USER MOD reduce.3.24.130724 H: found=0, std=0, add=1233, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1231 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 155 TYR OH : rot -13:sc= -0.518 USER MOD Set 1.2: A 157 GLN : amide:sc= -1.13 K(o=-1.6,f=-3.4) USER MOD Set 2.1: A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 123 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 78 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Set 3.2: A 80 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 59 ASN : amide:sc= -1.78 K(o=-11,f=-15) USER MOD Set 4.2: A 71 HIS :FLIP no HD1:sc= -2.58! F(o=-13,f=-11!) USER MOD Set 4.3: A 73 ASN :FLIP amide:sc= -5.49! C(o=-13!,f=-11!) USER MOD Set 4.4: A 84 ASN :FLIP amide:sc= -0.78 F(o=-13!,f=-11) USER MOD Set 5.1: A 17 MET CE :methyl -175:sc= -1.4 (180deg=-1.55) USER MOD Set 5.2: A 22 THR OG1 : rot -150:sc= 0 USER MOD Set 5.3: A 29 TYR OH : rot 108:sc= 0.17 USER MOD Set 6.1: A 16 THR OG1 : rot -44:sc= 1.19 USER MOD Set 6.2: A 34 GLN :FLIP amide:sc= -2.52 F(o=-7.1!,f=-1.3) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 HIS : no HD1:sc=-0.00223 X(o=-0.0022,f=-0.21) USER MOD Single : A 9 GLN : amide:sc= -0.519 K(o=-0.52,f=-4.4!) USER MOD Single : A 10 GLN : amide:sc= -1.23 X(o=-1.2,f=-1.5) USER MOD Single : A 12 ASN : amide:sc= -0.304 X(o=-0.3,f=-0.3) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= 0 X(o=0,f=0.22) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.905 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -162:sc= -1.12 (180deg=-1.85!) USER MOD Single : A 48 TYR OH : rot -30:sc= -0.0539 USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0194) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -99:sc= 0.289 USER MOD Single : A 76 MET CE :methyl 171:sc= -3.94 (180deg=-4.22!) USER MOD Single : A 85 SER OG : rot 17:sc= -2.01 USER MOD Single : A 88 ASN :FLIP amide:sc= -1.19 F(o=-3.6!,f=-1.2) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 38:sc= 1.17 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HD1:sc= -1.01 X(o=-1,f=-1.2) USER MOD Single : A 101 ASN : amide:sc= -0.939 K(o=-0.94,f=-7.1!) USER MOD Single : A 107 GLN : amide:sc= -0.353 X(o=-0.35,f=-0.26) USER MOD Single : A 112 SER OG : rot 180:sc= -0.02 USER MOD Single : A 115 CYS SG : rot 67:sc= -0.841 USER MOD Single : A 125 ASN : amide:sc= -0.47 X(o=-0.47,f=-0.84) USER MOD Single : A 127 GLN :FLIP amide:sc= 0.843 F(o=0,f=0.84) USER MOD Single : A 128 HIS : no HD1:sc= -2.14! C(o=-2.1!,f=-4.5!) USER MOD Single : A 134 HIS :FLIP no HD1:sc= -2.46 F(o=-3.7,f=-2.4) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.173 USER MOD Single : A 148 GLN :FLIP amide:sc= 0.735 F(o=-1.8,f=0.73) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 SER OG : rot 180:sc= 0 USER MOD Single : A 159 SER OG : rot -57:sc= -0.575 USER MOD Single : A 162 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -19.059 -11.375 -25.582 1.00 0.00 N ATOM 2 CA GLY A 1 -19.020 -10.765 -24.266 1.00 0.00 C ATOM 3 C GLY A 1 -20.320 -10.074 -23.908 1.00 0.00 C ATOM 4 O GLY A 1 -21.342 -10.728 -23.697 1.00 0.00 O ATOM 0 H1 GLY A 1 -18.147 -11.834 -25.779 1.00 0.00 H new ATOM 0 H2 GLY A 1 -19.818 -12.085 -25.613 1.00 0.00 H new ATOM 0 H3 GLY A 1 -19.240 -10.643 -26.299 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.802 -11.530 -23.521 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.205 -10.042 -24.228 1.00 0.00 H new ATOM 8 N SER A 2 -20.284 -8.747 -23.840 1.00 0.00 N ATOM 9 CA SER A 2 -21.467 -7.966 -23.500 1.00 0.00 C ATOM 10 C SER A 2 -22.161 -8.539 -22.268 1.00 0.00 C ATOM 11 O SER A 2 -23.387 -8.644 -22.224 1.00 0.00 O ATOM 12 CB SER A 2 -22.441 -7.936 -24.680 1.00 0.00 C ATOM 13 OG SER A 2 -23.276 -6.793 -24.624 1.00 0.00 O ATOM 0 H SER A 2 -19.448 -8.190 -24.016 1.00 0.00 H new ATOM 0 HA SER A 2 -21.148 -6.948 -23.275 1.00 0.00 H new ATOM 0 HB2 SER A 2 -21.883 -7.937 -25.616 1.00 0.00 H new ATOM 0 HB3 SER A 2 -23.053 -8.838 -24.673 1.00 0.00 H new ATOM 0 HG SER A 2 -23.888 -6.797 -25.390 1.00 0.00 H new ATOM 19 N SER A 3 -21.367 -8.909 -21.268 1.00 0.00 N ATOM 20 CA SER A 3 -21.903 -9.475 -20.036 1.00 0.00 C ATOM 21 C SER A 3 -21.569 -8.588 -18.840 1.00 0.00 C ATOM 22 O SER A 3 -20.441 -8.119 -18.697 1.00 0.00 O ATOM 23 CB SER A 3 -21.347 -10.883 -19.812 1.00 0.00 C ATOM 24 OG SER A 3 -19.943 -10.852 -19.619 1.00 0.00 O ATOM 0 H SER A 3 -20.350 -8.827 -21.287 1.00 0.00 H new ATOM 0 HA SER A 3 -22.987 -9.531 -20.133 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.827 -11.333 -18.943 1.00 0.00 H new ATOM 0 HB3 SER A 3 -21.586 -11.512 -20.669 1.00 0.00 H new ATOM 0 HG SER A 3 -19.612 -11.763 -19.476 1.00 0.00 H new ATOM 30 N GLY A 4 -22.561 -8.363 -17.983 1.00 0.00 N ATOM 31 CA GLY A 4 -22.353 -7.534 -16.810 1.00 0.00 C ATOM 32 C GLY A 4 -23.186 -7.984 -15.626 1.00 0.00 C ATOM 33 O GLY A 4 -24.067 -8.833 -15.766 1.00 0.00 O ATOM 0 H GLY A 4 -23.504 -8.740 -18.080 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.298 -7.555 -16.537 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -22.599 -6.500 -17.051 1.00 0.00 H new ATOM 37 N SER A 5 -22.905 -7.418 -14.457 1.00 0.00 N ATOM 38 CA SER A 5 -23.631 -7.770 -13.243 1.00 0.00 C ATOM 39 C SER A 5 -24.595 -6.657 -12.844 1.00 0.00 C ATOM 40 O SER A 5 -24.190 -5.512 -12.646 1.00 0.00 O ATOM 41 CB SER A 5 -22.652 -8.047 -12.101 1.00 0.00 C ATOM 42 OG SER A 5 -21.885 -9.211 -12.357 1.00 0.00 O ATOM 0 H SER A 5 -22.179 -6.713 -14.325 1.00 0.00 H new ATOM 0 HA SER A 5 -24.209 -8.672 -13.443 1.00 0.00 H new ATOM 0 HB2 SER A 5 -21.989 -7.192 -11.971 1.00 0.00 H new ATOM 0 HB3 SER A 5 -23.202 -8.168 -11.168 1.00 0.00 H new ATOM 0 HG SER A 5 -21.266 -9.365 -11.613 1.00 0.00 H new ATOM 48 N SER A 6 -25.873 -7.003 -12.727 1.00 0.00 N ATOM 49 CA SER A 6 -26.896 -6.033 -12.355 1.00 0.00 C ATOM 50 C SER A 6 -27.062 -5.972 -10.839 1.00 0.00 C ATOM 51 O SER A 6 -27.743 -6.806 -10.244 1.00 0.00 O ATOM 52 CB SER A 6 -28.231 -6.391 -13.011 1.00 0.00 C ATOM 53 OG SER A 6 -29.208 -5.396 -12.758 1.00 0.00 O ATOM 0 H SER A 6 -26.224 -7.947 -12.884 1.00 0.00 H new ATOM 0 HA SER A 6 -26.577 -5.052 -12.708 1.00 0.00 H new ATOM 0 HB2 SER A 6 -28.092 -6.504 -14.086 1.00 0.00 H new ATOM 0 HB3 SER A 6 -28.580 -7.352 -12.632 1.00 0.00 H new ATOM 0 HG SER A 6 -30.051 -5.648 -13.189 1.00 0.00 H new ATOM 59 N GLY A 7 -26.433 -4.978 -10.221 1.00 0.00 N ATOM 60 CA GLY A 7 -26.522 -4.825 -8.780 1.00 0.00 C ATOM 61 C GLY A 7 -25.430 -3.933 -8.223 1.00 0.00 C ATOM 62 O GLY A 7 -24.272 -4.028 -8.631 1.00 0.00 O ATOM 0 H GLY A 7 -25.863 -4.275 -10.692 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -27.495 -4.407 -8.522 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -26.461 -5.806 -8.309 1.00 0.00 H new ATOM 66 N HIS A 8 -25.799 -3.063 -7.289 1.00 0.00 N ATOM 67 CA HIS A 8 -24.843 -2.149 -6.675 1.00 0.00 C ATOM 68 C HIS A 8 -25.375 -1.616 -5.348 1.00 0.00 C ATOM 69 O HIS A 8 -26.570 -1.704 -5.068 1.00 0.00 O ATOM 70 CB HIS A 8 -24.538 -0.986 -7.620 1.00 0.00 C ATOM 71 CG HIS A 8 -25.676 -0.024 -7.772 1.00 0.00 C ATOM 72 ND1 HIS A 8 -25.821 1.100 -6.986 1.00 0.00 N ATOM 73 CD2 HIS A 8 -26.726 -0.022 -8.626 1.00 0.00 C ATOM 74 CE1 HIS A 8 -26.912 1.751 -7.350 1.00 0.00 C ATOM 75 NE2 HIS A 8 -27.479 1.091 -8.343 1.00 0.00 N ATOM 0 H HIS A 8 -26.753 -2.972 -6.941 1.00 0.00 H new ATOM 0 HA HIS A 8 -23.923 -2.701 -6.482 1.00 0.00 H new ATOM 0 HB2 HIS A 8 -23.665 -0.448 -7.251 1.00 0.00 H new ATOM 0 HB3 HIS A 8 -24.276 -1.384 -8.600 1.00 0.00 H new ATOM 0 HD2 HIS A 8 -26.933 -0.759 -9.388 1.00 0.00 H new ATOM 0 HE1 HIS A 8 -27.278 2.667 -6.910 1.00 0.00 H new ATOM 0 HE2 HIS A 8 -28.337 1.364 -8.822 1.00 0.00 H new ATOM 84 N GLN A 9 -24.479 -1.064 -4.536 1.00 0.00 N ATOM 85 CA GLN A 9 -24.860 -0.519 -3.238 1.00 0.00 C ATOM 86 C GLN A 9 -24.748 1.002 -3.233 1.00 0.00 C ATOM 87 O GLN A 9 -23.727 1.560 -3.634 1.00 0.00 O ATOM 88 CB GLN A 9 -23.980 -1.110 -2.135 1.00 0.00 C ATOM 89 CG GLN A 9 -23.990 -2.630 -2.098 1.00 0.00 C ATOM 90 CD GLN A 9 -25.278 -3.191 -1.527 1.00 0.00 C ATOM 91 OE1 GLN A 9 -26.323 -2.542 -1.566 1.00 0.00 O ATOM 92 NE2 GLN A 9 -25.208 -4.404 -0.991 1.00 0.00 N ATOM 0 H GLN A 9 -23.486 -0.982 -4.753 1.00 0.00 H new ATOM 0 HA GLN A 9 -25.899 -0.790 -3.049 1.00 0.00 H new ATOM 0 HB2 GLN A 9 -22.956 -0.765 -2.275 1.00 0.00 H new ATOM 0 HB3 GLN A 9 -24.316 -0.729 -1.170 1.00 0.00 H new ATOM 0 HG2 GLN A 9 -23.846 -3.015 -3.107 1.00 0.00 H new ATOM 0 HG3 GLN A 9 -23.149 -2.981 -1.500 1.00 0.00 H new ATOM 0 HE21 GLN A 9 -24.320 -4.906 -0.980 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -26.042 -4.833 -0.590 1.00 0.00 H new ATOM 101 N GLN A 10 -25.805 1.667 -2.776 1.00 0.00 N ATOM 102 CA GLN A 10 -25.825 3.124 -2.721 1.00 0.00 C ATOM 103 C GLN A 10 -25.194 3.628 -1.427 1.00 0.00 C ATOM 104 O GLN A 10 -25.362 4.789 -1.053 1.00 0.00 O ATOM 105 CB GLN A 10 -27.260 3.640 -2.837 1.00 0.00 C ATOM 106 CG GLN A 10 -28.172 3.159 -1.721 1.00 0.00 C ATOM 107 CD GLN A 10 -28.848 1.842 -2.046 1.00 0.00 C ATOM 108 OE1 GLN A 10 -28.605 0.828 -1.390 1.00 0.00 O ATOM 109 NE2 GLN A 10 -29.702 1.849 -3.063 1.00 0.00 N ATOM 0 H GLN A 10 -26.658 1.220 -2.439 1.00 0.00 H new ATOM 0 HA GLN A 10 -25.241 3.502 -3.560 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -27.246 4.730 -2.839 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -27.674 3.325 -3.795 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -27.592 3.049 -0.805 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -28.933 3.915 -1.527 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -29.873 2.712 -3.579 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -30.187 0.991 -3.328 1.00 0.00 H new ATOM 118 N LEU A 11 -24.469 2.747 -0.746 1.00 0.00 N ATOM 119 CA LEU A 11 -23.813 3.103 0.507 1.00 0.00 C ATOM 120 C LEU A 11 -22.419 3.667 0.252 1.00 0.00 C ATOM 121 O LEU A 11 -21.852 3.482 -0.824 1.00 0.00 O ATOM 122 CB LEU A 11 -23.721 1.880 1.422 1.00 0.00 C ATOM 123 CG LEU A 11 -25.016 1.465 2.120 1.00 0.00 C ATOM 124 CD1 LEU A 11 -25.975 0.824 1.129 1.00 0.00 C ATOM 125 CD2 LEU A 11 -24.721 0.514 3.271 1.00 0.00 C ATOM 0 H LEU A 11 -24.321 1.782 -1.040 1.00 0.00 H new ATOM 0 HA LEU A 11 -24.411 3.872 0.996 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -23.363 1.036 0.832 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -22.968 2.078 2.185 1.00 0.00 H new ATOM 0 HG LEU A 11 -25.489 2.359 2.526 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -26.891 0.535 1.644 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -26.212 1.537 0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -25.510 -0.060 0.692 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -25.655 0.229 3.756 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -24.224 -0.378 2.888 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -24.072 1.008 3.994 1.00 0.00 H new ATOM 137 N ASN A 12 -21.871 4.353 1.250 1.00 0.00 N ATOM 138 CA ASN A 12 -20.542 4.943 1.133 1.00 0.00 C ATOM 139 C ASN A 12 -19.588 3.994 0.414 1.00 0.00 C ATOM 140 O ASN A 12 -18.867 4.398 -0.499 1.00 0.00 O ATOM 141 CB ASN A 12 -19.991 5.286 2.518 1.00 0.00 C ATOM 142 CG ASN A 12 -21.041 5.904 3.422 1.00 0.00 C ATOM 143 OD1 ASN A 12 -21.467 7.039 3.210 1.00 0.00 O ATOM 144 ND2 ASN A 12 -21.462 5.157 4.436 1.00 0.00 N ATOM 0 H ASN A 12 -22.326 4.514 2.148 1.00 0.00 H new ATOM 0 HA ASN A 12 -20.627 5.858 0.546 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -19.601 4.382 2.985 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -19.155 5.977 2.412 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -22.167 5.519 5.078 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -21.080 4.221 4.573 1.00 0.00 H new ATOM 151 N SER A 13 -19.590 2.733 0.831 1.00 0.00 N ATOM 152 CA SER A 13 -18.722 1.727 0.229 1.00 0.00 C ATOM 153 C SER A 13 -18.543 1.987 -1.263 1.00 0.00 C ATOM 154 O SER A 13 -19.450 2.485 -1.932 1.00 0.00 O ATOM 155 CB SER A 13 -19.299 0.327 0.450 1.00 0.00 C ATOM 156 OG SER A 13 -19.151 -0.079 1.799 1.00 0.00 O ATOM 0 H SER A 13 -20.183 2.383 1.583 1.00 0.00 H new ATOM 0 HA SER A 13 -17.746 1.790 0.710 1.00 0.00 H new ATOM 0 HB2 SER A 13 -20.355 0.318 0.178 1.00 0.00 H new ATOM 0 HB3 SER A 13 -18.796 -0.385 -0.204 1.00 0.00 H new ATOM 0 HG SER A 13 -19.529 -0.976 1.914 1.00 0.00 H new ATOM 162 N LEU A 14 -17.368 1.646 -1.780 1.00 0.00 N ATOM 163 CA LEU A 14 -17.068 1.842 -3.194 1.00 0.00 C ATOM 164 C LEU A 14 -17.227 0.538 -3.970 1.00 0.00 C ATOM 165 O LEU A 14 -17.093 -0.558 -3.425 1.00 0.00 O ATOM 166 CB LEU A 14 -15.646 2.380 -3.365 1.00 0.00 C ATOM 167 CG LEU A 14 -14.528 1.522 -2.771 1.00 0.00 C ATOM 168 CD1 LEU A 14 -14.155 0.397 -3.725 1.00 0.00 C ATOM 169 CD2 LEU A 14 -13.311 2.378 -2.452 1.00 0.00 C ATOM 0 H LEU A 14 -16.607 1.232 -1.241 1.00 0.00 H new ATOM 0 HA LEU A 14 -17.775 2.570 -3.592 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.453 2.507 -4.430 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -15.597 3.370 -2.912 1.00 0.00 H new ATOM 0 HG LEU A 14 -14.890 1.080 -1.843 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -13.358 -0.203 -3.286 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.027 -0.232 -3.904 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -13.813 0.820 -4.670 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -12.526 1.751 -2.030 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -12.948 2.849 -3.365 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -13.587 3.148 -1.731 1.00 0.00 H new ATOM 181 N PRO A 15 -17.518 0.657 -5.274 1.00 0.00 N ATOM 182 CA PRO A 15 -17.698 -0.502 -6.153 1.00 0.00 C ATOM 183 C PRO A 15 -16.391 -1.243 -6.412 1.00 0.00 C ATOM 184 O PRO A 15 -15.396 -1.030 -5.718 1.00 0.00 O ATOM 185 CB PRO A 15 -18.228 0.116 -7.450 1.00 0.00 C ATOM 186 CG PRO A 15 -17.723 1.517 -7.435 1.00 0.00 C ATOM 187 CD PRO A 15 -17.692 1.931 -5.990 1.00 0.00 C ATOM 0 HA PRO A 15 -18.364 -1.246 -5.715 1.00 0.00 H new ATOM 0 HB2 PRO A 15 -17.866 -0.426 -8.324 1.00 0.00 H new ATOM 0 HB3 PRO A 15 -19.317 0.088 -7.486 1.00 0.00 H new ATOM 0 HG2 PRO A 15 -16.730 1.578 -7.880 1.00 0.00 H new ATOM 0 HG3 PRO A 15 -18.373 2.172 -8.015 1.00 0.00 H new ATOM 0 HD2 PRO A 15 -16.873 2.621 -5.787 1.00 0.00 H new ATOM 0 HD3 PRO A 15 -18.613 2.434 -5.696 1.00 0.00 H new ATOM 195 N THR A 16 -16.398 -2.114 -7.416 1.00 0.00 N ATOM 196 CA THR A 16 -15.213 -2.887 -7.766 1.00 0.00 C ATOM 197 C THR A 16 -14.273 -2.081 -8.656 1.00 0.00 C ATOM 198 O THR A 16 -14.707 -1.192 -9.387 1.00 0.00 O ATOM 199 CB THR A 16 -15.588 -4.195 -8.488 1.00 0.00 C ATOM 200 OG1 THR A 16 -15.941 -5.199 -7.529 1.00 0.00 O ATOM 201 CG2 THR A 16 -14.434 -4.690 -9.346 1.00 0.00 C ATOM 0 H THR A 16 -17.212 -2.302 -8.001 1.00 0.00 H new ATOM 0 HA THR A 16 -14.707 -3.128 -6.831 1.00 0.00 H new ATOM 0 HB THR A 16 -16.441 -3.995 -9.136 1.00 0.00 H new ATOM 0 HG1 THR A 16 -15.297 -5.186 -6.790 1.00 0.00 H new ATOM 0 HG21 THR A 16 -14.723 -5.615 -9.846 1.00 0.00 H new ATOM 0 HG22 THR A 16 -14.186 -3.936 -10.093 1.00 0.00 H new ATOM 0 HG23 THR A 16 -13.565 -4.875 -8.715 1.00 0.00 H new ATOM 209 N MET A 17 -12.985 -2.398 -8.588 1.00 0.00 N ATOM 210 CA MET A 17 -11.984 -1.703 -9.390 1.00 0.00 C ATOM 211 C MET A 17 -11.489 -2.590 -10.528 1.00 0.00 C ATOM 212 O MET A 17 -10.378 -3.117 -10.477 1.00 0.00 O ATOM 213 CB MET A 17 -10.806 -1.273 -8.513 1.00 0.00 C ATOM 214 CG MET A 17 -11.084 -0.024 -7.693 1.00 0.00 C ATOM 215 SD MET A 17 -9.587 0.910 -7.320 1.00 0.00 S ATOM 216 CE MET A 17 -8.531 -0.386 -6.679 1.00 0.00 C ATOM 0 H MET A 17 -12.609 -3.131 -7.986 1.00 0.00 H new ATOM 0 HA MET A 17 -12.450 -0.816 -9.820 1.00 0.00 H new ATOM 0 HB2 MET A 17 -10.548 -2.090 -7.839 1.00 0.00 H new ATOM 0 HB3 MET A 17 -9.937 -1.096 -9.147 1.00 0.00 H new ATOM 0 HG2 MET A 17 -11.780 0.615 -8.236 1.00 0.00 H new ATOM 0 HG3 MET A 17 -11.572 -0.307 -6.761 1.00 0.00 H new ATOM 0 HE1 MET A 17 -7.598 0.049 -6.321 1.00 0.00 H new ATOM 0 HE2 MET A 17 -9.035 -0.892 -5.856 1.00 0.00 H new ATOM 0 HE3 MET A 17 -8.316 -1.105 -7.470 1.00 0.00 H new ATOM 226 N GLU A 18 -12.320 -2.749 -11.553 1.00 0.00 N ATOM 227 CA GLU A 18 -11.965 -3.573 -12.703 1.00 0.00 C ATOM 228 C GLU A 18 -11.708 -2.708 -13.933 1.00 0.00 C ATOM 229 O GLU A 18 -11.752 -1.480 -13.863 1.00 0.00 O ATOM 230 CB GLU A 18 -13.077 -4.582 -12.998 1.00 0.00 C ATOM 231 CG GLU A 18 -12.890 -5.916 -12.296 1.00 0.00 C ATOM 232 CD GLU A 18 -11.460 -6.418 -12.367 1.00 0.00 C ATOM 233 OE1 GLU A 18 -10.841 -6.296 -13.444 1.00 0.00 O ATOM 234 OE2 GLU A 18 -10.961 -6.932 -11.344 1.00 0.00 O ATOM 0 H GLU A 18 -13.243 -2.319 -11.611 1.00 0.00 H new ATOM 0 HA GLU A 18 -11.049 -4.113 -12.462 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -14.033 -4.154 -12.698 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -13.127 -4.751 -14.074 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -13.185 -5.817 -11.251 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -13.553 -6.655 -12.746 1.00 0.00 H new ATOM 241 N GLY A 19 -11.439 -3.359 -15.061 1.00 0.00 N ATOM 242 CA GLY A 19 -11.178 -2.634 -16.291 1.00 0.00 C ATOM 243 C GLY A 19 -9.717 -2.260 -16.446 1.00 0.00 C ATOM 244 O GLY A 19 -8.819 -3.005 -16.052 1.00 0.00 O ATOM 0 H GLY A 19 -11.397 -4.375 -15.145 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -11.486 -3.244 -17.141 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -11.785 -1.729 -16.311 1.00 0.00 H new ATOM 248 N PRO A 20 -9.463 -1.081 -17.032 1.00 0.00 N ATOM 249 CA PRO A 20 -8.102 -0.584 -17.252 1.00 0.00 C ATOM 250 C PRO A 20 -7.409 -0.197 -15.950 1.00 0.00 C ATOM 251 O PRO A 20 -8.039 -0.054 -14.902 1.00 0.00 O ATOM 252 CB PRO A 20 -8.313 0.650 -18.133 1.00 0.00 C ATOM 253 CG PRO A 20 -9.698 1.103 -17.824 1.00 0.00 C ATOM 254 CD PRO A 20 -10.485 -0.143 -17.526 1.00 0.00 C ATOM 0 HA PRO A 20 -7.459 -1.341 -17.702 1.00 0.00 H new ATOM 0 HB2 PRO A 20 -7.583 1.427 -17.908 1.00 0.00 H new ATOM 0 HB3 PRO A 20 -8.203 0.406 -19.190 1.00 0.00 H new ATOM 0 HG2 PRO A 20 -9.705 1.782 -16.972 1.00 0.00 H new ATOM 0 HG3 PRO A 20 -10.129 1.644 -18.666 1.00 0.00 H new ATOM 0 HD2 PRO A 20 -11.258 0.039 -16.779 1.00 0.00 H new ATOM 0 HD3 PRO A 20 -10.985 -0.525 -18.416 1.00 0.00 H new ATOM 262 N PRO A 21 -6.081 -0.022 -16.015 1.00 0.00 N ATOM 263 CA PRO A 21 -5.274 0.353 -14.850 1.00 0.00 C ATOM 264 C PRO A 21 -5.538 1.784 -14.397 1.00 0.00 C ATOM 265 O PRO A 21 -6.282 2.524 -15.043 1.00 0.00 O ATOM 266 CB PRO A 21 -3.835 0.209 -15.354 1.00 0.00 C ATOM 267 CG PRO A 21 -3.930 0.391 -16.829 1.00 0.00 C ATOM 268 CD PRO A 21 -5.264 -0.175 -17.231 1.00 0.00 C ATOM 0 HA PRO A 21 -5.501 -0.266 -13.982 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -3.181 0.956 -14.904 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -3.423 -0.768 -15.101 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -3.856 1.445 -17.098 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -3.117 -0.126 -17.339 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -5.693 0.367 -18.074 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -5.183 -1.220 -17.532 1.00 0.00 H new ATOM 276 N THR A 22 -4.925 2.171 -13.283 1.00 0.00 N ATOM 277 CA THR A 22 -5.095 3.514 -12.743 1.00 0.00 C ATOM 278 C THR A 22 -4.130 4.496 -13.398 1.00 0.00 C ATOM 279 O THR A 22 -3.011 4.133 -13.760 1.00 0.00 O ATOM 280 CB THR A 22 -4.879 3.539 -11.218 1.00 0.00 C ATOM 281 OG1 THR A 22 -6.062 3.088 -10.549 1.00 0.00 O ATOM 282 CG2 THR A 22 -4.524 4.940 -10.744 1.00 0.00 C ATOM 0 H THR A 22 -4.306 1.573 -12.737 1.00 0.00 H new ATOM 0 HA THR A 22 -6.120 3.815 -12.962 1.00 0.00 H new ATOM 0 HB THR A 22 -4.050 2.872 -10.979 1.00 0.00 H new ATOM 0 HG1 THR A 22 -6.129 3.523 -9.673 1.00 0.00 H new ATOM 0 HG21 THR A 22 -4.376 4.932 -9.664 1.00 0.00 H new ATOM 0 HG22 THR A 22 -3.607 5.268 -11.233 1.00 0.00 H new ATOM 0 HG23 THR A 22 -5.334 5.625 -10.994 1.00 0.00 H new ATOM 290 N PHE A 23 -4.569 5.741 -13.545 1.00 0.00 N ATOM 291 CA PHE A 23 -3.743 6.776 -14.156 1.00 0.00 C ATOM 292 C PHE A 23 -4.036 8.141 -13.539 1.00 0.00 C ATOM 293 O PHE A 23 -5.180 8.593 -13.519 1.00 0.00 O ATOM 294 CB PHE A 23 -3.985 6.825 -15.666 1.00 0.00 C ATOM 295 CG PHE A 23 -3.039 5.963 -16.452 1.00 0.00 C ATOM 296 CD1 PHE A 23 -3.128 4.581 -16.394 1.00 0.00 C ATOM 297 CD2 PHE A 23 -2.060 6.534 -17.250 1.00 0.00 C ATOM 298 CE1 PHE A 23 -2.260 3.785 -17.116 1.00 0.00 C ATOM 299 CE2 PHE A 23 -1.189 5.742 -17.975 1.00 0.00 C ATOM 300 CZ PHE A 23 -1.288 4.366 -17.907 1.00 0.00 C ATOM 0 H PHE A 23 -5.492 6.058 -13.249 1.00 0.00 H new ATOM 0 HA PHE A 23 -2.698 6.529 -13.969 1.00 0.00 H new ATOM 0 HB2 PHE A 23 -5.008 6.510 -15.873 1.00 0.00 H new ATOM 0 HB3 PHE A 23 -3.894 7.856 -16.007 1.00 0.00 H new ATOM 0 HD1 PHE A 23 -3.885 4.121 -15.777 1.00 0.00 H new ATOM 0 HD2 PHE A 23 -1.977 7.609 -17.306 1.00 0.00 H new ATOM 0 HE1 PHE A 23 -2.341 2.709 -17.062 1.00 0.00 H new ATOM 0 HE2 PHE A 23 -0.431 6.199 -18.594 1.00 0.00 H new ATOM 0 HZ PHE A 23 -0.607 3.746 -18.471 1.00 0.00 H new ATOM 310 N ASN A 24 -2.992 8.791 -13.035 1.00 0.00 N ATOM 311 CA ASN A 24 -3.136 10.104 -12.415 1.00 0.00 C ATOM 312 C ASN A 24 -4.104 10.046 -11.237 1.00 0.00 C ATOM 313 O ASN A 24 -4.989 10.888 -11.087 1.00 0.00 O ATOM 314 CB ASN A 24 -3.628 11.125 -13.443 1.00 0.00 C ATOM 315 CG ASN A 24 -3.223 12.543 -13.089 1.00 0.00 C ATOM 316 OD1 ASN A 24 -3.909 13.224 -12.326 1.00 0.00 O ATOM 317 ND2 ASN A 24 -2.104 12.994 -13.642 1.00 0.00 N ATOM 0 H ASN A 24 -2.038 8.431 -13.044 1.00 0.00 H new ATOM 0 HA ASN A 24 -2.158 10.413 -12.045 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -3.228 10.870 -14.424 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -4.714 11.068 -13.517 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.781 13.940 -13.440 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -1.567 12.394 -14.269 1.00 0.00 H new ATOM 324 N PRO A 25 -3.931 9.029 -10.379 1.00 0.00 N ATOM 325 CA PRO A 25 -4.778 8.837 -9.198 1.00 0.00 C ATOM 326 C PRO A 25 -4.540 9.903 -8.135 1.00 0.00 C ATOM 327 O PRO A 25 -3.404 10.241 -7.803 1.00 0.00 O ATOM 328 CB PRO A 25 -4.357 7.460 -8.679 1.00 0.00 C ATOM 329 CG PRO A 25 -2.962 7.281 -9.171 1.00 0.00 C ATOM 330 CD PRO A 25 -2.896 7.989 -10.496 1.00 0.00 C ATOM 0 HA PRO A 25 -5.838 8.910 -9.441 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -4.402 7.416 -7.591 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.014 6.677 -9.057 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -2.243 7.701 -8.468 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -2.720 6.224 -9.281 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -1.911 8.421 -10.672 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -3.100 7.311 -11.325 1.00 0.00 H new ATOM 338 N PRO A 26 -5.636 10.447 -7.585 1.00 0.00 N ATOM 339 CA PRO A 26 -5.572 11.483 -6.549 1.00 0.00 C ATOM 340 C PRO A 26 -5.054 10.942 -5.221 1.00 0.00 C ATOM 341 O PRO A 26 -4.704 9.767 -5.111 1.00 0.00 O ATOM 342 CB PRO A 26 -7.027 11.937 -6.411 1.00 0.00 C ATOM 343 CG PRO A 26 -7.833 10.768 -6.860 1.00 0.00 C ATOM 344 CD PRO A 26 -7.023 10.093 -7.931 1.00 0.00 C ATOM 0 HA PRO A 26 -4.885 12.286 -6.816 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -7.261 12.207 -5.381 1.00 0.00 H new ATOM 0 HB3 PRO A 26 -7.228 12.815 -7.025 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -8.028 10.087 -6.031 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -8.801 11.087 -7.246 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -7.175 9.014 -7.929 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -7.293 10.451 -8.925 1.00 0.00 H new ATOM 352 N VAL A 27 -5.008 11.808 -4.212 1.00 0.00 N ATOM 353 CA VAL A 27 -4.535 11.417 -2.890 1.00 0.00 C ATOM 354 C VAL A 27 -5.347 12.095 -1.793 1.00 0.00 C ATOM 355 O VAL A 27 -5.685 13.276 -1.876 1.00 0.00 O ATOM 356 CB VAL A 27 -3.046 11.765 -2.701 1.00 0.00 C ATOM 357 CG1 VAL A 27 -2.597 11.440 -1.285 1.00 0.00 C ATOM 358 CG2 VAL A 27 -2.193 11.027 -3.722 1.00 0.00 C ATOM 0 H VAL A 27 -5.293 12.785 -4.286 1.00 0.00 H new ATOM 0 HA VAL A 27 -4.660 10.337 -2.816 1.00 0.00 H new ATOM 0 HB VAL A 27 -2.918 12.836 -2.860 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -1.543 11.692 -1.171 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -3.188 12.018 -0.574 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -2.738 10.376 -1.094 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -1.144 11.284 -3.574 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -2.324 9.952 -3.597 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -2.499 11.315 -4.728 1.00 0.00 H new ATOM 368 N PRO A 28 -5.669 11.332 -0.738 1.00 0.00 N ATOM 369 CA PRO A 28 -5.274 9.924 -0.629 1.00 0.00 C ATOM 370 C PRO A 28 -6.014 9.035 -1.622 1.00 0.00 C ATOM 371 O PRO A 28 -7.187 9.261 -1.917 1.00 0.00 O ATOM 372 CB PRO A 28 -5.659 9.558 0.807 1.00 0.00 C ATOM 373 CG PRO A 28 -6.753 10.505 1.159 1.00 0.00 C ATOM 374 CD PRO A 28 -6.445 11.783 0.429 1.00 0.00 C ATOM 0 HA PRO A 28 -4.217 9.779 -0.852 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -5.994 8.523 0.875 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.811 9.664 1.483 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -7.723 10.109 0.860 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -6.794 10.671 2.236 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -7.355 12.304 0.130 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -5.873 12.472 1.050 1.00 0.00 H new ATOM 382 N TYR A 29 -5.321 8.024 -2.134 1.00 0.00 N ATOM 383 CA TYR A 29 -5.912 7.102 -3.096 1.00 0.00 C ATOM 384 C TYR A 29 -6.382 5.824 -2.408 1.00 0.00 C ATOM 385 O TYR A 29 -5.578 5.064 -1.868 1.00 0.00 O ATOM 386 CB TYR A 29 -4.903 6.761 -4.194 1.00 0.00 C ATOM 387 CG TYR A 29 -5.272 5.533 -4.995 1.00 0.00 C ATOM 388 CD1 TYR A 29 -4.982 4.259 -4.523 1.00 0.00 C ATOM 389 CD2 TYR A 29 -5.909 5.646 -6.225 1.00 0.00 C ATOM 390 CE1 TYR A 29 -5.316 3.134 -5.251 1.00 0.00 C ATOM 391 CE2 TYR A 29 -6.248 4.527 -6.959 1.00 0.00 C ATOM 392 CZ TYR A 29 -5.950 3.273 -6.469 1.00 0.00 C ATOM 393 OH TYR A 29 -6.285 2.155 -7.198 1.00 0.00 O ATOM 0 H TYR A 29 -4.349 7.822 -1.899 1.00 0.00 H new ATOM 0 HA TYR A 29 -6.777 7.591 -3.545 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -4.813 7.612 -4.870 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -3.923 6.608 -3.741 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -4.487 4.146 -3.570 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -6.143 6.626 -6.613 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.082 2.151 -4.869 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -6.744 4.633 -7.912 1.00 0.00 H new ATOM 0 HH TYR A 29 -7.255 2.022 -7.165 1.00 0.00 H new ATOM 403 N PHE A 30 -7.691 5.594 -2.432 1.00 0.00 N ATOM 404 CA PHE A 30 -8.271 4.409 -1.810 1.00 0.00 C ATOM 405 C PHE A 30 -8.641 3.369 -2.863 1.00 0.00 C ATOM 406 O PHE A 30 -9.656 3.497 -3.547 1.00 0.00 O ATOM 407 CB PHE A 30 -9.508 4.789 -0.994 1.00 0.00 C ATOM 408 CG PHE A 30 -9.183 5.451 0.314 1.00 0.00 C ATOM 409 CD1 PHE A 30 -9.051 6.828 0.394 1.00 0.00 C ATOM 410 CD2 PHE A 30 -9.009 4.697 1.463 1.00 0.00 C ATOM 411 CE1 PHE A 30 -8.753 7.442 1.596 1.00 0.00 C ATOM 412 CE2 PHE A 30 -8.711 5.305 2.668 1.00 0.00 C ATOM 413 CZ PHE A 30 -8.581 6.679 2.735 1.00 0.00 C ATOM 0 H PHE A 30 -8.370 6.213 -2.875 1.00 0.00 H new ATOM 0 HA PHE A 30 -7.525 3.976 -1.144 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -10.132 5.459 -1.586 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -10.096 3.892 -0.802 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -9.183 7.429 -0.494 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -9.107 3.622 1.417 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.655 8.516 1.645 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -8.580 4.706 3.557 1.00 0.00 H new ATOM 0 HZ PHE A 30 -8.346 7.155 3.675 1.00 0.00 H new ATOM 423 N GLY A 31 -7.810 2.339 -2.988 1.00 0.00 N ATOM 424 CA GLY A 31 -8.066 1.292 -3.960 1.00 0.00 C ATOM 425 C GLY A 31 -8.324 -0.053 -3.309 1.00 0.00 C ATOM 426 O GLY A 31 -7.395 -0.713 -2.845 1.00 0.00 O ATOM 0 H GLY A 31 -6.964 2.211 -2.433 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.927 1.568 -4.569 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -7.213 1.209 -4.633 1.00 0.00 H new ATOM 430 N ARG A 32 -9.590 -0.458 -3.273 1.00 0.00 N ATOM 431 CA ARG A 32 -9.967 -1.731 -2.671 1.00 0.00 C ATOM 432 C ARG A 32 -9.530 -2.899 -3.551 1.00 0.00 C ATOM 433 O ARG A 32 -9.765 -2.901 -4.760 1.00 0.00 O ATOM 434 CB ARG A 32 -11.480 -1.785 -2.448 1.00 0.00 C ATOM 435 CG ARG A 32 -12.250 -2.358 -3.627 1.00 0.00 C ATOM 436 CD ARG A 32 -12.381 -3.869 -3.525 1.00 0.00 C ATOM 437 NE ARG A 32 -13.601 -4.266 -2.826 1.00 0.00 N ATOM 438 CZ ARG A 32 -14.047 -5.517 -2.779 1.00 0.00 C ATOM 439 NH1 ARG A 32 -13.377 -6.486 -3.386 1.00 0.00 N ATOM 440 NH2 ARG A 32 -15.165 -5.799 -2.123 1.00 0.00 N ATOM 0 H ARG A 32 -10.371 0.077 -3.653 1.00 0.00 H new ATOM 0 HA ARG A 32 -9.461 -1.814 -1.709 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -11.687 -2.387 -1.563 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -11.844 -0.779 -2.242 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.242 -1.908 -3.669 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -11.742 -2.098 -4.556 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -12.379 -4.302 -4.526 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -11.515 -4.274 -3.001 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.140 -3.544 -2.348 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -12.517 -6.272 -3.891 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -13.722 -7.445 -3.348 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -15.683 -5.056 -1.654 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.507 -6.759 -2.087 1.00 0.00 H new ATOM 454 N LEU A 33 -8.894 -3.889 -2.936 1.00 0.00 N ATOM 455 CA LEU A 33 -8.423 -5.063 -3.663 1.00 0.00 C ATOM 456 C LEU A 33 -9.577 -6.011 -3.974 1.00 0.00 C ATOM 457 O LEU A 33 -10.486 -6.183 -3.161 1.00 0.00 O ATOM 458 CB LEU A 33 -7.352 -5.795 -2.851 1.00 0.00 C ATOM 459 CG LEU A 33 -6.238 -4.923 -2.270 1.00 0.00 C ATOM 460 CD1 LEU A 33 -5.569 -5.624 -1.098 1.00 0.00 C ATOM 461 CD2 LEU A 33 -5.215 -4.580 -3.344 1.00 0.00 C ATOM 0 H LEU A 33 -8.692 -3.903 -1.936 1.00 0.00 H new ATOM 0 HA LEU A 33 -7.990 -4.726 -4.605 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -7.842 -6.319 -2.030 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -6.897 -6.554 -3.488 1.00 0.00 H new ATOM 0 HG LEU A 33 -6.680 -3.995 -1.908 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -4.779 -4.989 -0.697 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -6.308 -5.819 -0.321 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -5.140 -6.568 -1.435 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -4.429 -3.959 -2.913 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -4.778 -5.498 -3.736 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -5.704 -4.037 -4.152 1.00 0.00 H new ATOM 473 N GLN A 34 -9.533 -6.623 -5.153 1.00 0.00 N ATOM 474 CA GLN A 34 -10.575 -7.554 -5.569 1.00 0.00 C ATOM 475 C GLN A 34 -10.126 -8.998 -5.371 1.00 0.00 C ATOM 476 O GLN A 34 -9.517 -9.596 -6.256 1.00 0.00 O ATOM 477 CB GLN A 34 -10.943 -7.318 -7.035 1.00 0.00 C ATOM 478 CG GLN A 34 -12.085 -6.332 -7.225 1.00 0.00 C ATOM 479 CD GLN A 34 -13.262 -6.620 -6.314 1.00 0.00 C ATOM 480 OE1 GLN A 34 -13.869 -5.567 -5.780 1.00 0.00 O flip ATOM 481 NE2 GLN A 34 -13.622 -7.777 -6.093 1.00 0.00 N flip ATOM 0 H GLN A 34 -8.787 -6.491 -5.837 1.00 0.00 H new ATOM 0 HA GLN A 34 -11.453 -7.378 -4.948 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -10.065 -6.951 -7.567 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -11.217 -8.270 -7.490 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -11.723 -5.321 -7.036 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -12.418 -6.362 -8.263 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -13.126 -8.557 -6.525 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -14.416 -7.955 -5.478 1.00 0.00 H new ATOM 490 N GLY A 35 -10.431 -9.553 -4.202 1.00 0.00 N ATOM 491 CA GLY A 35 -10.051 -10.922 -3.908 1.00 0.00 C ATOM 492 C GLY A 35 -9.420 -11.068 -2.538 1.00 0.00 C ATOM 493 O GLY A 35 -9.815 -11.929 -1.753 1.00 0.00 O ATOM 0 H GLY A 35 -10.935 -9.078 -3.453 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -10.932 -11.561 -3.969 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -9.350 -11.272 -4.666 1.00 0.00 H new ATOM 497 N GLY A 36 -8.435 -10.223 -2.248 1.00 0.00 N ATOM 498 CA GLY A 36 -7.763 -10.279 -0.963 1.00 0.00 C ATOM 499 C GLY A 36 -6.350 -10.819 -1.070 1.00 0.00 C ATOM 500 O GLY A 36 -5.996 -11.458 -2.061 1.00 0.00 O ATOM 0 H GLY A 36 -8.091 -9.501 -2.880 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.735 -9.280 -0.527 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -8.338 -10.907 -0.283 1.00 0.00 H new ATOM 504 N LEU A 37 -5.541 -10.560 -0.049 1.00 0.00 N ATOM 505 CA LEU A 37 -4.158 -11.023 -0.033 1.00 0.00 C ATOM 506 C LEU A 37 -4.078 -12.511 -0.355 1.00 0.00 C ATOM 507 O LEU A 37 -4.405 -13.357 0.479 1.00 0.00 O ATOM 508 CB LEU A 37 -3.523 -10.749 1.332 1.00 0.00 C ATOM 509 CG LEU A 37 -3.414 -9.279 1.739 1.00 0.00 C ATOM 510 CD1 LEU A 37 -2.826 -9.155 3.136 1.00 0.00 C ATOM 511 CD2 LEU A 37 -2.571 -8.509 0.733 1.00 0.00 C ATOM 0 H LEU A 37 -5.819 -10.032 0.778 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.609 -10.475 -0.798 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -4.102 -11.274 2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -2.523 -11.182 1.339 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.415 -8.849 1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -2.756 -8.102 3.409 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -3.468 -9.673 3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -1.832 -9.601 3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -2.504 -7.465 1.038 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -1.571 -8.940 0.691 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -3.034 -8.570 -0.252 1.00 0.00 H new ATOM 523 N THR A 38 -3.638 -12.826 -1.569 1.00 0.00 N ATOM 524 CA THR A 38 -3.514 -14.213 -2.001 1.00 0.00 C ATOM 525 C THR A 38 -2.089 -14.525 -2.443 1.00 0.00 C ATOM 526 O THR A 38 -1.398 -13.669 -2.994 1.00 0.00 O ATOM 527 CB THR A 38 -4.479 -14.529 -3.159 1.00 0.00 C ATOM 528 OG1 THR A 38 -3.972 -13.985 -4.383 1.00 0.00 O ATOM 529 CG2 THR A 38 -5.863 -13.962 -2.881 1.00 0.00 C ATOM 0 H THR A 38 -3.361 -12.139 -2.271 1.00 0.00 H new ATOM 0 HA THR A 38 -3.771 -14.835 -1.144 1.00 0.00 H new ATOM 0 HB THR A 38 -4.559 -15.612 -3.249 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.591 -14.192 -5.114 1.00 0.00 H new ATOM 0 HG21 THR A 38 -6.527 -14.198 -3.713 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.259 -14.401 -1.965 1.00 0.00 H new ATOM 0 HG23 THR A 38 -5.797 -12.880 -2.765 1.00 0.00 H new ATOM 537 N ALA A 39 -1.655 -15.758 -2.198 1.00 0.00 N ATOM 538 CA ALA A 39 -0.313 -16.183 -2.574 1.00 0.00 C ATOM 539 C ALA A 39 0.036 -15.721 -3.984 1.00 0.00 C ATOM 540 O ALA A 39 1.195 -15.439 -4.287 1.00 0.00 O ATOM 541 CB ALA A 39 -0.190 -17.696 -2.467 1.00 0.00 C ATOM 0 H ALA A 39 -2.214 -16.479 -1.741 1.00 0.00 H new ATOM 0 HA ALA A 39 0.394 -15.721 -1.884 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.818 -18.000 -2.751 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -0.387 -18.005 -1.441 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -0.912 -18.168 -3.133 1.00 0.00 H new ATOM 547 N ARG A 40 -0.975 -15.645 -4.844 1.00 0.00 N ATOM 548 CA ARG A 40 -0.775 -15.218 -6.223 1.00 0.00 C ATOM 549 C ARG A 40 -1.245 -13.780 -6.421 1.00 0.00 C ATOM 550 O ARG A 40 -1.863 -13.452 -7.434 1.00 0.00 O ATOM 551 CB ARG A 40 -1.523 -16.147 -7.181 1.00 0.00 C ATOM 552 CG ARG A 40 -1.131 -17.609 -7.042 1.00 0.00 C ATOM 553 CD ARG A 40 0.156 -17.914 -7.791 1.00 0.00 C ATOM 554 NE ARG A 40 0.583 -19.298 -7.605 1.00 0.00 N ATOM 555 CZ ARG A 40 1.391 -19.937 -8.443 1.00 0.00 C ATOM 556 NH1 ARG A 40 1.858 -19.320 -9.520 1.00 0.00 N ATOM 557 NH2 ARG A 40 1.734 -21.197 -8.206 1.00 0.00 N ATOM 0 H ARG A 40 -1.941 -15.874 -4.609 1.00 0.00 H new ATOM 0 HA ARG A 40 0.292 -15.266 -6.440 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -2.594 -16.049 -7.006 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -1.336 -15.825 -8.206 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -1.006 -17.855 -5.987 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -1.934 -18.240 -7.424 1.00 0.00 H new ATOM 0 HD2 ARG A 40 0.012 -17.719 -8.854 1.00 0.00 H new ATOM 0 HD3 ARG A 40 0.943 -17.243 -7.448 1.00 0.00 H new ATOM 0 HE ARG A 40 0.242 -19.802 -6.786 1.00 0.00 H new ATOM 0 HH11 ARG A 40 1.597 -18.352 -9.707 1.00 0.00 H new ATOM 0 HH12 ARG A 40 2.478 -19.814 -10.162 1.00 0.00 H new ATOM 0 HH21 ARG A 40 1.377 -21.676 -7.379 1.00 0.00 H new ATOM 0 HH22 ARG A 40 2.355 -21.686 -8.851 1.00 0.00 H new ATOM 571 N ARG A 41 -0.948 -12.926 -5.447 1.00 0.00 N ATOM 572 CA ARG A 41 -1.342 -11.524 -5.513 1.00 0.00 C ATOM 573 C ARG A 41 -0.129 -10.611 -5.361 1.00 0.00 C ATOM 574 O ARG A 41 0.727 -10.835 -4.504 1.00 0.00 O ATOM 575 CB ARG A 41 -2.371 -11.209 -4.425 1.00 0.00 C ATOM 576 CG ARG A 41 -2.845 -9.765 -4.436 1.00 0.00 C ATOM 577 CD ARG A 41 -4.141 -9.599 -3.657 1.00 0.00 C ATOM 578 NE ARG A 41 -5.296 -10.086 -4.407 1.00 0.00 N ATOM 579 CZ ARG A 41 -5.986 -9.338 -5.260 1.00 0.00 C ATOM 580 NH1 ARG A 41 -5.640 -8.076 -5.472 1.00 0.00 N ATOM 581 NH2 ARG A 41 -7.026 -9.853 -5.905 1.00 0.00 N ATOM 0 H ARG A 41 -0.436 -13.181 -4.603 1.00 0.00 H new ATOM 0 HA ARG A 41 -1.790 -11.344 -6.490 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.232 -11.866 -4.549 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -1.937 -11.433 -3.450 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -2.075 -9.125 -4.005 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -2.993 -9.437 -5.465 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -4.068 -10.139 -2.713 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.285 -8.547 -3.413 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.588 -11.053 -4.268 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -4.841 -7.676 -4.979 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -6.172 -7.505 -6.128 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -7.295 -10.824 -5.745 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -7.556 -9.278 -6.560 1.00 0.00 H new ATOM 595 N THR A 42 -0.061 -9.580 -6.197 1.00 0.00 N ATOM 596 CA THR A 42 1.047 -8.634 -6.157 1.00 0.00 C ATOM 597 C THR A 42 0.548 -7.198 -6.267 1.00 0.00 C ATOM 598 O THR A 42 -0.182 -6.854 -7.198 1.00 0.00 O ATOM 599 CB THR A 42 2.056 -8.903 -7.289 1.00 0.00 C ATOM 600 OG1 THR A 42 2.489 -10.267 -7.245 1.00 0.00 O ATOM 601 CG2 THR A 42 3.259 -7.979 -7.172 1.00 0.00 C ATOM 0 H THR A 42 -0.761 -9.379 -6.911 1.00 0.00 H new ATOM 0 HA THR A 42 1.545 -8.770 -5.197 1.00 0.00 H new ATOM 0 HB THR A 42 1.561 -8.710 -8.241 1.00 0.00 H new ATOM 0 HG1 THR A 42 3.129 -10.431 -7.969 1.00 0.00 H new ATOM 0 HG21 THR A 42 3.958 -8.187 -7.982 1.00 0.00 H new ATOM 0 HG22 THR A 42 2.929 -6.942 -7.235 1.00 0.00 H new ATOM 0 HG23 THR A 42 3.753 -8.145 -6.215 1.00 0.00 H new ATOM 609 N ILE A 43 0.946 -6.364 -5.313 1.00 0.00 N ATOM 610 CA ILE A 43 0.539 -4.964 -5.305 1.00 0.00 C ATOM 611 C ILE A 43 1.633 -4.071 -5.880 1.00 0.00 C ATOM 612 O ILE A 43 2.803 -4.189 -5.513 1.00 0.00 O ATOM 613 CB ILE A 43 0.198 -4.485 -3.881 1.00 0.00 C ATOM 614 CG1 ILE A 43 -0.976 -5.288 -3.317 1.00 0.00 C ATOM 615 CG2 ILE A 43 -0.124 -2.998 -3.885 1.00 0.00 C ATOM 616 CD1 ILE A 43 -0.557 -6.566 -2.625 1.00 0.00 C ATOM 0 H ILE A 43 1.550 -6.633 -4.536 1.00 0.00 H new ATOM 0 HA ILE A 43 -0.352 -4.891 -5.928 1.00 0.00 H new ATOM 0 HB ILE A 43 1.066 -4.647 -3.242 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -1.526 -4.665 -2.611 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -1.662 -5.532 -4.128 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -0.363 -2.675 -2.872 1.00 0.00 H new ATOM 0 HG22 ILE A 43 0.738 -2.440 -4.250 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -0.978 -2.812 -4.536 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -1.440 -7.083 -2.250 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -0.033 -7.208 -3.333 1.00 0.00 H new ATOM 0 HD13 ILE A 43 0.105 -6.329 -1.792 1.00 0.00 H new ATOM 628 N ILE A 44 1.245 -3.176 -6.783 1.00 0.00 N ATOM 629 CA ILE A 44 2.192 -2.261 -7.407 1.00 0.00 C ATOM 630 C ILE A 44 1.773 -0.810 -7.199 1.00 0.00 C ATOM 631 O ILE A 44 0.605 -0.460 -7.372 1.00 0.00 O ATOM 632 CB ILE A 44 2.327 -2.533 -8.917 1.00 0.00 C ATOM 633 CG1 ILE A 44 2.895 -3.934 -9.156 1.00 0.00 C ATOM 634 CG2 ILE A 44 3.210 -1.480 -9.569 1.00 0.00 C ATOM 635 CD1 ILE A 44 2.798 -4.388 -10.596 1.00 0.00 C ATOM 0 H ILE A 44 0.281 -3.066 -7.098 1.00 0.00 H new ATOM 0 HA ILE A 44 3.156 -2.431 -6.928 1.00 0.00 H new ATOM 0 HB ILE A 44 1.337 -2.480 -9.370 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.940 -3.951 -8.848 1.00 0.00 H new ATOM 0 HG13 ILE A 44 2.365 -4.645 -8.523 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.295 -1.687 -10.636 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.768 -0.494 -9.424 1.00 0.00 H new ATOM 0 HG23 ILE A 44 4.200 -1.504 -9.115 1.00 0.00 H new ATOM 0 HD11 ILE A 44 3.219 -5.389 -10.691 1.00 0.00 H new ATOM 0 HD12 ILE A 44 1.752 -4.404 -10.903 1.00 0.00 H new ATOM 0 HD13 ILE A 44 3.353 -3.699 -11.233 1.00 0.00 H new ATOM 647 N ILE A 45 2.733 0.031 -6.829 1.00 0.00 N ATOM 648 CA ILE A 45 2.464 1.445 -6.601 1.00 0.00 C ATOM 649 C ILE A 45 3.545 2.319 -7.229 1.00 0.00 C ATOM 650 O ILE A 45 4.673 2.379 -6.739 1.00 0.00 O ATOM 651 CB ILE A 45 2.371 1.764 -5.097 1.00 0.00 C ATOM 652 CG1 ILE A 45 1.192 1.020 -4.467 1.00 0.00 C ATOM 653 CG2 ILE A 45 2.233 3.264 -4.882 1.00 0.00 C ATOM 654 CD1 ILE A 45 1.306 0.866 -2.967 1.00 0.00 C ATOM 0 H ILE A 45 3.704 -0.243 -6.681 1.00 0.00 H new ATOM 0 HA ILE A 45 1.505 1.664 -7.071 1.00 0.00 H new ATOM 0 HB ILE A 45 3.288 1.429 -4.612 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.270 1.553 -4.700 1.00 0.00 H new ATOM 0 HG13 ILE A 45 1.112 0.032 -4.920 1.00 0.00 H new ATOM 0 HG21 ILE A 45 2.168 3.474 -3.814 1.00 0.00 H new ATOM 0 HG22 ILE A 45 3.102 3.773 -5.300 1.00 0.00 H new ATOM 0 HG23 ILE A 45 1.330 3.621 -5.377 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.436 0.329 -2.589 1.00 0.00 H new ATOM 0 HD12 ILE A 45 2.210 0.306 -2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 45 1.355 1.851 -2.503 1.00 0.00 H new ATOM 666 N LYS A 46 3.192 2.997 -8.316 1.00 0.00 N ATOM 667 CA LYS A 46 4.129 3.871 -9.010 1.00 0.00 C ATOM 668 C LYS A 46 3.740 5.335 -8.835 1.00 0.00 C ATOM 669 O LYS A 46 2.726 5.786 -9.367 1.00 0.00 O ATOM 670 CB LYS A 46 4.179 3.520 -10.499 1.00 0.00 C ATOM 671 CG LYS A 46 5.214 2.462 -10.841 1.00 0.00 C ATOM 672 CD LYS A 46 4.990 1.891 -12.231 1.00 0.00 C ATOM 673 CE LYS A 46 4.101 0.658 -12.191 1.00 0.00 C ATOM 674 NZ LYS A 46 4.895 -0.594 -12.049 1.00 0.00 N ATOM 0 H LYS A 46 2.263 2.958 -8.735 1.00 0.00 H new ATOM 0 HA LYS A 46 5.117 3.721 -8.574 1.00 0.00 H new ATOM 0 HB2 LYS A 46 3.196 3.170 -10.814 1.00 0.00 H new ATOM 0 HB3 LYS A 46 4.393 4.424 -11.070 1.00 0.00 H new ATOM 0 HG2 LYS A 46 6.212 2.896 -10.781 1.00 0.00 H new ATOM 0 HG3 LYS A 46 5.171 1.659 -10.106 1.00 0.00 H new ATOM 0 HD2 LYS A 46 4.534 2.649 -12.868 1.00 0.00 H new ATOM 0 HD3 LYS A 46 5.950 1.634 -12.679 1.00 0.00 H new ATOM 0 HE2 LYS A 46 3.402 0.741 -11.359 1.00 0.00 H new ATOM 0 HE3 LYS A 46 3.506 0.609 -13.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 4.311 -1.409 -12.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 5.734 -0.544 -12.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 5.195 -0.704 -11.059 1.00 0.00 H new ATOM 688 N GLY A 47 4.554 6.074 -8.087 1.00 0.00 N ATOM 689 CA GLY A 47 4.278 7.480 -7.856 1.00 0.00 C ATOM 690 C GLY A 47 5.533 8.329 -7.879 1.00 0.00 C ATOM 691 O GLY A 47 6.449 8.074 -8.661 1.00 0.00 O ATOM 0 H GLY A 47 5.400 5.724 -7.637 1.00 0.00 H new ATOM 0 HA2 GLY A 47 3.585 7.841 -8.616 1.00 0.00 H new ATOM 0 HA3 GLY A 47 3.782 7.596 -6.892 1.00 0.00 H new ATOM 695 N TYR A 48 5.576 9.341 -7.020 1.00 0.00 N ATOM 696 CA TYR A 48 6.727 10.233 -6.947 1.00 0.00 C ATOM 697 C TYR A 48 6.631 11.149 -5.730 1.00 0.00 C ATOM 698 O TYR A 48 5.626 11.833 -5.532 1.00 0.00 O ATOM 699 CB TYR A 48 6.832 11.071 -8.223 1.00 0.00 C ATOM 700 CG TYR A 48 7.567 12.377 -8.031 1.00 0.00 C ATOM 701 CD1 TYR A 48 6.907 13.507 -7.562 1.00 0.00 C ATOM 702 CD2 TYR A 48 8.922 12.484 -8.319 1.00 0.00 C ATOM 703 CE1 TYR A 48 7.575 14.703 -7.385 1.00 0.00 C ATOM 704 CE2 TYR A 48 9.599 13.676 -8.144 1.00 0.00 C ATOM 705 CZ TYR A 48 8.920 14.782 -7.677 1.00 0.00 C ATOM 706 OH TYR A 48 9.590 15.972 -7.503 1.00 0.00 O ATOM 0 H TYR A 48 4.827 9.564 -6.364 1.00 0.00 H new ATOM 0 HA TYR A 48 7.623 9.620 -6.848 1.00 0.00 H new ATOM 0 HB2 TYR A 48 7.341 10.487 -8.990 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.829 11.280 -8.594 1.00 0.00 H new ATOM 0 HD1 TYR A 48 5.853 13.449 -7.332 1.00 0.00 H new ATOM 0 HD2 TYR A 48 9.456 11.620 -8.686 1.00 0.00 H new ATOM 0 HE1 TYR A 48 7.047 15.571 -7.020 1.00 0.00 H new ATOM 0 HE2 TYR A 48 10.653 13.741 -8.371 1.00 0.00 H new ATOM 0 HH TYR A 48 8.972 16.719 -7.643 1.00 0.00 H new ATOM 716 N VAL A 49 7.683 11.157 -4.919 1.00 0.00 N ATOM 717 CA VAL A 49 7.720 11.989 -3.722 1.00 0.00 C ATOM 718 C VAL A 49 8.009 13.444 -4.073 1.00 0.00 C ATOM 719 O VAL A 49 9.076 13.785 -4.585 1.00 0.00 O ATOM 720 CB VAL A 49 8.783 11.492 -2.725 1.00 0.00 C ATOM 721 CG1 VAL A 49 8.610 12.173 -1.376 1.00 0.00 C ATOM 722 CG2 VAL A 49 8.712 9.979 -2.580 1.00 0.00 C ATOM 0 H VAL A 49 8.522 10.596 -5.069 1.00 0.00 H new ATOM 0 HA VAL A 49 6.736 11.919 -3.257 1.00 0.00 H new ATOM 0 HB VAL A 49 9.768 11.751 -3.113 1.00 0.00 H new ATOM 0 HG11 VAL A 49 9.370 11.809 -0.685 1.00 0.00 H new ATOM 0 HG12 VAL A 49 8.715 13.251 -1.497 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.620 11.947 -0.979 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.470 9.645 -1.872 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.725 9.694 -2.216 1.00 0.00 H new ATOM 0 HG23 VAL A 49 8.890 9.512 -3.549 1.00 0.00 H new ATOM 732 N PRO A 50 7.037 14.325 -3.793 1.00 0.00 N ATOM 733 CA PRO A 50 7.164 15.759 -4.070 1.00 0.00 C ATOM 734 C PRO A 50 8.178 16.438 -3.156 1.00 0.00 C ATOM 735 O PRO A 50 8.506 15.944 -2.077 1.00 0.00 O ATOM 736 CB PRO A 50 5.757 16.298 -3.801 1.00 0.00 C ATOM 737 CG PRO A 50 5.159 15.332 -2.837 1.00 0.00 C ATOM 738 CD PRO A 50 5.739 13.989 -3.183 1.00 0.00 C ATOM 0 HA PRO A 50 7.522 15.949 -5.082 1.00 0.00 H new ATOM 0 HB2 PRO A 50 5.792 17.304 -3.383 1.00 0.00 H new ATOM 0 HB3 PRO A 50 5.172 16.354 -4.719 1.00 0.00 H new ATOM 0 HG2 PRO A 50 5.398 15.607 -1.810 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.072 15.321 -2.919 1.00 0.00 H new ATOM 0 HD2 PRO A 50 5.860 13.364 -2.298 1.00 0.00 H new ATOM 0 HD3 PRO A 50 5.099 13.441 -3.875 1.00 0.00 H new ATOM 746 N PRO A 51 8.688 17.598 -3.595 1.00 0.00 N ATOM 747 CA PRO A 51 9.672 18.371 -2.831 1.00 0.00 C ATOM 748 C PRO A 51 9.070 18.997 -1.577 1.00 0.00 C ATOM 749 O PRO A 51 9.790 19.370 -0.650 1.00 0.00 O ATOM 750 CB PRO A 51 10.111 19.458 -3.814 1.00 0.00 C ATOM 751 CG PRO A 51 8.960 19.611 -4.748 1.00 0.00 C ATOM 752 CD PRO A 51 8.343 18.246 -4.872 1.00 0.00 C ATOM 0 HA PRO A 51 10.491 17.747 -2.472 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.330 20.393 -3.298 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.017 19.168 -4.346 1.00 0.00 H new ATOM 0 HG2 PRO A 51 8.239 20.332 -4.363 1.00 0.00 H new ATOM 0 HG3 PRO A 51 9.292 19.979 -5.719 1.00 0.00 H new ATOM 0 HD2 PRO A 51 7.264 18.304 -5.014 1.00 0.00 H new ATOM 0 HD3 PRO A 51 8.748 17.698 -5.723 1.00 0.00 H new ATOM 760 N THR A 52 7.746 19.110 -1.555 1.00 0.00 N ATOM 761 CA THR A 52 7.048 19.692 -0.416 1.00 0.00 C ATOM 762 C THR A 52 6.271 18.630 0.354 1.00 0.00 C ATOM 763 O THR A 52 5.332 18.941 1.085 1.00 0.00 O ATOM 764 CB THR A 52 6.075 20.801 -0.860 1.00 0.00 C ATOM 765 OG1 THR A 52 5.132 20.278 -1.802 1.00 0.00 O ATOM 766 CG2 THR A 52 6.830 21.965 -1.484 1.00 0.00 C ATOM 0 H THR A 52 7.135 18.806 -2.313 1.00 0.00 H new ATOM 0 HA THR A 52 7.809 20.124 0.233 1.00 0.00 H new ATOM 0 HB THR A 52 5.545 21.162 0.021 1.00 0.00 H new ATOM 0 HG1 THR A 52 4.516 20.989 -2.078 1.00 0.00 H new ATOM 0 HG21 THR A 52 6.122 22.736 -1.790 1.00 0.00 H new ATOM 0 HG22 THR A 52 7.526 22.380 -0.755 1.00 0.00 H new ATOM 0 HG23 THR A 52 7.384 21.615 -2.355 1.00 0.00 H new ATOM 774 N GLY A 53 6.670 17.373 0.185 1.00 0.00 N ATOM 775 CA GLY A 53 6.001 16.283 0.871 1.00 0.00 C ATOM 776 C GLY A 53 6.904 15.584 1.867 1.00 0.00 C ATOM 777 O GLY A 53 7.948 15.044 1.499 1.00 0.00 O ATOM 0 H GLY A 53 7.445 17.090 -0.415 1.00 0.00 H new ATOM 0 HA2 GLY A 53 5.123 16.668 1.389 1.00 0.00 H new ATOM 0 HA3 GLY A 53 5.646 15.560 0.137 1.00 0.00 H new ATOM 781 N LYS A 54 6.504 15.593 3.135 1.00 0.00 N ATOM 782 CA LYS A 54 7.285 14.956 4.188 1.00 0.00 C ATOM 783 C LYS A 54 7.426 13.459 3.931 1.00 0.00 C ATOM 784 O LYS A 54 8.536 12.946 3.786 1.00 0.00 O ATOM 785 CB LYS A 54 6.627 15.189 5.550 1.00 0.00 C ATOM 786 CG LYS A 54 6.419 16.657 5.881 1.00 0.00 C ATOM 787 CD LYS A 54 6.287 16.878 7.379 1.00 0.00 C ATOM 788 CE LYS A 54 7.649 16.948 8.054 1.00 0.00 C ATOM 789 NZ LYS A 54 8.315 18.260 7.824 1.00 0.00 N ATOM 0 H LYS A 54 5.643 16.035 3.457 1.00 0.00 H new ATOM 0 HA LYS A 54 8.279 15.402 4.189 1.00 0.00 H new ATOM 0 HB2 LYS A 54 5.663 14.680 5.570 1.00 0.00 H new ATOM 0 HB3 LYS A 54 7.244 14.734 6.325 1.00 0.00 H new ATOM 0 HG2 LYS A 54 7.257 17.239 5.499 1.00 0.00 H new ATOM 0 HG3 LYS A 54 5.523 17.021 5.378 1.00 0.00 H new ATOM 0 HD2 LYS A 54 5.740 17.802 7.565 1.00 0.00 H new ATOM 0 HD3 LYS A 54 5.704 16.068 7.817 1.00 0.00 H new ATOM 0 HE2 LYS A 54 7.532 16.783 9.125 1.00 0.00 H new ATOM 0 HE3 LYS A 54 8.284 16.147 7.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 9.183 18.314 8.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 8.556 18.355 6.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 7.671 19.029 8.100 1.00 0.00 H new ATOM 803 N SER A 55 6.295 12.763 3.873 1.00 0.00 N ATOM 804 CA SER A 55 6.293 11.325 3.635 1.00 0.00 C ATOM 805 C SER A 55 4.868 10.798 3.501 1.00 0.00 C ATOM 806 O SER A 55 3.917 11.416 3.980 1.00 0.00 O ATOM 807 CB SER A 55 7.013 10.597 4.773 1.00 0.00 C ATOM 808 OG SER A 55 6.506 10.997 6.034 1.00 0.00 O ATOM 0 H SER A 55 5.368 13.172 3.988 1.00 0.00 H new ATOM 0 HA SER A 55 6.821 11.136 2.700 1.00 0.00 H new ATOM 0 HB2 SER A 55 6.893 9.520 4.654 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.082 10.806 4.724 1.00 0.00 H new ATOM 0 HG SER A 55 6.980 10.517 6.745 1.00 0.00 H new ATOM 814 N PHE A 56 4.727 9.650 2.845 1.00 0.00 N ATOM 815 CA PHE A 56 3.418 9.039 2.646 1.00 0.00 C ATOM 816 C PHE A 56 3.265 7.790 3.508 1.00 0.00 C ATOM 817 O PHE A 56 4.116 7.492 4.346 1.00 0.00 O ATOM 818 CB PHE A 56 3.217 8.683 1.171 1.00 0.00 C ATOM 819 CG PHE A 56 4.359 7.907 0.581 1.00 0.00 C ATOM 820 CD1 PHE A 56 5.582 8.517 0.350 1.00 0.00 C ATOM 821 CD2 PHE A 56 4.210 6.569 0.257 1.00 0.00 C ATOM 822 CE1 PHE A 56 6.635 7.805 -0.193 1.00 0.00 C ATOM 823 CE2 PHE A 56 5.260 5.852 -0.286 1.00 0.00 C ATOM 824 CZ PHE A 56 6.474 6.471 -0.513 1.00 0.00 C ATOM 0 H PHE A 56 5.503 9.125 2.443 1.00 0.00 H new ATOM 0 HA PHE A 56 2.658 9.761 2.945 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.301 8.101 1.067 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.078 9.601 0.600 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.714 9.560 0.597 1.00 0.00 H new ATOM 0 HD2 PHE A 56 3.263 6.080 0.430 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.583 8.292 -0.367 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.131 4.808 -0.533 1.00 0.00 H new ATOM 0 HZ PHE A 56 7.295 5.913 -0.939 1.00 0.00 H new ATOM 834 N ALA A 57 2.173 7.062 3.296 1.00 0.00 N ATOM 835 CA ALA A 57 1.907 5.844 4.052 1.00 0.00 C ATOM 836 C ALA A 57 1.006 4.897 3.267 1.00 0.00 C ATOM 837 O ALA A 57 0.074 5.332 2.588 1.00 0.00 O ATOM 838 CB ALA A 57 1.278 6.183 5.395 1.00 0.00 C ATOM 0 H ALA A 57 1.458 7.295 2.607 1.00 0.00 H new ATOM 0 HA ALA A 57 2.857 5.339 4.226 1.00 0.00 H new ATOM 0 HB1 ALA A 57 1.085 5.264 5.949 1.00 0.00 H new ATOM 0 HB2 ALA A 57 1.958 6.815 5.966 1.00 0.00 H new ATOM 0 HB3 ALA A 57 0.340 6.713 5.234 1.00 0.00 H new ATOM 844 N ILE A 58 1.288 3.603 3.364 1.00 0.00 N ATOM 845 CA ILE A 58 0.502 2.595 2.664 1.00 0.00 C ATOM 846 C ILE A 58 -0.071 1.570 3.637 1.00 0.00 C ATOM 847 O ILE A 58 0.616 0.636 4.046 1.00 0.00 O ATOM 848 CB ILE A 58 1.344 1.862 1.602 1.00 0.00 C ATOM 849 CG1 ILE A 58 2.218 2.858 0.837 1.00 0.00 C ATOM 850 CG2 ILE A 58 0.441 1.098 0.645 1.00 0.00 C ATOM 851 CD1 ILE A 58 3.556 3.117 1.494 1.00 0.00 C ATOM 0 H ILE A 58 2.056 3.227 3.921 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.315 3.120 2.170 1.00 0.00 H new ATOM 0 HB ILE A 58 1.995 1.147 2.105 1.00 0.00 H new ATOM 0 HG12 ILE A 58 2.385 2.482 -0.172 1.00 0.00 H new ATOM 0 HG13 ILE A 58 1.681 3.802 0.741 1.00 0.00 H new ATOM 0 HG21 ILE A 58 1.050 0.585 -0.099 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.143 0.366 1.202 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -0.232 1.795 0.145 1.00 0.00 H new ATOM 0 HD11 ILE A 58 4.122 3.832 0.897 1.00 0.00 H new ATOM 0 HD12 ILE A 58 3.398 3.523 2.493 1.00 0.00 H new ATOM 0 HD13 ILE A 58 4.113 2.183 1.566 1.00 0.00 H new ATOM 863 N ASN A 59 -1.336 1.753 4.003 1.00 0.00 N ATOM 864 CA ASN A 59 -2.003 0.844 4.927 1.00 0.00 C ATOM 865 C ASN A 59 -2.906 -0.130 4.176 1.00 0.00 C ATOM 866 O ASN A 59 -3.516 0.225 3.167 1.00 0.00 O ATOM 867 CB ASN A 59 -2.823 1.633 5.949 1.00 0.00 C ATOM 868 CG ASN A 59 -1.953 2.472 6.866 1.00 0.00 C ATOM 869 OD1 ASN A 59 -1.822 2.178 8.054 1.00 0.00 O ATOM 870 ND2 ASN A 59 -1.354 3.522 6.316 1.00 0.00 N ATOM 0 H ASN A 59 -1.919 2.522 3.674 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.237 0.271 5.450 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.525 2.282 5.425 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.415 0.941 6.548 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.756 4.123 6.883 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -1.492 3.727 5.326 1.00 0.00 H new ATOM 877 N PHE A 60 -2.987 -1.359 4.676 1.00 0.00 N ATOM 878 CA PHE A 60 -3.816 -2.384 4.053 1.00 0.00 C ATOM 879 C PHE A 60 -4.925 -2.836 4.998 1.00 0.00 C ATOM 880 O PHE A 60 -4.693 -3.623 5.915 1.00 0.00 O ATOM 881 CB PHE A 60 -2.958 -3.584 3.645 1.00 0.00 C ATOM 882 CG PHE A 60 -1.990 -3.280 2.537 1.00 0.00 C ATOM 883 CD1 PHE A 60 -0.884 -2.478 2.766 1.00 0.00 C ATOM 884 CD2 PHE A 60 -2.187 -3.796 1.266 1.00 0.00 C ATOM 885 CE1 PHE A 60 0.007 -2.196 1.748 1.00 0.00 C ATOM 886 CE2 PHE A 60 -1.299 -3.518 0.244 1.00 0.00 C ATOM 887 CZ PHE A 60 -0.199 -2.718 0.486 1.00 0.00 C ATOM 0 H PHE A 60 -2.489 -1.669 5.510 1.00 0.00 H new ATOM 0 HA PHE A 60 -4.275 -1.954 3.163 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -2.403 -3.936 4.515 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -3.612 -4.398 3.332 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -0.716 -2.069 3.751 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -3.045 -4.423 1.072 1.00 0.00 H new ATOM 0 HE1 PHE A 60 0.864 -1.568 1.939 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -1.465 -3.926 -0.742 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.498 -2.501 -0.310 1.00 0.00 H new ATOM 897 N LYS A 61 -6.132 -2.331 4.767 1.00 0.00 N ATOM 898 CA LYS A 61 -7.280 -2.681 5.596 1.00 0.00 C ATOM 899 C LYS A 61 -8.082 -3.813 4.963 1.00 0.00 C ATOM 900 O LYS A 61 -7.869 -4.167 3.804 1.00 0.00 O ATOM 901 CB LYS A 61 -8.178 -1.459 5.802 1.00 0.00 C ATOM 902 CG LYS A 61 -9.322 -1.702 6.771 1.00 0.00 C ATOM 903 CD LYS A 61 -10.051 -0.412 7.108 1.00 0.00 C ATOM 904 CE LYS A 61 -9.337 0.362 8.205 1.00 0.00 C ATOM 905 NZ LYS A 61 -9.994 1.670 8.480 1.00 0.00 N ATOM 0 H LYS A 61 -6.341 -1.678 4.012 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.909 -3.019 6.564 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.572 -0.631 6.169 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.587 -1.153 4.839 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -10.023 -2.414 6.336 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.936 -2.152 7.685 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -10.127 0.208 6.215 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -11.068 -0.640 7.426 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.319 -0.234 9.117 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.300 0.531 7.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.477 2.166 9.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -9.988 2.250 7.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -10.976 1.509 8.782 1.00 0.00 H new ATOM 919 N VAL A 62 -9.007 -4.379 5.733 1.00 0.00 N ATOM 920 CA VAL A 62 -9.844 -5.469 5.247 1.00 0.00 C ATOM 921 C VAL A 62 -11.223 -4.964 4.838 1.00 0.00 C ATOM 922 O VAL A 62 -11.942 -4.373 5.643 1.00 0.00 O ATOM 923 CB VAL A 62 -10.006 -6.570 6.312 1.00 0.00 C ATOM 924 CG1 VAL A 62 -10.850 -7.715 5.773 1.00 0.00 C ATOM 925 CG2 VAL A 62 -8.646 -7.070 6.772 1.00 0.00 C ATOM 0 H VAL A 62 -9.195 -4.100 6.696 1.00 0.00 H new ATOM 0 HA VAL A 62 -9.342 -5.889 4.375 1.00 0.00 H new ATOM 0 HB VAL A 62 -10.522 -6.145 7.173 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -10.953 -8.483 6.540 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -11.836 -7.342 5.498 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -10.366 -8.142 4.895 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.780 -7.847 7.524 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.102 -7.479 5.921 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.080 -6.243 7.201 1.00 0.00 H new ATOM 935 N GLY A 63 -11.587 -5.202 3.582 1.00 0.00 N ATOM 936 CA GLY A 63 -12.879 -4.766 3.088 1.00 0.00 C ATOM 937 C GLY A 63 -14.030 -5.321 3.904 1.00 0.00 C ATOM 938 O GLY A 63 -14.997 -4.614 4.188 1.00 0.00 O ATOM 0 H GLY A 63 -11.009 -5.690 2.897 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -12.921 -3.677 3.101 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -12.991 -5.077 2.049 1.00 0.00 H new ATOM 942 N SER A 64 -13.926 -6.591 4.282 1.00 0.00 N ATOM 943 CA SER A 64 -14.969 -7.243 5.066 1.00 0.00 C ATOM 944 C SER A 64 -15.089 -6.606 6.446 1.00 0.00 C ATOM 945 O SER A 64 -16.046 -5.884 6.728 1.00 0.00 O ATOM 946 CB SER A 64 -14.672 -8.738 5.206 1.00 0.00 C ATOM 947 OG SER A 64 -15.656 -9.381 5.996 1.00 0.00 O ATOM 0 H SER A 64 -13.130 -7.189 4.058 1.00 0.00 H new ATOM 0 HA SER A 64 -15.916 -7.115 4.542 1.00 0.00 H new ATOM 0 HB2 SER A 64 -14.635 -9.199 4.219 1.00 0.00 H new ATOM 0 HB3 SER A 64 -13.690 -8.876 5.659 1.00 0.00 H new ATOM 0 HG SER A 64 -15.445 -10.335 6.069 1.00 0.00 H new ATOM 953 N SER A 65 -14.111 -6.878 7.304 1.00 0.00 N ATOM 954 CA SER A 65 -14.108 -6.334 8.657 1.00 0.00 C ATOM 955 C SER A 65 -13.658 -4.877 8.657 1.00 0.00 C ATOM 956 O SER A 65 -14.472 -3.964 8.792 1.00 0.00 O ATOM 957 CB SER A 65 -13.191 -7.162 9.560 1.00 0.00 C ATOM 958 OG SER A 65 -13.206 -6.671 10.889 1.00 0.00 O ATOM 0 H SER A 65 -13.311 -7.472 7.086 1.00 0.00 H new ATOM 0 HA SER A 65 -15.126 -6.381 9.043 1.00 0.00 H new ATOM 0 HB2 SER A 65 -13.510 -8.204 9.550 1.00 0.00 H new ATOM 0 HB3 SER A 65 -12.173 -7.137 9.171 1.00 0.00 H new ATOM 0 HG SER A 65 -12.421 -6.104 11.037 1.00 0.00 H new ATOM 964 N GLY A 66 -12.354 -4.666 8.503 1.00 0.00 N ATOM 965 CA GLY A 66 -11.817 -3.318 8.487 1.00 0.00 C ATOM 966 C GLY A 66 -10.605 -3.166 9.385 1.00 0.00 C ATOM 967 O GLY A 66 -10.457 -2.156 10.074 1.00 0.00 O ATOM 0 H GLY A 66 -11.660 -5.405 8.389 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -11.545 -3.051 7.466 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -12.590 -2.618 8.804 1.00 0.00 H new ATOM 971 N ASP A 67 -9.738 -4.172 9.380 1.00 0.00 N ATOM 972 CA ASP A 67 -8.533 -4.146 10.201 1.00 0.00 C ATOM 973 C ASP A 67 -7.284 -4.039 9.331 1.00 0.00 C ATOM 974 O ASP A 67 -7.212 -4.636 8.256 1.00 0.00 O ATOM 975 CB ASP A 67 -8.456 -5.402 11.071 1.00 0.00 C ATOM 976 CG ASP A 67 -9.820 -5.860 11.548 1.00 0.00 C ATOM 977 OD1 ASP A 67 -10.729 -5.010 11.651 1.00 0.00 O ATOM 978 OD2 ASP A 67 -9.979 -7.069 11.816 1.00 0.00 O ATOM 0 H ASP A 67 -9.847 -5.015 8.817 1.00 0.00 H new ATOM 0 HA ASP A 67 -8.582 -3.268 10.845 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -7.984 -6.205 10.504 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -7.820 -5.204 11.934 1.00 0.00 H new ATOM 983 N ILE A 68 -6.305 -3.273 9.801 1.00 0.00 N ATOM 984 CA ILE A 68 -5.061 -3.088 9.066 1.00 0.00 C ATOM 985 C ILE A 68 -4.062 -4.194 9.388 1.00 0.00 C ATOM 986 O ILE A 68 -3.666 -4.371 10.539 1.00 0.00 O ATOM 987 CB ILE A 68 -4.419 -1.724 9.381 1.00 0.00 C ATOM 988 CG1 ILE A 68 -5.425 -0.595 9.146 1.00 0.00 C ATOM 989 CG2 ILE A 68 -3.173 -1.516 8.533 1.00 0.00 C ATOM 990 CD1 ILE A 68 -4.998 0.728 9.741 1.00 0.00 C ATOM 0 H ILE A 68 -6.350 -2.771 10.688 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.312 -3.126 8.006 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.126 -1.711 10.431 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -5.575 -0.470 8.074 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -6.387 -0.882 9.571 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -2.731 -0.548 8.767 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -2.452 -2.305 8.746 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -3.442 -1.546 7.477 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -5.758 1.482 9.536 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.876 0.620 10.819 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -4.052 1.038 9.298 1.00 0.00 H new ATOM 1002 N ALA A 69 -3.657 -4.935 8.362 1.00 0.00 N ATOM 1003 CA ALA A 69 -2.701 -6.022 8.534 1.00 0.00 C ATOM 1004 C ALA A 69 -1.272 -5.536 8.313 1.00 0.00 C ATOM 1005 O ALA A 69 -0.336 -6.020 8.951 1.00 0.00 O ATOM 1006 CB ALA A 69 -3.024 -7.165 7.584 1.00 0.00 C ATOM 0 H ALA A 69 -3.976 -4.802 7.402 1.00 0.00 H new ATOM 0 HA ALA A 69 -2.780 -6.383 9.559 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.302 -7.969 7.724 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -4.027 -7.538 7.791 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.975 -6.808 6.555 1.00 0.00 H new ATOM 1012 N LEU A 70 -1.111 -4.579 7.407 1.00 0.00 N ATOM 1013 CA LEU A 70 0.205 -4.028 7.101 1.00 0.00 C ATOM 1014 C LEU A 70 0.135 -2.514 6.931 1.00 0.00 C ATOM 1015 O LEU A 70 -0.712 -1.999 6.200 1.00 0.00 O ATOM 1016 CB LEU A 70 0.766 -4.670 5.831 1.00 0.00 C ATOM 1017 CG LEU A 70 2.079 -4.088 5.308 1.00 0.00 C ATOM 1018 CD1 LEU A 70 3.189 -4.269 6.333 1.00 0.00 C ATOM 1019 CD2 LEU A 70 2.461 -4.736 3.986 1.00 0.00 C ATOM 0 H LEU A 70 -1.875 -4.168 6.871 1.00 0.00 H new ATOM 0 HA LEU A 70 0.868 -4.251 7.937 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.913 -5.733 6.020 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.016 -4.587 5.044 1.00 0.00 H new ATOM 0 HG LEU A 70 1.939 -3.020 5.139 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.116 -3.849 5.943 1.00 0.00 H new ATOM 0 HD12 LEU A 70 2.918 -3.757 7.257 1.00 0.00 H new ATOM 0 HD13 LEU A 70 3.329 -5.331 6.534 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.398 -4.309 3.629 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.582 -5.810 4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 70 1.676 -4.554 3.252 1.00 0.00 H new ATOM 1031 N HIS A 71 1.032 -1.806 7.609 1.00 0.00 N ATOM 1032 CA HIS A 71 1.075 -0.350 7.531 1.00 0.00 C ATOM 1033 C HIS A 71 2.508 0.144 7.359 1.00 0.00 C ATOM 1034 O HIS A 71 3.224 0.353 8.339 1.00 0.00 O ATOM 1035 CB HIS A 71 0.457 0.268 8.786 1.00 0.00 C ATOM 1036 CG HIS A 71 0.845 1.698 9.003 1.00 0.00 C ATOM 1037 ND1 HIS A 71 0.994 2.411 10.144 1.00 0.00 N flip ATOM 1038 CD2 HIS A 71 1.130 2.566 7.970 1.00 0.00 C flip ATOM 1039 CE1 HIS A 71 1.363 3.684 9.783 1.00 0.00 C flip ATOM 1040 NE2 HIS A 71 1.439 3.751 8.466 1.00 0.00 N flip ATOM 0 H HIS A 71 1.739 -2.217 8.219 1.00 0.00 H new ATOM 0 HA HIS A 71 0.497 -0.041 6.660 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -0.629 0.201 8.717 1.00 0.00 H new ATOM 0 HB3 HIS A 71 0.758 -0.317 9.655 1.00 0.00 H new ATOM 0 HD2 HIS A 71 1.105 2.316 6.920 1.00 0.00 H new ATOM 0 HE1 HIS A 71 1.559 4.498 10.465 1.00 0.00 H new ATOM 0 HE2 HIS A 71 1.693 4.577 7.924 1.00 0.00 H new ATOM 1049 N ILE A 72 2.920 0.326 6.110 1.00 0.00 N ATOM 1050 CA ILE A 72 4.268 0.795 5.811 1.00 0.00 C ATOM 1051 C ILE A 72 4.294 2.308 5.622 1.00 0.00 C ATOM 1052 O ILE A 72 3.515 2.861 4.847 1.00 0.00 O ATOM 1053 CB ILE A 72 4.831 0.122 4.546 1.00 0.00 C ATOM 1054 CG1 ILE A 72 4.750 -1.401 4.673 1.00 0.00 C ATOM 1055 CG2 ILE A 72 6.267 0.563 4.305 1.00 0.00 C ATOM 1056 CD1 ILE A 72 4.806 -2.123 3.345 1.00 0.00 C ATOM 0 H ILE A 72 2.340 0.156 5.288 1.00 0.00 H new ATOM 0 HA ILE A 72 4.892 0.526 6.664 1.00 0.00 H new ATOM 0 HB ILE A 72 4.229 0.429 3.691 1.00 0.00 H new ATOM 0 HG12 ILE A 72 5.570 -1.749 5.301 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.824 -1.666 5.182 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.651 0.078 3.407 1.00 0.00 H new ATOM 0 HG22 ILE A 72 6.298 1.645 4.175 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.882 0.282 5.160 1.00 0.00 H new ATOM 0 HD11 ILE A 72 4.744 -3.198 3.513 1.00 0.00 H new ATOM 0 HD12 ILE A 72 3.971 -1.804 2.722 1.00 0.00 H new ATOM 0 HD13 ILE A 72 5.744 -1.888 2.842 1.00 0.00 H new ATOM 1068 N ASN A 73 5.197 2.973 6.336 1.00 0.00 N ATOM 1069 CA ASN A 73 5.326 4.422 6.246 1.00 0.00 C ATOM 1070 C ASN A 73 6.792 4.832 6.129 1.00 0.00 C ATOM 1071 O ASN A 73 7.552 4.794 7.097 1.00 0.00 O ATOM 1072 CB ASN A 73 4.696 5.088 7.471 1.00 0.00 C ATOM 1073 CG ASN A 73 4.267 6.517 7.195 1.00 0.00 C ATOM 1074 OD1 ASN A 73 5.135 7.280 6.542 1.00 0.00 O flip ATOM 1075 ND2 ASN A 73 3.167 6.928 7.565 1.00 0.00 N flip ATOM 0 H ASN A 73 5.850 2.531 6.983 1.00 0.00 H new ATOM 0 HA ASN A 73 4.801 4.753 5.350 1.00 0.00 H new ATOM 0 HB2 ASN A 73 3.831 4.507 7.793 1.00 0.00 H new ATOM 0 HB3 ASN A 73 5.410 5.078 8.294 1.00 0.00 H new ATOM 0 HD21 ASN A 73 2.532 6.306 8.064 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.891 7.891 7.372 1.00 0.00 H new ATOM 1082 N PRO A 74 7.199 5.233 4.916 1.00 0.00 N ATOM 1083 CA PRO A 74 8.575 5.659 4.643 1.00 0.00 C ATOM 1084 C PRO A 74 8.912 6.991 5.305 1.00 0.00 C ATOM 1085 O PRO A 74 8.027 7.805 5.568 1.00 0.00 O ATOM 1086 CB PRO A 74 8.608 5.795 3.119 1.00 0.00 C ATOM 1087 CG PRO A 74 7.194 6.059 2.731 1.00 0.00 C ATOM 1088 CD PRO A 74 6.347 5.304 3.717 1.00 0.00 C ATOM 0 HA PRO A 74 9.306 4.953 5.038 1.00 0.00 H new ATOM 0 HB2 PRO A 74 9.262 6.610 2.808 1.00 0.00 H new ATOM 0 HB3 PRO A 74 8.985 4.887 2.649 1.00 0.00 H new ATOM 0 HG2 PRO A 74 6.973 7.126 2.763 1.00 0.00 H new ATOM 0 HG3 PRO A 74 7.000 5.724 1.712 1.00 0.00 H new ATOM 0 HD2 PRO A 74 5.410 5.822 3.920 1.00 0.00 H new ATOM 0 HD3 PRO A 74 6.089 4.311 3.348 1.00 0.00 H new ATOM 1096 N ARG A 75 10.196 7.206 5.570 1.00 0.00 N ATOM 1097 CA ARG A 75 10.649 8.439 6.202 1.00 0.00 C ATOM 1098 C ARG A 75 11.814 9.050 5.429 1.00 0.00 C ATOM 1099 O ARG A 75 12.966 8.657 5.611 1.00 0.00 O ATOM 1100 CB ARG A 75 11.068 8.172 7.649 1.00 0.00 C ATOM 1101 CG ARG A 75 9.900 8.119 8.621 1.00 0.00 C ATOM 1102 CD ARG A 75 10.374 7.890 10.048 1.00 0.00 C ATOM 1103 NE ARG A 75 11.196 8.995 10.535 1.00 0.00 N ATOM 1104 CZ ARG A 75 11.401 9.245 11.823 1.00 0.00 C ATOM 1105 NH1 ARG A 75 10.848 8.474 12.749 1.00 0.00 N ATOM 1106 NH2 ARG A 75 12.163 10.269 12.188 1.00 0.00 N ATOM 0 H ARG A 75 10.941 6.543 5.357 1.00 0.00 H new ATOM 0 HA ARG A 75 9.820 9.146 6.196 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.610 7.227 7.693 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.760 8.951 7.968 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.338 9.052 8.568 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.219 7.320 8.330 1.00 0.00 H new ATOM 0 HD2 ARG A 75 9.510 7.765 10.701 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.946 6.964 10.096 1.00 0.00 H new ATOM 0 HE ARG A 75 11.636 9.608 9.849 1.00 0.00 H new ATOM 0 HH11 ARG A 75 10.263 7.686 12.473 1.00 0.00 H new ATOM 0 HH12 ARG A 75 11.008 8.669 13.737 1.00 0.00 H new ATOM 0 HH21 ARG A 75 12.591 10.864 11.479 1.00 0.00 H new ATOM 0 HH22 ARG A 75 12.320 10.461 13.177 1.00 0.00 H new ATOM 1120 N MET A 76 11.505 10.012 4.566 1.00 0.00 N ATOM 1121 CA MET A 76 12.526 10.677 3.765 1.00 0.00 C ATOM 1122 C MET A 76 13.536 11.393 4.658 1.00 0.00 C ATOM 1123 O MET A 76 14.742 11.329 4.422 1.00 0.00 O ATOM 1124 CB MET A 76 11.881 11.676 2.803 1.00 0.00 C ATOM 1125 CG MET A 76 11.040 11.020 1.720 1.00 0.00 C ATOM 1126 SD MET A 76 9.346 10.706 2.249 1.00 0.00 S ATOM 1127 CE MET A 76 8.981 9.205 1.344 1.00 0.00 C ATOM 0 H MET A 76 10.556 10.348 4.403 1.00 0.00 H new ATOM 0 HA MET A 76 13.052 9.916 3.188 1.00 0.00 H new ATOM 0 HB2 MET A 76 11.255 12.363 3.372 1.00 0.00 H new ATOM 0 HB3 MET A 76 12.663 12.272 2.333 1.00 0.00 H new ATOM 0 HG2 MET A 76 11.028 11.660 0.838 1.00 0.00 H new ATOM 0 HG3 MET A 76 11.504 10.079 1.425 1.00 0.00 H new ATOM 0 HE1 MET A 76 8.030 8.796 1.686 1.00 0.00 H new ATOM 0 HE2 MET A 76 8.918 9.428 0.279 1.00 0.00 H new ATOM 0 HE3 MET A 76 9.772 8.475 1.516 1.00 0.00 H new ATOM 1137 N GLY A 77 13.034 12.074 5.684 1.00 0.00 N ATOM 1138 CA GLY A 77 13.906 12.792 6.595 1.00 0.00 C ATOM 1139 C GLY A 77 14.971 11.900 7.201 1.00 0.00 C ATOM 1140 O GLY A 77 16.085 11.813 6.685 1.00 0.00 O ATOM 0 H GLY A 77 12.039 12.141 5.900 1.00 0.00 H new ATOM 0 HA2 GLY A 77 14.385 13.614 6.063 1.00 0.00 H new ATOM 0 HA3 GLY A 77 13.309 13.233 7.393 1.00 0.00 H new ATOM 1144 N ASN A 78 14.630 11.236 8.301 1.00 0.00 N ATOM 1145 CA ASN A 78 15.567 10.348 8.979 1.00 0.00 C ATOM 1146 C ASN A 78 16.112 9.296 8.019 1.00 0.00 C ATOM 1147 O ASN A 78 17.318 9.216 7.788 1.00 0.00 O ATOM 1148 CB ASN A 78 14.885 9.665 10.167 1.00 0.00 C ATOM 1149 CG ASN A 78 15.879 9.192 11.210 1.00 0.00 C ATOM 1150 OD1 ASN A 78 16.713 9.964 11.685 1.00 0.00 O ATOM 1151 ND2 ASN A 78 15.796 7.917 11.571 1.00 0.00 N ATOM 0 H ASN A 78 13.712 11.296 8.741 1.00 0.00 H new ATOM 0 HA ASN A 78 16.401 10.949 9.342 1.00 0.00 H new ATOM 0 HB2 ASN A 78 14.182 10.359 10.627 1.00 0.00 H new ATOM 0 HB3 ASN A 78 14.305 8.814 9.810 1.00 0.00 H new ATOM 0 HD21 ASN A 78 16.439 7.541 12.268 1.00 0.00 H new ATOM 0 HD22 ASN A 78 15.089 7.313 11.151 1.00 0.00 H new ATOM 1158 N GLY A 79 15.214 8.490 7.460 1.00 0.00 N ATOM 1159 CA GLY A 79 15.625 7.454 6.530 1.00 0.00 C ATOM 1160 C GLY A 79 15.324 6.060 7.046 1.00 0.00 C ATOM 1161 O GLY A 79 16.196 5.190 7.053 1.00 0.00 O ATOM 0 H GLY A 79 14.210 8.536 7.634 1.00 0.00 H new ATOM 0 HA2 GLY A 79 15.117 7.603 5.577 1.00 0.00 H new ATOM 0 HA3 GLY A 79 16.694 7.545 6.339 1.00 0.00 H new ATOM 1165 N THR A 80 14.086 5.846 7.480 1.00 0.00 N ATOM 1166 CA THR A 80 13.673 4.549 8.002 1.00 0.00 C ATOM 1167 C THR A 80 12.185 4.312 7.773 1.00 0.00 C ATOM 1168 O THR A 80 11.346 5.101 8.208 1.00 0.00 O ATOM 1169 CB THR A 80 13.974 4.428 9.508 1.00 0.00 C ATOM 1170 OG1 THR A 80 13.421 5.548 10.210 1.00 0.00 O ATOM 1171 CG2 THR A 80 15.473 4.358 9.757 1.00 0.00 C ATOM 0 H THR A 80 13.352 6.554 7.480 1.00 0.00 H new ATOM 0 HA THR A 80 14.246 3.795 7.462 1.00 0.00 H new ATOM 0 HB THR A 80 13.518 3.508 9.874 1.00 0.00 H new ATOM 0 HG1 THR A 80 13.615 5.463 11.167 1.00 0.00 H new ATOM 0 HG21 THR A 80 15.660 4.273 10.827 1.00 0.00 H new ATOM 0 HG22 THR A 80 15.887 3.489 9.246 1.00 0.00 H new ATOM 0 HG23 THR A 80 15.948 5.262 9.376 1.00 0.00 H new ATOM 1179 N VAL A 81 11.863 3.220 7.086 1.00 0.00 N ATOM 1180 CA VAL A 81 10.475 2.879 6.800 1.00 0.00 C ATOM 1181 C VAL A 81 9.880 2.023 7.912 1.00 0.00 C ATOM 1182 O VAL A 81 10.228 0.852 8.063 1.00 0.00 O ATOM 1183 CB VAL A 81 10.347 2.125 5.462 1.00 0.00 C ATOM 1184 CG1 VAL A 81 8.888 2.021 5.046 1.00 0.00 C ATOM 1185 CG2 VAL A 81 11.171 2.812 4.383 1.00 0.00 C ATOM 0 H VAL A 81 12.545 2.557 6.718 1.00 0.00 H new ATOM 0 HA VAL A 81 9.925 3.818 6.734 1.00 0.00 H new ATOM 0 HB VAL A 81 10.735 1.115 5.595 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.817 1.486 4.099 1.00 0.00 H new ATOM 0 HG12 VAL A 81 8.329 1.482 5.811 1.00 0.00 H new ATOM 0 HG13 VAL A 81 8.471 3.021 4.930 1.00 0.00 H new ATOM 0 HG21 VAL A 81 11.069 2.266 3.445 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.816 3.834 4.249 1.00 0.00 H new ATOM 0 HG23 VAL A 81 12.219 2.829 4.681 1.00 0.00 H new ATOM 1195 N VAL A 82 8.978 2.615 8.688 1.00 0.00 N ATOM 1196 CA VAL A 82 8.332 1.906 9.787 1.00 0.00 C ATOM 1197 C VAL A 82 7.185 1.038 9.281 1.00 0.00 C ATOM 1198 O VAL A 82 6.497 1.396 8.325 1.00 0.00 O ATOM 1199 CB VAL A 82 7.791 2.886 10.845 1.00 0.00 C ATOM 1200 CG1 VAL A 82 7.078 2.131 11.957 1.00 0.00 C ATOM 1201 CG2 VAL A 82 8.919 3.738 11.407 1.00 0.00 C ATOM 0 H VAL A 82 8.678 3.583 8.576 1.00 0.00 H new ATOM 0 HA VAL A 82 9.091 1.271 10.244 1.00 0.00 H new ATOM 0 HB VAL A 82 7.069 3.548 10.367 1.00 0.00 H new ATOM 0 HG11 VAL A 82 6.703 2.840 12.695 1.00 0.00 H new ATOM 0 HG12 VAL A 82 6.244 1.568 11.538 1.00 0.00 H new ATOM 0 HG13 VAL A 82 7.776 1.444 12.436 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.519 4.425 12.153 1.00 0.00 H new ATOM 0 HG22 VAL A 82 9.666 3.093 11.870 1.00 0.00 H new ATOM 0 HG23 VAL A 82 9.381 4.307 10.601 1.00 0.00 H new ATOM 1211 N ARG A 83 6.984 -0.104 9.930 1.00 0.00 N ATOM 1212 CA ARG A 83 5.921 -1.025 9.546 1.00 0.00 C ATOM 1213 C ARG A 83 5.047 -1.378 10.746 1.00 0.00 C ATOM 1214 O ARG A 83 5.544 -1.840 11.772 1.00 0.00 O ATOM 1215 CB ARG A 83 6.514 -2.299 8.941 1.00 0.00 C ATOM 1216 CG ARG A 83 7.020 -2.119 7.519 1.00 0.00 C ATOM 1217 CD ARG A 83 8.485 -1.711 7.496 1.00 0.00 C ATOM 1218 NE ARG A 83 9.370 -2.835 7.790 1.00 0.00 N ATOM 1219 CZ ARG A 83 10.646 -2.881 7.423 1.00 0.00 C ATOM 1220 NH1 ARG A 83 11.183 -1.872 6.751 1.00 0.00 N ATOM 1221 NH2 ARG A 83 11.388 -3.938 7.728 1.00 0.00 N ATOM 0 H ARG A 83 7.544 -0.414 10.725 1.00 0.00 H new ATOM 0 HA ARG A 83 5.300 -0.531 8.799 1.00 0.00 H new ATOM 0 HB2 ARG A 83 7.336 -2.641 9.570 1.00 0.00 H new ATOM 0 HB3 ARG A 83 5.757 -3.083 8.952 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.892 -3.049 6.966 1.00 0.00 H new ATOM 0 HG3 ARG A 83 6.422 -1.361 7.012 1.00 0.00 H new ATOM 0 HD2 ARG A 83 8.732 -1.301 6.517 1.00 0.00 H new ATOM 0 HD3 ARG A 83 8.652 -0.918 8.225 1.00 0.00 H new ATOM 0 HE ARG A 83 8.988 -3.628 8.305 1.00 0.00 H new ATOM 0 HH11 ARG A 83 10.616 -1.058 6.515 1.00 0.00 H new ATOM 0 HH12 ARG A 83 12.163 -1.910 6.471 1.00 0.00 H new ATOM 0 HH21 ARG A 83 10.979 -4.716 8.245 1.00 0.00 H new ATOM 0 HH22 ARG A 83 12.368 -3.972 7.446 1.00 0.00 H new ATOM 1235 N ASN A 84 3.744 -1.155 10.609 1.00 0.00 N ATOM 1236 CA ASN A 84 2.802 -1.448 11.682 1.00 0.00 C ATOM 1237 C ASN A 84 1.567 -2.162 11.142 1.00 0.00 C ATOM 1238 O ASN A 84 1.454 -2.407 9.940 1.00 0.00 O ATOM 1239 CB ASN A 84 2.389 -0.158 12.393 1.00 0.00 C ATOM 1240 CG ASN A 84 3.532 0.832 12.505 1.00 0.00 C ATOM 1241 OD1 ASN A 84 4.490 0.533 13.375 1.00 0.00 O flip ATOM 1242 ND2 ASN A 84 3.553 1.853 11.818 1.00 0.00 N flip ATOM 0 H ASN A 84 3.317 -0.772 9.765 1.00 0.00 H new ATOM 0 HA ASN A 84 3.297 -2.106 12.396 1.00 0.00 H new ATOM 0 HB2 ASN A 84 1.564 0.304 11.851 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.021 -0.398 13.390 1.00 0.00 H new ATOM 0 HD21 ASN A 84 2.795 2.042 11.162 1.00 0.00 H new ATOM 0 HD22 ASN A 84 4.328 2.510 11.904 1.00 0.00 H new ATOM 1249 N SER A 85 0.642 -2.493 12.037 1.00 0.00 N ATOM 1250 CA SER A 85 -0.584 -3.182 11.651 1.00 0.00 C ATOM 1251 C SER A 85 -1.656 -3.027 12.726 1.00 0.00 C ATOM 1252 O SER A 85 -1.587 -3.655 13.783 1.00 0.00 O ATOM 1253 CB SER A 85 -0.305 -4.665 11.403 1.00 0.00 C ATOM 1254 OG SER A 85 -1.491 -5.356 11.051 1.00 0.00 O ATOM 0 H SER A 85 0.718 -2.295 13.035 1.00 0.00 H new ATOM 0 HA SER A 85 -0.950 -2.730 10.729 1.00 0.00 H new ATOM 0 HB2 SER A 85 0.431 -4.771 10.606 1.00 0.00 H new ATOM 0 HB3 SER A 85 0.127 -5.111 12.298 1.00 0.00 H new ATOM 0 HG SER A 85 -2.176 -4.711 10.778 1.00 0.00 H new ATOM 1260 N LEU A 86 -2.646 -2.186 12.448 1.00 0.00 N ATOM 1261 CA LEU A 86 -3.734 -1.947 13.390 1.00 0.00 C ATOM 1262 C LEU A 86 -4.742 -3.092 13.360 1.00 0.00 C ATOM 1263 O LEU A 86 -5.352 -3.369 12.326 1.00 0.00 O ATOM 1264 CB LEU A 86 -4.435 -0.627 13.066 1.00 0.00 C ATOM 1265 CG LEU A 86 -5.783 -0.397 13.750 1.00 0.00 C ATOM 1266 CD1 LEU A 86 -5.614 -0.344 15.260 1.00 0.00 C ATOM 1267 CD2 LEU A 86 -6.429 0.882 13.239 1.00 0.00 C ATOM 0 H LEU A 86 -2.718 -1.658 11.578 1.00 0.00 H new ATOM 0 HA LEU A 86 -3.308 -1.889 14.392 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -3.768 0.191 13.337 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -4.584 -0.573 11.988 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.438 -1.234 13.508 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -6.584 -0.180 15.729 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -5.195 -1.287 15.613 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -4.941 0.472 15.522 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -7.387 1.030 13.737 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -5.776 1.729 13.450 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.587 0.805 12.163 1.00 0.00 H new ATOM 1279 N LEU A 87 -4.913 -3.753 14.499 1.00 0.00 N ATOM 1280 CA LEU A 87 -5.849 -4.867 14.605 1.00 0.00 C ATOM 1281 C LEU A 87 -7.184 -4.404 15.181 1.00 0.00 C ATOM 1282 O LEU A 87 -7.269 -3.344 15.800 1.00 0.00 O ATOM 1283 CB LEU A 87 -5.259 -5.973 15.480 1.00 0.00 C ATOM 1284 CG LEU A 87 -3.929 -6.564 15.010 1.00 0.00 C ATOM 1285 CD1 LEU A 87 -3.417 -7.589 16.010 1.00 0.00 C ATOM 1286 CD2 LEU A 87 -4.082 -7.191 13.632 1.00 0.00 C ATOM 0 H LEU A 87 -4.416 -3.537 15.363 1.00 0.00 H new ATOM 0 HA LEU A 87 -6.023 -5.259 13.603 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -5.123 -5.578 16.487 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -5.988 -6.781 15.550 1.00 0.00 H new ATOM 0 HG LEU A 87 -3.199 -5.758 14.942 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -2.470 -7.999 15.659 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -3.269 -7.110 16.978 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -4.145 -8.394 16.111 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -3.126 -7.607 13.313 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -4.827 -7.986 13.674 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -4.403 -6.431 12.920 1.00 0.00 H new ATOM 1298 N ASN A 88 -8.222 -5.208 14.975 1.00 0.00 N ATOM 1299 CA ASN A 88 -9.552 -4.881 15.476 1.00 0.00 C ATOM 1300 C ASN A 88 -9.471 -4.234 16.855 1.00 0.00 C ATOM 1301 O ASN A 88 -9.289 -4.916 17.862 1.00 0.00 O ATOM 1302 CB ASN A 88 -10.418 -6.141 15.541 1.00 0.00 C ATOM 1303 CG ASN A 88 -9.968 -7.096 16.630 1.00 0.00 C ATOM 1304 OD1 ASN A 88 -8.663 -7.324 16.714 1.00 0.00 O flip ATOM 1305 ND2 ASN A 88 -10.785 -7.622 17.387 1.00 0.00 N flip ATOM 0 H ASN A 88 -8.168 -6.090 14.465 1.00 0.00 H new ATOM 0 HA ASN A 88 -10.008 -4.169 14.788 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -11.456 -5.857 15.717 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -10.386 -6.651 14.578 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -11.779 -7.418 17.286 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -10.467 -8.262 18.115 1.00 0.00 H new ATOM 1312 N GLY A 89 -9.608 -2.912 16.891 1.00 0.00 N ATOM 1313 CA GLY A 89 -9.547 -2.194 18.151 1.00 0.00 C ATOM 1314 C GLY A 89 -8.186 -2.295 18.811 1.00 0.00 C ATOM 1315 O GLY A 89 -7.932 -1.648 19.827 1.00 0.00 O ATOM 0 H GLY A 89 -9.760 -2.326 16.070 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.787 -1.145 17.980 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -10.305 -2.588 18.827 1.00 0.00 H new ATOM 1319 N SER A 90 -7.309 -3.110 18.234 1.00 0.00 N ATOM 1320 CA SER A 90 -5.969 -3.298 18.776 1.00 0.00 C ATOM 1321 C SER A 90 -4.909 -2.866 17.766 1.00 0.00 C ATOM 1322 O SER A 90 -5.221 -2.564 16.614 1.00 0.00 O ATOM 1323 CB SER A 90 -5.753 -4.762 19.163 1.00 0.00 C ATOM 1324 OG SER A 90 -4.970 -4.868 20.339 1.00 0.00 O ATOM 0 H SER A 90 -7.503 -3.651 17.391 1.00 0.00 H new ATOM 0 HA SER A 90 -5.874 -2.676 19.666 1.00 0.00 H new ATOM 0 HB2 SER A 90 -6.717 -5.246 19.319 1.00 0.00 H new ATOM 0 HB3 SER A 90 -5.260 -5.289 18.346 1.00 0.00 H new ATOM 0 HG SER A 90 -4.848 -5.813 20.566 1.00 0.00 H new ATOM 1330 N TRP A 91 -3.657 -2.838 18.208 1.00 0.00 N ATOM 1331 CA TRP A 91 -2.551 -2.443 17.344 1.00 0.00 C ATOM 1332 C TRP A 91 -1.426 -3.471 17.395 1.00 0.00 C ATOM 1333 O TRP A 91 -1.348 -4.275 18.323 1.00 0.00 O ATOM 1334 CB TRP A 91 -2.020 -1.069 17.757 1.00 0.00 C ATOM 1335 CG TRP A 91 -2.620 0.059 16.973 1.00 0.00 C ATOM 1336 CD1 TRP A 91 -3.637 0.881 17.366 1.00 0.00 C ATOM 1337 CD2 TRP A 91 -2.240 0.488 15.660 1.00 0.00 C ATOM 1338 NE1 TRP A 91 -3.913 1.794 16.377 1.00 0.00 N ATOM 1339 CE2 TRP A 91 -3.069 1.575 15.321 1.00 0.00 C ATOM 1340 CE3 TRP A 91 -1.279 0.060 14.740 1.00 0.00 C ATOM 1341 CZ2 TRP A 91 -2.965 2.237 14.101 1.00 0.00 C ATOM 1342 CZ3 TRP A 91 -1.178 0.719 13.529 1.00 0.00 C ATOM 1343 CH2 TRP A 91 -2.016 1.798 13.219 1.00 0.00 C ATOM 0 H TRP A 91 -3.383 -3.084 19.159 1.00 0.00 H new ATOM 0 HA TRP A 91 -2.924 -2.389 16.321 1.00 0.00 H new ATOM 0 HB2 TRP A 91 -2.221 -0.913 18.817 1.00 0.00 H new ATOM 0 HB3 TRP A 91 -0.937 -1.053 17.632 1.00 0.00 H new ATOM 0 HD1 TRP A 91 -4.149 0.822 18.315 1.00 0.00 H new ATOM 0 HE1 TRP A 91 -4.630 2.518 16.422 1.00 0.00 H new ATOM 0 HE3 TRP A 91 -0.628 -0.770 14.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 -3.611 3.068 13.859 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 -0.440 0.396 12.809 1.00 0.00 H new ATOM 0 HH2 TRP A 91 -1.911 2.293 12.265 1.00 0.00 H new ATOM 1354 N GLY A 92 -0.556 -3.441 16.390 1.00 0.00 N ATOM 1355 CA GLY A 92 0.552 -4.376 16.340 1.00 0.00 C ATOM 1356 C GLY A 92 1.805 -3.825 16.991 1.00 0.00 C ATOM 1357 O GLY A 92 1.892 -3.743 18.216 1.00 0.00 O ATOM 0 H GLY A 92 -0.599 -2.786 15.610 1.00 0.00 H new ATOM 0 HA2 GLY A 92 0.265 -5.302 16.838 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.766 -4.626 15.301 1.00 0.00 H new ATOM 1361 N SER A 93 2.780 -3.447 16.169 1.00 0.00 N ATOM 1362 CA SER A 93 4.037 -2.906 16.673 1.00 0.00 C ATOM 1363 C SER A 93 4.827 -2.235 15.553 1.00 0.00 C ATOM 1364 O SER A 93 4.433 -2.282 14.388 1.00 0.00 O ATOM 1365 CB SER A 93 4.876 -4.016 17.310 1.00 0.00 C ATOM 1366 OG SER A 93 4.532 -4.196 18.673 1.00 0.00 O ATOM 0 H SER A 93 2.723 -3.506 15.152 1.00 0.00 H new ATOM 0 HA SER A 93 3.804 -2.157 17.430 1.00 0.00 H new ATOM 0 HB2 SER A 93 4.724 -4.949 16.767 1.00 0.00 H new ATOM 0 HB3 SER A 93 5.934 -3.769 17.228 1.00 0.00 H new ATOM 0 HG SER A 93 3.564 -4.091 18.783 1.00 0.00 H new ATOM 1372 N GLU A 94 5.944 -1.613 15.916 1.00 0.00 N ATOM 1373 CA GLU A 94 6.789 -0.932 14.942 1.00 0.00 C ATOM 1374 C GLU A 94 8.044 -1.748 14.646 1.00 0.00 C ATOM 1375 O GLU A 94 8.861 -1.992 15.533 1.00 0.00 O ATOM 1376 CB GLU A 94 7.179 0.456 15.455 1.00 0.00 C ATOM 1377 CG GLU A 94 6.021 1.227 16.066 1.00 0.00 C ATOM 1378 CD GLU A 94 6.216 2.729 15.990 1.00 0.00 C ATOM 1379 OE1 GLU A 94 7.159 3.239 16.631 1.00 0.00 O ATOM 1380 OE2 GLU A 94 5.424 3.394 15.290 1.00 0.00 O ATOM 0 H GLU A 94 6.285 -1.567 16.876 1.00 0.00 H new ATOM 0 HA GLU A 94 6.221 -0.824 14.018 1.00 0.00 H new ATOM 0 HB2 GLU A 94 7.967 0.350 16.200 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.595 1.035 14.631 1.00 0.00 H new ATOM 0 HG2 GLU A 94 5.098 0.958 15.552 1.00 0.00 H new ATOM 0 HG3 GLU A 94 5.903 0.932 17.109 1.00 0.00 H new ATOM 1387 N GLU A 95 8.188 -2.166 13.392 1.00 0.00 N ATOM 1388 CA GLU A 95 9.343 -2.956 12.979 1.00 0.00 C ATOM 1389 C GLU A 95 10.086 -2.275 11.833 1.00 0.00 C ATOM 1390 O GLU A 95 9.598 -2.227 10.704 1.00 0.00 O ATOM 1391 CB GLU A 95 8.903 -4.359 12.555 1.00 0.00 C ATOM 1392 CG GLU A 95 7.780 -4.361 11.532 1.00 0.00 C ATOM 1393 CD GLU A 95 7.067 -5.697 11.452 1.00 0.00 C ATOM 1394 OE1 GLU A 95 7.729 -6.736 11.658 1.00 0.00 O ATOM 1395 OE2 GLU A 95 5.848 -5.704 11.183 1.00 0.00 O ATOM 0 H GLU A 95 7.521 -1.971 12.646 1.00 0.00 H new ATOM 0 HA GLU A 95 10.020 -3.037 13.830 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.760 -4.890 12.142 1.00 0.00 H new ATOM 0 HB3 GLU A 95 8.580 -4.912 13.437 1.00 0.00 H new ATOM 0 HG2 GLU A 95 7.060 -3.584 11.787 1.00 0.00 H new ATOM 0 HG3 GLU A 95 8.186 -4.111 10.552 1.00 0.00 H new ATOM 1402 N LYS A 96 11.269 -1.750 12.133 1.00 0.00 N ATOM 1403 CA LYS A 96 12.081 -1.072 11.129 1.00 0.00 C ATOM 1404 C LYS A 96 13.260 -1.942 10.706 1.00 0.00 C ATOM 1405 O LYS A 96 13.982 -2.480 11.546 1.00 0.00 O ATOM 1406 CB LYS A 96 12.590 0.265 11.674 1.00 0.00 C ATOM 1407 CG LYS A 96 11.502 1.314 11.824 1.00 0.00 C ATOM 1408 CD LYS A 96 12.055 2.614 12.384 1.00 0.00 C ATOM 1409 CE LYS A 96 12.235 2.540 13.892 1.00 0.00 C ATOM 1410 NZ LYS A 96 12.114 3.879 14.532 1.00 0.00 N ATOM 0 H LYS A 96 11.687 -1.781 13.063 1.00 0.00 H new ATOM 0 HA LYS A 96 11.456 -0.887 10.255 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.058 0.098 12.644 1.00 0.00 H new ATOM 0 HB3 LYS A 96 13.363 0.648 11.009 1.00 0.00 H new ATOM 0 HG2 LYS A 96 11.040 1.502 10.855 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.720 0.937 12.482 1.00 0.00 H new ATOM 0 HD2 LYS A 96 13.012 2.836 11.913 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.380 3.434 12.137 1.00 0.00 H new ATOM 0 HE2 LYS A 96 11.489 1.867 14.314 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.213 2.115 14.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 12.243 3.785 15.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.842 4.514 14.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.172 4.274 14.336 1.00 0.00 H new ATOM 1424 N LYS A 97 13.451 -2.076 9.397 1.00 0.00 N ATOM 1425 CA LYS A 97 14.543 -2.878 8.861 1.00 0.00 C ATOM 1426 C LYS A 97 14.618 -2.750 7.343 1.00 0.00 C ATOM 1427 O LYS A 97 13.800 -3.322 6.622 1.00 0.00 O ATOM 1428 CB LYS A 97 14.364 -4.347 9.251 1.00 0.00 C ATOM 1429 CG LYS A 97 15.675 -5.096 9.420 1.00 0.00 C ATOM 1430 CD LYS A 97 16.120 -5.742 8.119 1.00 0.00 C ATOM 1431 CE LYS A 97 17.027 -4.820 7.320 1.00 0.00 C ATOM 1432 NZ LYS A 97 18.463 -5.035 7.646 1.00 0.00 N ATOM 0 H LYS A 97 12.862 -1.639 8.688 1.00 0.00 H new ATOM 0 HA LYS A 97 15.475 -2.507 9.286 1.00 0.00 H new ATOM 0 HB2 LYS A 97 13.802 -4.401 10.183 1.00 0.00 H new ATOM 0 HB3 LYS A 97 13.766 -4.846 8.489 1.00 0.00 H new ATOM 0 HG2 LYS A 97 16.446 -4.408 9.768 1.00 0.00 H new ATOM 0 HG3 LYS A 97 15.561 -5.862 10.187 1.00 0.00 H new ATOM 0 HD2 LYS A 97 16.645 -6.673 8.335 1.00 0.00 H new ATOM 0 HD3 LYS A 97 15.245 -6.000 7.522 1.00 0.00 H new ATOM 0 HE2 LYS A 97 16.868 -4.988 6.255 1.00 0.00 H new ATOM 0 HE3 LYS A 97 16.760 -3.783 7.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 19.048 -4.387 7.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 18.621 -4.850 8.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 18.725 -6.018 7.428 1.00 0.00 H new ATOM 1446 N ILE A 98 15.605 -1.999 6.865 1.00 0.00 N ATOM 1447 CA ILE A 98 15.787 -1.799 5.433 1.00 0.00 C ATOM 1448 C ILE A 98 17.262 -1.629 5.085 1.00 0.00 C ATOM 1449 O ILE A 98 18.063 -1.203 5.917 1.00 0.00 O ATOM 1450 CB ILE A 98 15.008 -0.568 4.933 1.00 0.00 C ATOM 1451 CG1 ILE A 98 15.438 -0.210 3.509 1.00 0.00 C ATOM 1452 CG2 ILE A 98 15.223 0.611 5.869 1.00 0.00 C ATOM 1453 CD1 ILE A 98 14.570 0.849 2.864 1.00 0.00 C ATOM 0 H ILE A 98 16.290 -1.519 7.449 1.00 0.00 H new ATOM 0 HA ILE A 98 15.400 -2.690 4.938 1.00 0.00 H new ATOM 0 HB ILE A 98 13.945 -0.809 4.922 1.00 0.00 H new ATOM 0 HG12 ILE A 98 16.470 0.139 3.527 1.00 0.00 H new ATOM 0 HG13 ILE A 98 15.416 -1.110 2.894 1.00 0.00 H new ATOM 0 HG21 ILE A 98 14.666 1.473 5.502 1.00 0.00 H new ATOM 0 HG22 ILE A 98 14.873 0.351 6.868 1.00 0.00 H new ATOM 0 HG23 ILE A 98 16.285 0.855 5.909 1.00 0.00 H new ATOM 0 HD11 ILE A 98 14.933 1.053 1.857 1.00 0.00 H new ATOM 0 HD12 ILE A 98 13.540 0.495 2.814 1.00 0.00 H new ATOM 0 HD13 ILE A 98 14.611 1.763 3.456 1.00 0.00 H new ATOM 1465 N THR A 99 17.615 -1.964 3.848 1.00 0.00 N ATOM 1466 CA THR A 99 18.993 -1.848 3.388 1.00 0.00 C ATOM 1467 C THR A 99 19.222 -0.525 2.665 1.00 0.00 C ATOM 1468 O THR A 99 20.224 0.153 2.893 1.00 0.00 O ATOM 1469 CB THR A 99 19.370 -3.007 2.446 1.00 0.00 C ATOM 1470 OG1 THR A 99 20.750 -2.907 2.076 1.00 0.00 O ATOM 1471 CG2 THR A 99 18.502 -2.994 1.197 1.00 0.00 C ATOM 0 H THR A 99 16.965 -2.318 3.146 1.00 0.00 H new ATOM 0 HA THR A 99 19.627 -1.889 4.274 1.00 0.00 H new ATOM 0 HB THR A 99 19.203 -3.945 2.975 1.00 0.00 H new ATOM 0 HG1 THR A 99 20.983 -3.648 1.478 1.00 0.00 H new ATOM 0 HG21 THR A 99 18.787 -3.822 0.547 1.00 0.00 H new ATOM 0 HG22 THR A 99 17.455 -3.099 1.481 1.00 0.00 H new ATOM 0 HG23 THR A 99 18.641 -2.052 0.667 1.00 0.00 H new ATOM 1479 N HIS A 100 18.287 -0.163 1.792 1.00 0.00 N ATOM 1480 CA HIS A 100 18.387 1.080 1.036 1.00 0.00 C ATOM 1481 C HIS A 100 17.030 1.771 0.945 1.00 0.00 C ATOM 1482 O HIS A 100 16.019 1.138 0.645 1.00 0.00 O ATOM 1483 CB HIS A 100 18.928 0.806 -0.367 1.00 0.00 C ATOM 1484 CG HIS A 100 17.861 0.495 -1.371 1.00 0.00 C ATOM 1485 ND1 HIS A 100 17.049 -0.616 -1.286 1.00 0.00 N ATOM 1486 CD2 HIS A 100 17.472 1.159 -2.484 1.00 0.00 C ATOM 1487 CE1 HIS A 100 16.209 -0.623 -2.306 1.00 0.00 C ATOM 1488 NE2 HIS A 100 16.444 0.444 -3.048 1.00 0.00 N ATOM 0 H HIS A 100 17.452 -0.713 1.591 1.00 0.00 H new ATOM 0 HA HIS A 100 19.077 1.741 1.560 1.00 0.00 H new ATOM 0 HB2 HIS A 100 19.492 1.675 -0.706 1.00 0.00 H new ATOM 0 HB3 HIS A 100 19.627 -0.029 -0.321 1.00 0.00 H new ATOM 0 HD2 HIS A 100 17.892 2.080 -2.859 1.00 0.00 H new ATOM 0 HE1 HIS A 100 15.458 -1.374 -2.500 1.00 0.00 H new ATOM 0 HE2 HIS A 100 15.944 0.696 -3.901 1.00 0.00 H new ATOM 1497 N ASN A 101 17.016 3.074 1.208 1.00 0.00 N ATOM 1498 CA ASN A 101 15.783 3.851 1.157 1.00 0.00 C ATOM 1499 C ASN A 101 15.800 4.822 -0.020 1.00 0.00 C ATOM 1500 O ASN A 101 16.340 5.925 0.061 1.00 0.00 O ATOM 1501 CB ASN A 101 15.585 4.620 2.464 1.00 0.00 C ATOM 1502 CG ASN A 101 14.243 5.324 2.524 1.00 0.00 C ATOM 1503 OD1 ASN A 101 13.737 5.806 1.511 1.00 0.00 O ATOM 1504 ND2 ASN A 101 13.661 5.386 3.716 1.00 0.00 N ATOM 0 H ASN A 101 17.844 3.614 1.459 1.00 0.00 H new ATOM 0 HA ASN A 101 14.952 3.158 1.022 1.00 0.00 H new ATOM 0 HB2 ASN A 101 15.668 3.930 3.304 1.00 0.00 H new ATOM 0 HB3 ASN A 101 16.383 5.355 2.574 1.00 0.00 H new ATOM 0 HD21 ASN A 101 12.757 5.847 3.819 1.00 0.00 H new ATOM 0 HD22 ASN A 101 14.118 4.972 4.529 1.00 0.00 H new ATOM 1511 N PRO A 102 15.194 4.403 -1.141 1.00 0.00 N ATOM 1512 CA PRO A 102 15.125 5.221 -2.356 1.00 0.00 C ATOM 1513 C PRO A 102 14.205 6.426 -2.192 1.00 0.00 C ATOM 1514 O PRO A 102 14.531 7.532 -2.624 1.00 0.00 O ATOM 1515 CB PRO A 102 14.560 4.256 -3.402 1.00 0.00 C ATOM 1516 CG PRO A 102 13.796 3.248 -2.614 1.00 0.00 C ATOM 1517 CD PRO A 102 14.530 3.100 -1.309 1.00 0.00 C ATOM 0 HA PRO A 102 16.096 5.639 -2.622 1.00 0.00 H new ATOM 0 HB2 PRO A 102 13.916 4.775 -4.112 1.00 0.00 H new ATOM 0 HB3 PRO A 102 15.357 3.786 -3.979 1.00 0.00 H new ATOM 0 HG2 PRO A 102 12.770 3.577 -2.450 1.00 0.00 H new ATOM 0 HG3 PRO A 102 13.745 2.296 -3.143 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.848 2.888 -0.486 1.00 0.00 H new ATOM 0 HD3 PRO A 102 15.251 2.283 -1.344 1.00 0.00 H new ATOM 1525 N PHE A 103 13.054 6.205 -1.565 1.00 0.00 N ATOM 1526 CA PHE A 103 12.086 7.273 -1.344 1.00 0.00 C ATOM 1527 C PHE A 103 12.792 8.597 -1.063 1.00 0.00 C ATOM 1528 O PHE A 103 13.320 8.812 0.027 1.00 0.00 O ATOM 1529 CB PHE A 103 11.160 6.918 -0.179 1.00 0.00 C ATOM 1530 CG PHE A 103 10.750 5.474 -0.158 1.00 0.00 C ATOM 1531 CD1 PHE A 103 10.215 4.875 -1.288 1.00 0.00 C ATOM 1532 CD2 PHE A 103 10.899 4.714 0.991 1.00 0.00 C ATOM 1533 CE1 PHE A 103 9.836 3.546 -1.271 1.00 0.00 C ATOM 1534 CE2 PHE A 103 10.522 3.384 1.013 1.00 0.00 C ATOM 1535 CZ PHE A 103 9.991 2.800 -0.119 1.00 0.00 C ATOM 0 H PHE A 103 12.769 5.296 -1.201 1.00 0.00 H new ATOM 0 HA PHE A 103 11.491 7.384 -2.251 1.00 0.00 H new ATOM 0 HB2 PHE A 103 11.660 7.159 0.759 1.00 0.00 H new ATOM 0 HB3 PHE A 103 10.267 7.540 -0.233 1.00 0.00 H new ATOM 0 HD1 PHE A 103 10.093 5.453 -2.192 1.00 0.00 H new ATOM 0 HD2 PHE A 103 11.314 5.166 1.880 1.00 0.00 H new ATOM 0 HE1 PHE A 103 9.419 3.091 -2.158 1.00 0.00 H new ATOM 0 HE2 PHE A 103 10.643 2.803 1.915 1.00 0.00 H new ATOM 0 HZ PHE A 103 9.697 1.761 -0.104 1.00 0.00 H new ATOM 1545 N GLY A 104 12.796 9.481 -2.056 1.00 0.00 N ATOM 1546 CA GLY A 104 13.440 10.772 -1.896 1.00 0.00 C ATOM 1547 C GLY A 104 12.599 11.910 -2.440 1.00 0.00 C ATOM 1548 O GLY A 104 11.987 11.806 -3.503 1.00 0.00 O ATOM 0 H GLY A 104 12.365 9.327 -2.968 1.00 0.00 H new ATOM 0 HA2 GLY A 104 13.641 10.946 -0.839 1.00 0.00 H new ATOM 0 HA3 GLY A 104 14.403 10.760 -2.406 1.00 0.00 H new ATOM 1552 N PRO A 105 12.560 13.028 -1.700 1.00 0.00 N ATOM 1553 CA PRO A 105 11.790 14.212 -2.093 1.00 0.00 C ATOM 1554 C PRO A 105 12.390 14.917 -3.304 1.00 0.00 C ATOM 1555 O PRO A 105 13.354 15.673 -3.181 1.00 0.00 O ATOM 1556 CB PRO A 105 11.867 15.112 -0.858 1.00 0.00 C ATOM 1557 CG PRO A 105 13.118 14.697 -0.164 1.00 0.00 C ATOM 1558 CD PRO A 105 13.265 13.223 -0.422 1.00 0.00 C ATOM 0 HA PRO A 105 10.772 13.957 -2.388 1.00 0.00 H new ATOM 0 HB2 PRO A 105 11.900 16.165 -1.137 1.00 0.00 H new ATOM 0 HB3 PRO A 105 10.996 14.979 -0.217 1.00 0.00 H new ATOM 0 HG2 PRO A 105 13.977 15.248 -0.546 1.00 0.00 H new ATOM 0 HG3 PRO A 105 13.058 14.902 0.905 1.00 0.00 H new ATOM 0 HD2 PRO A 105 14.313 12.930 -0.492 1.00 0.00 H new ATOM 0 HD3 PRO A 105 12.821 12.629 0.377 1.00 0.00 H new ATOM 1566 N GLY A 106 11.814 14.666 -4.476 1.00 0.00 N ATOM 1567 CA GLY A 106 12.306 15.286 -5.693 1.00 0.00 C ATOM 1568 C GLY A 106 12.524 14.282 -6.807 1.00 0.00 C ATOM 1569 O GLY A 106 12.769 14.661 -7.952 1.00 0.00 O ATOM 0 H GLY A 106 11.016 14.044 -4.604 1.00 0.00 H new ATOM 0 HA2 GLY A 106 11.595 16.043 -6.024 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.244 15.800 -5.482 1.00 0.00 H new ATOM 1573 N GLN A 107 12.435 12.999 -6.472 1.00 0.00 N ATOM 1574 CA GLN A 107 12.627 11.938 -7.453 1.00 0.00 C ATOM 1575 C GLN A 107 11.504 10.909 -7.370 1.00 0.00 C ATOM 1576 O GLN A 107 10.820 10.803 -6.352 1.00 0.00 O ATOM 1577 CB GLN A 107 13.979 11.254 -7.239 1.00 0.00 C ATOM 1578 CG GLN A 107 14.313 11.013 -5.775 1.00 0.00 C ATOM 1579 CD GLN A 107 15.801 10.860 -5.534 1.00 0.00 C ATOM 1580 OE1 GLN A 107 16.537 10.388 -6.401 1.00 0.00 O ATOM 1581 NE2 GLN A 107 16.254 11.259 -4.351 1.00 0.00 N ATOM 0 H GLN A 107 12.231 12.669 -5.529 1.00 0.00 H new ATOM 0 HA GLN A 107 12.609 12.389 -8.445 1.00 0.00 H new ATOM 0 HB2 GLN A 107 13.982 10.300 -7.766 1.00 0.00 H new ATOM 0 HB3 GLN A 107 14.762 11.867 -7.686 1.00 0.00 H new ATOM 0 HG2 GLN A 107 13.936 11.844 -5.179 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.799 10.115 -5.432 1.00 0.00 H new ATOM 0 HE21 GLN A 107 15.609 11.644 -3.661 1.00 0.00 H new ATOM 0 HE22 GLN A 107 17.247 11.180 -4.132 1.00 0.00 H new ATOM 1590 N PHE A 108 11.320 10.154 -8.447 1.00 0.00 N ATOM 1591 CA PHE A 108 10.278 9.134 -8.497 1.00 0.00 C ATOM 1592 C PHE A 108 10.689 7.898 -7.701 1.00 0.00 C ATOM 1593 O PHE A 108 11.816 7.806 -7.214 1.00 0.00 O ATOM 1594 CB PHE A 108 9.983 8.746 -9.947 1.00 0.00 C ATOM 1595 CG PHE A 108 9.900 9.922 -10.877 1.00 0.00 C ATOM 1596 CD1 PHE A 108 11.051 10.507 -11.381 1.00 0.00 C ATOM 1597 CD2 PHE A 108 8.671 10.444 -11.247 1.00 0.00 C ATOM 1598 CE1 PHE A 108 10.977 11.589 -12.238 1.00 0.00 C ATOM 1599 CE2 PHE A 108 8.591 11.526 -12.103 1.00 0.00 C ATOM 1600 CZ PHE A 108 9.746 12.100 -12.598 1.00 0.00 C ATOM 0 H PHE A 108 11.878 10.229 -9.297 1.00 0.00 H new ATOM 0 HA PHE A 108 9.375 9.550 -8.049 1.00 0.00 H new ATOM 0 HB2 PHE A 108 10.761 8.069 -10.299 1.00 0.00 H new ATOM 0 HB3 PHE A 108 9.042 8.197 -9.984 1.00 0.00 H new ATOM 0 HD1 PHE A 108 12.017 10.113 -11.101 1.00 0.00 H new ATOM 0 HD2 PHE A 108 7.765 10.000 -10.862 1.00 0.00 H new ATOM 0 HE1 PHE A 108 11.881 12.034 -12.626 1.00 0.00 H new ATOM 0 HE2 PHE A 108 7.627 11.922 -12.385 1.00 0.00 H new ATOM 0 HZ PHE A 108 9.686 12.947 -13.265 1.00 0.00 H new ATOM 1610 N PHE A 109 9.767 6.950 -7.574 1.00 0.00 N ATOM 1611 CA PHE A 109 10.031 5.720 -6.837 1.00 0.00 C ATOM 1612 C PHE A 109 9.025 4.636 -7.210 1.00 0.00 C ATOM 1613 O PHE A 109 7.823 4.788 -6.993 1.00 0.00 O ATOM 1614 CB PHE A 109 9.980 5.983 -5.330 1.00 0.00 C ATOM 1615 CG PHE A 109 8.584 6.113 -4.791 1.00 0.00 C ATOM 1616 CD1 PHE A 109 7.955 7.347 -4.751 1.00 0.00 C ATOM 1617 CD2 PHE A 109 7.901 5.001 -4.325 1.00 0.00 C ATOM 1618 CE1 PHE A 109 6.670 7.470 -4.257 1.00 0.00 C ATOM 1619 CE2 PHE A 109 6.616 5.118 -3.829 1.00 0.00 C ATOM 1620 CZ PHE A 109 6.000 6.354 -3.794 1.00 0.00 C ATOM 0 H PHE A 109 8.830 7.010 -7.972 1.00 0.00 H new ATOM 0 HA PHE A 109 11.029 5.372 -7.105 1.00 0.00 H new ATOM 0 HB2 PHE A 109 10.487 5.170 -4.810 1.00 0.00 H new ATOM 0 HB3 PHE A 109 10.532 6.896 -5.110 1.00 0.00 H new ATOM 0 HD1 PHE A 109 8.475 8.223 -5.110 1.00 0.00 H new ATOM 0 HD2 PHE A 109 8.378 4.032 -4.350 1.00 0.00 H new ATOM 0 HE1 PHE A 109 6.190 8.437 -4.233 1.00 0.00 H new ATOM 0 HE2 PHE A 109 6.094 4.244 -3.469 1.00 0.00 H new ATOM 0 HZ PHE A 109 4.997 6.448 -3.405 1.00 0.00 H new ATOM 1630 N ASP A 110 9.526 3.541 -7.773 1.00 0.00 N ATOM 1631 CA ASP A 110 8.672 2.430 -8.176 1.00 0.00 C ATOM 1632 C ASP A 110 8.607 1.370 -7.082 1.00 0.00 C ATOM 1633 O ASP A 110 9.533 0.575 -6.917 1.00 0.00 O ATOM 1634 CB ASP A 110 9.188 1.809 -9.476 1.00 0.00 C ATOM 1635 CG ASP A 110 8.682 0.395 -9.682 1.00 0.00 C ATOM 1636 OD1 ASP A 110 9.322 -0.545 -9.166 1.00 0.00 O ATOM 1637 OD2 ASP A 110 7.646 0.228 -10.359 1.00 0.00 O ATOM 0 H ASP A 110 10.519 3.400 -7.960 1.00 0.00 H new ATOM 0 HA ASP A 110 7.667 2.817 -8.341 1.00 0.00 H new ATOM 0 HB2 ASP A 110 8.880 2.428 -10.318 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.278 1.804 -9.465 1.00 0.00 H new ATOM 1642 N LEU A 111 7.508 1.364 -6.336 1.00 0.00 N ATOM 1643 CA LEU A 111 7.321 0.402 -5.255 1.00 0.00 C ATOM 1644 C LEU A 111 6.401 -0.734 -5.690 1.00 0.00 C ATOM 1645 O LEU A 111 5.380 -0.506 -6.338 1.00 0.00 O ATOM 1646 CB LEU A 111 6.744 1.096 -4.021 1.00 0.00 C ATOM 1647 CG LEU A 111 7.026 0.422 -2.678 1.00 0.00 C ATOM 1648 CD1 LEU A 111 6.314 -0.920 -2.595 1.00 0.00 C ATOM 1649 CD2 LEU A 111 8.523 0.247 -2.472 1.00 0.00 C ATOM 0 H LEU A 111 6.732 2.015 -6.460 1.00 0.00 H new ATOM 0 HA LEU A 111 8.295 -0.019 -5.005 1.00 0.00 H new ATOM 0 HB2 LEU A 111 7.136 2.112 -3.984 1.00 0.00 H new ATOM 0 HB3 LEU A 111 5.664 1.175 -4.145 1.00 0.00 H new ATOM 0 HG LEU A 111 6.644 1.063 -1.884 1.00 0.00 H new ATOM 0 HD11 LEU A 111 6.526 -1.385 -1.632 1.00 0.00 H new ATOM 0 HD12 LEU A 111 5.239 -0.769 -2.696 1.00 0.00 H new ATOM 0 HD13 LEU A 111 6.666 -1.569 -3.397 1.00 0.00 H new ATOM 0 HD21 LEU A 111 8.704 -0.234 -1.511 1.00 0.00 H new ATOM 0 HD22 LEU A 111 8.930 -0.373 -3.271 1.00 0.00 H new ATOM 0 HD23 LEU A 111 9.009 1.223 -2.486 1.00 0.00 H new ATOM 1661 N SER A 112 6.769 -1.959 -5.328 1.00 0.00 N ATOM 1662 CA SER A 112 5.977 -3.131 -5.682 1.00 0.00 C ATOM 1663 C SER A 112 6.011 -4.168 -4.563 1.00 0.00 C ATOM 1664 O SER A 112 7.059 -4.743 -4.266 1.00 0.00 O ATOM 1665 CB SER A 112 6.497 -3.750 -6.982 1.00 0.00 C ATOM 1666 OG SER A 112 6.735 -2.754 -7.961 1.00 0.00 O ATOM 0 H SER A 112 7.611 -2.166 -4.790 1.00 0.00 H new ATOM 0 HA SER A 112 4.945 -2.812 -5.827 1.00 0.00 H new ATOM 0 HB2 SER A 112 7.418 -4.298 -6.785 1.00 0.00 H new ATOM 0 HB3 SER A 112 5.772 -4.471 -7.361 1.00 0.00 H new ATOM 0 HG SER A 112 7.068 -3.174 -8.781 1.00 0.00 H new ATOM 1672 N ILE A 113 4.857 -4.401 -3.947 1.00 0.00 N ATOM 1673 CA ILE A 113 4.754 -5.369 -2.862 1.00 0.00 C ATOM 1674 C ILE A 113 4.265 -6.719 -3.374 1.00 0.00 C ATOM 1675 O ILE A 113 3.389 -6.787 -4.236 1.00 0.00 O ATOM 1676 CB ILE A 113 3.801 -4.876 -1.757 1.00 0.00 C ATOM 1677 CG1 ILE A 113 4.251 -3.510 -1.236 1.00 0.00 C ATOM 1678 CG2 ILE A 113 3.738 -5.887 -0.622 1.00 0.00 C ATOM 1679 CD1 ILE A 113 3.597 -2.346 -1.948 1.00 0.00 C ATOM 0 H ILE A 113 3.981 -3.933 -4.180 1.00 0.00 H new ATOM 0 HA ILE A 113 5.754 -5.482 -2.444 1.00 0.00 H new ATOM 0 HB ILE A 113 2.802 -4.771 -2.180 1.00 0.00 H new ATOM 0 HG12 ILE A 113 4.029 -3.445 -0.171 1.00 0.00 H new ATOM 0 HG13 ILE A 113 5.333 -3.428 -1.341 1.00 0.00 H new ATOM 0 HG21 ILE A 113 3.061 -5.524 0.151 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.375 -6.841 -1.004 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.733 -6.021 -0.198 1.00 0.00 H new ATOM 0 HD11 ILE A 113 3.963 -1.410 -1.527 1.00 0.00 H new ATOM 0 HD12 ILE A 113 3.840 -2.386 -3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 113 2.516 -2.403 -1.821 1.00 0.00 H new ATOM 1691 N ARG A 114 4.836 -7.792 -2.836 1.00 0.00 N ATOM 1692 CA ARG A 114 4.458 -9.142 -3.238 1.00 0.00 C ATOM 1693 C ARG A 114 3.824 -9.898 -2.075 1.00 0.00 C ATOM 1694 O ARG A 114 4.416 -10.015 -1.001 1.00 0.00 O ATOM 1695 CB ARG A 114 5.681 -9.905 -3.751 1.00 0.00 C ATOM 1696 CG ARG A 114 5.910 -9.754 -5.246 1.00 0.00 C ATOM 1697 CD ARG A 114 6.696 -10.927 -5.810 1.00 0.00 C ATOM 1698 NE ARG A 114 6.612 -10.993 -7.267 1.00 0.00 N ATOM 1699 CZ ARG A 114 6.918 -12.076 -7.973 1.00 0.00 C ATOM 1700 NH1 ARG A 114 7.326 -13.178 -7.359 1.00 0.00 N ATOM 1701 NH2 ARG A 114 6.816 -12.058 -9.295 1.00 0.00 N ATOM 0 H ARG A 114 5.562 -7.753 -2.121 1.00 0.00 H new ATOM 0 HA ARG A 114 3.724 -9.064 -4.040 1.00 0.00 H new ATOM 0 HB2 ARG A 114 6.566 -9.556 -3.219 1.00 0.00 H new ATOM 0 HB3 ARG A 114 5.564 -10.963 -3.515 1.00 0.00 H new ATOM 0 HG2 ARG A 114 4.950 -9.679 -5.757 1.00 0.00 H new ATOM 0 HG3 ARG A 114 6.448 -8.826 -5.441 1.00 0.00 H new ATOM 0 HD2 ARG A 114 7.741 -10.841 -5.511 1.00 0.00 H new ATOM 0 HD3 ARG A 114 6.318 -11.856 -5.383 1.00 0.00 H new ATOM 0 HE ARG A 114 6.301 -10.162 -7.770 1.00 0.00 H new ATOM 0 HH11 ARG A 114 7.406 -13.196 -6.342 1.00 0.00 H new ATOM 0 HH12 ARG A 114 7.560 -14.008 -7.903 1.00 0.00 H new ATOM 0 HH21 ARG A 114 6.502 -11.212 -9.771 1.00 0.00 H new ATOM 0 HH22 ARG A 114 7.051 -12.890 -9.836 1.00 0.00 H new ATOM 1715 N CYS A 115 2.618 -10.409 -2.296 1.00 0.00 N ATOM 1716 CA CYS A 115 1.902 -11.153 -1.265 1.00 0.00 C ATOM 1717 C CYS A 115 2.177 -12.649 -1.385 1.00 0.00 C ATOM 1718 O CYS A 115 1.863 -13.269 -2.400 1.00 0.00 O ATOM 1719 CB CYS A 115 0.399 -10.889 -1.367 1.00 0.00 C ATOM 1720 SG CYS A 115 -0.619 -12.050 -0.427 1.00 0.00 S ATOM 0 H CYS A 115 2.115 -10.322 -3.179 1.00 0.00 H new ATOM 0 HA CYS A 115 2.258 -10.813 -0.293 1.00 0.00 H new ATOM 0 HB2 CYS A 115 0.194 -9.877 -1.018 1.00 0.00 H new ATOM 0 HB3 CYS A 115 0.104 -10.930 -2.416 1.00 0.00 H new ATOM 0 HG CYS A 115 -0.407 -11.882 0.845 1.00 0.00 H new ATOM 1726 N GLY A 116 2.768 -13.222 -0.341 1.00 0.00 N ATOM 1727 CA GLY A 116 3.078 -14.640 -0.350 1.00 0.00 C ATOM 1728 C GLY A 116 2.295 -15.410 0.695 1.00 0.00 C ATOM 1729 O GLY A 116 1.138 -15.093 0.974 1.00 0.00 O ATOM 0 H GLY A 116 3.038 -12.730 0.511 1.00 0.00 H new ATOM 0 HA2 GLY A 116 2.862 -15.050 -1.337 1.00 0.00 H new ATOM 0 HA3 GLY A 116 4.145 -14.777 -0.174 1.00 0.00 H new ATOM 1733 N LEU A 117 2.925 -16.427 1.273 1.00 0.00 N ATOM 1734 CA LEU A 117 2.280 -17.247 2.292 1.00 0.00 C ATOM 1735 C LEU A 117 3.006 -17.127 3.628 1.00 0.00 C ATOM 1736 O LEU A 117 2.380 -17.120 4.688 1.00 0.00 O ATOM 1737 CB LEU A 117 2.243 -18.711 1.849 1.00 0.00 C ATOM 1738 CG LEU A 117 1.472 -19.003 0.561 1.00 0.00 C ATOM 1739 CD1 LEU A 117 1.990 -20.273 -0.096 1.00 0.00 C ATOM 1740 CD2 LEU A 117 -0.019 -19.118 0.847 1.00 0.00 C ATOM 0 H LEU A 117 3.882 -16.703 1.053 1.00 0.00 H new ATOM 0 HA LEU A 117 1.259 -16.886 2.420 1.00 0.00 H new ATOM 0 HB2 LEU A 117 3.269 -19.057 1.721 1.00 0.00 H new ATOM 0 HB3 LEU A 117 1.805 -19.302 2.653 1.00 0.00 H new ATOM 0 HG LEU A 117 1.627 -18.173 -0.129 1.00 0.00 H new ATOM 0 HD11 LEU A 117 1.429 -20.464 -1.011 1.00 0.00 H new ATOM 0 HD12 LEU A 117 3.046 -20.153 -0.336 1.00 0.00 H new ATOM 0 HD13 LEU A 117 1.866 -21.113 0.588 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -0.552 -19.326 -0.081 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -0.192 -19.929 1.555 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -0.381 -18.182 1.272 1.00 0.00 H new ATOM 1752 N ASP A 118 4.330 -17.031 3.569 1.00 0.00 N ATOM 1753 CA ASP A 118 5.142 -16.908 4.774 1.00 0.00 C ATOM 1754 C ASP A 118 5.384 -15.441 5.118 1.00 0.00 C ATOM 1755 O ASP A 118 5.452 -15.071 6.291 1.00 0.00 O ATOM 1756 CB ASP A 118 6.478 -17.629 4.591 1.00 0.00 C ATOM 1757 CG ASP A 118 7.464 -16.822 3.770 1.00 0.00 C ATOM 1758 OD1 ASP A 118 7.135 -16.481 2.614 1.00 0.00 O ATOM 1759 OD2 ASP A 118 8.564 -16.531 4.283 1.00 0.00 O ATOM 0 H ASP A 118 4.863 -17.036 2.700 1.00 0.00 H new ATOM 0 HA ASP A 118 4.599 -17.371 5.598 1.00 0.00 H new ATOM 0 HB2 ASP A 118 6.911 -17.840 5.569 1.00 0.00 H new ATOM 0 HB3 ASP A 118 6.306 -18.589 4.105 1.00 0.00 H new ATOM 1764 N ARG A 119 5.515 -14.611 4.089 1.00 0.00 N ATOM 1765 CA ARG A 119 5.753 -13.186 4.282 1.00 0.00 C ATOM 1766 C ARG A 119 5.662 -12.435 2.957 1.00 0.00 C ATOM 1767 O ARG A 119 5.547 -13.044 1.893 1.00 0.00 O ATOM 1768 CB ARG A 119 7.126 -12.957 4.917 1.00 0.00 C ATOM 1769 CG ARG A 119 8.279 -13.071 3.933 1.00 0.00 C ATOM 1770 CD ARG A 119 9.623 -12.984 4.638 1.00 0.00 C ATOM 1771 NE ARG A 119 9.799 -14.056 5.614 1.00 0.00 N ATOM 1772 CZ ARG A 119 10.813 -14.111 6.471 1.00 0.00 C ATOM 1773 NH1 ARG A 119 11.735 -13.159 6.473 1.00 0.00 N ATOM 1774 NH2 ARG A 119 10.904 -15.118 7.330 1.00 0.00 N ATOM 0 H ARG A 119 5.460 -14.901 3.113 1.00 0.00 H new ATOM 0 HA ARG A 119 4.983 -12.803 4.951 1.00 0.00 H new ATOM 0 HB2 ARG A 119 7.145 -11.967 5.373 1.00 0.00 H new ATOM 0 HB3 ARG A 119 7.271 -13.681 5.719 1.00 0.00 H new ATOM 0 HG2 ARG A 119 8.209 -14.017 3.397 1.00 0.00 H new ATOM 0 HG3 ARG A 119 8.205 -12.277 3.190 1.00 0.00 H new ATOM 0 HD2 ARG A 119 10.423 -13.031 3.900 1.00 0.00 H new ATOM 0 HD3 ARG A 119 9.708 -12.020 5.139 1.00 0.00 H new ATOM 0 HE ARG A 119 9.105 -14.804 5.639 1.00 0.00 H new ATOM 0 HH11 ARG A 119 11.667 -12.382 5.816 1.00 0.00 H new ATOM 0 HH12 ARG A 119 12.512 -13.203 7.132 1.00 0.00 H new ATOM 0 HH21 ARG A 119 10.195 -15.851 7.333 1.00 0.00 H new ATOM 0 HH22 ARG A 119 11.683 -15.159 7.987 1.00 0.00 H new ATOM 1788 N PHE A 120 5.715 -11.109 3.029 1.00 0.00 N ATOM 1789 CA PHE A 120 5.637 -10.275 1.835 1.00 0.00 C ATOM 1790 C PHE A 120 7.032 -9.886 1.352 1.00 0.00 C ATOM 1791 O PHE A 120 7.996 -9.909 2.117 1.00 0.00 O ATOM 1792 CB PHE A 120 4.815 -9.017 2.119 1.00 0.00 C ATOM 1793 CG PHE A 120 3.339 -9.205 1.910 1.00 0.00 C ATOM 1794 CD1 PHE A 120 2.757 -10.451 2.076 1.00 0.00 C ATOM 1795 CD2 PHE A 120 2.535 -8.136 1.549 1.00 0.00 C ATOM 1796 CE1 PHE A 120 1.399 -10.628 1.883 1.00 0.00 C ATOM 1797 CE2 PHE A 120 1.177 -8.306 1.356 1.00 0.00 C ATOM 1798 CZ PHE A 120 0.608 -9.554 1.524 1.00 0.00 C ATOM 0 H PHE A 120 5.812 -10.589 3.901 1.00 0.00 H new ATOM 0 HA PHE A 120 5.147 -10.852 1.050 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.991 -8.702 3.148 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.165 -8.211 1.475 1.00 0.00 H new ATOM 0 HD1 PHE A 120 3.370 -11.294 2.359 1.00 0.00 H new ATOM 0 HD2 PHE A 120 2.975 -7.158 1.417 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.957 -11.605 2.013 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.561 -7.465 1.074 1.00 0.00 H new ATOM 0 HZ PHE A 120 -0.453 -9.689 1.375 1.00 0.00 H new ATOM 1808 N LYS A 121 7.131 -9.530 0.076 1.00 0.00 N ATOM 1809 CA LYS A 121 8.405 -9.135 -0.512 1.00 0.00 C ATOM 1810 C LYS A 121 8.273 -7.812 -1.259 1.00 0.00 C ATOM 1811 O LYS A 121 7.795 -7.773 -2.393 1.00 0.00 O ATOM 1812 CB LYS A 121 8.910 -10.223 -1.464 1.00 0.00 C ATOM 1813 CG LYS A 121 8.966 -11.604 -0.834 1.00 0.00 C ATOM 1814 CD LYS A 121 9.860 -12.542 -1.627 1.00 0.00 C ATOM 1815 CE LYS A 121 11.328 -12.328 -1.293 1.00 0.00 C ATOM 1816 NZ LYS A 121 12.222 -13.071 -2.224 1.00 0.00 N ATOM 0 H LYS A 121 6.343 -9.507 -0.571 1.00 0.00 H new ATOM 0 HA LYS A 121 9.125 -9.005 0.296 1.00 0.00 H new ATOM 0 HB2 LYS A 121 8.261 -10.258 -2.339 1.00 0.00 H new ATOM 0 HB3 LYS A 121 9.906 -9.953 -1.816 1.00 0.00 H new ATOM 0 HG2 LYS A 121 9.336 -11.524 0.188 1.00 0.00 H new ATOM 0 HG3 LYS A 121 7.960 -12.020 -0.777 1.00 0.00 H new ATOM 0 HD2 LYS A 121 9.584 -13.575 -1.415 1.00 0.00 H new ATOM 0 HD3 LYS A 121 9.701 -12.382 -2.694 1.00 0.00 H new ATOM 0 HE2 LYS A 121 11.560 -11.264 -1.339 1.00 0.00 H new ATOM 0 HE3 LYS A 121 11.519 -12.652 -0.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 13.214 -12.900 -1.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 12.019 -14.089 -2.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 12.058 -12.744 -3.198 1.00 0.00 H new ATOM 1830 N VAL A 122 8.702 -6.730 -0.618 1.00 0.00 N ATOM 1831 CA VAL A 122 8.634 -5.405 -1.223 1.00 0.00 C ATOM 1832 C VAL A 122 9.863 -5.129 -2.081 1.00 0.00 C ATOM 1833 O VAL A 122 10.989 -5.435 -1.687 1.00 0.00 O ATOM 1834 CB VAL A 122 8.510 -4.305 -0.152 1.00 0.00 C ATOM 1835 CG1 VAL A 122 8.509 -2.928 -0.799 1.00 0.00 C ATOM 1836 CG2 VAL A 122 7.256 -4.512 0.682 1.00 0.00 C ATOM 0 H VAL A 122 9.101 -6.745 0.321 1.00 0.00 H new ATOM 0 HA VAL A 122 7.745 -5.390 -1.853 1.00 0.00 H new ATOM 0 HB VAL A 122 9.373 -4.368 0.511 1.00 0.00 H new ATOM 0 HG11 VAL A 122 8.421 -2.163 -0.027 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.439 -2.783 -1.348 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.666 -2.849 -1.486 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.185 -3.726 1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.379 -4.477 0.036 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.304 -5.483 1.176 1.00 0.00 H new ATOM 1846 N TYR A 123 9.641 -4.548 -3.254 1.00 0.00 N ATOM 1847 CA TYR A 123 10.731 -4.232 -4.170 1.00 0.00 C ATOM 1848 C TYR A 123 10.692 -2.762 -4.575 1.00 0.00 C ATOM 1849 O TYR A 123 9.632 -2.137 -4.585 1.00 0.00 O ATOM 1850 CB TYR A 123 10.653 -5.118 -5.414 1.00 0.00 C ATOM 1851 CG TYR A 123 10.817 -6.592 -5.119 1.00 0.00 C ATOM 1852 CD1 TYR A 123 9.736 -7.365 -4.715 1.00 0.00 C ATOM 1853 CD2 TYR A 123 12.055 -7.212 -5.245 1.00 0.00 C ATOM 1854 CE1 TYR A 123 9.881 -8.711 -4.444 1.00 0.00 C ATOM 1855 CE2 TYR A 123 12.209 -8.558 -4.977 1.00 0.00 C ATOM 1856 CZ TYR A 123 11.120 -9.304 -4.576 1.00 0.00 C ATOM 1857 OH TYR A 123 11.269 -10.645 -4.308 1.00 0.00 O ATOM 0 H TYR A 123 8.716 -4.286 -3.594 1.00 0.00 H new ATOM 0 HA TYR A 123 11.672 -4.424 -3.655 1.00 0.00 H new ATOM 0 HB2 TYR A 123 9.692 -4.959 -5.904 1.00 0.00 H new ATOM 0 HB3 TYR A 123 11.425 -4.809 -6.119 1.00 0.00 H new ATOM 0 HD1 TYR A 123 8.764 -6.905 -4.611 1.00 0.00 H new ATOM 0 HD2 TYR A 123 12.910 -6.631 -5.558 1.00 0.00 H new ATOM 0 HE1 TYR A 123 9.029 -9.297 -4.130 1.00 0.00 H new ATOM 0 HE2 TYR A 123 13.178 -9.024 -5.081 1.00 0.00 H new ATOM 0 HH TYR A 123 12.203 -10.905 -4.451 1.00 0.00 H new ATOM 1867 N ALA A 124 11.857 -2.217 -4.911 1.00 0.00 N ATOM 1868 CA ALA A 124 11.958 -0.821 -5.320 1.00 0.00 C ATOM 1869 C ALA A 124 12.950 -0.656 -6.466 1.00 0.00 C ATOM 1870 O ALA A 124 14.155 -0.826 -6.285 1.00 0.00 O ATOM 1871 CB ALA A 124 12.363 0.047 -4.139 1.00 0.00 C ATOM 0 H ALA A 124 12.744 -2.721 -4.908 1.00 0.00 H new ATOM 0 HA ALA A 124 10.978 -0.499 -5.673 1.00 0.00 H new ATOM 0 HB1 ALA A 124 12.435 1.086 -4.459 1.00 0.00 H new ATOM 0 HB2 ALA A 124 11.615 -0.039 -3.351 1.00 0.00 H new ATOM 0 HB3 ALA A 124 13.330 -0.283 -3.760 1.00 0.00 H new ATOM 1877 N ASN A 125 12.435 -0.324 -7.646 1.00 0.00 N ATOM 1878 CA ASN A 125 13.277 -0.137 -8.822 1.00 0.00 C ATOM 1879 C ASN A 125 14.101 -1.389 -9.106 1.00 0.00 C ATOM 1880 O ASN A 125 15.203 -1.311 -9.647 1.00 0.00 O ATOM 1881 CB ASN A 125 14.205 1.064 -8.625 1.00 0.00 C ATOM 1882 CG ASN A 125 13.566 2.159 -7.793 1.00 0.00 C ATOM 1883 OD1 ASN A 125 12.734 2.922 -8.285 1.00 0.00 O ATOM 1884 ND2 ASN A 125 13.952 2.240 -6.525 1.00 0.00 N ATOM 0 H ASN A 125 11.439 -0.179 -7.813 1.00 0.00 H new ATOM 0 HA ASN A 125 12.627 0.050 -9.677 1.00 0.00 H new ATOM 0 HB2 ASN A 125 15.124 0.734 -8.141 1.00 0.00 H new ATOM 0 HB3 ASN A 125 14.484 1.467 -9.598 1.00 0.00 H new ATOM 0 HD21 ASN A 125 13.556 2.956 -5.916 1.00 0.00 H new ATOM 0 HD22 ASN A 125 14.645 1.586 -6.160 1.00 0.00 H new ATOM 1891 N GLY A 126 13.557 -2.545 -8.738 1.00 0.00 N ATOM 1892 CA GLY A 126 14.254 -3.798 -8.961 1.00 0.00 C ATOM 1893 C GLY A 126 15.259 -4.105 -7.869 1.00 0.00 C ATOM 1894 O GLY A 126 16.294 -4.721 -8.125 1.00 0.00 O ATOM 0 H GLY A 126 12.646 -2.636 -8.289 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.528 -4.609 -9.020 1.00 0.00 H new ATOM 0 HA3 GLY A 126 14.767 -3.759 -9.922 1.00 0.00 H new ATOM 1898 N GLN A 127 14.956 -3.674 -6.649 1.00 0.00 N ATOM 1899 CA GLN A 127 15.843 -3.905 -5.515 1.00 0.00 C ATOM 1900 C GLN A 127 15.047 -4.284 -4.271 1.00 0.00 C ATOM 1901 O GLN A 127 14.134 -3.566 -3.862 1.00 0.00 O ATOM 1902 CB GLN A 127 16.684 -2.658 -5.237 1.00 0.00 C ATOM 1903 CG GLN A 127 17.466 -2.170 -6.446 1.00 0.00 C ATOM 1904 CD GLN A 127 18.762 -2.930 -6.648 1.00 0.00 C ATOM 1905 OE1 GLN A 127 19.773 -2.601 -5.851 1.00 0.00 O flip ATOM 1906 NE2 GLN A 127 18.855 -3.803 -7.511 1.00 0.00 N flip ATOM 0 H GLN A 127 14.103 -3.163 -6.420 1.00 0.00 H new ATOM 0 HA GLN A 127 16.506 -4.733 -5.766 1.00 0.00 H new ATOM 0 HB2 GLN A 127 16.029 -1.858 -4.891 1.00 0.00 H new ATOM 0 HB3 GLN A 127 17.381 -2.873 -4.427 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.848 -2.270 -7.338 1.00 0.00 H new ATOM 0 HG3 GLN A 127 17.686 -1.109 -6.328 1.00 0.00 H new ATOM 0 HE21 GLN A 127 18.053 -4.024 -8.102 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.734 -4.305 -7.635 1.00 0.00 H new ATOM 1915 N HIS A 128 15.400 -5.417 -3.671 1.00 0.00 N ATOM 1916 CA HIS A 128 14.719 -5.892 -2.472 1.00 0.00 C ATOM 1917 C HIS A 128 14.769 -4.841 -1.367 1.00 0.00 C ATOM 1918 O HIS A 128 15.825 -4.584 -0.788 1.00 0.00 O ATOM 1919 CB HIS A 128 15.352 -7.195 -1.982 1.00 0.00 C ATOM 1920 CG HIS A 128 14.699 -7.754 -0.756 1.00 0.00 C ATOM 1921 ND1 HIS A 128 15.354 -7.891 0.449 1.00 0.00 N ATOM 1922 CD2 HIS A 128 13.441 -8.210 -0.553 1.00 0.00 C ATOM 1923 CE1 HIS A 128 14.528 -8.410 1.341 1.00 0.00 C ATOM 1924 NE2 HIS A 128 13.360 -8.612 0.758 1.00 0.00 N ATOM 0 H HIS A 128 16.154 -6.023 -3.996 1.00 0.00 H new ATOM 0 HA HIS A 128 13.675 -6.078 -2.726 1.00 0.00 H new ATOM 0 HB2 HIS A 128 15.302 -7.936 -2.780 1.00 0.00 H new ATOM 0 HB3 HIS A 128 16.408 -7.021 -1.774 1.00 0.00 H new ATOM 0 HD2 HIS A 128 12.648 -8.250 -1.285 1.00 0.00 H new ATOM 0 HE1 HIS A 128 14.767 -8.631 2.371 1.00 0.00 H new ATOM 0 HE2 HIS A 128 12.532 -9.003 1.208 1.00 0.00 H new ATOM 1933 N LEU A 129 13.621 -4.237 -1.080 1.00 0.00 N ATOM 1934 CA LEU A 129 13.534 -3.213 -0.044 1.00 0.00 C ATOM 1935 C LEU A 129 13.516 -3.843 1.345 1.00 0.00 C ATOM 1936 O LEU A 129 14.468 -3.704 2.114 1.00 0.00 O ATOM 1937 CB LEU A 129 12.280 -2.361 -0.246 1.00 0.00 C ATOM 1938 CG LEU A 129 12.357 -0.922 0.265 1.00 0.00 C ATOM 1939 CD1 LEU A 129 13.406 -0.136 -0.507 1.00 0.00 C ATOM 1940 CD2 LEU A 129 10.998 -0.245 0.160 1.00 0.00 C ATOM 0 H LEU A 129 12.738 -4.438 -1.550 1.00 0.00 H new ATOM 0 HA LEU A 129 14.415 -2.576 -0.122 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.050 -2.335 -1.311 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.445 -2.857 0.248 1.00 0.00 H new ATOM 0 HG LEU A 129 12.649 -0.945 1.315 1.00 0.00 H new ATOM 0 HD11 LEU A 129 13.446 0.886 -0.129 1.00 0.00 H new ATOM 0 HD12 LEU A 129 14.380 -0.608 -0.381 1.00 0.00 H new ATOM 0 HD13 LEU A 129 13.144 -0.121 -1.565 1.00 0.00 H new ATOM 0 HD21 LEU A 129 11.072 0.778 0.528 1.00 0.00 H new ATOM 0 HD22 LEU A 129 10.677 -0.234 -0.881 1.00 0.00 H new ATOM 0 HD23 LEU A 129 10.271 -0.794 0.758 1.00 0.00 H new ATOM 1952 N PHE A 130 12.429 -4.539 1.659 1.00 0.00 N ATOM 1953 CA PHE A 130 12.287 -5.193 2.955 1.00 0.00 C ATOM 1954 C PHE A 130 11.146 -6.206 2.931 1.00 0.00 C ATOM 1955 O PHE A 130 10.385 -6.277 1.967 1.00 0.00 O ATOM 1956 CB PHE A 130 12.039 -4.153 4.050 1.00 0.00 C ATOM 1957 CG PHE A 130 10.712 -3.460 3.928 1.00 0.00 C ATOM 1958 CD1 PHE A 130 9.534 -4.138 4.197 1.00 0.00 C ATOM 1959 CD2 PHE A 130 10.642 -2.130 3.545 1.00 0.00 C ATOM 1960 CE1 PHE A 130 8.311 -3.504 4.087 1.00 0.00 C ATOM 1961 CE2 PHE A 130 9.422 -1.490 3.433 1.00 0.00 C ATOM 1962 CZ PHE A 130 8.255 -2.178 3.703 1.00 0.00 C ATOM 0 H PHE A 130 11.633 -4.665 1.034 1.00 0.00 H new ATOM 0 HA PHE A 130 13.215 -5.723 3.171 1.00 0.00 H new ATOM 0 HB2 PHE A 130 12.097 -4.641 5.023 1.00 0.00 H new ATOM 0 HB3 PHE A 130 12.834 -3.408 4.019 1.00 0.00 H new ATOM 0 HD1 PHE A 130 9.572 -5.175 4.496 1.00 0.00 H new ATOM 0 HD2 PHE A 130 11.551 -1.587 3.332 1.00 0.00 H new ATOM 0 HE1 PHE A 130 7.401 -4.044 4.301 1.00 0.00 H new ATOM 0 HE2 PHE A 130 9.381 -0.453 3.135 1.00 0.00 H new ATOM 0 HZ PHE A 130 7.301 -1.680 3.614 1.00 0.00 H new ATOM 1972 N ASP A 131 11.035 -6.988 4.000 1.00 0.00 N ATOM 1973 CA ASP A 131 9.988 -7.997 4.103 1.00 0.00 C ATOM 1974 C ASP A 131 9.009 -7.652 5.221 1.00 0.00 C ATOM 1975 O ASP A 131 9.373 -6.997 6.199 1.00 0.00 O ATOM 1976 CB ASP A 131 10.601 -9.375 4.353 1.00 0.00 C ATOM 1977 CG ASP A 131 11.610 -9.762 3.289 1.00 0.00 C ATOM 1978 OD1 ASP A 131 12.613 -9.034 3.130 1.00 0.00 O ATOM 1979 OD2 ASP A 131 11.397 -10.791 2.616 1.00 0.00 O ATOM 0 H ASP A 131 11.657 -6.942 4.807 1.00 0.00 H new ATOM 0 HA ASP A 131 9.442 -8.016 3.160 1.00 0.00 H new ATOM 0 HB2 ASP A 131 11.086 -9.382 5.329 1.00 0.00 H new ATOM 0 HB3 ASP A 131 9.808 -10.122 4.386 1.00 0.00 H new ATOM 1984 N PHE A 132 7.766 -8.095 5.070 1.00 0.00 N ATOM 1985 CA PHE A 132 6.734 -7.832 6.066 1.00 0.00 C ATOM 1986 C PHE A 132 6.232 -9.132 6.687 1.00 0.00 C ATOM 1987 O PHE A 132 5.534 -9.913 6.039 1.00 0.00 O ATOM 1988 CB PHE A 132 5.567 -7.072 5.433 1.00 0.00 C ATOM 1989 CG PHE A 132 4.227 -7.454 5.995 1.00 0.00 C ATOM 1990 CD1 PHE A 132 3.985 -7.379 7.357 1.00 0.00 C ATOM 1991 CD2 PHE A 132 3.210 -7.889 5.160 1.00 0.00 C ATOM 1992 CE1 PHE A 132 2.753 -7.731 7.876 1.00 0.00 C ATOM 1993 CE2 PHE A 132 1.976 -8.243 5.673 1.00 0.00 C ATOM 1994 CZ PHE A 132 1.747 -8.163 7.033 1.00 0.00 C ATOM 0 H PHE A 132 7.448 -8.638 4.267 1.00 0.00 H new ATOM 0 HA PHE A 132 7.173 -7.220 6.854 1.00 0.00 H new ATOM 0 HB2 PHE A 132 5.720 -6.002 5.576 1.00 0.00 H new ATOM 0 HB3 PHE A 132 5.566 -7.253 4.358 1.00 0.00 H new ATOM 0 HD1 PHE A 132 4.767 -7.042 8.021 1.00 0.00 H new ATOM 0 HD2 PHE A 132 3.384 -7.952 4.096 1.00 0.00 H new ATOM 0 HE1 PHE A 132 2.577 -7.668 8.940 1.00 0.00 H new ATOM 0 HE2 PHE A 132 1.192 -8.582 5.012 1.00 0.00 H new ATOM 0 HZ PHE A 132 0.784 -8.438 7.437 1.00 0.00 H new ATOM 2004 N ALA A 133 6.592 -9.358 7.946 1.00 0.00 N ATOM 2005 CA ALA A 133 6.178 -10.563 8.655 1.00 0.00 C ATOM 2006 C ALA A 133 4.662 -10.613 8.812 1.00 0.00 C ATOM 2007 O ALA A 133 4.033 -9.620 9.179 1.00 0.00 O ATOM 2008 CB ALA A 133 6.855 -10.633 10.015 1.00 0.00 C ATOM 0 H ALA A 133 7.170 -8.722 8.496 1.00 0.00 H new ATOM 0 HA ALA A 133 6.484 -11.427 8.065 1.00 0.00 H new ATOM 0 HB1 ALA A 133 6.537 -11.537 10.534 1.00 0.00 H new ATOM 0 HB2 ALA A 133 7.937 -10.652 9.882 1.00 0.00 H new ATOM 0 HB3 ALA A 133 6.577 -9.760 10.605 1.00 0.00 H new ATOM 2014 N HIS A 134 4.081 -11.775 8.533 1.00 0.00 N ATOM 2015 CA HIS A 134 2.637 -11.954 8.644 1.00 0.00 C ATOM 2016 C HIS A 134 2.175 -11.760 10.085 1.00 0.00 C ATOM 2017 O HIS A 134 2.348 -12.641 10.927 1.00 0.00 O ATOM 2018 CB HIS A 134 2.235 -13.344 8.150 1.00 0.00 C ATOM 2019 CG HIS A 134 2.272 -13.484 6.659 1.00 0.00 C ATOM 2020 ND1 HIS A 134 2.614 -14.534 5.877 1.00 0.00 N flip ATOM 2021 CD2 HIS A 134 1.932 -12.461 5.799 1.00 0.00 C flip ATOM 2022 CE1 HIS A 134 2.474 -14.132 4.572 1.00 0.00 C flip ATOM 2023 NE2 HIS A 134 2.062 -12.877 4.552 1.00 0.00 N flip ATOM 0 H HIS A 134 4.587 -12.607 8.229 1.00 0.00 H new ATOM 0 HA HIS A 134 2.153 -11.201 8.021 1.00 0.00 H new ATOM 0 HB2 HIS A 134 2.901 -14.085 8.593 1.00 0.00 H new ATOM 0 HB3 HIS A 134 1.229 -13.569 8.503 1.00 0.00 H new ATOM 0 HD2 HIS A 134 1.610 -11.474 6.098 1.00 0.00 H new ATOM 0 HE1 HIS A 134 2.669 -14.743 3.703 1.00 0.00 H new ATOM 0 HE2 HIS A 134 1.876 -12.323 3.716 1.00 0.00 H new ATOM 2032 N ARG A 135 1.588 -10.600 10.362 1.00 0.00 N ATOM 2033 CA ARG A 135 1.103 -10.290 11.701 1.00 0.00 C ATOM 2034 C ARG A 135 -0.322 -10.801 11.896 1.00 0.00 C ATOM 2035 O ARG A 135 -0.609 -11.521 12.853 1.00 0.00 O ATOM 2036 CB ARG A 135 1.152 -8.781 11.948 1.00 0.00 C ATOM 2037 CG ARG A 135 2.563 -8.217 11.988 1.00 0.00 C ATOM 2038 CD ARG A 135 2.567 -6.756 12.411 1.00 0.00 C ATOM 2039 NE ARG A 135 3.842 -6.361 13.003 1.00 0.00 N ATOM 2040 CZ ARG A 135 4.207 -6.677 14.241 1.00 0.00 C ATOM 2041 NH1 ARG A 135 3.397 -7.389 15.013 1.00 0.00 N ATOM 2042 NH2 ARG A 135 5.384 -6.281 14.709 1.00 0.00 N ATOM 0 H ARG A 135 1.437 -9.860 9.677 1.00 0.00 H new ATOM 0 HA ARG A 135 1.752 -10.791 12.419 1.00 0.00 H new ATOM 0 HB2 ARG A 135 0.589 -8.274 11.164 1.00 0.00 H new ATOM 0 HB3 ARG A 135 0.654 -8.559 12.892 1.00 0.00 H new ATOM 0 HG2 ARG A 135 3.169 -8.799 12.682 1.00 0.00 H new ATOM 0 HG3 ARG A 135 3.023 -8.313 11.004 1.00 0.00 H new ATOM 0 HD2 ARG A 135 2.359 -6.127 11.545 1.00 0.00 H new ATOM 0 HD3 ARG A 135 1.765 -6.584 13.129 1.00 0.00 H new ATOM 0 HE ARG A 135 4.488 -5.812 12.435 1.00 0.00 H new ATOM 0 HH11 ARG A 135 2.492 -7.695 14.657 1.00 0.00 H new ATOM 0 HH12 ARG A 135 3.679 -7.630 15.963 1.00 0.00 H new ATOM 0 HH21 ARG A 135 6.010 -5.733 14.118 1.00 0.00 H new ATOM 0 HH22 ARG A 135 5.663 -6.524 15.659 1.00 0.00 H new ATOM 2056 N LEU A 136 -1.210 -10.425 10.983 1.00 0.00 N ATOM 2057 CA LEU A 136 -2.605 -10.844 11.053 1.00 0.00 C ATOM 2058 C LEU A 136 -2.826 -12.136 10.272 1.00 0.00 C ATOM 2059 O LEU A 136 -2.797 -12.141 9.041 1.00 0.00 O ATOM 2060 CB LEU A 136 -3.518 -9.744 10.510 1.00 0.00 C ATOM 2061 CG LEU A 136 -4.986 -10.124 10.314 1.00 0.00 C ATOM 2062 CD1 LEU A 136 -5.752 -9.987 11.620 1.00 0.00 C ATOM 2063 CD2 LEU A 136 -5.619 -9.266 9.229 1.00 0.00 C ATOM 0 H LEU A 136 -0.989 -9.830 10.185 1.00 0.00 H new ATOM 0 HA LEU A 136 -2.851 -11.027 12.099 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -3.472 -8.893 11.190 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -3.120 -9.409 9.552 1.00 0.00 H new ATOM 0 HG LEU A 136 -5.032 -11.166 9.998 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -6.795 -10.262 11.461 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -5.314 -10.646 12.370 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -5.698 -8.955 11.967 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -6.664 -9.551 9.103 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -5.561 -8.216 9.515 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -5.087 -9.416 8.290 1.00 0.00 H new ATOM 2075 N SER A 137 -3.047 -13.229 10.995 1.00 0.00 N ATOM 2076 CA SER A 137 -3.272 -14.527 10.369 1.00 0.00 C ATOM 2077 C SER A 137 -4.346 -14.431 9.290 1.00 0.00 C ATOM 2078 O SER A 137 -4.300 -15.145 8.289 1.00 0.00 O ATOM 2079 CB SER A 137 -3.679 -15.560 11.421 1.00 0.00 C ATOM 2080 OG SER A 137 -4.926 -15.226 12.007 1.00 0.00 O ATOM 0 H SER A 137 -3.075 -13.242 12.015 1.00 0.00 H new ATOM 0 HA SER A 137 -2.340 -14.844 9.901 1.00 0.00 H new ATOM 0 HB2 SER A 137 -3.742 -16.546 10.962 1.00 0.00 H new ATOM 0 HB3 SER A 137 -2.913 -15.617 12.195 1.00 0.00 H new ATOM 0 HG SER A 137 -5.165 -15.902 12.675 1.00 0.00 H new ATOM 2086 N ALA A 138 -5.312 -13.544 9.503 1.00 0.00 N ATOM 2087 CA ALA A 138 -6.398 -13.353 8.549 1.00 0.00 C ATOM 2088 C ALA A 138 -5.978 -12.418 7.421 1.00 0.00 C ATOM 2089 O ALA A 138 -6.816 -11.765 6.798 1.00 0.00 O ATOM 2090 CB ALA A 138 -7.632 -12.811 9.255 1.00 0.00 C ATOM 0 H ALA A 138 -5.365 -12.946 10.328 1.00 0.00 H new ATOM 0 HA ALA A 138 -6.640 -14.322 8.112 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -8.435 -12.673 8.530 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -7.952 -13.517 10.021 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -7.394 -11.854 9.720 1.00 0.00 H new ATOM 2096 N PHE A 139 -4.676 -12.357 7.162 1.00 0.00 N ATOM 2097 CA PHE A 139 -4.145 -11.499 6.109 1.00 0.00 C ATOM 2098 C PHE A 139 -4.971 -11.630 4.833 1.00 0.00 C ATOM 2099 O PHE A 139 -5.276 -10.636 4.174 1.00 0.00 O ATOM 2100 CB PHE A 139 -2.684 -11.852 5.822 1.00 0.00 C ATOM 2101 CG PHE A 139 -2.521 -13.050 4.932 1.00 0.00 C ATOM 2102 CD1 PHE A 139 -2.656 -14.332 5.440 1.00 0.00 C ATOM 2103 CD2 PHE A 139 -2.231 -12.895 3.586 1.00 0.00 C ATOM 2104 CE1 PHE A 139 -2.506 -15.437 4.623 1.00 0.00 C ATOM 2105 CE2 PHE A 139 -2.081 -13.996 2.763 1.00 0.00 C ATOM 2106 CZ PHE A 139 -2.217 -15.268 3.283 1.00 0.00 C ATOM 0 H PHE A 139 -3.969 -12.892 7.667 1.00 0.00 H new ATOM 0 HA PHE A 139 -4.201 -10.466 6.454 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -2.196 -10.995 5.358 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -2.171 -12.038 6.766 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -2.881 -14.470 6.487 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -2.121 -11.902 3.175 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.615 -16.431 5.032 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.858 -13.861 1.715 1.00 0.00 H new ATOM 0 HZ PHE A 139 -2.098 -16.130 2.643 1.00 0.00 H new ATOM 2116 N GLN A 140 -5.329 -12.863 4.491 1.00 0.00 N ATOM 2117 CA GLN A 140 -6.119 -13.125 3.293 1.00 0.00 C ATOM 2118 C GLN A 140 -7.332 -12.203 3.229 1.00 0.00 C ATOM 2119 O GLN A 140 -7.689 -11.705 2.161 1.00 0.00 O ATOM 2120 CB GLN A 140 -6.572 -14.586 3.264 1.00 0.00 C ATOM 2121 CG GLN A 140 -7.393 -14.992 4.477 1.00 0.00 C ATOM 2122 CD GLN A 140 -7.352 -16.485 4.736 1.00 0.00 C ATOM 2123 OE1 GLN A 140 -7.696 -17.287 3.867 1.00 0.00 O ATOM 2124 NE2 GLN A 140 -6.928 -16.867 5.935 1.00 0.00 N ATOM 0 H GLN A 140 -5.085 -13.696 5.026 1.00 0.00 H new ATOM 0 HA GLN A 140 -5.490 -12.930 2.424 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -7.161 -14.757 2.363 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -5.694 -15.229 3.198 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -7.022 -14.464 5.356 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -8.427 -14.681 4.332 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.653 -16.168 6.625 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -6.878 -17.859 6.166 1.00 0.00 H new ATOM 2133 N ARG A 141 -7.961 -11.980 4.378 1.00 0.00 N ATOM 2134 CA ARG A 141 -9.135 -11.119 4.451 1.00 0.00 C ATOM 2135 C ARG A 141 -8.829 -9.733 3.892 1.00 0.00 C ATOM 2136 O ARG A 141 -9.654 -9.133 3.203 1.00 0.00 O ATOM 2137 CB ARG A 141 -9.618 -11.001 5.898 1.00 0.00 C ATOM 2138 CG ARG A 141 -9.954 -12.338 6.539 1.00 0.00 C ATOM 2139 CD ARG A 141 -10.650 -12.155 7.878 1.00 0.00 C ATOM 2140 NE ARG A 141 -12.088 -11.949 7.724 1.00 0.00 N ATOM 2141 CZ ARG A 141 -12.938 -12.919 7.406 1.00 0.00 C ATOM 2142 NH1 ARG A 141 -12.498 -14.153 7.209 1.00 0.00 N ATOM 2143 NH2 ARG A 141 -14.233 -12.653 7.284 1.00 0.00 N ATOM 0 H ARG A 141 -7.677 -12.383 5.271 1.00 0.00 H new ATOM 0 HA ARG A 141 -9.923 -11.570 3.847 1.00 0.00 H new ATOM 0 HB2 ARG A 141 -8.848 -10.507 6.490 1.00 0.00 H new ATOM 0 HB3 ARG A 141 -10.501 -10.362 5.927 1.00 0.00 H new ATOM 0 HG2 ARG A 141 -10.595 -12.912 5.870 1.00 0.00 H new ATOM 0 HG3 ARG A 141 -9.040 -12.916 6.679 1.00 0.00 H new ATOM 0 HD2 ARG A 141 -10.474 -13.032 8.501 1.00 0.00 H new ATOM 0 HD3 ARG A 141 -10.215 -11.302 8.399 1.00 0.00 H new ATOM 0 HE ARG A 141 -12.459 -11.010 7.868 1.00 0.00 H new ATOM 0 HH11 ARG A 141 -11.504 -14.361 7.301 1.00 0.00 H new ATOM 0 HH12 ARG A 141 -13.154 -14.895 6.965 1.00 0.00 H new ATOM 0 HH21 ARG A 141 -14.575 -11.704 7.434 1.00 0.00 H new ATOM 0 HH22 ARG A 141 -14.886 -13.398 7.040 1.00 0.00 H new ATOM 2157 N VAL A 142 -7.636 -9.229 4.193 1.00 0.00 N ATOM 2158 CA VAL A 142 -7.220 -7.914 3.720 1.00 0.00 C ATOM 2159 C VAL A 142 -7.408 -7.787 2.213 1.00 0.00 C ATOM 2160 O VAL A 142 -6.618 -8.316 1.431 1.00 0.00 O ATOM 2161 CB VAL A 142 -5.746 -7.633 4.068 1.00 0.00 C ATOM 2162 CG1 VAL A 142 -5.346 -6.237 3.615 1.00 0.00 C ATOM 2163 CG2 VAL A 142 -5.508 -7.807 5.560 1.00 0.00 C ATOM 0 H VAL A 142 -6.941 -9.712 4.762 1.00 0.00 H new ATOM 0 HA VAL A 142 -7.851 -7.182 4.225 1.00 0.00 H new ATOM 0 HB VAL A 142 -5.123 -8.353 3.538 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -4.302 -6.057 3.870 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -5.476 -6.153 2.536 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -5.973 -5.499 4.114 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -4.461 -7.605 5.788 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -6.141 -7.112 6.113 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -5.751 -8.829 5.850 1.00 0.00 H new ATOM 2173 N ASP A 143 -8.460 -7.082 1.811 1.00 0.00 N ATOM 2174 CA ASP A 143 -8.752 -6.884 0.396 1.00 0.00 C ATOM 2175 C ASP A 143 -8.882 -5.399 0.071 1.00 0.00 C ATOM 2176 O ASP A 143 -9.563 -5.017 -0.882 1.00 0.00 O ATOM 2177 CB ASP A 143 -10.038 -7.617 0.011 1.00 0.00 C ATOM 2178 CG ASP A 143 -11.245 -7.109 0.775 1.00 0.00 C ATOM 2179 OD1 ASP A 143 -11.754 -6.024 0.426 1.00 0.00 O ATOM 2180 OD2 ASP A 143 -11.680 -7.797 1.723 1.00 0.00 O ATOM 0 H ASP A 143 -9.125 -6.638 2.445 1.00 0.00 H new ATOM 0 HA ASP A 143 -7.923 -7.293 -0.181 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -10.213 -7.500 -1.058 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -9.915 -8.684 0.199 1.00 0.00 H new ATOM 2185 N THR A 144 -8.226 -4.563 0.870 1.00 0.00 N ATOM 2186 CA THR A 144 -8.270 -3.121 0.670 1.00 0.00 C ATOM 2187 C THR A 144 -6.873 -2.513 0.741 1.00 0.00 C ATOM 2188 O THR A 144 -6.055 -2.908 1.572 1.00 0.00 O ATOM 2189 CB THR A 144 -9.169 -2.435 1.715 1.00 0.00 C ATOM 2190 OG1 THR A 144 -10.314 -3.251 1.986 1.00 0.00 O ATOM 2191 CG2 THR A 144 -9.620 -1.066 1.227 1.00 0.00 C ATOM 0 H THR A 144 -7.657 -4.861 1.663 1.00 0.00 H new ATOM 0 HA THR A 144 -8.687 -2.953 -0.323 1.00 0.00 H new ATOM 0 HB THR A 144 -8.591 -2.304 2.630 1.00 0.00 H new ATOM 0 HG1 THR A 144 -10.880 -2.809 2.653 1.00 0.00 H new ATOM 0 HG21 THR A 144 -10.254 -0.601 1.982 1.00 0.00 H new ATOM 0 HG22 THR A 144 -8.747 -0.438 1.049 1.00 0.00 H new ATOM 0 HG23 THR A 144 -10.182 -1.177 0.300 1.00 0.00 H new ATOM 2199 N LEU A 145 -6.607 -1.550 -0.135 1.00 0.00 N ATOM 2200 CA LEU A 145 -5.309 -0.886 -0.171 1.00 0.00 C ATOM 2201 C LEU A 145 -5.473 0.626 -0.285 1.00 0.00 C ATOM 2202 O LEU A 145 -5.859 1.140 -1.334 1.00 0.00 O ATOM 2203 CB LEU A 145 -4.478 -1.410 -1.344 1.00 0.00 C ATOM 2204 CG LEU A 145 -3.390 -0.472 -1.868 1.00 0.00 C ATOM 2205 CD1 LEU A 145 -2.166 -0.518 -0.967 1.00 0.00 C ATOM 2206 CD2 LEU A 145 -3.016 -0.836 -3.298 1.00 0.00 C ATOM 0 H LEU A 145 -7.273 -1.212 -0.830 1.00 0.00 H new ATOM 0 HA LEU A 145 -4.790 -1.107 0.762 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -4.008 -2.346 -1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -5.154 -1.645 -2.166 1.00 0.00 H new ATOM 0 HG LEU A 145 -3.781 0.545 -1.863 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -1.402 0.156 -1.356 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -2.444 -0.209 0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -1.773 -1.534 -0.939 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -2.241 -0.158 -3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -2.644 -1.860 -3.327 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -3.895 -0.750 -3.937 1.00 0.00 H new ATOM 2218 N GLU A 146 -5.175 1.332 0.801 1.00 0.00 N ATOM 2219 CA GLU A 146 -5.289 2.785 0.822 1.00 0.00 C ATOM 2220 C GLU A 146 -3.912 3.438 0.914 1.00 0.00 C ATOM 2221 O GLU A 146 -2.988 2.879 1.506 1.00 0.00 O ATOM 2222 CB GLU A 146 -6.158 3.235 1.998 1.00 0.00 C ATOM 2223 CG GLU A 146 -5.874 2.483 3.287 1.00 0.00 C ATOM 2224 CD GLU A 146 -6.606 3.070 4.478 1.00 0.00 C ATOM 2225 OE1 GLU A 146 -6.428 4.276 4.747 1.00 0.00 O ATOM 2226 OE2 GLU A 146 -7.356 2.323 5.141 1.00 0.00 O ATOM 0 H GLU A 146 -4.853 0.921 1.677 1.00 0.00 H new ATOM 0 HA GLU A 146 -5.760 3.099 -0.109 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -6.002 4.301 2.167 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -7.208 3.104 1.734 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -6.164 1.439 3.166 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -4.802 2.496 3.482 1.00 0.00 H new ATOM 2233 N ILE A 147 -3.785 4.622 0.326 1.00 0.00 N ATOM 2234 CA ILE A 147 -2.522 5.350 0.342 1.00 0.00 C ATOM 2235 C ILE A 147 -2.745 6.831 0.634 1.00 0.00 C ATOM 2236 O ILE A 147 -3.307 7.556 -0.186 1.00 0.00 O ATOM 2237 CB ILE A 147 -1.773 5.210 -0.996 1.00 0.00 C ATOM 2238 CG1 ILE A 147 -1.669 3.736 -1.394 1.00 0.00 C ATOM 2239 CG2 ILE A 147 -0.391 5.837 -0.898 1.00 0.00 C ATOM 2240 CD1 ILE A 147 -1.631 3.515 -2.890 1.00 0.00 C ATOM 0 H ILE A 147 -4.540 5.098 -0.167 1.00 0.00 H new ATOM 0 HA ILE A 147 -1.916 4.912 1.135 1.00 0.00 H new ATOM 0 HB ILE A 147 -2.335 5.737 -1.767 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -0.769 3.311 -0.949 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -2.518 3.195 -0.976 1.00 0.00 H new ATOM 0 HG21 ILE A 147 0.126 5.730 -1.852 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -0.488 6.895 -0.655 1.00 0.00 H new ATOM 0 HG23 ILE A 147 0.181 5.336 -0.117 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -1.557 2.448 -3.098 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -2.542 3.910 -3.339 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -0.767 4.028 -3.312 1.00 0.00 H new ATOM 2252 N GLN A 148 -2.300 7.271 1.806 1.00 0.00 N ATOM 2253 CA GLN A 148 -2.450 8.665 2.205 1.00 0.00 C ATOM 2254 C GLN A 148 -1.100 9.279 2.560 1.00 0.00 C ATOM 2255 O GLN A 148 -0.075 8.598 2.548 1.00 0.00 O ATOM 2256 CB GLN A 148 -3.403 8.777 3.397 1.00 0.00 C ATOM 2257 CG GLN A 148 -3.079 7.814 4.527 1.00 0.00 C ATOM 2258 CD GLN A 148 -3.764 6.471 4.365 1.00 0.00 C ATOM 2259 OE1 GLN A 148 -2.990 5.448 4.025 1.00 0.00 O flip ATOM 2260 NE2 GLN A 148 -4.977 6.355 4.543 1.00 0.00 N flip ATOM 0 H GLN A 148 -1.833 6.683 2.496 1.00 0.00 H new ATOM 0 HA GLN A 148 -2.868 9.214 1.361 1.00 0.00 H new ATOM 0 HB2 GLN A 148 -3.374 9.797 3.780 1.00 0.00 H new ATOM 0 HB3 GLN A 148 -4.422 8.594 3.056 1.00 0.00 H new ATOM 0 HG2 GLN A 148 -2.000 7.664 4.573 1.00 0.00 H new ATOM 0 HG3 GLN A 148 -3.380 8.259 5.476 1.00 0.00 H new ATOM 0 HE21 GLN A 148 -5.534 7.169 4.804 1.00 0.00 H new ATOM 0 HE22 GLN A 148 -5.424 5.445 4.430 1.00 0.00 H new ATOM 2269 N GLY A 149 -1.106 10.571 2.874 1.00 0.00 N ATOM 2270 CA GLY A 149 0.125 11.254 3.226 1.00 0.00 C ATOM 2271 C GLY A 149 0.564 12.242 2.164 1.00 0.00 C ATOM 2272 O GLY A 149 -0.260 12.955 1.590 1.00 0.00 O ATOM 0 H GLY A 149 -1.941 11.157 2.891 1.00 0.00 H new ATOM 0 HA2 GLY A 149 -0.012 11.779 4.172 1.00 0.00 H new ATOM 0 HA3 GLY A 149 0.914 10.518 3.381 1.00 0.00 H new ATOM 2276 N ASP A 150 1.865 12.287 1.902 1.00 0.00 N ATOM 2277 CA ASP A 150 2.413 13.196 0.902 1.00 0.00 C ATOM 2278 C ASP A 150 3.138 12.424 -0.196 1.00 0.00 C ATOM 2279 O ASP A 150 4.334 12.152 -0.092 1.00 0.00 O ATOM 2280 CB ASP A 150 3.370 14.194 1.558 1.00 0.00 C ATOM 2281 CG ASP A 150 2.773 14.843 2.791 1.00 0.00 C ATOM 2282 OD1 ASP A 150 2.476 14.114 3.761 1.00 0.00 O ATOM 2283 OD2 ASP A 150 2.605 16.080 2.787 1.00 0.00 O ATOM 0 H ASP A 150 2.560 11.704 2.368 1.00 0.00 H new ATOM 0 HA ASP A 150 1.584 13.742 0.451 1.00 0.00 H new ATOM 0 HB2 ASP A 150 4.293 13.682 1.831 1.00 0.00 H new ATOM 0 HB3 ASP A 150 3.635 14.967 0.836 1.00 0.00 H new ATOM 2288 N VAL A 151 2.405 12.071 -1.247 1.00 0.00 N ATOM 2289 CA VAL A 151 2.977 11.329 -2.364 1.00 0.00 C ATOM 2290 C VAL A 151 2.245 11.642 -3.664 1.00 0.00 C ATOM 2291 O VAL A 151 1.079 12.038 -3.654 1.00 0.00 O ATOM 2292 CB VAL A 151 2.929 9.810 -2.113 1.00 0.00 C ATOM 2293 CG1 VAL A 151 1.531 9.382 -1.696 1.00 0.00 C ATOM 2294 CG2 VAL A 151 3.382 9.051 -3.351 1.00 0.00 C ATOM 0 H VAL A 151 1.413 12.287 -1.348 1.00 0.00 H new ATOM 0 HA VAL A 151 4.017 11.642 -2.452 1.00 0.00 H new ATOM 0 HB VAL A 151 3.613 9.572 -1.299 1.00 0.00 H new ATOM 0 HG11 VAL A 151 1.516 8.306 -1.523 1.00 0.00 H new ATOM 0 HG12 VAL A 151 1.250 9.901 -0.779 1.00 0.00 H new ATOM 0 HG13 VAL A 151 0.823 9.632 -2.486 1.00 0.00 H new ATOM 0 HG21 VAL A 151 3.342 7.979 -3.156 1.00 0.00 H new ATOM 0 HG22 VAL A 151 2.725 9.293 -4.187 1.00 0.00 H new ATOM 0 HG23 VAL A 151 4.404 9.336 -3.599 1.00 0.00 H new ATOM 2304 N THR A 152 2.936 11.460 -4.785 1.00 0.00 N ATOM 2305 CA THR A 152 2.352 11.723 -6.094 1.00 0.00 C ATOM 2306 C THR A 152 2.192 10.435 -6.894 1.00 0.00 C ATOM 2307 O THR A 152 3.119 9.997 -7.577 1.00 0.00 O ATOM 2308 CB THR A 152 3.211 12.713 -6.904 1.00 0.00 C ATOM 2309 OG1 THR A 152 3.433 13.905 -6.143 1.00 0.00 O ATOM 2310 CG2 THR A 152 2.535 13.065 -8.221 1.00 0.00 C ATOM 0 H THR A 152 3.901 11.131 -4.812 1.00 0.00 H new ATOM 0 HA THR A 152 1.370 12.163 -5.919 1.00 0.00 H new ATOM 0 HB THR A 152 4.167 12.237 -7.121 1.00 0.00 H new ATOM 0 HG1 THR A 152 3.981 14.528 -6.664 1.00 0.00 H new ATOM 0 HG21 THR A 152 3.160 13.765 -8.775 1.00 0.00 H new ATOM 0 HG22 THR A 152 2.394 12.159 -8.811 1.00 0.00 H new ATOM 0 HG23 THR A 152 1.566 13.523 -8.022 1.00 0.00 H new ATOM 2318 N LEU A 153 1.012 9.832 -6.804 1.00 0.00 N ATOM 2319 CA LEU A 153 0.730 8.593 -7.521 1.00 0.00 C ATOM 2320 C LEU A 153 0.457 8.867 -8.996 1.00 0.00 C ATOM 2321 O LEU A 153 -0.247 9.815 -9.342 1.00 0.00 O ATOM 2322 CB LEU A 153 -0.468 7.879 -6.893 1.00 0.00 C ATOM 2323 CG LEU A 153 -0.297 7.432 -5.440 1.00 0.00 C ATOM 2324 CD1 LEU A 153 -1.637 7.023 -4.847 1.00 0.00 C ATOM 2325 CD2 LEU A 153 0.701 6.288 -5.348 1.00 0.00 C ATOM 0 H LEU A 153 0.235 10.180 -6.242 1.00 0.00 H new ATOM 0 HA LEU A 153 1.608 7.951 -7.446 1.00 0.00 H new ATOM 0 HB2 LEU A 153 -1.331 8.542 -6.949 1.00 0.00 H new ATOM 0 HB3 LEU A 153 -0.700 7.002 -7.497 1.00 0.00 H new ATOM 0 HG LEU A 153 0.091 8.272 -4.864 1.00 0.00 H new ATOM 0 HD11 LEU A 153 -1.496 6.708 -3.813 1.00 0.00 H new ATOM 0 HD12 LEU A 153 -2.322 7.870 -4.878 1.00 0.00 H new ATOM 0 HD13 LEU A 153 -2.054 6.198 -5.424 1.00 0.00 H new ATOM 0 HD21 LEU A 153 0.810 5.983 -4.307 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.343 5.444 -5.938 1.00 0.00 H new ATOM 0 HD23 LEU A 153 1.667 6.616 -5.733 1.00 0.00 H new ATOM 2337 N SER A 154 1.018 8.029 -9.862 1.00 0.00 N ATOM 2338 CA SER A 154 0.836 8.181 -11.301 1.00 0.00 C ATOM 2339 C SER A 154 0.208 6.929 -11.905 1.00 0.00 C ATOM 2340 O SER A 154 -0.646 7.014 -12.788 1.00 0.00 O ATOM 2341 CB SER A 154 2.177 8.470 -11.978 1.00 0.00 C ATOM 2342 OG SER A 154 1.989 8.997 -13.280 1.00 0.00 O ATOM 0 H SER A 154 1.602 7.238 -9.592 1.00 0.00 H new ATOM 0 HA SER A 154 0.163 9.021 -11.470 1.00 0.00 H new ATOM 0 HB2 SER A 154 2.747 9.177 -11.375 1.00 0.00 H new ATOM 0 HB3 SER A 154 2.764 7.553 -12.035 1.00 0.00 H new ATOM 0 HG SER A 154 2.861 9.174 -13.690 1.00 0.00 H new ATOM 2348 N TYR A 155 0.637 5.768 -11.423 1.00 0.00 N ATOM 2349 CA TYR A 155 0.119 4.498 -11.916 1.00 0.00 C ATOM 2350 C TYR A 155 0.001 3.481 -10.784 1.00 0.00 C ATOM 2351 O TYR A 155 0.951 3.258 -10.033 1.00 0.00 O ATOM 2352 CB TYR A 155 1.025 3.947 -13.019 1.00 0.00 C ATOM 2353 CG TYR A 155 0.576 2.608 -13.559 1.00 0.00 C ATOM 2354 CD1 TYR A 155 0.805 1.437 -12.847 1.00 0.00 C ATOM 2355 CD2 TYR A 155 -0.078 2.514 -14.781 1.00 0.00 C ATOM 2356 CE1 TYR A 155 0.398 0.212 -13.337 1.00 0.00 C ATOM 2357 CE2 TYR A 155 -0.490 1.293 -15.278 1.00 0.00 C ATOM 2358 CZ TYR A 155 -0.250 0.145 -14.553 1.00 0.00 C ATOM 2359 OH TYR A 155 -0.658 -1.074 -15.044 1.00 0.00 O ATOM 0 H TYR A 155 1.342 5.680 -10.691 1.00 0.00 H new ATOM 0 HA TYR A 155 -0.875 4.675 -12.326 1.00 0.00 H new ATOM 0 HB2 TYR A 155 1.064 4.665 -13.838 1.00 0.00 H new ATOM 0 HB3 TYR A 155 2.039 3.851 -12.631 1.00 0.00 H new ATOM 0 HD1 TYR A 155 1.310 1.486 -11.894 1.00 0.00 H new ATOM 0 HD2 TYR A 155 -0.267 3.411 -15.352 1.00 0.00 H new ATOM 0 HE1 TYR A 155 0.586 -0.689 -12.771 1.00 0.00 H new ATOM 0 HE2 TYR A 155 -0.998 1.238 -16.230 1.00 0.00 H new ATOM 0 HH TYR A 155 -0.237 -1.792 -14.527 1.00 0.00 H new ATOM 2369 N VAL A 156 -1.172 2.867 -10.669 1.00 0.00 N ATOM 2370 CA VAL A 156 -1.415 1.872 -9.631 1.00 0.00 C ATOM 2371 C VAL A 156 -2.256 0.717 -10.163 1.00 0.00 C ATOM 2372 O VAL A 156 -3.462 0.856 -10.362 1.00 0.00 O ATOM 2373 CB VAL A 156 -2.127 2.493 -8.414 1.00 0.00 C ATOM 2374 CG1 VAL A 156 -2.499 1.416 -7.407 1.00 0.00 C ATOM 2375 CG2 VAL A 156 -1.250 3.557 -7.771 1.00 0.00 C ATOM 0 H VAL A 156 -1.969 3.041 -11.282 1.00 0.00 H new ATOM 0 HA VAL A 156 -0.441 1.495 -9.320 1.00 0.00 H new ATOM 0 HB VAL A 156 -3.046 2.970 -8.755 1.00 0.00 H new ATOM 0 HG11 VAL A 156 -3.001 1.873 -6.554 1.00 0.00 H new ATOM 0 HG12 VAL A 156 -3.167 0.694 -7.877 1.00 0.00 H new ATOM 0 HG13 VAL A 156 -1.596 0.908 -7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 156 -1.768 3.986 -6.913 1.00 0.00 H new ATOM 0 HG22 VAL A 156 -0.314 3.107 -7.442 1.00 0.00 H new ATOM 0 HG23 VAL A 156 -1.039 4.342 -8.497 1.00 0.00 H new ATOM 2385 N GLN A 157 -1.610 -0.422 -10.391 1.00 0.00 N ATOM 2386 CA GLN A 157 -2.299 -1.602 -10.900 1.00 0.00 C ATOM 2387 C GLN A 157 -2.209 -2.756 -9.907 1.00 0.00 C ATOM 2388 O GLN A 157 -1.141 -3.038 -9.364 1.00 0.00 O ATOM 2389 CB GLN A 157 -1.706 -2.024 -12.245 1.00 0.00 C ATOM 2390 CG GLN A 157 -2.284 -3.322 -12.785 1.00 0.00 C ATOM 2391 CD GLN A 157 -2.266 -3.384 -14.299 1.00 0.00 C ATOM 2392 OE1 GLN A 157 -1.219 -3.604 -14.910 1.00 0.00 O ATOM 2393 NE2 GLN A 157 -3.427 -3.191 -14.914 1.00 0.00 N ATOM 0 H GLN A 157 -0.611 -0.553 -10.231 1.00 0.00 H new ATOM 0 HA GLN A 157 -3.350 -1.347 -11.038 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -1.876 -1.230 -12.972 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -0.627 -2.133 -12.138 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -1.717 -4.162 -12.384 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -3.310 -3.433 -12.433 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -4.270 -3.012 -14.368 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -3.476 -3.222 -15.932 1.00 0.00 H new ATOM 2402 N ILE A 158 -3.337 -3.419 -9.675 1.00 0.00 N ATOM 2403 CA ILE A 158 -3.384 -4.543 -8.748 1.00 0.00 C ATOM 2404 C ILE A 158 -3.472 -5.869 -9.495 1.00 0.00 C ATOM 2405 O ILE A 158 -4.563 -6.355 -9.792 1.00 0.00 O ATOM 2406 CB ILE A 158 -4.582 -4.429 -7.786 1.00 0.00 C ATOM 2407 CG1 ILE A 158 -4.422 -3.205 -6.881 1.00 0.00 C ATOM 2408 CG2 ILE A 158 -4.716 -5.696 -6.954 1.00 0.00 C ATOM 2409 CD1 ILE A 158 -5.738 -2.598 -6.447 1.00 0.00 C ATOM 0 H ILE A 158 -4.230 -3.197 -10.116 1.00 0.00 H new ATOM 0 HA ILE A 158 -2.460 -4.515 -8.171 1.00 0.00 H new ATOM 0 HB ILE A 158 -5.491 -4.307 -8.374 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -3.853 -3.490 -5.996 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -3.838 -2.449 -7.406 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.567 -5.600 -6.279 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -4.871 -6.550 -7.614 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -3.807 -5.847 -6.372 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.548 -1.735 -5.808 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.300 -2.282 -7.326 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.315 -3.339 -5.894 1.00 0.00 H new ATOM 2421 N SER A 159 -2.315 -6.450 -9.795 1.00 0.00 N ATOM 2422 CA SER A 159 -2.260 -7.720 -10.510 1.00 0.00 C ATOM 2423 C SER A 159 -2.969 -8.818 -9.723 1.00 0.00 C ATOM 2424 O SER A 159 -3.430 -8.596 -8.604 1.00 0.00 O ATOM 2425 CB SER A 159 -0.806 -8.120 -10.771 1.00 0.00 C ATOM 2426 OG SER A 159 -0.208 -8.656 -9.603 1.00 0.00 O ATOM 0 H SER A 159 -1.403 -6.062 -9.554 1.00 0.00 H new ATOM 0 HA SER A 159 -2.771 -7.594 -11.464 1.00 0.00 H new ATOM 0 HB2 SER A 159 -0.766 -8.856 -11.574 1.00 0.00 H new ATOM 0 HB3 SER A 159 -0.241 -7.251 -11.107 1.00 0.00 H new ATOM 0 HG SER A 159 -0.263 -8.000 -8.877 1.00 0.00 H new ATOM 2432 N GLY A 160 -3.051 -10.004 -10.317 1.00 0.00 N ATOM 2433 CA GLY A 160 -3.705 -11.120 -9.658 1.00 0.00 C ATOM 2434 C GLY A 160 -4.310 -12.101 -10.642 1.00 0.00 C ATOM 2435 O GLY A 160 -3.898 -12.187 -11.799 1.00 0.00 O ATOM 0 H GLY A 160 -2.676 -10.212 -11.243 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -2.983 -11.640 -9.029 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -4.487 -10.742 -9.000 1.00 0.00 H new ATOM 2439 N PRO A 161 -5.311 -12.866 -10.182 1.00 0.00 N ATOM 2440 CA PRO A 161 -5.994 -13.861 -11.014 1.00 0.00 C ATOM 2441 C PRO A 161 -6.852 -13.219 -12.098 1.00 0.00 C ATOM 2442 O PRO A 161 -6.938 -11.995 -12.191 1.00 0.00 O ATOM 2443 CB PRO A 161 -6.872 -14.617 -10.014 1.00 0.00 C ATOM 2444 CG PRO A 161 -7.103 -13.649 -8.905 1.00 0.00 C ATOM 2445 CD PRO A 161 -5.853 -12.818 -8.814 1.00 0.00 C ATOM 0 HA PRO A 161 -5.290 -14.498 -11.549 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -7.812 -14.929 -10.469 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -6.377 -15.519 -9.655 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -7.973 -13.024 -9.107 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -7.295 -14.169 -7.967 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -6.072 -11.796 -8.504 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -5.150 -13.228 -8.089 1.00 0.00 H new ATOM 2453 N SER A 162 -7.486 -14.053 -12.916 1.00 0.00 N ATOM 2454 CA SER A 162 -8.336 -13.566 -13.996 1.00 0.00 C ATOM 2455 C SER A 162 -9.804 -13.873 -13.714 1.00 0.00 C ATOM 2456 O SER A 162 -10.214 -15.034 -13.697 1.00 0.00 O ATOM 2457 CB SER A 162 -7.918 -14.197 -15.326 1.00 0.00 C ATOM 2458 OG SER A 162 -8.372 -13.423 -16.423 1.00 0.00 O ATOM 0 H SER A 162 -7.427 -15.069 -12.851 1.00 0.00 H new ATOM 0 HA SER A 162 -8.215 -12.485 -14.060 1.00 0.00 H new ATOM 0 HB2 SER A 162 -6.832 -14.286 -15.364 1.00 0.00 H new ATOM 0 HB3 SER A 162 -8.323 -15.206 -15.397 1.00 0.00 H new ATOM 0 HG SER A 162 -8.091 -13.846 -17.261 1.00 0.00 H new ATOM 2464 N SER A 163 -10.589 -12.824 -13.493 1.00 0.00 N ATOM 2465 CA SER A 163 -12.011 -12.981 -13.207 1.00 0.00 C ATOM 2466 C SER A 163 -12.850 -12.677 -14.444 1.00 0.00 C ATOM 2467 O SER A 163 -13.894 -12.032 -14.357 1.00 0.00 O ATOM 2468 CB SER A 163 -12.425 -12.061 -12.057 1.00 0.00 C ATOM 2469 OG SER A 163 -12.269 -10.698 -12.412 1.00 0.00 O ATOM 0 H SER A 163 -10.265 -11.857 -13.506 1.00 0.00 H new ATOM 0 HA SER A 163 -12.187 -14.017 -12.916 1.00 0.00 H new ATOM 0 HB2 SER A 163 -13.464 -12.254 -11.789 1.00 0.00 H new ATOM 0 HB3 SER A 163 -11.823 -12.282 -11.176 1.00 0.00 H new ATOM 0 HG SER A 163 -12.542 -10.131 -11.661 1.00 0.00 H new ATOM 2475 N GLY A 164 -12.385 -13.148 -15.597 1.00 0.00 N ATOM 2476 CA GLY A 164 -13.104 -12.917 -16.837 1.00 0.00 C ATOM 2477 C GLY A 164 -12.273 -13.250 -18.060 1.00 0.00 C ATOM 2478 O GLY A 164 -12.727 -13.083 -19.191 1.00 0.00 O ATOM 0 H GLY A 164 -11.524 -13.685 -15.695 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -14.013 -13.519 -16.844 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -13.413 -11.873 -16.885 1.00 0.00 H new TER 2482 GLY A 164