USER MOD reduce.3.24.130724 H: found=0, std=0, add=1396, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1394 hydrogens (12 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 151 SER OG : rot 92:sc= 0.996 USER MOD Set 1.2: A 154 THR OG1 : rot -150:sc= -2.66! USER MOD Set 2.1: A 32 LYS NZ :NH3+ -151:sc= 1.14 (180deg=-0.532) USER MOD Set 2.2: A 48 TYR OH : rot 80:sc= -0.195 USER MOD Set 3.1: A 31 SER OG : rot 60:sc= 0.586 USER MOD Set 3.2: A 155 LYS NZ :NH3+ 164:sc= -0.203 (180deg=-0.65) USER MOD Set 4.1: A 16 HIS : no HD1:sc= -7.1! C(o=-17!,f=-17!) USER MOD Set 4.2: A 19 HIS : no HD1:sc= -6.74! C(o=-17!,f=-29!) USER MOD Set 4.3: A 96 THR OG1 : rot -168:sc= -3.33! 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 HIS : no HD1:sc= -0.438 X(o=-0.44,f=-0.12) USER MOD Single : A 4 MET CE :methyl -163:sc= -0.0874 (180deg=-0.481) USER MOD Single : A 12 THR OG1 : rot 167:sc= 0.828 USER MOD Single : A 14 MET CE :methyl -137:sc= 0 (180deg=-0.867) USER MOD Single : A 21 LYS NZ :NH3+ -153:sc= 1.16 (180deg=0.973) USER MOD Single : A 22 THR OG1 : rot 82:sc= 0.585 USER MOD Single : A 23 THR OG1 : rot -111:sc= -1.37! USER MOD Single : A 30 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.095) USER MOD Single : A 34 THR OG1 : rot 162:sc= 0.959 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot 180:sc=-0.00676 USER MOD Single : A 43 GLN : amide:sc= -0.0262 K(o=-0.026,f=-1) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.0002) USER MOD Single : A 49 GLN : amide:sc= 1.13 K(o=1.1,f=-2.5) USER MOD Single : A 51 THR OG1 : rot -170:sc= -0.784 USER MOD Single : A 53 ASN : amide:sc= -0.0964 K(o=-0.096,f=-11!) USER MOD Single : A 55 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.22) USER MOD Single : A 56 LYS NZ :NH3+ -111:sc= 1.04 (180deg=-0.228) USER MOD Single : A 58 THR OG1 : rot 180:sc= -1.25 USER MOD Single : A 62 THR OG1 : rot 65:sc= 0.79 USER MOD Single : A 65 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.0388 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 GLN : amide:sc= -0.439 K(o=-0.44,f=-4.5!) USER MOD Single : A 79 THR OG1 : rot -23:sc= 0.696 USER MOD Single : A 93 MET CE :methyl -121:sc= -0.0712 (180deg=-1.06) USER MOD Single : A 95 GLN : amide:sc= -2.63! K(o=-2.6!,f=-1.2) USER MOD Single : A 101 ASN : amide:sc= -2.69! C(o=-2.7!,f=-2.8!) USER MOD Single : A 102 HIS : no HD1:sc= -2.58! K(o=-2.6!,f=-1.1) USER MOD Single : A 104 LYS NZ :NH3+ 171:sc= 1.12 (180deg=0.908) USER MOD Single : A 107 ASN : amide:sc=-0.000867 K(o=-0.00087,f=-0.78) USER MOD Single : A 115 ASN : amide:sc= -4.71! C(o=-4.7!,f=-12!) USER MOD Single : A 116 LYS NZ :NH3+ -148:sc= 2.21 (180deg=1.44) USER MOD Single : A 117 MET CE :methyl -115:sc= -3.89! (180deg=-12.3!) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= -5.54! K(o=-5.5!,f=-0.9) USER MOD Single : A 128 MET CE :methyl 147:sc= -2.89! (180deg=-4.31) USER MOD Single : A 129 GLN : amide:sc= 0.725 K(o=0.73,f=0) USER MOD Single : A 132 MET CE :methyl 146:sc= -0.56 (180deg=-1.66!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.101 K(o=-0.1,f=-2.4!) USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 CYS SG : rot -130:sc= -1.06 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 160 HIS : no HD1:sc=-0.00406 X(o=-0.0041,f=-0.0041) USER MOD Single : A 164 MET CE :methyl 134:sc= -2.47! (180deg=-5.38!) USER MOD Single : A 169 SER OG : rot 68:sc= 0.814 USER MOD Single : A 171 MET CE :methyl 163:sc= -0.193 (180deg=-0.734) USER MOD Single : A 175 LYS NZ :NH3+ 179:sc= 1.16 (180deg=1.15) USER MOD Single : A 177 ASN : amide:sc= -0.0972 X(o=-0.097,f=-0.45) USER MOD Single : A 179 GDP O2' : rot -15:sc= 0.271 USER MOD Single : A 179 GDP O3' : rot 180:sc= 0.228 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.526 0.134 -29.257 1.00 11.58 N ATOM 2 CA GLY A 1 -19.252 -0.945 -28.551 1.00 11.11 C ATOM 3 C GLY A 1 -19.921 -0.442 -27.294 1.00 10.21 C ATOM 4 O GLY A 1 -19.259 -0.200 -26.284 1.00 9.82 O ATOM 0 H1 GLY A 1 -18.080 -0.251 -30.114 1.00 11.58 H new ATOM 0 H2 GLY A 1 -19.194 0.886 -29.522 1.00 11.58 H new ATOM 0 H3 GLY A 1 -17.793 0.526 -28.632 1.00 11.58 H new ATOM 0 HA2 GLY A 1 -20.002 -1.373 -29.216 1.00 11.11 H new ATOM 0 HA3 GLY A 1 -18.557 -1.745 -28.297 1.00 11.11 H new ATOM 10 N SER A 2 -21.233 -0.265 -27.361 1.00 10.08 N ATOM 11 CA SER A 2 -21.996 0.226 -26.230 1.00 9.47 C ATOM 12 C SER A 2 -22.070 -0.839 -25.141 1.00 8.68 C ATOM 13 O SER A 2 -22.887 -1.761 -25.208 1.00 8.69 O ATOM 14 CB SER A 2 -23.402 0.632 -26.680 1.00 9.96 C ATOM 15 OG SER A 2 -23.341 1.566 -27.748 1.00 10.61 O ATOM 0 H SER A 2 -21.791 -0.456 -28.193 1.00 10.08 H new ATOM 0 HA SER A 2 -21.495 1.103 -25.821 1.00 9.47 H new ATOM 0 HB2 SER A 2 -23.957 -0.252 -26.995 1.00 9.96 H new ATOM 0 HB3 SER A 2 -23.945 1.067 -25.841 1.00 9.96 H new ATOM 0 HG SER A 2 -24.250 1.811 -28.021 1.00 10.61 H new ATOM 21 N HIS A 3 -21.180 -0.729 -24.163 1.00 8.25 N ATOM 22 CA HIS A 3 -21.137 -1.670 -23.049 1.00 7.71 C ATOM 23 C HIS A 3 -22.425 -1.591 -22.228 1.00 6.90 C ATOM 24 O HIS A 3 -22.808 -0.524 -21.744 1.00 6.93 O ATOM 25 CB HIS A 3 -19.904 -1.407 -22.163 1.00 8.30 C ATOM 26 CG HIS A 3 -19.919 -0.092 -21.429 1.00 8.89 C ATOM 27 ND1 HIS A 3 -19.585 0.031 -20.097 1.00 9.51 N ATOM 28 CD2 HIS A 3 -20.239 1.156 -21.845 1.00 9.23 C ATOM 29 CE1 HIS A 3 -19.700 1.291 -19.731 1.00 10.14 C ATOM 30 NE2 HIS A 3 -20.095 1.997 -20.771 1.00 9.99 N ATOM 0 H HIS A 3 -20.474 0.006 -24.118 1.00 8.25 H new ATOM 0 HA HIS A 3 -21.054 -2.679 -23.454 1.00 7.71 H new ATOM 0 HB2 HIS A 3 -19.821 -2.213 -21.434 1.00 8.30 H new ATOM 0 HB3 HIS A 3 -19.011 -1.448 -22.787 1.00 8.30 H new ATOM 0 HD2 HIS A 3 -20.551 1.438 -22.840 1.00 9.23 H new ATOM 0 HE1 HIS A 3 -19.503 1.681 -18.743 1.00 10.14 H new ATOM 0 HE2 HIS A 3 -20.266 3.003 -20.777 1.00 9.99 H new ATOM 39 N MET A 4 -23.103 -2.720 -22.090 1.00 6.50 N ATOM 40 CA MET A 4 -24.358 -2.763 -21.351 1.00 6.05 C ATOM 41 C MET A 4 -24.147 -3.346 -19.964 1.00 5.19 C ATOM 42 O MET A 4 -24.897 -3.049 -19.034 1.00 5.17 O ATOM 43 CB MET A 4 -25.410 -3.573 -22.111 1.00 6.67 C ATOM 44 CG MET A 4 -25.883 -2.907 -23.392 1.00 7.26 C ATOM 45 SD MET A 4 -26.647 -1.298 -23.098 1.00 8.18 S ATOM 46 CE MET A 4 -28.072 -1.771 -22.113 1.00 8.77 C ATOM 0 H MET A 4 -22.808 -3.616 -22.478 1.00 6.50 H new ATOM 0 HA MET A 4 -24.720 -1.740 -21.246 1.00 6.05 H new ATOM 0 HB2 MET A 4 -24.998 -4.553 -22.352 1.00 6.67 H new ATOM 0 HB3 MET A 4 -26.268 -3.740 -21.460 1.00 6.67 H new ATOM 0 HG2 MET A 4 -25.036 -2.785 -24.067 1.00 7.26 H new ATOM 0 HG3 MET A 4 -26.599 -3.559 -23.893 1.00 7.26 H new ATOM 0 HE1 MET A 4 -28.796 -0.956 -22.106 1.00 8.77 H new ATOM 0 HE2 MET A 4 -28.532 -2.661 -22.542 1.00 8.77 H new ATOM 0 HE3 MET A 4 -27.754 -1.983 -21.092 1.00 8.77 H new ATOM 56 N VAL A 5 -23.131 -4.180 -19.825 1.00 4.89 N ATOM 57 CA VAL A 5 -22.802 -4.753 -18.532 1.00 4.47 C ATOM 58 C VAL A 5 -21.631 -4.002 -17.903 1.00 4.02 C ATOM 59 O VAL A 5 -20.577 -3.822 -18.522 1.00 4.26 O ATOM 60 CB VAL A 5 -22.482 -6.265 -18.635 1.00 5.11 C ATOM 61 CG1 VAL A 5 -21.303 -6.525 -19.560 1.00 5.46 C ATOM 62 CG2 VAL A 5 -22.227 -6.857 -17.256 1.00 5.74 C ATOM 0 H VAL A 5 -22.522 -4.474 -20.588 1.00 4.89 H new ATOM 0 HA VAL A 5 -23.678 -4.648 -17.893 1.00 4.47 H new ATOM 0 HB VAL A 5 -23.353 -6.758 -19.066 1.00 5.11 H new ATOM 0 HG11 VAL A 5 -21.107 -7.596 -19.608 1.00 5.46 H new ATOM 0 HG12 VAL A 5 -21.535 -6.154 -20.558 1.00 5.46 H new ATOM 0 HG13 VAL A 5 -20.421 -6.012 -19.178 1.00 5.46 H new ATOM 0 HG21 VAL A 5 -22.004 -7.920 -17.352 1.00 5.74 H new ATOM 0 HG22 VAL A 5 -21.381 -6.349 -16.793 1.00 5.74 H new ATOM 0 HG23 VAL A 5 -23.113 -6.727 -16.635 1.00 5.74 H new ATOM 72 N GLU A 6 -21.831 -3.534 -16.686 1.00 3.71 N ATOM 73 CA GLU A 6 -20.796 -2.811 -15.967 1.00 3.56 C ATOM 74 C GLU A 6 -20.445 -3.554 -14.687 1.00 3.07 C ATOM 75 O GLU A 6 -21.192 -4.428 -14.246 1.00 3.23 O ATOM 76 CB GLU A 6 -21.246 -1.376 -15.645 1.00 4.14 C ATOM 77 CG GLU A 6 -22.406 -1.272 -14.661 1.00 4.54 C ATOM 78 CD GLU A 6 -23.712 -1.812 -15.213 1.00 5.11 C ATOM 79 OE1 GLU A 6 -24.433 -1.054 -15.891 1.00 5.29 O ATOM 80 OE2 GLU A 6 -24.019 -2.996 -14.971 1.00 5.70 O ATOM 0 H GLU A 6 -22.705 -3.642 -16.171 1.00 3.71 H new ATOM 0 HA GLU A 6 -19.912 -2.750 -16.602 1.00 3.56 H new ATOM 0 HB2 GLU A 6 -20.396 -0.826 -15.241 1.00 4.14 H new ATOM 0 HB3 GLU A 6 -21.532 -0.883 -16.574 1.00 4.14 H new ATOM 0 HG2 GLU A 6 -22.152 -1.816 -13.751 1.00 4.54 H new ATOM 0 HG3 GLU A 6 -22.543 -0.228 -14.380 1.00 4.54 H new ATOM 87 N ARG A 7 -19.308 -3.221 -14.106 1.00 2.85 N ATOM 88 CA ARG A 7 -18.882 -3.850 -12.868 1.00 2.62 C ATOM 89 C ARG A 7 -18.191 -2.828 -11.979 1.00 2.19 C ATOM 90 O ARG A 7 -17.048 -2.454 -12.236 1.00 2.44 O ATOM 91 CB ARG A 7 -17.929 -5.012 -13.155 1.00 3.27 C ATOM 92 CG ARG A 7 -17.677 -5.905 -11.948 1.00 3.86 C ATOM 93 CD ARG A 7 -18.884 -6.774 -11.643 1.00 4.69 C ATOM 94 NE ARG A 7 -19.129 -7.753 -12.705 1.00 5.27 N ATOM 95 CZ ARG A 7 -20.190 -8.557 -12.756 1.00 6.08 C ATOM 96 NH1 ARG A 7 -21.155 -8.462 -11.847 1.00 6.40 N ATOM 97 NH2 ARG A 7 -20.297 -9.441 -13.739 1.00 6.85 N ATOM 0 H ARG A 7 -18.663 -2.520 -14.470 1.00 2.85 H new ATOM 0 HA ARG A 7 -19.763 -4.238 -12.357 1.00 2.62 H new ATOM 0 HB2 ARG A 7 -18.339 -5.616 -13.964 1.00 3.27 H new ATOM 0 HB3 ARG A 7 -16.978 -4.613 -13.506 1.00 3.27 H new ATOM 0 HG2 ARG A 7 -16.809 -6.537 -12.136 1.00 3.86 H new ATOM 0 HG3 ARG A 7 -17.441 -5.289 -11.080 1.00 3.86 H new ATOM 0 HD2 ARG A 7 -18.729 -7.294 -10.698 1.00 4.69 H new ATOM 0 HD3 ARG A 7 -19.764 -6.143 -11.519 1.00 4.69 H new ATOM 0 HE ARG A 7 -18.442 -7.824 -13.455 1.00 5.27 H new ATOM 0 HH11 ARG A 7 -21.087 -7.769 -11.102 1.00 6.40 H new ATOM 0 HH12 ARG A 7 -21.963 -9.082 -11.895 1.00 6.40 H new ATOM 0 HH21 ARG A 7 -19.569 -9.503 -14.451 1.00 6.85 H new ATOM 0 HH22 ARG A 7 -21.107 -10.059 -13.783 1.00 6.85 H new ATOM 111 N PRO A 8 -18.884 -2.347 -10.939 1.00 2.01 N ATOM 112 CA PRO A 8 -18.303 -1.403 -9.982 1.00 2.04 C ATOM 113 C PRO A 8 -17.065 -1.985 -9.304 1.00 1.71 C ATOM 114 O PRO A 8 -17.061 -3.148 -8.891 1.00 1.69 O ATOM 115 CB PRO A 8 -19.425 -1.184 -8.960 1.00 2.57 C ATOM 116 CG PRO A 8 -20.674 -1.585 -9.663 1.00 2.80 C ATOM 117 CD PRO A 8 -20.279 -2.678 -10.615 1.00 2.42 C ATOM 0 HA PRO A 8 -17.971 -0.481 -10.459 1.00 2.04 H new ATOM 0 HB2 PRO A 8 -19.266 -1.786 -8.065 1.00 2.57 H new ATOM 0 HB3 PRO A 8 -19.469 -0.143 -8.640 1.00 2.57 H new ATOM 0 HG2 PRO A 8 -21.425 -1.936 -8.955 1.00 2.80 H new ATOM 0 HG3 PRO A 8 -21.110 -0.741 -10.197 1.00 2.80 H new ATOM 0 HD2 PRO A 8 -20.364 -3.663 -10.156 1.00 2.42 H new ATOM 0 HD3 PRO A 8 -20.909 -2.686 -11.504 1.00 2.42 H new ATOM 125 N PRO A 9 -15.985 -1.192 -9.214 1.00 1.83 N ATOM 126 CA PRO A 9 -14.735 -1.620 -8.584 1.00 1.84 C ATOM 127 C PRO A 9 -14.907 -1.877 -7.088 1.00 1.40 C ATOM 128 O PRO A 9 -14.833 -0.956 -6.271 1.00 1.72 O ATOM 129 CB PRO A 9 -13.777 -0.444 -8.822 1.00 2.47 C ATOM 130 CG PRO A 9 -14.419 0.380 -9.887 1.00 2.76 C ATOM 131 CD PRO A 9 -15.896 0.183 -9.726 1.00 2.36 C ATOM 0 HA PRO A 9 -14.373 -2.560 -9.000 1.00 1.84 H new ATOM 0 HB2 PRO A 9 -13.632 0.136 -7.910 1.00 2.47 H new ATOM 0 HB3 PRO A 9 -12.794 -0.795 -9.136 1.00 2.47 H new ATOM 0 HG2 PRO A 9 -14.152 1.431 -9.782 1.00 2.76 H new ATOM 0 HG3 PRO A 9 -14.089 0.065 -10.877 1.00 2.76 H new ATOM 0 HD2 PRO A 9 -16.327 0.903 -9.030 1.00 2.36 H new ATOM 0 HD3 PRO A 9 -16.425 0.298 -10.672 1.00 2.36 H new ATOM 139 N VAL A 10 -15.162 -3.130 -6.739 1.00 1.18 N ATOM 140 CA VAL A 10 -15.293 -3.521 -5.349 1.00 0.94 C ATOM 141 C VAL A 10 -13.932 -3.510 -4.667 1.00 0.94 C ATOM 142 O VAL A 10 -12.912 -3.843 -5.274 1.00 1.76 O ATOM 143 CB VAL A 10 -15.946 -4.913 -5.198 1.00 1.25 C ATOM 144 CG1 VAL A 10 -17.395 -4.872 -5.657 1.00 1.90 C ATOM 145 CG2 VAL A 10 -15.171 -5.965 -5.974 1.00 2.00 C ATOM 0 H VAL A 10 -15.282 -3.893 -7.405 1.00 1.18 H new ATOM 0 HA VAL A 10 -15.947 -2.794 -4.868 1.00 0.94 H new ATOM 0 HB VAL A 10 -15.922 -5.186 -4.143 1.00 1.25 H new ATOM 0 HG11 VAL A 10 -17.841 -5.860 -5.544 1.00 1.90 H new ATOM 0 HG12 VAL A 10 -17.948 -4.153 -5.052 1.00 1.90 H new ATOM 0 HG13 VAL A 10 -17.437 -4.573 -6.704 1.00 1.90 H new ATOM 0 HG21 VAL A 10 -15.652 -6.936 -5.851 1.00 2.00 H new ATOM 0 HG22 VAL A 10 -15.155 -5.699 -7.031 1.00 2.00 H new ATOM 0 HG23 VAL A 10 -14.149 -6.016 -5.597 1.00 2.00 H new ATOM 155 N VAL A 11 -13.922 -3.111 -3.411 1.00 0.62 N ATOM 156 CA VAL A 11 -12.686 -2.969 -2.672 1.00 0.61 C ATOM 157 C VAL A 11 -12.635 -4.005 -1.552 1.00 0.62 C ATOM 158 O VAL A 11 -13.649 -4.616 -1.219 1.00 0.93 O ATOM 159 CB VAL A 11 -12.567 -1.540 -2.083 1.00 0.76 C ATOM 160 CG1 VAL A 11 -11.203 -1.299 -1.453 1.00 1.35 C ATOM 161 CG2 VAL A 11 -12.838 -0.499 -3.155 1.00 0.95 C ATOM 0 H VAL A 11 -14.761 -2.879 -2.880 1.00 0.62 H new ATOM 0 HA VAL A 11 -11.849 -3.132 -3.351 1.00 0.61 H new ATOM 0 HB VAL A 11 -13.317 -1.449 -1.297 1.00 0.76 H new ATOM 0 HG11 VAL A 11 -11.161 -0.286 -1.052 1.00 1.35 H new ATOM 0 HG12 VAL A 11 -11.043 -2.015 -0.647 1.00 1.35 H new ATOM 0 HG13 VAL A 11 -10.427 -1.423 -2.208 1.00 1.35 H new ATOM 0 HG21 VAL A 11 -12.750 0.498 -2.724 1.00 0.95 H new ATOM 0 HG22 VAL A 11 -12.114 -0.611 -3.962 1.00 0.95 H new ATOM 0 HG23 VAL A 11 -13.845 -0.636 -3.549 1.00 0.95 H new ATOM 171 N THR A 12 -11.451 -4.244 -1.020 1.00 0.44 N ATOM 172 CA THR A 12 -11.291 -5.045 0.175 1.00 0.45 C ATOM 173 C THR A 12 -10.284 -4.373 1.098 1.00 0.41 C ATOM 174 O THR A 12 -9.123 -4.190 0.734 1.00 0.50 O ATOM 175 CB THR A 12 -10.830 -6.474 -0.158 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.753 -7.072 -1.077 1.00 0.61 O ATOM 177 CG2 THR A 12 -10.742 -7.326 1.099 1.00 0.64 C ATOM 0 H THR A 12 -10.576 -3.888 -1.405 1.00 0.44 H new ATOM 0 HA THR A 12 -12.259 -5.120 0.671 1.00 0.45 H new ATOM 0 HB THR A 12 -9.838 -6.420 -0.608 1.00 0.54 H new ATOM 0 HG1 THR A 12 -11.358 -7.885 -1.455 1.00 0.61 H new ATOM 0 HG21 THR A 12 -10.414 -8.331 0.835 1.00 0.64 H new ATOM 0 HG22 THR A 12 -10.027 -6.881 1.791 1.00 0.64 H new ATOM 0 HG23 THR A 12 -11.722 -7.377 1.573 1.00 0.64 H new ATOM 185 N ILE A 13 -10.738 -3.965 2.272 1.00 0.40 N ATOM 186 CA ILE A 13 -9.874 -3.268 3.208 1.00 0.40 C ATOM 187 C ILE A 13 -9.123 -4.263 4.094 1.00 0.37 C ATOM 188 O ILE A 13 -9.689 -5.232 4.604 1.00 0.52 O ATOM 189 CB ILE A 13 -10.658 -2.254 4.075 1.00 0.52 C ATOM 190 CG1 ILE A 13 -9.692 -1.305 4.790 1.00 1.15 C ATOM 191 CG2 ILE A 13 -11.534 -2.979 5.082 1.00 1.26 C ATOM 192 CD1 ILE A 13 -10.382 -0.204 5.569 1.00 1.30 C ATOM 0 H ILE A 13 -11.695 -4.104 2.597 1.00 0.40 H new ATOM 0 HA ILE A 13 -9.149 -2.704 2.621 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.302 -1.665 3.421 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -9.067 -1.883 5.471 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -9.028 -0.854 4.053 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -12.078 -2.250 5.683 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -12.244 -3.616 4.555 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -10.910 -3.592 5.732 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -9.633 0.427 6.048 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -10.985 0.399 4.890 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -11.025 -0.645 6.331 1.00 1.30 H new ATOM 204 N MET A 14 -7.840 -4.014 4.248 1.00 0.26 N ATOM 205 CA MET A 14 -6.955 -4.857 5.011 1.00 0.28 C ATOM 206 C MET A 14 -6.024 -3.977 5.834 1.00 0.24 C ATOM 207 O MET A 14 -6.120 -2.754 5.772 1.00 0.29 O ATOM 208 CB MET A 14 -6.141 -5.733 4.061 1.00 0.36 C ATOM 209 CG MET A 14 -6.953 -6.794 3.329 1.00 0.49 C ATOM 210 SD MET A 14 -5.958 -7.738 2.155 1.00 0.79 S ATOM 211 CE MET A 14 -7.164 -8.896 1.516 1.00 0.69 C ATOM 0 H MET A 14 -7.377 -3.203 3.837 1.00 0.26 H new ATOM 0 HA MET A 14 -7.532 -5.499 5.676 1.00 0.28 H new ATOM 0 HB2 MET A 14 -5.654 -5.094 3.325 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.351 -6.225 4.628 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.394 -7.475 4.056 1.00 0.49 H new ATOM 0 HG3 MET A 14 -7.777 -6.315 2.800 1.00 0.49 H new ATOM 0 HE1 MET A 14 -6.716 -9.888 1.449 1.00 0.69 H new ATOM 0 HE2 MET A 14 -8.025 -8.931 2.184 1.00 0.69 H new ATOM 0 HE3 MET A 14 -7.487 -8.576 0.525 1.00 0.69 H new ATOM 221 N GLY A 15 -5.131 -4.581 6.600 1.00 0.27 N ATOM 222 CA GLY A 15 -4.179 -3.811 7.361 1.00 0.27 C ATOM 223 C GLY A 15 -3.880 -4.432 8.702 1.00 0.24 C ATOM 224 O GLY A 15 -4.291 -5.560 8.971 1.00 0.31 O ATOM 0 H GLY A 15 -5.050 -5.592 6.707 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -3.254 -3.717 6.792 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -4.566 -2.803 7.508 1.00 0.27 H new ATOM 228 N HIS A 16 -3.154 -3.707 9.538 1.00 0.20 N ATOM 229 CA HIS A 16 -2.762 -4.220 10.843 1.00 0.17 C ATOM 230 C HIS A 16 -3.687 -3.722 11.953 1.00 0.19 C ATOM 231 O HIS A 16 -4.410 -2.732 11.805 1.00 0.22 O ATOM 232 CB HIS A 16 -1.318 -3.828 11.165 1.00 0.17 C ATOM 233 CG HIS A 16 -0.750 -4.526 12.371 1.00 0.16 C ATOM 234 ND1 HIS A 16 -0.849 -5.887 12.531 1.00 0.16 N ATOM 235 CD2 HIS A 16 -0.120 -4.004 13.445 1.00 0.19 C ATOM 236 CE1 HIS A 16 -0.280 -6.154 13.696 1.00 0.19 C ATOM 237 NE2 HIS A 16 0.174 -5.044 14.285 1.00 0.22 N ATOM 0 H HIS A 16 -2.824 -2.763 9.338 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.842 -5.306 10.796 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.691 -4.049 10.301 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -1.272 -2.751 11.326 1.00 0.17 H new ATOM 0 HD2 HIS A 16 0.109 -2.962 13.610 1.00 0.19 H new ATOM 0 HE1 HIS A 16 -0.194 -7.145 14.117 1.00 0.19 H new ATOM 0 HE2 HIS A 16 0.648 -4.983 15.186 1.00 0.22 H new ATOM 245 N VAL A 17 -3.641 -4.438 13.061 1.00 0.20 N ATOM 246 CA VAL A 17 -4.354 -4.082 14.273 1.00 0.25 C ATOM 247 C VAL A 17 -3.675 -2.897 14.952 1.00 0.26 C ATOM 248 O VAL A 17 -2.472 -2.705 14.789 1.00 0.25 O ATOM 249 CB VAL A 17 -4.384 -5.294 15.221 1.00 0.29 C ATOM 250 CG1 VAL A 17 -2.973 -5.765 15.535 1.00 0.30 C ATOM 251 CG2 VAL A 17 -5.114 -4.999 16.501 1.00 0.36 C ATOM 0 H VAL A 17 -3.098 -5.297 13.145 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.376 -3.797 14.022 1.00 0.25 H new ATOM 0 HB VAL A 17 -4.926 -6.085 14.702 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -3.017 -6.622 16.207 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -2.471 -6.053 14.611 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -2.418 -4.958 16.013 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -5.108 -5.885 17.136 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -4.621 -4.177 17.020 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -6.144 -4.721 16.277 1.00 0.36 H new ATOM 261 N ASP A 18 -4.456 -2.088 15.674 1.00 0.31 N ATOM 262 CA ASP A 18 -3.956 -0.892 16.364 1.00 0.36 C ATOM 263 C ASP A 18 -3.665 0.225 15.367 1.00 0.34 C ATOM 264 O ASP A 18 -3.830 1.406 15.671 1.00 0.41 O ATOM 265 CB ASP A 18 -2.716 -1.207 17.207 1.00 0.42 C ATOM 266 CG ASP A 18 -2.136 0.028 17.867 1.00 0.55 C ATOM 267 OD1 ASP A 18 -2.596 0.382 18.974 1.00 0.69 O ATOM 268 OD2 ASP A 18 -1.210 0.638 17.290 1.00 0.59 O ATOM 0 H ASP A 18 -5.456 -2.243 15.798 1.00 0.31 H new ATOM 0 HA ASP A 18 -4.737 -0.551 17.043 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -2.977 -1.936 17.974 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -1.957 -1.667 16.574 1.00 0.42 H new ATOM 273 N HIS A 19 -3.246 -0.160 14.173 1.00 0.29 N ATOM 274 CA HIS A 19 -3.129 0.775 13.070 1.00 0.32 C ATOM 275 C HIS A 19 -4.518 1.256 12.689 1.00 0.43 C ATOM 276 O HIS A 19 -4.677 2.297 12.061 1.00 0.63 O ATOM 277 CB HIS A 19 -2.452 0.124 11.862 1.00 0.29 C ATOM 278 CG HIS A 19 -1.059 -0.356 12.125 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.211 -0.676 11.097 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.423 -0.555 13.303 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.915 -1.067 11.668 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.832 -1.011 13.001 1.00 0.24 N ATOM 0 H HIS A 19 -2.981 -1.118 13.944 1.00 0.29 H new ATOM 0 HA HIS A 19 -2.511 1.617 13.383 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.058 -0.719 11.530 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.428 0.842 11.042 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -0.827 -0.387 14.290 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.791 -1.391 11.126 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.564 -1.260 13.666 1.00 0.24 H new ATOM 290 N GLY A 20 -5.520 0.472 13.081 1.00 0.42 N ATOM 291 CA GLY A 20 -6.896 0.864 12.884 1.00 0.54 C ATOM 292 C GLY A 20 -7.714 -0.173 12.158 1.00 0.57 C ATOM 293 O GLY A 20 -8.311 0.122 11.130 1.00 0.79 O ATOM 0 H GLY A 20 -5.396 -0.433 13.534 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.352 1.063 13.854 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -6.924 1.797 12.322 1.00 0.54 H new ATOM 297 N LYS A 21 -7.753 -1.392 12.675 1.00 0.61 N ATOM 298 CA LYS A 21 -8.574 -2.419 12.068 1.00 0.95 C ATOM 299 C LYS A 21 -10.059 -2.053 12.174 1.00 0.89 C ATOM 300 O LYS A 21 -10.741 -1.894 11.161 1.00 1.05 O ATOM 301 CB LYS A 21 -8.303 -3.769 12.728 1.00 1.36 C ATOM 302 CG LYS A 21 -8.287 -4.924 11.738 1.00 1.79 C ATOM 303 CD LYS A 21 -9.585 -4.999 10.952 1.00 2.30 C ATOM 304 CE LYS A 21 -9.323 -5.232 9.478 1.00 2.66 C ATOM 305 NZ LYS A 21 -10.585 -5.259 8.692 1.00 3.31 N ATOM 0 H LYS A 21 -7.233 -1.688 13.501 1.00 0.61 H new ATOM 0 HA LYS A 21 -8.317 -2.492 11.011 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -7.344 -3.728 13.245 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -9.065 -3.957 13.484 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -7.450 -4.804 11.050 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -8.129 -5.861 12.272 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -10.205 -5.805 11.345 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -10.145 -4.073 11.082 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -8.673 -4.445 9.095 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -8.793 -6.175 9.347 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -10.452 -5.843 7.842 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -11.347 -5.662 9.273 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -10.839 -4.291 8.410 1.00 3.31 H new ATOM 319 N THR A 22 -10.550 -1.922 13.396 1.00 0.84 N ATOM 320 CA THR A 22 -11.940 -1.557 13.626 1.00 0.87 C ATOM 321 C THR A 22 -12.111 -0.040 13.640 1.00 0.79 C ATOM 322 O THR A 22 -13.059 0.496 13.066 1.00 0.79 O ATOM 323 CB THR A 22 -12.449 -2.131 14.966 1.00 1.02 C ATOM 324 OG1 THR A 22 -12.165 -3.532 15.029 1.00 1.21 O ATOM 325 CG2 THR A 22 -13.946 -1.908 15.130 1.00 1.18 C ATOM 0 H THR A 22 -10.005 -2.063 14.247 1.00 0.84 H new ATOM 0 HA THR A 22 -12.524 -1.979 12.808 1.00 0.87 H new ATOM 0 HB THR A 22 -11.935 -1.611 15.774 1.00 1.02 H new ATOM 0 HG1 THR A 22 -11.236 -3.665 15.312 1.00 1.21 H new ATOM 0 HG21 THR A 22 -14.273 -2.323 16.083 1.00 1.18 H new ATOM 0 HG22 THR A 22 -14.159 -0.839 15.107 1.00 1.18 H new ATOM 0 HG23 THR A 22 -14.479 -2.401 14.317 1.00 1.18 H new ATOM 333 N THR A 23 -11.173 0.644 14.281 1.00 0.75 N ATOM 334 CA THR A 23 -11.247 2.085 14.471 1.00 0.75 C ATOM 335 C THR A 23 -11.354 2.858 13.157 1.00 0.67 C ATOM 336 O THR A 23 -12.026 3.880 13.100 1.00 0.66 O ATOM 337 CB THR A 23 -10.031 2.587 15.261 1.00 0.82 C ATOM 338 OG1 THR A 23 -8.945 1.657 15.107 1.00 1.25 O ATOM 339 CG2 THR A 23 -10.367 2.756 16.735 1.00 1.17 C ATOM 0 H THR A 23 -10.340 0.215 14.684 1.00 0.75 H new ATOM 0 HA THR A 23 -12.162 2.271 15.034 1.00 0.75 H new ATOM 0 HB THR A 23 -9.739 3.561 14.869 1.00 0.82 H new ATOM 0 HG1 THR A 23 -8.778 1.205 15.960 1.00 1.25 H new ATOM 0 HG21 THR A 23 -9.487 3.113 17.270 1.00 1.17 H new ATOM 0 HG22 THR A 23 -11.175 3.479 16.843 1.00 1.17 H new ATOM 0 HG23 THR A 23 -10.680 1.797 17.149 1.00 1.17 H new ATOM 347 N LEU A 24 -10.718 2.363 12.102 1.00 0.65 N ATOM 348 CA LEU A 24 -10.756 3.039 10.815 1.00 0.63 C ATOM 349 C LEU A 24 -12.133 2.870 10.208 1.00 0.64 C ATOM 350 O LEU A 24 -12.721 3.817 9.704 1.00 0.65 O ATOM 351 CB LEU A 24 -9.722 2.435 9.890 1.00 0.67 C ATOM 352 CG LEU A 24 -9.101 3.367 8.835 1.00 0.84 C ATOM 353 CD1 LEU A 24 -10.144 3.886 7.854 1.00 1.49 C ATOM 354 CD2 LEU A 24 -8.376 4.524 9.508 1.00 1.30 C ATOM 0 H LEU A 24 -10.173 1.501 12.114 1.00 0.65 H new ATOM 0 HA LEU A 24 -10.539 4.098 10.953 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -8.916 2.030 10.501 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -10.182 1.594 9.371 1.00 0.67 H new ATOM 0 HG LEU A 24 -8.379 2.783 8.264 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -9.665 4.540 7.126 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -10.607 3.046 7.337 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -10.907 4.444 8.396 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -7.943 5.174 8.747 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -9.082 5.094 10.112 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -7.583 4.134 10.147 1.00 1.30 H new ATOM 366 N LEU A 25 -12.648 1.654 10.299 1.00 0.68 N ATOM 367 CA LEU A 25 -13.947 1.315 9.740 1.00 0.75 C ATOM 368 C LEU A 25 -15.056 2.049 10.484 1.00 0.74 C ATOM 369 O LEU A 25 -16.170 2.186 9.985 1.00 0.82 O ATOM 370 CB LEU A 25 -14.161 -0.197 9.825 1.00 0.85 C ATOM 371 CG LEU A 25 -14.661 -0.863 8.543 1.00 0.92 C ATOM 372 CD1 LEU A 25 -16.092 -0.449 8.238 1.00 1.63 C ATOM 373 CD2 LEU A 25 -13.745 -0.508 7.382 1.00 1.69 C ATOM 0 H LEU A 25 -12.178 0.876 10.762 1.00 0.68 H new ATOM 0 HA LEU A 25 -13.976 1.623 8.695 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -13.219 -0.664 10.113 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -14.875 -0.401 10.623 1.00 0.85 H new ATOM 0 HG LEU A 25 -14.648 -1.943 8.687 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -16.424 -0.936 7.321 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -16.740 -0.746 9.062 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -16.139 0.633 8.111 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -14.108 -0.986 6.472 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -13.735 0.573 7.244 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -12.734 -0.856 7.596 1.00 1.69 H new ATOM 385 N ASP A 26 -14.736 2.543 11.672 1.00 0.71 N ATOM 386 CA ASP A 26 -15.697 3.286 12.472 1.00 0.75 C ATOM 387 C ASP A 26 -15.527 4.755 12.200 1.00 0.70 C ATOM 388 O ASP A 26 -16.492 5.497 12.012 1.00 0.76 O ATOM 389 CB ASP A 26 -15.479 3.028 13.947 1.00 0.81 C ATOM 390 CG ASP A 26 -16.532 3.695 14.811 1.00 1.01 C ATOM 391 OD1 ASP A 26 -17.609 3.089 15.016 1.00 1.13 O ATOM 392 OD2 ASP A 26 -16.282 4.817 15.300 1.00 1.23 O ATOM 0 H ASP A 26 -13.817 2.442 12.103 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.703 2.962 12.205 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -15.489 1.954 14.131 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -14.493 3.392 14.235 1.00 0.81 H new ATOM 397 N ALA A 27 -14.270 5.155 12.150 1.00 0.63 N ATOM 398 CA ALA A 27 -13.911 6.530 11.873 1.00 0.61 C ATOM 399 C ALA A 27 -14.433 6.926 10.506 1.00 0.58 C ATOM 400 O ALA A 27 -15.010 7.995 10.320 1.00 0.62 O ATOM 401 CB ALA A 27 -12.402 6.679 11.925 1.00 0.61 C ATOM 0 H ALA A 27 -13.473 4.537 12.300 1.00 0.63 H new ATOM 0 HA ALA A 27 -14.357 7.184 12.622 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -12.131 7.714 11.716 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -12.043 6.403 12.916 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.946 6.027 11.179 1.00 0.61 H new ATOM 407 N ILE A 28 -14.254 6.014 9.567 1.00 0.56 N ATOM 408 CA ILE A 28 -14.626 6.219 8.183 1.00 0.57 C ATOM 409 C ILE A 28 -16.145 6.363 8.032 1.00 0.64 C ATOM 410 O ILE A 28 -16.627 7.011 7.102 1.00 0.71 O ATOM 411 CB ILE A 28 -14.088 5.044 7.339 1.00 0.61 C ATOM 412 CG1 ILE A 28 -13.904 5.430 5.879 1.00 0.84 C ATOM 413 CG2 ILE A 28 -14.995 3.824 7.444 1.00 1.02 C ATOM 414 CD1 ILE A 28 -13.028 4.441 5.151 1.00 0.85 C ATOM 0 H ILE A 28 -13.841 5.099 9.749 1.00 0.56 H new ATOM 0 HA ILE A 28 -14.183 7.149 7.826 1.00 0.57 H new ATOM 0 HB ILE A 28 -13.110 4.789 7.748 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -14.877 5.484 5.391 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -13.461 6.424 5.818 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -14.588 3.015 6.838 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -15.055 3.504 8.484 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -15.992 4.080 7.085 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -12.919 4.749 4.111 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -12.047 4.407 5.624 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -13.485 3.452 5.191 1.00 0.85 H new ATOM 426 N ARG A 29 -16.897 5.781 8.965 1.00 0.70 N ATOM 427 CA ARG A 29 -18.351 5.909 8.975 1.00 0.82 C ATOM 428 C ARG A 29 -18.741 7.356 9.228 1.00 0.86 C ATOM 429 O ARG A 29 -19.678 7.878 8.633 1.00 1.07 O ATOM 430 CB ARG A 29 -18.966 5.022 10.070 1.00 0.99 C ATOM 431 CG ARG A 29 -18.860 3.531 9.800 1.00 1.06 C ATOM 432 CD ARG A 29 -19.873 3.076 8.764 1.00 1.06 C ATOM 433 NE ARG A 29 -21.242 3.157 9.271 1.00 1.62 N ATOM 434 CZ ARG A 29 -22.310 2.689 8.628 1.00 2.19 C ATOM 435 NH1 ARG A 29 -22.175 2.074 7.458 1.00 2.49 N ATOM 436 NH2 ARG A 29 -23.510 2.821 9.168 1.00 3.04 N ATOM 0 H ARG A 29 -16.521 5.215 9.725 1.00 0.70 H new ATOM 0 HA ARG A 29 -18.729 5.589 8.004 1.00 0.82 H new ATOM 0 HB2 ARG A 29 -18.476 5.243 11.018 1.00 0.99 H new ATOM 0 HB3 ARG A 29 -20.018 5.284 10.186 1.00 0.99 H new ATOM 0 HG2 ARG A 29 -17.854 3.294 9.454 1.00 1.06 H new ATOM 0 HG3 ARG A 29 -19.016 2.981 10.728 1.00 1.06 H new ATOM 0 HD2 ARG A 29 -19.780 3.692 7.869 1.00 1.06 H new ATOM 0 HD3 ARG A 29 -19.655 2.050 8.469 1.00 1.06 H new ATOM 0 HE ARG A 29 -21.389 3.601 10.177 1.00 1.62 H new ATOM 0 HH11 ARG A 29 -21.249 1.958 7.047 1.00 2.49 H new ATOM 0 HH12 ARG A 29 -22.998 1.718 6.971 1.00 2.49 H new ATOM 0 HH21 ARG A 29 -23.614 3.280 10.073 1.00 3.04 H new ATOM 0 HH22 ARG A 29 -24.331 2.464 8.679 1.00 3.04 H new ATOM 450 N HIS A 30 -17.970 8.002 10.086 1.00 0.83 N ATOM 451 CA HIS A 30 -18.291 9.335 10.576 1.00 0.98 C ATOM 452 C HIS A 30 -17.431 10.391 9.896 1.00 0.95 C ATOM 453 O HIS A 30 -17.221 11.482 10.423 1.00 1.10 O ATOM 454 CB HIS A 30 -18.034 9.363 12.064 1.00 1.15 C ATOM 455 CG HIS A 30 -18.713 10.460 12.816 1.00 1.60 C ATOM 456 ND1 HIS A 30 -18.436 10.761 14.134 1.00 2.04 N ATOM 457 CD2 HIS A 30 -19.665 11.321 12.428 1.00 2.10 C ATOM 458 CE1 HIS A 30 -19.199 11.764 14.520 1.00 2.61 C ATOM 459 NE2 HIS A 30 -19.958 12.126 13.504 1.00 2.65 N ATOM 0 H HIS A 30 -17.103 7.619 10.464 1.00 0.83 H new ATOM 0 HA HIS A 30 -19.335 9.557 10.355 1.00 0.98 H new ATOM 0 HB2 HIS A 30 -18.348 8.409 12.487 1.00 1.15 H new ATOM 0 HB3 HIS A 30 -16.960 9.446 12.227 1.00 1.15 H new ATOM 0 HD2 HIS A 30 -20.119 11.373 11.449 1.00 2.10 H new ATOM 0 HE1 HIS A 30 -19.202 12.213 15.502 1.00 2.61 H new ATOM 0 HE2 HIS A 30 -20.647 12.878 13.514 1.00 2.65 H new ATOM 468 N SER A 31 -16.937 10.050 8.739 1.00 0.82 N ATOM 469 CA SER A 31 -16.054 10.943 7.997 1.00 0.84 C ATOM 470 C SER A 31 -16.710 11.477 6.722 1.00 1.00 C ATOM 471 O SER A 31 -16.301 12.515 6.201 1.00 1.38 O ATOM 472 CB SER A 31 -14.737 10.237 7.661 1.00 0.78 C ATOM 473 OG SER A 31 -14.046 9.857 8.840 1.00 1.46 O ATOM 0 H SER A 31 -17.124 9.160 8.278 1.00 0.82 H new ATOM 0 HA SER A 31 -15.848 11.799 8.640 1.00 0.84 H new ATOM 0 HB2 SER A 31 -14.938 9.355 7.054 1.00 0.78 H new ATOM 0 HB3 SER A 31 -14.108 10.898 7.064 1.00 0.78 H new ATOM 0 HG SER A 31 -14.605 9.247 9.365 1.00 1.46 H new ATOM 479 N LYS A 32 -17.738 10.790 6.232 1.00 0.91 N ATOM 480 CA LYS A 32 -18.398 11.202 4.996 1.00 1.09 C ATOM 481 C LYS A 32 -19.705 10.440 4.797 1.00 1.10 C ATOM 482 O LYS A 32 -20.087 9.614 5.631 1.00 1.37 O ATOM 483 CB LYS A 32 -17.490 10.979 3.776 1.00 1.39 C ATOM 484 CG LYS A 32 -17.390 9.524 3.354 1.00 1.56 C ATOM 485 CD LYS A 32 -16.465 8.723 4.248 1.00 2.24 C ATOM 486 CE LYS A 32 -16.778 7.245 4.151 1.00 3.10 C ATOM 487 NZ LYS A 32 -18.159 6.943 4.630 1.00 3.92 N ATOM 0 H LYS A 32 -18.129 9.954 6.666 1.00 0.91 H new ATOM 0 HA LYS A 32 -18.612 12.267 5.085 1.00 1.09 H new ATOM 0 HB2 LYS A 32 -17.868 11.567 2.939 1.00 1.39 H new ATOM 0 HB3 LYS A 32 -16.492 11.353 4.003 1.00 1.39 H new ATOM 0 HG2 LYS A 32 -18.383 9.075 3.369 1.00 1.56 H new ATOM 0 HG3 LYS A 32 -17.032 9.471 2.326 1.00 1.56 H new ATOM 0 HD2 LYS A 32 -15.429 8.900 3.960 1.00 2.24 H new ATOM 0 HD3 LYS A 32 -16.570 9.056 5.281 1.00 2.24 H new ATOM 0 HE2 LYS A 32 -16.671 6.917 3.117 1.00 3.10 H new ATOM 0 HE3 LYS A 32 -16.056 6.680 4.741 1.00 3.10 H new ATOM 0 HZ1 LYS A 32 -18.190 5.977 5.014 1.00 3.92 H new ATOM 0 HZ2 LYS A 32 -18.424 7.620 5.374 1.00 3.92 H new ATOM 0 HZ3 LYS A 32 -18.827 7.022 3.836 1.00 3.92 H new ATOM 501 N VAL A 33 -20.353 10.692 3.664 1.00 1.17 N ATOM 502 CA VAL A 33 -21.638 10.086 3.337 1.00 1.39 C ATOM 503 C VAL A 33 -21.518 8.572 3.131 1.00 1.51 C ATOM 504 O VAL A 33 -20.450 8.051 2.776 1.00 2.31 O ATOM 505 CB VAL A 33 -22.237 10.725 2.057 1.00 2.16 C ATOM 506 CG1 VAL A 33 -23.686 10.307 1.853 1.00 3.10 C ATOM 507 CG2 VAL A 33 -22.119 12.241 2.100 1.00 3.06 C ATOM 0 H VAL A 33 -20.000 11.324 2.945 1.00 1.17 H new ATOM 0 HA VAL A 33 -22.299 10.270 4.184 1.00 1.39 H new ATOM 0 HB VAL A 33 -21.660 10.359 1.207 1.00 2.16 H new ATOM 0 HG11 VAL A 33 -24.075 10.773 0.947 1.00 3.10 H new ATOM 0 HG12 VAL A 33 -23.742 9.223 1.756 1.00 3.10 H new ATOM 0 HG13 VAL A 33 -24.281 10.626 2.709 1.00 3.10 H new ATOM 0 HG21 VAL A 33 -22.546 12.665 1.191 1.00 3.06 H new ATOM 0 HG22 VAL A 33 -22.658 12.623 2.967 1.00 3.06 H new ATOM 0 HG23 VAL A 33 -21.068 12.522 2.173 1.00 3.06 H new ATOM 517 N THR A 34 -22.604 7.871 3.419 1.00 1.46 N ATOM 518 CA THR A 34 -22.737 6.459 3.109 1.00 1.91 C ATOM 519 C THR A 34 -24.214 6.088 3.064 1.00 2.50 C ATOM 520 O THR A 34 -25.067 6.872 3.487 1.00 2.78 O ATOM 521 CB THR A 34 -21.988 5.577 4.131 1.00 1.83 C ATOM 522 OG1 THR A 34 -22.188 4.187 3.849 1.00 2.42 O ATOM 523 CG2 THR A 34 -22.433 5.878 5.558 1.00 1.73 C ATOM 0 H THR A 34 -23.423 8.271 3.878 1.00 1.46 H new ATOM 0 HA THR A 34 -22.285 6.277 2.134 1.00 1.91 H new ATOM 0 HB THR A 34 -20.927 5.810 4.042 1.00 1.83 H new ATOM 0 HG1 THR A 34 -21.503 3.658 4.309 1.00 2.42 H new ATOM 0 HG21 THR A 34 -21.886 5.240 6.252 1.00 1.73 H new ATOM 0 HG22 THR A 34 -22.230 6.924 5.790 1.00 1.73 H new ATOM 0 HG23 THR A 34 -23.502 5.686 5.654 1.00 1.73 H new ATOM 531 N GLU A 35 -24.512 4.906 2.555 1.00 3.15 N ATOM 532 CA GLU A 35 -25.890 4.442 2.467 1.00 3.98 C ATOM 533 C GLU A 35 -26.141 3.320 3.470 1.00 4.05 C ATOM 534 O GLU A 35 -25.278 3.004 4.294 1.00 4.33 O ATOM 535 CB GLU A 35 -26.229 3.986 1.045 1.00 4.75 C ATOM 536 CG GLU A 35 -26.156 5.109 0.021 1.00 5.08 C ATOM 537 CD GLU A 35 -27.071 4.886 -1.166 1.00 5.84 C ATOM 538 OE1 GLU A 35 -28.260 5.259 -1.100 1.00 6.34 O ATOM 539 OE2 GLU A 35 -26.605 4.315 -2.177 1.00 6.16 O ATOM 0 H GLU A 35 -23.820 4.248 2.196 1.00 3.15 H new ATOM 0 HA GLU A 35 -26.545 5.278 2.714 1.00 3.98 H new ATOM 0 HB2 GLU A 35 -25.543 3.191 0.752 1.00 4.75 H new ATOM 0 HB3 GLU A 35 -27.232 3.560 1.037 1.00 4.75 H new ATOM 0 HG2 GLU A 35 -26.418 6.051 0.503 1.00 5.08 H new ATOM 0 HG3 GLU A 35 -25.129 5.206 -0.332 1.00 5.08 H new ATOM 546 N GLN A 36 -27.322 2.718 3.390 1.00 4.07 N ATOM 547 CA GLN A 36 -27.768 1.754 4.393 1.00 4.38 C ATOM 548 C GLN A 36 -27.142 0.372 4.194 1.00 4.02 C ATOM 549 O GLN A 36 -27.820 -0.597 3.843 1.00 4.41 O ATOM 550 CB GLN A 36 -29.295 1.661 4.388 1.00 5.16 C ATOM 551 CG GLN A 36 -29.973 2.979 4.728 1.00 5.59 C ATOM 552 CD GLN A 36 -31.485 2.898 4.701 1.00 6.26 C ATOM 553 OE1 GLN A 36 -32.111 3.119 3.664 1.00 6.59 O ATOM 554 NE2 GLN A 36 -32.084 2.598 5.844 1.00 6.79 N ATOM 0 H GLN A 36 -27.992 2.880 2.638 1.00 4.07 H new ATOM 0 HA GLN A 36 -27.432 2.115 5.365 1.00 4.38 H new ATOM 0 HB2 GLN A 36 -29.630 1.330 3.405 1.00 5.16 H new ATOM 0 HB3 GLN A 36 -29.609 0.902 5.104 1.00 5.16 H new ATOM 0 HG2 GLN A 36 -29.651 3.301 5.718 1.00 5.59 H new ATOM 0 HG3 GLN A 36 -29.644 3.742 4.022 1.00 5.59 H new ATOM 0 HE21 GLN A 36 -31.528 2.422 6.681 1.00 6.79 H new ATOM 0 HE22 GLN A 36 -33.102 2.543 5.887 1.00 6.79 H new ATOM 563 N GLU A 37 -25.841 0.298 4.419 1.00 3.65 N ATOM 564 CA GLU A 37 -25.132 -0.970 4.438 1.00 3.72 C ATOM 565 C GLU A 37 -24.567 -1.205 5.836 1.00 3.46 C ATOM 566 O GLU A 37 -23.766 -0.405 6.331 1.00 3.48 O ATOM 567 CB GLU A 37 -24.006 -0.983 3.402 1.00 4.27 C ATOM 568 CG GLU A 37 -23.320 -2.335 3.254 1.00 4.95 C ATOM 569 CD GLU A 37 -24.212 -3.382 2.610 1.00 5.60 C ATOM 570 OE1 GLU A 37 -25.201 -3.805 3.251 1.00 5.76 O ATOM 571 OE2 GLU A 37 -23.931 -3.792 1.465 1.00 6.24 O ATOM 0 H GLU A 37 -25.249 1.110 4.593 1.00 3.65 H new ATOM 0 HA GLU A 37 -25.828 -1.770 4.184 1.00 3.72 H new ATOM 0 HB2 GLU A 37 -24.411 -0.684 2.435 1.00 4.27 H new ATOM 0 HB3 GLU A 37 -23.261 -0.237 3.680 1.00 4.27 H new ATOM 0 HG2 GLU A 37 -22.417 -2.215 2.655 1.00 4.95 H new ATOM 0 HG3 GLU A 37 -23.006 -2.687 4.237 1.00 4.95 H new ATOM 578 N ALA A 38 -25.010 -2.277 6.477 1.00 3.77 N ATOM 579 CA ALA A 38 -24.580 -2.597 7.830 1.00 4.17 C ATOM 580 C ALA A 38 -23.176 -3.186 7.838 1.00 4.07 C ATOM 581 O ALA A 38 -22.993 -4.388 7.631 1.00 4.46 O ATOM 582 CB ALA A 38 -25.563 -3.557 8.482 1.00 4.95 C ATOM 0 H ALA A 38 -25.671 -2.944 6.078 1.00 3.77 H new ATOM 0 HA ALA A 38 -24.557 -1.671 8.405 1.00 4.17 H new ATOM 0 HB1 ALA A 38 -25.229 -3.788 9.494 1.00 4.95 H new ATOM 0 HB2 ALA A 38 -26.550 -3.096 8.522 1.00 4.95 H new ATOM 0 HB3 ALA A 38 -25.615 -4.476 7.898 1.00 4.95 H new ATOM 588 N GLY A 39 -22.192 -2.331 8.076 1.00 4.00 N ATOM 589 CA GLY A 39 -20.811 -2.777 8.119 1.00 4.22 C ATOM 590 C GLY A 39 -20.314 -2.957 9.538 1.00 4.22 C ATOM 591 O GLY A 39 -19.186 -3.392 9.760 1.00 4.68 O ATOM 0 H GLY A 39 -22.324 -1.333 8.241 1.00 4.00 H new ATOM 0 HA2 GLY A 39 -20.718 -3.720 7.581 1.00 4.22 H new ATOM 0 HA3 GLY A 39 -20.180 -2.052 7.604 1.00 4.22 H new ATOM 595 N GLY A 40 -21.161 -2.605 10.492 1.00 4.14 N ATOM 596 CA GLY A 40 -20.822 -2.752 11.890 1.00 4.55 C ATOM 597 C GLY A 40 -22.060 -2.906 12.744 1.00 4.28 C ATOM 598 O GLY A 40 -22.592 -1.922 13.255 1.00 4.37 O ATOM 0 H GLY A 40 -22.088 -2.216 10.319 1.00 4.14 H new ATOM 0 HA2 GLY A 40 -20.178 -3.621 12.020 1.00 4.55 H new ATOM 0 HA3 GLY A 40 -20.255 -1.882 12.222 1.00 4.55 H new ATOM 602 N ILE A 41 -22.537 -4.135 12.868 1.00 4.35 N ATOM 603 CA ILE A 41 -23.748 -4.414 13.632 1.00 4.40 C ATOM 604 C ILE A 41 -23.435 -5.308 14.832 1.00 4.54 C ATOM 605 O ILE A 41 -22.797 -6.354 14.689 1.00 5.04 O ATOM 606 CB ILE A 41 -24.842 -5.063 12.743 1.00 4.99 C ATOM 607 CG1 ILE A 41 -26.065 -5.461 13.575 1.00 5.27 C ATOM 608 CG2 ILE A 41 -24.292 -6.265 11.991 1.00 5.57 C ATOM 609 CD1 ILE A 41 -26.758 -4.294 14.247 1.00 5.56 C ATOM 0 H ILE A 41 -22.104 -4.958 12.449 1.00 4.35 H new ATOM 0 HA ILE A 41 -24.135 -3.463 13.997 1.00 4.40 H new ATOM 0 HB ILE A 41 -25.158 -4.319 12.011 1.00 4.99 H new ATOM 0 HG12 ILE A 41 -26.780 -5.973 12.930 1.00 5.27 H new ATOM 0 HG13 ILE A 41 -25.756 -6.175 14.338 1.00 5.27 H new ATOM 0 HG21 ILE A 41 -25.079 -6.701 11.376 1.00 5.57 H new ATOM 0 HG22 ILE A 41 -23.466 -5.949 11.353 1.00 5.57 H new ATOM 0 HG23 ILE A 41 -23.935 -7.008 12.704 1.00 5.57 H new ATOM 0 HD11 ILE A 41 -27.613 -4.658 14.817 1.00 5.56 H new ATOM 0 HD12 ILE A 41 -26.060 -3.795 14.919 1.00 5.56 H new ATOM 0 HD13 ILE A 41 -27.100 -3.589 13.490 1.00 5.56 H new ATOM 621 N THR A 42 -23.879 -4.871 16.010 1.00 4.43 N ATOM 622 CA THR A 42 -23.642 -5.576 17.263 1.00 4.86 C ATOM 623 C THR A 42 -22.152 -5.549 17.624 1.00 4.64 C ATOM 624 O THR A 42 -21.715 -4.768 18.470 1.00 4.68 O ATOM 625 CB THR A 42 -24.131 -7.036 17.178 1.00 5.21 C ATOM 626 OG1 THR A 42 -25.485 -7.079 16.701 1.00 5.55 O ATOM 627 CG2 THR A 42 -24.042 -7.731 18.529 1.00 5.93 C ATOM 0 H THR A 42 -24.417 -4.011 16.119 1.00 4.43 H new ATOM 0 HA THR A 42 -24.207 -5.065 18.043 1.00 4.86 H new ATOM 0 HB THR A 42 -23.482 -7.563 16.479 1.00 5.21 H new ATOM 0 HG1 THR A 42 -25.784 -8.011 16.649 1.00 5.55 H new ATOM 0 HG21 THR A 42 -24.394 -8.758 18.434 1.00 5.93 H new ATOM 0 HG22 THR A 42 -23.007 -7.733 18.870 1.00 5.93 H new ATOM 0 HG23 THR A 42 -24.661 -7.201 19.252 1.00 5.93 H new ATOM 635 N GLN A 43 -21.387 -6.400 16.958 1.00 4.73 N ATOM 636 CA GLN A 43 -19.943 -6.450 17.115 1.00 4.79 C ATOM 637 C GLN A 43 -19.334 -7.037 15.840 1.00 4.45 C ATOM 638 O GLN A 43 -18.149 -7.351 15.773 1.00 4.74 O ATOM 639 CB GLN A 43 -19.577 -7.277 18.353 1.00 5.52 C ATOM 640 CG GLN A 43 -18.094 -7.278 18.687 1.00 5.96 C ATOM 641 CD GLN A 43 -17.808 -7.828 20.068 1.00 6.23 C ATOM 642 OE1 GLN A 43 -18.614 -7.681 20.988 1.00 6.39 O ATOM 643 NE2 GLN A 43 -16.666 -8.472 20.222 1.00 6.63 N ATOM 0 H GLN A 43 -21.753 -7.079 16.290 1.00 4.73 H new ATOM 0 HA GLN A 43 -19.541 -5.448 17.266 1.00 4.79 H new ATOM 0 HB2 GLN A 43 -20.130 -6.892 19.210 1.00 5.52 H new ATOM 0 HB3 GLN A 43 -19.904 -8.305 18.198 1.00 5.52 H new ATOM 0 HG2 GLN A 43 -17.559 -7.872 17.946 1.00 5.96 H new ATOM 0 HG3 GLN A 43 -17.709 -6.260 18.619 1.00 5.96 H new ATOM 0 HE21 GLN A 43 -16.026 -8.571 19.434 1.00 6.63 H new ATOM 0 HE22 GLN A 43 -16.423 -8.870 21.129 1.00 6.63 H new ATOM 652 N HIS A 44 -20.167 -7.154 14.815 1.00 4.15 N ATOM 653 CA HIS A 44 -19.739 -7.699 13.535 1.00 4.05 C ATOM 654 C HIS A 44 -19.243 -6.588 12.632 1.00 3.55 C ATOM 655 O HIS A 44 -20.035 -5.844 12.055 1.00 3.72 O ATOM 656 CB HIS A 44 -20.883 -8.454 12.854 1.00 4.61 C ATOM 657 CG HIS A 44 -21.157 -9.796 13.457 1.00 5.23 C ATOM 658 ND1 HIS A 44 -20.592 -10.959 12.982 1.00 5.76 N ATOM 659 CD2 HIS A 44 -21.938 -10.158 14.498 1.00 5.72 C ATOM 660 CE1 HIS A 44 -21.013 -11.977 13.705 1.00 6.54 C ATOM 661 NE2 HIS A 44 -21.832 -11.520 14.635 1.00 6.49 N ATOM 0 H HIS A 44 -21.148 -6.877 14.846 1.00 4.15 H new ATOM 0 HA HIS A 44 -18.925 -8.400 13.719 1.00 4.05 H new ATOM 0 HB2 HIS A 44 -21.788 -7.849 12.907 1.00 4.61 H new ATOM 0 HB3 HIS A 44 -20.646 -8.581 11.798 1.00 4.61 H new ATOM 0 HD2 HIS A 44 -22.535 -9.498 15.110 1.00 5.72 H new ATOM 0 HE1 HIS A 44 -20.735 -13.011 13.561 1.00 6.54 H new ATOM 0 HE2 HIS A 44 -22.307 -12.085 15.339 1.00 6.49 H new ATOM 670 N ILE A 45 -17.931 -6.473 12.539 1.00 3.31 N ATOM 671 CA ILE A 45 -17.302 -5.464 11.714 1.00 3.06 C ATOM 672 C ILE A 45 -16.929 -6.031 10.349 1.00 2.33 C ATOM 673 O ILE A 45 -17.284 -7.164 10.014 1.00 2.50 O ATOM 674 CB ILE A 45 -16.030 -4.924 12.390 1.00 3.87 C ATOM 675 CG1 ILE A 45 -15.043 -6.067 12.659 1.00 4.51 C ATOM 676 CG2 ILE A 45 -16.382 -4.197 13.680 1.00 4.43 C ATOM 677 CD1 ILE A 45 -13.687 -5.592 13.130 1.00 5.17 C ATOM 0 H ILE A 45 -17.274 -7.077 13.033 1.00 3.31 H new ATOM 0 HA ILE A 45 -18.020 -4.654 11.585 1.00 3.06 H new ATOM 0 HB ILE A 45 -15.552 -4.211 11.718 1.00 3.87 H new ATOM 0 HG12 ILE A 45 -15.467 -6.734 13.410 1.00 4.51 H new ATOM 0 HG13 ILE A 45 -14.918 -6.651 11.747 1.00 4.51 H new ATOM 0 HG21 ILE A 45 -15.471 -3.821 14.146 1.00 4.43 H new ATOM 0 HG22 ILE A 45 -17.047 -3.362 13.458 1.00 4.43 H new ATOM 0 HG23 ILE A 45 -16.880 -4.886 14.362 1.00 4.43 H new ATOM 0 HD11 ILE A 45 -13.039 -6.452 13.301 1.00 5.17 H new ATOM 0 HD12 ILE A 45 -13.243 -4.949 12.370 1.00 5.17 H new ATOM 0 HD13 ILE A 45 -13.800 -5.032 14.059 1.00 5.17 H new ATOM 689 N GLY A 46 -16.210 -5.235 9.573 1.00 2.18 N ATOM 690 CA GLY A 46 -15.777 -5.660 8.264 1.00 2.10 C ATOM 691 C GLY A 46 -15.601 -4.488 7.329 1.00 1.86 C ATOM 692 O GLY A 46 -14.502 -3.942 7.212 1.00 2.51 O ATOM 0 H GLY A 46 -15.917 -4.293 9.833 1.00 2.18 H new ATOM 0 HA2 GLY A 46 -14.835 -6.202 8.350 1.00 2.10 H new ATOM 0 HA3 GLY A 46 -16.507 -6.353 7.846 1.00 2.10 H new ATOM 696 N ALA A 47 -16.694 -4.097 6.686 1.00 1.36 N ATOM 697 CA ALA A 47 -16.705 -2.975 5.759 1.00 1.12 C ATOM 698 C ALA A 47 -18.117 -2.746 5.253 1.00 1.01 C ATOM 699 O ALA A 47 -19.059 -3.363 5.741 1.00 1.17 O ATOM 700 CB ALA A 47 -15.759 -3.216 4.602 1.00 1.29 C ATOM 0 H ALA A 47 -17.601 -4.552 6.794 1.00 1.36 H new ATOM 0 HA ALA A 47 -16.364 -2.084 6.286 1.00 1.12 H new ATOM 0 HB1 ALA A 47 -15.787 -2.362 3.925 1.00 1.29 H new ATOM 0 HB2 ALA A 47 -14.745 -3.345 4.982 1.00 1.29 H new ATOM 0 HB3 ALA A 47 -16.062 -4.115 4.065 1.00 1.29 H new ATOM 706 N TYR A 48 -18.256 -1.888 4.253 1.00 0.85 N ATOM 707 CA TYR A 48 -19.559 -1.422 3.809 1.00 0.89 C ATOM 708 C TYR A 48 -19.406 -0.617 2.527 1.00 0.81 C ATOM 709 O TYR A 48 -18.298 -0.482 2.001 1.00 0.73 O ATOM 710 CB TYR A 48 -20.210 -0.555 4.893 1.00 0.97 C ATOM 711 CG TYR A 48 -19.507 0.766 5.098 1.00 0.94 C ATOM 712 CD1 TYR A 48 -18.282 0.831 5.740 1.00 0.92 C ATOM 713 CD2 TYR A 48 -20.071 1.942 4.639 1.00 1.20 C ATOM 714 CE1 TYR A 48 -17.635 2.037 5.913 1.00 1.15 C ATOM 715 CE2 TYR A 48 -19.433 3.152 4.807 1.00 1.40 C ATOM 716 CZ TYR A 48 -18.217 3.195 5.445 1.00 1.37 C ATOM 717 OH TYR A 48 -17.577 4.402 5.605 1.00 1.70 O ATOM 0 H TYR A 48 -17.472 -1.498 3.730 1.00 0.85 H new ATOM 0 HA TYR A 48 -20.197 -2.285 3.619 1.00 0.89 H new ATOM 0 HB2 TYR A 48 -21.250 -0.368 4.624 1.00 0.97 H new ATOM 0 HB3 TYR A 48 -20.218 -1.105 5.834 1.00 0.97 H new ATOM 0 HD1 TYR A 48 -17.827 -0.075 6.111 1.00 0.92 H new ATOM 0 HD2 TYR A 48 -21.028 1.912 4.140 1.00 1.20 H new ATOM 0 HE1 TYR A 48 -16.678 2.073 6.412 1.00 1.15 H new ATOM 0 HE2 TYR A 48 -19.886 4.061 4.439 1.00 1.40 H new ATOM 0 HH TYR A 48 -16.887 4.500 4.917 1.00 1.70 H new ATOM 727 N GLN A 49 -20.511 -0.072 2.038 1.00 0.91 N ATOM 728 CA GLN A 49 -20.506 0.719 0.819 1.00 0.89 C ATOM 729 C GLN A 49 -20.206 2.181 1.134 1.00 0.90 C ATOM 730 O GLN A 49 -21.005 2.862 1.782 1.00 1.02 O ATOM 731 CB GLN A 49 -21.859 0.615 0.124 1.00 1.02 C ATOM 732 CG GLN A 49 -22.311 -0.810 -0.122 1.00 1.09 C ATOM 733 CD GLN A 49 -23.690 -0.874 -0.747 1.00 1.45 C ATOM 734 OE1 GLN A 49 -24.087 0.018 -1.490 1.00 1.87 O ATOM 735 NE2 GLN A 49 -24.432 -1.921 -0.439 1.00 1.91 N ATOM 0 H GLN A 49 -21.429 -0.165 2.472 1.00 0.91 H new ATOM 0 HA GLN A 49 -19.729 0.332 0.159 1.00 0.89 H new ATOM 0 HB2 GLN A 49 -22.608 1.125 0.730 1.00 1.02 H new ATOM 0 HB3 GLN A 49 -21.809 1.140 -0.830 1.00 1.02 H new ATOM 0 HG2 GLN A 49 -21.595 -1.309 -0.775 1.00 1.09 H new ATOM 0 HG3 GLN A 49 -22.316 -1.356 0.822 1.00 1.09 H new ATOM 0 HE21 GLN A 49 -24.065 -2.641 0.183 1.00 1.91 H new ATOM 0 HE22 GLN A 49 -25.373 -2.010 -0.823 1.00 1.91 H new ATOM 744 N VAL A 50 -19.053 2.652 0.692 1.00 0.85 N ATOM 745 CA VAL A 50 -18.677 4.046 0.869 1.00 0.91 C ATOM 746 C VAL A 50 -19.425 4.913 -0.152 1.00 0.96 C ATOM 747 O VAL A 50 -20.048 4.388 -1.067 1.00 1.01 O ATOM 748 CB VAL A 50 -17.138 4.217 0.742 1.00 0.93 C ATOM 749 CG1 VAL A 50 -16.692 5.655 0.963 1.00 1.53 C ATOM 750 CG2 VAL A 50 -16.429 3.302 1.728 1.00 1.34 C ATOM 0 H VAL A 50 -18.357 2.087 0.205 1.00 0.85 H new ATOM 0 HA VAL A 50 -18.959 4.372 1.870 1.00 0.91 H new ATOM 0 HB VAL A 50 -16.868 3.945 -0.279 1.00 0.93 H new ATOM 0 HG11 VAL A 50 -15.608 5.719 0.863 1.00 1.53 H new ATOM 0 HG12 VAL A 50 -17.164 6.300 0.222 1.00 1.53 H new ATOM 0 HG13 VAL A 50 -16.984 5.977 1.963 1.00 1.53 H new ATOM 0 HG21 VAL A 50 -15.351 3.429 1.632 1.00 1.34 H new ATOM 0 HG22 VAL A 50 -16.735 3.555 2.743 1.00 1.34 H new ATOM 0 HG23 VAL A 50 -16.693 2.266 1.517 1.00 1.34 H new ATOM 760 N THR A 51 -19.386 6.222 0.029 1.00 1.09 N ATOM 761 CA THR A 51 -20.127 7.157 -0.783 1.00 1.16 C ATOM 762 C THR A 51 -19.405 8.501 -0.762 1.00 1.19 C ATOM 763 O THR A 51 -19.725 9.376 0.039 1.00 1.28 O ATOM 764 CB THR A 51 -21.565 7.323 -0.241 1.00 1.29 C ATOM 765 OG1 THR A 51 -22.198 6.039 -0.143 1.00 1.51 O ATOM 766 CG2 THR A 51 -22.393 8.228 -1.138 1.00 1.42 C ATOM 0 H THR A 51 -18.828 6.667 0.758 1.00 1.09 H new ATOM 0 HA THR A 51 -20.189 6.782 -1.805 1.00 1.16 H new ATOM 0 HB THR A 51 -21.502 7.783 0.745 1.00 1.29 H new ATOM 0 HG1 THR A 51 -23.152 6.158 0.048 1.00 1.51 H new ATOM 0 HG21 THR A 51 -23.399 8.324 -0.729 1.00 1.42 H new ATOM 0 HG22 THR A 51 -21.927 9.212 -1.191 1.00 1.42 H new ATOM 0 HG23 THR A 51 -22.448 7.798 -2.138 1.00 1.42 H new ATOM 774 N VAL A 52 -18.388 8.640 -1.611 1.00 1.36 N ATOM 775 CA VAL A 52 -17.650 9.898 -1.715 1.00 1.62 C ATOM 776 C VAL A 52 -18.575 10.985 -2.235 1.00 1.81 C ATOM 777 O VAL A 52 -18.820 11.992 -1.576 1.00 2.11 O ATOM 778 CB VAL A 52 -16.404 9.770 -2.636 1.00 1.88 C ATOM 779 CG1 VAL A 52 -16.747 9.067 -3.943 1.00 1.98 C ATOM 780 CG2 VAL A 52 -15.803 11.140 -2.921 1.00 2.27 C ATOM 0 H VAL A 52 -18.058 7.902 -2.233 1.00 1.36 H new ATOM 0 HA VAL A 52 -17.290 10.160 -0.720 1.00 1.62 H new ATOM 0 HB VAL A 52 -15.668 9.164 -2.108 1.00 1.88 H new ATOM 0 HG11 VAL A 52 -15.853 8.995 -4.563 1.00 1.98 H new ATOM 0 HG12 VAL A 52 -17.123 8.066 -3.730 1.00 1.98 H new ATOM 0 HG13 VAL A 52 -17.511 9.636 -4.473 1.00 1.98 H new ATOM 0 HG21 VAL A 52 -14.932 11.028 -3.567 1.00 2.27 H new ATOM 0 HG22 VAL A 52 -16.544 11.767 -3.417 1.00 2.27 H new ATOM 0 HG23 VAL A 52 -15.501 11.607 -1.984 1.00 2.27 H new ATOM 790 N ASN A 53 -19.086 10.748 -3.421 1.00 1.81 N ATOM 791 CA ASN A 53 -20.101 11.566 -4.008 1.00 1.99 C ATOM 792 C ASN A 53 -21.426 10.830 -3.904 1.00 1.80 C ATOM 793 O ASN A 53 -22.355 11.272 -3.227 1.00 1.82 O ATOM 794 CB ASN A 53 -19.740 11.887 -5.468 1.00 2.39 C ATOM 795 CG ASN A 53 -19.059 10.760 -6.221 1.00 3.10 C ATOM 796 OD1 ASN A 53 -19.234 9.575 -5.925 1.00 3.68 O ATOM 797 ND2 ASN A 53 -18.271 11.126 -7.212 1.00 3.42 N ATOM 0 H ASN A 53 -18.797 9.966 -4.008 1.00 1.81 H new ATOM 0 HA ASN A 53 -20.182 12.517 -3.481 1.00 1.99 H new ATOM 0 HB2 ASN A 53 -20.651 12.161 -6.000 1.00 2.39 H new ATOM 0 HB3 ASN A 53 -19.087 12.760 -5.482 1.00 2.39 H new ATOM 0 HD21 ASN A 53 -17.782 10.420 -7.762 1.00 3.42 H new ATOM 0 HD22 ASN A 53 -18.150 12.115 -7.429 1.00 3.42 H new ATOM 804 N ASP A 54 -21.474 9.692 -4.573 1.00 1.81 N ATOM 805 CA ASP A 54 -22.553 8.727 -4.421 1.00 1.82 C ATOM 806 C ASP A 54 -22.172 7.426 -5.113 1.00 2.08 C ATOM 807 O ASP A 54 -22.985 6.783 -5.774 1.00 2.23 O ATOM 808 CB ASP A 54 -23.884 9.273 -4.952 1.00 2.01 C ATOM 809 CG ASP A 54 -23.928 9.435 -6.461 1.00 2.47 C ATOM 810 OD1 ASP A 54 -23.167 10.262 -7.001 1.00 2.99 O ATOM 811 OD2 ASP A 54 -24.740 8.740 -7.107 1.00 2.69 O ATOM 0 H ASP A 54 -20.760 9.407 -5.243 1.00 1.81 H new ATOM 0 HA ASP A 54 -22.698 8.534 -3.358 1.00 1.82 H new ATOM 0 HB2 ASP A 54 -24.688 8.603 -4.645 1.00 2.01 H new ATOM 0 HB3 ASP A 54 -24.080 10.239 -4.487 1.00 2.01 H new ATOM 816 N LYS A 55 -20.929 7.014 -4.918 1.00 2.27 N ATOM 817 CA LYS A 55 -20.418 5.821 -5.570 1.00 2.75 C ATOM 818 C LYS A 55 -20.188 4.756 -4.524 1.00 1.92 C ATOM 819 O LYS A 55 -19.467 4.992 -3.561 1.00 2.45 O ATOM 820 CB LYS A 55 -19.115 6.116 -6.324 1.00 4.02 C ATOM 821 CG LYS A 55 -18.419 4.868 -6.856 1.00 5.04 C ATOM 822 CD LYS A 55 -17.120 5.206 -7.570 1.00 5.92 C ATOM 823 CE LYS A 55 -17.366 5.850 -8.927 1.00 6.66 C ATOM 824 NZ LYS A 55 -17.687 4.848 -9.981 1.00 7.36 N ATOM 0 H LYS A 55 -20.257 7.488 -4.314 1.00 2.27 H new ATOM 0 HA LYS A 55 -21.149 5.474 -6.301 1.00 2.75 H new ATOM 0 HB2 LYS A 55 -19.331 6.784 -7.158 1.00 4.02 H new ATOM 0 HB3 LYS A 55 -18.433 6.646 -5.659 1.00 4.02 H new ATOM 0 HG2 LYS A 55 -18.213 4.187 -6.030 1.00 5.04 H new ATOM 0 HG3 LYS A 55 -19.085 4.345 -7.542 1.00 5.04 H new ATOM 0 HD2 LYS A 55 -16.531 5.881 -6.950 1.00 5.92 H new ATOM 0 HD3 LYS A 55 -16.531 4.298 -7.701 1.00 5.92 H new ATOM 0 HE2 LYS A 55 -18.187 6.562 -8.845 1.00 6.66 H new ATOM 0 HE3 LYS A 55 -16.482 6.415 -9.224 1.00 6.66 H new ATOM 0 HZ1 LYS A 55 -18.043 5.336 -10.828 1.00 7.36 H new ATOM 0 HZ2 LYS A 55 -16.829 4.313 -10.225 1.00 7.36 H new ATOM 0 HZ3 LYS A 55 -18.414 4.194 -9.628 1.00 7.36 H new ATOM 838 N LYS A 56 -20.805 3.599 -4.717 1.00 1.27 N ATOM 839 CA LYS A 56 -20.769 2.536 -3.726 1.00 1.10 C ATOM 840 C LYS A 56 -19.400 1.870 -3.682 1.00 1.03 C ATOM 841 O LYS A 56 -19.193 0.794 -4.248 1.00 1.91 O ATOM 842 CB LYS A 56 -21.856 1.505 -4.028 1.00 1.91 C ATOM 843 CG LYS A 56 -23.266 2.047 -3.869 1.00 2.63 C ATOM 844 CD LYS A 56 -24.308 1.077 -4.402 1.00 3.33 C ATOM 845 CE LYS A 56 -25.718 1.516 -4.039 1.00 3.92 C ATOM 846 NZ LYS A 56 -26.034 2.879 -4.546 1.00 4.46 N ATOM 0 H LYS A 56 -21.339 3.373 -5.556 1.00 1.27 H new ATOM 0 HA LYS A 56 -20.957 2.975 -2.746 1.00 1.10 H new ATOM 0 HB2 LYS A 56 -21.728 1.142 -5.048 1.00 1.91 H new ATOM 0 HB3 LYS A 56 -21.728 0.649 -3.366 1.00 1.91 H new ATOM 0 HG2 LYS A 56 -23.462 2.248 -2.816 1.00 2.63 H new ATOM 0 HG3 LYS A 56 -23.351 2.998 -4.396 1.00 2.63 H new ATOM 0 HD2 LYS A 56 -24.217 1.003 -5.486 1.00 3.33 H new ATOM 0 HD3 LYS A 56 -24.120 0.082 -3.998 1.00 3.33 H new ATOM 0 HE2 LYS A 56 -26.434 0.804 -4.448 1.00 3.92 H new ATOM 0 HE3 LYS A 56 -25.834 1.498 -2.955 1.00 3.92 H new ATOM 0 HZ1 LYS A 56 -26.116 3.537 -3.745 1.00 4.46 H new ATOM 0 HZ2 LYS A 56 -25.274 3.198 -5.180 1.00 4.46 H new ATOM 0 HZ3 LYS A 56 -26.933 2.855 -5.068 1.00 4.46 H new ATOM 860 N ILE A 57 -18.475 2.518 -2.996 1.00 0.92 N ATOM 861 CA ILE A 57 -17.150 1.968 -2.785 1.00 0.72 C ATOM 862 C ILE A 57 -17.219 0.944 -1.672 1.00 0.69 C ATOM 863 O ILE A 57 -16.913 1.234 -0.519 1.00 0.80 O ATOM 864 CB ILE A 57 -16.114 3.059 -2.425 1.00 0.65 C ATOM 865 CG1 ILE A 57 -16.322 4.315 -3.283 1.00 0.73 C ATOM 866 CG2 ILE A 57 -14.703 2.522 -2.626 1.00 0.71 C ATOM 867 CD1 ILE A 57 -15.453 5.489 -2.871 1.00 0.75 C ATOM 0 H ILE A 57 -18.621 3.434 -2.572 1.00 0.92 H new ATOM 0 HA ILE A 57 -16.822 1.506 -3.716 1.00 0.72 H new ATOM 0 HB ILE A 57 -16.251 3.331 -1.378 1.00 0.65 H new ATOM 0 HG12 ILE A 57 -16.116 4.070 -4.325 1.00 0.73 H new ATOM 0 HG13 ILE A 57 -17.369 4.613 -3.227 1.00 0.73 H new ATOM 0 HG21 ILE A 57 -13.979 3.296 -2.370 1.00 0.71 H new ATOM 0 HG22 ILE A 57 -14.549 1.655 -1.984 1.00 0.71 H new ATOM 0 HG23 ILE A 57 -14.570 2.230 -3.668 1.00 0.71 H new ATOM 0 HD11 ILE A 57 -15.656 6.339 -3.523 1.00 0.75 H new ATOM 0 HD12 ILE A 57 -15.675 5.762 -1.839 1.00 0.75 H new ATOM 0 HD13 ILE A 57 -14.402 5.211 -2.954 1.00 0.75 H new ATOM 879 N THR A 58 -17.668 -0.246 -2.017 1.00 0.71 N ATOM 880 CA THR A 58 -17.832 -1.287 -1.031 1.00 0.71 C ATOM 881 C THR A 58 -16.487 -1.901 -0.685 1.00 0.71 C ATOM 882 O THR A 58 -15.933 -2.688 -1.443 1.00 0.82 O ATOM 883 CB THR A 58 -18.799 -2.376 -1.510 1.00 0.85 C ATOM 884 OG1 THR A 58 -19.938 -1.765 -2.135 1.00 0.96 O ATOM 885 CG2 THR A 58 -19.251 -3.223 -0.326 1.00 0.86 C ATOM 0 H THR A 58 -17.924 -0.512 -2.968 1.00 0.71 H new ATOM 0 HA THR A 58 -18.260 -0.830 -0.139 1.00 0.71 H new ATOM 0 HB THR A 58 -18.292 -3.017 -2.232 1.00 0.85 H new ATOM 0 HG1 THR A 58 -20.555 -2.461 -2.443 1.00 0.96 H new ATOM 0 HG21 THR A 58 -19.938 -3.995 -0.672 1.00 0.86 H new ATOM 0 HG22 THR A 58 -18.383 -3.691 0.139 1.00 0.86 H new ATOM 0 HG23 THR A 58 -19.755 -2.589 0.403 1.00 0.86 H new ATOM 893 N PHE A 59 -15.969 -1.491 0.463 1.00 0.67 N ATOM 894 CA PHE A 59 -14.665 -1.952 0.960 1.00 0.77 C ATOM 895 C PHE A 59 -14.638 -3.445 1.310 1.00 0.96 C ATOM 896 O PHE A 59 -13.604 -3.948 1.758 1.00 1.57 O ATOM 897 CB PHE A 59 -14.249 -1.147 2.196 1.00 0.80 C ATOM 898 CG PHE A 59 -13.704 0.225 1.899 1.00 0.72 C ATOM 899 CD1 PHE A 59 -13.824 0.761 0.627 1.00 1.07 C ATOM 900 CD2 PHE A 59 -13.077 0.977 2.881 1.00 1.04 C ATOM 901 CE1 PHE A 59 -13.333 2.020 0.340 1.00 1.10 C ATOM 902 CE2 PHE A 59 -12.584 2.236 2.596 1.00 1.06 C ATOM 903 CZ PHE A 59 -12.686 2.758 1.375 1.00 0.80 C ATOM 0 H PHE A 59 -16.435 -0.829 1.083 1.00 0.67 H new ATOM 0 HA PHE A 59 -13.962 -1.794 0.142 1.00 0.77 H new ATOM 0 HB2 PHE A 59 -15.112 -1.046 2.854 1.00 0.80 H new ATOM 0 HB3 PHE A 59 -13.495 -1.712 2.744 1.00 0.80 H new ATOM 0 HD1 PHE A 59 -14.307 0.187 -0.150 1.00 1.07 H new ATOM 0 HD2 PHE A 59 -12.973 0.575 3.878 1.00 1.04 H new ATOM 0 HE1 PHE A 59 -13.437 2.438 -0.650 1.00 1.10 H new ATOM 0 HE2 PHE A 59 -12.107 2.808 3.378 1.00 1.06 H new ATOM 0 HZ PHE A 59 -12.280 3.737 1.169 1.00 0.80 H new ATOM 913 N LEU A 60 -15.757 -4.144 1.123 1.00 1.19 N ATOM 914 CA LEU A 60 -15.815 -5.586 1.370 1.00 1.38 C ATOM 915 C LEU A 60 -17.172 -6.144 0.960 1.00 1.95 C ATOM 916 O LEU A 60 -18.209 -5.643 1.388 1.00 2.65 O ATOM 917 CB LEU A 60 -15.554 -5.889 2.848 1.00 1.84 C ATOM 918 CG LEU A 60 -15.414 -7.366 3.213 1.00 2.35 C ATOM 919 CD1 LEU A 60 -14.256 -7.997 2.457 1.00 2.89 C ATOM 920 CD2 LEU A 60 -15.210 -7.514 4.714 1.00 3.21 C ATOM 0 H LEU A 60 -16.635 -3.737 0.802 1.00 1.19 H new ATOM 0 HA LEU A 60 -15.041 -6.064 0.770 1.00 1.38 H new ATOM 0 HB2 LEU A 60 -14.643 -5.373 3.149 1.00 1.84 H new ATOM 0 HB3 LEU A 60 -16.369 -5.466 3.435 1.00 1.84 H new ATOM 0 HG LEU A 60 -16.330 -7.884 2.928 1.00 2.35 H new ATOM 0 HD11 LEU A 60 -14.173 -9.049 2.731 1.00 2.89 H new ATOM 0 HD12 LEU A 60 -14.433 -7.914 1.385 1.00 2.89 H new ATOM 0 HD13 LEU A 60 -13.330 -7.481 2.713 1.00 2.89 H new ATOM 0 HD21 LEU A 60 -15.111 -8.570 4.965 1.00 3.21 H new ATOM 0 HD22 LEU A 60 -14.306 -6.984 5.012 1.00 3.21 H new ATOM 0 HD23 LEU A 60 -16.067 -7.094 5.241 1.00 3.21 H new ATOM 932 N ASP A 61 -17.151 -7.170 0.120 1.00 2.43 N ATOM 933 CA ASP A 61 -18.376 -7.835 -0.314 1.00 3.40 C ATOM 934 C ASP A 61 -18.897 -8.768 0.769 1.00 3.45 C ATOM 935 O ASP A 61 -18.245 -9.747 1.115 1.00 3.73 O ATOM 936 CB ASP A 61 -18.126 -8.619 -1.610 1.00 4.36 C ATOM 937 CG ASP A 61 -19.170 -9.698 -1.867 1.00 5.14 C ATOM 938 OD1 ASP A 61 -20.373 -9.441 -1.660 1.00 5.61 O ATOM 939 OD2 ASP A 61 -18.776 -10.818 -2.270 1.00 5.55 O ATOM 0 H ASP A 61 -16.297 -7.562 -0.277 1.00 2.43 H new ATOM 0 HA ASP A 61 -19.130 -7.071 -0.503 1.00 3.40 H new ATOM 0 HB2 ASP A 61 -18.115 -7.925 -2.451 1.00 4.36 H new ATOM 0 HB3 ASP A 61 -17.139 -9.080 -1.564 1.00 4.36 H new ATOM 944 N THR A 62 -20.078 -8.450 1.296 1.00 3.65 N ATOM 945 CA THR A 62 -20.715 -9.264 2.325 1.00 4.03 C ATOM 946 C THR A 62 -19.927 -9.201 3.636 1.00 4.27 C ATOM 947 O THR A 62 -18.879 -9.829 3.759 1.00 4.71 O ATOM 948 CB THR A 62 -20.855 -10.732 1.863 1.00 4.83 C ATOM 949 OG1 THR A 62 -21.507 -10.783 0.581 1.00 5.19 O ATOM 950 CG2 THR A 62 -21.650 -11.550 2.875 1.00 5.45 C ATOM 0 H THR A 62 -20.615 -7.627 1.023 1.00 3.65 H new ATOM 0 HA THR A 62 -21.712 -8.858 2.497 1.00 4.03 H new ATOM 0 HB THR A 62 -19.856 -11.160 1.782 1.00 4.83 H new ATOM 0 HG1 THR A 62 -20.940 -10.352 -0.092 1.00 5.19 H new ATOM 0 HG21 THR A 62 -21.734 -12.579 2.526 1.00 5.45 H new ATOM 0 HG22 THR A 62 -21.139 -11.534 3.838 1.00 5.45 H new ATOM 0 HG23 THR A 62 -22.646 -11.122 2.986 1.00 5.45 H new ATOM 958 N PRO A 63 -20.437 -8.437 4.626 1.00 4.49 N ATOM 959 CA PRO A 63 -19.769 -8.218 5.920 1.00 5.20 C ATOM 960 C PRO A 63 -19.112 -9.476 6.490 1.00 5.56 C ATOM 961 O PRO A 63 -19.767 -10.327 7.094 1.00 6.11 O ATOM 962 CB PRO A 63 -20.917 -7.756 6.812 1.00 5.69 C ATOM 963 CG PRO A 63 -21.825 -7.023 5.886 1.00 5.34 C ATOM 964 CD PRO A 63 -21.728 -7.723 4.555 1.00 4.58 C ATOM 0 HA PRO A 63 -18.945 -7.509 5.836 1.00 5.20 H new ATOM 0 HB2 PRO A 63 -21.423 -8.601 7.280 1.00 5.69 H new ATOM 0 HB3 PRO A 63 -20.562 -7.111 7.616 1.00 5.69 H new ATOM 0 HG2 PRO A 63 -22.850 -7.034 6.257 1.00 5.34 H new ATOM 0 HG3 PRO A 63 -21.529 -5.978 5.798 1.00 5.34 H new ATOM 0 HD2 PRO A 63 -22.559 -8.412 4.404 1.00 4.58 H new ATOM 0 HD3 PRO A 63 -21.748 -7.014 3.728 1.00 4.58 H new ATOM 972 N GLY A 64 -17.809 -9.577 6.280 1.00 5.49 N ATOM 973 CA GLY A 64 -17.059 -10.743 6.689 1.00 6.04 C ATOM 974 C GLY A 64 -16.035 -11.105 5.637 1.00 5.99 C ATOM 975 O GLY A 64 -16.043 -10.531 4.552 1.00 6.36 O ATOM 0 H GLY A 64 -17.249 -8.856 5.824 1.00 5.49 H new ATOM 0 HA2 GLY A 64 -16.561 -10.549 7.639 1.00 6.04 H new ATOM 0 HA3 GLY A 64 -17.737 -11.581 6.850 1.00 6.04 H new ATOM 979 N HIS A 65 -15.159 -12.055 5.949 1.00 5.85 N ATOM 980 CA HIS A 65 -14.083 -12.449 5.034 1.00 6.04 C ATOM 981 C HIS A 65 -13.155 -11.265 4.789 1.00 5.42 C ATOM 982 O HIS A 65 -12.947 -10.850 3.649 1.00 5.51 O ATOM 983 CB HIS A 65 -14.634 -12.955 3.689 1.00 6.53 C ATOM 984 CG HIS A 65 -15.750 -13.949 3.797 1.00 7.30 C ATOM 985 ND1 HIS A 65 -15.576 -15.233 4.255 1.00 8.05 N ATOM 986 CD2 HIS A 65 -17.068 -13.833 3.501 1.00 7.71 C ATOM 987 CE1 HIS A 65 -16.734 -15.866 4.236 1.00 8.78 C ATOM 988 NE2 HIS A 65 -17.657 -15.039 3.783 1.00 8.61 N ATOM 0 H HIS A 65 -15.170 -12.570 6.830 1.00 5.85 H new ATOM 0 HA HIS A 65 -13.533 -13.265 5.502 1.00 6.04 H new ATOM 0 HB2 HIS A 65 -14.984 -12.099 3.112 1.00 6.53 H new ATOM 0 HB3 HIS A 65 -13.818 -13.407 3.126 1.00 6.53 H new ATOM 0 HD2 HIS A 65 -17.562 -12.954 3.115 1.00 7.71 H new ATOM 0 HE1 HIS A 65 -16.898 -16.889 4.540 1.00 8.78 H new ATOM 0 HE2 HIS A 65 -18.645 -15.260 3.662 1.00 8.61 H new ATOM 997 N GLU A 66 -12.610 -10.719 5.873 1.00 5.13 N ATOM 998 CA GLU A 66 -11.788 -9.513 5.805 1.00 4.83 C ATOM 999 C GLU A 66 -10.552 -9.716 4.932 1.00 4.30 C ATOM 1000 O GLU A 66 -10.149 -8.819 4.189 1.00 4.72 O ATOM 1001 CB GLU A 66 -11.373 -9.086 7.214 1.00 5.31 C ATOM 1002 CG GLU A 66 -12.550 -8.834 8.143 1.00 5.97 C ATOM 1003 CD GLU A 66 -12.115 -8.351 9.507 1.00 6.59 C ATOM 1004 OE1 GLU A 66 -11.819 -9.196 10.372 1.00 6.87 O ATOM 1005 OE2 GLU A 66 -12.087 -7.122 9.729 1.00 7.05 O ATOM 0 H GLU A 66 -12.724 -11.095 6.814 1.00 5.13 H new ATOM 0 HA GLU A 66 -12.388 -8.727 5.347 1.00 4.83 H new ATOM 0 HB2 GLU A 66 -10.738 -9.859 7.647 1.00 5.31 H new ATOM 0 HB3 GLU A 66 -10.772 -8.179 7.148 1.00 5.31 H new ATOM 0 HG2 GLU A 66 -13.212 -8.095 7.693 1.00 5.97 H new ATOM 0 HG3 GLU A 66 -13.126 -9.753 8.253 1.00 5.97 H new ATOM 1012 N ALA A 67 -9.955 -10.895 5.016 1.00 3.82 N ATOM 1013 CA ALA A 67 -8.789 -11.219 4.205 1.00 3.70 C ATOM 1014 C ALA A 67 -9.224 -11.744 2.842 1.00 2.58 C ATOM 1015 O ALA A 67 -8.910 -12.878 2.473 1.00 2.95 O ATOM 1016 CB ALA A 67 -7.917 -12.237 4.912 1.00 4.55 C ATOM 0 H ALA A 67 -10.258 -11.645 5.638 1.00 3.82 H new ATOM 0 HA ALA A 67 -8.205 -10.311 4.058 1.00 3.70 H new ATOM 0 HB1 ALA A 67 -7.051 -12.467 4.292 1.00 4.55 H new ATOM 0 HB2 ALA A 67 -7.582 -11.829 5.866 1.00 4.55 H new ATOM 0 HB3 ALA A 67 -8.490 -13.148 5.087 1.00 4.55 H new ATOM 1022 N PHE A 68 -9.941 -10.893 2.120 1.00 1.79 N ATOM 1023 CA PHE A 68 -10.547 -11.231 0.832 1.00 1.15 C ATOM 1024 C PHE A 68 -11.703 -12.208 1.012 1.00 1.77 C ATOM 1025 O PHE A 68 -11.662 -13.100 1.863 1.00 2.37 O ATOM 1026 CB PHE A 68 -9.519 -11.796 -0.158 1.00 1.18 C ATOM 1027 CG PHE A 68 -9.089 -10.816 -1.216 1.00 1.12 C ATOM 1028 CD1 PHE A 68 -9.883 -9.728 -1.538 1.00 1.67 C ATOM 1029 CD2 PHE A 68 -7.899 -10.993 -1.900 1.00 1.08 C ATOM 1030 CE1 PHE A 68 -9.496 -8.836 -2.522 1.00 2.10 C ATOM 1031 CE2 PHE A 68 -7.505 -10.106 -2.882 1.00 1.52 C ATOM 1032 CZ PHE A 68 -8.305 -9.026 -3.196 1.00 2.00 C ATOM 0 H PHE A 68 -10.123 -9.933 2.414 1.00 1.79 H new ATOM 0 HA PHE A 68 -10.935 -10.304 0.411 1.00 1.15 H new ATOM 0 HB2 PHE A 68 -8.640 -12.127 0.395 1.00 1.18 H new ATOM 0 HB3 PHE A 68 -9.941 -12.676 -0.642 1.00 1.18 H new ATOM 0 HD1 PHE A 68 -10.815 -9.574 -1.015 1.00 1.67 H new ATOM 0 HD2 PHE A 68 -7.269 -11.837 -1.662 1.00 1.08 H new ATOM 0 HE1 PHE A 68 -10.125 -7.992 -2.763 1.00 2.10 H new ATOM 0 HE2 PHE A 68 -6.572 -10.257 -3.404 1.00 1.52 H new ATOM 0 HZ PHE A 68 -8.001 -8.332 -3.966 1.00 2.00 H new ATOM 1042 N THR A 69 -12.732 -12.035 0.200 1.00 2.35 N ATOM 1043 CA THR A 69 -13.935 -12.844 0.300 1.00 3.31 C ATOM 1044 C THR A 69 -13.753 -14.207 -0.358 1.00 3.54 C ATOM 1045 O THR A 69 -14.457 -14.550 -1.310 1.00 3.89 O ATOM 1046 CB THR A 69 -15.131 -12.107 -0.322 1.00 4.11 C ATOM 1047 OG1 THR A 69 -14.750 -11.503 -1.567 1.00 4.46 O ATOM 1048 CG2 THR A 69 -15.641 -11.036 0.622 1.00 4.90 C ATOM 0 H THR A 69 -12.758 -11.335 -0.542 1.00 2.35 H new ATOM 0 HA THR A 69 -14.132 -13.010 1.359 1.00 3.31 H new ATOM 0 HB THR A 69 -15.924 -12.833 -0.501 1.00 4.11 H new ATOM 0 HG1 THR A 69 -15.521 -11.038 -1.954 1.00 4.46 H new ATOM 0 HG21 THR A 69 -16.488 -10.523 0.167 1.00 4.90 H new ATOM 0 HG22 THR A 69 -15.956 -11.496 1.558 1.00 4.90 H new ATOM 0 HG23 THR A 69 -14.846 -10.317 0.821 1.00 4.90 H new ATOM 1056 N THR A 70 -12.806 -14.976 0.175 1.00 3.82 N ATOM 1057 CA THR A 70 -12.478 -16.305 -0.328 1.00 4.35 C ATOM 1058 C THR A 70 -11.842 -16.226 -1.716 1.00 4.41 C ATOM 1059 O THR A 70 -10.623 -16.370 -1.848 1.00 4.95 O ATOM 1060 CB THR A 70 -13.719 -17.225 -0.362 1.00 5.16 C ATOM 1061 OG1 THR A 70 -14.360 -17.225 0.926 1.00 5.40 O ATOM 1062 CG2 THR A 70 -13.336 -18.650 -0.737 1.00 5.84 C ATOM 0 H THR A 70 -12.241 -14.690 0.975 1.00 3.82 H new ATOM 0 HA THR A 70 -11.755 -16.739 0.363 1.00 4.35 H new ATOM 0 HB THR A 70 -14.405 -16.842 -1.117 1.00 5.16 H new ATOM 0 HG1 THR A 70 -15.147 -17.808 0.900 1.00 5.40 H new ATOM 0 HG21 THR A 70 -14.229 -19.275 -0.753 1.00 5.84 H new ATOM 0 HG22 THR A 70 -12.872 -18.655 -1.723 1.00 5.84 H new ATOM 0 HG23 THR A 70 -12.632 -19.043 -0.003 1.00 5.84 H new ATOM 1070 N MET A 71 -12.665 -15.964 -2.737 1.00 4.19 N ATOM 1071 CA MET A 71 -12.201 -15.862 -4.120 1.00 4.50 C ATOM 1072 C MET A 71 -11.409 -17.097 -4.529 1.00 4.86 C ATOM 1073 O MET A 71 -10.191 -17.042 -4.694 1.00 5.21 O ATOM 1074 CB MET A 71 -11.356 -14.596 -4.316 1.00 4.42 C ATOM 1075 CG MET A 71 -12.154 -13.304 -4.220 1.00 4.38 C ATOM 1076 SD MET A 71 -11.115 -11.842 -4.385 1.00 4.69 S ATOM 1077 CE MET A 71 -12.352 -10.545 -4.391 1.00 4.34 C ATOM 0 H MET A 71 -13.668 -15.817 -2.626 1.00 4.19 H new ATOM 0 HA MET A 71 -13.080 -15.797 -4.761 1.00 4.50 H new ATOM 0 HB2 MET A 71 -10.564 -14.579 -3.567 1.00 4.42 H new ATOM 0 HB3 MET A 71 -10.871 -14.641 -5.291 1.00 4.42 H new ATOM 0 HG2 MET A 71 -12.918 -13.293 -4.997 1.00 4.38 H new ATOM 0 HG3 MET A 71 -12.673 -13.271 -3.262 1.00 4.38 H new ATOM 0 HE1 MET A 71 -11.863 -9.576 -4.487 1.00 4.34 H new ATOM 0 HE2 MET A 71 -13.031 -10.694 -5.231 1.00 4.34 H new ATOM 0 HE3 MET A 71 -12.916 -10.576 -3.459 1.00 4.34 H new ATOM 1087 N ARG A 72 -12.106 -18.214 -4.695 1.00 5.04 N ATOM 1088 CA ARG A 72 -11.458 -19.462 -5.071 1.00 5.54 C ATOM 1089 C ARG A 72 -11.289 -19.551 -6.583 1.00 5.80 C ATOM 1090 O ARG A 72 -10.613 -20.445 -7.091 1.00 6.36 O ATOM 1091 CB ARG A 72 -12.248 -20.670 -4.551 1.00 5.95 C ATOM 1092 CG ARG A 72 -13.669 -20.775 -5.087 1.00 6.36 C ATOM 1093 CD ARG A 72 -14.344 -22.039 -4.582 1.00 6.73 C ATOM 1094 NE ARG A 72 -15.758 -22.114 -4.947 1.00 7.09 N ATOM 1095 CZ ARG A 72 -16.664 -22.807 -4.250 1.00 7.63 C ATOM 1096 NH1 ARG A 72 -16.281 -23.533 -3.206 1.00 7.86 N ATOM 1097 NH2 ARG A 72 -17.942 -22.795 -4.608 1.00 8.21 N ATOM 0 H ARG A 72 -13.117 -18.280 -4.575 1.00 5.04 H new ATOM 0 HA ARG A 72 -10.470 -19.475 -4.611 1.00 5.54 H new ATOM 0 HB2 ARG A 72 -11.707 -21.580 -4.810 1.00 5.95 H new ATOM 0 HB3 ARG A 72 -12.287 -20.621 -3.463 1.00 5.95 H new ATOM 0 HG2 ARG A 72 -14.244 -19.902 -4.779 1.00 6.36 H new ATOM 0 HG3 ARG A 72 -13.652 -20.777 -6.177 1.00 6.36 H new ATOM 0 HD2 ARG A 72 -13.824 -22.908 -4.984 1.00 6.73 H new ATOM 0 HD3 ARG A 72 -14.251 -22.086 -3.497 1.00 6.73 H new ATOM 0 HE ARG A 72 -16.070 -21.611 -5.778 1.00 7.09 H new ATOM 0 HH11 ARG A 72 -15.297 -23.561 -2.938 1.00 7.86 H new ATOM 0 HH12 ARG A 72 -16.970 -24.063 -2.673 1.00 7.86 H new ATOM 0 HH21 ARG A 72 -18.239 -22.254 -5.420 1.00 8.21 H new ATOM 0 HH22 ARG A 72 -18.627 -23.327 -4.071 1.00 8.21 H new ATOM 1111 N ALA A 73 -11.909 -18.626 -7.300 1.00 5.58 N ATOM 1112 CA ALA A 73 -11.808 -18.594 -8.749 1.00 6.01 C ATOM 1113 C ALA A 73 -11.534 -17.181 -9.242 1.00 5.86 C ATOM 1114 O ALA A 73 -10.470 -16.907 -9.799 1.00 6.36 O ATOM 1115 CB ALA A 73 -13.082 -19.136 -9.375 1.00 6.36 C ATOM 0 H ALA A 73 -12.488 -17.887 -6.900 1.00 5.58 H new ATOM 0 HA ALA A 73 -10.972 -19.226 -9.049 1.00 6.01 H new ATOM 0 HB1 ALA A 73 -12.995 -19.107 -10.461 1.00 6.36 H new ATOM 0 HB2 ALA A 73 -13.238 -20.165 -9.051 1.00 6.36 H new ATOM 0 HB3 ALA A 73 -13.929 -18.525 -9.063 1.00 6.36 H new ATOM 1121 N ARG A 74 -12.496 -16.290 -9.007 1.00 5.40 N ATOM 1122 CA ARG A 74 -12.439 -14.910 -9.490 1.00 5.50 C ATOM 1123 C ARG A 74 -12.211 -14.889 -11.001 1.00 5.18 C ATOM 1124 O ARG A 74 -11.149 -14.481 -11.481 1.00 5.49 O ATOM 1125 CB ARG A 74 -11.350 -14.107 -8.768 1.00 6.12 C ATOM 1126 CG ARG A 74 -11.576 -12.600 -8.807 1.00 6.76 C ATOM 1127 CD ARG A 74 -12.936 -12.249 -8.229 1.00 7.55 C ATOM 1128 NE ARG A 74 -13.164 -10.811 -8.115 1.00 8.14 N ATOM 1129 CZ ARG A 74 -14.377 -10.264 -8.048 1.00 8.93 C ATOM 1130 NH1 ARG A 74 -15.458 -11.010 -8.247 1.00 9.21 N ATOM 1131 NH2 ARG A 74 -14.513 -8.967 -7.817 1.00 9.65 N ATOM 0 H ARG A 74 -13.339 -16.505 -8.475 1.00 5.40 H new ATOM 0 HA ARG A 74 -13.396 -14.437 -9.271 1.00 5.50 H new ATOM 0 HB2 ARG A 74 -11.300 -14.432 -7.729 1.00 6.12 H new ATOM 0 HB3 ARG A 74 -10.384 -14.333 -9.220 1.00 6.12 H new ATOM 0 HG2 ARG A 74 -10.793 -12.095 -8.242 1.00 6.76 H new ATOM 0 HG3 ARG A 74 -11.508 -12.243 -9.835 1.00 6.76 H new ATOM 0 HD2 ARG A 74 -13.713 -12.684 -8.858 1.00 7.55 H new ATOM 0 HD3 ARG A 74 -13.032 -12.704 -7.243 1.00 7.55 H new ATOM 0 HE ARG A 74 -12.353 -10.194 -8.085 1.00 8.14 H new ATOM 0 HH11 ARG A 74 -15.361 -12.004 -8.452 1.00 9.21 H new ATOM 0 HH12 ARG A 74 -16.385 -10.588 -8.195 1.00 9.21 H new ATOM 0 HH21 ARG A 74 -13.687 -8.382 -7.690 1.00 9.65 H new ATOM 0 HH22 ARG A 74 -15.444 -8.553 -7.767 1.00 9.65 H new ATOM 1145 N GLY A 75 -13.210 -15.360 -11.739 1.00 4.93 N ATOM 1146 CA GLY A 75 -13.113 -15.408 -13.183 1.00 4.87 C ATOM 1147 C GLY A 75 -12.936 -14.033 -13.790 1.00 4.49 C ATOM 1148 O GLY A 75 -11.992 -13.791 -14.544 1.00 4.54 O ATOM 0 H GLY A 75 -14.089 -15.711 -11.359 1.00 4.93 H new ATOM 0 HA2 GLY A 75 -12.272 -16.040 -13.468 1.00 4.87 H new ATOM 0 HA3 GLY A 75 -14.012 -15.870 -13.591 1.00 4.87 H new ATOM 1152 N ALA A 76 -13.844 -13.131 -13.461 1.00 4.53 N ATOM 1153 CA ALA A 76 -13.755 -11.763 -13.935 1.00 4.52 C ATOM 1154 C ALA A 76 -12.782 -10.980 -13.069 1.00 3.91 C ATOM 1155 O ALA A 76 -13.089 -10.651 -11.926 1.00 4.15 O ATOM 1156 CB ALA A 76 -15.129 -11.106 -13.932 1.00 5.47 C ATOM 0 H ALA A 76 -14.651 -13.322 -12.867 1.00 4.53 H new ATOM 0 HA ALA A 76 -13.386 -11.767 -14.961 1.00 4.52 H new ATOM 0 HB1 ALA A 76 -15.043 -10.080 -14.291 1.00 5.47 H new ATOM 0 HB2 ALA A 76 -15.800 -11.663 -14.585 1.00 5.47 H new ATOM 0 HB3 ALA A 76 -15.529 -11.103 -12.918 1.00 5.47 H new ATOM 1162 N GLN A 77 -11.604 -10.706 -13.617 1.00 3.61 N ATOM 1163 CA GLN A 77 -10.579 -9.960 -12.895 1.00 3.40 C ATOM 1164 C GLN A 77 -11.029 -8.520 -12.685 1.00 2.90 C ATOM 1165 O GLN A 77 -10.627 -7.867 -11.724 1.00 3.33 O ATOM 1166 CB GLN A 77 -9.260 -9.966 -13.671 1.00 4.25 C ATOM 1167 CG GLN A 77 -8.745 -11.353 -14.032 1.00 4.87 C ATOM 1168 CD GLN A 77 -8.197 -12.125 -12.846 1.00 5.70 C ATOM 1169 OE1 GLN A 77 -8.650 -11.972 -11.714 1.00 6.14 O ATOM 1170 NE2 GLN A 77 -7.198 -12.954 -13.101 1.00 6.26 N ATOM 0 H GLN A 77 -11.334 -10.989 -14.559 1.00 3.61 H new ATOM 0 HA GLN A 77 -10.427 -10.441 -11.929 1.00 3.40 H new ATOM 0 HB2 GLN A 77 -9.390 -9.391 -14.588 1.00 4.25 H new ATOM 0 HB3 GLN A 77 -8.502 -9.454 -13.078 1.00 4.25 H new ATOM 0 HG2 GLN A 77 -9.554 -11.925 -14.485 1.00 4.87 H new ATOM 0 HG3 GLN A 77 -7.963 -11.256 -14.785 1.00 4.87 H new ATOM 0 HE21 GLN A 77 -6.849 -13.054 -14.054 1.00 6.26 H new ATOM 0 HE22 GLN A 77 -6.777 -13.493 -12.344 1.00 6.26 H new ATOM 1179 N VAL A 78 -11.874 -8.057 -13.618 1.00 2.65 N ATOM 1180 CA VAL A 78 -12.425 -6.697 -13.639 1.00 2.75 C ATOM 1181 C VAL A 78 -11.457 -5.645 -13.096 1.00 2.21 C ATOM 1182 O VAL A 78 -10.520 -5.248 -13.796 1.00 2.72 O ATOM 1183 CB VAL A 78 -13.809 -6.594 -12.938 1.00 3.65 C ATOM 1184 CG1 VAL A 78 -14.886 -7.193 -13.826 1.00 4.31 C ATOM 1185 CG2 VAL A 78 -13.822 -7.287 -11.577 1.00 4.21 C ATOM 0 H VAL A 78 -12.199 -8.632 -14.395 1.00 2.65 H new ATOM 0 HA VAL A 78 -12.577 -6.475 -14.695 1.00 2.75 H new ATOM 0 HB VAL A 78 -14.009 -5.536 -12.771 1.00 3.65 H new ATOM 0 HG11 VAL A 78 -15.852 -7.117 -13.328 1.00 4.31 H new ATOM 0 HG12 VAL A 78 -14.921 -6.651 -14.771 1.00 4.31 H new ATOM 0 HG13 VAL A 78 -14.658 -8.242 -14.017 1.00 4.31 H new ATOM 0 HG21 VAL A 78 -14.810 -7.187 -11.127 1.00 4.21 H new ATOM 0 HG22 VAL A 78 -13.586 -8.344 -11.704 1.00 4.21 H new ATOM 0 HG23 VAL A 78 -13.079 -6.825 -10.927 1.00 4.21 H new ATOM 1195 N THR A 79 -11.672 -5.207 -11.863 1.00 1.82 N ATOM 1196 CA THR A 79 -10.807 -4.233 -11.218 1.00 1.90 C ATOM 1197 C THR A 79 -10.999 -4.295 -9.703 1.00 1.53 C ATOM 1198 O THR A 79 -11.682 -3.453 -9.117 1.00 1.82 O ATOM 1199 CB THR A 79 -11.087 -2.791 -11.720 1.00 2.70 C ATOM 1200 OG1 THR A 79 -11.040 -2.746 -13.155 1.00 3.20 O ATOM 1201 CG2 THR A 79 -10.068 -1.807 -11.157 1.00 3.41 C ATOM 0 H THR A 79 -12.451 -5.518 -11.283 1.00 1.82 H new ATOM 0 HA THR A 79 -9.777 -4.482 -11.474 1.00 1.90 H new ATOM 0 HB THR A 79 -12.081 -2.507 -11.375 1.00 2.70 H new ATOM 0 HG1 THR A 79 -10.495 -3.490 -13.488 1.00 3.20 H new ATOM 0 HG21 THR A 79 -10.288 -0.805 -11.525 1.00 3.41 H new ATOM 0 HG22 THR A 79 -10.119 -1.813 -10.068 1.00 3.41 H new ATOM 0 HG23 THR A 79 -9.067 -2.098 -11.475 1.00 3.41 H new ATOM 1209 N ASP A 80 -10.426 -5.316 -9.078 1.00 1.21 N ATOM 1210 CA ASP A 80 -10.464 -5.435 -7.625 1.00 1.14 C ATOM 1211 C ASP A 80 -9.408 -4.531 -7.008 1.00 0.88 C ATOM 1212 O ASP A 80 -8.348 -4.310 -7.598 1.00 1.12 O ATOM 1213 CB ASP A 80 -10.245 -6.884 -7.168 1.00 1.60 C ATOM 1214 CG ASP A 80 -11.440 -7.779 -7.444 1.00 2.14 C ATOM 1215 OD1 ASP A 80 -12.570 -7.385 -7.101 1.00 2.66 O ATOM 1216 OD2 ASP A 80 -11.255 -8.880 -8.004 1.00 2.60 O ATOM 0 H ASP A 80 -9.931 -6.071 -9.552 1.00 1.21 H new ATOM 0 HA ASP A 80 -11.454 -5.128 -7.289 1.00 1.14 H new ATOM 0 HB2 ASP A 80 -9.369 -7.290 -7.674 1.00 1.60 H new ATOM 0 HB3 ASP A 80 -10.030 -6.894 -6.100 1.00 1.60 H new ATOM 1221 N ILE A 81 -9.701 -3.989 -5.834 1.00 0.63 N ATOM 1222 CA ILE A 81 -8.792 -3.063 -5.171 1.00 0.42 C ATOM 1223 C ILE A 81 -8.644 -3.420 -3.696 1.00 0.38 C ATOM 1224 O ILE A 81 -9.633 -3.678 -3.014 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.304 -1.607 -5.285 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.505 -1.220 -6.753 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -8.340 -0.645 -4.608 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -10.136 0.142 -6.944 1.00 0.71 C ATOM 0 H ILE A 81 -10.562 -4.175 -5.320 1.00 0.63 H new ATOM 0 HA ILE A 81 -7.824 -3.143 -5.666 1.00 0.42 H new ATOM 0 HB ILE A 81 -10.266 -1.543 -4.777 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -8.540 -1.237 -7.259 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -10.131 -1.971 -7.235 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -8.718 0.373 -4.699 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -8.248 -0.905 -3.553 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.363 -0.713 -5.085 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -10.246 0.346 -8.009 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -11.116 0.159 -6.468 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -9.500 0.904 -6.493 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.412 -3.445 -3.199 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.186 -3.686 -1.773 1.00 0.28 C ATOM 1242 C VAL A 82 -6.644 -2.451 -1.084 1.00 0.23 C ATOM 1243 O VAL A 82 -5.677 -1.850 -1.538 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.233 -4.873 -1.509 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -5.718 -4.866 -0.068 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -6.956 -6.169 -1.789 1.00 1.17 C ATOM 0 H VAL A 82 -6.565 -3.304 -3.750 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.162 -3.938 -1.358 1.00 0.28 H new ATOM 0 HB VAL A 82 -5.373 -4.776 -2.172 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.050 -5.714 0.084 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.176 -3.939 0.120 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -6.560 -4.940 0.620 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -6.285 -7.008 -1.603 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -7.826 -6.249 -1.137 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -7.280 -6.187 -2.830 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.280 -2.079 0.008 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.804 -0.981 0.824 1.00 0.19 C ATOM 1258 C ILE A 83 -6.008 -1.488 2.000 1.00 0.19 C ATOM 1259 O ILE A 83 -6.427 -2.404 2.701 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.951 -0.085 1.314 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.531 0.620 0.105 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -7.462 0.913 2.365 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -9.475 1.757 0.434 1.00 0.37 C ATOM 0 H ILE A 83 -8.131 -2.523 0.352 1.00 0.22 H new ATOM 0 HA ILE A 83 -6.156 -0.376 0.190 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.721 -0.686 1.798 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.712 1.008 -0.501 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -9.061 -0.110 -0.506 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -8.296 1.534 2.693 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -7.054 0.372 3.219 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.687 1.546 1.933 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -9.842 2.204 -0.490 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -10.317 1.375 1.012 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -8.947 2.511 1.017 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.859 -0.889 2.205 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.982 -1.305 3.282 1.00 0.23 C ATOM 1277 C LEU A 84 -3.935 -0.270 4.386 1.00 0.24 C ATOM 1278 O LEU A 84 -3.399 0.813 4.200 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.565 -1.535 2.776 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.959 -2.860 3.207 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -1.948 -3.004 4.724 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -2.753 -3.964 2.570 1.00 1.01 C ATOM 0 H LEU A 84 -4.507 -0.113 1.644 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.388 -2.237 3.676 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -2.567 -1.486 1.687 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -1.928 -0.724 3.130 1.00 0.39 H new ATOM 0 HG LEU A 84 -0.920 -2.908 2.882 1.00 0.31 H new ATOM 0 HD11 LEU A 84 -1.508 -3.964 4.995 1.00 0.91 H new ATOM 0 HD12 LEU A 84 -1.359 -2.198 5.162 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -2.969 -2.954 5.102 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -2.337 -4.928 2.864 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -3.791 -3.901 2.897 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.708 -3.865 1.485 1.00 1.01 H new ATOM 1294 N VAL A 85 -4.474 -0.608 5.536 1.00 0.21 N ATOM 1295 CA VAL A 85 -4.395 0.267 6.684 1.00 0.27 C ATOM 1296 C VAL A 85 -3.108 0.000 7.458 1.00 0.25 C ATOM 1297 O VAL A 85 -3.040 -0.911 8.285 1.00 0.29 O ATOM 1298 CB VAL A 85 -5.614 0.080 7.608 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -5.504 0.975 8.822 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.907 0.360 6.858 1.00 0.40 C ATOM 0 H VAL A 85 -4.972 -1.483 5.701 1.00 0.21 H new ATOM 0 HA VAL A 85 -4.393 1.297 6.327 1.00 0.27 H new ATOM 0 HB VAL A 85 -5.630 -0.957 7.943 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -6.374 0.828 9.462 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -4.599 0.726 9.377 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -5.459 2.016 8.503 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -7.754 0.222 7.530 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -6.899 1.386 6.490 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.995 -0.327 6.016 1.00 0.40 H new ATOM 1310 N VAL A 86 -2.079 0.774 7.147 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.821 0.689 7.860 1.00 0.20 C ATOM 1312 C VAL A 86 -0.516 1.997 8.568 1.00 0.17 C ATOM 1313 O VAL A 86 -0.554 3.069 7.969 1.00 0.22 O ATOM 1314 CB VAL A 86 0.352 0.347 6.925 1.00 0.23 C ATOM 1315 CG1 VAL A 86 0.295 -1.108 6.501 1.00 0.49 C ATOM 1316 CG2 VAL A 86 0.364 1.254 5.702 1.00 0.64 C ATOM 0 H VAL A 86 -2.095 1.470 6.401 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.930 -0.114 8.589 1.00 0.20 H new ATOM 0 HB VAL A 86 1.276 0.512 7.479 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.134 -1.328 5.840 1.00 0.49 H new ATOM 0 HG12 VAL A 86 0.351 -1.746 7.383 1.00 0.49 H new ATOM 0 HG13 VAL A 86 -0.641 -1.297 5.975 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.204 0.988 5.060 1.00 0.64 H new ATOM 0 HG22 VAL A 86 -0.568 1.132 5.149 1.00 0.64 H new ATOM 0 HG23 VAL A 86 0.464 2.292 6.020 1.00 0.64 H new ATOM 1326 N ALA A 87 -0.224 1.913 9.848 1.00 0.17 N ATOM 1327 CA ALA A 87 0.176 3.080 10.605 1.00 0.18 C ATOM 1328 C ALA A 87 1.638 3.388 10.326 1.00 0.16 C ATOM 1329 O ALA A 87 2.475 2.487 10.346 1.00 0.24 O ATOM 1330 CB ALA A 87 -0.058 2.851 12.086 1.00 0.28 C ATOM 0 H ALA A 87 -0.256 1.048 10.387 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.426 3.935 10.299 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.247 3.736 12.644 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -1.116 2.658 12.262 1.00 0.28 H new ATOM 0 HB3 ALA A 87 0.527 1.993 12.418 1.00 0.28 H new ATOM 1336 N ALA A 88 1.950 4.657 10.076 1.00 0.12 N ATOM 1337 CA ALA A 88 3.300 5.041 9.674 1.00 0.14 C ATOM 1338 C ALA A 88 4.257 4.930 10.835 1.00 0.16 C ATOM 1339 O ALA A 88 5.464 5.079 10.677 1.00 0.22 O ATOM 1340 CB ALA A 88 3.317 6.456 9.134 1.00 0.17 C ATOM 0 H ALA A 88 1.291 5.432 10.144 1.00 0.12 H new ATOM 0 HA ALA A 88 3.619 4.358 8.887 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.333 6.721 8.841 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.660 6.522 8.267 1.00 0.17 H new ATOM 0 HB3 ALA A 88 2.971 7.144 9.905 1.00 0.17 H new ATOM 1346 N ASP A 89 3.702 4.682 12.000 1.00 0.16 N ATOM 1347 CA ASP A 89 4.512 4.572 13.201 1.00 0.21 C ATOM 1348 C ASP A 89 5.059 3.154 13.364 1.00 0.22 C ATOM 1349 O ASP A 89 6.022 2.929 14.103 1.00 0.37 O ATOM 1350 CB ASP A 89 3.696 4.958 14.435 1.00 0.30 C ATOM 1351 CG ASP A 89 3.078 3.758 15.145 1.00 0.39 C ATOM 1352 OD1 ASP A 89 2.031 3.253 14.681 1.00 0.47 O ATOM 1353 OD2 ASP A 89 3.633 3.323 16.175 1.00 0.58 O ATOM 0 H ASP A 89 2.701 4.553 12.145 1.00 0.16 H new ATOM 0 HA ASP A 89 5.352 5.259 13.101 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.338 5.495 15.134 1.00 0.30 H new ATOM 0 HB3 ASP A 89 2.903 5.645 14.138 1.00 0.30 H new ATOM 1358 N ASP A 90 4.459 2.202 12.654 1.00 0.19 N ATOM 1359 CA ASP A 90 4.754 0.789 12.875 1.00 0.23 C ATOM 1360 C ASP A 90 5.020 0.064 11.552 1.00 0.25 C ATOM 1361 O ASP A 90 6.020 -0.641 11.413 1.00 0.42 O ATOM 1362 CB ASP A 90 3.589 0.155 13.626 1.00 0.26 C ATOM 1363 CG ASP A 90 3.936 -1.162 14.277 1.00 0.36 C ATOM 1364 OD1 ASP A 90 5.101 -1.321 14.690 1.00 0.56 O ATOM 1365 OD2 ASP A 90 3.062 -2.056 14.336 1.00 0.46 O ATOM 0 H ASP A 90 3.769 2.382 11.924 1.00 0.19 H new ATOM 0 HA ASP A 90 5.661 0.699 13.473 1.00 0.23 H new ATOM 0 HB2 ASP A 90 3.240 0.848 14.391 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.761 0.002 12.934 1.00 0.26 H new ATOM 1370 N GLY A 91 4.128 0.250 10.581 1.00 0.20 N ATOM 1371 CA GLY A 91 4.362 -0.264 9.239 1.00 0.21 C ATOM 1372 C GLY A 91 3.685 -1.594 8.971 1.00 0.22 C ATOM 1373 O GLY A 91 2.528 -1.789 9.330 1.00 0.37 O ATOM 0 H GLY A 91 3.246 0.748 10.699 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.008 0.467 8.512 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.435 -0.374 9.083 1.00 0.21 H new ATOM 1377 N VAL A 92 4.395 -2.502 8.314 1.00 0.26 N ATOM 1378 CA VAL A 92 3.854 -3.824 8.025 1.00 0.26 C ATOM 1379 C VAL A 92 4.162 -4.762 9.189 1.00 0.24 C ATOM 1380 O VAL A 92 5.251 -4.729 9.759 1.00 0.28 O ATOM 1381 CB VAL A 92 4.413 -4.405 6.701 1.00 0.32 C ATOM 1382 CG1 VAL A 92 5.853 -4.869 6.852 1.00 0.96 C ATOM 1383 CG2 VAL A 92 3.531 -5.536 6.200 1.00 1.03 C ATOM 0 H VAL A 92 5.344 -2.348 7.972 1.00 0.26 H new ATOM 0 HA VAL A 92 2.775 -3.729 7.902 1.00 0.26 H new ATOM 0 HB VAL A 92 4.406 -3.605 5.961 1.00 0.32 H new ATOM 0 HG11 VAL A 92 6.208 -5.269 5.902 1.00 0.96 H new ATOM 0 HG12 VAL A 92 6.478 -4.026 7.146 1.00 0.96 H new ATOM 0 HG13 VAL A 92 5.907 -5.645 7.616 1.00 0.96 H new ATOM 0 HG21 VAL A 92 3.939 -5.931 5.270 1.00 1.03 H new ATOM 0 HG22 VAL A 92 3.497 -6.329 6.947 1.00 1.03 H new ATOM 0 HG23 VAL A 92 2.523 -5.160 6.023 1.00 1.03 H new ATOM 1393 N MET A 93 3.190 -5.575 9.546 1.00 0.22 N ATOM 1394 CA MET A 93 3.260 -6.397 10.740 1.00 0.22 C ATOM 1395 C MET A 93 2.608 -7.755 10.457 1.00 0.22 C ATOM 1396 O MET A 93 2.125 -7.963 9.347 1.00 0.23 O ATOM 1397 CB MET A 93 2.551 -5.654 11.875 1.00 0.21 C ATOM 1398 CG MET A 93 3.223 -4.342 12.244 1.00 0.23 C ATOM 1399 SD MET A 93 4.718 -4.593 13.209 1.00 0.28 S ATOM 1400 CE MET A 93 3.974 -5.046 14.769 1.00 0.27 C ATOM 0 H MET A 93 2.326 -5.686 9.016 1.00 0.22 H new ATOM 0 HA MET A 93 4.294 -6.580 11.033 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.520 -5.457 11.583 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.516 -6.297 12.755 1.00 0.21 H new ATOM 0 HG2 MET A 93 3.467 -3.793 11.335 1.00 0.23 H new ATOM 0 HG3 MET A 93 2.526 -3.725 12.811 1.00 0.23 H new ATOM 0 HE1 MET A 93 4.291 -4.344 15.541 1.00 0.27 H new ATOM 0 HE2 MET A 93 2.888 -5.017 14.676 1.00 0.27 H new ATOM 0 HE3 MET A 93 4.288 -6.053 15.043 1.00 0.27 H new ATOM 1410 N PRO A 94 2.597 -8.697 11.433 1.00 0.25 N ATOM 1411 CA PRO A 94 2.052 -10.050 11.250 1.00 0.30 C ATOM 1412 C PRO A 94 0.800 -10.127 10.364 1.00 0.28 C ATOM 1413 O PRO A 94 0.864 -10.641 9.247 1.00 0.31 O ATOM 1414 CB PRO A 94 1.726 -10.471 12.678 1.00 0.37 C ATOM 1415 CG PRO A 94 2.779 -9.815 13.504 1.00 0.58 C ATOM 1416 CD PRO A 94 3.155 -8.536 12.794 1.00 0.30 C ATOM 0 HA PRO A 94 2.762 -10.691 10.727 1.00 0.30 H new ATOM 0 HB2 PRO A 94 0.729 -10.144 12.971 1.00 0.37 H new ATOM 0 HB3 PRO A 94 1.751 -11.555 12.789 1.00 0.37 H new ATOM 0 HG2 PRO A 94 2.409 -9.606 14.508 1.00 0.58 H new ATOM 0 HG3 PRO A 94 3.646 -10.466 13.613 1.00 0.58 H new ATOM 0 HD2 PRO A 94 2.735 -7.664 13.296 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.236 -8.399 12.767 1.00 0.30 H new ATOM 1424 N GLN A 95 -0.329 -9.606 10.844 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.581 -9.730 10.111 1.00 0.32 C ATOM 1426 C GLN A 95 -1.606 -8.808 8.893 1.00 0.31 C ATOM 1427 O GLN A 95 -2.355 -9.030 7.947 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.785 -9.453 11.015 1.00 0.37 C ATOM 1429 CG GLN A 95 -3.011 -7.987 11.339 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.361 -7.741 12.006 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -5.364 -7.545 11.329 1.00 0.75 O ATOM 1432 NE2 GLN A 95 -4.400 -7.725 13.336 1.00 0.34 N ATOM 0 H GLN A 95 -0.399 -9.100 11.727 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.648 -10.760 9.760 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.681 -9.847 10.535 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -2.655 -10.002 11.948 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.215 -7.636 11.995 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.950 -7.401 10.422 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -3.549 -7.892 13.873 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -5.281 -7.546 13.818 1.00 0.34 H new ATOM 1441 N THR A 96 -0.763 -7.789 8.928 1.00 0.26 N ATOM 1442 CA THR A 96 -0.652 -6.841 7.829 1.00 0.25 C ATOM 1443 C THR A 96 -0.081 -7.542 6.618 1.00 0.25 C ATOM 1444 O THR A 96 -0.559 -7.378 5.496 1.00 0.31 O ATOM 1445 CB THR A 96 0.269 -5.681 8.201 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.393 -5.623 9.618 1.00 0.24 O ATOM 1447 CG2 THR A 96 -0.277 -4.365 7.677 1.00 0.28 C ATOM 0 H THR A 96 -0.140 -7.595 9.712 1.00 0.26 H new ATOM 0 HA THR A 96 -1.646 -6.450 7.612 1.00 0.25 H new ATOM 0 HB THR A 96 1.246 -5.846 7.747 1.00 0.25 H new ATOM 0 HG1 THR A 96 0.821 -4.779 9.875 1.00 0.24 H new ATOM 0 HG21 THR A 96 0.397 -3.555 7.955 1.00 0.28 H new ATOM 0 HG22 THR A 96 -0.359 -4.412 6.591 1.00 0.28 H new ATOM 0 HG23 THR A 96 -1.261 -4.182 8.108 1.00 0.28 H new ATOM 1455 N VAL A 97 0.943 -8.344 6.865 1.00 0.25 N ATOM 1456 CA VAL A 97 1.580 -9.088 5.814 1.00 0.31 C ATOM 1457 C VAL A 97 0.649 -10.131 5.256 1.00 0.23 C ATOM 1458 O VAL A 97 0.552 -10.297 4.051 1.00 0.24 O ATOM 1459 CB VAL A 97 2.826 -9.830 6.279 1.00 0.48 C ATOM 1460 CG1 VAL A 97 3.437 -10.502 5.087 1.00 1.02 C ATOM 1461 CG2 VAL A 97 3.817 -8.910 6.940 1.00 1.38 C ATOM 0 H VAL A 97 1.345 -8.490 7.791 1.00 0.25 H new ATOM 0 HA VAL A 97 1.854 -8.344 5.066 1.00 0.31 H new ATOM 0 HB VAL A 97 2.544 -10.568 7.030 1.00 0.48 H new ATOM 0 HG11 VAL A 97 4.333 -11.042 5.393 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.721 -11.202 4.657 1.00 1.02 H new ATOM 0 HG13 VAL A 97 3.702 -9.751 4.342 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.690 -9.482 7.256 1.00 1.38 H new ATOM 0 HG22 VAL A 97 4.124 -8.139 6.234 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.355 -8.443 7.810 1.00 1.38 H new ATOM 1471 N GLU A 98 -0.026 -10.840 6.138 1.00 0.24 N ATOM 1472 CA GLU A 98 -0.878 -11.945 5.716 1.00 0.29 C ATOM 1473 C GLU A 98 -2.051 -11.422 4.893 1.00 0.31 C ATOM 1474 O GLU A 98 -2.733 -12.181 4.200 1.00 0.37 O ATOM 1475 CB GLU A 98 -1.353 -12.733 6.931 1.00 0.39 C ATOM 1476 CG GLU A 98 -0.200 -13.253 7.780 1.00 0.92 C ATOM 1477 CD GLU A 98 0.717 -14.196 7.020 1.00 1.64 C ATOM 1478 OE1 GLU A 98 1.666 -13.717 6.357 1.00 2.35 O ATOM 1479 OE2 GLU A 98 0.496 -15.423 7.089 1.00 1.97 O ATOM 0 H GLU A 98 -0.005 -10.677 7.145 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.304 -12.621 5.083 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -1.993 -12.098 7.544 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -1.962 -13.573 6.599 1.00 0.39 H new ATOM 0 HG2 GLU A 98 0.382 -12.409 8.150 1.00 0.92 H new ATOM 0 HG3 GLU A 98 -0.602 -13.769 8.652 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.264 -10.117 4.967 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.206 -9.442 4.102 1.00 0.35 C ATOM 1488 C ALA A 99 -2.559 -9.150 2.747 1.00 0.34 C ATOM 1489 O ALA A 99 -3.186 -9.313 1.700 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.687 -8.160 4.761 1.00 0.39 C ATOM 0 H ALA A 99 -1.788 -9.502 5.627 1.00 0.31 H new ATOM 0 HA ALA A 99 -4.068 -10.088 3.936 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.396 -7.657 4.104 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -4.174 -8.398 5.707 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.836 -7.505 4.946 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.282 -8.782 2.767 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.569 -8.448 1.552 1.00 0.29 C ATOM 1498 C ILE A 100 -0.266 -9.716 0.781 1.00 0.29 C ATOM 1499 O ILE A 100 -0.418 -9.782 -0.436 1.00 0.34 O ATOM 1500 CB ILE A 100 0.746 -7.728 1.881 1.00 0.32 C ATOM 1501 CG1 ILE A 100 0.465 -6.354 2.486 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.606 -7.613 0.638 1.00 0.36 C ATOM 1503 CD1 ILE A 100 1.700 -5.669 3.028 1.00 0.41 C ATOM 0 H ILE A 100 -0.723 -8.709 3.617 1.00 0.28 H new ATOM 0 HA ILE A 100 -1.192 -7.787 0.950 1.00 0.29 H new ATOM 0 HB ILE A 100 1.294 -8.314 2.619 1.00 0.32 H new ATOM 0 HG12 ILE A 100 0.010 -5.718 1.727 1.00 0.35 H new ATOM 0 HG13 ILE A 100 -0.263 -6.462 3.290 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.536 -7.100 0.885 1.00 0.36 H new ATOM 0 HG22 ILE A 100 1.831 -8.609 0.258 1.00 0.36 H new ATOM 0 HG23 ILE A 100 1.071 -7.046 -0.124 1.00 0.36 H new ATOM 0 HD11 ILE A 100 1.426 -4.699 3.442 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.144 -6.285 3.810 1.00 0.41 H new ATOM 0 HD13 ILE A 100 2.421 -5.529 2.223 1.00 0.41 H new ATOM 1515 N ASN A 101 0.145 -10.726 1.525 1.00 0.29 N ATOM 1516 CA ASN A 101 0.445 -12.040 0.986 1.00 0.34 C ATOM 1517 C ASN A 101 -0.768 -12.613 0.276 1.00 0.36 C ATOM 1518 O ASN A 101 -0.636 -13.358 -0.691 1.00 0.43 O ATOM 1519 CB ASN A 101 0.893 -12.965 2.126 1.00 0.44 C ATOM 1520 CG ASN A 101 2.383 -12.944 2.341 1.00 0.53 C ATOM 1521 OD1 ASN A 101 3.157 -12.812 1.394 1.00 0.67 O ATOM 1522 ND2 ASN A 101 2.796 -13.056 3.587 1.00 0.64 N ATOM 0 H ASN A 101 0.282 -10.656 2.533 1.00 0.29 H new ATOM 0 HA ASN A 101 1.251 -11.955 0.257 1.00 0.34 H new ATOM 0 HB2 ASN A 101 0.393 -12.667 3.048 1.00 0.44 H new ATOM 0 HB3 ASN A 101 0.576 -13.985 1.907 1.00 0.44 H new ATOM 0 HD21 ASN A 101 3.794 -13.035 3.797 1.00 0.64 H new ATOM 0 HD22 ASN A 101 2.118 -13.164 4.341 1.00 0.64 H new ATOM 1529 N HIS A 102 -1.947 -12.239 0.743 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.175 -12.674 0.118 1.00 0.43 C ATOM 1531 C HIS A 102 -3.467 -11.813 -1.108 1.00 0.37 C ATOM 1532 O HIS A 102 -3.936 -12.301 -2.135 1.00 0.41 O ATOM 1533 CB HIS A 102 -4.328 -12.595 1.124 1.00 0.61 C ATOM 1534 CG HIS A 102 -5.518 -13.406 0.731 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -6.043 -14.405 1.519 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -6.278 -13.365 -0.379 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -7.073 -14.952 0.902 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -7.240 -14.339 -0.256 1.00 1.91 N ATOM 0 H HIS A 102 -2.075 -11.634 1.554 1.00 0.35 H new ATOM 0 HA HIS A 102 -3.069 -13.710 -0.205 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -3.974 -12.933 2.098 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -4.629 -11.554 1.238 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.155 -12.690 -1.213 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -7.677 -15.764 1.280 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -7.962 -14.553 -0.944 1.00 1.91 H new ATOM 1547 N ALA A 103 -3.167 -10.524 -0.996 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.429 -9.583 -2.073 1.00 0.41 C ATOM 1549 C ALA A 103 -2.489 -9.809 -3.257 1.00 0.40 C ATOM 1550 O ALA A 103 -2.923 -9.784 -4.407 1.00 0.44 O ATOM 1551 CB ALA A 103 -3.318 -8.146 -1.573 1.00 0.47 C ATOM 0 H ALA A 103 -2.741 -10.108 -0.168 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.448 -9.756 -2.418 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -3.518 -7.458 -2.395 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -4.044 -7.981 -0.777 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -2.313 -7.971 -1.190 1.00 0.47 H new ATOM 1557 N LYS A 104 -1.203 -10.047 -2.987 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.236 -10.240 -4.062 1.00 0.49 C ATOM 1559 C LYS A 104 -0.445 -11.584 -4.713 1.00 0.54 C ATOM 1560 O LYS A 104 -0.186 -11.762 -5.902 1.00 0.66 O ATOM 1561 CB LYS A 104 1.192 -10.158 -3.545 1.00 0.61 C ATOM 1562 CG LYS A 104 1.464 -8.940 -2.692 1.00 0.70 C ATOM 1563 CD LYS A 104 1.014 -7.639 -3.358 1.00 0.84 C ATOM 1564 CE LYS A 104 1.460 -7.530 -4.813 1.00 0.99 C ATOM 1565 NZ LYS A 104 2.935 -7.583 -4.976 1.00 1.66 N ATOM 0 H LYS A 104 -0.814 -10.109 -2.046 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.391 -9.444 -4.790 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.410 -11.053 -2.963 1.00 0.61 H new ATOM 0 HB3 LYS A 104 1.876 -10.156 -4.394 1.00 0.61 H new ATOM 0 HG2 LYS A 104 0.952 -9.050 -1.736 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.531 -8.883 -2.477 1.00 0.70 H new ATOM 0 HD2 LYS A 104 -0.073 -7.570 -3.311 1.00 0.84 H new ATOM 0 HD3 LYS A 104 1.412 -6.793 -2.797 1.00 0.84 H new ATOM 0 HE2 LYS A 104 1.008 -8.339 -5.387 1.00 0.99 H new ATOM 0 HE3 LYS A 104 1.088 -6.595 -5.232 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 3.170 -7.658 -5.986 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 3.359 -6.717 -4.585 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 3.311 -8.411 -4.471 1.00 1.66 H new ATOM 1579 N ALA A 105 -0.884 -12.528 -3.902 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.278 -13.845 -4.398 1.00 0.61 C ATOM 1581 C ALA A 105 -2.250 -13.715 -5.569 1.00 0.62 C ATOM 1582 O ALA A 105 -2.110 -14.391 -6.592 1.00 0.77 O ATOM 1583 CB ALA A 105 -1.900 -14.676 -3.284 1.00 0.65 C ATOM 0 H ALA A 105 -0.979 -12.412 -2.893 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.381 -14.355 -4.750 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.186 -15.652 -3.675 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.176 -14.805 -2.479 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -2.783 -14.166 -2.900 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.225 -12.826 -5.421 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.182 -12.553 -6.487 1.00 0.64 C ATOM 1591 C ALA A 106 -3.590 -11.579 -7.504 1.00 0.64 C ATOM 1592 O ALA A 106 -3.969 -11.591 -8.677 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.472 -11.996 -5.901 1.00 0.68 C ATOM 0 H ALA A 106 -3.374 -12.281 -4.572 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.407 -13.487 -7.002 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.180 -11.795 -6.705 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -5.902 -12.723 -5.212 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.259 -11.071 -5.366 1.00 0.68 H new ATOM 1599 N ASN A 107 -2.658 -10.750 -7.035 1.00 0.59 N ATOM 1600 CA ASN A 107 -1.972 -9.753 -7.864 1.00 0.65 C ATOM 1601 C ASN A 107 -2.949 -8.706 -8.373 1.00 0.60 C ATOM 1602 O ASN A 107 -3.519 -8.833 -9.458 1.00 0.85 O ATOM 1603 CB ASN A 107 -1.241 -10.397 -9.032 1.00 0.85 C ATOM 1604 CG ASN A 107 -0.345 -9.430 -9.767 1.00 1.04 C ATOM 1605 OD1 ASN A 107 0.197 -8.489 -9.183 1.00 1.17 O ATOM 1606 ND2 ASN A 107 -0.180 -9.657 -11.055 1.00 1.41 N ATOM 0 H ASN A 107 -2.354 -10.750 -6.061 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.231 -9.265 -7.231 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -0.643 -11.231 -8.665 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -1.971 -10.810 -9.728 1.00 0.85 H new ATOM 0 HD21 ASN A 107 0.416 -9.042 -11.609 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -0.648 -10.448 -11.498 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.132 -7.665 -7.579 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.086 -6.619 -7.890 1.00 0.42 C ATOM 1615 C VAL A 108 -3.533 -5.265 -7.448 1.00 0.37 C ATOM 1616 O VAL A 108 -2.681 -5.207 -6.554 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.445 -6.897 -7.194 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -5.722 -5.890 -6.084 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.575 -6.923 -8.211 1.00 1.35 C ATOM 0 H VAL A 108 -2.625 -7.523 -6.705 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.249 -6.602 -8.968 1.00 0.42 H new ATOM 0 HB VAL A 108 -5.386 -7.881 -6.729 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -6.682 -6.116 -5.619 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -4.933 -5.949 -5.334 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -5.750 -4.884 -6.504 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -7.518 -7.119 -7.702 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -6.630 -5.960 -8.718 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -6.388 -7.708 -8.943 1.00 1.35 H new ATOM 1629 N PRO A 109 -3.978 -4.170 -8.088 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.612 -2.818 -7.676 1.00 0.33 C ATOM 1631 C PRO A 109 -4.079 -2.509 -6.258 1.00 0.28 C ATOM 1632 O PRO A 109 -5.192 -2.875 -5.852 1.00 0.29 O ATOM 1633 CB PRO A 109 -4.334 -1.904 -8.663 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.748 -2.776 -9.801 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.857 -4.174 -9.266 1.00 0.40 C ATOM 0 HA PRO A 109 -2.530 -2.687 -7.677 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -5.199 -1.433 -8.197 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.679 -1.102 -9.004 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.701 -2.445 -10.213 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -4.018 -2.728 -10.609 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.884 -4.420 -8.997 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.535 -4.910 -10.003 1.00 0.40 H new ATOM 1643 N ILE A 110 -3.248 -1.812 -5.503 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.564 -1.586 -4.111 1.00 0.21 C ATOM 1645 C ILE A 110 -3.686 -0.105 -3.790 1.00 0.19 C ATOM 1646 O ILE A 110 -3.143 0.760 -4.475 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.541 -2.285 -3.181 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -2.817 -3.794 -3.151 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.535 -1.708 -1.769 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -2.441 -4.455 -1.845 1.00 0.60 C ATOM 0 H ILE A 110 -2.370 -1.403 -5.824 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.540 -2.034 -3.926 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.548 -2.102 -3.591 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -3.876 -3.964 -3.342 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -2.266 -4.271 -3.961 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.799 -2.237 -1.163 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.278 -0.649 -1.810 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.523 -1.825 -1.324 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -2.665 -5.520 -1.899 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -1.376 -4.317 -1.661 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -3.011 -4.005 -1.032 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.421 0.141 -2.730 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.662 1.467 -2.200 1.00 0.18 C ATOM 1664 C ILE A 111 -4.255 1.455 -0.741 1.00 0.16 C ATOM 1665 O ILE A 111 -5.071 1.224 0.149 1.00 0.18 O ATOM 1666 CB ILE A 111 -6.151 1.893 -2.315 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.542 2.092 -3.775 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.413 3.181 -1.532 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.951 3.342 -4.378 1.00 0.37 C ATOM 0 H ILE A 111 -4.882 -0.596 -2.196 1.00 0.18 H new ATOM 0 HA ILE A 111 -4.082 2.186 -2.779 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.759 1.094 -1.890 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -6.217 1.227 -4.354 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.628 2.137 -3.852 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.463 3.458 -1.628 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -6.175 3.022 -0.480 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.788 3.981 -1.929 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -6.265 3.428 -5.418 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -6.297 4.213 -3.821 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.863 3.289 -4.331 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.982 1.632 -0.490 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.521 1.652 0.864 1.00 0.18 C ATOM 1683 C VAL A 112 -2.871 2.976 1.478 1.00 0.20 C ATOM 1684 O VAL A 112 -2.930 3.994 0.805 1.00 0.22 O ATOM 1685 CB VAL A 112 -1.014 1.429 0.991 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.650 1.236 2.427 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.579 0.218 0.222 1.00 0.19 C ATOM 0 H VAL A 112 -2.260 1.762 -1.198 1.00 0.16 H new ATOM 0 HA VAL A 112 -3.012 0.828 1.382 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.512 2.308 0.586 1.00 0.19 H new ATOM 0 HG11 VAL A 112 0.425 1.077 2.512 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.932 2.122 2.996 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -1.177 0.368 2.822 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.497 0.085 0.331 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -1.094 -0.662 0.607 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.823 0.349 -0.832 1.00 0.19 H new ATOM 1697 N ALA A 113 -3.110 2.939 2.745 1.00 0.21 N ATOM 1698 CA ALA A 113 -3.473 4.117 3.475 1.00 0.24 C ATOM 1699 C ALA A 113 -2.750 4.154 4.801 1.00 0.25 C ATOM 1700 O ALA A 113 -3.009 3.359 5.705 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.973 4.184 3.644 1.00 0.29 C ATOM 0 H ALA A 113 -3.060 2.091 3.310 1.00 0.21 H new ATOM 0 HA ALA A 113 -3.168 4.999 2.913 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -5.237 5.084 4.200 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -5.449 4.211 2.664 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -5.317 3.306 4.190 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.816 5.075 4.878 1.00 0.24 N ATOM 1708 CA ILE A 114 -1.006 5.263 6.050 1.00 0.27 C ATOM 1709 C ILE A 114 -1.819 5.971 7.117 1.00 0.30 C ATOM 1710 O ILE A 114 -2.478 6.942 6.828 1.00 0.50 O ATOM 1711 CB ILE A 114 0.256 6.092 5.712 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.246 5.269 4.881 1.00 0.38 C ATOM 1713 CG2 ILE A 114 0.920 6.611 6.969 1.00 0.44 C ATOM 1714 CD1 ILE A 114 0.897 5.184 3.409 1.00 0.59 C ATOM 0 H ILE A 114 -1.599 5.719 4.118 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.688 4.288 6.420 1.00 0.27 H new ATOM 0 HB ILE A 114 -0.060 6.949 5.117 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.240 5.705 4.983 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.297 4.260 5.290 1.00 0.38 H new ATOM 0 HG21 ILE A 114 1.804 7.190 6.701 1.00 0.44 H new ATOM 0 HG22 ILE A 114 0.222 7.246 7.514 1.00 0.44 H new ATOM 0 HG23 ILE A 114 1.213 5.771 7.599 1.00 0.44 H new ATOM 0 HD11 ILE A 114 1.646 4.585 2.891 1.00 0.59 H new ATOM 0 HD12 ILE A 114 -0.082 4.719 3.293 1.00 0.59 H new ATOM 0 HD13 ILE A 114 0.876 6.187 2.982 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.779 5.473 8.331 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.479 6.097 9.444 1.00 0.22 C ATOM 1728 C ASN A 115 -1.445 6.592 10.403 1.00 0.20 C ATOM 1729 O ASN A 115 -0.261 6.280 10.257 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.408 5.085 10.120 1.00 0.33 C ATOM 1731 CG ASN A 115 -4.233 5.713 11.224 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -4.562 6.899 11.167 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -4.562 4.933 12.233 1.00 0.56 N ATOM 0 H ASN A 115 -1.265 4.628 8.581 1.00 0.19 H new ATOM 0 HA ASN A 115 -3.097 6.925 9.096 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -4.073 4.651 9.374 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -2.815 4.269 10.532 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -5.111 5.306 13.008 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -4.268 3.956 12.239 1.00 0.56 H new ATOM 1740 N LYS A 116 -1.885 7.383 11.350 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.026 7.884 12.375 1.00 0.20 C ATOM 1742 C LYS A 116 -0.069 8.946 11.849 1.00 0.21 C ATOM 1743 O LYS A 116 1.053 9.078 12.322 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.293 6.719 13.031 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.152 5.957 14.019 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.318 5.012 14.863 1.00 0.40 C ATOM 1747 CE LYS A 116 -1.163 3.954 15.567 1.00 0.51 C ATOM 1748 NZ LYS A 116 -0.308 2.946 16.250 1.00 0.59 N ATOM 0 H LYS A 116 -2.853 7.694 11.425 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.632 8.383 13.131 1.00 0.20 H new ATOM 0 HB2 LYS A 116 0.055 6.034 12.257 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.592 7.097 13.544 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -1.675 6.660 14.667 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -1.913 5.392 13.481 1.00 0.32 H new ATOM 0 HD2 LYS A 116 0.420 4.520 14.229 1.00 0.40 H new ATOM 0 HD3 LYS A 116 0.233 5.586 15.608 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -1.817 4.433 16.296 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -1.806 3.457 14.841 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -0.786 2.022 16.241 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 0.603 2.870 15.754 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -0.143 3.240 17.234 1.00 0.59 H new ATOM 1762 N MET A 117 -0.532 9.698 10.857 1.00 0.21 N ATOM 1763 CA MET A 117 0.145 10.926 10.440 1.00 0.28 C ATOM 1764 C MET A 117 -0.070 12.007 11.478 1.00 0.29 C ATOM 1765 O MET A 117 0.607 13.035 11.482 1.00 0.37 O ATOM 1766 CB MET A 117 -0.367 11.401 9.087 1.00 0.38 C ATOM 1767 CG MET A 117 0.315 10.703 7.939 1.00 0.48 C ATOM 1768 SD MET A 117 2.029 11.194 7.776 1.00 0.77 S ATOM 1769 CE MET A 117 2.567 9.902 6.689 1.00 0.92 C ATOM 0 H MET A 117 -1.374 9.481 10.324 1.00 0.21 H new ATOM 0 HA MET A 117 1.210 10.715 10.347 1.00 0.28 H new ATOM 0 HB2 MET A 117 -1.442 11.229 9.027 1.00 0.38 H new ATOM 0 HB3 MET A 117 -0.211 12.476 8.999 1.00 0.38 H new ATOM 0 HG2 MET A 117 0.260 9.624 8.086 1.00 0.48 H new ATOM 0 HG3 MET A 117 -0.215 10.926 7.013 1.00 0.48 H new ATOM 0 HE1 MET A 117 3.299 9.277 7.201 1.00 0.92 H new ATOM 0 HE2 MET A 117 1.712 9.293 6.396 1.00 0.92 H new ATOM 0 HE3 MET A 117 3.022 10.340 5.800 1.00 0.92 H new ATOM 1779 N ASP A 118 -1.036 11.758 12.349 1.00 0.27 N ATOM 1780 CA ASP A 118 -1.270 12.609 13.509 1.00 0.34 C ATOM 1781 C ASP A 118 -0.127 12.435 14.483 1.00 0.33 C ATOM 1782 O ASP A 118 0.129 13.283 15.337 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.573 12.229 14.207 1.00 0.39 C ATOM 1784 CG ASP A 118 -2.540 10.815 14.752 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -2.604 9.865 13.940 1.00 0.67 O ATOM 1786 OD2 ASP A 118 -2.475 10.649 15.987 1.00 0.76 O ATOM 0 H ASP A 118 -1.676 10.967 12.274 1.00 0.27 H new ATOM 0 HA ASP A 118 -1.339 13.644 13.175 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -2.763 12.927 15.023 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.401 12.327 13.505 1.00 0.39 H new ATOM 1791 N LYS A 119 0.538 11.306 14.344 1.00 0.23 N ATOM 1792 CA LYS A 119 1.648 10.954 15.201 1.00 0.26 C ATOM 1793 C LYS A 119 2.952 11.491 14.635 1.00 0.28 C ATOM 1794 O LYS A 119 3.234 11.343 13.452 1.00 0.26 O ATOM 1795 CB LYS A 119 1.734 9.435 15.332 1.00 0.29 C ATOM 1796 CG LYS A 119 0.511 8.790 15.971 1.00 0.36 C ATOM 1797 CD LYS A 119 0.522 8.911 17.491 1.00 0.72 C ATOM 1798 CE LYS A 119 0.164 10.315 17.952 1.00 0.87 C ATOM 1799 NZ LYS A 119 0.331 10.482 19.420 1.00 1.17 N ATOM 0 H LYS A 119 0.323 10.607 13.633 1.00 0.23 H new ATOM 0 HA LYS A 119 1.484 11.398 16.183 1.00 0.26 H new ATOM 0 HB2 LYS A 119 1.881 9.005 14.341 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.614 9.182 15.923 1.00 0.29 H new ATOM 0 HG2 LYS A 119 -0.391 9.258 15.578 1.00 0.36 H new ATOM 0 HG3 LYS A 119 0.471 7.737 15.693 1.00 0.36 H new ATOM 0 HD2 LYS A 119 -0.184 8.198 17.917 1.00 0.72 H new ATOM 0 HD3 LYS A 119 1.509 8.646 17.869 1.00 0.72 H new ATOM 0 HE2 LYS A 119 0.792 11.038 17.432 1.00 0.87 H new ATOM 0 HE3 LYS A 119 -0.868 10.534 17.678 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 0.076 11.453 19.690 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 -0.287 9.810 19.918 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 1.321 10.299 19.680 1.00 1.17 H new ATOM 1813 N PRO A 120 3.770 12.125 15.487 1.00 0.38 N ATOM 1814 CA PRO A 120 5.117 12.578 15.112 1.00 0.45 C ATOM 1815 C PRO A 120 6.028 11.401 14.771 1.00 0.40 C ATOM 1816 O PRO A 120 7.128 11.568 14.244 1.00 0.45 O ATOM 1817 CB PRO A 120 5.631 13.283 16.369 1.00 0.57 C ATOM 1818 CG PRO A 120 4.770 12.791 17.482 1.00 0.58 C ATOM 1819 CD PRO A 120 3.436 12.475 16.874 1.00 0.48 C ATOM 0 HA PRO A 120 5.100 13.217 14.229 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.680 13.047 16.550 1.00 0.57 H new ATOM 0 HB3 PRO A 120 5.561 14.366 16.268 1.00 0.57 H new ATOM 0 HG2 PRO A 120 5.204 11.906 17.948 1.00 0.58 H new ATOM 0 HG3 PRO A 120 4.673 13.547 18.262 1.00 0.58 H new ATOM 0 HD2 PRO A 120 2.944 11.650 17.390 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.760 13.329 16.922 1.00 0.48 H new ATOM 1827 N GLU A 121 5.546 10.214 15.099 1.00 0.35 N ATOM 1828 CA GLU A 121 6.252 8.971 14.832 1.00 0.37 C ATOM 1829 C GLU A 121 5.955 8.487 13.417 1.00 0.30 C ATOM 1830 O GLU A 121 6.407 7.420 13.004 1.00 0.37 O ATOM 1831 CB GLU A 121 5.812 7.924 15.853 1.00 0.48 C ATOM 1832 CG GLU A 121 5.825 8.458 17.272 1.00 0.62 C ATOM 1833 CD GLU A 121 5.239 7.489 18.275 1.00 1.04 C ATOM 1834 OE1 GLU A 121 4.002 7.453 18.422 1.00 1.45 O ATOM 1835 OE2 GLU A 121 6.015 6.738 18.901 1.00 1.40 O ATOM 0 H GLU A 121 4.646 10.084 15.562 1.00 0.35 H new ATOM 0 HA GLU A 121 7.326 9.135 14.916 1.00 0.37 H new ATOM 0 HB2 GLU A 121 4.807 7.580 15.607 1.00 0.48 H new ATOM 0 HB3 GLU A 121 6.471 7.058 15.788 1.00 0.48 H new ATOM 0 HG2 GLU A 121 6.851 8.691 17.557 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.264 9.392 17.308 1.00 0.62 H new ATOM 1842 N ALA A 122 5.173 9.283 12.695 1.00 0.24 N ATOM 1843 CA ALA A 122 4.844 9.007 11.302 1.00 0.22 C ATOM 1844 C ALA A 122 6.100 8.850 10.466 1.00 0.21 C ATOM 1845 O ALA A 122 6.810 9.820 10.193 1.00 0.26 O ATOM 1846 CB ALA A 122 3.972 10.117 10.737 1.00 0.27 C ATOM 0 H ALA A 122 4.750 10.137 13.059 1.00 0.24 H new ATOM 0 HA ALA A 122 4.291 8.068 11.264 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.734 9.898 9.696 1.00 0.27 H new ATOM 0 HB2 ALA A 122 3.050 10.185 11.314 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.507 11.065 10.795 1.00 0.27 H new ATOM 1852 N ASN A 123 6.387 7.622 10.072 1.00 0.21 N ATOM 1853 CA ASN A 123 7.488 7.365 9.164 1.00 0.23 C ATOM 1854 C ASN A 123 6.950 6.670 7.933 1.00 0.23 C ATOM 1855 O ASN A 123 7.115 5.466 7.749 1.00 0.25 O ATOM 1856 CB ASN A 123 8.566 6.509 9.820 1.00 0.26 C ATOM 1857 CG ASN A 123 9.929 7.101 9.665 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.362 7.933 10.462 1.00 0.95 O ATOM 1859 ND2 ASN A 123 10.619 6.677 8.646 1.00 0.52 N ATOM 0 H ASN A 123 5.874 6.791 10.366 1.00 0.21 H new ATOM 0 HA ASN A 123 7.947 8.315 8.891 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.340 6.393 10.880 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.553 5.512 9.381 1.00 0.26 H new ATOM 0 HD21 ASN A 123 11.560 7.036 8.482 1.00 0.52 H new ATOM 0 HD22 ASN A 123 10.219 5.986 8.011 1.00 0.52 H new ATOM 1866 N PRO A 124 6.311 7.446 7.064 1.00 0.25 N ATOM 1867 CA PRO A 124 5.581 6.921 5.913 1.00 0.32 C ATOM 1868 C PRO A 124 6.472 6.267 4.894 1.00 0.33 C ATOM 1869 O PRO A 124 6.266 5.117 4.532 1.00 0.35 O ATOM 1870 CB PRO A 124 4.940 8.155 5.324 1.00 0.40 C ATOM 1871 CG PRO A 124 5.795 9.290 5.765 1.00 0.32 C ATOM 1872 CD PRO A 124 6.241 8.916 7.139 1.00 0.27 C ATOM 0 HA PRO A 124 4.879 6.141 6.207 1.00 0.32 H new ATOM 0 HB2 PRO A 124 4.896 8.095 4.237 1.00 0.40 H new ATOM 0 HB3 PRO A 124 3.916 8.273 5.678 1.00 0.40 H new ATOM 0 HG2 PRO A 124 6.645 9.429 5.097 1.00 0.32 H new ATOM 0 HG3 PRO A 124 5.238 10.227 5.771 1.00 0.32 H new ATOM 0 HD2 PRO A 124 7.207 9.356 7.386 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.535 9.250 7.900 1.00 0.27 H new ATOM 1880 N ASP A 125 7.455 7.019 4.444 1.00 0.37 N ATOM 1881 CA ASP A 125 8.436 6.533 3.482 1.00 0.44 C ATOM 1882 C ASP A 125 9.025 5.214 3.948 1.00 0.34 C ATOM 1883 O ASP A 125 9.405 4.366 3.140 1.00 0.33 O ATOM 1884 CB ASP A 125 9.551 7.562 3.304 1.00 0.61 C ATOM 1885 CG ASP A 125 9.012 8.932 2.961 1.00 0.99 C ATOM 1886 OD1 ASP A 125 8.734 9.183 1.771 1.00 1.13 O ATOM 1887 OD2 ASP A 125 8.885 9.779 3.867 1.00 1.44 O ATOM 0 H ASP A 125 7.601 7.986 4.732 1.00 0.37 H new ATOM 0 HA ASP A 125 7.936 6.378 2.526 1.00 0.44 H new ATOM 0 HB2 ASP A 125 10.137 7.623 4.221 1.00 0.61 H new ATOM 0 HB3 ASP A 125 10.227 7.231 2.515 1.00 0.61 H new ATOM 1892 N ARG A 126 9.040 5.024 5.259 1.00 0.31 N ATOM 1893 CA ARG A 126 9.601 3.815 5.831 1.00 0.31 C ATOM 1894 C ARG A 126 8.597 2.686 5.721 1.00 0.27 C ATOM 1895 O ARG A 126 8.876 1.647 5.134 1.00 0.30 O ATOM 1896 CB ARG A 126 9.991 4.036 7.294 1.00 0.35 C ATOM 1897 CG ARG A 126 10.575 2.805 7.972 1.00 0.51 C ATOM 1898 CD ARG A 126 11.805 2.299 7.239 1.00 1.24 C ATOM 1899 NE ARG A 126 12.416 1.147 7.901 1.00 1.92 N ATOM 1900 CZ ARG A 126 13.373 0.403 7.353 1.00 2.94 C ATOM 1901 NH1 ARG A 126 13.780 0.658 6.115 1.00 3.49 N ATOM 1902 NH2 ARG A 126 13.925 -0.583 8.044 1.00 3.79 N ATOM 0 H ARG A 126 8.672 5.688 5.940 1.00 0.31 H new ATOM 0 HA ARG A 126 10.502 3.551 5.277 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.718 4.847 7.347 1.00 0.35 H new ATOM 0 HB3 ARG A 126 9.111 4.360 7.849 1.00 0.35 H new ATOM 0 HG2 ARG A 126 10.837 3.045 9.002 1.00 0.51 H new ATOM 0 HG3 ARG A 126 9.823 2.017 8.010 1.00 0.51 H new ATOM 0 HD2 ARG A 126 11.530 2.025 6.220 1.00 1.24 H new ATOM 0 HD3 ARG A 126 12.537 3.103 7.166 1.00 1.24 H new ATOM 0 HE ARG A 126 12.090 0.900 8.835 1.00 1.92 H new ATOM 0 HH11 ARG A 126 13.359 1.423 5.587 1.00 3.49 H new ATOM 0 HH12 ARG A 126 14.514 0.089 5.692 1.00 3.49 H new ATOM 0 HH21 ARG A 126 13.616 -0.773 8.998 1.00 3.79 H new ATOM 0 HH22 ARG A 126 14.659 -1.153 7.623 1.00 3.79 H new ATOM 1916 N VAL A 127 7.416 2.921 6.264 1.00 0.25 N ATOM 1917 CA VAL A 127 6.366 1.912 6.280 1.00 0.28 C ATOM 1918 C VAL A 127 5.874 1.570 4.869 1.00 0.28 C ATOM 1919 O VAL A 127 5.470 0.432 4.594 1.00 0.33 O ATOM 1920 CB VAL A 127 5.198 2.339 7.204 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.747 2.654 8.582 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.408 3.531 6.665 1.00 0.44 C ATOM 0 H VAL A 127 7.157 3.805 6.702 1.00 0.25 H new ATOM 0 HA VAL A 127 6.799 1.000 6.690 1.00 0.28 H new ATOM 0 HB VAL A 127 4.497 1.506 7.251 1.00 0.36 H new ATOM 0 HG11 VAL A 127 4.931 2.956 9.239 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.234 1.768 8.991 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.472 3.465 8.508 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.605 3.779 7.359 1.00 0.44 H new ATOM 0 HG22 VAL A 127 5.072 4.389 6.557 1.00 0.44 H new ATOM 0 HG23 VAL A 127 3.983 3.277 5.694 1.00 0.44 H new ATOM 1932 N MET A 128 5.957 2.529 3.957 1.00 0.27 N ATOM 1933 CA MET A 128 5.563 2.285 2.574 1.00 0.31 C ATOM 1934 C MET A 128 6.672 1.544 1.824 1.00 0.26 C ATOM 1935 O MET A 128 6.425 0.924 0.789 1.00 0.35 O ATOM 1936 CB MET A 128 5.173 3.592 1.870 1.00 0.52 C ATOM 1937 CG MET A 128 6.317 4.544 1.580 1.00 0.81 C ATOM 1938 SD MET A 128 5.740 6.224 1.234 1.00 0.67 S ATOM 1939 CE MET A 128 4.569 5.939 -0.094 1.00 0.46 C ATOM 0 H MET A 128 6.290 3.474 4.146 1.00 0.27 H new ATOM 0 HA MET A 128 4.679 1.647 2.575 1.00 0.31 H new ATOM 0 HB2 MET A 128 4.682 3.345 0.929 1.00 0.52 H new ATOM 0 HB3 MET A 128 4.439 4.111 2.486 1.00 0.52 H new ATOM 0 HG2 MET A 128 6.996 4.564 2.433 1.00 0.81 H new ATOM 0 HG3 MET A 128 6.887 4.175 0.727 1.00 0.81 H new ATOM 0 HE1 MET A 128 3.757 6.663 -0.025 1.00 0.46 H new ATOM 0 HE2 MET A 128 5.073 6.050 -1.054 1.00 0.46 H new ATOM 0 HE3 MET A 128 4.164 4.930 -0.012 1.00 0.46 H new ATOM 1949 N GLN A 129 7.891 1.598 2.358 1.00 0.24 N ATOM 1950 CA GLN A 129 8.979 0.775 1.841 1.00 0.27 C ATOM 1951 C GLN A 129 8.804 -0.677 2.265 1.00 0.30 C ATOM 1952 O GLN A 129 9.167 -1.588 1.526 1.00 0.33 O ATOM 1953 CB GLN A 129 10.341 1.293 2.307 1.00 0.32 C ATOM 1954 CG GLN A 129 11.020 2.199 1.297 1.00 0.42 C ATOM 1955 CD GLN A 129 12.293 2.817 1.831 1.00 0.54 C ATOM 1956 OE1 GLN A 129 13.380 2.258 1.686 1.00 1.17 O ATOM 1957 NE2 GLN A 129 12.166 3.972 2.457 1.00 1.31 N ATOM 0 H GLN A 129 8.147 2.198 3.142 1.00 0.24 H new ATOM 0 HA GLN A 129 8.945 0.834 0.753 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.214 1.836 3.243 1.00 0.32 H new ATOM 0 HB3 GLN A 129 10.992 0.444 2.517 1.00 0.32 H new ATOM 0 HG2 GLN A 129 11.248 1.627 0.398 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.331 2.991 1.005 1.00 0.42 H new ATOM 0 HE21 GLN A 129 11.246 4.401 2.555 1.00 1.31 H new ATOM 0 HE22 GLN A 129 12.988 4.436 2.843 1.00 1.31 H new ATOM 1966 N GLU A 130 8.240 -0.886 3.445 1.00 0.37 N ATOM 1967 CA GLU A 130 7.980 -2.235 3.937 1.00 0.43 C ATOM 1968 C GLU A 130 7.091 -2.984 2.955 1.00 0.36 C ATOM 1969 O GLU A 130 7.354 -4.139 2.593 1.00 0.35 O ATOM 1970 CB GLU A 130 7.284 -2.183 5.299 1.00 0.61 C ATOM 1971 CG GLU A 130 7.839 -1.123 6.228 1.00 0.63 C ATOM 1972 CD GLU A 130 9.229 -1.439 6.742 1.00 1.04 C ATOM 1973 OE1 GLU A 130 10.183 -1.450 5.941 1.00 1.64 O ATOM 1974 OE2 GLU A 130 9.368 -1.690 7.958 1.00 1.63 O ATOM 0 H GLU A 130 7.953 -0.142 4.081 1.00 0.37 H new ATOM 0 HA GLU A 130 8.934 -2.752 4.040 1.00 0.43 H new ATOM 0 HB2 GLU A 130 6.221 -1.999 5.147 1.00 0.61 H new ATOM 0 HB3 GLU A 130 7.373 -3.157 5.780 1.00 0.61 H new ATOM 0 HG2 GLU A 130 7.862 -0.168 5.704 1.00 0.63 H new ATOM 0 HG3 GLU A 130 7.165 -1.005 7.076 1.00 0.63 H new ATOM 1981 N LEU A 131 6.034 -2.311 2.511 1.00 0.36 N ATOM 1982 CA LEU A 131 5.112 -2.907 1.569 1.00 0.37 C ATOM 1983 C LEU A 131 5.775 -3.148 0.227 1.00 0.29 C ATOM 1984 O LEU A 131 5.482 -4.138 -0.437 1.00 0.32 O ATOM 1985 CB LEU A 131 3.880 -2.033 1.389 1.00 0.49 C ATOM 1986 CG LEU A 131 2.797 -2.214 2.446 1.00 0.71 C ATOM 1987 CD1 LEU A 131 3.306 -1.860 3.817 1.00 1.36 C ATOM 1988 CD2 LEU A 131 1.618 -1.347 2.118 1.00 1.18 C ATOM 0 H LEU A 131 5.801 -1.358 2.790 1.00 0.36 H new ATOM 0 HA LEU A 131 4.804 -3.869 1.979 1.00 0.37 H new ATOM 0 HB2 LEU A 131 4.192 -0.989 1.386 1.00 0.49 H new ATOM 0 HB3 LEU A 131 3.448 -2.239 0.410 1.00 0.49 H new ATOM 0 HG LEU A 131 2.501 -3.263 2.447 1.00 0.71 H new ATOM 0 HD11 LEU A 131 2.510 -2.000 4.548 1.00 1.36 H new ATOM 0 HD12 LEU A 131 4.148 -2.504 4.070 1.00 1.36 H new ATOM 0 HD13 LEU A 131 3.630 -0.819 3.827 1.00 1.36 H new ATOM 0 HD21 LEU A 131 0.846 -1.480 2.876 1.00 1.18 H new ATOM 0 HD22 LEU A 131 1.929 -0.303 2.096 1.00 1.18 H new ATOM 0 HD23 LEU A 131 1.220 -1.628 1.143 1.00 1.18 H new ATOM 2000 N MET A 132 6.683 -2.263 -0.179 1.00 0.25 N ATOM 2001 CA MET A 132 7.319 -2.426 -1.477 1.00 0.26 C ATOM 2002 C MET A 132 8.364 -3.531 -1.430 1.00 0.30 C ATOM 2003 O MET A 132 8.897 -3.936 -2.464 1.00 0.37 O ATOM 2004 CB MET A 132 7.920 -1.120 -2.004 1.00 0.32 C ATOM 2005 CG MET A 132 9.201 -0.669 -1.320 1.00 0.88 C ATOM 2006 SD MET A 132 10.684 -1.259 -2.160 1.00 1.60 S ATOM 2007 CE MET A 132 10.457 -0.515 -3.777 1.00 1.61 C ATOM 0 H MET A 132 6.986 -1.449 0.356 1.00 0.25 H new ATOM 0 HA MET A 132 6.539 -2.716 -2.181 1.00 0.26 H new ATOM 0 HB2 MET A 132 8.118 -1.235 -3.070 1.00 0.32 H new ATOM 0 HB3 MET A 132 7.176 -0.330 -1.902 1.00 0.32 H new ATOM 0 HG2 MET A 132 9.221 0.420 -1.278 1.00 0.88 H new ATOM 0 HG3 MET A 132 9.204 -1.028 -0.291 1.00 0.88 H new ATOM 0 HE1 MET A 132 11.428 -0.245 -4.193 1.00 1.61 H new ATOM 0 HE2 MET A 132 9.964 -1.227 -4.439 1.00 1.61 H new ATOM 0 HE3 MET A 132 9.841 0.379 -3.683 1.00 1.61 H new ATOM 2017 N GLU A 133 8.639 -4.033 -0.235 1.00 0.32 N ATOM 2018 CA GLU A 133 9.483 -5.198 -0.091 1.00 0.40 C ATOM 2019 C GLU A 133 8.635 -6.437 -0.321 1.00 0.38 C ATOM 2020 O GLU A 133 9.134 -7.481 -0.734 1.00 0.45 O ATOM 2021 CB GLU A 133 10.159 -5.229 1.273 1.00 0.54 C ATOM 2022 CG GLU A 133 11.156 -4.101 1.465 1.00 0.79 C ATOM 2023 CD GLU A 133 12.302 -4.482 2.371 1.00 1.07 C ATOM 2024 OE1 GLU A 133 12.162 -4.362 3.605 1.00 1.53 O ATOM 2025 OE2 GLU A 133 13.354 -4.912 1.847 1.00 1.67 O ATOM 0 H GLU A 133 8.289 -3.650 0.643 1.00 0.32 H new ATOM 0 HA GLU A 133 10.283 -5.163 -0.830 1.00 0.40 H new ATOM 0 HB2 GLU A 133 9.398 -5.171 2.051 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.670 -6.184 1.398 1.00 0.54 H new ATOM 0 HG2 GLU A 133 11.550 -3.801 0.494 1.00 0.79 H new ATOM 0 HG3 GLU A 133 10.642 -3.235 1.881 1.00 0.79 H new ATOM 2032 N TYR A 134 7.339 -6.299 -0.060 1.00 0.35 N ATOM 2033 CA TYR A 134 6.364 -7.274 -0.525 1.00 0.40 C ATOM 2034 C TYR A 134 5.829 -6.860 -1.898 1.00 0.41 C ATOM 2035 O TYR A 134 4.712 -7.207 -2.293 1.00 0.50 O ATOM 2036 CB TYR A 134 5.249 -7.440 0.495 1.00 0.46 C ATOM 2037 CG TYR A 134 5.664 -8.299 1.670 1.00 0.55 C ATOM 2038 CD1 TYR A 134 5.930 -9.651 1.494 1.00 0.98 C ATOM 2039 CD2 TYR A 134 5.817 -7.762 2.942 1.00 0.88 C ATOM 2040 CE1 TYR A 134 6.331 -10.444 2.550 1.00 1.08 C ATOM 2041 CE2 TYR A 134 6.223 -8.548 4.002 1.00 0.95 C ATOM 2042 CZ TYR A 134 6.478 -9.888 3.799 1.00 0.80 C ATOM 2043 OH TYR A 134 6.890 -10.678 4.851 1.00 0.95 O ATOM 0 H TYR A 134 6.942 -5.523 0.470 1.00 0.35 H new ATOM 0 HA TYR A 134 6.846 -8.245 -0.634 1.00 0.40 H new ATOM 0 HB2 TYR A 134 4.942 -6.459 0.857 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.381 -7.887 0.011 1.00 0.46 H new ATOM 0 HD1 TYR A 134 5.821 -10.090 0.513 1.00 0.98 H new ATOM 0 HD2 TYR A 134 5.615 -6.713 3.104 1.00 0.88 H new ATOM 0 HE1 TYR A 134 6.528 -11.495 2.396 1.00 1.08 H new ATOM 0 HE2 TYR A 134 6.340 -8.116 4.985 1.00 0.95 H new ATOM 0 HH TYR A 134 6.946 -10.135 5.665 1.00 0.95 H new ATOM 2053 N ASN A 135 6.678 -6.116 -2.609 1.00 0.36 N ATOM 2054 CA ASN A 135 6.424 -5.630 -3.960 1.00 0.43 C ATOM 2055 C ASN A 135 5.105 -4.868 -4.046 1.00 0.48 C ATOM 2056 O ASN A 135 4.204 -5.228 -4.800 1.00 0.64 O ATOM 2057 CB ASN A 135 6.447 -6.794 -4.955 1.00 0.58 C ATOM 2058 CG ASN A 135 6.583 -6.347 -6.397 1.00 0.71 C ATOM 2059 OD1 ASN A 135 6.287 -5.206 -6.750 1.00 0.89 O ATOM 2060 ND2 ASN A 135 6.995 -7.262 -7.251 1.00 1.10 N ATOM 0 H ASN A 135 7.587 -5.828 -2.247 1.00 0.36 H new ATOM 0 HA ASN A 135 7.219 -4.931 -4.220 1.00 0.43 H new ATOM 0 HB2 ASN A 135 7.275 -7.458 -4.708 1.00 0.58 H new ATOM 0 HB3 ASN A 135 5.531 -7.374 -4.846 1.00 0.58 H new ATOM 0 HD21 ASN A 135 7.077 -7.035 -8.242 1.00 1.10 H new ATOM 0 HD22 ASN A 135 7.232 -8.198 -6.921 1.00 1.10 H new ATOM 2067 N LEU A 136 4.994 -3.842 -3.231 1.00 0.44 N ATOM 2068 CA LEU A 136 3.907 -2.892 -3.327 1.00 0.54 C ATOM 2069 C LEU A 136 4.469 -1.507 -3.543 1.00 0.41 C ATOM 2070 O LEU A 136 4.853 -0.828 -2.594 1.00 0.47 O ATOM 2071 CB LEU A 136 3.082 -2.934 -2.069 1.00 0.78 C ATOM 2072 CG LEU A 136 2.238 -4.183 -1.906 1.00 0.64 C ATOM 2073 CD1 LEU A 136 1.745 -4.296 -0.479 1.00 1.36 C ATOM 2074 CD2 LEU A 136 1.079 -4.147 -2.889 1.00 1.17 C ATOM 0 H LEU A 136 5.656 -3.642 -2.481 1.00 0.44 H new ATOM 0 HA LEU A 136 3.268 -3.151 -4.171 1.00 0.54 H new ATOM 0 HB2 LEU A 136 3.748 -2.848 -1.211 1.00 0.78 H new ATOM 0 HB3 LEU A 136 2.426 -2.064 -2.052 1.00 0.78 H new ATOM 0 HG LEU A 136 2.844 -5.064 -2.121 1.00 0.64 H new ATOM 0 HD11 LEU A 136 1.140 -5.196 -0.373 1.00 1.36 H new ATOM 0 HD12 LEU A 136 2.598 -4.350 0.197 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.142 -3.422 -0.232 1.00 1.36 H new ATOM 0 HD21 LEU A 136 0.473 -5.045 -2.771 1.00 1.17 H new ATOM 0 HD22 LEU A 136 0.465 -3.267 -2.696 1.00 1.17 H new ATOM 0 HD23 LEU A 136 1.466 -4.102 -3.907 1.00 1.17 H new ATOM 2086 N VAL A 137 4.522 -1.094 -4.792 1.00 0.31 N ATOM 2087 CA VAL A 137 5.220 0.127 -5.144 1.00 0.27 C ATOM 2088 C VAL A 137 4.285 1.324 -5.208 1.00 0.29 C ATOM 2089 O VAL A 137 3.380 1.391 -6.044 1.00 0.33 O ATOM 2090 CB VAL A 137 5.971 -0.001 -6.471 1.00 0.29 C ATOM 2091 CG1 VAL A 137 6.726 1.288 -6.767 1.00 0.43 C ATOM 2092 CG2 VAL A 137 6.916 -1.191 -6.417 1.00 0.41 C ATOM 0 H VAL A 137 4.093 -1.582 -5.578 1.00 0.31 H new ATOM 0 HA VAL A 137 5.945 0.293 -4.347 1.00 0.27 H new ATOM 0 HB VAL A 137 5.258 -0.169 -7.278 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.258 1.189 -7.713 1.00 0.43 H new ATOM 0 HG12 VAL A 137 6.020 2.116 -6.832 1.00 0.43 H new ATOM 0 HG13 VAL A 137 7.441 1.483 -5.967 1.00 0.43 H new ATOM 0 HG21 VAL A 137 7.448 -1.277 -7.365 1.00 0.41 H new ATOM 0 HG22 VAL A 137 7.634 -1.049 -5.610 1.00 0.41 H new ATOM 0 HG23 VAL A 137 6.344 -2.102 -6.238 1.00 0.41 H new ATOM 2102 N PRO A 138 4.510 2.266 -4.290 1.00 0.34 N ATOM 2103 CA PRO A 138 3.836 3.546 -4.242 1.00 0.43 C ATOM 2104 C PRO A 138 3.749 4.216 -5.589 1.00 0.43 C ATOM 2105 O PRO A 138 4.602 4.040 -6.468 1.00 0.45 O ATOM 2106 CB PRO A 138 4.736 4.374 -3.335 1.00 0.53 C ATOM 2107 CG PRO A 138 5.351 3.396 -2.415 1.00 0.54 C ATOM 2108 CD PRO A 138 5.433 2.105 -3.169 1.00 0.39 C ATOM 0 HA PRO A 138 2.806 3.439 -3.901 1.00 0.43 H new ATOM 0 HB2 PRO A 138 5.494 4.906 -3.910 1.00 0.53 H new ATOM 0 HB3 PRO A 138 4.164 5.124 -2.789 1.00 0.53 H new ATOM 0 HG2 PRO A 138 6.341 3.727 -2.101 1.00 0.54 H new ATOM 0 HG3 PRO A 138 4.752 3.282 -1.512 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.448 1.914 -3.517 1.00 0.39 H new ATOM 0 HD3 PRO A 138 5.148 1.261 -2.540 1.00 0.39 H new ATOM 2116 N GLU A 139 2.733 5.020 -5.722 1.00 0.48 N ATOM 2117 CA GLU A 139 2.516 5.761 -6.957 1.00 0.56 C ATOM 2118 C GLU A 139 3.448 6.961 -7.004 1.00 0.56 C ATOM 2119 O GLU A 139 3.729 7.511 -8.068 1.00 0.64 O ATOM 2120 CB GLU A 139 1.051 6.180 -7.111 1.00 0.71 C ATOM 2121 CG GLU A 139 0.493 6.999 -5.961 1.00 1.35 C ATOM 2122 CD GLU A 139 0.721 8.492 -6.127 1.00 2.40 C ATOM 2123 OE1 GLU A 139 0.085 9.103 -7.011 1.00 2.78 O ATOM 2124 OE2 GLU A 139 1.524 9.073 -5.367 1.00 3.08 O ATOM 0 H GLU A 139 2.035 5.187 -4.997 1.00 0.48 H new ATOM 0 HA GLU A 139 2.745 5.109 -7.800 1.00 0.56 H new ATOM 0 HB2 GLU A 139 0.948 6.756 -8.031 1.00 0.71 H new ATOM 0 HB3 GLU A 139 0.443 5.283 -7.227 1.00 0.71 H new ATOM 0 HG2 GLU A 139 -0.577 6.808 -5.872 1.00 1.35 H new ATOM 0 HG3 GLU A 139 0.954 6.668 -5.030 1.00 1.35 H new ATOM 2131 N GLU A 140 3.946 7.337 -5.833 1.00 0.54 N ATOM 2132 CA GLU A 140 4.967 8.365 -5.716 1.00 0.60 C ATOM 2133 C GLU A 140 6.303 7.865 -6.258 1.00 0.56 C ATOM 2134 O GLU A 140 7.200 8.661 -6.537 1.00 0.65 O ATOM 2135 CB GLU A 140 5.128 8.816 -4.254 1.00 0.67 C ATOM 2136 CG GLU A 140 4.956 7.716 -3.226 1.00 0.63 C ATOM 2137 CD GLU A 140 3.511 7.537 -2.804 1.00 1.12 C ATOM 2138 OE1 GLU A 140 3.073 8.230 -1.862 1.00 1.27 O ATOM 2139 OE2 GLU A 140 2.814 6.705 -3.421 1.00 1.57 O ATOM 0 H GLU A 140 3.653 6.938 -4.941 1.00 0.54 H new ATOM 0 HA GLU A 140 4.646 9.221 -6.310 1.00 0.60 H new ATOM 0 HB2 GLU A 140 6.117 9.257 -4.132 1.00 0.67 H new ATOM 0 HB3 GLU A 140 4.401 9.602 -4.049 1.00 0.67 H new ATOM 0 HG2 GLU A 140 5.330 6.778 -3.636 1.00 0.63 H new ATOM 0 HG3 GLU A 140 5.562 7.945 -2.349 1.00 0.63 H new ATOM 2146 N TRP A 141 6.444 6.546 -6.399 1.00 0.47 N ATOM 2147 CA TRP A 141 7.690 5.971 -6.870 1.00 0.49 C ATOM 2148 C TRP A 141 7.557 5.472 -8.301 1.00 0.51 C ATOM 2149 O TRP A 141 8.541 5.379 -9.028 1.00 0.66 O ATOM 2150 CB TRP A 141 8.129 4.858 -5.947 1.00 0.45 C ATOM 2151 CG TRP A 141 8.300 5.297 -4.523 1.00 0.46 C ATOM 2152 CD1 TRP A 141 8.295 6.577 -4.038 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.500 4.450 -3.401 1.00 0.44 C ATOM 2154 NE1 TRP A 141 8.451 6.564 -2.676 1.00 0.55 N ATOM 2155 CE2 TRP A 141 8.583 5.268 -2.262 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.607 3.075 -3.254 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.764 4.747 -0.987 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 8.792 2.557 -1.990 1.00 0.50 C ATOM 2159 CH2 TRP A 141 8.862 3.390 -0.869 1.00 0.52 C ATOM 0 H TRP A 141 5.712 5.866 -6.194 1.00 0.47 H new ATOM 0 HA TRP A 141 8.453 6.749 -6.864 1.00 0.49 H new ATOM 0 HB2 TRP A 141 7.395 4.053 -5.986 1.00 0.45 H new ATOM 0 HB3 TRP A 141 9.072 4.447 -6.308 1.00 0.45 H new ATOM 0 HD1 TRP A 141 8.184 7.467 -4.640 1.00 0.54 H new ATOM 0 HE1 TRP A 141 8.466 7.386 -2.072 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.547 2.423 -4.113 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.825 5.391 -0.122 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 8.885 1.488 -1.863 1.00 0.50 H new ATOM 0 HH2 TRP A 141 8.996 2.952 0.109 1.00 0.52 H new ATOM 2170 N GLY A 142 6.332 5.150 -8.702 1.00 0.45 N ATOM 2171 CA GLY A 142 6.089 4.798 -10.086 1.00 0.50 C ATOM 2172 C GLY A 142 5.543 3.398 -10.279 1.00 0.45 C ATOM 2173 O GLY A 142 5.563 2.880 -11.396 1.00 0.53 O ATOM 0 H GLY A 142 5.510 5.127 -8.098 1.00 0.45 H new ATOM 0 HA2 GLY A 142 5.387 5.513 -10.514 1.00 0.50 H new ATOM 0 HA3 GLY A 142 7.021 4.894 -10.644 1.00 0.50 H new ATOM 2177 N GLY A 143 5.052 2.773 -9.214 1.00 0.39 N ATOM 2178 CA GLY A 143 4.448 1.468 -9.369 1.00 0.41 C ATOM 2179 C GLY A 143 2.968 1.576 -9.648 1.00 0.45 C ATOM 2180 O GLY A 143 2.553 2.203 -10.624 1.00 0.60 O ATOM 0 H GLY A 143 5.062 3.141 -8.263 1.00 0.39 H new ATOM 0 HA2 GLY A 143 4.936 0.934 -10.185 1.00 0.41 H new ATOM 0 HA3 GLY A 143 4.607 0.882 -8.464 1.00 0.41 H new ATOM 2184 N ASP A 144 2.174 0.976 -8.784 1.00 0.40 N ATOM 2185 CA ASP A 144 0.721 1.082 -8.867 1.00 0.45 C ATOM 2186 C ASP A 144 0.079 0.620 -7.570 1.00 0.33 C ATOM 2187 O ASP A 144 -0.708 -0.338 -7.483 1.00 0.35 O ATOM 2188 CB ASP A 144 0.157 0.327 -10.081 1.00 0.64 C ATOM 2189 CG ASP A 144 0.533 -1.143 -10.121 1.00 1.33 C ATOM 2190 OD1 ASP A 144 1.666 -1.456 -10.546 1.00 1.91 O ATOM 2191 OD2 ASP A 144 -0.313 -1.993 -9.782 1.00 1.91 O ATOM 0 H ASP A 144 2.509 0.404 -8.008 1.00 0.40 H new ATOM 0 HA ASP A 144 0.471 2.133 -9.013 1.00 0.45 H new ATOM 0 HB2 ASP A 144 -0.930 0.414 -10.078 1.00 0.64 H new ATOM 0 HB3 ASP A 144 0.512 0.808 -10.992 1.00 0.64 H new ATOM 2196 N THR A 145 0.410 1.359 -6.557 1.00 0.26 N ATOM 2197 CA THR A 145 -0.180 1.201 -5.269 1.00 0.24 C ATOM 2198 C THR A 145 -0.363 2.581 -4.685 1.00 0.27 C ATOM 2199 O THR A 145 0.610 3.233 -4.305 1.00 0.37 O ATOM 2200 CB THR A 145 0.699 0.337 -4.356 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.902 -0.953 -4.945 1.00 0.30 O ATOM 2202 CG2 THR A 145 0.047 0.189 -3.000 1.00 0.30 C ATOM 0 H THR A 145 1.109 2.100 -6.605 1.00 0.26 H new ATOM 0 HA THR A 145 -1.139 0.690 -5.356 1.00 0.24 H new ATOM 0 HB THR A 145 1.666 0.825 -4.233 1.00 0.25 H new ATOM 0 HG1 THR A 145 1.466 -1.497 -4.356 1.00 0.30 H new ATOM 0 HG21 THR A 145 0.678 -0.426 -2.358 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.081 1.173 -2.548 1.00 0.30 H new ATOM 0 HG23 THR A 145 -0.927 -0.287 -3.115 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.593 3.054 -4.676 1.00 0.26 N ATOM 2211 CA ILE A 146 -1.859 4.392 -4.233 1.00 0.28 C ATOM 2212 C ILE A 146 -1.740 4.473 -2.731 1.00 0.23 C ATOM 2213 O ILE A 146 -2.674 4.171 -1.988 1.00 0.24 O ATOM 2214 CB ILE A 146 -3.238 4.879 -4.681 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -3.384 4.738 -6.198 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.427 6.316 -4.257 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.296 5.444 -6.966 1.00 0.63 C ATOM 0 H ILE A 146 -2.416 2.528 -4.971 1.00 0.26 H new ATOM 0 HA ILE A 146 -1.117 5.045 -4.692 1.00 0.28 H new ATOM 0 HB ILE A 146 -4.007 4.268 -4.209 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -3.378 3.680 -6.461 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -4.352 5.136 -6.502 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.410 6.663 -4.576 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.351 6.388 -3.172 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -2.657 6.935 -4.716 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -2.457 5.306 -8.035 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -2.316 6.508 -6.731 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -1.327 5.029 -6.688 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.546 4.815 -2.307 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.250 5.037 -0.910 1.00 0.30 C ATOM 2231 C PHE A 147 -0.802 6.373 -0.458 1.00 0.32 C ATOM 2232 O PHE A 147 -0.294 7.435 -0.818 1.00 0.50 O ATOM 2233 CB PHE A 147 1.243 5.010 -0.680 1.00 0.41 C ATOM 2234 CG PHE A 147 1.800 3.632 -0.545 1.00 0.33 C ATOM 2235 CD1 PHE A 147 2.028 2.847 -1.660 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.080 3.115 0.699 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.530 1.570 -1.531 1.00 0.33 C ATOM 2238 CE2 PHE A 147 2.579 1.839 0.838 1.00 0.36 C ATOM 2239 CZ PHE A 147 2.863 1.083 -0.308 1.00 0.33 C ATOM 0 H PHE A 147 0.254 4.948 -2.926 1.00 0.25 H new ATOM 0 HA PHE A 147 -0.719 4.241 -0.332 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.739 5.514 -1.509 1.00 0.41 H new ATOM 0 HB3 PHE A 147 1.474 5.577 0.222 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.810 3.239 -2.643 1.00 0.32 H new ATOM 0 HD2 PHE A 147 1.906 3.718 1.578 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.659 0.953 -2.408 1.00 0.33 H new ATOM 0 HE2 PHE A 147 2.750 1.425 1.821 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.343 0.120 -0.219 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.845 6.303 0.325 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.487 7.480 0.857 1.00 0.27 C ATOM 2251 C CYS A 148 -2.021 7.734 2.280 1.00 0.31 C ATOM 2252 O CYS A 148 -2.380 7.013 3.202 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.996 7.312 0.825 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.662 6.964 -0.820 1.00 0.68 S ATOM 0 H CYS A 148 -2.277 5.425 0.614 1.00 0.26 H new ATOM 0 HA CYS A 148 -2.214 8.336 0.240 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -4.275 6.501 1.498 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -4.461 8.220 1.209 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.650 7.772 -1.068 1.00 0.68 H new ATOM 2260 N LYS A 149 -1.221 8.763 2.447 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.634 9.079 3.739 1.00 0.28 C ATOM 2262 C LYS A 149 -1.620 9.880 4.572 1.00 0.28 C ATOM 2263 O LYS A 149 -1.772 11.091 4.393 1.00 0.40 O ATOM 2264 CB LYS A 149 0.669 9.852 3.530 1.00 0.36 C ATOM 2265 CG LYS A 149 1.675 9.087 2.685 1.00 0.56 C ATOM 2266 CD LYS A 149 2.749 9.998 2.111 1.00 0.89 C ATOM 2267 CE LYS A 149 3.634 9.244 1.131 1.00 1.01 C ATOM 2268 NZ LYS A 149 4.526 10.151 0.366 1.00 1.44 N ATOM 0 H LYS A 149 -0.957 9.404 1.699 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.407 8.159 4.277 1.00 0.28 H new ATOM 0 HB2 LYS A 149 0.448 10.806 3.050 1.00 0.36 H new ATOM 0 HB3 LYS A 149 1.112 10.078 4.500 1.00 0.36 H new ATOM 0 HG2 LYS A 149 2.144 8.313 3.292 1.00 0.56 H new ATOM 0 HG3 LYS A 149 1.155 8.582 1.871 1.00 0.56 H new ATOM 0 HD2 LYS A 149 2.282 10.845 1.608 1.00 0.89 H new ATOM 0 HD3 LYS A 149 3.358 10.403 2.919 1.00 0.89 H new ATOM 0 HE2 LYS A 149 4.238 8.517 1.675 1.00 1.01 H new ATOM 0 HE3 LYS A 149 3.008 8.683 0.437 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 5.110 9.593 -0.289 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 3.951 10.829 -0.175 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 5.143 10.668 1.025 1.00 1.44 H new ATOM 2282 N LEU A 150 -2.305 9.199 5.478 1.00 0.21 N ATOM 2283 CA LEU A 150 -3.360 9.816 6.249 1.00 0.22 C ATOM 2284 C LEU A 150 -3.191 9.597 7.745 1.00 0.19 C ATOM 2285 O LEU A 150 -2.159 9.161 8.245 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.725 9.276 5.799 1.00 0.25 C ATOM 2287 CG LEU A 150 -4.967 7.776 5.931 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -5.687 7.441 7.227 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -5.750 7.265 4.737 1.00 0.84 C ATOM 0 H LEU A 150 -2.144 8.215 5.694 1.00 0.21 H new ATOM 0 HA LEU A 150 -3.304 10.889 6.067 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.496 9.793 6.370 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.867 9.549 4.753 1.00 0.25 H new ATOM 0 HG LEU A 150 -3.997 7.279 5.956 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -5.843 6.364 7.289 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -5.084 7.769 8.074 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -6.651 7.949 7.250 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -5.916 6.193 4.843 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -6.710 7.778 4.685 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -5.187 7.456 3.824 1.00 0.84 H new ATOM 2301 N SER A 151 -4.252 9.907 8.426 1.00 0.26 N ATOM 2302 CA SER A 151 -4.405 9.734 9.844 1.00 0.29 C ATOM 2303 C SER A 151 -5.870 9.910 10.127 1.00 0.25 C ATOM 2304 O SER A 151 -6.440 10.949 9.792 1.00 0.29 O ATOM 2305 CB SER A 151 -3.606 10.745 10.639 1.00 0.46 C ATOM 2306 OG SER A 151 -4.024 10.760 11.991 1.00 1.77 O ATOM 0 H SER A 151 -5.080 10.309 7.987 1.00 0.26 H new ATOM 0 HA SER A 151 -4.035 8.752 10.141 1.00 0.29 H new ATOM 0 HB2 SER A 151 -2.545 10.502 10.584 1.00 0.46 H new ATOM 0 HB3 SER A 151 -3.729 11.737 10.204 1.00 0.46 H new ATOM 0 HG SER A 151 -3.480 10.130 12.508 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.504 8.901 10.667 1.00 0.28 N ATOM 2313 CA ALA A 152 -7.897 9.029 11.027 1.00 0.31 C ATOM 2314 C ALA A 152 -8.012 9.808 12.321 1.00 0.33 C ATOM 2315 O ALA A 152 -9.107 10.146 12.769 1.00 0.41 O ATOM 2316 CB ALA A 152 -8.557 7.676 11.137 1.00 0.41 C ATOM 0 H ALA A 152 -6.087 7.992 10.866 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.420 9.574 10.241 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.605 7.803 11.409 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -8.491 7.160 10.179 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -8.052 7.086 11.902 1.00 0.41 H new ATOM 2322 N LYS A 153 -6.862 10.100 12.913 1.00 0.30 N ATOM 2323 CA LYS A 153 -6.829 10.927 14.107 1.00 0.34 C ATOM 2324 C LYS A 153 -6.764 12.410 13.758 1.00 0.36 C ATOM 2325 O LYS A 153 -7.367 13.230 14.441 1.00 0.49 O ATOM 2326 CB LYS A 153 -5.686 10.538 15.024 1.00 0.35 C ATOM 2327 CG LYS A 153 -6.126 9.688 16.203 1.00 0.60 C ATOM 2328 CD LYS A 153 -7.243 10.372 16.973 1.00 1.12 C ATOM 2329 CE LYS A 153 -7.685 9.557 18.174 1.00 1.65 C ATOM 2330 NZ LYS A 153 -8.843 10.186 18.860 1.00 2.30 N ATOM 0 H LYS A 153 -5.950 9.780 12.589 1.00 0.30 H new ATOM 0 HA LYS A 153 -7.761 10.750 14.644 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -4.938 9.991 14.450 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -5.204 11.442 15.396 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -6.465 8.715 15.849 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -5.278 9.509 16.865 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -6.906 11.354 17.305 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -8.094 10.534 16.311 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -7.953 8.550 17.854 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -6.855 9.458 18.874 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -9.121 9.605 19.676 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -8.578 11.137 19.187 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -9.642 10.257 18.198 1.00 2.30 H new ATOM 2344 N THR A 154 -6.030 12.767 12.706 1.00 0.30 N ATOM 2345 CA THR A 154 -6.089 14.142 12.218 1.00 0.39 C ATOM 2346 C THR A 154 -7.219 14.306 11.213 1.00 0.36 C ATOM 2347 O THR A 154 -7.604 15.422 10.857 1.00 0.41 O ATOM 2348 CB THR A 154 -4.773 14.610 11.566 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.264 13.601 10.690 1.00 0.50 O ATOM 2350 CG2 THR A 154 -3.735 14.958 12.614 1.00 0.70 C ATOM 0 H THR A 154 -5.407 12.146 12.190 1.00 0.30 H new ATOM 0 HA THR A 154 -6.266 14.763 13.096 1.00 0.39 H new ATOM 0 HB THR A 154 -4.989 15.508 10.988 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.286 13.657 10.660 1.00 0.50 H new ATOM 0 HG21 THR A 154 -2.818 15.285 12.123 1.00 0.70 H new ATOM 0 HG22 THR A 154 -4.113 15.760 13.248 1.00 0.70 H new ATOM 0 HG23 THR A 154 -3.527 14.080 13.225 1.00 0.70 H new ATOM 2358 N LYS A 155 -7.734 13.162 10.752 1.00 0.30 N ATOM 2359 CA LYS A 155 -8.805 13.122 9.760 1.00 0.32 C ATOM 2360 C LYS A 155 -8.353 13.815 8.493 1.00 0.34 C ATOM 2361 O LYS A 155 -9.081 14.593 7.882 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.085 13.752 10.302 1.00 0.38 C ATOM 2363 CG LYS A 155 -10.865 12.822 11.204 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.174 11.524 10.480 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.142 10.649 11.267 1.00 0.61 C ATOM 2366 NZ LYS A 155 -13.245 11.435 11.881 1.00 1.36 N ATOM 0 H LYS A 155 -7.419 12.241 11.057 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.029 12.080 9.531 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -9.832 14.657 10.854 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -10.717 14.054 9.467 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.292 12.615 12.108 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -11.792 13.301 11.518 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.600 11.747 9.502 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.248 10.976 10.307 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -12.563 9.892 10.606 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -11.597 10.121 12.049 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -14.011 10.793 12.168 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -12.887 11.942 12.716 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -13.609 12.121 11.189 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.145 13.488 8.095 1.00 0.30 N ATOM 2381 CA GLU A 156 -6.466 14.206 7.050 1.00 0.33 C ATOM 2382 C GLU A 156 -6.589 13.462 5.720 1.00 0.28 C ATOM 2383 O GLU A 156 -7.300 13.882 4.794 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.008 14.376 7.498 1.00 0.40 C ATOM 2385 CG GLU A 156 -4.004 14.469 6.383 1.00 1.30 C ATOM 2386 CD GLU A 156 -4.102 15.760 5.599 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -4.061 16.840 6.223 1.00 1.52 O ATOM 2388 OE2 GLU A 156 -4.229 15.702 4.361 1.00 2.48 O ATOM 0 H GLU A 156 -6.608 12.716 8.489 1.00 0.30 H new ATOM 0 HA GLU A 156 -6.911 15.187 6.883 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -4.934 15.276 8.108 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -4.740 13.535 8.138 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -3.000 14.379 6.798 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -4.145 13.628 5.704 1.00 1.30 H new ATOM 2395 N GLY A 157 -5.939 12.326 5.650 1.00 0.29 N ATOM 2396 CA GLY A 157 -5.890 11.592 4.425 1.00 0.28 C ATOM 2397 C GLY A 157 -7.135 10.769 4.165 1.00 0.27 C ATOM 2398 O GLY A 157 -7.179 10.040 3.189 1.00 0.29 O ATOM 0 H GLY A 157 -5.440 11.897 6.429 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -5.745 12.288 3.599 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -5.023 10.931 4.441 1.00 0.28 H new ATOM 2402 N LEU A 158 -8.137 10.853 5.041 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.389 10.155 4.798 1.00 0.28 C ATOM 2404 C LEU A 158 -10.158 10.889 3.718 1.00 0.30 C ATOM 2405 O LEU A 158 -10.752 10.275 2.830 1.00 0.33 O ATOM 2406 CB LEU A 158 -10.218 10.038 6.077 1.00 0.31 C ATOM 2407 CG LEU A 158 -9.678 9.044 7.110 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.646 8.901 8.270 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.421 7.688 6.467 1.00 0.80 C ATOM 0 H LEU A 158 -8.104 11.388 5.909 1.00 0.26 H new ATOM 0 HA LEU A 158 -9.173 9.140 4.465 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -10.283 11.022 6.541 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.233 9.745 5.809 1.00 0.31 H new ATOM 0 HG LEU A 158 -8.733 9.430 7.492 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.245 8.191 8.993 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -10.784 9.870 8.751 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.606 8.540 7.901 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.038 6.996 7.217 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.352 7.298 6.056 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -8.689 7.798 5.667 1.00 0.80 H new ATOM 2421 N ASP A 159 -10.108 12.213 3.785 1.00 0.32 N ATOM 2422 CA ASP A 159 -10.633 13.042 2.719 1.00 0.38 C ATOM 2423 C ASP A 159 -9.807 12.814 1.465 1.00 0.32 C ATOM 2424 O ASP A 159 -10.349 12.598 0.380 1.00 0.33 O ATOM 2425 CB ASP A 159 -10.601 14.522 3.110 1.00 0.50 C ATOM 2426 CG ASP A 159 -10.985 15.433 1.955 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -12.195 15.577 1.680 1.00 1.42 O ATOM 2428 OD2 ASP A 159 -10.077 16.008 1.324 1.00 2.20 O ATOM 0 H ASP A 159 -9.709 12.731 4.567 1.00 0.32 H new ATOM 0 HA ASP A 159 -11.672 12.768 2.534 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -11.282 14.690 3.944 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -9.601 14.782 3.458 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.485 12.813 1.640 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.563 12.594 0.527 1.00 0.30 C ATOM 2435 C HIS A 160 -7.668 11.158 -0.012 1.00 0.28 C ATOM 2436 O HIS A 160 -7.237 10.876 -1.131 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.132 12.902 0.980 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.096 12.776 -0.096 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -4.897 13.729 -1.072 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.194 11.803 -0.335 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -3.912 13.345 -1.863 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.465 12.179 -1.437 1.00 0.54 N ATOM 0 H HIS A 160 -8.030 12.961 2.541 1.00 0.30 H new ATOM 0 HA HIS A 160 -7.834 13.266 -0.287 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.101 13.916 1.379 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -5.871 12.230 1.798 1.00 0.34 H new ATOM 0 HD2 HIS A 160 -4.068 10.895 0.235 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -3.536 13.893 -2.715 1.00 0.58 H new ATOM 0 HE2 HIS A 160 -2.704 11.645 -1.857 1.00 0.54 H new ATOM 2451 N LEU A 161 -8.252 10.261 0.780 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.409 8.861 0.388 1.00 0.28 C ATOM 2453 C LEU A 161 -9.411 8.748 -0.742 1.00 0.29 C ATOM 2454 O LEU A 161 -9.102 8.230 -1.814 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.885 8.023 1.578 1.00 0.29 C ATOM 2456 CG LEU A 161 -9.001 6.518 1.323 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.640 5.920 1.009 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -9.627 5.822 2.522 1.00 1.16 C ATOM 0 H LEU A 161 -8.627 10.480 1.703 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.442 8.486 0.054 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -8.197 8.181 2.409 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.859 8.396 1.895 1.00 0.29 H new ATOM 0 HG LEU A 161 -9.648 6.366 0.459 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.745 4.850 0.831 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -7.229 6.397 0.119 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -6.968 6.083 1.851 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -9.702 4.753 2.324 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -9.006 5.985 3.403 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -10.622 6.229 2.700 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.609 9.251 -0.486 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.682 9.253 -1.473 1.00 0.37 C ATOM 2472 C LEU A 162 -11.216 9.958 -2.736 1.00 0.38 C ATOM 2473 O LEU A 162 -11.533 9.538 -3.846 1.00 0.45 O ATOM 2474 CB LEU A 162 -12.904 9.978 -0.914 1.00 0.47 C ATOM 2475 CG LEU A 162 -13.190 9.717 0.562 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -14.368 10.554 1.035 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -13.446 8.238 0.818 1.00 1.51 C ATOM 0 H LEU A 162 -10.866 9.668 0.408 1.00 0.31 H new ATOM 0 HA LEU A 162 -11.948 8.222 -1.706 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -12.769 11.050 -1.058 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -13.779 9.686 -1.495 1.00 0.47 H new ATOM 0 HG LEU A 162 -12.308 10.009 1.132 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -14.556 10.354 2.090 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -14.140 11.611 0.901 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -15.253 10.298 0.453 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -13.647 8.082 1.878 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -14.306 7.911 0.234 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -12.569 7.661 0.526 1.00 1.51 H new ATOM 2489 N GLU A 163 -10.453 11.028 -2.541 1.00 0.37 N ATOM 2490 CA GLU A 163 -9.865 11.783 -3.647 1.00 0.44 C ATOM 2491 C GLU A 163 -9.014 10.886 -4.546 1.00 0.41 C ATOM 2492 O GLU A 163 -9.058 10.995 -5.769 1.00 0.50 O ATOM 2493 CB GLU A 163 -9.005 12.927 -3.112 1.00 0.56 C ATOM 2494 CG GLU A 163 -9.776 13.925 -2.269 1.00 1.03 C ATOM 2495 CD GLU A 163 -10.862 14.635 -3.047 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -10.532 15.535 -3.843 1.00 2.14 O ATOM 2497 OE2 GLU A 163 -12.048 14.309 -2.849 1.00 2.57 O ATOM 0 H GLU A 163 -10.224 11.397 -1.618 1.00 0.37 H new ATOM 0 HA GLU A 163 -10.685 12.188 -4.240 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -8.193 12.511 -2.516 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -8.548 13.450 -3.952 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -10.223 13.408 -1.420 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -9.084 14.663 -1.864 1.00 1.03 H new ATOM 2504 N MET A 164 -8.237 10.004 -3.938 1.00 0.37 N ATOM 2505 CA MET A 164 -7.404 9.084 -4.701 1.00 0.39 C ATOM 2506 C MET A 164 -8.241 7.943 -5.260 1.00 0.37 C ATOM 2507 O MET A 164 -7.966 7.424 -6.342 1.00 0.43 O ATOM 2508 CB MET A 164 -6.273 8.534 -3.832 1.00 0.43 C ATOM 2509 CG MET A 164 -5.265 9.579 -3.362 1.00 0.64 C ATOM 2510 SD MET A 164 -4.214 10.227 -4.688 1.00 0.58 S ATOM 2511 CE MET A 164 -5.320 11.363 -5.525 1.00 0.53 C ATOM 0 H MET A 164 -8.165 9.904 -2.925 1.00 0.37 H new ATOM 0 HA MET A 164 -6.965 9.633 -5.534 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.708 8.049 -2.958 1.00 0.43 H new ATOM 0 HB3 MET A 164 -5.743 7.764 -4.393 1.00 0.43 H new ATOM 0 HG2 MET A 164 -5.802 10.407 -2.899 1.00 0.64 H new ATOM 0 HG3 MET A 164 -4.632 9.139 -2.591 1.00 0.64 H new ATOM 0 HE1 MET A 164 -4.802 12.303 -5.713 1.00 0.53 H new ATOM 0 HE2 MET A 164 -5.639 10.929 -6.473 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.193 11.548 -4.899 1.00 0.53 H new ATOM 2521 N ILE A 165 -9.273 7.568 -4.520 1.00 0.34 N ATOM 2522 CA ILE A 165 -10.189 6.525 -4.952 1.00 0.38 C ATOM 2523 C ILE A 165 -10.959 6.952 -6.200 1.00 0.44 C ATOM 2524 O ILE A 165 -11.047 6.196 -7.163 1.00 0.52 O ATOM 2525 CB ILE A 165 -11.188 6.145 -3.841 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -10.448 5.524 -2.654 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -12.240 5.184 -4.382 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -11.344 5.175 -1.483 1.00 0.50 C ATOM 0 H ILE A 165 -9.498 7.974 -3.612 1.00 0.34 H new ATOM 0 HA ILE A 165 -9.581 5.651 -5.186 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.693 7.048 -3.498 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -9.938 4.621 -2.989 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -9.679 6.218 -2.315 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -12.939 4.924 -3.587 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.781 5.660 -5.200 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -11.753 4.280 -4.747 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -10.745 4.740 -0.683 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -11.835 6.077 -1.119 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -12.098 4.456 -1.803 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.501 8.169 -6.191 1.00 0.46 N ATOM 2541 CA LEU A 166 -12.293 8.656 -7.318 1.00 0.57 C ATOM 2542 C LEU A 166 -11.439 8.812 -8.565 1.00 0.61 C ATOM 2543 O LEU A 166 -11.931 8.698 -9.683 1.00 0.70 O ATOM 2544 CB LEU A 166 -13.008 9.969 -6.984 1.00 0.66 C ATOM 2545 CG LEU A 166 -12.151 11.111 -6.430 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -11.514 11.919 -7.554 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -12.994 12.014 -5.545 1.00 1.38 C ATOM 0 H LEU A 166 -11.407 8.831 -5.421 1.00 0.46 H new ATOM 0 HA LEU A 166 -13.057 7.905 -7.520 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -13.501 10.325 -7.889 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -13.792 9.752 -6.258 1.00 0.66 H new ATOM 0 HG LEU A 166 -11.349 10.675 -5.835 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -10.912 12.722 -7.129 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -10.879 11.268 -8.155 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -12.295 12.345 -8.183 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -12.375 12.823 -5.156 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -13.814 12.433 -6.129 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -13.398 11.435 -4.715 1.00 1.38 H new ATOM 2559 N LEU A 167 -10.164 9.090 -8.358 1.00 0.56 N ATOM 2560 CA LEU A 167 -9.185 9.070 -9.437 1.00 0.64 C ATOM 2561 C LEU A 167 -9.196 7.707 -10.115 1.00 0.66 C ATOM 2562 O LEU A 167 -9.269 7.598 -11.338 1.00 0.75 O ATOM 2563 CB LEU A 167 -7.786 9.357 -8.888 1.00 0.64 C ATOM 2564 CG LEU A 167 -6.697 9.553 -9.941 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -6.991 10.774 -10.799 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -5.334 9.683 -9.277 1.00 1.51 C ATOM 0 H LEU A 167 -9.778 9.334 -7.446 1.00 0.56 H new ATOM 0 HA LEU A 167 -9.446 9.840 -10.163 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -7.834 10.252 -8.268 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -7.494 8.534 -8.236 1.00 0.64 H new ATOM 0 HG LEU A 167 -6.685 8.676 -10.589 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -6.203 10.895 -11.542 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -7.948 10.642 -11.303 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -7.033 11.661 -10.167 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -4.569 9.822 -10.041 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -5.337 10.542 -8.606 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -5.119 8.778 -8.708 1.00 1.51 H new ATOM 2578 N VAL A 168 -9.127 6.664 -9.301 1.00 0.61 N ATOM 2579 CA VAL A 168 -9.234 5.305 -9.784 1.00 0.69 C ATOM 2580 C VAL A 168 -10.635 5.050 -10.342 1.00 0.77 C ATOM 2581 O VAL A 168 -10.804 4.372 -11.355 1.00 0.89 O ATOM 2582 CB VAL A 168 -8.926 4.298 -8.659 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -8.996 2.883 -9.185 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -7.560 4.574 -8.045 1.00 0.66 C ATOM 0 H VAL A 168 -8.996 6.740 -8.292 1.00 0.61 H new ATOM 0 HA VAL A 168 -8.502 5.169 -10.581 1.00 0.69 H new ATOM 0 HB VAL A 168 -9.678 4.415 -7.879 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -8.776 2.184 -8.378 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -9.996 2.688 -9.572 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -8.266 2.756 -9.985 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -7.364 3.851 -7.253 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -6.792 4.488 -8.813 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -7.545 5.581 -7.628 1.00 0.66 H new ATOM 2594 N SER A 169 -11.634 5.627 -9.687 1.00 0.74 N ATOM 2595 CA SER A 169 -13.016 5.551 -10.149 1.00 0.87 C ATOM 2596 C SER A 169 -13.208 6.303 -11.473 1.00 0.96 C ATOM 2597 O SER A 169 -14.281 6.259 -12.072 1.00 1.12 O ATOM 2598 CB SER A 169 -13.947 6.128 -9.085 1.00 0.88 C ATOM 2599 OG SER A 169 -13.739 5.504 -7.829 1.00 1.35 O ATOM 0 H SER A 169 -11.512 6.158 -8.825 1.00 0.74 H new ATOM 0 HA SER A 169 -13.258 4.502 -10.321 1.00 0.87 H new ATOM 0 HB2 SER A 169 -13.778 7.201 -8.993 1.00 0.88 H new ATOM 0 HB3 SER A 169 -14.984 5.994 -9.394 1.00 0.88 H new ATOM 0 HG SER A 169 -12.857 5.754 -7.482 1.00 1.35 H new ATOM 2605 N GLU A 170 -12.185 7.019 -11.915 1.00 0.96 N ATOM 2606 CA GLU A 170 -12.245 7.703 -13.194 1.00 1.11 C ATOM 2607 C GLU A 170 -11.586 6.855 -14.280 1.00 1.17 C ATOM 2608 O GLU A 170 -12.010 6.864 -15.438 1.00 1.37 O ATOM 2609 CB GLU A 170 -11.573 9.073 -13.095 1.00 1.26 C ATOM 2610 CG GLU A 170 -11.858 9.973 -14.285 1.00 1.84 C ATOM 2611 CD GLU A 170 -11.266 11.355 -14.131 1.00 2.19 C ATOM 2612 OE1 GLU A 170 -11.799 12.145 -13.324 1.00 2.73 O ATOM 2613 OE2 GLU A 170 -10.285 11.667 -14.834 1.00 2.56 O ATOM 0 H GLU A 170 -11.308 7.140 -11.408 1.00 0.96 H new ATOM 0 HA GLU A 170 -13.291 7.853 -13.463 1.00 1.11 H new ATOM 0 HB2 GLU A 170 -11.910 9.569 -12.185 1.00 1.26 H new ATOM 0 HB3 GLU A 170 -10.496 8.935 -13.003 1.00 1.26 H new ATOM 0 HG2 GLU A 170 -11.459 9.511 -15.188 1.00 1.84 H new ATOM 0 HG3 GLU A 170 -12.936 10.058 -14.420 1.00 1.84 H new ATOM 2620 N MET A 171 -10.566 6.095 -13.896 1.00 1.11 N ATOM 2621 CA MET A 171 -9.865 5.233 -14.842 1.00 1.28 C ATOM 2622 C MET A 171 -10.654 3.954 -15.090 1.00 1.54 C ATOM 2623 O MET A 171 -10.345 3.194 -16.007 1.00 1.88 O ATOM 2624 CB MET A 171 -8.445 4.897 -14.361 1.00 1.31 C ATOM 2625 CG MET A 171 -8.392 4.046 -13.105 1.00 1.43 C ATOM 2626 SD MET A 171 -6.710 3.553 -12.666 1.00 1.66 S ATOM 2627 CE MET A 171 -5.904 5.151 -12.593 1.00 1.68 C ATOM 0 H MET A 171 -10.207 6.058 -12.942 1.00 1.11 H new ATOM 0 HA MET A 171 -9.778 5.782 -15.780 1.00 1.28 H new ATOM 0 HB2 MET A 171 -7.918 4.376 -15.160 1.00 1.31 H new ATOM 0 HB3 MET A 171 -7.907 5.827 -14.178 1.00 1.31 H new ATOM 0 HG2 MET A 171 -8.831 4.601 -12.276 1.00 1.43 H new ATOM 0 HG3 MET A 171 -9.001 3.154 -13.250 1.00 1.43 H new ATOM 0 HE1 MET A 171 -4.963 5.059 -12.051 1.00 1.68 H new ATOM 0 HE2 MET A 171 -5.708 5.506 -13.605 1.00 1.68 H new ATOM 0 HE3 MET A 171 -6.551 5.862 -12.078 1.00 1.68 H new ATOM 2637 N GLU A 172 -11.678 3.715 -14.268 1.00 1.62 N ATOM 2638 CA GLU A 172 -12.554 2.566 -14.465 1.00 2.07 C ATOM 2639 C GLU A 172 -13.363 2.748 -15.749 1.00 2.05 C ATOM 2640 O GLU A 172 -13.854 1.781 -16.333 1.00 2.58 O ATOM 2641 CB GLU A 172 -13.494 2.355 -13.267 1.00 2.47 C ATOM 2642 CG GLU A 172 -14.561 3.427 -13.114 1.00 3.01 C ATOM 2643 CD GLU A 172 -15.559 3.111 -12.011 1.00 3.71 C ATOM 2644 OE1 GLU A 172 -16.463 2.288 -12.246 1.00 4.04 O ATOM 2645 OE2 GLU A 172 -15.444 3.690 -10.908 1.00 4.27 O ATOM 0 H GLU A 172 -11.917 4.299 -13.466 1.00 1.62 H new ATOM 0 HA GLU A 172 -11.930 1.676 -14.551 1.00 2.07 H new ATOM 0 HB2 GLU A 172 -13.981 1.385 -13.369 1.00 2.47 H new ATOM 0 HB3 GLU A 172 -12.899 2.318 -12.355 1.00 2.47 H new ATOM 0 HG2 GLU A 172 -14.082 4.383 -12.901 1.00 3.01 H new ATOM 0 HG3 GLU A 172 -15.094 3.541 -14.058 1.00 3.01 H new ATOM 2652 N GLU A 173 -13.484 4.000 -16.189 1.00 1.85 N ATOM 2653 CA GLU A 173 -14.192 4.297 -17.423 1.00 2.28 C ATOM 2654 C GLU A 173 -13.252 4.181 -18.615 1.00 2.77 C ATOM 2655 O GLU A 173 -13.155 3.133 -19.251 1.00 3.47 O ATOM 2656 CB GLU A 173 -14.752 5.722 -17.404 1.00 2.50 C ATOM 2657 CG GLU A 173 -15.559 6.082 -16.173 1.00 2.86 C ATOM 2658 CD GLU A 173 -15.945 7.547 -16.172 1.00 3.41 C ATOM 2659 OE1 GLU A 173 -15.148 8.376 -15.686 1.00 3.91 O ATOM 2660 OE2 GLU A 173 -17.037 7.879 -16.676 1.00 3.82 O ATOM 0 H GLU A 173 -13.102 4.816 -15.710 1.00 1.85 H new ATOM 0 HA GLU A 173 -15.008 3.579 -17.510 1.00 2.28 H new ATOM 0 HB2 GLU A 173 -13.922 6.423 -17.492 1.00 2.50 H new ATOM 0 HB3 GLU A 173 -15.380 5.860 -18.284 1.00 2.50 H new ATOM 0 HG2 GLU A 173 -16.458 5.468 -16.134 1.00 2.86 H new ATOM 0 HG3 GLU A 173 -14.979 5.857 -15.278 1.00 2.86 H new ATOM 2667 N LEU A 174 -12.548 5.276 -18.888 1.00 2.83 N ATOM 2668 CA LEU A 174 -11.684 5.377 -20.057 1.00 3.69 C ATOM 2669 C LEU A 174 -10.377 6.088 -19.713 1.00 3.89 C ATOM 2670 O LEU A 174 -9.376 5.948 -20.418 1.00 4.73 O ATOM 2671 CB LEU A 174 -12.403 6.162 -21.159 1.00 4.31 C ATOM 2672 CG LEU A 174 -13.774 5.623 -21.577 1.00 4.98 C ATOM 2673 CD1 LEU A 174 -14.445 6.580 -22.546 1.00 5.48 C ATOM 2674 CD2 LEU A 174 -13.646 4.240 -22.197 1.00 5.72 C ATOM 0 H LEU A 174 -12.561 6.114 -18.307 1.00 2.83 H new ATOM 0 HA LEU A 174 -11.455 4.368 -20.399 1.00 3.69 H new ATOM 0 HB2 LEU A 174 -12.526 7.192 -20.824 1.00 4.31 H new ATOM 0 HB3 LEU A 174 -11.760 6.187 -22.039 1.00 4.31 H new ATOM 0 HG LEU A 174 -14.394 5.539 -20.685 1.00 4.98 H new ATOM 0 HD11 LEU A 174 -15.418 6.183 -22.834 1.00 5.48 H new ATOM 0 HD12 LEU A 174 -14.576 7.550 -22.067 1.00 5.48 H new ATOM 0 HD13 LEU A 174 -13.823 6.695 -23.434 1.00 5.48 H new ATOM 0 HD21 LEU A 174 -14.633 3.878 -22.486 1.00 5.72 H new ATOM 0 HD22 LEU A 174 -13.007 4.294 -23.078 1.00 5.72 H new ATOM 0 HD23 LEU A 174 -13.206 3.555 -21.472 1.00 5.72 H new ATOM 2686 N LYS A 175 -10.408 6.858 -18.628 1.00 3.42 N ATOM 2687 CA LYS A 175 -9.326 7.761 -18.267 1.00 3.88 C ATOM 2688 C LYS A 175 -8.122 7.015 -17.698 1.00 4.00 C ATOM 2689 O LYS A 175 -7.889 7.033 -16.493 1.00 4.36 O ATOM 2690 CB LYS A 175 -9.830 8.772 -17.225 1.00 4.27 C ATOM 2691 CG LYS A 175 -10.979 9.673 -17.684 1.00 4.29 C ATOM 2692 CD LYS A 175 -12.266 8.910 -17.983 1.00 4.24 C ATOM 2693 CE LYS A 175 -13.437 9.851 -18.216 1.00 4.99 C ATOM 2694 NZ LYS A 175 -13.895 10.495 -16.957 1.00 5.49 N ATOM 0 H LYS A 175 -11.190 6.871 -17.973 1.00 3.42 H new ATOM 0 HA LYS A 175 -9.006 8.272 -19.175 1.00 3.88 H new ATOM 0 HB2 LYS A 175 -10.152 8.225 -16.339 1.00 4.27 H new ATOM 0 HB3 LYS A 175 -8.994 9.403 -16.923 1.00 4.27 H new ATOM 0 HG2 LYS A 175 -11.178 10.417 -16.913 1.00 4.29 H new ATOM 0 HG3 LYS A 175 -10.671 10.215 -18.578 1.00 4.29 H new ATOM 0 HD2 LYS A 175 -12.122 8.284 -18.864 1.00 4.24 H new ATOM 0 HD3 LYS A 175 -12.495 8.243 -17.152 1.00 4.24 H new ATOM 0 HE2 LYS A 175 -13.147 10.620 -18.932 1.00 4.99 H new ATOM 0 HE3 LYS A 175 -14.264 9.297 -18.661 1.00 4.99 H new ATOM 0 HZ1 LYS A 175 -14.683 11.141 -17.164 1.00 5.49 H new ATOM 0 HZ2 LYS A 175 -14.213 9.764 -16.289 1.00 5.49 H new ATOM 0 HZ3 LYS A 175 -13.110 11.031 -16.536 1.00 5.49 H new ATOM 2708 N ALA A 176 -7.357 6.366 -18.562 1.00 4.26 N ATOM 2709 CA ALA A 176 -6.154 5.671 -18.127 1.00 4.89 C ATOM 2710 C ALA A 176 -5.039 6.673 -17.856 1.00 5.36 C ATOM 2711 O ALA A 176 -4.301 6.549 -16.877 1.00 5.78 O ATOM 2712 CB ALA A 176 -5.721 4.646 -19.162 1.00 5.48 C ATOM 0 H ALA A 176 -7.545 6.306 -19.563 1.00 4.26 H new ATOM 0 HA ALA A 176 -6.374 5.139 -17.201 1.00 4.89 H new ATOM 0 HB1 ALA A 176 -4.820 4.138 -18.817 1.00 5.48 H new ATOM 0 HB2 ALA A 176 -6.517 3.915 -19.306 1.00 5.48 H new ATOM 0 HB3 ALA A 176 -5.515 5.148 -20.107 1.00 5.48 H new ATOM 2718 N ASN A 177 -4.918 7.667 -18.726 1.00 5.66 N ATOM 2719 CA ASN A 177 -3.971 8.754 -18.515 1.00 6.40 C ATOM 2720 C ASN A 177 -4.637 10.101 -18.773 1.00 6.79 C ATOM 2721 O ASN A 177 -5.004 10.422 -19.905 1.00 6.94 O ATOM 2722 CB ASN A 177 -2.704 8.591 -19.378 1.00 6.79 C ATOM 2723 CG ASN A 177 -2.978 8.446 -20.863 1.00 7.41 C ATOM 2724 OD1 ASN A 177 -3.071 9.435 -21.595 1.00 7.72 O ATOM 2725 ND2 ASN A 177 -3.078 7.210 -21.328 1.00 7.88 N ATOM 0 H ASN A 177 -5.464 7.743 -19.584 1.00 5.66 H new ATOM 0 HA ASN A 177 -3.655 8.716 -17.473 1.00 6.40 H new ATOM 0 HB2 ASN A 177 -2.058 9.455 -19.222 1.00 6.79 H new ATOM 0 HB3 ASN A 177 -2.154 7.715 -19.034 1.00 6.79 H new ATOM 0 HD21 ASN A 177 -3.237 7.051 -22.323 1.00 7.88 H new ATOM 0 HD22 ASN A 177 -2.996 6.417 -20.691 1.00 7.88 H new ATOM 2732 N PRO A 178 -4.831 10.891 -17.710 1.00 7.29 N ATOM 2733 CA PRO A 178 -5.416 12.233 -17.806 1.00 8.00 C ATOM 2734 C PRO A 178 -4.501 13.185 -18.564 1.00 8.71 C ATOM 2735 O PRO A 178 -3.374 13.435 -18.084 1.00 9.19 O ATOM 2736 CB PRO A 178 -5.563 12.681 -16.346 1.00 8.54 C ATOM 2737 CG PRO A 178 -5.411 11.440 -15.533 1.00 8.16 C ATOM 2738 CD PRO A 178 -4.505 10.541 -16.322 1.00 7.54 C ATOM 2739 OXT PRO A 178 -4.907 13.681 -19.636 1.00 9.00 O ATOM 0 HA PRO A 178 -6.361 12.230 -18.349 1.00 8.00 H new ATOM 0 HB2 PRO A 178 -4.804 13.418 -16.083 1.00 8.54 H new ATOM 0 HB3 PRO A 178 -6.533 13.147 -16.174 1.00 8.54 H new ATOM 0 HG2 PRO A 178 -4.985 11.663 -14.555 1.00 8.16 H new ATOM 0 HG3 PRO A 178 -6.377 10.966 -15.359 1.00 8.16 H new ATOM 0 HD2 PRO A 178 -3.455 10.724 -16.094 1.00 7.54 H new ATOM 0 HD3 PRO A 178 -4.698 9.489 -16.114 1.00 7.54 H new TER 2747 PRO A 178 HETATM 2748 PB GDP A 179 -8.263 -2.873 16.431 1.00 0.68 P HETATM 2749 O1B GDP A 179 -8.016 -4.215 17.040 1.00 1.61 O HETATM 2750 O2B GDP A 179 -9.627 -2.742 15.776 1.00 1.63 O HETATM 2751 O3B GDP A 179 -7.113 -2.324 15.564 1.00 1.65 O HETATM 2752 O3A GDP A 179 -8.342 -1.844 17.739 1.00 0.68 O HETATM 2753 PA GDP A 179 -9.204 -0.554 17.965 1.00 0.75 P HETATM 2754 O1A GDP A 179 -9.789 -0.520 19.326 1.00 0.87 O HETATM 2755 O2A GDP A 179 -10.122 -0.263 16.802 1.00 0.88 O HETATM 2756 O5' GDP A 179 -8.062 0.577 17.889 1.00 0.69 O HETATM 2757 C5' GDP A 179 -6.820 0.391 18.568 1.00 0.65 C HETATM 2758 C4' GDP A 179 -6.167 1.717 18.878 1.00 0.66 C HETATM 2759 O4' GDP A 179 -5.682 2.319 17.653 1.00 0.63 O HETATM 2760 C3' GDP A 179 -7.069 2.795 19.458 1.00 0.75 C HETATM 2761 O3' GDP A 179 -7.216 2.637 20.864 1.00 0.96 O HETATM 2762 C2' GDP A 179 -6.328 4.087 19.118 1.00 0.75 C HETATM 2763 O2' GDP A 179 -5.443 4.465 20.155 1.00 0.95 O HETATM 2764 C1' GDP A 179 -5.517 3.706 17.876 1.00 0.62 C HETATM 2765 N9 GDP A 179 -5.930 4.420 16.674 1.00 0.55 N HETATM 2766 C8 GDP A 179 -7.047 4.177 15.918 1.00 0.62 C HETATM 2767 N7 GDP A 179 -7.170 4.980 14.898 1.00 0.61 N HETATM 2768 C5 GDP A 179 -6.061 5.811 14.988 1.00 0.49 C HETATM 2769 C6 GDP A 179 -5.653 6.882 14.154 1.00 0.45 C HETATM 2770 O6 GDP A 179 -6.219 7.328 13.155 1.00 0.55 O HETATM 2771 N1 GDP A 179 -4.465 7.459 14.592 1.00 0.37 N HETATM 2772 C2 GDP A 179 -3.768 7.050 15.706 1.00 0.40 C HETATM 2773 N2 GDP A 179 -2.660 7.744 16.003 1.00 0.46 N HETATM 2774 N3 GDP A 179 -4.139 6.052 16.493 1.00 0.45 N HETATM 2775 C4 GDP A 179 -5.285 5.479 16.075 1.00 0.46 C HETATM 0 HO3' GDP A 179 -7.799 3.343 21.213 1.00 0.96 H new HETATM 0 HO2' GDP A 179 -5.660 3.964 20.969 1.00 0.95 H new HETATM 0 HN22 GDP A 179 -2.101 7.488 16.817 1.00 0.46 H new HETATM 0 HN21 GDP A 179 -2.376 8.528 15.415 1.00 0.46 H new HETATM 0 H5'' GDP A 179 -6.987 -0.161 19.493 1.00 0.65 H new HETATM 0 HN1 GDP A 179 -4.086 8.237 14.052 1.00 0.37 H new HETATM 0 H8 GDP A 179 -7.764 3.388 16.147 1.00 0.62 H new HETATM 0 H5' GDP A 179 -6.152 -0.212 17.953 1.00 0.65 H new HETATM 0 H4' GDP A 179 -5.409 1.446 19.613 1.00 0.66 H new HETATM 0 H3' GDP A 179 -8.083 2.768 19.058 1.00 0.75 H new HETATM 0 H2' GDP A 179 -7.008 4.926 18.971 1.00 0.75 H new HETATM 0 H1' GDP A 179 -4.479 3.976 18.067 1.00 0.62 H new