA LYS A 84 -2.611 5.830 -2.127 1.00 4.12 C ATOM 1401 C LYS A 84 -1.736 5.778 -3.409 1.00 12.14 C ATOM 1402 O LYS A 84 -2.144 6.250 -4.459 1.00 64.42 O ATOM 1403 CB LYS A 84 -2.149 6.935 -1.085 1.00 74.02 C ATOM 1404 CG LYS A 84 -1.158 8.021 -1.574 1.00 11.44 C ATOM 1405 CD LYS A 84 -1.762 9.027 -2.582 1.00 61.45 C ATOM 1406 CE LYS A 84 -2.723 10.031 -1.944 1.00 75.12 C ATOM 1407 NZ LYS A 84 -3.431 10.852 -2.964 1.00 44.45 N ATOM 0 H LYS A 84 -2.180 4.540 -0.531 1.00 51.31 H new ATOM 0 HA LYS A 84 -3.615 6.097 -2.456 1.00 4.12 H new ATOM 0 HB2 LYS A 84 -3.041 7.439 -0.714 1.00 74.02 H new ATOM 0 HB3 LYS A 84 -1.694 6.425 -0.236 1.00 74.02 H new ATOM 0 HG2 LYS A 84 -0.784 8.570 -0.710 1.00 11.44 H new ATOM 0 HG3 LYS A 84 -0.300 7.532 -2.036 1.00 11.44 H new ATOM 0 HD2 LYS A 84 -0.953 9.571 -3.069 1.00 61.45 H new ATOM 0 HD3 LYS A 84 -2.290 8.476 -3.361 1.00 61.45 H new ATOM 0 HE2 LYS A 84 -3.454 9.497 -1.337 1.00 75.12 H new ATOM 0 HE3 LYS A 84 -2.169 10.686 -1.272 1.00 75.12 H new ATOM 0 HZ1 LYS A 84 -3.095 11.835 -2.912 1.00 44.45 H new ATOM 0 HZ2 LYS A 84 -3.239 10.470 -3.912 1.00 44.45 H new ATOM 0 HZ3 LYS A 84 -4.454 10.826 -2.781 1.00 44.45 H new ATOM 1421 N PHE A 85 -0.546 5.169 -3.296 1.00 51.41 N ATOM 1422 CA PHE A 85 0.371 4.932 -4.438 1.00 42.22 C ATOM 1423 C PHE A 85 -0.266 4.011 -5.504 1.00 75.44 C ATOM 1424 O PHE A 85 -0.102 4.241 -6.706 1.00 1.13 O ATOM 1425 CB PHE A 85 1.683 4.313 -3.891 1.00 12.43 C ATOM 1426 CG PHE A 85 2.711 3.867 -4.934 1.00 70.12 C ATOM 1427 CD1 PHE A 85 3.571 4.782 -5.527 1.00 65.02 C ATOM 1428 CD2 PHE A 85 2.837 2.521 -5.292 1.00 5.22 C ATOM 1429 CE1 PHE A 85 4.525 4.369 -6.433 1.00 11.34 C ATOM 1430 CE2 PHE A 85 3.789 2.111 -6.203 1.00 62.42 C ATOM 1431 CZ PHE A 85 4.636 3.037 -6.774 1.00 71.45 C ATOM 0 H PHE A 85 -0.184 4.822 -2.408 1.00 51.41 H new ATOM 0 HA PHE A 85 0.580 5.882 -4.930 1.00 42.22 H new ATOM 0 HB2 PHE A 85 2.157 5.042 -3.234 1.00 12.43 H new ATOM 0 HB3 PHE A 85 1.424 3.451 -3.276 1.00 12.43 H new ATOM 0 HD1 PHE A 85 3.492 5.829 -5.276 1.00 65.02 H new ATOM 0 HD2 PHE A 85 2.178 1.790 -4.848 1.00 5.22 H new ATOM 0 HE1 PHE A 85 5.190 5.094 -6.879 1.00 11.34 H new ATOM 0 HE2 PHE A 85 3.870 1.067 -6.468 1.00 62.42 H new ATOM 0 HZ PHE A 85 5.384 2.721 -7.486 1.00 71.45 H new ATOM 1441 N ALA A 86 -1.006 2.994 -5.025 1.00 62.43 N ATOM 1442 CA ALA A 86 -1.578 1.916 -5.854 1.00 43.14 C ATOM 1443 C ALA A 86 -2.434 2.431 -7.036 1.00 53.02 C ATOM 1444 O ALA A 86 -2.297 1.947 -8.157 1.00 53.22 O ATOM 1445 CB ALA A 86 -2.406 0.972 -4.972 1.00 12.44 C ATOM 0 H ALA A 86 -1.227 2.896 -4.034 1.00 62.43 H new ATOM 0 HA ALA A 86 -0.738 1.382 -6.298 1.00 43.14 H new ATOM 0 HB1 ALA A 86 -2.828 0.176 -5.586 1.00 12.44 H new ATOM 0 HB2 ALA A 86 -1.766 0.537 -4.204 1.00 12.44 H new ATOM 0 HB3 ALA A 86 -3.213 1.531 -4.498 1.00 12.44 H new ATOM 1451 N GLU A 87 -3.286 3.439 -6.784 1.00 54.42 N ATOM 1452 CA GLU A 87 -4.221 3.971 -7.810 1.00 1.22 C ATOM 1453 C GLU A 87 -3.495 4.662 -9.003 1.00 64.43 C ATOM 1454 O GLU A 87 -4.097 4.870 -10.060 1.00 31.32 O ATOM 1455 CB GLU A 87 -5.238 4.945 -7.152 1.00 40.12 C ATOM 1456 CG GLU A 87 -4.593 6.151 -6.436 1.00 11.30 C ATOM 1457 CD GLU A 87 -5.604 7.112 -5.784 1.00 41.25 C ATOM 1458 OE1 GLU A 87 -6.357 6.681 -4.885 1.00 13.13 O ATOM 1459 OE2 GLU A 87 -5.660 8.301 -6.168 1.00 44.52 O ATOM 0 H GLU A 87 -3.352 3.907 -5.880 1.00 54.42 H new ATOM 0 HA GLU A 87 -4.751 3.115 -8.228 1.00 1.22 H new ATOM 0 HB2 GLU A 87 -5.918 5.315 -7.920 1.00 40.12 H new ATOM 0 HB3 GLU A 87 -5.841 4.391 -6.433 1.00 40.12 H new ATOM 0 HG2 GLU A 87 -3.912 5.782 -5.669 1.00 11.30 H new ATOM 0 HG3 GLU A 87 -3.992 6.707 -7.155 1.00 11.30 H new ATOM 1466 N TYR A 88 -2.203 4.993 -8.827 1.00 44.21 N ATOM 1467 CA TYR A 88 -1.374 5.653 -9.876 1.00 1.23 C ATOM 1468 C TYR A 88 -0.532 4.638 -10.692 1.00 51.42 C ATOM 1469 O TYR A 88 0.137 5.022 -11.658 1.00 44.41 O ATOM 1470 CB TYR A 88 -0.429 6.701 -9.227 1.00 53.04 C ATOM 1471 CG TYR A 88 -1.137 7.697 -8.301 1.00 71.02 C ATOM 1472 CD1 TYR A 88 -2.191 8.485 -8.766 1.00 35.24 C ATOM 1473 CD2 TYR A 88 -0.778 7.823 -6.958 1.00 14.14 C ATOM 1474 CE1 TYR A 88 -2.848 9.361 -7.929 1.00 12.14 C ATOM 1475 CE2 TYR A 88 -1.440 8.691 -6.125 1.00 74.01 C ATOM 1476 CZ TYR A 88 -2.471 9.455 -6.608 1.00 74.43 C ATOM 1477 OH TYR A 88 -3.144 10.309 -5.760 1.00 32.40 O ATOM 0 H TYR A 88 -1.697 4.815 -7.960 1.00 44.21 H new ATOM 0 HA TYR A 88 -2.063 6.142 -10.565 1.00 1.23 H new ATOM 0 HB2 TYR A 88 0.340 6.178 -8.659 1.00 53.04 H new ATOM 0 HB3 TYR A 88 0.079 7.254 -10.017 1.00 53.04 H new ATOM 0 HD1 TYR A 88 -2.497 8.407 -9.799 1.00 35.24 H new ATOM 0 HD2 TYR A 88 0.034 7.228 -6.567 1.00 14.14 H new ATOM 0 HE1 TYR A 88 -3.655 9.971 -8.308 1.00 12.14 H new ATOM 0 HE2 TYR A 88 -1.148 8.772 -5.088 1.00 74.01 H new ATOM 0 HH TYR A 88 -4.050 9.969 -5.604 1.00 32.40 H new ATOM 1487 N ASN A 89 -0.558 3.355 -10.293 1.00 44.53 N ATOM 1488 CA ASN A 89 0.293 2.292 -10.897 1.00 22.31 C ATOM 1489 C ASN A 89 -0.556 1.095 -11.380 1.00 40.21 C ATOM 1490 O ASN A 89 -1.492 0.672 -10.702 1.00 61.22 O ATOM 1491 CB ASN A 89 1.356 1.826 -9.866 1.00 1.54 C ATOM 1492 CG ASN A 89 2.346 2.938 -9.514 1.00 54.01 C ATOM 1493 OD1 ASN A 89 3.427 3.036 -10.074 1.00 2.40 O ATOM 1494 ND2 ASN A 89 1.973 3.806 -8.603 1.00 1.23 N ATOM 0 H ASN A 89 -1.164 3.017 -9.546 1.00 44.53 H new ATOM 0 HA ASN A 89 0.796 2.709 -11.770 1.00 22.31 H new ATOM 0 HB2 ASN A 89 0.856 1.487 -8.959 1.00 1.54 H new ATOM 0 HB3 ASN A 89 1.900 0.972 -10.269 1.00 1.54 H new ATOM 0 HD21 ASN A 89 2.590 4.579 -8.352 1.00 1.23 H new ATOM 0 HD22 ASN A 89 1.066 3.708 -8.146 1.00 1.23 H new ATOM 1501 N SER A 90 -0.217 0.566 -12.564 1.00 61.11 N ATOM 1502 CA SER A 90 -0.914 -0.601 -13.167 1.00 11.31 C ATOM 1503 C SER A 90 -0.291 -1.948 -12.722 1.00 2.41 C ATOM 1504 O SER A 90 -0.920 -2.997 -12.873 1.00 25.32 O ATOM 1505 CB SER A 90 -0.899 -0.493 -14.711 1.00 74.13 C ATOM 1506 OG SER A 90 -1.506 0.722 -15.148 1.00 55.33 O ATOM 0 H SER A 90 0.545 0.927 -13.137 1.00 61.11 H new ATOM 0 HA SER A 90 -1.944 -0.584 -12.810 1.00 11.31 H new ATOM 0 HB2 SER A 90 0.129 -0.540 -15.072 1.00 74.13 H new ATOM 0 HB3 SER A 90 -1.427 -1.343 -15.143 1.00 74.13 H new ATOM 0 HG SER A 90 -1.482 0.766 -16.127 1.00 55.33 H new ATOM 1512 N ASP A 91 0.948 -1.913 -12.178 1.00 64.42 N ATOM 1513 CA ASP A 91 1.660 -3.124 -11.683 1.00 45.13 C ATOM 1514 C ASP A 91 1.279 -3.473 -10.221 1.00 54.51 C ATOM 1515 O ASP A 91 2.150 -3.675 -9.373 1.00 62.41 O ATOM 1516 CB ASP A 91 3.202 -2.936 -11.816 1.00 61.31 C ATOM 1517 CG ASP A 91 3.684 -3.019 -13.267 1.00 14.04 C ATOM 1518 OD1 ASP A 91 3.895 -4.144 -13.764 1.00 42.33 O ATOM 1519 OD2 ASP A 91 3.851 -1.970 -13.922 1.00 0.24 O ATOM 0 H ASP A 91 1.483 -1.052 -12.068 1.00 64.42 H new ATOM 0 HA ASP A 91 1.346 -3.963 -12.305 1.00 45.13 H new ATOM 0 HB2 ASP A 91 3.483 -1.969 -11.399 1.00 61.31 H new ATOM 0 HB3 ASP A 91 3.709 -3.698 -11.225 1.00 61.31 H new ATOM 1524 N LEU A 92 -0.033 -3.594 -9.947 1.00 0.22 N ATOM 1525 CA LEU A 92 -0.542 -3.869 -8.580 1.00 71.22 C ATOM 1526 C LEU A 92 -0.315 -5.329 -8.130 1.00 51.43 C ATOM 1527 O LEU A 92 -0.202 -5.581 -6.928 1.00 74.34 O ATOM 1528 CB LEU A 92 -2.035 -3.471 -8.438 1.00 43.20 C ATOM 1529 CG LEU A 92 -2.351 -1.956 -8.650 1.00 13.44 C ATOM 1530 CD1 LEU A 92 -3.802 -1.610 -8.243 1.00 11.12 C ATOM 1531 CD2 LEU A 92 -1.334 -1.062 -7.904 1.00 41.22 C ATOM 0 H LEU A 92 -0.765 -3.506 -10.652 1.00 0.22 H new ATOM 0 HA LEU A 92 0.046 -3.242 -7.910 1.00 71.22 H new ATOM 0 HB2 LEU A 92 -2.617 -4.049 -9.156 1.00 43.20 H new ATOM 0 HB3 LEU A 92 -2.377 -3.760 -7.444 1.00 43.20 H new ATOM 0 HG LEU A 92 -2.256 -1.753 -9.717 1.00 13.44 H new ATOM 0 HD11 LEU A 92 -3.982 -0.547 -8.405 1.00 11.12 H new ATOM 0 HD12 LEU A 92 -4.498 -2.192 -8.847 1.00 11.12 H new ATOM 0 HD13 LEU A 92 -3.950 -1.846 -7.189 1.00 11.12 H new ATOM 0 HD21 LEU A 92 -1.580 -0.013 -8.071 1.00 41.22 H new ATOM 0 HD22 LEU A 92 -1.373 -1.279 -6.836 1.00 41.22 H new ATOM 0 HD23 LEU A 92 -0.330 -1.263 -8.278 1.00 41.22 H new ATOM 1543 N HIS A 93 -0.278 -6.289 -9.082 1.00 20.42 N ATOM 1544 CA HIS A 93 0.175 -7.664 -8.789 1.00 32.55 C ATOM 1545 C HIS A 93 1.586 -7.644 -8.164 1.00 60.03 C ATOM 1546 O HIS A 93 1.751 -8.062 -7.029 1.00 41.10 O ATOM 1547 CB HIS A 93 0.154 -8.556 -10.061 1.00 5.34 C ATOM 1548 CG HIS A 93 0.689 -9.953 -9.842 1.00 44.43 C ATOM 1549 ND1 HIS A 93 -0.096 -10.995 -9.412 1.00 12.11 N ATOM 1550 CD2 HIS A 93 1.948 -10.464 -9.952 1.00 51.44 C ATOM 1551 CE1 HIS A 93 0.644 -12.072 -9.265 1.00 21.11 C ATOM 1552 NE2 HIS A 93 1.884 -11.780 -9.582 1.00 55.41 N ATOM 0 H HIS A 93 -0.555 -6.137 -10.052 1.00 20.42 H new ATOM 0 HA HIS A 93 -0.521 -8.098 -8.071 1.00 32.55 H new ATOM 0 HB2 HIS A 93 -0.870 -8.624 -10.428 1.00 5.34 H new ATOM 0 HB3 HIS A 93 0.741 -8.072 -10.842 1.00 5.34 H new ATOM 0 HD2 HIS A 93 2.831 -9.930 -10.271 1.00 51.44 H new ATOM 0 HE1 HIS A 93 0.290 -13.038 -8.937 1.00 21.11 H new ATOM 0 HE2 HIS A 93 2.671 -12.428 -9.557 1.00 55.41 H new ATOM 1561 N GLN A 94 2.576 -7.118 -8.915 1.00 3.25 N ATOM 1562 CA GLN A 94 3.986 -7.038 -8.462 1.00 14.15 C ATOM 1563 C GLN A 94 4.131 -6.209 -7.170 1.00 2.52 C ATOM 1564 O GLN A 94 4.905 -6.565 -6.288 1.00 34.34 O ATOM 1565 CB GLN A 94 4.888 -6.421 -9.564 1.00 13.22 C ATOM 1566 CG GLN A 94 5.104 -7.308 -10.805 1.00 34.32 C ATOM 1567 CD GLN A 94 6.104 -6.717 -11.805 1.00 61.43 C ATOM 1568 OE1 GLN A 94 6.233 -5.507 -11.943 1.00 20.32 O ATOM 1569 NE2 GLN A 94 6.833 -7.571 -12.499 1.00 35.25 N ATOM 0 H GLN A 94 2.424 -6.737 -9.849 1.00 3.25 H new ATOM 0 HA GLN A 94 4.305 -8.060 -8.256 1.00 14.15 H new ATOM 0 HB2 GLN A 94 4.449 -5.476 -9.884 1.00 13.22 H new ATOM 0 HB3 GLN A 94 5.860 -6.190 -9.129 1.00 13.22 H new ATOM 0 HG2 GLN A 94 5.457 -8.289 -10.485 1.00 34.32 H new ATOM 0 HG3 GLN A 94 4.148 -7.461 -11.305 1.00 34.32 H new ATOM 0 HE21 GLN A 94 6.707 -8.574 -12.366 1.00 35.25 H new ATOM 0 HE22 GLN A 94 7.522 -7.227 -13.168 1.00 35.25 H new ATOM 1578 N PHE A 95 3.367 -5.112 -7.095 1.00 3.21 N ATOM 1579 CA PHE A 95 3.419 -4.158 -5.975 1.00 15.54 C ATOM 1580 C PHE A 95 2.955 -4.797 -4.640 1.00 14.50 C ATOM 1581 O PHE A 95 3.754 -4.938 -3.710 1.00 13.24 O ATOM 1582 CB PHE A 95 2.571 -2.908 -6.341 1.00 1.22 C ATOM 1583 CG PHE A 95 2.368 -1.920 -5.207 1.00 50.44 C ATOM 1584 CD1 PHE A 95 3.459 -1.407 -4.507 1.00 30.44 C ATOM 1585 CD2 PHE A 95 1.086 -1.517 -4.831 1.00 50.33 C ATOM 1586 CE1 PHE A 95 3.273 -0.529 -3.472 1.00 51.34 C ATOM 1587 CE2 PHE A 95 0.910 -0.635 -3.797 1.00 34.43 C ATOM 1588 CZ PHE A 95 2.003 -0.142 -3.119 1.00 53.11 C ATOM 0 H PHE A 95 2.690 -4.858 -7.814 1.00 3.21 H new ATOM 0 HA PHE A 95 4.454 -3.857 -5.815 1.00 15.54 H new ATOM 0 HB2 PHE A 95 3.051 -2.392 -7.172 1.00 1.22 H new ATOM 0 HB3 PHE A 95 1.594 -3.240 -6.694 1.00 1.22 H new ATOM 0 HD1 PHE A 95 4.460 -1.704 -4.783 1.00 30.44 H new ATOM 0 HD2 PHE A 95 0.226 -1.903 -5.359 1.00 50.33 H new ATOM 0 HE1 PHE A 95 4.125 -0.141 -2.933 1.00 51.34 H new ATOM 0 HE2 PHE A 95 -0.085 -0.327 -3.514 1.00 34.43 H new ATOM 0 HZ PHE A 95 1.861 0.553 -2.305 1.00 53.11 H new ATOM 1598 N PHE A 96 1.667 -5.189 -4.561 1.00 20.31 N ATOM 1599 CA PHE A 96 1.082 -5.766 -3.328 1.00 35.23 C ATOM 1600 C PHE A 96 1.731 -7.126 -2.955 1.00 20.32 C ATOM 1601 O PHE A 96 1.775 -7.491 -1.773 1.00 54.12 O ATOM 1602 CB PHE A 96 -0.444 -5.934 -3.476 1.00 15.11 C ATOM 1603 CG PHE A 96 -1.246 -4.631 -3.527 1.00 22.01 C ATOM 1604 CD1 PHE A 96 -1.344 -3.822 -2.400 1.00 44.44 C ATOM 1605 CD2 PHE A 96 -1.920 -4.228 -4.683 1.00 22.24 C ATOM 1606 CE1 PHE A 96 -2.081 -2.656 -2.423 1.00 12.22 C ATOM 1607 CE2 PHE A 96 -2.663 -3.062 -4.702 1.00 51.12 C ATOM 1608 CZ PHE A 96 -2.742 -2.277 -3.571 1.00 42.24 C ATOM 0 H PHE A 96 1.009 -5.117 -5.337 1.00 20.31 H new ATOM 0 HA PHE A 96 1.290 -5.066 -2.519 1.00 35.23 H new ATOM 0 HB2 PHE A 96 -0.644 -6.500 -4.386 1.00 15.11 H new ATOM 0 HB3 PHE A 96 -0.809 -6.533 -2.642 1.00 15.11 H new ATOM 0 HD1 PHE A 96 -0.835 -4.111 -1.492 1.00 44.44 H new ATOM 0 HD2 PHE A 96 -1.860 -4.836 -5.574 1.00 22.24 H new ATOM 0 HE1 PHE A 96 -2.140 -2.039 -1.539 1.00 12.22 H new ATOM 0 HE2 PHE A 96 -3.181 -2.766 -5.602 1.00 51.12 H new ATOM 0 HZ PHE A 96 -3.322 -1.366 -3.585 1.00 42.24 H new ATOM 1618 N GLU A 97 2.219 -7.866 -3.977 1.00 64.13 N ATOM 1619 CA GLU A 97 2.948 -9.143 -3.773 1.00 73.11 C ATOM 1620 C GLU A 97 4.303 -8.888 -3.085 1.00 42.31 C ATOM 1621 O GLU A 97 4.637 -9.562 -2.119 1.00 14.33 O ATOM 1622 CB GLU A 97 3.143 -9.883 -5.124 1.00 21.31 C ATOM 1623 CG GLU A 97 3.656 -11.332 -5.024 1.00 24.53 C ATOM 1624 CD GLU A 97 3.648 -12.059 -6.383 1.00 72.23 C ATOM 1625 OE1 GLU A 97 4.580 -11.850 -7.192 1.00 33.20 O ATOM 1626 OE2 GLU A 97 2.687 -12.816 -6.664 1.00 5.33 O ATOM 0 H GLU A 97 2.121 -7.600 -4.957 1.00 64.13 H new ATOM 0 HA GLU A 97 2.351 -9.781 -3.121 1.00 73.11 H new ATOM 0 HB2 GLU A 97 2.191 -9.890 -5.654 1.00 21.31 H new ATOM 0 HB3 GLU A 97 3.843 -9.311 -5.733 1.00 21.31 H new ATOM 0 HG2 GLU A 97 4.670 -11.328 -4.625 1.00 24.53 H new ATOM 0 HG3 GLU A 97 3.037 -11.885 -4.317 1.00 24.53 H new ATOM 1633 N PHE A 98 5.047 -7.882 -3.592 1.00 73.43 N ATOM 1634 CA PHE A 98 6.335 -7.414 -3.010 1.00 5.03 C ATOM 1635 C PHE A 98 6.170 -7.027 -1.516 1.00 1.01 C ATOM 1636 O PHE A 98 6.976 -7.436 -0.661 1.00 50.02 O ATOM 1637 CB PHE A 98 6.907 -6.233 -3.890 1.00 73.25 C ATOM 1638 CG PHE A 98 7.519 -5.034 -3.149 1.00 1.42 C ATOM 1639 CD1 PHE A 98 8.773 -5.120 -2.545 1.00 32.33 C ATOM 1640 CD2 PHE A 98 6.828 -3.820 -3.059 1.00 74.51 C ATOM 1641 CE1 PHE A 98 9.310 -4.038 -1.878 1.00 15.45 C ATOM 1642 CE2 PHE A 98 7.372 -2.742 -2.390 1.00 0.05 C ATOM 1643 CZ PHE A 98 8.610 -2.850 -1.801 1.00 15.34 C ATOM 0 H PHE A 98 4.772 -7.363 -4.426 1.00 73.43 H new ATOM 0 HA PHE A 98 7.061 -8.227 -3.028 1.00 5.03 H new ATOM 0 HB2 PHE A 98 7.668 -6.644 -4.553 1.00 73.25 H new ATOM 0 HB3 PHE A 98 6.100 -5.863 -4.523 1.00 73.25 H new ATOM 0 HD1 PHE A 98 9.330 -6.044 -2.600 1.00 32.33 H new ATOM 0 HD2 PHE A 98 5.856 -3.725 -3.519 1.00 74.51 H new ATOM 0 HE1 PHE A 98 10.282 -4.121 -1.414 1.00 15.45 H new ATOM 0 HE2 PHE A 98 6.825 -1.813 -2.329 1.00 0.05 H new ATOM 0 HZ PHE A 98 9.035 -2.006 -1.278 1.00 15.34 H new ATOM 1653 N LEU A 99 5.111 -6.247 -1.229 1.00 2.12 N ATOM 1654 CA LEU A 99 4.747 -5.849 0.143 1.00 32.54 C ATOM 1655 C LEU A 99 4.533 -7.093 1.042 1.00 50.51 C ATOM 1656 O LEU A 99 5.168 -7.226 2.089 1.00 4.34 O ATOM 1657 CB LEU A 99 3.470 -4.963 0.120 1.00 12.32 C ATOM 1658 CG LEU A 99 3.589 -3.603 -0.649 1.00 43.04 C ATOM 1659 CD1 LEU A 99 2.231 -2.871 -0.713 1.00 5.40 C ATOM 1660 CD2 LEU A 99 4.685 -2.696 -0.035 1.00 14.24 C ATOM 0 H LEU A 99 4.484 -5.875 -1.942 1.00 2.12 H new ATOM 0 HA LEU A 99 5.569 -5.269 0.564 1.00 32.54 H new ATOM 0 HB2 LEU A 99 2.660 -5.540 -0.326 1.00 12.32 H new ATOM 0 HB3 LEU A 99 3.181 -4.751 1.149 1.00 12.32 H new ATOM 0 HG LEU A 99 3.889 -3.834 -1.671 1.00 43.04 H new ATOM 0 HD11 LEU A 99 2.349 -1.932 -1.253 1.00 5.40 H new ATOM 0 HD12 LEU A 99 1.504 -3.498 -1.230 1.00 5.40 H new ATOM 0 HD13 LEU A 99 1.880 -2.666 0.298 1.00 5.40 H new ATOM 0 HD21 LEU A 99 4.739 -1.762 -0.594 1.00 14.24 H new ATOM 0 HD22 LEU A 99 4.440 -2.483 1.006 1.00 14.24 H new ATOM 0 HD23 LEU A 99 5.648 -3.205 -0.084 1.00 14.24 H new ATOM 1672 N TYR A 100 3.682 -8.018 0.572 1.00 32.42 N ATOM 1673 CA TYR A 100 3.360 -9.271 1.287 1.00 51.34 C ATOM 1674 C TYR A 100 4.624 -10.146 1.543 1.00 75.40 C ATOM 1675 O TYR A 100 4.782 -10.707 2.635 1.00 35.11 O ATOM 1676 CB TYR A 100 2.289 -10.064 0.490 1.00 1.34 C ATOM 1677 CG TYR A 100 1.808 -11.345 1.194 1.00 25.24 C ATOM 1678 CD1 TYR A 100 1.058 -11.277 2.372 1.00 71.54 C ATOM 1679 CD2 TYR A 100 2.115 -12.615 0.695 1.00 31.32 C ATOM 1680 CE1 TYR A 100 0.636 -12.422 3.016 1.00 2.21 C ATOM 1681 CE2 TYR A 100 1.690 -13.758 1.341 1.00 3.40 C ATOM 1682 CZ TYR A 100 0.953 -13.656 2.500 1.00 14.32 C ATOM 1683 OH TYR A 100 0.520 -14.796 3.141 1.00 64.12 O ATOM 0 H TYR A 100 3.194 -7.921 -0.318 1.00 32.42 H new ATOM 0 HA TYR A 100 2.961 -9.007 2.266 1.00 51.34 H new ATOM 0 HB2 TYR A 100 1.431 -9.416 0.310 1.00 1.34 H new ATOM 0 HB3 TYR A 100 2.698 -10.329 -0.485 1.00 1.34 H new ATOM 0 HD1 TYR A 100 0.805 -10.312 2.785 1.00 71.54 H new ATOM 0 HD2 TYR A 100 2.695 -12.703 -0.212 1.00 31.32 H new ATOM 0 HE1 TYR A 100 0.057 -12.349 3.925 1.00 2.21 H new ATOM 0 HE2 TYR A 100 1.935 -14.730 0.939 1.00 3.40 H new ATOM 0 HH TYR A 100 0.827 -15.585 2.648 1.00 64.12 H new ATOM 1693 N ASN A 101 5.525 -10.229 0.537 1.00 51.52 N ATOM 1694 CA ASN A 101 6.797 -10.995 0.643 1.00 53.45 C ATOM 1695 C ASN A 101 7.769 -10.365 1.669 1.00 71.44 C ATOM 1696 O ASN A 101 8.519 -11.086 2.334 1.00 23.33 O ATOM 1697 CB ASN A 101 7.516 -11.144 -0.739 1.00 4.12 C ATOM 1698 CG ASN A 101 6.912 -12.243 -1.622 1.00 3.30 C ATOM 1699 OD1 ASN A 101 7.203 -13.423 -1.447 1.00 71.20 O ATOM 1700 ND2 ASN A 101 6.125 -11.879 -2.613 1.00 65.34 N ATOM 0 H ASN A 101 5.396 -9.772 -0.366 1.00 51.52 H new ATOM 0 HA ASN A 101 6.517 -11.988 0.993 1.00 53.45 H new ATOM 0 HB2 ASN A 101 7.468 -10.193 -1.270 1.00 4.12 H new ATOM 0 HB3 ASN A 101 8.571 -11.362 -0.570 1.00 4.12 H new ATOM 0 HD21 ASN A 101 5.748 -12.582 -3.249 1.00 65.34 H new ATOM 0 HD22 ASN A 101 5.893 -10.895 -2.745 1.00 65.34 H new ATOM 1707 N HIS A 102 7.764 -9.025 1.792 1.00 1.31 N ATOM 1708 CA HIS A 102 8.647 -8.317 2.753 1.00 31.01 C ATOM 1709 C HIS A 102 7.940 -8.074 4.125 1.00 21.01 C ATOM 1710 O HIS A 102 8.466 -7.365 4.989 1.00 1.43 O ATOM 1711 CB HIS A 102 9.158 -6.986 2.129 1.00 22.44 C ATOM 1712 CG HIS A 102 10.476 -6.526 2.711 1.00 22.31 C ATOM 1713 ND1 HIS A 102 10.590 -5.957 3.960 1.00 41.03 N ATOM 1714 CD2 HIS A 102 11.745 -6.634 2.244 1.00 22.52 C ATOM 1715 CE1 HIS A 102 11.853 -5.731 4.226 1.00 4.51 C ATOM 1716 NE2 HIS A 102 12.577 -6.131 3.207 1.00 54.23 N ATOM 0 H HIS A 102 7.164 -8.409 1.244 1.00 1.31 H new ATOM 0 HA HIS A 102 9.507 -8.955 2.956 1.00 31.01 H new ATOM 0 HB2 HIS A 102 9.268 -7.115 1.052 1.00 22.44 H new ATOM 0 HB3 HIS A 102 8.409 -6.209 2.282 1.00 22.44 H new ATOM 0 HD1 HIS A 102 9.811 -5.744 4.583 1.00 41.03 H new ATOM 0 HD2 HIS A 102 12.043 -7.041 1.289 1.00 22.52 H new ATOM 0 HE1 HIS A 102 12.235 -5.289 5.134 1.00 4.51 H new ATOM 0 HE2 HIS A 102 13.594 -6.076 3.143 1.00 54.23 H new ATOM 1725 N GLY A 103 6.742 -8.658 4.314 1.00 41.31 N ATOM 1726 CA GLY A 103 6.011 -8.569 5.596 1.00 63.11 C ATOM 1727 C GLY A 103 5.188 -7.287 5.764 1.00 14.11 C ATOM 1728 O GLY A 103 4.540 -7.090 6.803 1.00 42.12 O ATOM 0 H GLY A 103 6.258 -9.197 3.596 1.00 41.31 H new ATOM 0 HA2 GLY A 103 5.346 -9.428 5.682 1.00 63.11 H new ATOM 0 HA3 GLY A 103 6.727 -8.637 6.415 1.00 63.11 H new ATOM 1732 N ILE A 104 5.218 -6.410 4.744 1.00 53.23 N ATOM 1733 CA ILE A 104 4.463 -5.145 4.746 1.00 21.51 C ATOM 1734 C ILE A 104 2.943 -5.438 4.564 1.00 12.23 C ATOM 1735 O ILE A 104 2.535 -5.969 3.532 1.00 24.42 O ATOM 1736 CB ILE A 104 4.947 -4.161 3.608 1.00 22.41 C ATOM 1737 CG1 ILE A 104 6.511 -4.021 3.565 1.00 3.45 C ATOM 1738 CG2 ILE A 104 4.265 -2.772 3.738 1.00 11.52 C ATOM 1739 CD1 ILE A 104 7.159 -3.496 4.837 1.00 71.12 C ATOM 0 H ILE A 104 5.766 -6.559 3.897 1.00 53.23 H new ATOM 0 HA ILE A 104 4.642 -4.660 5.705 1.00 21.51 H new ATOM 0 HB ILE A 104 4.641 -4.602 2.659 1.00 22.41 H new ATOM 0 HG12 ILE A 104 6.939 -4.997 3.337 1.00 3.45 H new ATOM 0 HG13 ILE A 104 6.776 -3.356 2.743 1.00 3.45 H new ATOM 0 HG21 ILE A 104 4.618 -2.117 2.941 1.00 11.52 H new ATOM 0 HG22 ILE A 104 3.184 -2.889 3.660 1.00 11.52 H new ATOM 0 HG23 ILE A 104 4.513 -2.334 4.705 1.00 11.52 H new ATOM 0 HD11 ILE A 104 8.239 -3.439 4.698 1.00 71.12 H new ATOM 0 HD12 ILE A 104 6.769 -2.503 5.061 1.00 71.12 H new ATOM 0 HD13 ILE A 104 6.935 -4.169 5.664 1.00 71.12 H new ATOM 1751 N GLY A 105 2.142 -5.110 5.593 1.00 34.42 N ATOM 1752 CA GLY A 105 0.682 -5.243 5.551 1.00 13.31 C ATOM 1753 C GLY A 105 0.143 -6.638 5.866 1.00 64.24 C ATOM 1754 O GLY A 105 -1.015 -6.922 5.546 1.00 51.53 O ATOM 0 H GLY A 105 2.494 -4.745 6.478 1.00 34.42 H new ATOM 0 HA2 GLY A 105 0.249 -4.536 6.259 1.00 13.31 H new ATOM 0 HA3 GLY A 105 0.336 -4.953 4.559 1.00 13.31 H new ATOM 1758 N THR A 106 0.961 -7.506 6.504 1.00 13.34 N ATOM 1759 CA THR A 106 0.527 -8.875 6.901 1.00 12.21 C ATOM 1760 C THR A 106 -0.586 -8.859 7.971 1.00 31.30 C ATOM 1761 O THR A 106 -1.455 -9.741 7.983 1.00 41.43 O ATOM 1762 CB THR A 106 1.718 -9.750 7.409 1.00 30.23 C ATOM 1763 OG1 THR A 106 2.391 -9.087 8.496 1.00 44.12 O ATOM 1764 CG2 THR A 106 2.713 -10.053 6.280 1.00 0.31 C ATOM 0 H THR A 106 1.925 -7.288 6.757 1.00 13.34 H new ATOM 0 HA THR A 106 0.125 -9.322 5.992 1.00 12.21 H new ATOM 0 HB THR A 106 1.311 -10.698 7.761 1.00 30.23 H new ATOM 0 HG1 THR A 106 2.079 -8.160 8.557 1.00 44.12 H new ATOM 0 HG21 THR A 106 3.529 -10.663 6.668 1.00 0.31 H new ATOM 0 HG22 THR A 106 2.204 -10.593 5.482 1.00 0.31 H new ATOM 0 HG23 THR A 106 3.114 -9.118 5.888 1.00 0.31 H new ATOM 1772 N LEU A 107 -0.549 -7.857 8.869 1.00 34.10 N ATOM 1773 CA LEU A 107 -1.620 -7.625 9.870 1.00 71.21 C ATOM 1774 C LEU A 107 -2.516 -6.417 9.479 1.00 21.15 C ATOM 1775 O LEU A 107 -3.259 -5.886 10.315 1.00 74.13 O ATOM 1776 CB LEU A 107 -1.009 -7.426 11.282 1.00 34.11 C ATOM 1777 CG LEU A 107 -0.243 -8.647 11.880 1.00 5.12 C ATOM 1778 CD1 LEU A 107 0.424 -8.274 13.222 1.00 64.51 C ATOM 1779 CD2 LEU A 107 -1.176 -9.869 12.037 1.00 14.43 C ATOM 0 H LEU A 107 0.217 -7.186 8.926 1.00 34.10 H new ATOM 0 HA LEU A 107 -2.256 -8.510 9.889 1.00 71.21 H new ATOM 0 HB2 LEU A 107 -0.325 -6.578 11.243 1.00 34.11 H new ATOM 0 HB3 LEU A 107 -1.812 -7.156 11.968 1.00 34.11 H new ATOM 0 HG LEU A 107 0.546 -8.925 11.181 1.00 5.12 H new ATOM 0 HD11 LEU A 107 0.952 -9.141 13.619 1.00 64.51 H new ATOM 0 HD12 LEU A 107 1.131 -7.460 13.063 1.00 64.51 H new ATOM 0 HD13 LEU A 107 -0.340 -7.957 13.932 1.00 64.51 H new ATOM 0 HD21 LEU A 107 -0.614 -10.704 12.456 1.00 14.43 H new ATOM 0 HD22 LEU A 107 -2.000 -9.615 12.704 1.00 14.43 H new ATOM 0 HD23 LEU A 107 -1.573 -10.151 11.062 1.00 14.43 H new ATOM 1791 N SER A 108 -2.485 -6.028 8.191 1.00 31.22 N ATOM 1792 CA SER A 108 -3.335 -4.942 7.651 1.00 15.41 C ATOM 1793 C SER A 108 -4.315 -5.508 6.601 1.00 65.44 C ATOM 1794 O SER A 108 -3.922 -5.787 5.466 1.00 1.00 O ATOM 1795 CB SER A 108 -2.455 -3.827 7.027 1.00 72.21 C ATOM 1796 OG SER A 108 -1.507 -3.329 7.963 1.00 11.31 O ATOM 0 H SER A 108 -1.873 -6.454 7.495 1.00 31.22 H new ATOM 0 HA SER A 108 -3.911 -4.508 8.468 1.00 15.41 H new ATOM 0 HB2 SER A 108 -1.934 -4.219 6.153 1.00 72.21 H new ATOM 0 HB3 SER A 108 -3.090 -3.011 6.681 1.00 72.21 H new ATOM 0 HG SER A 108 -1.954 -2.724 8.591 1.00 11.31 H new ATOM 1802 N SER A 109 -5.589 -5.691 7.009 1.00 74.22 N ATOM 1803 CA SER A 109 -6.696 -6.121 6.108 1.00 72.34 C ATOM 1804 C SER A 109 -6.832 -5.242 4.824 1.00 21.31 C ATOM 1805 O SER A 109 -6.892 -5.811 3.726 1.00 70.02 O ATOM 1806 CB SER A 109 -8.044 -6.151 6.875 1.00 51.12 C ATOM 1807 OG SER A 109 -9.153 -6.418 6.023 1.00 44.13 O ATOM 0 H SER A 109 -5.886 -5.546 7.974 1.00 74.22 H new ATOM 0 HA SER A 109 -6.438 -7.126 5.774 1.00 72.34 H new ATOM 0 HB2 SER A 109 -7.998 -6.912 7.654 1.00 51.12 H new ATOM 0 HB3 SER A 109 -8.196 -5.193 7.373 1.00 51.12 H new ATOM 0 HG SER A 109 -9.951 -6.586 6.567 1.00 44.13 H new ATOM 1813 N PRO A 110 -6.849 -3.848 4.912 1.00 21.11 N ATOM 1814 CA PRO A 110 -7.000 -2.949 3.713 1.00 72.15 C ATOM 1815 C PRO A 110 -6.014 -3.237 2.542 1.00 23.11 C ATOM 1816 O PRO A 110 -6.304 -2.882 1.396 1.00 3.30 O ATOM 1817 CB PRO A 110 -6.768 -1.521 4.297 1.00 21.52 C ATOM 1818 CG PRO A 110 -6.129 -1.741 5.638 1.00 51.40 C ATOM 1819 CD PRO A 110 -6.746 -3.010 6.153 1.00 44.40 C ATOM 0 HA PRO A 110 -7.976 -3.097 3.250 1.00 72.15 H new ATOM 0 HB2 PRO A 110 -6.124 -0.930 3.646 1.00 21.52 H new ATOM 0 HB3 PRO A 110 -7.708 -0.978 4.393 1.00 21.52 H new ATOM 0 HG2 PRO A 110 -5.047 -1.835 5.550 1.00 51.40 H new ATOM 0 HG3 PRO A 110 -6.323 -0.905 6.311 1.00 51.40 H new ATOM 0 HD2 PRO A 110 -6.124 -3.484 6.913 1.00 44.40 H new ATOM 0 HD3 PRO A 110 -7.722 -2.832 6.605 1.00 44.40 H new ATOM 1827 N LEU A 111 -4.862 -3.875 2.845 1.00 3.14 N ATOM 1828 CA LEU A 111 -3.881 -4.302 1.822 1.00 13.40 C ATOM 1829 C LEU A 111 -4.472 -5.420 0.923 1.00 14.22 C ATOM 1830 O LEU A 111 -4.521 -5.299 -0.307 1.00 74.25 O ATOM 1831 CB LEU A 111 -2.581 -4.832 2.495 1.00 63.00 C ATOM 1832 CG LEU A 111 -1.378 -5.058 1.521 1.00 4.35 C ATOM 1833 CD1 LEU A 111 -0.693 -3.722 1.170 1.00 44.42 C ATOM 1834 CD2 LEU A 111 -0.371 -6.103 2.058 1.00 72.22 C ATOM 0 H LEU A 111 -4.587 -4.107 3.799 1.00 3.14 H new ATOM 0 HA LEU A 111 -3.646 -3.432 1.209 1.00 13.40 H new ATOM 0 HB2 LEU A 111 -2.276 -4.126 3.268 1.00 63.00 H new ATOM 0 HB3 LEU A 111 -2.806 -5.774 2.995 1.00 63.00 H new ATOM 0 HG LEU A 111 -1.783 -5.475 0.599 1.00 4.35 H new ATOM 0 HD11 LEU A 111 0.140 -3.907 0.492 1.00 44.42 H new ATOM 0 HD12 LEU A 111 -1.413 -3.060 0.689 1.00 44.42 H new ATOM 0 HD13 LEU A 111 -0.321 -3.253 2.081 1.00 44.42 H new ATOM 0 HD21 LEU A 111 0.444 -6.223 1.345 1.00 72.22 H new ATOM 0 HD22 LEU A 111 0.030 -5.765 3.014 1.00 72.22 H new ATOM 0 HD23 LEU A 111 -0.877 -7.059 2.195 1.00 72.22 H new ATOM 1846 N TYR A 112 -4.932 -6.502 1.588 1.00 42.24 N ATOM 1847 CA TYR A 112 -5.494 -7.702 0.929 1.00 14.24 C ATOM 1848 C TYR A 112 -6.798 -7.370 0.180 1.00 52.10 C ATOM 1849 O TYR A 112 -7.032 -7.870 -0.921 1.00 33.51 O ATOM 1850 CB TYR A 112 -5.773 -8.815 1.971 1.00 53.11 C ATOM 1851 CG TYR A 112 -4.542 -9.277 2.762 1.00 3.33 C ATOM 1852 CD1 TYR A 112 -3.731 -10.313 2.295 1.00 64.20 C ATOM 1853 CD2 TYR A 112 -4.205 -8.695 3.988 1.00 10.33 C ATOM 1854 CE1 TYR A 112 -2.644 -10.753 3.018 1.00 4.10 C ATOM 1855 CE2 TYR A 112 -3.110 -9.130 4.707 1.00 52.24 C ATOM 1856 CZ TYR A 112 -2.338 -10.160 4.220 1.00 53.45 C ATOM 1857 OH TYR A 112 -1.272 -10.619 4.954 1.00 45.45 O ATOM 0 H TYR A 112 -4.924 -6.568 2.606 1.00 42.24 H new ATOM 0 HA TYR A 112 -4.756 -8.054 0.209 1.00 14.24 H new ATOM 0 HB2 TYR A 112 -6.525 -8.456 2.673 1.00 53.11 H new ATOM 0 HB3 TYR A 112 -6.202 -9.675 1.457 1.00 53.11 H new ATOM 0 HD1 TYR A 112 -3.960 -10.779 1.348 1.00 64.20 H new ATOM 0 HD2 TYR A 112 -4.812 -7.892 4.379 1.00 10.33 H new ATOM 0 HE1 TYR A 112 -2.034 -11.561 2.642 1.00 4.10 H new ATOM 0 HE2 TYR A 112 -2.860 -8.664 5.648 1.00 52.24 H new ATOM 0 HH TYR A 112 -1.462 -10.511 5.909 1.00 45.45 H new ATOM 1867 N ILE A 113 -7.638 -6.528 0.817 1.00 24.55 N ATOM 1868 CA ILE A 113 -8.911 -6.044 0.236 1.00 54.30 C ATOM 1869 C ILE A 113 -8.652 -5.236 -1.067 1.00 55.41 C ATOM 1870 O ILE A 113 -9.340 -5.432 -2.073 1.00 44.54 O ATOM 1871 CB ILE A 113 -9.714 -5.155 1.270 1.00 3.53 C ATOM 1872 CG1 ILE A 113 -9.905 -5.904 2.630 1.00 12.23 C ATOM 1873 CG2 ILE A 113 -11.083 -4.700 0.698 1.00 31.24 C ATOM 1874 CD1 ILE A 113 -10.764 -7.159 2.575 1.00 70.12 C ATOM 0 H ILE A 113 -7.453 -6.163 1.751 1.00 24.55 H new ATOM 0 HA ILE A 113 -9.513 -6.920 -0.005 1.00 54.30 H new ATOM 0 HB ILE A 113 -9.119 -4.260 1.453 1.00 3.53 H new ATOM 0 HG12 ILE A 113 -8.922 -6.175 3.016 1.00 12.23 H new ATOM 0 HG13 ILE A 113 -10.349 -5.212 3.346 1.00 12.23 H new ATOM 0 HG21 ILE A 113 -11.603 -4.092 1.439 1.00 31.24 H new ATOM 0 HG22 ILE A 113 -10.922 -4.112 -0.206 1.00 31.24 H new ATOM 0 HG23 ILE A 113 -11.687 -5.576 0.459 1.00 31.24 H new ATOM 0 HD11 ILE A 113 -10.830 -7.598 3.570 1.00 70.12 H new ATOM 0 HD12 ILE A 113 -11.763 -6.901 2.225 1.00 70.12 H new ATOM 0 HD13 ILE A 113 -10.314 -7.878 1.890 1.00 70.12 H new ATOM 1886 N ALA A 114 -7.629 -4.351 -1.037 1.00 62.11 N ATOM 1887 CA ALA A 114 -7.238 -3.509 -2.198 1.00 35.05 C ATOM 1888 C ALA A 114 -6.745 -4.348 -3.397 1.00 2.31 C ATOM 1889 O ALA A 114 -7.167 -4.121 -4.541 1.00 30.15 O ATOM 1890 CB ALA A 114 -6.156 -2.506 -1.778 1.00 0.20 C ATOM 0 H ALA A 114 -7.051 -4.199 -0.211 1.00 62.11 H new ATOM 0 HA ALA A 114 -8.130 -2.975 -2.524 1.00 35.05 H new ATOM 0 HB1 ALA A 114 -5.876 -1.893 -2.635 1.00 0.20 H new ATOM 0 HB2 ALA A 114 -6.542 -1.866 -0.985 1.00 0.20 H new ATOM 0 HB3 ALA A 114 -5.281 -3.045 -1.416 1.00 0.20 H new ATOM 1896 N TRP A 115 -5.847 -5.316 -3.115 1.00 24.45 N ATOM 1897 CA TRP A 115 -5.291 -6.211 -4.148 1.00 15.35 C ATOM 1898 C TRP A 115 -6.413 -7.082 -4.768 1.00 11.12 C ATOM 1899 O TRP A 115 -6.529 -7.159 -5.986 1.00 34.31 O ATOM 1900 CB TRP A 115 -4.161 -7.099 -3.555 1.00 72.52 C ATOM 1901 CG TRP A 115 -3.297 -7.824 -4.584 1.00 62.15 C ATOM 1902 CD1 TRP A 115 -3.263 -7.633 -5.947 1.00 64.30 C ATOM 1903 CD2 TRP A 115 -2.296 -8.819 -4.308 1.00 24.12 C ATOM 1904 NE1 TRP A 115 -2.347 -8.478 -6.520 1.00 11.21 N ATOM 1905 CE2 TRP A 115 -1.734 -9.207 -5.538 1.00 63.31 C ATOM 1906 CE3 TRP A 115 -1.830 -9.424 -3.134 1.00 30.35 C ATOM 1907 CZ2 TRP A 115 -0.736 -10.173 -5.628 1.00 74.24 C ATOM 1908 CZ3 TRP A 115 -0.840 -10.381 -3.224 1.00 3.53 C ATOM 1909 CH2 TRP A 115 -0.302 -10.745 -4.464 1.00 2.10 C ATOM 0 H TRP A 115 -5.492 -5.497 -2.176 1.00 24.45 H new ATOM 0 HA TRP A 115 -4.857 -5.600 -4.939 1.00 15.35 H new ATOM 0 HB2 TRP A 115 -3.516 -6.474 -2.938 1.00 72.52 H new ATOM 0 HB3 TRP A 115 -4.612 -7.841 -2.895 1.00 72.52 H new ATOM 0 HD1 TRP A 115 -3.870 -6.921 -6.487 1.00 64.30 H new ATOM 0 HE1 TRP A 115 -2.154 -8.551 -7.519 1.00 11.21 H new ATOM 0 HE3 TRP A 115 -2.239 -9.146 -2.174 1.00 30.35 H new ATOM 0 HZ2 TRP A 115 -0.320 -10.460 -6.582 1.00 74.24 H new ATOM 0 HZ3 TRP A 115 -0.475 -10.856 -2.325 1.00 3.53 H new ATOM 0 HH2 TRP A 115 0.474 -11.495 -4.502 1.00 2.10 H new ATOM 1920 N ALA A 116 -7.246 -7.695 -3.904 1.00 21.43 N ATOM 1921 CA ALA A 116 -8.404 -8.522 -4.324 1.00 43.44 C ATOM 1922 C ALA A 116 -9.416 -7.737 -5.198 1.00 20.53 C ATOM 1923 O ALA A 116 -9.961 -8.280 -6.164 1.00 0.54 O ATOM 1924 CB ALA A 116 -9.104 -9.105 -3.093 1.00 71.43 C ATOM 0 H ALA A 116 -7.138 -7.633 -2.892 1.00 21.43 H new ATOM 0 HA ALA A 116 -8.014 -9.330 -4.943 1.00 43.44 H new ATOM 0 HB1 ALA A 116 -9.953 -9.711 -3.410 1.00 71.43 H new ATOM 0 HB2 ALA A 116 -8.403 -9.726 -2.536 1.00 71.43 H new ATOM 0 HB3 ALA A 116 -9.455 -8.293 -2.456 1.00 71.43 H new ATOM 1930 N GLY A 117 -9.643 -6.455 -4.840 1.00 13.13 N ATOM 1931 CA GLY A 117 -10.494 -5.544 -5.626 1.00 1.40 C ATOM 1932 C GLY A 117 -9.960 -5.282 -7.035 1.00 61.12 C ATOM 1933 O GLY A 117 -10.726 -5.262 -8.010 1.00 24.14 O ATOM 0 H GLY A 117 -9.244 -6.028 -4.004 1.00 13.13 H new ATOM 0 HA2 GLY A 117 -11.497 -5.966 -5.698 1.00 1.40 H new ATOM 0 HA3 GLY A 117 -10.584 -4.595 -5.097 1.00 1.40 H new ATOM 1937 N HIS A 118 -8.630 -5.090 -7.129 1.00 44.15 N ATOM 1938 CA HIS A 118 -7.915 -4.979 -8.415 1.00 15.10 C ATOM 1939 C HIS A 118 -8.095 -6.257 -9.270 1.00 42.15 C ATOM 1940 O HIS A 118 -8.511 -6.183 -10.426 1.00 22.54 O ATOM 1941 CB HIS A 118 -6.406 -4.718 -8.159 1.00 34.13 C ATOM 1942 CG HIS A 118 -5.546 -4.740 -9.403 1.00 12.24 C ATOM 1943 ND1 HIS A 118 -5.521 -3.712 -10.322 1.00 4.34 N ATOM 1944 CD2 HIS A 118 -4.677 -5.675 -9.881 1.00 72.54 C ATOM 1945 CE1 HIS A 118 -4.689 -4.008 -11.298 1.00 24.45 C ATOM 1946 NE2 HIS A 118 -4.166 -5.187 -11.053 1.00 34.54 N ATOM 0 H HIS A 118 -8.021 -5.007 -6.315 1.00 44.15 H new ATOM 0 HA HIS A 118 -8.339 -4.141 -8.969 1.00 15.10 H new ATOM 0 HB2 HIS A 118 -6.295 -3.749 -7.673 1.00 34.13 H new ATOM 0 HB3 HIS A 118 -6.034 -5.468 -7.462 1.00 34.13 H new ATOM 0 HD2 HIS A 118 -4.437 -6.622 -9.421 1.00 72.54 H new ATOM 0 HE1 HIS A 118 -4.473 -3.387 -12.155 1.00 24.45 H new ATOM 0 HE2 HIS A 118 -3.485 -5.665 -11.644 1.00 34.54 H new ATOM 1955 N LEU A 119 -7.803 -7.418 -8.658 1.00 65.13 N ATOM 1956 CA LEU A 119 -7.765 -8.724 -9.344 1.00 40.32 C ATOM 1957 C LEU A 119 -9.156 -9.130 -9.895 1.00 35.04 C ATOM 1958 O LEU A 119 -9.253 -9.636 -11.009 1.00 74.42 O ATOM 1959 CB LEU A 119 -7.224 -9.800 -8.370 1.00 4.33 C ATOM 1960 CG LEU A 119 -5.772 -9.588 -7.839 1.00 45.31 C ATOM 1961 CD1 LEU A 119 -5.409 -10.609 -6.738 1.00 4.30 C ATOM 1962 CD2 LEU A 119 -4.743 -9.613 -8.986 1.00 64.12 C ATOM 0 H LEU A 119 -7.584 -7.478 -7.663 1.00 65.13 H new ATOM 0 HA LEU A 119 -7.098 -8.641 -10.202 1.00 40.32 H new ATOM 0 HB2 LEU A 119 -7.896 -9.855 -7.514 1.00 4.33 H new ATOM 0 HB3 LEU A 119 -7.267 -10.767 -8.871 1.00 4.33 H new ATOM 0 HG LEU A 119 -5.738 -8.597 -7.386 1.00 45.31 H new ATOM 0 HD11 LEU A 119 -4.390 -10.428 -6.395 1.00 4.30 H new ATOM 0 HD12 LEU A 119 -6.098 -10.502 -5.901 1.00 4.30 H new ATOM 0 HD13 LEU A 119 -5.482 -11.619 -7.140 1.00 4.30 H new ATOM 0 HD21 LEU A 119 -3.742 -9.462 -8.581 1.00 64.12 H new ATOM 0 HD22 LEU A 119 -4.787 -10.576 -9.494 1.00 64.12 H new ATOM 0 HD23 LEU A 119 -4.970 -8.818 -9.696 1.00 64.12 H new ATOM 1974 N GLU A 120 -10.220 -8.883 -9.105 1.00 53.10 N ATOM 1975 CA GLU A 120 -11.629 -9.064 -9.545 1.00 15.33 C ATOM 1976 C GLU A 120 -11.913 -8.300 -10.859 1.00 22.32 C ATOM 1977 O GLU A 120 -12.454 -8.863 -11.812 1.00 15.43 O ATOM 1978 CB GLU A 120 -12.597 -8.570 -8.440 1.00 43.41 C ATOM 1979 CG GLU A 120 -14.090 -8.517 -8.856 1.00 54.35 C ATOM 1980 CD GLU A 120 -15.014 -8.003 -7.744 1.00 2.31 C ATOM 1981 OE1 GLU A 120 -15.013 -6.777 -7.480 1.00 20.32 O ATOM 1982 OE2 GLU A 120 -15.735 -8.813 -7.125 1.00 22.04 O ATOM 0 H GLU A 120 -10.133 -8.553 -8.144 1.00 53.10 H new ATOM 0 HA GLU A 120 -11.787 -10.127 -9.726 1.00 15.33 H new ATOM 0 HB2 GLU A 120 -12.499 -9.223 -7.573 1.00 43.41 H new ATOM 0 HB3 GLU A 120 -12.287 -7.574 -8.125 1.00 43.41 H new ATOM 0 HG2 GLU A 120 -14.193 -7.874 -9.730 1.00 54.35 H new ATOM 0 HG3 GLU A 120 -14.412 -9.515 -9.154 1.00 54.35 H new ATOM 1989 N ALA A 121 -11.492 -7.019 -10.889 1.00 32.51 N ATOM 1990 CA ALA A 121 -11.668 -6.120 -12.052 1.00 32.32 C ATOM 1991 C ALA A 121 -10.840 -6.573 -13.292 1.00 1.12 C ATOM 1992 O ALA A 121 -11.083 -6.105 -14.409 1.00 2.33 O ATOM 1993 CB ALA A 121 -11.308 -4.684 -11.638 1.00 35.21 C ATOM 0 H ALA A 121 -11.017 -6.575 -10.103 1.00 32.51 H new ATOM 0 HA ALA A 121 -12.713 -6.163 -12.358 1.00 32.32 H new ATOM 0 HB1 ALA A 121 -11.436 -4.017 -12.490 1.00 35.21 H new ATOM 0 HB2 ALA A 121 -11.962 -4.365 -10.826 1.00 35.21 H new ATOM 0 HB3 ALA A 121 -10.271 -4.651 -11.303 1.00 35.21 H new ATOM 1999 N GLN A 122 -9.858 -7.473 -13.073 1.00 33.22 N ATOM 2000 CA GLN A 122 -9.047 -8.092 -14.154 1.00 71.42 C ATOM 2001 C GLN A 122 -9.623 -9.469 -14.585 1.00 44.12 C ATOM 2002 O GLN A 122 -9.455 -9.884 -15.732 1.00 30.01 O ATOM 2003 CB GLN A 122 -7.567 -8.267 -13.688 1.00 11.22 C ATOM 2004 CG GLN A 122 -6.924 -6.995 -13.099 1.00 21.35 C ATOM 2005 CD GLN A 122 -6.924 -5.786 -14.043 1.00 72.13 C ATOM 2006 OE1 GLN A 122 -6.810 -5.912 -15.258 1.00 34.52 O ATOM 2007 NE2 GLN A 122 -7.080 -4.602 -13.490 1.00 32.44 N ATOM 0 H GLN A 122 -9.601 -7.795 -12.140 1.00 33.22 H new ATOM 0 HA GLN A 122 -9.083 -7.423 -15.014 1.00 71.42 H new ATOM 0 HB2 GLN A 122 -7.527 -9.058 -12.939 1.00 11.22 H new ATOM 0 HB3 GLN A 122 -6.970 -8.600 -14.537 1.00 11.22 H new ATOM 0 HG2 GLN A 122 -7.453 -6.726 -12.185 1.00 21.35 H new ATOM 0 HG3 GLN A 122 -5.895 -7.220 -12.818 1.00 21.35 H new ATOM 0 HE21 GLN A 122 -7.173 -4.520 -12.478 1.00 32.44 H new ATOM 0 HE22 GLN A 122 -7.108 -3.766 -14.074 1.00 32.44 H new ATOM 2016 N GLY A 123 -10.291 -10.169 -13.647 1.00 33.01 N ATOM 2017 CA GLY A 123 -10.778 -11.549 -13.870 1.00 21.23 C ATOM 2018 C GLY A 123 -10.052 -12.585 -13.006 1.00 60.04 C ATOM 2019 O GLY A 123 -10.359 -13.774 -13.059 1.00 71.43 O ATOM 0 H GLY A 123 -10.508 -9.800 -12.721 1.00 33.01 H new ATOM 0 HA2 GLY A 123 -11.846 -11.591 -13.657 1.00 21.23 H new ATOM 0 HA3 GLY A 123 -10.652 -11.808 -14.921 1.00 21.23 H new ATOM 2023 N GLU A 124 -9.078 -12.115 -12.211 1.00 22.21 N ATOM 2024 CA GLU A 124 -8.332 -12.934 -11.224 1.00 55.13 C ATOM 2025 C GLU A 124 -9.137 -13.114 -9.905 1.00 42.10 C ATOM 2026 O GLU A 124 -8.625 -12.865 -8.821 1.00 65.45 O ATOM 2027 CB GLU A 124 -6.946 -12.277 -10.937 1.00 32.30 C ATOM 2028 CG GLU A 124 -5.904 -12.405 -12.055 1.00 52.12 C ATOM 2029 CD GLU A 124 -5.296 -13.818 -12.142 1.00 44.22 C ATOM 2030 OE1 GLU A 124 -5.853 -14.687 -12.843 1.00 45.32 O ATOM 2031 OE2 GLU A 124 -4.254 -14.066 -11.496 1.00 52.41 O ATOM 0 H GLU A 124 -8.777 -11.141 -12.231 1.00 22.21 H new ATOM 0 HA GLU A 124 -8.179 -13.926 -11.648 1.00 55.13 H new ATOM 0 HB2 GLU A 124 -7.102 -11.218 -10.731 1.00 32.30 H new ATOM 0 HB3 GLU A 124 -6.535 -12.721 -10.030 1.00 32.30 H new ATOM 0 HG2 GLU A 124 -6.368 -12.154 -13.009 1.00 52.12 H new ATOM 0 HG3 GLU A 124 -5.107 -11.681 -11.888 1.00 52.12 H new ATOM 2038 N LEU A 125 -10.395 -13.565 -10.026 1.00 64.31 N ATOM 2039 CA LEU A 125 -11.294 -13.858 -8.886 1.00 54.44 C ATOM 2040 C LEU A 125 -10.738 -14.974 -7.961 1.00 4.10 C ATOM 2041 O LEU A 125 -10.773 -14.840 -6.739 1.00 14.42 O ATOM 2042 CB LEU A 125 -12.693 -14.248 -9.438 1.00 31.13 C ATOM 2043 CG LEU A 125 -13.541 -13.075 -10.023 1.00 3.31 C ATOM 2044 CD1 LEU A 125 -14.707 -13.580 -10.898 1.00 34.32 C ATOM 2045 CD2 LEU A 125 -14.055 -12.169 -8.889 1.00 75.21 C ATOM 0 H LEU A 125 -10.829 -13.741 -10.932 1.00 64.31 H new ATOM 0 HA LEU A 125 -11.369 -12.961 -8.271 1.00 54.44 H new ATOM 0 HB2 LEU A 125 -12.560 -14.999 -10.217 1.00 31.13 H new ATOM 0 HB3 LEU A 125 -13.262 -14.718 -8.636 1.00 31.13 H new ATOM 0 HG LEU A 125 -12.889 -12.490 -10.672 1.00 3.31 H new ATOM 0 HD11 LEU A 125 -15.268 -12.729 -11.283 1.00 34.32 H new ATOM 0 HD12 LEU A 125 -14.312 -14.160 -11.732 1.00 34.32 H new ATOM 0 HD13 LEU A 125 -15.366 -14.208 -10.299 1.00 34.32 H new ATOM 0 HD21 LEU A 125 -14.645 -11.356 -9.312 1.00 75.21 H new ATOM 0 HD22 LEU A 125 -14.677 -12.753 -8.210 1.00 75.21 H new ATOM 0 HD23 LEU A 125 -13.208 -11.756 -8.341 1.00 75.21 H new ATOM 2057 N GLN A 126 -10.220 -16.065 -8.554 1.00 53.45 N ATOM 2058 CA GLN A 126 -9.658 -17.204 -7.785 1.00 62.42 C ATOM 2059 C GLN A 126 -8.368 -16.797 -7.024 1.00 41.32 C ATOM 2060 O GLN A 126 -8.169 -17.182 -5.867 1.00 54.44 O ATOM 2061 CB GLN A 126 -9.384 -18.407 -8.728 1.00 22.20 C ATOM 2062 CG GLN A 126 -10.621 -18.925 -9.498 1.00 23.31 C ATOM 2063 CD GLN A 126 -11.751 -19.412 -8.581 1.00 32.22 C ATOM 2064 OE1 GLN A 126 -11.793 -20.574 -8.195 1.00 64.23 O ATOM 2065 NE2 GLN A 126 -12.684 -18.539 -8.233 1.00 54.31 N ATOM 0 H GLN A 126 -10.176 -16.187 -9.566 1.00 53.45 H new ATOM 0 HA GLN A 126 -10.396 -17.503 -7.040 1.00 62.42 H new ATOM 0 HB2 GLN A 126 -8.620 -18.118 -9.449 1.00 22.20 H new ATOM 0 HB3 GLN A 126 -8.972 -19.226 -8.138 1.00 22.20 H new ATOM 0 HG2 GLN A 126 -11.001 -18.129 -10.138 1.00 23.31 H new ATOM 0 HG3 GLN A 126 -10.316 -19.742 -10.152 1.00 23.31 H new ATOM 0 HE21 GLN A 126 -12.631 -17.576 -8.565 1.00 54.31 H new ATOM 0 HE22 GLN A 126 -13.456 -18.830 -7.633 1.00 54.31 H new ATOM 2074 N HIS A 127 -7.517 -15.988 -7.692 1.00 35.24 N ATOM 2075 CA HIS A 127 -6.269 -15.457 -7.100 1.00 21.31 C ATOM 2076 C HIS A 127 -6.573 -14.404 -6.001 1.00 44.21 C ATOM 2077 O HIS A 127 -5.880 -14.340 -4.993 1.00 33.20 O ATOM 2078 CB HIS A 127 -5.361 -14.855 -8.205 1.00 74.04 C ATOM 2079 CG HIS A 127 -4.060 -14.265 -7.700 1.00 34.54 C ATOM 2080 ND1 HIS A 127 -3.578 -13.039 -8.104 1.00 22.32 N ATOM 2081 CD2 HIS A 127 -3.148 -14.734 -6.805 1.00 23.24 C ATOM 2082 CE1 HIS A 127 -2.445 -12.784 -7.485 1.00 75.13 C ATOM 2083 NE2 HIS A 127 -2.160 -13.791 -6.695 1.00 33.04 N ATOM 0 H HIS A 127 -7.675 -15.685 -8.653 1.00 35.24 H new ATOM 0 HA HIS A 127 -5.738 -16.284 -6.628 1.00 21.31 H new ATOM 0 HB2 HIS A 127 -5.133 -15.633 -8.934 1.00 74.04 H new ATOM 0 HB3 HIS A 127 -5.917 -14.079 -8.731 1.00 74.04 H new ATOM 0 HD2 HIS A 127 -3.195 -15.676 -6.279 1.00 23.24 H new ATOM 0 HE1 HIS A 127 -1.848 -11.892 -7.608 1.00 75.13 H new ATOM 0 HE2 HIS A 127 -1.337 -13.861 -6.096 1.00 33.04 H new ATOM 2092 N ALA A 128 -7.601 -13.582 -6.233 1.00 3.54 N ATOM 2093 CA ALA A 128 -8.065 -12.557 -5.274 1.00 65.25 C ATOM 2094 C ALA A 128 -8.601 -13.179 -3.973 1.00 73.31 C ATOM 2095 O ALA A 128 -8.308 -12.697 -2.878 1.00 64.21 O ATOM 2096 CB ALA A 128 -9.136 -11.704 -5.934 1.00 31.21 C ATOM 0 H ALA A 128 -8.143 -13.604 -7.097 1.00 3.54 H new ATOM 0 HA ALA A 128 -7.211 -11.937 -5.000 1.00 65.25 H new ATOM 0 HB1 ALA A 128 -9.482 -10.946 -5.231 1.00 31.21 H new ATOM 0 HB2 ALA A 128 -8.721 -11.218 -6.817 1.00 31.21 H new ATOM 0 HB3 ALA A 128 -9.974 -12.336 -6.228 1.00 31.21 H new ATOM 2102 N SER A 129 -9.397 -14.246 -4.131 1.00 51.23 N ATOM 2103 CA SER A 129 -9.858 -15.099 -3.016 1.00 4.33 C ATOM 2104 C SER A 129 -8.662 -15.694 -2.246 1.00 53.14 C ATOM 2105 O SER A 129 -8.647 -15.716 -1.011 1.00 75.52 O ATOM 2106 CB SER A 129 -10.730 -16.235 -3.564 1.00 33.23 C ATOM 2107 OG SER A 129 -11.912 -15.731 -4.151 1.00 4.51 O ATOM 0 H SER A 129 -9.744 -14.547 -5.042 1.00 51.23 H new ATOM 0 HA SER A 129 -10.439 -14.483 -2.330 1.00 4.33 H new ATOM 0 HB2 SER A 129 -10.168 -16.805 -4.303 1.00 33.23 H new ATOM 0 HB3 SER A 129 -10.985 -16.923 -2.758 1.00 33.23 H new ATOM 0 HG SER A 129 -11.710 -15.382 -5.044 1.00 4.51 H new ATOM 2113 N ALA A 130 -7.660 -16.156 -3.022 1.00 5.44 N ATOM 2114 CA ALA A 130 -6.388 -16.687 -2.504 1.00 42.32 C ATOM 2115 C ALA A 130 -5.602 -15.625 -1.694 1.00 33.23 C ATOM 2116 O ALA A 130 -4.854 -15.972 -0.790 1.00 32.24 O ATOM 2117 CB ALA A 130 -5.537 -17.242 -3.661 1.00 54.54 C ATOM 0 H ALA A 130 -7.715 -16.170 -4.040 1.00 5.44 H new ATOM 0 HA ALA A 130 -6.620 -17.500 -1.816 1.00 42.32 H new ATOM 0 HB1 ALA A 130 -4.598 -17.632 -3.268 1.00 54.54 H new ATOM 0 HB2 ALA A 130 -6.081 -18.043 -4.162 1.00 54.54 H new ATOM 0 HB3 ALA A 130 -5.328 -16.444 -4.374 1.00 54.54 H new ATOM 2123 N VAL A 131 -5.786 -14.334 -2.025 1.00 71.22 N ATOM 2124 CA VAL A 131 -5.185 -13.201 -1.272 1.00 52.13 C ATOM 2125 C VAL A 131 -5.973 -12.907 0.036 1.00 64.52 C ATOM 2126 O VAL A 131 -5.379 -12.681 1.093 1.00 13.31 O ATOM 2127 CB VAL A 131 -5.113 -11.910 -2.183 1.00 24.33 C ATOM 2128 CG1 VAL A 131 -4.678 -10.649 -1.394 1.00 72.11 C ATOM 2129 CG2 VAL A 131 -4.187 -12.160 -3.401 1.00 45.22 C ATOM 0 H VAL A 131 -6.354 -14.040 -2.820 1.00 71.22 H new ATOM 0 HA VAL A 131 -4.172 -13.486 -0.990 1.00 52.13 H new ATOM 0 HB VAL A 131 -6.122 -11.712 -2.546 1.00 24.33 H new ATOM 0 HG11 VAL A 131 -4.645 -9.792 -2.067 1.00 72.11 H new ATOM 0 HG12 VAL A 131 -5.393 -10.455 -0.595 1.00 72.11 H new ATOM 0 HG13 VAL A 131 -3.689 -10.811 -0.965 1.00 72.11 H new ATOM 0 HG21 VAL A 131 -4.148 -11.263 -4.018 1.00 45.22 H new ATOM 0 HG22 VAL A 131 -3.184 -12.404 -3.051 1.00 45.22 H new ATOM 0 HG23 VAL A 131 -4.578 -12.989 -3.991 1.00 45.22 H new ATOM 2139 N LEU A 132 -7.309 -12.939 -0.052 1.00 40.33 N ATOM 2140 CA LEU A 132 -8.211 -12.638 1.097 1.00 43.13 C ATOM 2141 C LEU A 132 -8.060 -13.678 2.234 1.00 23.34 C ATOM 2142 O LEU A 132 -8.054 -13.318 3.419 1.00 44.24 O ATOM 2143 CB LEU A 132 -9.689 -12.567 0.624 1.00 62.01 C ATOM 2144 CG LEU A 132 -10.061 -11.373 -0.304 1.00 2.34 C ATOM 2145 CD1 LEU A 132 -11.525 -11.474 -0.803 1.00 61.33 C ATOM 2146 CD2 LEU A 132 -9.799 -10.018 0.400 1.00 45.32 C ATOM 0 H LEU A 132 -7.806 -13.172 -0.912 1.00 40.33 H new ATOM 0 HA LEU A 132 -7.919 -11.667 1.496 1.00 43.13 H new ATOM 0 HB2 LEU A 132 -9.925 -13.493 0.101 1.00 62.01 H new ATOM 0 HB3 LEU A 132 -10.329 -12.527 1.506 1.00 62.01 H new ATOM 0 HG LEU A 132 -9.415 -11.424 -1.181 1.00 2.34 H new ATOM 0 HD11 LEU A 132 -11.749 -10.624 -1.448 1.00 61.33 H new ATOM 0 HD12 LEU A 132 -11.655 -12.399 -1.364 1.00 61.33 H new ATOM 0 HD13 LEU A 132 -12.202 -11.470 0.051 1.00 61.33 H new ATOM 0 HD21 LEU A 132 -10.067 -9.202 -0.271 1.00 45.32 H new ATOM 0 HD22 LEU A 132 -10.402 -9.956 1.306 1.00 45.32 H new ATOM 0 HD23 LEU A 132 -8.743 -9.941 0.660 1.00 45.32 H new ATOM 2158 N GLN A 133 -7.914 -14.964 1.850 1.00 73.02 N ATOM 2159 CA GLN A 133 -7.680 -16.064 2.813 1.00 30.44 C ATOM 2160 C GLN A 133 -6.287 -15.945 3.480 1.00 33.13 C ATOM 2161 O GLN A 133 -6.125 -16.358 4.630 1.00 44.33 O ATOM 2162 CB GLN A 133 -7.824 -17.456 2.148 1.00 42.45 C ATOM 2163 CG GLN A 133 -6.868 -17.700 0.977 1.00 51.51 C ATOM 2164 CD GLN A 133 -6.887 -19.138 0.459 1.00 32.51 C ATOM 2165 OE1 GLN A 133 -7.678 -19.494 -0.411 1.00 74.41 O ATOM 2166 NE2 GLN A 133 -6.005 -19.975 0.981 1.00 50.05 N ATOM 0 H GLN A 133 -7.954 -15.268 0.877 1.00 73.02 H new ATOM 0 HA GLN A 133 -8.447 -15.971 3.581 1.00 30.44 H new ATOM 0 HB2 GLN A 133 -7.658 -18.225 2.903 1.00 42.45 H new ATOM 0 HB3 GLN A 133 -8.849 -17.572 1.795 1.00 42.45 H new ATOM 0 HG2 GLN A 133 -7.127 -17.026 0.161 1.00 51.51 H new ATOM 0 HG3 GLN A 133 -5.854 -17.449 1.288 1.00 51.51 H new ATOM 0 HE21 GLN A 133 -5.360 -19.652 1.702 1.00 50.05 H new ATOM 0 HE22 GLN A 133 -5.970 -20.943 0.662 1.00 50.05 H new ATOM 2175 N ARG A 134 -5.291 -15.377 2.742 1.00 34.24 N ATOM 2176 CA ARG A 134 -3.949 -15.073 3.301 1.00 51.04 C ATOM 2177 C ARG A 134 -4.073 -14.103 4.486 1.00 11.44 C ATOM 2178 O ARG A 134 -3.452 -14.308 5.516 1.00 20.01 O ATOM 2179 CB ARG A 134 -2.990 -14.477 2.236 1.00 32.21 C ATOM 2180 CG ARG A 134 -2.522 -15.470 1.160 1.00 74.23 C ATOM 2181 CD ARG A 134 -1.610 -14.817 0.096 1.00 1.22 C ATOM 2182 NE ARG A 134 -0.859 -15.811 -0.703 1.00 65.13 N ATOM 2183 CZ ARG A 134 -1.274 -16.409 -1.799 1.00 74.52 C ATOM 2184 NH1 ARG A 134 -2.457 -16.204 -2.279 1.00 2.10 N ATOM 2185 NH2 ARG A 134 -0.488 -17.230 -2.409 1.00 24.44 N ATOM 0 H ARG A 134 -5.396 -15.122 1.760 1.00 34.24 H new ATOM 0 HA ARG A 134 -3.522 -16.017 3.640 1.00 51.04 H new ATOM 0 HB2 ARG A 134 -3.489 -13.641 1.746 1.00 32.21 H new ATOM 0 HB3 ARG A 134 -2.114 -14.073 2.743 1.00 32.21 H new ATOM 0 HG2 ARG A 134 -1.985 -16.290 1.638 1.00 74.23 H new ATOM 0 HG3 ARG A 134 -3.393 -15.903 0.668 1.00 74.23 H new ATOM 0 HD2 ARG A 134 -2.218 -14.206 -0.571 1.00 1.22 H new ATOM 0 HD3 ARG A 134 -0.906 -14.147 0.589 1.00 1.22 H new ATOM 0 HE ARG A 134 0.073 -16.057 -0.371 1.00 65.13 H new ATOM 0 HH11 ARG A 134 -3.096 -15.565 -1.806 1.00 2.10 H new ATOM 0 HH12 ARG A 134 -2.752 -16.682 -3.131 1.00 2.10 H new ATOM 0 HH21 ARG A 134 0.446 -17.411 -2.041 1.00 24.44 H new ATOM 0 HH22 ARG A 134 -0.800 -17.699 -3.259 1.00 24.44 H new ATOM 2199 N GLY A 135 -4.911 -13.063 4.323 1.00 63.44 N ATOM 2200 CA GLY A 135 -5.216 -12.139 5.415 1.00 14.14 C ATOM 2201 C GLY A 135 -5.848 -12.817 6.636 1.00 10.51 C ATOM 2202 O GLY A 135 -5.393 -12.626 7.758 1.00 2.11 O ATOM 0 H GLY A 135 -5.385 -12.847 3.446 1.00 63.44 H new ATOM 0 HA2 GLY A 135 -4.298 -11.638 5.723 1.00 14.14 H new ATOM 0 HA3 GLY A 135 -5.893 -11.367 5.048 1.00 14.14 H new ATOM 2206 N ILE A 136 -6.892 -13.624 6.384 1.00 13.50 N ATOM 2207 CA ILE A 136 -7.652 -14.355 7.427 1.00 20.02 C ATOM 2208 C ILE A 136 -6.742 -15.277 8.294 1.00 12.44 C ATOM 2209 O ILE A 136 -6.844 -15.270 9.521 1.00 22.30 O ATOM 2210 CB ILE A 136 -8.828 -15.170 6.752 1.00 41.41 C ATOM 2211 CG1 ILE A 136 -9.891 -14.176 6.169 1.00 22.30 C ATOM 2212 CG2 ILE A 136 -9.476 -16.194 7.723 1.00 52.41 C ATOM 2213 CD1 ILE A 136 -10.961 -14.796 5.291 1.00 3.31 C ATOM 0 H ILE A 136 -7.241 -13.793 5.441 1.00 13.50 H new ATOM 0 HA ILE A 136 -8.074 -13.621 8.113 1.00 20.02 H new ATOM 0 HB ILE A 136 -8.406 -15.757 5.936 1.00 41.41 H new ATOM 0 HG12 ILE A 136 -10.379 -13.667 7.000 1.00 22.30 H new ATOM 0 HG13 ILE A 136 -9.369 -13.414 5.590 1.00 22.30 H new ATOM 0 HG21 ILE A 136 -10.277 -16.726 7.209 1.00 52.41 H new ATOM 0 HG22 ILE A 136 -8.722 -16.907 8.056 1.00 52.41 H new ATOM 0 HG23 ILE A 136 -9.885 -15.669 8.586 1.00 52.41 H new ATOM 0 HD11 ILE A 136 -11.642 -14.019 4.943 1.00 3.31 H new ATOM 0 HD12 ILE A 136 -10.493 -15.279 4.433 1.00 3.31 H new ATOM 0 HD13 ILE A 136 -11.519 -15.536 5.865 1.00 3.31 H new ATOM 2225 N GLN A 137 -5.833 -16.037 7.646 1.00 42.01 N ATOM 2226 CA GLN A 137 -4.887 -16.946 8.358 1.00 3.13 C ATOM 2227 C GLN A 137 -3.726 -16.166 9.038 1.00 31.11 C ATOM 2228 O GLN A 137 -3.238 -16.576 10.097 1.00 5.41 O ATOM 2229 CB GLN A 137 -4.331 -18.022 7.387 1.00 30.25 C ATOM 2230 CG GLN A 137 -3.548 -17.450 6.198 1.00 12.23 C ATOM 2231 CD GLN A 137 -3.124 -18.494 5.165 1.00 21.04 C ATOM 2232 OE1 GLN A 137 -2.052 -19.082 5.248 1.00 73.12 O ATOM 2233 NE2 GLN A 137 -3.970 -18.738 4.191 1.00 42.44 N ATOM 0 H GLN A 137 -5.728 -16.044 6.631 1.00 42.01 H new ATOM 0 HA GLN A 137 -5.448 -17.443 9.150 1.00 3.13 H new ATOM 0 HB2 GLN A 137 -3.682 -18.698 7.944 1.00 30.25 H new ATOM 0 HB3 GLN A 137 -5.161 -18.618 7.008 1.00 30.25 H new ATOM 0 HG2 GLN A 137 -4.160 -16.695 5.704 1.00 12.23 H new ATOM 0 HG3 GLN A 137 -2.658 -16.944 6.573 1.00 12.23 H new ATOM 0 HE21 GLN A 137 -4.855 -18.234 4.146 1.00 42.44 H new ATOM 0 HE22 GLN A 137 -3.742 -19.432 3.479 1.00 42.44 H new ATOM 2242 N ASN A 138 -3.295 -15.038 8.425 1.00 54.02 N ATOM 2243 CA ASN A 138 -2.262 -14.141 9.014 1.00 31.32 C ATOM 2244 C ASN A 138 -2.844 -13.272 10.151 1.00 11.25 C ATOM 2245 O ASN A 138 -2.083 -12.613 10.854 1.00 32.44 O ATOM 2246 CB ASN A 138 -1.623 -13.226 7.926 1.00 0.23 C ATOM 2247 CG ASN A 138 -0.761 -13.993 6.920 1.00 52.32 C ATOM 2248 OD1 ASN A 138 -0.128 -14.989 7.252 1.00 55.12 O ATOM 2249 ND2 ASN A 138 -0.737 -13.545 5.679 1.00 61.24 N ATOM 0 H ASN A 138 -3.646 -14.724 7.520 1.00 54.02 H new ATOM 0 HA ASN A 138 -1.487 -14.783 9.433 1.00 31.32 H new ATOM 0 HB2 ASN A 138 -2.415 -12.702 7.391 1.00 0.23 H new ATOM 0 HB3 ASN A 138 -1.012 -12.466 8.413 1.00 0.23 H new ATOM 0 HD21 ASN A 138 -0.184 -14.030 4.972 1.00 61.24 H new ATOM 0 HD22 ASN A 138 -1.272 -12.714 5.426 1.00 61.24 H new ATOM 2256 N GLN A 139 -4.195 -13.283 10.306 1.00 64.41 N ATOM 2257 CA GLN A 139 -4.920 -12.515 11.351 1.00 20.11 C ATOM 2258 C GLN A 139 -4.827 -10.984 11.104 1.00 71.30 C ATOM 2259 O GLN A 139 -4.671 -10.191 12.039 1.00 34.03 O ATOM 2260 CB GLN A 139 -4.425 -12.893 12.785 1.00 12.23 C ATOM 2261 CG GLN A 139 -4.615 -14.373 13.187 1.00 24.03 C ATOM 2262 CD GLN A 139 -6.084 -14.782 13.348 1.00 42.45 C ATOM 2263 OE1 GLN A 139 -6.668 -14.647 14.420 1.00 1.11 O ATOM 2264 NE2 GLN A 139 -6.690 -15.297 12.303 1.00 30.42 N ATOM 0 H GLN A 139 -4.814 -13.828 9.706 1.00 64.41 H new ATOM 0 HA GLN A 139 -5.972 -12.791 11.284 1.00 20.11 H new ATOM 0 HB2 GLN A 139 -3.366 -12.647 12.861 1.00 12.23 H new ATOM 0 HB3 GLN A 139 -4.950 -12.268 13.508 1.00 12.23 H new ATOM 0 HG2 GLN A 139 -4.150 -15.008 12.433 1.00 24.03 H new ATOM 0 HG3 GLN A 139 -4.091 -14.556 14.125 1.00 24.03 H new ATOM 0 HE21 GLN A 139 -6.187 -15.401 11.422 1.00 30.42 H new ATOM 0 HE22 GLN A 139 -7.663 -15.593 12.373 1.00 30.42 H new ATOM 2273 N ALA A 140 -4.979 -10.583 9.833 1.00 74.35 N ATOM 2274 CA ALA A 140 -4.877 -9.173 9.414 1.00 53.13 C ATOM 2275 C ALA A 140 -6.108 -8.348 9.852 1.00 51.12 C ATOM 2276 O ALA A 140 -7.231 -8.648 9.464 1.00 70.20 O ATOM 2277 CB ALA A 140 -4.659 -9.085 7.900 1.00 63.12 C ATOM 0 H ALA A 140 -5.176 -11.225 9.065 1.00 74.35 H new ATOM 0 HA ALA A 140 -4.013 -8.737 9.916 1.00 53.13 H new ATOM 0 HB1 ALA A 140 -4.585 -8.039 7.603 1.00 63.12 H new ATOM 0 HB2 ALA A 140 -3.738 -9.603 7.634 1.00 63.12 H new ATOM 0 HB3 ALA A 140 -5.499 -9.550 7.384 1.00 63.12 H new ATOM 2283 N GLU A 141 -5.867 -7.305 10.660 1.00 21.34 N ATOM 2284 CA GLU A 141 -6.935 -6.473 11.253 1.00 50.15 C ATOM 2285 C GLU A 141 -7.388 -5.327 10.308 1.00 22.02 C ATOM 2286 O GLU A 141 -6.541 -4.677 9.685 1.00 4.15 O ATOM 2287 CB GLU A 141 -6.452 -5.908 12.618 1.00 15.33 C ATOM 2288 CG GLU A 141 -6.313 -6.969 13.732 1.00 73.21 C ATOM 2289 CD GLU A 141 -7.660 -7.439 14.336 1.00 64.15 C ATOM 2290 OE1 GLU A 141 -8.527 -7.948 13.596 1.00 73.03 O ATOM 2291 OE2 GLU A 141 -7.864 -7.302 15.564 1.00 41.22 O ATOM 0 H GLU A 141 -4.927 -7.011 10.924 1.00 21.34 H new ATOM 0 HA GLU A 141 -7.808 -7.107 11.408 1.00 50.15 H new ATOM 0 HB2 GLU A 141 -5.488 -5.420 12.475 1.00 15.33 H new ATOM 0 HB3 GLU A 141 -7.152 -5.141 12.949 1.00 15.33 H new ATOM 0 HG2 GLU A 141 -5.787 -7.835 13.330 1.00 73.21 H new ATOM 0 HG3 GLU A 141 -5.693 -6.562 14.530 1.00 73.21 H new ATOM 2298 N PRO A 142 -8.737 -5.051 10.177 1.00 53.24 N ATOM 2299 CA PRO A 142 -9.838 -5.863 10.796 1.00 14.15 C ATOM 2300 C PRO A 142 -10.102 -7.236 10.084 1.00 23.12 C ATOM 2301 O PRO A 142 -10.444 -7.285 8.895 1.00 3.41 O ATOM 2302 CB PRO A 142 -11.064 -4.921 10.697 1.00 41.34 C ATOM 2303 CG PRO A 142 -10.780 -4.028 9.523 1.00 74.41 C ATOM 2304 CD PRO A 142 -9.275 -3.858 9.460 1.00 70.34 C ATOM 0 HA PRO A 142 -9.590 -6.163 11.814 1.00 14.15 H new ATOM 0 HB2 PRO A 142 -11.984 -5.486 10.548 1.00 41.34 H new ATOM 0 HB3 PRO A 142 -11.190 -4.341 11.611 1.00 41.34 H new ATOM 0 HG2 PRO A 142 -11.159 -4.469 8.601 1.00 74.41 H new ATOM 0 HG3 PRO A 142 -11.274 -3.064 9.642 1.00 74.41 H new ATOM 0 HD2 PRO A 142 -8.922 -3.821 8.429 1.00 70.34 H new ATOM 0 HD3 PRO A 142 -8.959 -2.931 9.938 1.00 70.34 H new ATOM 2312 N ARG A 143 -9.932 -8.340 10.850 1.00 43.04 N ATOM 2313 CA ARG A 143 -10.197 -9.737 10.395 1.00 0.40 C ATOM 2314 C ARG A 143 -11.654 -9.935 9.921 1.00 55.44 C ATOM 2315 O ARG A 143 -11.900 -10.599 8.912 1.00 22.31 O ATOM 2316 CB ARG A 143 -9.890 -10.726 11.552 1.00 1.32 C ATOM 2317 CG ARG A 143 -8.393 -10.937 11.835 1.00 51.15 C ATOM 2318 CD ARG A 143 -8.137 -11.698 13.154 1.00 32.40 C ATOM 2319 NE ARG A 143 -8.349 -10.841 14.331 1.00 71.40 N ATOM 2320 CZ ARG A 143 -7.994 -11.133 15.565 1.00 12.32 C ATOM 2321 NH1 ARG A 143 -7.525 -12.301 15.884 1.00 54.14 N ATOM 2322 NH2 ARG A 143 -8.117 -10.236 16.481 1.00 31.41 N ATOM 0 H ARG A 143 -9.603 -8.291 11.814 1.00 43.04 H new ATOM 0 HA ARG A 143 -9.546 -9.933 9.543 1.00 0.40 H new ATOM 0 HB2 ARG A 143 -10.370 -10.362 12.460 1.00 1.32 H new ATOM 0 HB3 ARG A 143 -10.341 -11.690 11.317 1.00 1.32 H new ATOM 0 HG2 ARG A 143 -7.946 -11.490 11.009 1.00 51.15 H new ATOM 0 HG3 ARG A 143 -7.895 -9.968 11.877 1.00 51.15 H new ATOM 0 HD2 ARG A 143 -8.800 -12.562 13.209 1.00 32.40 H new ATOM 0 HD3 ARG A 143 -7.116 -12.079 13.161 1.00 32.40 H new ATOM 0 HE ARG A 143 -8.810 -9.944 14.178 1.00 71.40 H new ATOM 0 HH11 ARG A 143 -7.423 -13.022 15.170 1.00 54.14 H new ATOM 0 HH12 ARG A 143 -7.258 -12.497 16.849 1.00 54.14 H new ATOM 0 HH21 ARG A 143 -8.485 -9.314 16.246 1.00 31.41 H new ATOM 0 HH22 ARG A 143 -7.846 -10.447 17.441 1.00 31.41 H new ATOM 2336 N GLU A 144 -12.602 -9.356 10.673 1.00 20.34 N ATOM 2337 CA GLU A 144 -14.045 -9.395 10.351 1.00 65.22 C ATOM 2338 C GLU A 144 -14.337 -8.802 8.955 1.00 44.53 C ATOM 2339 O GLU A 144 -15.185 -9.316 8.223 1.00 32.22 O ATOM 2340 CB GLU A 144 -14.830 -8.624 11.442 1.00 13.21 C ATOM 2341 CG GLU A 144 -16.353 -8.524 11.215 1.00 64.13 C ATOM 2342 CD GLU A 144 -17.046 -7.647 12.266 1.00 31.03 C ATOM 2343 OE1 GLU A 144 -16.932 -6.408 12.176 1.00 61.12 O ATOM 2344 OE2 GLU A 144 -17.672 -8.187 13.202 1.00 2.34 O ATOM 0 H GLU A 144 -12.392 -8.843 11.529 1.00 20.34 H new ATOM 0 HA GLU A 144 -14.366 -10.436 10.330 1.00 65.22 H new ATOM 0 HB2 GLU A 144 -14.654 -9.108 12.403 1.00 13.21 H new ATOM 0 HB3 GLU A 144 -14.423 -7.615 11.514 1.00 13.21 H new ATOM 0 HG2 GLU A 144 -16.543 -8.115 10.223 1.00 64.13 H new ATOM 0 HG3 GLU A 144 -16.787 -9.524 11.237 1.00 64.13 H new ATOM 2351 N PHE A 145 -13.598 -7.730 8.592 1.00 3.44 N ATOM 2352 CA PHE A 145 -13.727 -7.084 7.270 1.00 52.42 C ATOM 2353 C PHE A 145 -13.236 -8.020 6.144 1.00 33.20 C ATOM 2354 O PHE A 145 -13.818 -8.050 5.067 1.00 4.12 O ATOM 2355 CB PHE A 145 -12.976 -5.737 7.232 1.00 1.22 C ATOM 2356 CG PHE A 145 -13.273 -4.886 5.997 1.00 71.02 C ATOM 2357 CD1 PHE A 145 -14.580 -4.468 5.726 1.00 63.30 C ATOM 2358 CD2 PHE A 145 -12.264 -4.492 5.120 1.00 51.33 C ATOM 2359 CE1 PHE A 145 -14.864 -3.691 4.620 1.00 64.32 C ATOM 2360 CE2 PHE A 145 -12.553 -3.716 4.012 1.00 70.41 C ATOM 2361 CZ PHE A 145 -13.851 -3.315 3.763 1.00 3.14 C ATOM 0 H PHE A 145 -12.904 -7.294 9.200 1.00 3.44 H new ATOM 0 HA PHE A 145 -14.785 -6.882 7.102 1.00 52.42 H new ATOM 0 HB2 PHE A 145 -13.234 -5.165 8.123 1.00 1.22 H new ATOM 0 HB3 PHE A 145 -11.904 -5.930 7.276 1.00 1.22 H new ATOM 0 HD1 PHE A 145 -15.380 -4.757 6.392 1.00 63.30 H new ATOM 0 HD2 PHE A 145 -11.245 -4.796 5.308 1.00 51.33 H new ATOM 0 HE1 PHE A 145 -15.879 -3.378 4.426 1.00 64.32 H new ATOM 0 HE2 PHE A 145 -11.761 -3.423 3.339 1.00 70.41 H new ATOM 0 HZ PHE A 145 -14.072 -2.708 2.898 1.00 3.14 H new ATOM 2371 N LEU A 146 -12.190 -8.808 6.436 1.00 22.11 N ATOM 2372 CA LEU A 146 -11.676 -9.841 5.510 1.00 4.04 C ATOM 2373 C LEU A 146 -12.711 -10.948 5.273 1.00 41.41 C ATOM 2374 O LEU A 146 -12.910 -11.352 4.140 1.00 21.13 O ATOM 2375 CB LEU A 146 -10.375 -10.470 6.062 1.00 61.55 C ATOM 2376 CG LEU A 146 -9.086 -9.653 5.823 1.00 41.22 C ATOM 2377 CD1 LEU A 146 -7.975 -10.099 6.772 1.00 22.12 C ATOM 2378 CD2 LEU A 146 -8.638 -9.748 4.341 1.00 0.54 C ATOM 0 H LEU A 146 -11.676 -8.751 7.315 1.00 22.11 H new ATOM 0 HA LEU A 146 -11.468 -9.348 4.560 1.00 4.04 H new ATOM 0 HB2 LEU A 146 -10.493 -10.623 7.135 1.00 61.55 H new ATOM 0 HB3 LEU A 146 -10.249 -11.454 5.611 1.00 61.55 H new ATOM 0 HG LEU A 146 -9.302 -8.606 6.036 1.00 41.22 H new ATOM 0 HD11 LEU A 146 -7.078 -9.509 6.584 1.00 22.12 H new ATOM 0 HD12 LEU A 146 -8.297 -9.952 7.803 1.00 22.12 H new ATOM 0 HD13 LEU A 146 -7.757 -11.154 6.606 1.00 22.12 H new ATOM 0 HD21 LEU A 146 -7.728 -9.165 4.198 1.00 0.54 H new ATOM 0 HD22 LEU A 146 -8.445 -10.790 4.085 1.00 0.54 H new ATOM 0 HD23 LEU A 146 -9.425 -9.356 3.697 1.00 0.54 H new ATOM 2390 N GLN A 147 -13.346 -11.435 6.357 1.00 41.34 N ATOM 2391 CA GLN A 147 -14.302 -12.559 6.287 1.00 72.20 C ATOM 2392 C GLN A 147 -15.627 -12.154 5.601 1.00 64.22 C ATOM 2393 O GLN A 147 -16.178 -12.929 4.812 1.00 12.33 O ATOM 2394 CB GLN A 147 -14.571 -13.141 7.701 1.00 3.52 C ATOM 2395 CG GLN A 147 -13.293 -13.520 8.488 1.00 44.21 C ATOM 2396 CD GLN A 147 -13.536 -14.545 9.597 1.00 25.34 C ATOM 2397 OE1 GLN A 147 -13.834 -14.208 10.738 1.00 52.43 O ATOM 2398 NE2 GLN A 147 -13.398 -15.816 9.269 1.00 11.34 N ATOM 0 H GLN A 147 -13.213 -11.065 7.298 1.00 41.34 H new ATOM 0 HA GLN A 147 -13.844 -13.334 5.672 1.00 72.20 H new ATOM 0 HB2 GLN A 147 -15.137 -12.411 8.280 1.00 3.52 H new ATOM 0 HB3 GLN A 147 -15.199 -14.026 7.603 1.00 3.52 H new ATOM 0 HG2 GLN A 147 -12.554 -13.918 7.793 1.00 44.21 H new ATOM 0 HG3 GLN A 147 -12.866 -12.618 8.926 1.00 44.21 H new ATOM 0 HE21 GLN A 147 -13.150 -16.072 8.313 1.00 11.34 H new ATOM 0 HE22 GLN A 147 -13.540 -16.542 9.971 1.00 11.34 H new ATOM 2407 N GLN A 148 -16.128 -10.934 5.905 1.00 64.12 N ATOM 2408 CA GLN A 148 -17.342 -10.395 5.253 1.00 21.20 C ATOM 2409 C GLN A 148 -17.083 -10.110 3.756 1.00 14.35 C ATOM 2410 O GLN A 148 -17.908 -10.442 2.917 1.00 51.54 O ATOM 2411 CB GLN A 148 -17.890 -9.139 5.994 1.00 51.13 C ATOM 2412 CG GLN A 148 -17.046 -7.860 5.868 1.00 60.44 C ATOM 2413 CD GLN A 148 -17.502 -6.739 6.812 1.00 30.40 C ATOM 2414 OE1 GLN A 148 -17.059 -6.646 7.953 1.00 43.04 O ATOM 2415 NE2 GLN A 148 -18.389 -5.883 6.351 1.00 23.52 N ATOM 0 H GLN A 148 -15.712 -10.308 6.594 1.00 64.12 H new ATOM 0 HA GLN A 148 -18.117 -11.158 5.317 1.00 21.20 H new ATOM 0 HB2 GLN A 148 -18.891 -8.928 5.618 1.00 51.13 H new ATOM 0 HB3 GLN A 148 -17.991 -9.381 7.052 1.00 51.13 H new ATOM 0 HG2 GLN A 148 -16.003 -8.099 6.075 1.00 60.44 H new ATOM 0 HG3 GLN A 148 -17.093 -7.502 4.840 1.00 60.44 H new ATOM 0 HE21 GLN A 148 -18.744 -5.979 5.400 1.00 23.52 H new ATOM 0 HE22 GLN A 148 -18.722 -5.124 6.945 1.00 23.52 H new ATOM 2424 N GLN A 149 -15.899 -9.556 3.425 1.00 32.44 N ATOM 2425 CA GLN A 149 -15.506 -9.336 2.020 1.00 32.02 C ATOM 2426 C GLN A 149 -15.190 -10.670 1.313 1.00 15.10 C ATOM 2427 O GLN A 149 -15.387 -10.776 0.118 1.00 15.02 O ATOM 2428 CB GLN A 149 -14.311 -8.353 1.910 1.00 11.31 C ATOM 2429 CG GLN A 149 -14.647 -6.892 2.284 1.00 61.30 C ATOM 2430 CD GLN A 149 -15.677 -6.250 1.352 1.00 22.01 C ATOM 2431 OE1 GLN A 149 -15.330 -5.659 0.335 1.00 30.25 O ATOM 2432 NE2 GLN A 149 -16.948 -6.356 1.687 1.00 34.15 N ATOM 0 H GLN A 149 -15.203 -9.255 4.107 1.00 32.44 H new ATOM 0 HA GLN A 149 -16.356 -8.880 1.513 1.00 32.02 H new ATOM 0 HB2 GLN A 149 -13.507 -8.705 2.557 1.00 11.31 H new ATOM 0 HB3 GLN A 149 -13.931 -8.375 0.888 1.00 11.31 H new ATOM 0 HG2 GLN A 149 -15.025 -6.864 3.306 1.00 61.30 H new ATOM 0 HG3 GLN A 149 -13.732 -6.300 2.266 1.00 61.30 H new ATOM 0 HE21 GLN A 149 -17.211 -6.853 2.538 1.00 34.15 H new ATOM 0 HE22 GLN A 149 -17.668 -5.941 1.095 1.00 34.15 H new ATOM 2441 N TYR A 150 -14.723 -11.682 2.069 1.00 72.04 N ATOM 2442 CA TYR A 150 -14.432 -13.026 1.519 1.00 72.30 C ATOM 2443 C TYR A 150 -15.733 -13.690 1.027 1.00 44.43 C ATOM 2444 O TYR A 150 -15.832 -14.043 -0.136 1.00 23.12 O ATOM 2445 CB TYR A 150 -13.721 -13.936 2.567 1.00 55.33 C ATOM 2446 CG TYR A 150 -13.100 -15.229 1.989 1.00 35.41 C ATOM 2447 CD1 TYR A 150 -11.798 -15.234 1.483 1.00 41.40 C ATOM 2448 CD2 TYR A 150 -13.805 -16.438 1.942 1.00 64.23 C ATOM 2449 CE1 TYR A 150 -11.227 -16.376 0.958 1.00 13.20 C ATOM 2450 CE2 TYR A 150 -13.232 -17.586 1.413 1.00 54.24 C ATOM 2451 CZ TYR A 150 -11.944 -17.547 0.922 1.00 32.50 C ATOM 2452 OH TYR A 150 -11.376 -18.684 0.386 1.00 60.33 O ATOM 0 H TYR A 150 -14.537 -11.596 3.068 1.00 72.04 H new ATOM 0 HA TYR A 150 -13.752 -12.902 0.676 1.00 72.30 H new ATOM 0 HB2 TYR A 150 -12.935 -13.359 3.055 1.00 55.33 H new ATOM 0 HB3 TYR A 150 -14.441 -14.209 3.338 1.00 55.33 H new ATOM 0 HD1 TYR A 150 -11.223 -14.320 1.503 1.00 41.40 H new ATOM 0 HD2 TYR A 150 -14.814 -16.478 2.325 1.00 64.23 H new ATOM 0 HE1 TYR A 150 -10.217 -16.349 0.576 1.00 13.20 H new ATOM 0 HE2 TYR A 150 -13.794 -18.508 1.386 1.00 54.24 H new ATOM 0 HH TYR A 150 -12.015 -19.425 0.438 1.00 60.33 H new ATOM 2462 N ARG A 151 -16.736 -13.801 1.921 1.00 44.24 N ATOM 2463 CA ARG A 151 -18.021 -14.475 1.613 1.00 55.03 C ATOM 2464 C ARG A 151 -18.836 -13.734 0.521 1.00 23.51 C ATOM 2465 O ARG A 151 -19.480 -14.374 -0.322 1.00 44.12 O ATOM 2466 CB ARG A 151 -18.871 -14.653 2.900 1.00 13.31 C ATOM 2467 CG ARG A 151 -19.330 -13.346 3.574 1.00 3.01 C ATOM 2468 CD ARG A 151 -20.209 -13.596 4.809 1.00 2.03 C ATOM 2469 NE ARG A 151 -21.429 -14.353 4.475 1.00 22.05 N ATOM 2470 CZ ARG A 151 -22.633 -13.841 4.309 1.00 62.12 C ATOM 2471 NH1 ARG A 151 -22.842 -12.563 4.336 1.00 4.41 N ATOM 2472 NH2 ARG A 151 -23.627 -14.628 4.081 1.00 22.30 N ATOM 0 H ARG A 151 -16.683 -13.431 2.870 1.00 44.24 H new ATOM 0 HA ARG A 151 -17.772 -15.458 1.213 1.00 55.03 H new ATOM 0 HB2 ARG A 151 -19.753 -15.244 2.654 1.00 13.31 H new ATOM 0 HB3 ARG A 151 -18.292 -15.230 3.621 1.00 13.31 H new ATOM 0 HG2 ARG A 151 -18.455 -12.766 3.867 1.00 3.01 H new ATOM 0 HG3 ARG A 151 -19.885 -12.745 2.853 1.00 3.01 H new ATOM 0 HD2 ARG A 151 -19.636 -14.144 5.557 1.00 2.03 H new ATOM 0 HD3 ARG A 151 -20.486 -12.641 5.256 1.00 2.03 H new ATOM 0 HE ARG A 151 -21.334 -15.362 4.362 1.00 22.05 H new ATOM 0 HH11 ARG A 151 -22.063 -11.922 4.489 1.00 4.41 H new ATOM 0 HH12 ARG A 151 -23.785 -12.198 4.204 1.00 4.41 H new ATOM 0 HH21 ARG A 151 -23.478 -15.636 4.030 1.00 22.30 H new ATOM 0 HH22 ARG A 151 -24.563 -14.243 3.951 1.00 22.30 H new ATOM 2486 N LEU A 152 -18.779 -12.383 0.532 1.00 21.25 N ATOM 2487 CA LEU A 152 -19.441 -11.544 -0.493 1.00 54.30 C ATOM 2488 C LEU A 152 -18.718 -11.666 -1.852 1.00 54.32 C ATOM 2489 O LEU A 152 -19.341 -11.558 -2.902 1.00 50.14 O ATOM 2490 CB LEU A 152 -19.497 -10.058 -0.040 1.00 74.24 C ATOM 2491 CG LEU A 152 -20.371 -9.759 1.219 1.00 3.03 C ATOM 2492 CD1 LEU A 152 -20.239 -8.280 1.660 1.00 21.32 C ATOM 2493 CD2 LEU A 152 -21.848 -10.165 0.997 1.00 63.41 C ATOM 0 H LEU A 152 -18.279 -11.849 1.243 1.00 21.25 H new ATOM 0 HA LEU A 152 -20.463 -11.905 -0.613 1.00 54.30 H new ATOM 0 HB2 LEU A 152 -18.480 -9.721 0.160 1.00 74.24 H new ATOM 0 HB3 LEU A 152 -19.874 -9.460 -0.870 1.00 74.24 H new ATOM 0 HG LEU A 152 -19.991 -10.374 2.035 1.00 3.03 H new ATOM 0 HD11 LEU A 152 -20.860 -8.106 2.539 1.00 21.32 H new ATOM 0 HD12 LEU A 152 -19.198 -8.064 1.902 1.00 21.32 H new ATOM 0 HD13 LEU A 152 -20.566 -7.628 0.850 1.00 21.32 H new ATOM 0 HD21 LEU A 152 -22.425 -9.942 1.894 1.00 63.41 H new ATOM 0 HD22 LEU A 152 -22.256 -9.606 0.155 1.00 63.41 H new ATOM 0 HD23 LEU A 152 -21.904 -11.233 0.786 1.00 63.41 H new ATOM 2505 N PHE A 153 -17.396 -11.857 -1.805 1.00 60.45 N ATOM 2506 CA PHE A 153 -16.576 -12.154 -2.994 1.00 53.34 C ATOM 2507 C PHE A 153 -16.907 -13.559 -3.581 1.00 22.22 C ATOM 2508 O PHE A 153 -16.993 -13.723 -4.803 1.00 22.03 O ATOM 2509 CB PHE A 153 -15.081 -12.061 -2.600 1.00 44.53 C ATOM 2510 CG PHE A 153 -14.139 -11.833 -3.757 1.00 44.13 C ATOM 2511 CD1 PHE A 153 -13.867 -10.538 -4.199 1.00 61.22 C ATOM 2512 CD2 PHE A 153 -13.523 -12.897 -4.400 1.00 55.42 C ATOM 2513 CE1 PHE A 153 -13.013 -10.320 -5.249 1.00 65.45 C ATOM 2514 CE2 PHE A 153 -12.675 -12.674 -5.448 1.00 3.02 C ATOM 2515 CZ PHE A 153 -12.417 -11.389 -5.870 1.00 51.23 C ATOM 0 H PHE A 153 -16.858 -11.811 -0.940 1.00 60.45 H new ATOM 0 HA PHE A 153 -16.800 -11.425 -3.773 1.00 53.34 H new ATOM 0 HB2 PHE A 153 -14.958 -11.249 -1.883 1.00 44.53 H new ATOM 0 HB3 PHE A 153 -14.795 -12.982 -2.092 1.00 44.53 H new ATOM 0 HD1 PHE A 153 -14.335 -9.697 -3.708 1.00 61.22 H new ATOM 0 HD2 PHE A 153 -13.715 -13.907 -4.070 1.00 55.42 H new ATOM 0 HE1 PHE A 153 -12.811 -9.314 -5.585 1.00 65.45 H new ATOM 0 HE2 PHE A 153 -12.205 -13.509 -5.947 1.00 3.02 H new ATOM 0 HZ PHE A 153 -11.741 -11.221 -6.695 1.00 51.23 H new ATOM 2525 N GLN A 154 -17.106 -14.556 -2.687 1.00 22.10 N ATOM 2526 CA GLN A 154 -17.394 -15.957 -3.085 1.00 74.25 C ATOM 2527 C GLN A 154 -18.784 -16.085 -3.728 1.00 4.05 C ATOM 2528 O GLN A 154 -18.949 -16.796 -4.727 1.00 14.44 O ATOM 2529 CB GLN A 154 -17.274 -16.938 -1.885 1.00 60.33 C ATOM 2530 CG GLN A 154 -15.894 -16.957 -1.205 1.00 51.43 C ATOM 2531 CD GLN A 154 -14.727 -17.232 -2.155 1.00 33.35 C ATOM 2532 OE1 GLN A 154 -14.840 -17.974 -3.124 1.00 53.10 O ATOM 2533 NE2 GLN A 154 -13.603 -16.609 -1.900 1.00 31.14 N ATOM 0 H GLN A 154 -17.072 -14.415 -1.677 1.00 22.10 H new ATOM 0 HA GLN A 154 -16.641 -16.230 -3.824 1.00 74.25 H new ATOM 0 HB2 GLN A 154 -18.027 -16.675 -1.142 1.00 60.33 H new ATOM 0 HB3 GLN A 154 -17.507 -17.945 -2.232 1.00 60.33 H new ATOM 0 HG2 GLN A 154 -15.730 -15.997 -0.716 1.00 51.43 H new ATOM 0 HG3 GLN A 154 -15.898 -17.717 -0.423 1.00 51.43 H new ATOM 0 HE21 GLN A 154 -13.532 -15.996 -1.088 1.00 31.14 H new ATOM 0 HE22 GLN A 154 -12.799 -16.737 -2.514 1.00 31.14 H new ATOM 2542 N THR A 155 -19.773 -15.349 -3.172 1.00 34.33 N ATOM 2543 CA THR A 155 -21.158 -15.360 -3.699 1.00 53.53 C ATOM 2544 C THR A 155 -21.236 -14.698 -5.103 1.00 21.34 C ATOM 2545 O THR A 155 -22.202 -14.902 -5.834 1.00 62.51 O ATOM 2546 CB THR A 155 -22.187 -14.696 -2.716 1.00 71.51 C ATOM 2547 OG1 THR A 155 -23.535 -14.986 -3.142 1.00 5.22 O ATOM 2548 CG2 THR A 155 -22.027 -13.176 -2.605 1.00 14.43 C ATOM 0 H THR A 155 -19.640 -14.743 -2.363 1.00 34.33 H new ATOM 0 HA THR A 155 -21.439 -16.409 -3.795 1.00 53.53 H new ATOM 0 HB THR A 155 -21.985 -15.122 -1.733 1.00 71.51 H new ATOM 0 HG1 THR A 155 -23.556 -15.085 -4.117 1.00 5.22 H new ATOM 0 HG21 THR A 155 -22.769 -12.782 -1.910 1.00 14.43 H new ATOM 0 HG22 THR A 155 -21.027 -12.941 -2.240 1.00 14.43 H new ATOM 0 HG23 THR A 155 -22.171 -12.722 -3.586 1.00 14.43 H new ATOM 2556 N ARG A 156 -20.197 -13.909 -5.463 1.00 64.23 N ATOM 2557 CA ARG A 156 -20.047 -13.335 -6.817 1.00 23.30 C ATOM 2558 C ARG A 156 -19.489 -14.379 -7.816 1.00 1.12 C ATOM 2559 O ARG A 156 -20.139 -14.695 -8.821 1.00 52.14 O ATOM 2560 CB ARG A 156 -19.118 -12.090 -6.771 1.00 52.35 C ATOM 2561 CG ARG A 156 -19.691 -10.904 -5.976 1.00 34.30 C ATOM 2562 CD ARG A 156 -18.726 -9.714 -5.890 1.00 75.02 C ATOM 2563 NE ARG A 156 -19.326 -8.580 -5.165 1.00 20.42 N ATOM 2564 CZ ARG A 156 -19.026 -7.313 -5.351 1.00 72.21 C ATOM 2565 NH1 ARG A 156 -18.113 -6.950 -6.200 1.00 63.33 N ATOM 2566 NH2 ARG A 156 -19.636 -6.411 -4.657 1.00 21.53 N ATOM 0 H ARG A 156 -19.443 -13.654 -4.825 1.00 64.23 H new ATOM 0 HA ARG A 156 -21.035 -13.034 -7.164 1.00 23.30 H new ATOM 0 HB2 ARG A 156 -18.163 -12.379 -6.332 1.00 52.35 H new ATOM 0 HB3 ARG A 156 -18.915 -11.765 -7.791 1.00 52.35 H new ATOM 0 HG2 ARG A 156 -20.621 -10.577 -6.442 1.00 34.30 H new ATOM 0 HG3 ARG A 156 -19.939 -11.236 -4.968 1.00 34.30 H new ATOM 0 HD2 ARG A 156 -17.810 -10.024 -5.388 1.00 75.02 H new ATOM 0 HD3 ARG A 156 -18.447 -9.397 -6.895 1.00 75.02 H new ATOM 0 HE ARG A 156 -20.032 -8.795 -4.461 1.00 20.42 H new ATOM 0 HH11 ARG A 156 -17.610 -7.654 -6.741 1.00 63.33 H new ATOM 0 HH12 ARG A 156 -17.898 -5.961 -6.326 1.00 63.33 H new ATOM 0 HH21 ARG A 156 -20.342 -6.684 -3.973 1.00 21.53 H new ATOM 0 HH22 ARG A 156 -19.412 -5.425 -4.792 1.00 21.53 H new ATOM 2580 N LEU A 157 -18.290 -14.931 -7.511 1.00 31.41 N ATOM 2581 CA LEU A 157 -17.564 -15.837 -8.442 1.00 31.24 C ATOM 2582 C LEU A 157 -18.287 -17.189 -8.670 1.00 34.21 C ATOM 2583 O LEU A 157 -18.102 -17.815 -9.717 1.00 51.24 O ATOM 2584 CB LEU A 157 -16.073 -16.028 -8.004 1.00 52.41 C ATOM 2585 CG LEU A 157 -15.788 -16.506 -6.535 1.00 72.11 C ATOM 2586 CD1 LEU A 157 -16.059 -18.017 -6.319 1.00 52.33 C ATOM 2587 CD2 LEU A 157 -14.355 -16.137 -6.104 1.00 42.13 C ATOM 0 H LEU A 157 -17.803 -14.767 -6.630 1.00 31.41 H new ATOM 0 HA LEU A 157 -17.561 -15.343 -9.414 1.00 31.24 H new ATOM 0 HB2 LEU A 157 -15.616 -16.747 -8.683 1.00 52.41 H new ATOM 0 HB3 LEU A 157 -15.558 -15.079 -8.151 1.00 52.41 H new ATOM 0 HG LEU A 157 -16.495 -15.974 -5.898 1.00 72.11 H new ATOM 0 HD11 LEU A 157 -15.842 -18.281 -5.284 1.00 52.33 H new ATOM 0 HD12 LEU A 157 -17.105 -18.234 -6.538 1.00 52.33 H new ATOM 0 HD13 LEU A 157 -15.421 -18.600 -6.983 1.00 52.33 H new ATOM 0 HD21 LEU A 157 -14.183 -16.479 -5.083 1.00 42.13 H new ATOM 0 HD22 LEU A 157 -13.639 -16.615 -6.773 1.00 42.13 H new ATOM 0 HD23 LEU A 157 -14.228 -15.055 -6.151 1.00 42.13 H new ATOM 2599 N THR A 158 -19.102 -17.635 -7.686 1.00 72.33 N ATOM 2600 CA THR A 158 -19.921 -18.872 -7.829 1.00 3.14 C ATOM 2601 C THR A 158 -21.050 -18.700 -8.875 1.00 52.52 C ATOM 2602 O THR A 158 -21.459 -19.665 -9.523 1.00 51.41 O ATOM 2603 CB THR A 158 -20.535 -19.352 -6.468 1.00 41.33 C ATOM 2604 OG1 THR A 158 -21.181 -20.631 -6.634 1.00 4.12 O ATOM 2605 CG2 THR A 158 -21.550 -18.352 -5.891 1.00 53.43 C ATOM 0 H THR A 158 -19.213 -17.164 -6.788 1.00 72.33 H new ATOM 0 HA THR A 158 -19.230 -19.640 -8.178 1.00 3.14 H new ATOM 0 HB THR A 158 -19.706 -19.433 -5.765 1.00 41.33 H new ATOM 0 HG1 THR A 158 -21.559 -20.920 -5.777 1.00 4.12 H new ATOM 0 HG21 THR A 158 -21.943 -18.735 -4.949 1.00 53.43 H new ATOM 0 HG22 THR A 158 -21.059 -17.395 -5.717 1.00 53.43 H new ATOM 0 HG23 THR A 158 -22.369 -18.216 -6.597 1.00 53.43 H new ATOM 2613 N GLU A 159 -21.549 -17.457 -9.030 1.00 65.24 N ATOM 2614 CA GLU A 159 -22.622 -17.128 -9.996 1.00 21.45 C ATOM 2615 C GLU A 159 -22.050 -16.843 -11.405 1.00 3.33 C ATOM 2616 O GLU A 159 -22.683 -17.174 -12.415 1.00 70.30 O ATOM 2617 CB GLU A 159 -23.457 -15.922 -9.490 1.00 14.41 C ATOM 2618 CG GLU A 159 -24.217 -16.181 -8.169 1.00 63.20 C ATOM 2619 CD GLU A 159 -25.183 -15.043 -7.791 1.00 4.23 C ATOM 2620 OE1 GLU A 159 -26.320 -15.020 -8.308 1.00 30.52 O ATOM 2621 OE2 GLU A 159 -24.809 -14.152 -7.003 1.00 72.05 O ATOM 0 H GLU A 159 -21.222 -16.654 -8.492 1.00 65.24 H new ATOM 0 HA GLU A 159 -23.276 -17.997 -10.076 1.00 21.45 H new ATOM 0 HB2 GLU A 159 -22.793 -15.069 -9.352 1.00 14.41 H new ATOM 0 HB3 GLU A 159 -24.176 -15.645 -10.261 1.00 14.41 H new ATOM 0 HG2 GLU A 159 -24.778 -17.111 -8.257 1.00 63.20 H new ATOM 0 HG3 GLU A 159 -23.496 -16.319 -7.364 1.00 63.20 H new ATOM 2628 N THR A 160 -20.855 -16.220 -11.459 1.00 42.11 N ATOM 2629 CA THR A 160 -20.164 -15.901 -12.739 1.00 12.34 C ATOM 2630 C THR A 160 -19.647 -17.196 -13.454 1.00 34.42 C ATOM 2631 O THR A 160 -18.676 -17.821 -12.965 1.00 33.34 O ATOM 2632 CB THR A 160 -18.979 -14.887 -12.517 1.00 21.20 C ATOM 2633 OG1 THR A 160 -18.020 -15.427 -11.593 1.00 5.43 O ATOM 2634 CG2 THR A 160 -19.470 -13.530 -11.987 1.00 34.11 C ATOM 2635 OXT THR A 160 -20.232 -17.603 -14.489 1.00 36.81 O ATOM 0 H THR A 160 -20.341 -15.924 -10.629 1.00 42.11 H new ATOM 0 HA THR A 160 -20.901 -15.428 -13.388 1.00 12.34 H new ATOM 0 HB THR A 160 -18.514 -14.730 -13.490 1.00 21.20 H new ATOM 0 HG1 THR A 160 -17.903 -16.385 -11.766 1.00 5.43 H new ATOM 0 HG21 THR A 160 -18.619 -12.864 -11.849 1.00 34.11 H new ATOM 0 HG22 THR A 160 -20.164 -13.089 -12.703 1.00 34.11 H new ATOM 0 HG23 THR A 160 -19.976 -13.674 -11.033 1.00 34.11 H new TER 2643 THR A 160