USER MOD reduce.3.24.130724 H: found=0, std=0, add=919, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 919 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 CYS SG : rot 180:sc= -5.75! USER MOD Set 1.2: A 107 HIS : no HD1:sc= -1.01 K(o=-7.7,f=-4.4) USER MOD Set 1.3: A 109 SER OG : rot 133:sc= -0.944 USER MOD Set 2.1: A 53 THR OG1 : rot -28:sc= 0.491 USER MOD Set 2.2: A 91 TYR OH : rot -68:sc= 1.51 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 165:sc= 0.916 (180deg=0.584) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= -0.762 K(o=-0.76,f=-0.25) USER MOD Single : A 6 HIS : no HD1:sc= -2.1! K(o=-2.1!,f=-0.18) USER MOD Single : A 7 HIS : no HD1:sc= -0.112 X(o=-0.11,f=-0.11) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 MET CE :methyl -160:sc= -0.173 (180deg=-0.702) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= -1.7 K(o=-1.7,f=-1.1) USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0241 USER MOD Single : A 17 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 MET CE :methyl 165:sc= -0.0416 (180deg=-0.358) USER MOD Single : A 23 GLN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 MET CE :methyl 158:sc= -0.184 (180deg=-0.877) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 34:sc= 0.123 USER MOD Single : A 34 THR OG1 : rot -57:sc= -0.719 USER MOD Single : A 35 THR OG1 : rot -100:sc= -1.14 USER MOD Single : A 38 TYR OH : rot 130:sc= -0.509 USER MOD Single : A 41 THR OG1 : rot -170:sc= -1.36 USER MOD Single : A 43 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0573) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=-0.43) USER MOD Single : A 51 LYS NZ :NH3+ -162:sc= -0.132 (180deg=-0.516) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 54 LYS NZ :NH3+ -107:sc= 1.24 (180deg=-0.00522) USER MOD Single : A 55 LYS NZ :NH3+ -164:sc= -0.0569 (180deg=-0.327) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 65 TYR OH : rot 30:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= -3.17! USER MOD Single : A 68 ASN : amide:sc= -1.53 K(o=-1.5,f=-0.6) USER MOD Single : A 69 ASN : amide:sc= -1.29! K(o=-1.3!,f=-0.04) USER MOD Single : A 73 SER OG : rot 180:sc= -0.0238 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0.0586 K(o=0.059,f=-2) USER MOD Single : A 82 LYS NZ :NH3+ -179:sc= 1.22 (180deg=1.15) USER MOD Single : A 84 GLN : amide:sc= -0.394 X(o=-0.39,f=-0.55) USER MOD Single : A 90 LYS NZ :NH3+ 161:sc= 1.09 (180deg=0.823) USER MOD Single : A 93 HIS : no HD1:sc= -0.52 K(o=-0.52,f=-1.2) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot -173:sc= -0.0358 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 SER OG : rot 137:sc= 0.262 USER MOD Single : A 102 LYS NZ :NH3+ 135:sc=-0.00547 (180deg=-0.286) USER MOD Single : A 103 LYS NZ :NH3+ 169:sc= -0.0383 (180deg=-0.22) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0.152 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.694-164.591 31.195 1.00 52.12 N ATOM 2 CA MET A 1 -3.036-163.247 30.673 1.00 51.22 C ATOM 3 C MET A 1 -3.207-163.287 29.157 1.00 31.51 C ATOM 4 O MET A 1 -2.541-164.064 28.473 1.00 43.23 O ATOM 5 CB MET A 1 -1.951-162.223 31.051 1.00 33.04 C ATOM 6 CG MET A 1 -1.930-161.875 32.533 1.00 72.33 C ATOM 7 SD MET A 1 -1.695-163.318 33.586 1.00 4.50 S ATOM 8 CE MET A 1 -1.893-162.582 35.206 1.00 20.10 C ATOM 0 H1 MET A 1 -2.336-164.505 32.168 1.00 52.12 H new ATOM 0 H2 MET A 1 -3.543-165.192 31.190 1.00 52.12 H new ATOM 0 H3 MET A 1 -1.963-165.021 30.594 1.00 52.12 H new ATOM 0 HA MET A 1 -3.979-162.940 31.126 1.00 51.22 H new ATOM 0 HB2 MET A 1 -0.976-162.617 30.765 1.00 33.04 H new ATOM 0 HB3 MET A 1 -2.107-161.311 30.475 1.00 33.04 H new ATOM 0 HG2 MET A 1 -1.130-161.159 32.722 1.00 72.33 H new ATOM 0 HG3 MET A 1 -2.866-161.385 32.800 1.00 72.33 H new ATOM 0 HE1 MET A 1 -1.775-163.349 35.971 1.00 20.10 H new ATOM 0 HE2 MET A 1 -1.138-161.809 35.349 1.00 20.10 H new ATOM 0 HE3 MET A 1 -2.886-162.139 35.286 1.00 20.10 H new ATOM 20 N ALA A 2 -4.101-162.445 28.641 1.00 23.30 N ATOM 21 CA ALA A 2 -4.363-162.366 27.208 1.00 11.25 C ATOM 22 C ALA A 2 -5.029-161.037 26.877 1.00 62.11 C ATOM 23 O ALA A 2 -5.732-160.465 27.713 1.00 12.45 O ATOM 24 CB ALA A 2 -5.234-163.533 26.748 1.00 63.04 C ATOM 0 H ALA A 2 -4.660-161.803 29.202 1.00 23.30 H new ATOM 0 HA ALA A 2 -3.414-162.428 26.676 1.00 11.25 H new ATOM 0 HB1 ALA A 2 -5.415-163.451 25.676 1.00 63.04 H new ATOM 0 HB2 ALA A 2 -4.724-164.473 26.959 1.00 63.04 H new ATOM 0 HB3 ALA A 2 -6.185-163.509 27.280 1.00 63.04 H new ATOM 30 N HIS A 3 -4.783-160.539 25.669 1.00 20.45 N ATOM 31 CA HIS A 3 -5.364-159.276 25.212 1.00 41.31 C ATOM 32 C HIS A 3 -5.888-159.429 23.792 1.00 14.54 C ATOM 33 O HIS A 3 -5.243-160.063 22.949 1.00 61.24 O ATOM 34 CB HIS A 3 -4.325-158.143 25.238 1.00 23.32 C ATOM 35 CG HIS A 3 -3.739-157.871 26.591 1.00 30.41 C ATOM 36 ND1 HIS A 3 -4.187-156.867 27.420 1.00 73.03 N ATOM 37 CD2 HIS A 3 -2.717-158.467 27.249 1.00 73.32 C ATOM 38 CE1 HIS A 3 -3.465-156.855 28.523 1.00 11.32 C ATOM 39 NE2 HIS A 3 -2.567-157.816 28.448 1.00 30.43 N ATOM 0 H HIS A 3 -4.181-160.993 24.983 1.00 20.45 H new ATOM 0 HA HIS A 3 -6.180-159.022 25.889 1.00 41.31 H new ATOM 0 HB2 HIS A 3 -3.518-158.391 24.549 1.00 23.32 H new ATOM 0 HB3 HIS A 3 -4.791-157.230 24.867 1.00 23.32 H new ATOM 0 HD2 HIS A 3 -2.128-159.301 26.896 1.00 73.32 H new ATOM 0 HE1 HIS A 3 -3.589-156.172 29.350 1.00 11.32 H new ATOM 0 HE2 HIS A 3 -1.875-158.039 29.163 1.00 30.43 H new ATOM 48 N HIS A 4 -7.056-158.858 23.522 1.00 51.22 N ATOM 49 CA HIS A 4 -7.590-158.823 22.164 1.00 51.34 C ATOM 50 C HIS A 4 -6.876-157.730 21.369 1.00 0.14 C ATOM 51 O HIS A 4 -7.455-156.689 21.041 1.00 74.33 O ATOM 52 CB HIS A 4 -9.109-158.592 22.175 1.00 24.43 C ATOM 53 CG HIS A 4 -9.751-158.728 20.823 1.00 72.12 C ATOM 54 ND1 HIS A 4 -10.094-159.946 20.272 1.00 51.04 N ATOM 55 CD2 HIS A 4 -10.109-157.793 19.907 1.00 71.54 C ATOM 56 CE1 HIS A 4 -10.634-159.756 19.084 1.00 1.32 C ATOM 57 NE2 HIS A 4 -10.656-158.463 18.839 1.00 72.33 N ATOM 0 H HIS A 4 -7.650-158.414 24.222 1.00 51.22 H new ATOM 0 HA HIS A 4 -7.412-159.786 21.686 1.00 51.34 H new ATOM 0 HB2 HIS A 4 -9.571-159.303 22.860 1.00 24.43 H new ATOM 0 HB3 HIS A 4 -9.313-157.595 22.566 1.00 24.43 H new ATOM 0 HD2 HIS A 4 -9.987-156.724 20.000 1.00 71.54 H new ATOM 0 HE1 HIS A 4 -10.997-160.530 18.424 1.00 1.32 H new ATOM 0 HE2 HIS A 4 -11.021-158.028 17.992 1.00 72.33 H new ATOM 66 N HIS A 5 -5.595-157.972 21.102 1.00 1.20 N ATOM 67 CA HIS A 5 -4.740-157.007 20.418 1.00 3.11 C ATOM 68 C HIS A 5 -5.271-156.706 19.016 1.00 72.12 C ATOM 69 O HIS A 5 -5.240-157.556 18.124 1.00 25.44 O ATOM 70 CB HIS A 5 -3.284-157.508 20.360 1.00 71.20 C ATOM 71 CG HIS A 5 -3.102-158.804 19.625 1.00 35.25 C ATOM 72 ND1 HIS A 5 -2.409-158.908 18.440 1.00 61.31 N ATOM 73 CD2 HIS A 5 -3.515-160.058 19.924 1.00 64.31 C ATOM 74 CE1 HIS A 5 -2.406-160.165 18.043 1.00 14.53 C ATOM 75 NE2 HIS A 5 -3.070-160.884 18.927 1.00 10.22 N ATOM 0 H HIS A 5 -5.122-158.840 21.353 1.00 1.20 H new ATOM 0 HA HIS A 5 -4.754-156.079 20.989 1.00 3.11 H new ATOM 0 HB2 HIS A 5 -2.669-156.745 19.883 1.00 71.20 H new ATOM 0 HB3 HIS A 5 -2.913-157.627 21.378 1.00 71.20 H new ATOM 0 HD2 HIS A 5 -4.090-160.353 20.790 1.00 64.31 H new ATOM 0 HE1 HIS A 5 -1.939-160.542 17.145 1.00 14.53 H new ATOM 0 HE2 HIS A 5 -3.226-161.891 18.876 1.00 10.22 H new ATOM 84 N HIS A 6 -5.774-155.490 18.850 1.00 74.41 N ATOM 85 CA HIS A 6 -6.347-155.035 17.586 1.00 62.44 C ATOM 86 C HIS A 6 -5.310-154.236 16.797 1.00 42.35 C ATOM 87 O HIS A 6 -5.061-153.064 17.088 1.00 32.12 O ATOM 88 CB HIS A 6 -7.613-154.192 17.847 1.00 4.33 C ATOM 89 CG HIS A 6 -7.384-152.985 18.720 1.00 54.12 C ATOM 90 ND1 HIS A 6 -7.635-151.695 18.308 1.00 25.22 N ATOM 91 CD2 HIS A 6 -6.928-152.880 19.995 1.00 51.05 C ATOM 92 CE1 HIS A 6 -7.340-150.856 19.281 1.00 34.00 C ATOM 93 NE2 HIS A 6 -6.910-151.548 20.319 1.00 2.42 N ATOM 0 H HIS A 6 -5.797-154.788 19.589 1.00 74.41 H new ATOM 0 HA HIS A 6 -6.634-155.903 16.992 1.00 62.44 H new ATOM 0 HB2 HIS A 6 -8.020-153.863 16.891 1.00 4.33 H new ATOM 0 HB3 HIS A 6 -8.368-154.825 18.313 1.00 4.33 H new ATOM 0 HD2 HIS A 6 -6.633-153.697 20.637 1.00 51.05 H new ATOM 0 HE1 HIS A 6 -7.435-149.781 19.236 1.00 34.00 H new ATOM 0 HE2 HIS A 6 -6.614-151.157 21.213 1.00 2.42 H new ATOM 102 N HIS A 7 -4.691-154.883 15.811 1.00 3.41 N ATOM 103 CA HIS A 7 -3.605-154.261 15.049 1.00 22.42 C ATOM 104 C HIS A 7 -4.153-153.197 14.094 1.00 74.24 C ATOM 105 O HIS A 7 -5.059-153.465 13.300 1.00 22.25 O ATOM 106 CB HIS A 7 -2.787-155.315 14.275 1.00 14.31 C ATOM 107 CG HIS A 7 -3.483-155.907 13.080 1.00 52.42 C ATOM 108 ND1 HIS A 7 -2.996-155.784 11.797 1.00 2.02 N ATOM 109 CD2 HIS A 7 -4.617-156.643 12.976 1.00 55.24 C ATOM 110 CE1 HIS A 7 -3.796-156.415 10.960 1.00 30.14 C ATOM 111 NE2 HIS A 7 -4.788-156.944 11.648 1.00 45.03 N ATOM 0 H HIS A 7 -4.920-155.834 15.520 1.00 3.41 H new ATOM 0 HA HIS A 7 -2.937-153.776 15.760 1.00 22.42 H new ATOM 0 HB2 HIS A 7 -1.854-154.858 13.944 1.00 14.31 H new ATOM 0 HB3 HIS A 7 -2.522-156.121 14.959 1.00 14.31 H new ATOM 0 HD2 HIS A 7 -5.265-156.938 13.788 1.00 55.24 H new ATOM 0 HE1 HIS A 7 -3.661-156.486 9.891 1.00 30.14 H new ATOM 0 HE2 HIS A 7 -5.557-157.488 11.257 1.00 45.03 H new ATOM 120 N HIS A 8 -3.612-151.989 14.201 1.00 1.42 N ATOM 121 CA HIS A 8 -3.980-150.884 13.319 1.00 40.41 C ATOM 122 C HIS A 8 -2.877-149.831 13.322 1.00 31.21 C ATOM 123 O HIS A 8 -2.300-149.538 14.371 1.00 1.54 O ATOM 124 CB HIS A 8 -5.317-150.255 13.745 1.00 5.14 C ATOM 125 CG HIS A 8 -5.754-149.116 12.867 1.00 51.02 C ATOM 126 ND1 HIS A 8 -6.279-149.299 11.605 1.00 43.10 N ATOM 127 CD2 HIS A 8 -5.731-147.777 13.069 1.00 71.51 C ATOM 128 CE1 HIS A 8 -6.559-148.125 11.072 1.00 10.51 C ATOM 129 NE2 HIS A 8 -6.236-147.186 11.939 1.00 62.52 N ATOM 0 H HIS A 8 -2.908-151.747 14.898 1.00 1.42 H new ATOM 0 HA HIS A 8 -4.101-151.277 12.309 1.00 40.41 H new ATOM 0 HB2 HIS A 8 -6.089-151.024 13.739 1.00 5.14 H new ATOM 0 HB3 HIS A 8 -5.230-149.899 14.772 1.00 5.14 H new ATOM 0 HD2 HIS A 8 -5.380-147.269 13.955 1.00 71.51 H new ATOM 0 HE1 HIS A 8 -6.981-147.961 10.092 1.00 10.51 H new ATOM 0 HE2 HIS A 8 -6.344-146.182 11.793 1.00 62.52 H new ATOM 138 N MET A 9 -2.583-149.269 12.152 1.00 32.43 N ATOM 139 CA MET A 9 -1.525-148.265 12.023 1.00 63.23 C ATOM 140 C MET A 9 -2.095-146.941 11.519 1.00 31.31 C ATOM 141 O MET A 9 -3.031-146.923 10.719 1.00 61.42 O ATOM 142 CB MET A 9 -0.423-148.755 11.067 1.00 35.41 C ATOM 143 CG MET A 9 -0.904-149.023 9.643 1.00 51.11 C ATOM 144 SD MET A 9 0.434-149.492 8.525 1.00 3.44 S ATOM 145 CE MET A 9 1.451-148.015 8.567 1.00 24.31 C ATOM 0 H MET A 9 -3.061-149.490 11.279 1.00 32.43 H new ATOM 0 HA MET A 9 -1.091-148.108 13.010 1.00 63.23 H new ATOM 0 HB2 MET A 9 0.373-148.011 11.036 1.00 35.41 H new ATOM 0 HB3 MET A 9 0.012-149.670 11.470 1.00 35.41 H new ATOM 0 HG2 MET A 9 -1.651-149.817 9.661 1.00 51.11 H new ATOM 0 HG3 MET A 9 -1.397-148.130 9.257 1.00 51.11 H new ATOM 0 HE1 MET A 9 2.099-147.994 7.691 1.00 24.31 H new ATOM 0 HE2 MET A 9 0.811-147.133 8.566 1.00 24.31 H new ATOM 0 HE3 MET A 9 2.062-148.019 9.470 1.00 24.31 H new ATOM 155 N GLY A 10 -1.543-145.839 12.015 1.00 41.12 N ATOM 156 CA GLY A 10 -1.921-144.518 11.539 1.00 0.44 C ATOM 157 C GLY A 10 -0.845-143.919 10.655 1.00 11.55 C ATOM 158 O GLY A 10 0.218-143.529 11.141 1.00 74.43 O ATOM 0 H GLY A 10 -0.832-145.837 12.747 1.00 41.12 H new ATOM 0 HA2 GLY A 10 -2.856-144.584 10.983 1.00 0.44 H new ATOM 0 HA3 GLY A 10 -2.102-143.861 12.390 1.00 0.44 H new ATOM 162 N THR A 11 -1.113-143.862 9.355 1.00 73.24 N ATOM 163 CA THR A 11 -0.140-143.370 8.385 1.00 53.21 C ATOM 164 C THR A 11 0.099-141.861 8.547 1.00 62.12 C ATOM 165 O THR A 11 -0.742-141.136 9.091 1.00 32.23 O ATOM 166 CB THR A 11 -0.613-143.665 6.941 1.00 24.22 C ATOM 167 OG1 THR A 11 -1.081-145.020 6.854 1.00 5.43 O ATOM 168 CG2 THR A 11 0.512-143.455 5.926 1.00 21.21 C ATOM 0 H THR A 11 -2.001-144.152 8.946 1.00 73.24 H new ATOM 0 HA THR A 11 0.798-143.892 8.572 1.00 53.21 H new ATOM 0 HB THR A 11 -1.420-142.971 6.706 1.00 24.22 H new ATOM 0 HG1 THR A 11 -1.382-145.204 5.940 1.00 5.43 H new ATOM 0 HG21 THR A 11 0.143-143.672 4.924 1.00 21.21 H new ATOM 0 HG22 THR A 11 0.854-142.421 5.971 1.00 21.21 H new ATOM 0 HG23 THR A 11 1.342-144.122 6.159 1.00 21.21 H new ATOM 176 N LEU A 12 1.250-141.400 8.063 1.00 73.43 N ATOM 177 CA LEU A 12 1.614-139.985 8.096 1.00 60.44 C ATOM 178 C LEU A 12 2.143-139.572 6.724 1.00 2.34 C ATOM 179 O LEU A 12 2.608-140.417 5.954 1.00 43.41 O ATOM 180 CB LEU A 12 2.665-139.693 9.191 1.00 50.00 C ATOM 181 CG LEU A 12 4.090-140.239 8.947 1.00 32.44 C ATOM 182 CD1 LEU A 12 5.072-139.631 9.945 1.00 40.14 C ATOM 183 CD2 LEU A 12 4.133-141.766 9.032 1.00 54.24 C ATOM 0 H LEU A 12 1.958-141.998 7.636 1.00 73.43 H new ATOM 0 HA LEU A 12 0.725-139.403 8.339 1.00 60.44 H new ATOM 0 HB2 LEU A 12 2.732-138.613 9.319 1.00 50.00 H new ATOM 0 HB3 LEU A 12 2.299-140.104 10.132 1.00 50.00 H new ATOM 0 HG LEU A 12 4.382-139.952 7.937 1.00 32.44 H new ATOM 0 HD11 LEU A 12 6.071-140.026 9.759 1.00 40.14 H new ATOM 0 HD12 LEU A 12 5.083-138.547 9.830 1.00 40.14 H new ATOM 0 HD13 LEU A 12 4.764-139.885 10.959 1.00 40.14 H new ATOM 0 HD21 LEU A 12 5.151-142.112 8.855 1.00 54.24 H new ATOM 0 HD22 LEU A 12 3.809-142.085 10.023 1.00 54.24 H new ATOM 0 HD23 LEU A 12 3.469-142.191 8.279 1.00 54.24 H new ATOM 195 N GLU A 13 2.071-138.282 6.420 1.00 52.03 N ATOM 196 CA GLU A 13 2.435-137.778 5.097 1.00 22.25 C ATOM 197 C GLU A 13 3.852-137.198 5.094 1.00 62.32 C ATOM 198 O GLU A 13 4.661-137.517 4.217 1.00 2.42 O ATOM 199 CB GLU A 13 1.419-136.718 4.635 1.00 51.21 C ATOM 200 CG GLU A 13 1.213-135.578 5.631 1.00 55.21 C ATOM 201 CD GLU A 13 0.238-134.530 5.129 1.00 31.33 C ATOM 202 OE1 GLU A 13 -0.980-134.676 5.375 1.00 54.41 O ATOM 203 OE2 GLU A 13 0.680-133.553 4.484 1.00 45.33 O ATOM 0 H GLU A 13 1.763-137.562 7.073 1.00 52.03 H new ATOM 0 HA GLU A 13 2.416-138.615 4.399 1.00 22.25 H new ATOM 0 HB2 GLU A 13 1.752-136.301 3.685 1.00 51.21 H new ATOM 0 HB3 GLU A 13 0.461-137.204 4.452 1.00 51.21 H new ATOM 0 HG2 GLU A 13 0.848-135.986 6.573 1.00 55.21 H new ATOM 0 HG3 GLU A 13 2.173-135.105 5.839 1.00 55.21 H new ATOM 210 N ALA A 14 4.153-136.364 6.084 1.00 75.13 N ATOM 211 CA ALA A 14 5.436-135.670 6.146 1.00 74.41 C ATOM 212 C ALA A 14 5.649-135.046 7.523 1.00 5.34 C ATOM 213 O ALA A 14 4.798-135.168 8.410 1.00 31.41 O ATOM 214 CB ALA A 14 5.505-134.599 5.059 1.00 21.45 C ATOM 0 H ALA A 14 3.523-136.151 6.858 1.00 75.13 H new ATOM 0 HA ALA A 14 6.231-136.397 5.977 1.00 74.41 H new ATOM 0 HB1 ALA A 14 6.466-134.087 5.113 1.00 21.45 H new ATOM 0 HB2 ALA A 14 5.398-135.067 4.080 1.00 21.45 H new ATOM 0 HB3 ALA A 14 4.701-133.878 5.207 1.00 21.45 H new ATOM 220 N GLN A 15 6.782-134.374 7.693 1.00 73.23 N ATOM 221 CA GLN A 15 7.128-133.730 8.956 1.00 10.44 C ATOM 222 C GLN A 15 7.550-132.280 8.724 1.00 33.22 C ATOM 223 O GLN A 15 7.543-131.792 7.589 1.00 53.33 O ATOM 224 CB GLN A 15 8.234-134.528 9.679 1.00 53.15 C ATOM 225 CG GLN A 15 9.501-134.797 8.856 1.00 42.52 C ATOM 226 CD GLN A 15 10.369-133.563 8.639 1.00 12.50 C ATOM 227 OE1 GLN A 15 11.225-133.236 9.458 1.00 73.33 O ATOM 228 NE2 GLN A 15 10.169-132.882 7.521 1.00 64.32 N ATOM 0 H GLN A 15 7.485-134.260 6.962 1.00 73.23 H new ATOM 0 HA GLN A 15 6.246-133.719 9.597 1.00 10.44 H new ATOM 0 HB2 GLN A 15 8.517-133.987 10.582 1.00 53.15 H new ATOM 0 HB3 GLN A 15 7.819-135.484 9.997 1.00 53.15 H new ATOM 0 HG2 GLN A 15 10.093-135.562 9.358 1.00 42.52 H new ATOM 0 HG3 GLN A 15 9.213-135.202 7.886 1.00 42.52 H new ATOM 0 HE21 GLN A 15 9.450-133.182 6.863 1.00 64.32 H new ATOM 0 HE22 GLN A 15 10.734-132.058 7.318 1.00 64.32 H new ATOM 237 N THR A 16 7.914-131.594 9.799 1.00 2.53 N ATOM 238 CA THR A 16 8.373-130.213 9.718 1.00 64.02 C ATOM 239 C THR A 16 9.407-129.943 10.815 1.00 10.20 C ATOM 240 O THR A 16 9.266-130.427 11.941 1.00 24.02 O ATOM 241 CB THR A 16 7.185-129.227 9.845 1.00 64.03 C ATOM 242 OG1 THR A 16 6.162-129.568 8.895 1.00 72.31 O ATOM 243 CG2 THR A 16 7.632-127.788 9.608 1.00 44.12 C ATOM 0 H THR A 16 7.900-131.975 10.745 1.00 2.53 H new ATOM 0 HA THR A 16 8.837-130.059 8.744 1.00 64.02 H new ATOM 0 HB THR A 16 6.792-129.306 10.859 1.00 64.03 H new ATOM 0 HG1 THR A 16 5.413-128.942 8.982 1.00 72.31 H new ATOM 0 HG21 THR A 16 6.776-127.120 9.704 1.00 44.12 H new ATOM 0 HG22 THR A 16 8.388-127.516 10.344 1.00 44.12 H new ATOM 0 HG23 THR A 16 8.052-127.698 8.606 1.00 44.12 H new ATOM 251 N GLN A 17 10.446-129.182 10.481 1.00 71.03 N ATOM 252 CA GLN A 17 11.539-128.895 11.414 1.00 43.41 C ATOM 253 C GLN A 17 11.326-127.534 12.082 1.00 71.34 C ATOM 254 O GLN A 17 12.213-126.997 12.750 1.00 24.31 O ATOM 255 CB GLN A 17 12.879-128.935 10.657 1.00 10.42 C ATOM 256 CG GLN A 17 14.119-128.903 11.548 1.00 13.32 C ATOM 257 CD GLN A 17 15.415-128.899 10.754 1.00 52.11 C ATOM 258 OE1 GLN A 17 15.475-128.378 9.640 1.00 64.41 O ATOM 259 NE2 GLN A 17 16.462-129.483 11.316 1.00 14.45 N ATOM 0 H GLN A 17 10.557-128.749 9.564 1.00 71.03 H new ATOM 0 HA GLN A 17 11.556-129.651 12.199 1.00 43.41 H new ATOM 0 HB2 GLN A 17 12.909-129.839 10.048 1.00 10.42 H new ATOM 0 HB3 GLN A 17 12.919-128.088 9.972 1.00 10.42 H new ATOM 0 HG2 GLN A 17 14.083-128.016 12.181 1.00 13.32 H new ATOM 0 HG3 GLN A 17 14.107-129.768 12.211 1.00 13.32 H new ATOM 0 HE21 GLN A 17 16.375-129.905 12.241 1.00 14.45 H new ATOM 0 HE22 GLN A 17 17.355-129.511 10.824 1.00 14.45 H new ATOM 268 N GLY A 18 10.124-127.003 11.921 1.00 1.13 N ATOM 269 CA GLY A 18 9.799-125.681 12.432 1.00 52.34 C ATOM 270 C GLY A 18 9.837-124.628 11.344 1.00 34.32 C ATOM 271 O GLY A 18 10.088-124.952 10.179 1.00 71.43 O ATOM 0 H GLY A 18 9.355-127.469 11.439 1.00 1.13 H new ATOM 0 HA2 GLY A 18 8.807-125.700 12.883 1.00 52.34 H new ATOM 0 HA3 GLY A 18 10.503-125.414 13.220 1.00 52.34 H new ATOM 275 N PRO A 19 9.595-123.350 11.694 1.00 11.21 N ATOM 276 CA PRO A 19 9.575-122.248 10.721 1.00 44.43 C ATOM 277 C PRO A 19 10.981-121.849 10.256 1.00 61.53 C ATOM 278 O PRO A 19 11.135-121.054 9.323 1.00 33.10 O ATOM 279 CB PRO A 19 8.909-121.104 11.499 1.00 34.13 C ATOM 280 CG PRO A 19 9.255-121.375 12.925 1.00 11.35 C ATOM 281 CD PRO A 19 9.312-122.877 13.067 1.00 74.15 C ATOM 0 HA PRO A 19 9.049-122.519 9.805 1.00 44.43 H new ATOM 0 HB2 PRO A 19 9.284-120.133 11.177 1.00 34.13 H new ATOM 0 HB3 PRO A 19 7.830-121.095 11.347 1.00 34.13 H new ATOM 0 HG2 PRO A 19 10.212-120.923 13.186 1.00 11.35 H new ATOM 0 HG3 PRO A 19 8.508-120.949 13.595 1.00 11.35 H new ATOM 0 HD2 PRO A 19 10.091-123.184 13.765 1.00 74.15 H new ATOM 0 HD3 PRO A 19 8.371-123.279 13.443 1.00 74.15 H new ATOM 289 N GLY A 20 11.996-122.401 10.917 1.00 53.25 N ATOM 290 CA GLY A 20 13.374-122.134 10.545 1.00 63.03 C ATOM 291 C GLY A 20 13.944-120.923 11.258 1.00 10.53 C ATOM 292 O GLY A 20 13.198-120.043 11.701 1.00 74.25 O ATOM 0 H GLY A 20 11.886-123.033 11.710 1.00 53.25 H new ATOM 0 HA2 GLY A 20 13.985-123.007 10.774 1.00 63.03 H new ATOM 0 HA3 GLY A 20 13.432-121.978 9.468 1.00 63.03 H new ATOM 296 N SER A 21 15.266-120.884 11.381 1.00 73.15 N ATOM 297 CA SER A 21 15.954-119.763 12.003 1.00 14.22 C ATOM 298 C SER A 21 16.032-118.587 11.028 1.00 10.43 C ATOM 299 O SER A 21 16.950-118.509 10.209 1.00 10.21 O ATOM 300 CB SER A 21 17.358-120.196 12.441 1.00 12.32 C ATOM 301 OG SER A 21 17.298-121.385 13.212 1.00 22.03 O ATOM 0 H SER A 21 15.886-121.625 11.054 1.00 73.15 H new ATOM 0 HA SER A 21 15.396-119.442 12.883 1.00 14.22 H new ATOM 0 HB2 SER A 21 17.985-120.357 11.564 1.00 12.32 H new ATOM 0 HB3 SER A 21 17.824-119.402 13.024 1.00 12.32 H new ATOM 0 HG SER A 21 18.203-121.647 13.481 1.00 22.03 H new ATOM 307 N MET A 22 15.044-117.699 11.093 1.00 63.14 N ATOM 308 CA MET A 22 14.988-116.552 10.195 1.00 73.31 C ATOM 309 C MET A 22 16.116-115.568 10.508 1.00 20.42 C ATOM 310 O MET A 22 16.074-114.845 11.507 1.00 43.13 O ATOM 311 CB MET A 22 13.623-115.851 10.280 1.00 54.34 C ATOM 312 CG MET A 22 13.462-114.708 9.282 1.00 52.42 C ATOM 313 SD MET A 22 11.813-113.974 9.307 1.00 3.25 S ATOM 314 CE MET A 22 11.744-113.323 10.975 1.00 22.13 C ATOM 0 H MET A 22 14.272-117.752 11.758 1.00 63.14 H new ATOM 0 HA MET A 22 15.118-116.916 9.176 1.00 73.31 H new ATOM 0 HB2 MET A 22 12.835-116.585 10.110 1.00 54.34 H new ATOM 0 HB3 MET A 22 13.485-115.464 11.289 1.00 54.34 H new ATOM 0 HG2 MET A 22 14.200-113.936 9.500 1.00 52.42 H new ATOM 0 HG3 MET A 22 13.674-115.077 8.279 1.00 52.42 H new ATOM 0 HE1 MET A 22 10.914-112.621 11.057 1.00 22.13 H new ATOM 0 HE2 MET A 22 11.598-114.142 11.679 1.00 22.13 H new ATOM 0 HE3 MET A 22 12.678-112.810 11.204 1.00 22.13 H new ATOM 324 N GLN A 23 17.131-115.573 9.656 1.00 42.32 N ATOM 325 CA GLN A 23 18.281-114.685 9.793 1.00 71.32 C ATOM 326 C GLN A 23 18.914-114.460 8.423 1.00 74.11 C ATOM 327 O GLN A 23 18.459-115.032 7.430 1.00 61.22 O ATOM 328 CB GLN A 23 19.303-115.280 10.774 1.00 23.42 C ATOM 329 CG GLN A 23 19.829-116.653 10.363 1.00 73.31 C ATOM 330 CD GLN A 23 20.729-117.282 11.412 1.00 45.10 C ATOM 331 OE1 GLN A 23 20.566-117.051 12.613 1.00 2.12 O ATOM 332 NE2 GLN A 23 21.690-118.075 10.970 1.00 73.02 N ATOM 0 H GLN A 23 17.182-116.193 8.848 1.00 42.32 H new ATOM 0 HA GLN A 23 17.951-113.726 10.192 1.00 71.32 H new ATOM 0 HB2 GLN A 23 20.144-114.593 10.868 1.00 23.42 H new ATOM 0 HB3 GLN A 23 18.843-115.358 11.759 1.00 23.42 H new ATOM 0 HG2 GLN A 23 18.986-117.316 10.171 1.00 73.31 H new ATOM 0 HG3 GLN A 23 20.381-116.560 9.428 1.00 73.31 H new ATOM 0 HE21 GLN A 23 21.793-118.242 9.969 1.00 73.02 H new ATOM 0 HE22 GLN A 23 22.328-118.520 11.630 1.00 73.02 H new ATOM 341 N GLY A 24 19.953-113.635 8.368 1.00 4.42 N ATOM 342 CA GLY A 24 20.613-113.361 7.106 1.00 12.50 C ATOM 343 C GLY A 24 21.783-112.414 7.258 1.00 71.41 C ATOM 344 O GLY A 24 22.063-111.929 8.358 1.00 61.51 O ATOM 0 H GLY A 24 20.350-113.152 9.174 1.00 4.42 H new ATOM 0 HA2 GLY A 24 20.962-114.298 6.671 1.00 12.50 H new ATOM 0 HA3 GLY A 24 19.893-112.934 6.408 1.00 12.50 H new ATOM 348 N SER A 25 22.464-112.158 6.148 1.00 41.01 N ATOM 349 CA SER A 25 23.607-111.260 6.113 1.00 14.24 C ATOM 350 C SER A 25 23.797-110.753 4.687 1.00 14.43 C ATOM 351 O SER A 25 23.476-111.458 3.726 1.00 11.33 O ATOM 352 CB SER A 25 24.865-111.988 6.604 1.00 34.44 C ATOM 353 OG SER A 25 26.004-111.135 6.595 1.00 60.00 O ATOM 0 H SER A 25 22.236-112.570 5.243 1.00 41.01 H new ATOM 0 HA SER A 25 23.430-110.411 6.773 1.00 14.24 H new ATOM 0 HB2 SER A 25 24.698-112.362 7.614 1.00 34.44 H new ATOM 0 HB3 SER A 25 25.054-112.855 5.971 1.00 34.44 H new ATOM 0 HG SER A 25 26.786-111.631 6.915 1.00 60.00 H new ATOM 359 N MET A 26 24.306-109.534 4.545 1.00 62.34 N ATOM 360 CA MET A 26 24.471-108.919 3.233 1.00 2.51 C ATOM 361 C MET A 26 25.651-107.950 3.227 1.00 11.11 C ATOM 362 O MET A 26 25.841-107.186 4.175 1.00 5.31 O ATOM 363 CB MET A 26 23.184-108.189 2.827 1.00 50.04 C ATOM 364 CG MET A 26 23.303-107.368 1.549 1.00 55.43 C ATOM 365 SD MET A 26 21.806-106.434 1.171 1.00 2.11 S ATOM 366 CE MET A 26 21.692-105.366 2.609 1.00 34.05 C ATOM 0 H MET A 26 24.612-108.951 5.324 1.00 62.34 H new ATOM 0 HA MET A 26 24.676-109.708 2.510 1.00 2.51 H new ATOM 0 HB2 MET A 26 22.389-108.923 2.700 1.00 50.04 H new ATOM 0 HB3 MET A 26 22.882-107.530 3.641 1.00 50.04 H new ATOM 0 HG2 MET A 26 24.141-106.678 1.643 1.00 55.43 H new ATOM 0 HG3 MET A 26 23.530-108.033 0.716 1.00 55.43 H new ATOM 0 HE1 MET A 26 21.087-104.492 2.366 1.00 34.05 H new ATOM 0 HE2 MET A 26 21.229-105.911 3.431 1.00 34.05 H new ATOM 0 HE3 MET A 26 22.691-105.045 2.904 1.00 34.05 H new ATOM 376 N PRO A 27 26.465-107.988 2.156 1.00 74.34 N ATOM 377 CA PRO A 27 27.578-107.049 1.965 1.00 71.44 C ATOM 378 C PRO A 27 27.071-105.638 1.669 1.00 34.14 C ATOM 379 O PRO A 27 25.942-105.456 1.208 1.00 11.14 O ATOM 380 CB PRO A 27 28.326-107.626 0.755 1.00 53.44 C ATOM 381 CG PRO A 27 27.290-108.391 0.004 1.00 33.13 C ATOM 382 CD PRO A 27 26.360-108.955 1.047 1.00 61.22 C ATOM 0 HA PRO A 27 28.205-106.953 2.852 1.00 71.44 H new ATOM 0 HB2 PRO A 27 28.758-106.835 0.141 1.00 53.44 H new ATOM 0 HB3 PRO A 27 29.147-108.271 1.067 1.00 53.44 H new ATOM 0 HG2 PRO A 27 26.753-107.745 -0.690 1.00 33.13 H new ATOM 0 HG3 PRO A 27 27.743-109.187 -0.587 1.00 33.13 H new ATOM 0 HD2 PRO A 27 25.338-109.031 0.675 1.00 61.22 H new ATOM 0 HD3 PRO A 27 26.662-109.956 1.356 1.00 61.22 H new ATOM 390 N SER A 28 27.906-104.644 1.929 1.00 3.22 N ATOM 391 CA SER A 28 27.526-103.255 1.729 1.00 34.34 C ATOM 392 C SER A 28 27.756-102.849 0.273 1.00 61.20 C ATOM 393 O SER A 28 28.888-102.589 -0.139 1.00 25.04 O ATOM 394 CB SER A 28 28.328-102.349 2.677 1.00 12.32 C ATOM 395 OG SER A 28 27.898-101.000 2.598 1.00 70.24 O ATOM 0 H SER A 28 28.855-104.775 2.280 1.00 3.22 H new ATOM 0 HA SER A 28 26.466-103.141 1.954 1.00 34.34 H new ATOM 0 HB2 SER A 28 28.220-102.707 3.701 1.00 12.32 H new ATOM 0 HB3 SER A 28 29.388-102.409 2.429 1.00 12.32 H new ATOM 0 HG SER A 28 28.427-100.451 3.214 1.00 70.24 H new ATOM 401 N SER A 29 26.684-102.836 -0.516 1.00 60.23 N ATOM 402 CA SER A 29 26.764-102.413 -1.908 1.00 32.34 C ATOM 403 C SER A 29 26.726-100.887 -1.977 1.00 73.11 C ATOM 404 O SER A 29 25.903-100.246 -1.313 1.00 31.03 O ATOM 405 CB SER A 29 25.614-103.028 -2.719 1.00 33.44 C ATOM 406 OG SER A 29 25.780-102.804 -4.111 1.00 52.53 O ATOM 0 H SER A 29 25.751-103.114 -0.213 1.00 60.23 H new ATOM 0 HA SER A 29 27.702-102.761 -2.340 1.00 32.34 H new ATOM 0 HB2 SER A 29 25.564-104.099 -2.525 1.00 33.44 H new ATOM 0 HB3 SER A 29 24.667-102.600 -2.391 1.00 33.44 H new ATOM 0 HG SER A 29 25.033-103.209 -4.599 1.00 52.53 H new ATOM 412 N SER A 30 27.623-100.304 -2.761 1.00 64.34 N ATOM 413 CA SER A 30 27.752 -98.854 -2.843 1.00 21.24 C ATOM 414 C SER A 30 27.395 -98.347 -4.240 1.00 2.22 C ATOM 415 O SER A 30 27.930 -98.836 -5.236 1.00 33.13 O ATOM 416 CB SER A 30 29.188 -98.450 -2.480 1.00 51.34 C ATOM 417 OG SER A 30 30.138 -99.185 -3.242 1.00 75.40 O ATOM 0 H SER A 30 28.276-100.817 -3.353 1.00 64.34 H new ATOM 0 HA SER A 30 27.056 -98.400 -2.138 1.00 21.24 H new ATOM 0 HB2 SER A 30 29.324 -97.383 -2.656 1.00 51.34 H new ATOM 0 HB3 SER A 30 29.359 -98.622 -1.417 1.00 51.34 H new ATOM 0 HG SER A 30 29.778 -99.355 -4.138 1.00 75.40 H new ATOM 423 N GLU A 31 26.482 -97.382 -4.309 1.00 40.24 N ATOM 424 CA GLU A 31 26.144 -96.736 -5.572 1.00 62.35 C ATOM 425 C GLU A 31 27.072 -95.540 -5.802 1.00 41.11 C ATOM 426 O GLU A 31 27.400 -94.805 -4.865 1.00 60.14 O ATOM 427 CB GLU A 31 24.671 -96.287 -5.582 1.00 12.31 C ATOM 428 CG GLU A 31 24.299 -95.343 -4.443 1.00 22.01 C ATOM 429 CD GLU A 31 22.857 -94.864 -4.513 1.00 14.11 C ATOM 430 OE1 GLU A 31 21.942 -95.686 -4.297 1.00 62.50 O ATOM 431 OE2 GLU A 31 22.631 -93.657 -4.753 1.00 55.42 O ATOM 0 H GLU A 31 25.963 -97.031 -3.504 1.00 40.24 H new ATOM 0 HA GLU A 31 26.279 -97.454 -6.381 1.00 62.35 H new ATOM 0 HB2 GLU A 31 24.459 -95.795 -6.531 1.00 12.31 H new ATOM 0 HB3 GLU A 31 24.033 -97.169 -5.531 1.00 12.31 H new ATOM 0 HG2 GLU A 31 24.462 -95.849 -3.491 1.00 22.01 H new ATOM 0 HG3 GLU A 31 24.964 -94.480 -4.463 1.00 22.01 H new ATOM 438 N ASP A 32 27.521 -95.374 -7.040 1.00 41.14 N ATOM 439 CA ASP A 32 28.392 -94.256 -7.399 1.00 53.41 C ATOM 440 C ASP A 32 27.598 -93.205 -8.158 1.00 74.21 C ATOM 441 O ASP A 32 27.874 -92.006 -8.061 1.00 0.32 O ATOM 442 CB ASP A 32 29.568 -94.753 -8.257 1.00 20.24 C ATOM 443 CG ASP A 32 30.412 -95.792 -7.536 1.00 71.33 C ATOM 444 OD1 ASP A 32 31.290 -95.402 -6.734 1.00 71.55 O ATOM 445 OD2 ASP A 32 30.193 -97.004 -7.754 1.00 22.21 O ATOM 0 H ASP A 32 27.297 -95.999 -7.815 1.00 41.14 H new ATOM 0 HA ASP A 32 28.789 -93.810 -6.487 1.00 53.41 H new ATOM 0 HB2 ASP A 32 29.184 -95.180 -9.183 1.00 20.24 H new ATOM 0 HB3 ASP A 32 30.196 -93.906 -8.533 1.00 20.24 H new ATOM 450 N VAL A 33 26.592 -93.663 -8.897 1.00 64.33 N ATOM 451 CA VAL A 33 25.686 -92.776 -9.613 1.00 3.41 C ATOM 452 C VAL A 33 24.344 -92.732 -8.897 1.00 52.31 C ATOM 453 O VAL A 33 23.539 -93.659 -9.002 1.00 55.05 O ATOM 454 CB VAL A 33 25.457 -93.229 -11.072 1.00 32.24 C ATOM 455 CG1 VAL A 33 24.614 -92.207 -11.837 1.00 21.34 C ATOM 456 CG2 VAL A 33 26.788 -93.483 -11.781 1.00 54.35 C ATOM 0 H VAL A 33 26.384 -94.655 -9.015 1.00 64.33 H new ATOM 0 HA VAL A 33 26.147 -91.789 -9.633 1.00 3.41 H new ATOM 0 HB VAL A 33 24.905 -94.168 -11.049 1.00 32.24 H new ATOM 0 HG11 VAL A 33 24.468 -92.550 -12.861 1.00 21.34 H new ATOM 0 HG12 VAL A 33 23.645 -92.096 -11.349 1.00 21.34 H new ATOM 0 HG13 VAL A 33 25.128 -91.246 -11.846 1.00 21.34 H new ATOM 0 HG21 VAL A 33 26.599 -93.801 -12.806 1.00 54.35 H new ATOM 0 HG22 VAL A 33 27.377 -92.566 -11.788 1.00 54.35 H new ATOM 0 HG23 VAL A 33 27.337 -94.263 -11.255 1.00 54.35 H new ATOM 466 N THR A 34 24.123 -91.662 -8.163 1.00 32.15 N ATOM 467 CA THR A 34 22.896 -91.474 -7.413 1.00 71.11 C ATOM 468 C THR A 34 21.766 -91.050 -8.349 1.00 2.24 C ATOM 469 O THR A 34 21.926 -90.126 -9.152 1.00 60.35 O ATOM 470 CB THR A 34 23.087 -90.420 -6.298 1.00 3.00 C ATOM 471 OG1 THR A 34 24.161 -90.827 -5.435 1.00 50.55 O ATOM 472 CG2 THR A 34 21.812 -90.238 -5.474 1.00 1.10 C ATOM 0 H THR A 34 24.789 -90.896 -8.068 1.00 32.15 H new ATOM 0 HA THR A 34 22.633 -92.423 -6.945 1.00 71.11 H new ATOM 0 HB THR A 34 23.324 -89.466 -6.770 1.00 3.00 H new ATOM 0 HG1 THR A 34 23.968 -91.716 -5.070 1.00 50.55 H new ATOM 0 HG21 THR A 34 21.983 -89.490 -4.700 1.00 1.10 H new ATOM 0 HG22 THR A 34 21.002 -89.908 -6.125 1.00 1.10 H new ATOM 0 HG23 THR A 34 21.541 -91.186 -5.009 1.00 1.10 H new ATOM 480 N THR A 35 20.644 -91.752 -8.265 1.00 71.32 N ATOM 481 CA THR A 35 19.480 -91.467 -9.089 1.00 44.34 C ATOM 482 C THR A 35 18.258 -91.223 -8.213 1.00 64.43 C ATOM 483 O THR A 35 17.994 -91.981 -7.280 1.00 74.11 O ATOM 484 CB THR A 35 19.205 -92.632 -10.063 1.00 51.43 C ATOM 485 OG1 THR A 35 20.345 -92.829 -10.916 1.00 13.30 O ATOM 486 CG2 THR A 35 17.963 -92.377 -10.912 1.00 62.32 C ATOM 0 H THR A 35 20.516 -92.535 -7.623 1.00 71.32 H new ATOM 0 HA THR A 35 19.685 -90.568 -9.670 1.00 44.34 H new ATOM 0 HB THR A 35 19.025 -93.529 -9.470 1.00 51.43 H new ATOM 0 HG1 THR A 35 20.179 -92.410 -11.786 1.00 13.30 H new ATOM 0 HG21 THR A 35 17.803 -93.220 -11.585 1.00 62.32 H new ATOM 0 HG22 THR A 35 17.096 -92.262 -10.262 1.00 62.32 H new ATOM 0 HG23 THR A 35 18.102 -91.467 -11.496 1.00 62.32 H new ATOM 494 N LEU A 36 17.540 -90.146 -8.507 1.00 13.40 N ATOM 495 CA LEU A 36 16.335 -89.777 -7.774 1.00 32.23 C ATOM 496 C LEU A 36 15.323 -89.168 -8.737 1.00 30.20 C ATOM 497 O LEU A 36 15.681 -88.335 -9.572 1.00 35.32 O ATOM 498 CB LEU A 36 16.665 -88.765 -6.659 1.00 70.33 C ATOM 499 CG LEU A 36 17.553 -89.284 -5.512 1.00 3.23 C ATOM 500 CD1 LEU A 36 17.923 -88.148 -4.559 1.00 10.31 C ATOM 501 CD2 LEU A 36 16.854 -90.417 -4.757 1.00 4.14 C ATOM 0 H LEU A 36 17.777 -89.502 -9.262 1.00 13.40 H new ATOM 0 HA LEU A 36 15.915 -90.672 -7.315 1.00 32.23 H new ATOM 0 HB2 LEU A 36 17.158 -87.905 -7.112 1.00 70.33 H new ATOM 0 HB3 LEU A 36 15.728 -88.407 -6.232 1.00 70.33 H new ATOM 0 HG LEU A 36 18.472 -89.679 -5.945 1.00 3.23 H new ATOM 0 HD11 LEU A 36 18.550 -88.536 -3.756 1.00 10.31 H new ATOM 0 HD12 LEU A 36 18.468 -87.378 -5.105 1.00 10.31 H new ATOM 0 HD13 LEU A 36 17.015 -87.719 -4.135 1.00 10.31 H new ATOM 0 HD21 LEU A 36 17.498 -90.769 -3.951 1.00 4.14 H new ATOM 0 HD22 LEU A 36 15.916 -90.051 -4.338 1.00 4.14 H new ATOM 0 HD23 LEU A 36 16.649 -91.239 -5.443 1.00 4.14 H new ATOM 513 N CYS A 37 14.068 -89.590 -8.638 1.00 71.23 N ATOM 514 CA CYS A 37 13.014 -89.036 -9.487 1.00 40.31 C ATOM 515 C CYS A 37 12.422 -87.785 -8.835 1.00 32.44 C ATOM 516 O CYS A 37 12.205 -87.755 -7.625 1.00 34.41 O ATOM 517 CB CYS A 37 11.921 -90.076 -9.737 1.00 1.21 C ATOM 518 SG CYS A 37 12.539 -91.648 -10.378 1.00 21.43 S ATOM 0 H CYS A 37 13.754 -90.308 -7.985 1.00 71.23 H new ATOM 0 HA CYS A 37 13.448 -88.761 -10.448 1.00 40.31 H new ATOM 0 HB2 CYS A 37 11.388 -90.260 -8.804 1.00 1.21 H new ATOM 0 HB3 CYS A 37 11.198 -89.666 -10.442 1.00 1.21 H new ATOM 0 HG CYS A 37 11.544 -92.465 -10.556 1.00 21.43 H new ATOM 524 N TYR A 38 12.168 -86.761 -9.639 1.00 44.52 N ATOM 525 CA TYR A 38 11.678 -85.481 -9.146 1.00 13.14 C ATOM 526 C TYR A 38 10.243 -85.222 -9.594 1.00 33.50 C ATOM 527 O TYR A 38 9.842 -85.607 -10.696 1.00 34.40 O ATOM 528 CB TYR A 38 12.577 -84.341 -9.648 1.00 2.52 C ATOM 529 CG TYR A 38 13.872 -84.176 -8.880 1.00 51.01 C ATOM 530 CD1 TYR A 38 14.734 -85.246 -8.674 1.00 5.21 C ATOM 531 CD2 TYR A 38 14.230 -82.940 -8.360 1.00 74.21 C ATOM 532 CE1 TYR A 38 15.912 -85.085 -7.972 1.00 42.41 C ATOM 533 CE2 TYR A 38 15.407 -82.770 -7.660 1.00 41.03 C ATOM 534 CZ TYR A 38 16.245 -83.844 -7.469 1.00 0.42 C ATOM 535 OH TYR A 38 17.421 -83.679 -6.777 1.00 72.24 O ATOM 0 H TYR A 38 12.296 -86.794 -10.650 1.00 44.52 H new ATOM 0 HA TYR A 38 11.700 -85.519 -8.057 1.00 13.14 H new ATOM 0 HB2 TYR A 38 12.812 -84.516 -10.698 1.00 2.52 H new ATOM 0 HB3 TYR A 38 12.018 -83.406 -9.598 1.00 2.52 H new ATOM 0 HD1 TYR A 38 14.479 -86.218 -9.069 1.00 5.21 H new ATOM 0 HD2 TYR A 38 13.574 -82.094 -8.506 1.00 74.21 H new ATOM 0 HE1 TYR A 38 16.570 -85.927 -7.817 1.00 42.41 H new ATOM 0 HE2 TYR A 38 15.669 -81.800 -7.265 1.00 41.03 H new ATOM 0 HH TYR A 38 17.909 -82.910 -7.139 1.00 72.24 H new ATOM 545 N ARG A 39 9.484 -84.577 -8.722 1.00 41.31 N ATOM 546 CA ARG A 39 8.171 -84.043 -9.059 1.00 13.40 C ATOM 547 C ARG A 39 7.869 -82.848 -8.162 1.00 14.02 C ATOM 548 O ARG A 39 7.680 -82.994 -6.953 1.00 25.40 O ATOM 549 CB ARG A 39 7.069 -85.111 -8.926 1.00 74.33 C ATOM 550 CG ARG A 39 5.671 -84.586 -9.267 1.00 12.21 C ATOM 551 CD ARG A 39 4.632 -85.702 -9.364 1.00 54.31 C ATOM 552 NE ARG A 39 4.428 -86.387 -8.086 1.00 25.32 N ATOM 553 CZ ARG A 39 3.638 -87.452 -7.926 1.00 14.22 C ATOM 554 NH1 ARG A 39 2.932 -87.924 -8.946 1.00 32.13 N ATOM 555 NH2 ARG A 39 3.535 -88.026 -6.737 1.00 64.21 N ATOM 0 H ARG A 39 9.762 -84.408 -7.755 1.00 41.31 H new ATOM 0 HA ARG A 39 8.185 -83.725 -10.102 1.00 13.40 H new ATOM 0 HB2 ARG A 39 7.304 -85.949 -9.582 1.00 74.33 H new ATOM 0 HB3 ARG A 39 7.066 -85.495 -7.906 1.00 74.33 H new ATOM 0 HG2 ARG A 39 5.360 -83.870 -8.506 1.00 12.21 H new ATOM 0 HG3 ARG A 39 5.710 -84.048 -10.214 1.00 12.21 H new ATOM 0 HD2 ARG A 39 3.685 -85.284 -9.704 1.00 54.31 H new ATOM 0 HD3 ARG A 39 4.949 -86.426 -10.115 1.00 54.31 H new ATOM 0 HE ARG A 39 4.920 -86.029 -7.267 1.00 25.32 H new ATOM 0 HH11 ARG A 39 2.991 -87.473 -9.859 1.00 32.13 H new ATOM 0 HH12 ARG A 39 2.331 -88.738 -8.817 1.00 32.13 H new ATOM 0 HH21 ARG A 39 4.059 -87.655 -5.944 1.00 64.21 H new ATOM 0 HH22 ARG A 39 2.932 -88.839 -6.614 1.00 64.21 H new ATOM 569 N VAL A 40 7.849 -81.663 -8.754 1.00 72.34 N ATOM 570 CA VAL A 40 7.568 -80.432 -8.027 1.00 72.44 C ATOM 571 C VAL A 40 6.330 -79.758 -8.606 1.00 70.43 C ATOM 572 O VAL A 40 6.049 -79.879 -9.798 1.00 61.43 O ATOM 573 CB VAL A 40 8.773 -79.453 -8.079 1.00 33.24 C ATOM 574 CG1 VAL A 40 9.042 -78.992 -9.510 1.00 32.30 C ATOM 575 CG2 VAL A 40 8.552 -78.255 -7.154 1.00 22.25 C ATOM 0 H VAL A 40 8.026 -81.527 -9.749 1.00 72.34 H new ATOM 0 HA VAL A 40 7.389 -80.692 -6.984 1.00 72.44 H new ATOM 0 HB VAL A 40 9.653 -79.991 -7.726 1.00 33.24 H new ATOM 0 HG11 VAL A 40 9.890 -78.308 -9.518 1.00 32.30 H new ATOM 0 HG12 VAL A 40 9.267 -79.857 -10.135 1.00 32.30 H new ATOM 0 HG13 VAL A 40 8.161 -78.482 -9.900 1.00 32.30 H new ATOM 0 HG21 VAL A 40 9.412 -77.587 -7.212 1.00 22.25 H new ATOM 0 HG22 VAL A 40 7.655 -77.718 -7.462 1.00 22.25 H new ATOM 0 HG23 VAL A 40 8.432 -78.604 -6.129 1.00 22.25 H new ATOM 585 N THR A 41 5.592 -79.063 -7.760 1.00 2.24 N ATOM 586 CA THR A 41 4.377 -78.379 -8.170 1.00 62.42 C ATOM 587 C THR A 41 4.581 -76.867 -8.143 1.00 74.20 C ATOM 588 O THR A 41 5.371 -76.360 -7.344 1.00 2.33 O ATOM 589 CB THR A 41 3.203 -78.774 -7.245 1.00 55.34 C ATOM 590 OG1 THR A 41 3.628 -78.716 -5.873 1.00 61.12 O ATOM 591 CG2 THR A 41 2.696 -80.181 -7.562 1.00 64.10 C ATOM 0 H THR A 41 5.816 -78.956 -6.771 1.00 2.24 H new ATOM 0 HA THR A 41 4.138 -78.680 -9.190 1.00 62.42 H new ATOM 0 HB THR A 41 2.388 -78.070 -7.413 1.00 55.34 H new ATOM 0 HG1 THR A 41 2.940 -79.115 -5.300 1.00 61.12 H new ATOM 0 HG21 THR A 41 1.871 -80.429 -6.895 1.00 64.10 H new ATOM 0 HG22 THR A 41 2.351 -80.219 -8.595 1.00 64.10 H new ATOM 0 HG23 THR A 41 3.504 -80.899 -7.422 1.00 64.10 H new ATOM 599 N GLY A 42 3.892 -76.155 -9.028 1.00 41.40 N ATOM 600 CA GLY A 42 3.987 -74.703 -9.067 1.00 24.42 C ATOM 601 C GLY A 42 2.825 -74.041 -8.349 1.00 40.24 C ATOM 602 O GLY A 42 1.665 -74.394 -8.584 1.00 32.35 O ATOM 0 H GLY A 42 3.265 -76.558 -9.724 1.00 41.40 H new ATOM 0 HA2 GLY A 42 4.924 -74.388 -8.608 1.00 24.42 H new ATOM 0 HA3 GLY A 42 4.011 -74.368 -10.104 1.00 24.42 H new ATOM 606 N LYS A 43 3.128 -73.095 -7.457 1.00 4.30 N ATOM 607 CA LYS A 43 2.090 -72.362 -6.731 1.00 54.14 C ATOM 608 C LYS A 43 1.311 -71.490 -7.713 1.00 34.03 C ATOM 609 O LYS A 43 0.081 -71.444 -7.686 1.00 15.12 O ATOM 610 CB LYS A 43 2.708 -71.493 -5.611 1.00 24.05 C ATOM 611 CG LYS A 43 1.917 -71.492 -4.297 1.00 42.10 C ATOM 612 CD LYS A 43 0.465 -71.040 -4.471 1.00 4.43 C ATOM 613 CE LYS A 43 0.349 -69.573 -4.881 1.00 3.20 C ATOM 614 NZ LYS A 43 0.810 -68.649 -3.810 1.00 10.25 N ATOM 0 H LYS A 43 4.081 -72.820 -7.221 1.00 4.30 H new ATOM 0 HA LYS A 43 1.413 -73.076 -6.262 1.00 54.14 H new ATOM 0 HB2 LYS A 43 3.720 -71.846 -5.411 1.00 24.05 H new ATOM 0 HB3 LYS A 43 2.793 -70.467 -5.970 1.00 24.05 H new ATOM 0 HG2 LYS A 43 1.930 -72.495 -3.871 1.00 42.10 H new ATOM 0 HG3 LYS A 43 2.413 -70.835 -3.582 1.00 42.10 H new ATOM 0 HD2 LYS A 43 -0.017 -71.663 -5.225 1.00 4.43 H new ATOM 0 HD3 LYS A 43 -0.074 -71.195 -3.536 1.00 4.43 H new ATOM 0 HE2 LYS A 43 0.937 -69.403 -5.783 1.00 3.20 H new ATOM 0 HE3 LYS A 43 -0.688 -69.349 -5.130 1.00 3.20 H new ATOM 0 HZ1 LYS A 43 0.588 -67.669 -4.078 1.00 10.25 H new ATOM 0 HZ2 LYS A 43 0.328 -68.882 -2.919 1.00 10.25 H new ATOM 0 HZ3 LYS A 43 1.837 -68.749 -3.684 1.00 10.25 H new ATOM 628 N VAL A 44 2.048 -70.813 -8.587 1.00 15.21 N ATOM 629 CA VAL A 44 1.463 -69.959 -9.616 1.00 11.51 C ATOM 630 C VAL A 44 1.680 -70.592 -10.987 1.00 43.13 C ATOM 631 O VAL A 44 2.702 -71.245 -11.215 1.00 73.31 O ATOM 632 CB VAL A 44 2.094 -68.540 -9.594 1.00 65.30 C ATOM 633 CG1 VAL A 44 1.467 -67.637 -10.656 1.00 4.45 C ATOM 634 CG2 VAL A 44 1.968 -67.914 -8.206 1.00 65.34 C ATOM 0 H VAL A 44 3.068 -70.840 -8.603 1.00 15.21 H new ATOM 0 HA VAL A 44 0.396 -69.862 -9.414 1.00 11.51 H new ATOM 0 HB VAL A 44 3.153 -68.642 -9.829 1.00 65.30 H new ATOM 0 HG11 VAL A 44 1.930 -66.651 -10.615 1.00 4.45 H new ATOM 0 HG12 VAL A 44 1.626 -68.072 -11.643 1.00 4.45 H new ATOM 0 HG13 VAL A 44 0.397 -67.543 -10.469 1.00 4.45 H new ATOM 0 HG21 VAL A 44 2.416 -66.921 -8.213 1.00 65.34 H new ATOM 0 HG22 VAL A 44 0.915 -67.835 -7.937 1.00 65.34 H new ATOM 0 HG23 VAL A 44 2.483 -68.539 -7.477 1.00 65.34 H new ATOM 644 N GLN A 45 0.713 -70.420 -11.886 1.00 50.12 N ATOM 645 CA GLN A 45 0.833 -70.939 -13.246 1.00 32.13 C ATOM 646 C GLN A 45 1.949 -70.214 -14.000 1.00 53.04 C ATOM 647 O GLN A 45 1.696 -69.278 -14.764 1.00 31.24 O ATOM 648 CB GLN A 45 -0.491 -70.810 -14.013 1.00 23.21 C ATOM 649 CG GLN A 45 -1.613 -71.693 -13.477 1.00 74.44 C ATOM 650 CD GLN A 45 -2.873 -71.611 -14.325 1.00 75.11 C ATOM 651 OE1 GLN A 45 -3.167 -70.573 -14.925 1.00 53.52 O ATOM 652 NE2 GLN A 45 -3.613 -72.705 -14.400 1.00 75.34 N ATOM 0 H GLN A 45 -0.160 -69.927 -11.698 1.00 50.12 H new ATOM 0 HA GLN A 45 1.082 -71.998 -13.175 1.00 32.13 H new ATOM 0 HB2 GLN A 45 -0.816 -69.770 -13.982 1.00 23.21 H new ATOM 0 HB3 GLN A 45 -0.317 -71.058 -15.060 1.00 23.21 H new ATOM 0 HG2 GLN A 45 -1.271 -72.727 -13.439 1.00 74.44 H new ATOM 0 HG3 GLN A 45 -1.847 -71.397 -12.454 1.00 74.44 H new ATOM 0 HE21 GLN A 45 -3.337 -73.544 -13.889 1.00 75.34 H new ATOM 0 HE22 GLN A 45 -4.460 -72.710 -14.969 1.00 75.34 H new ATOM 661 N GLY A 46 3.182 -70.640 -13.750 1.00 33.40 N ATOM 662 CA GLY A 46 4.338 -70.080 -14.424 1.00 5.31 C ATOM 663 C GLY A 46 5.274 -71.173 -14.899 1.00 42.35 C ATOM 664 O GLY A 46 5.369 -72.228 -14.264 1.00 52.52 O ATOM 0 H GLY A 46 3.403 -71.377 -13.080 1.00 33.40 H new ATOM 0 HA2 GLY A 46 4.012 -69.481 -15.274 1.00 5.31 H new ATOM 0 HA3 GLY A 46 4.869 -69.411 -13.747 1.00 5.31 H new ATOM 668 N VAL A 47 5.960 -70.932 -16.008 1.00 50.43 N ATOM 669 CA VAL A 47 6.843 -71.933 -16.596 1.00 62.01 C ATOM 670 C VAL A 47 8.105 -72.130 -15.756 1.00 63.33 C ATOM 671 O VAL A 47 8.589 -71.200 -15.098 1.00 24.14 O ATOM 672 CB VAL A 47 7.246 -71.566 -18.049 1.00 61.21 C ATOM 673 CG1 VAL A 47 6.013 -71.479 -18.946 1.00 73.20 C ATOM 674 CG2 VAL A 47 8.042 -70.259 -18.089 1.00 13.12 C ATOM 0 H VAL A 47 5.923 -70.051 -16.520 1.00 50.43 H new ATOM 0 HA VAL A 47 6.279 -72.866 -16.615 1.00 62.01 H new ATOM 0 HB VAL A 47 7.890 -72.359 -18.429 1.00 61.21 H new ATOM 0 HG11 VAL A 47 6.318 -71.221 -19.960 1.00 73.20 H new ATOM 0 HG12 VAL A 47 5.501 -72.441 -18.955 1.00 73.20 H new ATOM 0 HG13 VAL A 47 5.338 -70.713 -18.564 1.00 73.20 H new ATOM 0 HG21 VAL A 47 8.310 -70.028 -19.120 1.00 13.12 H new ATOM 0 HG22 VAL A 47 7.435 -69.451 -17.682 1.00 13.12 H new ATOM 0 HG23 VAL A 47 8.949 -70.367 -17.494 1.00 13.12 H new ATOM 684 N PHE A 48 8.624 -73.351 -15.772 1.00 44.21 N ATOM 685 CA PHE A 48 9.875 -73.666 -15.099 1.00 43.23 C ATOM 686 C PHE A 48 11.035 -73.193 -15.974 1.00 63.04 C ATOM 687 O PHE A 48 11.124 -73.570 -17.145 1.00 45.54 O ATOM 688 CB PHE A 48 9.960 -75.175 -14.833 1.00 61.12 C ATOM 689 CG PHE A 48 10.993 -75.575 -13.802 1.00 53.24 C ATOM 690 CD1 PHE A 48 10.761 -75.355 -12.449 1.00 42.11 C ATOM 691 CD2 PHE A 48 12.185 -76.182 -14.180 1.00 54.45 C ATOM 692 CE1 PHE A 48 11.695 -75.729 -11.500 1.00 23.41 C ATOM 693 CE2 PHE A 48 13.119 -76.558 -13.232 1.00 23.53 C ATOM 694 CZ PHE A 48 12.873 -76.331 -11.891 1.00 52.33 C ATOM 0 H PHE A 48 8.193 -74.144 -16.248 1.00 44.21 H new ATOM 0 HA PHE A 48 9.925 -73.156 -14.137 1.00 43.23 H new ATOM 0 HB2 PHE A 48 8.982 -75.529 -14.505 1.00 61.12 H new ATOM 0 HB3 PHE A 48 10.185 -75.684 -15.770 1.00 61.12 H new ATOM 0 HD1 PHE A 48 9.840 -74.886 -12.135 1.00 42.11 H new ATOM 0 HD2 PHE A 48 12.384 -76.362 -15.226 1.00 54.45 H new ATOM 0 HE1 PHE A 48 11.502 -75.550 -10.453 1.00 23.41 H new ATOM 0 HE2 PHE A 48 14.041 -77.029 -13.540 1.00 23.53 H new ATOM 0 HZ PHE A 48 13.602 -76.625 -11.150 1.00 52.33 H new ATOM 704 N PHE A 49 11.888 -72.345 -15.410 1.00 15.34 N ATOM 705 CA PHE A 49 12.983 -71.712 -16.146 1.00 4.40 C ATOM 706 C PHE A 49 13.945 -72.732 -16.786 1.00 62.32 C ATOM 707 O PHE A 49 15.016 -73.034 -16.247 1.00 1.00 O ATOM 708 CB PHE A 49 13.738 -70.720 -15.238 1.00 33.40 C ATOM 709 CG PHE A 49 14.255 -71.273 -13.916 1.00 61.25 C ATOM 710 CD1 PHE A 49 13.875 -72.524 -13.440 1.00 2.54 C ATOM 711 CD2 PHE A 49 15.119 -70.511 -13.138 1.00 61.52 C ATOM 712 CE1 PHE A 49 14.343 -72.995 -12.231 1.00 70.11 C ATOM 713 CE2 PHE A 49 15.592 -70.984 -11.929 1.00 52.45 C ATOM 714 CZ PHE A 49 15.202 -72.226 -11.475 1.00 63.23 C ATOM 0 H PHE A 49 11.842 -72.075 -14.428 1.00 15.34 H new ATOM 0 HA PHE A 49 12.536 -71.160 -16.973 1.00 4.40 H new ATOM 0 HB2 PHE A 49 14.585 -70.322 -15.797 1.00 33.40 H new ATOM 0 HB3 PHE A 49 13.076 -69.882 -15.022 1.00 33.40 H new ATOM 0 HD1 PHE A 49 13.204 -73.135 -14.026 1.00 2.54 H new ATOM 0 HD2 PHE A 49 15.425 -69.535 -13.484 1.00 61.52 H new ATOM 0 HE1 PHE A 49 14.036 -73.968 -11.876 1.00 70.11 H new ATOM 0 HE2 PHE A 49 16.267 -70.381 -11.340 1.00 52.45 H new ATOM 0 HZ PHE A 49 15.569 -72.596 -10.529 1.00 63.23 H new ATOM 724 N ARG A 50 13.546 -73.231 -17.959 1.00 20.24 N ATOM 725 CA ARG A 50 14.303 -74.243 -18.701 1.00 11.11 C ATOM 726 C ARG A 50 15.715 -73.758 -19.020 1.00 62.02 C ATOM 727 O ARG A 50 16.650 -74.557 -19.100 1.00 13.04 O ATOM 728 CB ARG A 50 13.557 -74.610 -19.997 1.00 4.24 C ATOM 729 CG ARG A 50 14.224 -75.719 -20.813 1.00 63.42 C ATOM 730 CD ARG A 50 13.353 -76.181 -21.982 1.00 31.41 C ATOM 731 NE ARG A 50 13.107 -75.116 -22.962 1.00 52.04 N ATOM 732 CZ ARG A 50 12.406 -75.277 -24.092 1.00 22.45 C ATOM 733 NH1 ARG A 50 11.842 -76.447 -24.378 1.00 12.14 N ATOM 734 NH2 ARG A 50 12.268 -74.265 -24.937 1.00 70.43 N ATOM 0 H ARG A 50 12.685 -72.943 -18.423 1.00 20.24 H new ATOM 0 HA ARG A 50 14.391 -75.130 -18.074 1.00 11.11 H new ATOM 0 HB2 ARG A 50 12.543 -74.920 -19.744 1.00 4.24 H new ATOM 0 HB3 ARG A 50 13.472 -73.719 -20.618 1.00 4.24 H new ATOM 0 HG2 ARG A 50 15.181 -75.362 -21.194 1.00 63.42 H new ATOM 0 HG3 ARG A 50 14.437 -76.568 -20.163 1.00 63.42 H new ATOM 0 HD2 ARG A 50 13.836 -77.022 -22.479 1.00 31.41 H new ATOM 0 HD3 ARG A 50 12.399 -76.543 -21.598 1.00 31.41 H new ATOM 0 HE ARG A 50 13.495 -74.193 -22.770 1.00 52.04 H new ATOM 0 HH11 ARG A 50 11.941 -77.232 -23.734 1.00 12.14 H new ATOM 0 HH12 ARG A 50 11.310 -76.559 -25.241 1.00 12.14 H new ATOM 0 HH21 ARG A 50 12.696 -73.363 -24.727 1.00 70.43 H new ATOM 0 HH22 ARG A 50 11.734 -74.388 -25.797 1.00 70.43 H new ATOM 748 N LYS A 51 15.866 -72.443 -19.195 1.00 31.42 N ATOM 749 CA LYS A 51 17.175 -71.849 -19.480 1.00 51.24 C ATOM 750 C LYS A 51 18.162 -72.171 -18.358 1.00 43.40 C ATOM 751 O LYS A 51 19.259 -72.681 -18.600 1.00 4.25 O ATOM 752 CB LYS A 51 17.075 -70.321 -19.647 1.00 42.54 C ATOM 753 CG LYS A 51 16.400 -69.851 -20.937 1.00 63.21 C ATOM 754 CD LYS A 51 14.894 -70.097 -20.938 1.00 2.41 C ATOM 755 CE LYS A 51 14.228 -69.484 -22.164 1.00 61.10 C ATOM 756 NZ LYS A 51 14.467 -68.017 -22.248 1.00 63.52 N ATOM 0 H LYS A 51 15.101 -71.771 -19.145 1.00 31.42 H new ATOM 0 HA LYS A 51 17.532 -72.278 -20.416 1.00 51.24 H new ATOM 0 HB2 LYS A 51 16.525 -69.914 -18.799 1.00 42.54 H new ATOM 0 HB3 LYS A 51 18.080 -69.900 -19.607 1.00 42.54 H new ATOM 0 HG2 LYS A 51 16.590 -68.787 -21.074 1.00 63.21 H new ATOM 0 HG3 LYS A 51 16.849 -70.367 -21.786 1.00 63.21 H new ATOM 0 HD2 LYS A 51 14.700 -71.169 -20.915 1.00 2.41 H new ATOM 0 HD3 LYS A 51 14.455 -69.674 -20.035 1.00 2.41 H new ATOM 0 HE2 LYS A 51 14.609 -69.966 -23.064 1.00 61.10 H new ATOM 0 HE3 LYS A 51 13.156 -69.676 -22.129 1.00 61.10 H new ATOM 0 HZ1 LYS A 51 13.773 -67.588 -22.893 1.00 63.52 H new ATOM 0 HZ2 LYS A 51 14.369 -67.595 -21.303 1.00 63.52 H new ATOM 0 HZ3 LYS A 51 15.427 -67.842 -22.607 1.00 63.52 H new ATOM 770 N TYR A 52 17.754 -71.884 -17.126 1.00 33.33 N ATOM 771 CA TYR A 52 18.622 -72.071 -15.971 1.00 52.21 C ATOM 772 C TYR A 52 18.677 -73.540 -15.564 1.00 31.13 C ATOM 773 O TYR A 52 19.641 -73.974 -14.938 1.00 33.12 O ATOM 774 CB TYR A 52 18.163 -71.192 -14.803 1.00 51.11 C ATOM 775 CG TYR A 52 18.234 -69.705 -15.109 1.00 65.03 C ATOM 776 CD1 TYR A 52 19.424 -68.997 -14.964 1.00 73.20 C ATOM 777 CD2 TYR A 52 17.113 -69.012 -15.552 1.00 31.11 C ATOM 778 CE1 TYR A 52 19.490 -67.647 -15.249 1.00 34.30 C ATOM 779 CE2 TYR A 52 17.173 -67.664 -15.841 1.00 52.05 C ATOM 780 CZ TYR A 52 18.361 -66.985 -15.688 1.00 23.30 C ATOM 781 OH TYR A 52 18.422 -65.638 -15.974 1.00 53.21 O ATOM 0 H TYR A 52 16.827 -71.521 -16.903 1.00 33.33 H new ATOM 0 HA TYR A 52 19.631 -71.765 -16.248 1.00 52.21 H new ATOM 0 HB2 TYR A 52 17.138 -71.454 -14.541 1.00 51.11 H new ATOM 0 HB3 TYR A 52 18.780 -71.407 -13.931 1.00 51.11 H new ATOM 0 HD1 TYR A 52 20.310 -69.512 -14.623 1.00 73.20 H new ATOM 0 HD2 TYR A 52 16.178 -69.539 -15.672 1.00 31.11 H new ATOM 0 HE1 TYR A 52 20.420 -67.112 -15.129 1.00 34.30 H new ATOM 0 HE2 TYR A 52 16.292 -67.144 -16.186 1.00 52.05 H new ATOM 0 HH TYR A 52 17.542 -65.327 -16.272 1.00 53.21 H new ATOM 791 N THR A 53 17.641 -74.302 -15.915 1.00 44.10 N ATOM 792 CA THR A 53 17.668 -75.751 -15.731 1.00 3.41 C ATOM 793 C THR A 53 18.768 -76.355 -16.605 1.00 73.23 C ATOM 794 O THR A 53 19.568 -77.179 -16.147 1.00 72.33 O ATOM 795 CB THR A 53 16.306 -76.385 -16.088 1.00 45.12 C ATOM 796 OG1 THR A 53 15.263 -75.724 -15.361 1.00 53.20 O ATOM 797 CG2 THR A 53 16.286 -77.879 -15.766 1.00 71.23 C ATOM 0 H THR A 53 16.779 -73.942 -16.325 1.00 44.10 H new ATOM 0 HA THR A 53 17.873 -75.962 -14.681 1.00 3.41 H new ATOM 0 HB THR A 53 16.147 -76.266 -17.160 1.00 45.12 H new ATOM 0 HG1 THR A 53 15.625 -75.365 -14.524 1.00 53.20 H new ATOM 0 HG21 THR A 53 15.313 -78.295 -16.029 1.00 71.23 H new ATOM 0 HG22 THR A 53 17.064 -78.385 -16.338 1.00 71.23 H new ATOM 0 HG23 THR A 53 16.467 -78.024 -14.701 1.00 71.23 H new ATOM 805 N LYS A 54 18.811 -75.909 -17.862 1.00 52.34 N ATOM 806 CA LYS A 54 19.855 -76.308 -18.795 1.00 30.44 C ATOM 807 C LYS A 54 21.218 -75.884 -18.265 1.00 3.54 C ATOM 808 O LYS A 54 22.134 -76.696 -18.189 1.00 44.10 O ATOM 809 CB LYS A 54 19.594 -75.684 -20.178 1.00 40.44 C ATOM 810 CG LYS A 54 20.745 -75.833 -21.174 1.00 35.45 C ATOM 811 CD LYS A 54 21.117 -77.292 -21.442 1.00 30.33 C ATOM 812 CE LYS A 54 22.211 -77.402 -22.503 1.00 3.15 C ATOM 813 NZ LYS A 54 22.671 -78.801 -22.701 1.00 23.31 N ATOM 0 H LYS A 54 18.125 -75.265 -18.256 1.00 52.34 H new ATOM 0 HA LYS A 54 19.845 -77.393 -18.898 1.00 30.44 H new ATOM 0 HB2 LYS A 54 18.701 -76.140 -20.605 1.00 40.44 H new ATOM 0 HB3 LYS A 54 19.379 -74.623 -20.048 1.00 40.44 H new ATOM 0 HG2 LYS A 54 20.469 -75.355 -22.114 1.00 35.45 H new ATOM 0 HG3 LYS A 54 21.619 -75.305 -20.793 1.00 35.45 H new ATOM 0 HD2 LYS A 54 21.457 -77.758 -20.517 1.00 30.33 H new ATOM 0 HD3 LYS A 54 20.234 -77.840 -21.770 1.00 30.33 H new ATOM 0 HE2 LYS A 54 21.837 -77.008 -23.448 1.00 3.15 H new ATOM 0 HE3 LYS A 54 23.059 -76.782 -22.212 1.00 3.15 H new ATOM 0 HZ1 LYS A 54 23.617 -78.917 -22.286 1.00 23.31 H new ATOM 0 HZ2 LYS A 54 22.007 -79.454 -22.238 1.00 23.31 H new ATOM 0 HZ3 LYS A 54 22.711 -79.012 -23.718 1.00 23.31 H new ATOM 827 N LYS A 55 21.332 -74.612 -17.883 1.00 61.15 N ATOM 828 CA LYS A 55 22.573 -74.066 -17.332 1.00 23.30 C ATOM 829 C LYS A 55 23.078 -74.917 -16.163 1.00 15.04 C ATOM 830 O LYS A 55 24.227 -75.365 -16.158 1.00 2.24 O ATOM 831 CB LYS A 55 22.336 -72.624 -16.857 1.00 11.43 C ATOM 832 CG LYS A 55 23.450 -72.059 -15.976 1.00 64.44 C ATOM 833 CD LYS A 55 23.097 -70.676 -15.435 1.00 65.33 C ATOM 834 CE LYS A 55 24.120 -70.188 -14.414 1.00 14.41 C ATOM 835 NZ LYS A 55 24.177 -71.066 -13.215 1.00 63.50 N ATOM 0 H LYS A 55 20.572 -73.934 -17.946 1.00 61.15 H new ATOM 0 HA LYS A 55 23.330 -74.077 -18.116 1.00 23.30 H new ATOM 0 HB2 LYS A 55 22.218 -71.982 -17.730 1.00 11.43 H new ATOM 0 HB3 LYS A 55 21.397 -72.586 -16.304 1.00 11.43 H new ATOM 0 HG2 LYS A 55 23.636 -72.738 -15.144 1.00 64.44 H new ATOM 0 HG3 LYS A 55 24.374 -72.000 -16.551 1.00 64.44 H new ATOM 0 HD2 LYS A 55 23.041 -69.966 -16.261 1.00 65.33 H new ATOM 0 HD3 LYS A 55 22.110 -70.707 -14.974 1.00 65.33 H new ATOM 0 HE2 LYS A 55 25.105 -70.147 -14.880 1.00 14.41 H new ATOM 0 HE3 LYS A 55 23.869 -69.172 -14.107 1.00 14.41 H new ATOM 0 HZ1 LYS A 55 24.667 -70.569 -12.444 1.00 63.50 H new ATOM 0 HZ2 LYS A 55 23.211 -71.305 -12.914 1.00 63.50 H new ATOM 0 HZ3 LYS A 55 24.693 -71.938 -13.448 1.00 63.50 H new ATOM 849 N GLU A 56 22.197 -75.159 -15.200 1.00 61.35 N ATOM 850 CA GLU A 56 22.556 -75.871 -13.977 1.00 4.44 C ATOM 851 C GLU A 56 23.011 -77.291 -14.293 1.00 34.44 C ATOM 852 O GLU A 56 24.151 -77.677 -14.016 1.00 61.15 O ATOM 853 CB GLU A 56 21.353 -75.915 -13.024 1.00 12.34 C ATOM 854 CG GLU A 56 21.695 -76.392 -11.618 1.00 53.51 C ATOM 855 CD GLU A 56 22.559 -75.389 -10.869 1.00 25.14 C ATOM 856 OE1 GLU A 56 22.008 -74.385 -10.371 1.00 24.04 O ATOM 857 OE2 GLU A 56 23.786 -75.584 -10.786 1.00 63.10 O ATOM 0 H GLU A 56 21.220 -74.870 -15.243 1.00 61.35 H new ATOM 0 HA GLU A 56 23.379 -75.339 -13.499 1.00 4.44 H new ATOM 0 HB2 GLU A 56 20.914 -74.919 -12.962 1.00 12.34 H new ATOM 0 HB3 GLU A 56 20.593 -76.573 -13.445 1.00 12.34 H new ATOM 0 HG2 GLU A 56 20.775 -76.565 -11.060 1.00 53.51 H new ATOM 0 HG3 GLU A 56 22.217 -77.347 -11.676 1.00 53.51 H new ATOM 864 N ALA A 57 22.112 -78.058 -14.904 1.00 2.01 N ATOM 865 CA ALA A 57 22.361 -79.464 -15.186 1.00 74.43 C ATOM 866 C ALA A 57 23.565 -79.643 -16.109 1.00 71.13 C ATOM 867 O ALA A 57 24.331 -80.588 -15.958 1.00 12.10 O ATOM 868 CB ALA A 57 21.120 -80.105 -15.793 1.00 4.12 C ATOM 0 H ALA A 57 21.199 -77.724 -15.214 1.00 2.01 H new ATOM 0 HA ALA A 57 22.591 -79.962 -14.244 1.00 74.43 H new ATOM 0 HB1 ALA A 57 21.318 -81.157 -16.000 1.00 4.12 H new ATOM 0 HB2 ALA A 57 20.289 -80.023 -15.093 1.00 4.12 H new ATOM 0 HB3 ALA A 57 20.864 -79.595 -16.721 1.00 4.12 H new ATOM 874 N ASP A 58 23.738 -78.719 -17.049 1.00 44.45 N ATOM 875 CA ASP A 58 24.816 -78.822 -18.038 1.00 61.14 C ATOM 876 C ASP A 58 26.167 -78.507 -17.397 1.00 50.21 C ATOM 877 O ASP A 58 27.167 -79.177 -17.666 1.00 33.21 O ATOM 878 CB ASP A 58 24.555 -77.872 -19.216 1.00 0.41 C ATOM 879 CG ASP A 58 25.461 -78.135 -20.413 1.00 35.12 C ATOM 880 OD1 ASP A 58 26.610 -77.644 -20.423 1.00 32.14 O ATOM 881 OD2 ASP A 58 25.018 -78.818 -21.362 1.00 22.10 O ATOM 0 H ASP A 58 23.150 -77.892 -17.150 1.00 44.45 H new ATOM 0 HA ASP A 58 24.840 -79.846 -18.412 1.00 61.14 H new ATOM 0 HB2 ASP A 58 23.515 -77.968 -19.528 1.00 0.41 H new ATOM 0 HB3 ASP A 58 24.694 -76.844 -18.882 1.00 0.41 H new ATOM 886 N ALA A 59 26.185 -77.489 -16.535 1.00 41.11 N ATOM 887 CA ALA A 59 27.415 -77.054 -15.875 1.00 31.13 C ATOM 888 C ALA A 59 27.874 -78.076 -14.837 1.00 41.12 C ATOM 889 O ALA A 59 29.071 -78.359 -14.715 1.00 73.43 O ATOM 890 CB ALA A 59 27.216 -75.691 -15.225 1.00 33.22 C ATOM 0 H ALA A 59 25.358 -76.950 -16.278 1.00 41.11 H new ATOM 0 HA ALA A 59 28.193 -76.971 -16.634 1.00 31.13 H new ATOM 0 HB1 ALA A 59 28.141 -75.382 -14.738 1.00 33.22 H new ATOM 0 HB2 ALA A 59 26.945 -74.960 -15.987 1.00 33.22 H new ATOM 0 HB3 ALA A 59 26.419 -75.754 -14.484 1.00 33.22 H new ATOM 896 N LEU A 60 26.920 -78.620 -14.084 1.00 54.24 N ATOM 897 CA LEU A 60 27.218 -79.604 -13.042 1.00 74.52 C ATOM 898 C LEU A 60 27.163 -81.035 -13.581 1.00 2.20 C ATOM 899 O LEU A 60 27.542 -81.980 -12.889 1.00 5.04 O ATOM 900 CB LEU A 60 26.250 -79.437 -11.865 1.00 10.34 C ATOM 901 CG LEU A 60 26.489 -78.202 -10.988 1.00 60.33 C ATOM 902 CD1 LEU A 60 25.439 -78.122 -9.887 1.00 41.11 C ATOM 903 CD2 LEU A 60 27.899 -78.225 -10.388 1.00 51.52 C ATOM 0 H LEU A 60 25.929 -78.395 -14.176 1.00 54.24 H new ATOM 0 HA LEU A 60 28.236 -79.424 -12.696 1.00 74.52 H new ATOM 0 HB2 LEU A 60 25.233 -79.393 -12.256 1.00 10.34 H new ATOM 0 HB3 LEU A 60 26.312 -80.326 -11.237 1.00 10.34 H new ATOM 0 HG LEU A 60 26.402 -77.314 -11.615 1.00 60.33 H new ATOM 0 HD11 LEU A 60 25.622 -77.240 -9.273 1.00 41.11 H new ATOM 0 HD12 LEU A 60 24.447 -78.053 -10.334 1.00 41.11 H new ATOM 0 HD13 LEU A 60 25.495 -79.015 -9.265 1.00 41.11 H new ATOM 0 HD21 LEU A 60 28.046 -77.339 -9.770 1.00 51.52 H new ATOM 0 HD22 LEU A 60 28.019 -79.119 -9.776 1.00 51.52 H new ATOM 0 HD23 LEU A 60 28.636 -78.233 -11.191 1.00 51.52 H new ATOM 915 N SER A 61 26.665 -81.184 -14.807 1.00 74.52 N ATOM 916 CA SER A 61 26.678 -82.462 -15.516 1.00 3.53 C ATOM 917 C SER A 61 25.734 -83.481 -14.868 1.00 64.03 C ATOM 918 O SER A 61 26.089 -84.648 -14.684 1.00 34.12 O ATOM 919 CB SER A 61 28.110 -83.011 -15.598 1.00 74.53 C ATOM 920 OG SER A 61 28.985 -82.059 -16.186 1.00 63.03 O ATOM 0 H SER A 61 26.241 -80.422 -15.337 1.00 74.52 H new ATOM 0 HA SER A 61 26.314 -82.287 -16.528 1.00 3.53 H new ATOM 0 HB2 SER A 61 28.463 -83.267 -14.599 1.00 74.53 H new ATOM 0 HB3 SER A 61 28.119 -83.930 -16.185 1.00 74.53 H new ATOM 0 HG SER A 61 29.892 -82.429 -16.227 1.00 63.03 H new ATOM 926 N LEU A 62 24.518 -83.038 -14.545 1.00 73.12 N ATOM 927 CA LEU A 62 23.463 -83.955 -14.118 1.00 32.44 C ATOM 928 C LEU A 62 22.767 -84.509 -15.357 1.00 13.42 C ATOM 929 O LEU A 62 22.433 -83.755 -16.274 1.00 54.02 O ATOM 930 CB LEU A 62 22.419 -83.267 -13.202 1.00 62.02 C ATOM 931 CG LEU A 62 22.895 -82.882 -11.785 1.00 31.13 C ATOM 932 CD1 LEU A 62 23.588 -84.063 -11.108 1.00 22.14 C ATOM 933 CD2 LEU A 62 23.798 -81.658 -11.833 1.00 20.31 C ATOM 0 H LEU A 62 24.241 -82.057 -14.571 1.00 73.12 H new ATOM 0 HA LEU A 62 23.924 -84.755 -13.538 1.00 32.44 H new ATOM 0 HB2 LEU A 62 22.069 -82.364 -13.702 1.00 62.02 H new ATOM 0 HB3 LEU A 62 21.560 -83.931 -13.105 1.00 62.02 H new ATOM 0 HG LEU A 62 22.022 -82.624 -11.186 1.00 31.13 H new ATOM 0 HD11 LEU A 62 23.915 -83.770 -10.111 1.00 22.14 H new ATOM 0 HD12 LEU A 62 22.891 -84.898 -11.030 1.00 22.14 H new ATOM 0 HD13 LEU A 62 24.452 -84.365 -11.699 1.00 22.14 H new ATOM 0 HD21 LEU A 62 24.122 -81.405 -10.823 1.00 20.31 H new ATOM 0 HD22 LEU A 62 24.670 -81.873 -12.450 1.00 20.31 H new ATOM 0 HD23 LEU A 62 23.250 -80.818 -12.260 1.00 20.31 H new ATOM 945 N VAL A 63 22.554 -85.818 -15.388 1.00 63.31 N ATOM 946 CA VAL A 63 21.873 -86.460 -16.509 1.00 53.30 C ATOM 947 C VAL A 63 20.524 -87.002 -16.054 1.00 24.01 C ATOM 948 O VAL A 63 20.292 -87.162 -14.862 1.00 52.40 O ATOM 949 CB VAL A 63 22.723 -87.599 -17.133 1.00 11.42 C ATOM 950 CG1 VAL A 63 24.042 -87.051 -17.676 1.00 23.31 C ATOM 951 CG2 VAL A 63 22.973 -88.718 -16.123 1.00 10.23 C ATOM 0 H VAL A 63 22.843 -86.459 -14.649 1.00 63.31 H new ATOM 0 HA VAL A 63 21.724 -85.705 -17.281 1.00 53.30 H new ATOM 0 HB VAL A 63 22.160 -88.022 -17.965 1.00 11.42 H new ATOM 0 HG11 VAL A 63 24.623 -87.865 -18.109 1.00 23.31 H new ATOM 0 HG12 VAL A 63 23.837 -86.303 -18.442 1.00 23.31 H new ATOM 0 HG13 VAL A 63 24.607 -86.593 -16.864 1.00 23.31 H new ATOM 0 HG21 VAL A 63 23.571 -89.502 -16.589 1.00 10.23 H new ATOM 0 HG22 VAL A 63 23.507 -88.318 -15.261 1.00 10.23 H new ATOM 0 HG23 VAL A 63 22.020 -89.134 -15.798 1.00 10.23 H new ATOM 961 N GLY A 64 19.636 -87.257 -17.004 1.00 15.23 N ATOM 962 CA GLY A 64 18.305 -87.739 -16.677 1.00 55.25 C ATOM 963 C GLY A 64 17.275 -87.205 -17.647 1.00 30.41 C ATOM 964 O GLY A 64 17.487 -87.255 -18.862 1.00 63.55 O ATOM 0 H GLY A 64 19.813 -87.139 -18.002 1.00 15.23 H new ATOM 0 HA2 GLY A 64 18.295 -88.829 -16.696 1.00 55.25 H new ATOM 0 HA3 GLY A 64 18.045 -87.436 -15.663 1.00 55.25 H new ATOM 968 N TYR A 65 16.166 -86.683 -17.130 1.00 73.32 N ATOM 969 CA TYR A 65 15.126 -86.120 -17.987 1.00 13.32 C ATOM 970 C TYR A 65 14.121 -85.312 -17.171 1.00 31.43 C ATOM 971 O TYR A 65 13.880 -85.615 -16.005 1.00 30.44 O ATOM 972 CB TYR A 65 14.441 -87.237 -18.811 1.00 12.34 C ATOM 973 CG TYR A 65 12.948 -87.422 -18.572 1.00 12.32 C ATOM 974 CD1 TYR A 65 12.485 -88.236 -17.542 1.00 2.54 C ATOM 975 CD2 TYR A 65 12.008 -86.803 -19.393 1.00 43.24 C ATOM 976 CE1 TYR A 65 11.132 -88.427 -17.337 1.00 14.21 C ATOM 977 CE2 TYR A 65 10.654 -86.985 -19.189 1.00 74.34 C ATOM 978 CZ TYR A 65 10.220 -87.800 -18.161 1.00 4.14 C ATOM 979 OH TYR A 65 8.869 -87.998 -17.964 1.00 22.34 O ATOM 0 H TYR A 65 15.965 -86.638 -16.131 1.00 73.32 H new ATOM 0 HA TYR A 65 15.591 -85.430 -18.691 1.00 13.32 H new ATOM 0 HB2 TYR A 65 14.596 -87.028 -19.869 1.00 12.34 H new ATOM 0 HB3 TYR A 65 14.943 -88.180 -18.595 1.00 12.34 H new ATOM 0 HD1 TYR A 65 13.195 -88.726 -16.892 1.00 2.54 H new ATOM 0 HD2 TYR A 65 12.343 -86.171 -20.202 1.00 43.24 H new ATOM 0 HE1 TYR A 65 10.790 -89.064 -16.535 1.00 14.21 H new ATOM 0 HE2 TYR A 65 9.938 -86.493 -19.830 1.00 74.34 H new ATOM 0 HH TYR A 65 8.699 -88.169 -17.014 1.00 22.34 H new ATOM 989 N VAL A 66 13.563 -84.268 -17.788 1.00 23.54 N ATOM 990 CA VAL A 66 12.572 -83.402 -17.138 1.00 72.34 C ATOM 991 C VAL A 66 11.451 -83.048 -18.116 1.00 10.41 C ATOM 992 O VAL A 66 11.707 -82.873 -19.308 1.00 63.31 O ATOM 993 CB VAL A 66 13.228 -82.102 -16.584 1.00 1.11 C ATOM 994 CG1 VAL A 66 12.185 -81.024 -16.292 1.00 51.44 C ATOM 995 CG2 VAL A 66 14.037 -82.410 -15.324 1.00 12.42 C ATOM 0 H VAL A 66 13.783 -83.999 -18.747 1.00 23.54 H new ATOM 0 HA VAL A 66 12.152 -83.953 -16.297 1.00 72.34 H new ATOM 0 HB VAL A 66 13.898 -81.717 -17.353 1.00 1.11 H new ATOM 0 HG11 VAL A 66 12.681 -80.133 -15.907 1.00 51.44 H new ATOM 0 HG12 VAL A 66 11.652 -80.775 -17.210 1.00 51.44 H new ATOM 0 HG13 VAL A 66 11.477 -81.394 -15.550 1.00 51.44 H new ATOM 0 HG21 VAL A 66 14.489 -81.492 -14.949 1.00 12.42 H new ATOM 0 HG22 VAL A 66 13.379 -82.828 -14.562 1.00 12.42 H new ATOM 0 HG23 VAL A 66 14.820 -83.130 -15.561 1.00 12.42 H new ATOM 1005 N THR A 67 10.223 -82.937 -17.591 1.00 33.35 N ATOM 1006 CA THR A 67 9.034 -82.600 -18.369 1.00 62.00 C ATOM 1007 C THR A 67 7.975 -81.988 -17.445 1.00 43.22 C ATOM 1008 O THR A 67 8.059 -82.137 -16.224 1.00 43.20 O ATOM 1009 CB THR A 67 8.431 -83.835 -19.088 1.00 20.20 C ATOM 1010 OG1 THR A 67 7.318 -83.440 -19.897 1.00 12.03 O ATOM 1011 CG2 THR A 67 7.966 -84.888 -18.094 1.00 52.41 C ATOM 0 H THR A 67 10.030 -83.082 -16.600 1.00 33.35 H new ATOM 0 HA THR A 67 9.336 -81.885 -19.134 1.00 62.00 H new ATOM 0 HB THR A 67 9.215 -84.264 -19.711 1.00 20.20 H new ATOM 0 HG1 THR A 67 6.946 -84.227 -20.348 1.00 12.03 H new ATOM 0 HG21 THR A 67 7.549 -85.739 -18.633 1.00 52.41 H new ATOM 0 HG22 THR A 67 8.812 -85.219 -17.492 1.00 52.41 H new ATOM 0 HG23 THR A 67 7.203 -84.462 -17.443 1.00 52.41 H new ATOM 1019 N ASN A 68 6.994 -81.293 -18.016 1.00 24.14 N ATOM 1020 CA ASN A 68 5.948 -80.641 -17.224 1.00 73.40 C ATOM 1021 C ASN A 68 4.570 -81.182 -17.603 1.00 73.12 C ATOM 1022 O ASN A 68 4.395 -81.768 -18.672 1.00 10.52 O ATOM 1023 CB ASN A 68 6.008 -79.120 -17.427 1.00 71.15 C ATOM 1024 CG ASN A 68 4.917 -78.361 -16.682 1.00 11.14 C ATOM 1025 OD1 ASN A 68 3.861 -78.067 -17.236 1.00 14.14 O ATOM 1026 ND2 ASN A 68 5.159 -78.047 -15.418 1.00 71.23 N ATOM 0 H ASN A 68 6.899 -81.165 -19.024 1.00 24.14 H new ATOM 0 HA ASN A 68 6.118 -80.860 -16.170 1.00 73.40 H new ATOM 0 HB2 ASN A 68 6.981 -78.756 -17.098 1.00 71.15 H new ATOM 0 HB3 ASN A 68 5.929 -78.901 -18.492 1.00 71.15 H new ATOM 0 HD21 ASN A 68 4.457 -77.546 -14.874 1.00 71.23 H new ATOM 0 HD22 ASN A 68 6.047 -78.307 -14.989 1.00 71.23 H new ATOM 1033 N ASN A 69 3.603 -81.008 -16.709 1.00 74.00 N ATOM 1034 CA ASN A 69 2.226 -81.431 -16.959 1.00 52.24 C ATOM 1035 C ASN A 69 1.263 -80.277 -16.711 1.00 5.25 C ATOM 1036 O ASN A 69 1.607 -79.304 -16.039 1.00 52.52 O ATOM 1037 CB ASN A 69 1.851 -82.628 -16.072 1.00 72.13 C ATOM 1038 CG ASN A 69 2.544 -83.922 -16.478 1.00 72.22 C ATOM 1039 OD1 ASN A 69 2.840 -84.764 -15.632 1.00 2.34 O ATOM 1040 ND2 ASN A 69 2.784 -84.104 -17.769 1.00 31.15 N ATOM 0 H ASN A 69 3.747 -80.574 -15.797 1.00 74.00 H new ATOM 0 HA ASN A 69 2.151 -81.738 -18.002 1.00 52.24 H new ATOM 0 HB2 ASN A 69 2.105 -82.398 -15.037 1.00 72.13 H new ATOM 0 HB3 ASN A 69 0.772 -82.775 -16.110 1.00 72.13 H new ATOM 0 HD21 ASN A 69 3.228 -84.965 -18.089 1.00 31.15 H new ATOM 0 HD22 ASN A 69 2.525 -83.383 -18.443 1.00 31.15 H new ATOM 1047 N GLU A 70 0.045 -80.414 -17.239 1.00 63.52 N ATOM 1048 CA GLU A 70 -0.985 -79.374 -17.147 1.00 54.22 C ATOM 1049 C GLU A 70 -1.215 -78.910 -15.705 1.00 23.41 C ATOM 1050 O GLU A 70 -1.651 -77.783 -15.467 1.00 22.31 O ATOM 1051 CB GLU A 70 -2.305 -79.893 -17.731 1.00 35.24 C ATOM 1052 CG GLU A 70 -2.775 -81.208 -17.110 1.00 73.50 C ATOM 1053 CD GLU A 70 -4.187 -81.585 -17.527 1.00 44.50 C ATOM 1054 OE1 GLU A 70 -4.423 -81.782 -18.737 1.00 32.11 O ATOM 1055 OE2 GLU A 70 -5.073 -81.659 -16.650 1.00 22.30 O ATOM 0 H GLU A 70 -0.256 -81.248 -17.743 1.00 63.52 H new ATOM 0 HA GLU A 70 -0.630 -78.517 -17.720 1.00 54.22 H new ATOM 0 HB2 GLU A 70 -3.077 -79.137 -17.588 1.00 35.24 H new ATOM 0 HB3 GLU A 70 -2.188 -80.030 -18.806 1.00 35.24 H new ATOM 0 HG2 GLU A 70 -2.091 -82.006 -17.399 1.00 73.50 H new ATOM 0 HG3 GLU A 70 -2.731 -81.128 -16.024 1.00 73.50 H new ATOM 1062 N ASP A 71 -0.927 -79.784 -14.747 1.00 53.44 N ATOM 1063 CA ASP A 71 -1.137 -79.483 -13.327 1.00 52.32 C ATOM 1064 C ASP A 71 -0.135 -78.437 -12.829 1.00 60.33 C ATOM 1065 O ASP A 71 -0.196 -78.006 -11.675 1.00 61.33 O ATOM 1066 CB ASP A 71 -1.000 -80.762 -12.492 1.00 72.43 C ATOM 1067 CG ASP A 71 -1.890 -81.892 -12.994 1.00 73.01 C ATOM 1068 OD1 ASP A 71 -3.050 -81.998 -12.542 1.00 44.11 O ATOM 1069 OD2 ASP A 71 -1.427 -82.685 -13.841 1.00 23.34 O ATOM 0 H ASP A 71 -0.545 -80.713 -14.925 1.00 53.44 H new ATOM 0 HA ASP A 71 -2.143 -79.079 -13.215 1.00 52.32 H new ATOM 0 HB2 ASP A 71 0.039 -81.090 -12.506 1.00 72.43 H new ATOM 0 HB3 ASP A 71 -1.251 -80.542 -11.454 1.00 72.43 H new ATOM 1074 N GLY A 72 0.781 -78.030 -13.706 1.00 2.22 N ATOM 1075 CA GLY A 72 1.831 -77.106 -13.320 1.00 24.21 C ATOM 1076 C GLY A 72 2.927 -77.818 -12.560 1.00 64.40 C ATOM 1077 O GLY A 72 3.676 -77.206 -11.797 1.00 24.14 O ATOM 0 H GLY A 72 0.813 -78.327 -14.681 1.00 2.22 H new ATOM 0 HA2 GLY A 72 2.248 -76.632 -14.209 1.00 24.21 H new ATOM 0 HA3 GLY A 72 1.412 -76.312 -12.702 1.00 24.21 H new ATOM 1081 N SER A 73 3.007 -79.125 -12.770 1.00 74.30 N ATOM 1082 CA SER A 73 3.969 -79.969 -12.081 1.00 53.52 C ATOM 1083 C SER A 73 5.134 -80.332 -13.005 1.00 5.24 C ATOM 1084 O SER A 73 4.928 -80.753 -14.145 1.00 20.32 O ATOM 1085 CB SER A 73 3.266 -81.234 -11.578 1.00 23.04 C ATOM 1086 OG SER A 73 2.517 -81.851 -12.616 1.00 33.31 O ATOM 0 H SER A 73 2.406 -79.628 -13.423 1.00 74.30 H new ATOM 0 HA SER A 73 4.377 -79.422 -11.231 1.00 53.52 H new ATOM 0 HB2 SER A 73 4.006 -81.936 -11.193 1.00 23.04 H new ATOM 0 HB3 SER A 73 2.605 -80.981 -10.749 1.00 23.04 H new ATOM 0 HG SER A 73 2.080 -82.657 -12.269 1.00 33.31 H new ATOM 1092 N VAL A 74 6.353 -80.140 -12.510 1.00 2.14 N ATOM 1093 CA VAL A 74 7.557 -80.520 -13.238 1.00 23.14 C ATOM 1094 C VAL A 74 8.079 -81.850 -12.697 1.00 45.15 C ATOM 1095 O VAL A 74 8.457 -81.946 -11.529 1.00 50.12 O ATOM 1096 CB VAL A 74 8.659 -79.436 -13.114 1.00 61.55 C ATOM 1097 CG1 VAL A 74 9.887 -79.806 -13.944 1.00 25.24 C ATOM 1098 CG2 VAL A 74 8.114 -78.068 -13.525 1.00 44.21 C ATOM 0 H VAL A 74 6.533 -79.719 -11.598 1.00 2.14 H new ATOM 0 HA VAL A 74 7.301 -80.621 -14.293 1.00 23.14 H new ATOM 0 HB VAL A 74 8.967 -79.382 -12.070 1.00 61.55 H new ATOM 0 HG11 VAL A 74 10.644 -79.029 -13.839 1.00 25.24 H new ATOM 0 HG12 VAL A 74 10.290 -80.756 -13.593 1.00 25.24 H new ATOM 0 HG13 VAL A 74 9.603 -79.897 -14.993 1.00 25.24 H new ATOM 0 HG21 VAL A 74 8.901 -77.320 -13.432 1.00 44.21 H new ATOM 0 HG22 VAL A 74 7.772 -78.108 -14.559 1.00 44.21 H new ATOM 0 HG23 VAL A 74 7.279 -77.799 -12.877 1.00 44.21 H new ATOM 1108 N SER A 75 8.075 -82.870 -13.540 1.00 24.41 N ATOM 1109 CA SER A 75 8.490 -84.211 -13.140 1.00 33.53 C ATOM 1110 C SER A 75 9.628 -84.718 -14.025 1.00 25.55 C ATOM 1111 O SER A 75 9.763 -84.298 -15.175 1.00 44.43 O ATOM 1112 CB SER A 75 7.289 -85.161 -13.209 1.00 45.42 C ATOM 1113 OG SER A 75 6.598 -85.026 -14.446 1.00 50.11 O ATOM 0 H SER A 75 7.786 -82.796 -14.516 1.00 24.41 H new ATOM 0 HA SER A 75 8.859 -84.174 -12.115 1.00 33.53 H new ATOM 0 HB2 SER A 75 7.628 -86.190 -13.089 1.00 45.42 H new ATOM 0 HB3 SER A 75 6.608 -84.952 -12.384 1.00 45.42 H new ATOM 0 HG SER A 75 5.838 -85.644 -14.465 1.00 50.11 H new ATOM 1119 N GLY A 76 10.438 -85.620 -13.479 1.00 32.44 N ATOM 1120 CA GLY A 76 11.550 -86.184 -14.220 1.00 51.54 C ATOM 1121 C GLY A 76 12.445 -87.024 -13.336 1.00 43.42 C ATOM 1122 O GLY A 76 12.019 -87.474 -12.273 1.00 53.55 O ATOM 0 H GLY A 76 10.341 -85.973 -12.527 1.00 32.44 H new ATOM 0 HA2 GLY A 76 11.169 -86.796 -15.038 1.00 51.54 H new ATOM 0 HA3 GLY A 76 12.133 -85.380 -14.669 1.00 51.54 H new ATOM 1126 N VAL A 77 13.683 -87.243 -13.771 1.00 42.05 N ATOM 1127 CA VAL A 77 14.657 -88.015 -13.003 1.00 43.44 C ATOM 1128 C VAL A 77 16.038 -87.371 -13.116 1.00 74.14 C ATOM 1129 O VAL A 77 16.413 -86.886 -14.190 1.00 42.33 O ATOM 1130 CB VAL A 77 14.750 -89.489 -13.488 1.00 53.04 C ATOM 1131 CG1 VAL A 77 15.759 -90.270 -12.648 1.00 73.25 C ATOM 1132 CG2 VAL A 77 13.384 -90.174 -13.453 1.00 44.22 C ATOM 0 H VAL A 77 14.038 -86.893 -14.661 1.00 42.05 H new ATOM 0 HA VAL A 77 14.319 -88.017 -11.967 1.00 43.44 H new ATOM 0 HB VAL A 77 15.093 -89.476 -14.523 1.00 53.04 H new ATOM 0 HG11 VAL A 77 15.809 -91.299 -13.003 1.00 73.25 H new ATOM 0 HG12 VAL A 77 16.742 -89.807 -12.737 1.00 73.25 H new ATOM 0 HG13 VAL A 77 15.447 -90.262 -11.604 1.00 73.25 H new ATOM 0 HG21 VAL A 77 13.484 -91.203 -13.798 1.00 44.22 H new ATOM 0 HG22 VAL A 77 13.001 -90.169 -12.433 1.00 44.22 H new ATOM 0 HG23 VAL A 77 12.692 -89.639 -14.103 1.00 44.22 H new ATOM 1142 N VAL A 78 16.775 -87.361 -12.004 1.00 11.12 N ATOM 1143 CA VAL A 78 18.149 -86.866 -11.976 1.00 13.11 C ATOM 1144 C VAL A 78 19.099 -88.025 -11.677 1.00 3.40 C ATOM 1145 O VAL A 78 18.767 -88.925 -10.897 1.00 63.53 O ATOM 1146 CB VAL A 78 18.344 -85.756 -10.904 1.00 55.53 C ATOM 1147 CG1 VAL A 78 18.376 -86.347 -9.497 1.00 52.34 C ATOM 1148 CG2 VAL A 78 19.609 -84.947 -11.176 1.00 23.42 C ATOM 0 H VAL A 78 16.436 -87.695 -11.102 1.00 11.12 H new ATOM 0 HA VAL A 78 18.367 -86.433 -12.952 1.00 13.11 H new ATOM 0 HB VAL A 78 17.489 -85.083 -10.968 1.00 55.53 H new ATOM 0 HG11 VAL A 78 18.513 -85.547 -8.769 1.00 52.34 H new ATOM 0 HG12 VAL A 78 17.436 -86.862 -9.297 1.00 52.34 H new ATOM 0 HG13 VAL A 78 19.201 -87.055 -9.418 1.00 52.34 H new ATOM 0 HG21 VAL A 78 19.721 -84.178 -10.411 1.00 23.42 H new ATOM 0 HG22 VAL A 78 20.475 -85.608 -11.155 1.00 23.42 H new ATOM 0 HG23 VAL A 78 19.536 -84.476 -12.156 1.00 23.42 H new ATOM 1158 N GLN A 79 20.265 -88.014 -12.311 1.00 61.04 N ATOM 1159 CA GLN A 79 21.259 -89.068 -12.134 1.00 72.34 C ATOM 1160 C GLN A 79 22.661 -88.457 -12.167 1.00 51.25 C ATOM 1161 O GLN A 79 22.947 -87.602 -13.013 1.00 1.41 O ATOM 1162 CB GLN A 79 21.131 -90.124 -13.250 1.00 75.34 C ATOM 1163 CG GLN A 79 19.695 -90.381 -13.711 1.00 65.40 C ATOM 1164 CD GLN A 79 19.599 -91.354 -14.874 1.00 13.34 C ATOM 1165 OE1 GLN A 79 18.742 -91.211 -15.744 1.00 12.03 O ATOM 1166 NE2 GLN A 79 20.443 -92.374 -14.874 1.00 41.24 N ATOM 0 H GLN A 79 20.548 -87.279 -12.959 1.00 61.04 H new ATOM 0 HA GLN A 79 21.090 -89.552 -11.172 1.00 72.34 H new ATOM 0 HB2 GLN A 79 21.724 -89.804 -14.107 1.00 75.34 H new ATOM 0 HB3 GLN A 79 21.561 -91.062 -12.898 1.00 75.34 H new ATOM 0 HG2 GLN A 79 19.116 -90.770 -12.873 1.00 65.40 H new ATOM 0 HG3 GLN A 79 19.239 -89.434 -14.001 1.00 65.40 H new ATOM 0 HE21 GLN A 79 21.141 -92.459 -14.135 1.00 41.24 H new ATOM 0 HE22 GLN A 79 20.396 -93.075 -15.613 1.00 41.24 H new ATOM 1175 N GLY A 80 23.520 -88.872 -11.243 1.00 73.20 N ATOM 1176 CA GLY A 80 24.895 -88.403 -11.240 1.00 70.11 C ATOM 1177 C GLY A 80 25.546 -88.542 -9.878 1.00 45.11 C ATOM 1178 O GLY A 80 25.042 -89.273 -9.024 1.00 30.00 O ATOM 0 H GLY A 80 23.289 -89.526 -10.495 1.00 73.20 H new ATOM 0 HA2 GLY A 80 25.470 -88.966 -11.975 1.00 70.11 H new ATOM 0 HA3 GLY A 80 24.921 -87.358 -11.548 1.00 70.11 H new ATOM 1182 N PRO A 81 26.678 -87.855 -9.643 1.00 21.24 N ATOM 1183 CA PRO A 81 27.353 -87.876 -8.342 1.00 24.25 C ATOM 1184 C PRO A 81 26.496 -87.204 -7.270 1.00 43.11 C ATOM 1185 O PRO A 81 25.937 -86.128 -7.500 1.00 61.12 O ATOM 1186 CB PRO A 81 28.649 -87.087 -8.592 1.00 14.12 C ATOM 1187 CG PRO A 81 28.346 -86.221 -9.770 1.00 1.43 C ATOM 1188 CD PRO A 81 27.384 -87.006 -10.623 1.00 73.32 C ATOM 0 HA PRO A 81 27.539 -88.886 -7.978 1.00 24.25 H new ATOM 0 HB2 PRO A 81 28.923 -86.490 -7.722 1.00 14.12 H new ATOM 0 HB3 PRO A 81 29.486 -87.755 -8.797 1.00 14.12 H new ATOM 0 HG2 PRO A 81 27.907 -85.274 -9.456 1.00 1.43 H new ATOM 0 HG3 PRO A 81 29.254 -85.983 -10.324 1.00 1.43 H new ATOM 0 HD2 PRO A 81 26.696 -86.352 -11.159 1.00 73.32 H new ATOM 0 HD3 PRO A 81 27.905 -87.603 -11.372 1.00 73.32 H new ATOM 1196 N LYS A 82 26.416 -87.825 -6.093 1.00 34.24 N ATOM 1197 CA LYS A 82 25.526 -87.363 -5.026 1.00 65.22 C ATOM 1198 C LYS A 82 25.821 -85.912 -4.630 1.00 10.03 C ATOM 1199 O LYS A 82 24.966 -85.232 -4.070 1.00 13.55 O ATOM 1200 CB LYS A 82 25.596 -88.313 -3.810 1.00 54.13 C ATOM 1201 CG LYS A 82 27.008 -88.596 -3.279 1.00 14.43 C ATOM 1202 CD LYS A 82 27.485 -87.546 -2.279 1.00 71.14 C ATOM 1203 CE LYS A 82 28.841 -87.912 -1.681 1.00 51.01 C ATOM 1204 NZ LYS A 82 29.254 -86.956 -0.619 1.00 4.33 N ATOM 0 H LYS A 82 26.960 -88.654 -5.853 1.00 34.24 H new ATOM 0 HA LYS A 82 24.505 -87.382 -5.408 1.00 65.22 H new ATOM 0 HB2 LYS A 82 25.001 -87.887 -3.002 1.00 54.13 H new ATOM 0 HB3 LYS A 82 25.132 -89.261 -4.083 1.00 54.13 H new ATOM 0 HG2 LYS A 82 27.023 -89.577 -2.804 1.00 14.43 H new ATOM 0 HG3 LYS A 82 27.705 -88.637 -4.116 1.00 14.43 H new ATOM 0 HD2 LYS A 82 27.555 -86.577 -2.774 1.00 71.14 H new ATOM 0 HD3 LYS A 82 26.750 -87.444 -1.480 1.00 71.14 H new ATOM 0 HE2 LYS A 82 28.795 -88.919 -1.266 1.00 51.01 H new ATOM 0 HE3 LYS A 82 29.594 -87.927 -2.469 1.00 51.01 H new ATOM 0 HZ1 LYS A 82 30.187 -87.229 -0.250 1.00 4.33 H new ATOM 0 HZ2 LYS A 82 29.306 -85.997 -1.017 1.00 4.33 H new ATOM 0 HZ3 LYS A 82 28.558 -86.973 0.153 1.00 4.33 H new ATOM 1218 N GLU A 83 27.027 -85.451 -4.947 1.00 45.34 N ATOM 1219 CA GLU A 83 27.414 -84.060 -4.718 1.00 53.14 C ATOM 1220 C GLU A 83 26.589 -83.126 -5.605 1.00 41.52 C ATOM 1221 O GLU A 83 25.972 -82.164 -5.131 1.00 1.31 O ATOM 1222 CB GLU A 83 28.908 -83.890 -5.035 1.00 53.44 C ATOM 1223 CG GLU A 83 29.812 -84.811 -4.226 1.00 34.25 C ATOM 1224 CD GLU A 83 29.950 -84.382 -2.776 1.00 42.22 C ATOM 1225 OE1 GLU A 83 29.010 -84.604 -1.988 1.00 53.32 O ATOM 1226 OE2 GLU A 83 31.010 -83.834 -2.414 1.00 25.22 O ATOM 0 H GLU A 83 27.759 -86.024 -5.366 1.00 45.34 H new ATOM 0 HA GLU A 83 27.228 -83.805 -3.675 1.00 53.14 H new ATOM 0 HB2 GLU A 83 29.069 -84.077 -6.097 1.00 53.44 H new ATOM 0 HB3 GLU A 83 29.195 -82.856 -4.847 1.00 53.44 H new ATOM 0 HG2 GLU A 83 29.415 -85.825 -4.263 1.00 34.25 H new ATOM 0 HG3 GLU A 83 30.799 -84.838 -4.687 1.00 34.25 H new ATOM 1233 N GLN A 84 26.576 -83.436 -6.896 1.00 71.32 N ATOM 1234 CA GLN A 84 25.873 -82.633 -7.887 1.00 73.41 C ATOM 1235 C GLN A 84 24.365 -82.862 -7.802 1.00 4.41 C ATOM 1236 O GLN A 84 23.579 -81.963 -8.095 1.00 35.12 O ATOM 1237 CB GLN A 84 26.420 -82.944 -9.292 1.00 70.43 C ATOM 1238 CG GLN A 84 27.665 -82.137 -9.669 1.00 43.51 C ATOM 1239 CD GLN A 84 28.631 -81.943 -8.510 1.00 53.33 C ATOM 1240 OE1 GLN A 84 28.523 -80.975 -7.758 1.00 64.14 O ATOM 1241 NE2 GLN A 84 29.580 -82.849 -8.359 1.00 5.13 N ATOM 0 H GLN A 84 27.052 -84.250 -7.284 1.00 71.32 H new ATOM 0 HA GLN A 84 26.047 -81.577 -7.681 1.00 73.41 H new ATOM 0 HB2 GLN A 84 26.657 -84.006 -9.351 1.00 70.43 H new ATOM 0 HB3 GLN A 84 25.638 -82.750 -10.026 1.00 70.43 H new ATOM 0 HG2 GLN A 84 28.183 -82.642 -10.484 1.00 43.51 H new ATOM 0 HG3 GLN A 84 27.357 -81.161 -10.043 1.00 43.51 H new ATOM 0 HE21 GLN A 84 29.638 -83.638 -9.002 1.00 5.13 H new ATOM 0 HE22 GLN A 84 30.255 -82.759 -7.599 1.00 5.13 H new ATOM 1250 N VAL A 85 23.967 -84.068 -7.403 1.00 33.13 N ATOM 1251 CA VAL A 85 22.557 -84.366 -7.160 1.00 22.34 C ATOM 1252 C VAL A 85 22.060 -83.538 -5.976 1.00 73.43 C ATOM 1253 O VAL A 85 20.947 -83.010 -5.990 1.00 53.31 O ATOM 1254 CB VAL A 85 22.322 -85.876 -6.886 1.00 44.11 C ATOM 1255 CG1 VAL A 85 20.855 -86.155 -6.560 1.00 71.00 C ATOM 1256 CG2 VAL A 85 22.775 -86.718 -8.078 1.00 25.24 C ATOM 0 H VAL A 85 24.598 -84.853 -7.241 1.00 33.13 H new ATOM 0 HA VAL A 85 21.998 -84.106 -8.059 1.00 22.34 H new ATOM 0 HB VAL A 85 22.920 -86.155 -6.018 1.00 44.11 H new ATOM 0 HG11 VAL A 85 20.720 -87.220 -6.373 1.00 71.00 H new ATOM 0 HG12 VAL A 85 20.566 -85.591 -5.673 1.00 71.00 H new ATOM 0 HG13 VAL A 85 20.231 -85.853 -7.401 1.00 71.00 H new ATOM 0 HG21 VAL A 85 22.602 -87.773 -7.865 1.00 25.24 H new ATOM 0 HG22 VAL A 85 22.209 -86.429 -8.964 1.00 25.24 H new ATOM 0 HG23 VAL A 85 23.838 -86.554 -8.257 1.00 25.24 H new ATOM 1266 N ASP A 86 22.911 -83.422 -4.959 1.00 15.30 N ATOM 1267 CA ASP A 86 22.650 -82.554 -3.812 1.00 63.23 C ATOM 1268 C ASP A 86 22.499 -81.108 -4.279 1.00 64.31 C ATOM 1269 O ASP A 86 21.553 -80.405 -3.905 1.00 72.04 O ATOM 1270 CB ASP A 86 23.805 -82.680 -2.803 1.00 35.40 C ATOM 1271 CG ASP A 86 23.736 -81.675 -1.665 1.00 14.31 C ATOM 1272 OD1 ASP A 86 23.012 -81.933 -0.677 1.00 32.10 O ATOM 1273 OD2 ASP A 86 24.421 -80.631 -1.740 1.00 61.35 O ATOM 0 H ASP A 86 23.797 -83.924 -4.906 1.00 15.30 H new ATOM 0 HA ASP A 86 21.722 -82.857 -3.326 1.00 63.23 H new ATOM 0 HB2 ASP A 86 23.803 -83.687 -2.387 1.00 35.40 H new ATOM 0 HB3 ASP A 86 24.751 -82.554 -3.330 1.00 35.40 H new ATOM 1278 N ALA A 87 23.437 -80.679 -5.119 1.00 21.34 N ATOM 1279 CA ALA A 87 23.391 -79.352 -5.720 1.00 34.53 C ATOM 1280 C ALA A 87 22.070 -79.137 -6.457 1.00 20.20 C ATOM 1281 O ALA A 87 21.445 -78.081 -6.345 1.00 62.15 O ATOM 1282 CB ALA A 87 24.557 -79.176 -6.682 1.00 10.13 C ATOM 0 H ALA A 87 24.243 -81.237 -5.400 1.00 21.34 H new ATOM 0 HA ALA A 87 23.467 -78.611 -4.924 1.00 34.53 H new ATOM 0 HB1 ALA A 87 24.515 -78.182 -7.127 1.00 10.13 H new ATOM 0 HB2 ALA A 87 25.496 -79.292 -6.141 1.00 10.13 H new ATOM 0 HB3 ALA A 87 24.496 -79.928 -7.469 1.00 10.13 H new ATOM 1288 N PHE A 88 21.654 -80.162 -7.196 1.00 23.24 N ATOM 1289 CA PHE A 88 20.455 -80.097 -8.022 1.00 53.22 C ATOM 1290 C PHE A 88 19.197 -80.000 -7.158 1.00 41.43 C ATOM 1291 O PHE A 88 18.310 -79.190 -7.432 1.00 24.23 O ATOM 1292 CB PHE A 88 20.384 -81.328 -8.938 1.00 13.44 C ATOM 1293 CG PHE A 88 19.482 -81.149 -10.134 1.00 60.45 C ATOM 1294 CD1 PHE A 88 19.984 -80.626 -11.317 1.00 2.04 C ATOM 1295 CD2 PHE A 88 18.140 -81.501 -10.080 1.00 41.43 C ATOM 1296 CE1 PHE A 88 19.170 -80.461 -12.420 1.00 65.45 C ATOM 1297 CE2 PHE A 88 17.321 -81.335 -11.182 1.00 43.45 C ATOM 1298 CZ PHE A 88 17.838 -80.816 -12.354 1.00 72.11 C ATOM 0 H PHE A 88 22.138 -81.059 -7.238 1.00 23.24 H new ATOM 0 HA PHE A 88 20.508 -79.198 -8.637 1.00 53.22 H new ATOM 0 HB2 PHE A 88 21.389 -81.568 -9.286 1.00 13.44 H new ATOM 0 HB3 PHE A 88 20.035 -82.182 -8.357 1.00 13.44 H new ATOM 0 HD1 PHE A 88 21.025 -80.344 -11.376 1.00 2.04 H new ATOM 0 HD2 PHE A 88 17.731 -81.909 -9.167 1.00 41.43 H new ATOM 0 HE1 PHE A 88 19.576 -80.054 -13.334 1.00 65.45 H new ATOM 0 HE2 PHE A 88 16.278 -81.611 -11.127 1.00 43.45 H new ATOM 0 HZ PHE A 88 17.201 -80.688 -13.217 1.00 72.11 H new ATOM 1308 N VAL A 89 19.124 -80.820 -6.111 1.00 5.13 N ATOM 1309 CA VAL A 89 17.961 -80.821 -5.222 1.00 63.22 C ATOM 1310 C VAL A 89 17.849 -79.479 -4.490 1.00 22.42 C ATOM 1311 O VAL A 89 16.746 -78.959 -4.289 1.00 63.11 O ATOM 1312 CB VAL A 89 17.994 -81.995 -4.196 1.00 62.24 C ATOM 1313 CG1 VAL A 89 19.070 -81.795 -3.133 1.00 41.30 C ATOM 1314 CG2 VAL A 89 16.620 -82.190 -3.552 1.00 71.34 C ATOM 0 H VAL A 89 19.851 -81.489 -5.857 1.00 5.13 H new ATOM 0 HA VAL A 89 17.081 -80.967 -5.848 1.00 63.22 H new ATOM 0 HB VAL A 89 18.250 -82.900 -4.746 1.00 62.24 H new ATOM 0 HG11 VAL A 89 19.057 -82.636 -2.440 1.00 41.30 H new ATOM 0 HG12 VAL A 89 20.047 -81.734 -3.612 1.00 41.30 H new ATOM 0 HG13 VAL A 89 18.875 -80.872 -2.587 1.00 41.30 H new ATOM 0 HG21 VAL A 89 16.666 -83.014 -2.840 1.00 71.34 H new ATOM 0 HG22 VAL A 89 16.329 -81.277 -3.033 1.00 71.34 H new ATOM 0 HG23 VAL A 89 15.885 -82.418 -4.324 1.00 71.34 H new ATOM 1324 N LYS A 90 18.996 -78.909 -4.109 1.00 72.24 N ATOM 1325 CA LYS A 90 19.024 -77.581 -3.497 1.00 63.21 C ATOM 1326 C LYS A 90 18.563 -76.529 -4.501 1.00 31.12 C ATOM 1327 O LYS A 90 17.789 -75.632 -4.164 1.00 14.12 O ATOM 1328 CB LYS A 90 20.431 -77.258 -2.979 1.00 12.24 C ATOM 1329 CG LYS A 90 20.830 -78.083 -1.760 1.00 73.32 C ATOM 1330 CD LYS A 90 22.288 -77.865 -1.380 1.00 40.24 C ATOM 1331 CE LYS A 90 22.653 -78.612 -0.105 1.00 1.53 C ATOM 1332 NZ LYS A 90 24.121 -78.613 0.128 1.00 60.33 N ATOM 0 H LYS A 90 19.912 -79.345 -4.214 1.00 72.24 H new ATOM 0 HA LYS A 90 18.340 -77.572 -2.649 1.00 63.21 H new ATOM 0 HB2 LYS A 90 21.153 -77.430 -3.777 1.00 12.24 H new ATOM 0 HB3 LYS A 90 20.483 -76.199 -2.725 1.00 12.24 H new ATOM 0 HG2 LYS A 90 20.192 -77.818 -0.917 1.00 73.32 H new ATOM 0 HG3 LYS A 90 20.663 -79.140 -1.966 1.00 73.32 H new ATOM 0 HD2 LYS A 90 22.931 -78.199 -2.195 1.00 40.24 H new ATOM 0 HD3 LYS A 90 22.474 -76.800 -1.244 1.00 40.24 H new ATOM 0 HE2 LYS A 90 22.150 -78.150 0.744 1.00 1.53 H new ATOM 0 HE3 LYS A 90 22.294 -79.639 -0.169 1.00 1.53 H new ATOM 0 HZ1 LYS A 90 24.314 -78.831 1.126 1.00 60.33 H new ATOM 0 HZ2 LYS A 90 24.568 -79.332 -0.476 1.00 60.33 H new ATOM 0 HZ3 LYS A 90 24.510 -77.676 -0.103 1.00 60.33 H new ATOM 1346 N TYR A 91 19.038 -76.662 -5.736 1.00 10.11 N ATOM 1347 CA TYR A 91 18.606 -75.808 -6.838 1.00 12.44 C ATOM 1348 C TYR A 91 17.088 -75.888 -6.997 1.00 44.40 C ATOM 1349 O TYR A 91 16.416 -74.879 -7.222 1.00 2.03 O ATOM 1350 CB TYR A 91 19.322 -76.246 -8.128 1.00 54.24 C ATOM 1351 CG TYR A 91 18.632 -75.837 -9.420 1.00 52.31 C ATOM 1352 CD1 TYR A 91 18.747 -74.547 -9.925 1.00 71.31 C ATOM 1353 CD2 TYR A 91 17.871 -76.756 -10.140 1.00 52.30 C ATOM 1354 CE1 TYR A 91 18.126 -74.185 -11.106 1.00 23.41 C ATOM 1355 CE2 TYR A 91 17.247 -76.401 -11.320 1.00 24.51 C ATOM 1356 CZ TYR A 91 17.378 -75.117 -11.799 1.00 4.44 C ATOM 1357 OH TYR A 91 16.765 -74.762 -12.979 1.00 53.33 O ATOM 0 H TYR A 91 19.731 -77.362 -6.001 1.00 10.11 H new ATOM 0 HA TYR A 91 18.867 -74.771 -6.627 1.00 12.44 H new ATOM 0 HB2 TYR A 91 20.329 -75.830 -8.125 1.00 54.24 H new ATOM 0 HB3 TYR A 91 19.425 -77.331 -8.117 1.00 54.24 H new ATOM 0 HD1 TYR A 91 19.331 -73.816 -9.386 1.00 71.31 H new ATOM 0 HD2 TYR A 91 17.767 -77.765 -9.768 1.00 52.30 H new ATOM 0 HE1 TYR A 91 18.225 -73.179 -11.485 1.00 23.41 H new ATOM 0 HE2 TYR A 91 16.660 -77.126 -11.864 1.00 24.51 H new ATOM 0 HH TYR A 91 16.052 -74.116 -12.795 1.00 53.33 H new ATOM 1367 N LEU A 92 16.563 -77.099 -6.858 1.00 51.34 N ATOM 1368 CA LEU A 92 15.135 -77.348 -6.985 1.00 60.14 C ATOM 1369 C LEU A 92 14.380 -76.720 -5.811 1.00 5.34 C ATOM 1370 O LEU A 92 13.258 -76.232 -5.965 1.00 21.55 O ATOM 1371 CB LEU A 92 14.876 -78.865 -7.044 1.00 42.10 C ATOM 1372 CG LEU A 92 13.831 -79.323 -8.073 1.00 14.12 C ATOM 1373 CD1 LEU A 92 12.470 -78.688 -7.805 1.00 1.11 C ATOM 1374 CD2 LEU A 92 14.312 -79.016 -9.491 1.00 4.50 C ATOM 0 H LEU A 92 17.114 -77.933 -6.655 1.00 51.34 H new ATOM 0 HA LEU A 92 14.774 -76.892 -7.907 1.00 60.14 H new ATOM 0 HB2 LEU A 92 15.818 -79.368 -7.262 1.00 42.10 H new ATOM 0 HB3 LEU A 92 14.558 -79.199 -6.057 1.00 42.10 H new ATOM 0 HG LEU A 92 13.710 -80.402 -7.976 1.00 14.12 H new ATOM 0 HD11 LEU A 92 11.754 -79.033 -8.551 1.00 1.11 H new ATOM 0 HD12 LEU A 92 12.125 -78.973 -6.811 1.00 1.11 H new ATOM 0 HD13 LEU A 92 12.557 -77.603 -7.861 1.00 1.11 H new ATOM 0 HD21 LEU A 92 13.561 -79.346 -10.209 1.00 4.50 H new ATOM 0 HD22 LEU A 92 14.469 -77.943 -9.598 1.00 4.50 H new ATOM 0 HD23 LEU A 92 15.249 -79.540 -9.679 1.00 4.50 H new ATOM 1386 N HIS A 93 15.008 -76.740 -4.634 1.00 5.42 N ATOM 1387 CA HIS A 93 14.417 -76.147 -3.432 1.00 23.34 C ATOM 1388 C HIS A 93 14.215 -74.639 -3.603 1.00 11.23 C ATOM 1389 O HIS A 93 13.396 -74.032 -2.908 1.00 14.15 O ATOM 1390 CB HIS A 93 15.286 -76.421 -2.193 1.00 35.40 C ATOM 1391 CG HIS A 93 15.304 -77.858 -1.756 1.00 30.45 C ATOM 1392 ND1 HIS A 93 16.224 -78.363 -0.861 1.00 2.31 N ATOM 1393 CD2 HIS A 93 14.493 -78.895 -2.080 1.00 73.34 C ATOM 1394 CE1 HIS A 93 15.982 -79.645 -0.658 1.00 65.23 C ATOM 1395 NE2 HIS A 93 14.936 -79.993 -1.385 1.00 2.30 N ATOM 0 H HIS A 93 15.926 -77.160 -4.487 1.00 5.42 H new ATOM 0 HA HIS A 93 13.444 -76.615 -3.285 1.00 23.34 H new ATOM 0 HB2 HIS A 93 16.308 -76.105 -2.403 1.00 35.40 H new ATOM 0 HB3 HIS A 93 14.925 -75.807 -1.368 1.00 35.40 H new ATOM 0 HD2 HIS A 93 13.654 -78.863 -2.759 1.00 73.34 H new ATOM 0 HE1 HIS A 93 16.544 -80.298 -0.007 1.00 65.23 H new ATOM 0 HE2 HIS A 93 14.524 -80.925 -1.424 1.00 2.30 H new ATOM 1404 N LYS A 94 14.975 -74.040 -4.519 1.00 64.43 N ATOM 1405 CA LYS A 94 14.838 -72.619 -4.824 1.00 13.01 C ATOM 1406 C LYS A 94 13.563 -72.375 -5.633 1.00 4.10 C ATOM 1407 O LYS A 94 12.687 -71.607 -5.221 1.00 53.20 O ATOM 1408 CB LYS A 94 16.065 -72.115 -5.603 1.00 13.44 C ATOM 1409 CG LYS A 94 17.378 -72.210 -4.825 1.00 34.11 C ATOM 1410 CD LYS A 94 17.378 -71.312 -3.589 1.00 31.12 C ATOM 1411 CE LYS A 94 17.285 -69.833 -3.957 1.00 75.41 C ATOM 1412 NZ LYS A 94 17.309 -68.960 -2.757 1.00 1.31 N ATOM 0 H LYS A 94 15.693 -74.519 -5.063 1.00 64.43 H new ATOM 0 HA LYS A 94 14.772 -72.067 -3.886 1.00 13.01 H new ATOM 0 HB2 LYS A 94 16.158 -72.689 -6.525 1.00 13.44 H new ATOM 0 HB3 LYS A 94 15.899 -71.077 -5.890 1.00 13.44 H new ATOM 0 HG2 LYS A 94 17.546 -73.244 -4.522 1.00 34.11 H new ATOM 0 HG3 LYS A 94 18.206 -71.930 -5.476 1.00 34.11 H new ATOM 0 HD2 LYS A 94 16.539 -71.579 -2.947 1.00 31.12 H new ATOM 0 HD3 LYS A 94 18.288 -71.486 -3.014 1.00 31.12 H new ATOM 0 HE2 LYS A 94 18.114 -69.570 -4.614 1.00 75.41 H new ATOM 0 HE3 LYS A 94 16.367 -69.655 -4.516 1.00 75.41 H new ATOM 0 HZ1 LYS A 94 17.244 -67.964 -3.051 1.00 1.31 H new ATOM 0 HZ2 LYS A 94 16.503 -69.193 -2.142 1.00 1.31 H new ATOM 0 HZ3 LYS A 94 18.197 -69.110 -2.236 1.00 1.31 H new ATOM 1426 N GLY A 95 13.464 -73.047 -6.777 1.00 31.54 N ATOM 1427 CA GLY A 95 12.295 -72.919 -7.632 1.00 21.24 C ATOM 1428 C GLY A 95 12.498 -71.920 -8.754 1.00 10.52 C ATOM 1429 O GLY A 95 13.584 -71.350 -8.902 1.00 3.03 O ATOM 0 H GLY A 95 14.179 -73.683 -7.130 1.00 31.54 H new ATOM 0 HA2 GLY A 95 12.053 -73.893 -8.057 1.00 21.24 H new ATOM 0 HA3 GLY A 95 11.440 -72.613 -7.029 1.00 21.24 H new ATOM 1433 N SER A 96 11.452 -71.711 -9.547 1.00 75.45 N ATOM 1434 CA SER A 96 11.499 -70.780 -10.666 1.00 64.44 C ATOM 1435 C SER A 96 11.068 -69.386 -10.193 1.00 73.22 C ATOM 1436 O SER A 96 10.148 -69.268 -9.385 1.00 41.20 O ATOM 1437 CB SER A 96 10.584 -71.287 -11.795 1.00 73.31 C ATOM 1438 OG SER A 96 10.650 -70.461 -12.949 1.00 75.44 O ATOM 0 H SER A 96 10.553 -72.180 -9.432 1.00 75.45 H new ATOM 0 HA SER A 96 12.517 -70.713 -11.051 1.00 64.44 H new ATOM 0 HB2 SER A 96 10.868 -72.305 -12.062 1.00 73.31 H new ATOM 0 HB3 SER A 96 9.555 -71.327 -11.437 1.00 73.31 H new ATOM 0 HG SER A 96 9.971 -70.747 -13.595 1.00 75.44 H new ATOM 1444 N PRO A 97 11.720 -68.314 -10.693 1.00 15.32 N ATOM 1445 CA PRO A 97 11.468 -66.936 -10.236 1.00 63.34 C ATOM 1446 C PRO A 97 9.981 -66.561 -10.251 1.00 3.15 C ATOM 1447 O PRO A 97 9.468 -65.971 -9.298 1.00 13.01 O ATOM 1448 CB PRO A 97 12.262 -66.064 -11.233 1.00 53.52 C ATOM 1449 CG PRO A 97 12.653 -66.982 -12.348 1.00 13.42 C ATOM 1450 CD PRO A 97 12.754 -68.352 -11.738 1.00 51.42 C ATOM 0 HA PRO A 97 11.774 -66.801 -9.199 1.00 63.34 H new ATOM 0 HB2 PRO A 97 11.654 -65.237 -11.601 1.00 53.52 H new ATOM 0 HB3 PRO A 97 13.141 -65.627 -10.758 1.00 53.52 H new ATOM 0 HG2 PRO A 97 11.912 -66.964 -13.147 1.00 13.42 H new ATOM 0 HG3 PRO A 97 13.603 -66.679 -12.788 1.00 13.42 H new ATOM 0 HD2 PRO A 97 12.562 -69.137 -12.470 1.00 51.42 H new ATOM 0 HD3 PRO A 97 13.744 -68.539 -11.322 1.00 51.42 H new ATOM 1458 N LYS A 98 9.294 -66.911 -11.334 1.00 53.54 N ATOM 1459 CA LYS A 98 7.875 -66.581 -11.487 1.00 24.34 C ATOM 1460 C LYS A 98 6.993 -67.796 -11.222 1.00 74.31 C ATOM 1461 O LYS A 98 5.773 -67.734 -11.380 1.00 21.32 O ATOM 1462 CB LYS A 98 7.602 -66.021 -12.889 1.00 51.22 C ATOM 1463 CG LYS A 98 8.283 -64.680 -13.160 1.00 43.41 C ATOM 1464 CD LYS A 98 7.844 -63.599 -12.165 1.00 31.02 C ATOM 1465 CE LYS A 98 6.332 -63.373 -12.187 1.00 2.21 C ATOM 1466 NZ LYS A 98 5.908 -62.303 -11.245 1.00 75.23 N ATOM 0 H LYS A 98 9.694 -67.423 -12.120 1.00 53.54 H new ATOM 0 HA LYS A 98 7.629 -65.818 -10.749 1.00 24.34 H new ATOM 0 HB2 LYS A 98 7.938 -66.745 -13.631 1.00 51.22 H new ATOM 0 HB3 LYS A 98 6.526 -65.905 -13.021 1.00 51.22 H new ATOM 0 HG2 LYS A 98 9.364 -64.805 -13.105 1.00 43.41 H new ATOM 0 HG3 LYS A 98 8.051 -64.354 -14.174 1.00 43.41 H new ATOM 0 HD2 LYS A 98 8.152 -63.886 -11.160 1.00 31.02 H new ATOM 0 HD3 LYS A 98 8.353 -62.664 -12.399 1.00 31.02 H new ATOM 0 HE2 LYS A 98 6.021 -63.109 -13.198 1.00 2.21 H new ATOM 0 HE3 LYS A 98 5.824 -64.303 -11.930 1.00 2.21 H new ATOM 0 HZ1 LYS A 98 4.876 -62.186 -11.295 1.00 75.23 H new ATOM 0 HZ2 LYS A 98 6.180 -62.565 -10.276 1.00 75.23 H new ATOM 0 HZ3 LYS A 98 6.371 -61.409 -11.504 1.00 75.23 H new ATOM 1480 N SER A 99 7.612 -68.889 -10.804 1.00 22.33 N ATOM 1481 CA SER A 99 6.887 -70.102 -10.460 1.00 33.13 C ATOM 1482 C SER A 99 7.430 -70.653 -9.142 1.00 51.15 C ATOM 1483 O SER A 99 8.307 -71.525 -9.120 1.00 65.20 O ATOM 1484 CB SER A 99 6.998 -71.140 -11.589 1.00 24.15 C ATOM 1485 OG SER A 99 6.157 -72.258 -11.354 1.00 42.35 O ATOM 0 H SER A 99 8.624 -68.961 -10.694 1.00 22.33 H new ATOM 0 HA SER A 99 5.829 -69.872 -10.336 1.00 33.13 H new ATOM 0 HB2 SER A 99 6.731 -70.676 -12.538 1.00 24.15 H new ATOM 0 HB3 SER A 99 8.032 -71.474 -11.677 1.00 24.15 H new ATOM 0 HG SER A 99 5.701 -72.505 -12.186 1.00 42.35 H new ATOM 1491 N VAL A 100 6.943 -70.080 -8.046 1.00 74.22 N ATOM 1492 CA VAL A 100 7.357 -70.484 -6.709 1.00 45.42 C ATOM 1493 C VAL A 100 6.868 -71.897 -6.419 1.00 51.00 C ATOM 1494 O VAL A 100 5.690 -72.206 -6.625 1.00 74.34 O ATOM 1495 CB VAL A 100 6.814 -69.513 -5.630 1.00 21.34 C ATOM 1496 CG1 VAL A 100 7.280 -69.928 -4.233 1.00 13.01 C ATOM 1497 CG2 VAL A 100 7.231 -68.074 -5.938 1.00 20.43 C ATOM 0 H VAL A 100 6.255 -69.327 -8.060 1.00 74.22 H new ATOM 0 HA VAL A 100 8.446 -70.457 -6.673 1.00 45.42 H new ATOM 0 HB VAL A 100 5.725 -69.564 -5.648 1.00 21.34 H new ATOM 0 HG11 VAL A 100 6.885 -69.230 -3.495 1.00 13.01 H new ATOM 0 HG12 VAL A 100 6.918 -70.932 -4.012 1.00 13.01 H new ATOM 0 HG13 VAL A 100 8.369 -69.918 -4.195 1.00 13.01 H new ATOM 0 HG21 VAL A 100 6.839 -67.409 -5.168 1.00 20.43 H new ATOM 0 HG22 VAL A 100 8.319 -68.006 -5.957 1.00 20.43 H new ATOM 0 HG23 VAL A 100 6.832 -67.780 -6.909 1.00 20.43 H new ATOM 1507 N VAL A 101 7.775 -72.750 -5.957 1.00 73.33 N ATOM 1508 CA VAL A 101 7.450 -74.141 -5.682 1.00 33.12 C ATOM 1509 C VAL A 101 6.331 -74.260 -4.641 1.00 14.21 C ATOM 1510 O VAL A 101 6.426 -73.734 -3.529 1.00 71.23 O ATOM 1511 CB VAL A 101 8.698 -74.944 -5.218 1.00 1.53 C ATOM 1512 CG1 VAL A 101 9.736 -75.014 -6.338 1.00 0.11 C ATOM 1513 CG2 VAL A 101 9.309 -74.341 -3.953 1.00 23.20 C ATOM 0 H VAL A 101 8.745 -72.499 -5.765 1.00 73.33 H new ATOM 0 HA VAL A 101 7.098 -74.572 -6.619 1.00 33.12 H new ATOM 0 HB VAL A 101 8.375 -75.957 -4.979 1.00 1.53 H new ATOM 0 HG11 VAL A 101 10.603 -75.580 -5.996 1.00 0.11 H new ATOM 0 HG12 VAL A 101 9.301 -75.507 -7.207 1.00 0.11 H new ATOM 0 HG13 VAL A 101 10.046 -74.005 -6.611 1.00 0.11 H new ATOM 0 HG21 VAL A 101 10.179 -74.926 -3.655 1.00 23.20 H new ATOM 0 HG22 VAL A 101 9.613 -73.313 -4.150 1.00 23.20 H new ATOM 0 HG23 VAL A 101 8.571 -74.354 -3.151 1.00 23.20 H new ATOM 1523 N LYS A 102 5.254 -74.930 -5.040 1.00 25.24 N ATOM 1524 CA LYS A 102 4.138 -75.231 -4.153 1.00 22.23 C ATOM 1525 C LYS A 102 4.564 -76.330 -3.183 1.00 52.51 C ATOM 1526 O LYS A 102 4.327 -76.246 -1.976 1.00 64.20 O ATOM 1527 CB LYS A 102 2.929 -75.698 -4.983 1.00 14.41 C ATOM 1528 CG LYS A 102 1.654 -75.940 -4.174 1.00 2.24 C ATOM 1529 CD LYS A 102 0.670 -76.846 -4.919 1.00 35.55 C ATOM 1530 CE LYS A 102 0.296 -76.305 -6.299 1.00 34.44 C ATOM 1531 NZ LYS A 102 -0.539 -75.076 -6.222 1.00 11.03 N ATOM 0 H LYS A 102 5.132 -75.280 -5.990 1.00 25.24 H new ATOM 0 HA LYS A 102 3.855 -74.339 -3.593 1.00 22.23 H new ATOM 0 HB2 LYS A 102 2.721 -74.951 -5.749 1.00 14.41 H new ATOM 0 HB3 LYS A 102 3.195 -76.620 -5.501 1.00 14.41 H new ATOM 0 HG2 LYS A 102 1.912 -76.393 -3.217 1.00 2.24 H new ATOM 0 HG3 LYS A 102 1.175 -74.985 -3.956 1.00 2.24 H new ATOM 0 HD2 LYS A 102 1.108 -77.838 -5.029 1.00 35.55 H new ATOM 0 HD3 LYS A 102 -0.234 -76.962 -4.322 1.00 35.55 H new ATOM 0 HE2 LYS A 102 1.205 -76.088 -6.859 1.00 34.44 H new ATOM 0 HE3 LYS A 102 -0.244 -77.073 -6.853 1.00 34.44 H new ATOM 0 HZ1 LYS A 102 -0.183 -74.371 -6.899 1.00 11.03 H new ATOM 0 HZ2 LYS A 102 -1.525 -75.311 -6.454 1.00 11.03 H new ATOM 0 HZ3 LYS A 102 -0.493 -74.685 -5.259 1.00 11.03 H new ATOM 1545 N LYS A 103 5.205 -77.354 -3.742 1.00 12.03 N ATOM 1546 CA LYS A 103 5.771 -78.457 -2.971 1.00 72.44 C ATOM 1547 C LYS A 103 6.677 -79.299 -3.868 1.00 14.24 C ATOM 1548 O LYS A 103 6.341 -79.561 -5.026 1.00 53.50 O ATOM 1549 CB LYS A 103 4.663 -79.335 -2.366 1.00 61.22 C ATOM 1550 CG LYS A 103 5.192 -80.538 -1.587 1.00 3.35 C ATOM 1551 CD LYS A 103 4.068 -81.350 -0.955 1.00 22.31 C ATOM 1552 CE LYS A 103 4.605 -82.567 -0.213 1.00 15.43 C ATOM 1553 NZ LYS A 103 5.572 -82.195 0.855 1.00 35.52 N ATOM 0 H LYS A 103 5.347 -77.442 -4.748 1.00 12.03 H new ATOM 0 HA LYS A 103 6.356 -78.041 -2.151 1.00 72.44 H new ATOM 0 HB2 LYS A 103 4.049 -78.725 -1.703 1.00 61.22 H new ATOM 0 HB3 LYS A 103 4.013 -79.688 -3.167 1.00 61.22 H new ATOM 0 HG2 LYS A 103 5.769 -81.177 -2.255 1.00 3.35 H new ATOM 0 HG3 LYS A 103 5.873 -80.194 -0.808 1.00 3.35 H new ATOM 0 HD2 LYS A 103 3.507 -80.720 -0.264 1.00 22.31 H new ATOM 0 HD3 LYS A 103 3.372 -81.673 -1.729 1.00 22.31 H new ATOM 0 HE2 LYS A 103 3.774 -83.117 0.228 1.00 15.43 H new ATOM 0 HE3 LYS A 103 5.090 -83.237 -0.922 1.00 15.43 H new ATOM 0 HZ1 LYS A 103 5.768 -83.025 1.451 1.00 35.52 H new ATOM 0 HZ2 LYS A 103 6.457 -81.864 0.422 1.00 35.52 H new ATOM 0 HZ3 LYS A 103 5.168 -81.436 1.440 1.00 35.52 H new ATOM 1567 N VAL A 104 7.828 -79.700 -3.338 1.00 20.25 N ATOM 1568 CA VAL A 104 8.772 -80.541 -4.072 1.00 63.52 C ATOM 1569 C VAL A 104 8.731 -81.971 -3.530 1.00 23.40 C ATOM 1570 O VAL A 104 8.635 -82.178 -2.319 1.00 41.12 O ATOM 1571 CB VAL A 104 10.219 -79.975 -3.984 1.00 12.25 C ATOM 1572 CG1 VAL A 104 10.685 -79.873 -2.532 1.00 24.45 C ATOM 1573 CG2 VAL A 104 11.191 -80.815 -4.817 1.00 13.11 C ATOM 0 H VAL A 104 8.133 -79.455 -2.396 1.00 20.25 H new ATOM 0 HA VAL A 104 8.476 -80.546 -5.121 1.00 63.52 H new ATOM 0 HB VAL A 104 10.207 -78.968 -4.400 1.00 12.25 H new ATOM 0 HG11 VAL A 104 11.699 -79.475 -2.502 1.00 24.45 H new ATOM 0 HG12 VAL A 104 10.018 -79.209 -1.982 1.00 24.45 H new ATOM 0 HG13 VAL A 104 10.671 -80.862 -2.075 1.00 24.45 H new ATOM 0 HG21 VAL A 104 12.194 -80.397 -4.737 1.00 13.11 H new ATOM 0 HG22 VAL A 104 11.195 -81.840 -4.447 1.00 13.11 H new ATOM 0 HG23 VAL A 104 10.877 -80.807 -5.861 1.00 13.11 H new ATOM 1583 N SER A 105 8.786 -82.952 -4.423 1.00 70.15 N ATOM 1584 CA SER A 105 8.712 -84.354 -4.042 1.00 14.10 C ATOM 1585 C SER A 105 9.762 -85.157 -4.797 1.00 74.04 C ATOM 1586 O SER A 105 9.914 -85.005 -6.011 1.00 24.02 O ATOM 1587 CB SER A 105 7.308 -84.902 -4.337 1.00 4.52 C ATOM 1588 OG SER A 105 6.313 -84.161 -3.649 1.00 72.03 O ATOM 0 H SER A 105 8.883 -82.797 -5.427 1.00 70.15 H new ATOM 0 HA SER A 105 8.907 -84.443 -2.973 1.00 14.10 H new ATOM 0 HB2 SER A 105 7.118 -84.863 -5.410 1.00 4.52 H new ATOM 0 HB3 SER A 105 7.254 -85.950 -4.041 1.00 4.52 H new ATOM 0 HG SER A 105 5.429 -84.530 -3.856 1.00 72.03 H new ATOM 1594 N ILE A 106 10.493 -85.996 -4.074 1.00 60.24 N ATOM 1595 CA ILE A 106 11.556 -86.804 -4.659 1.00 10.30 C ATOM 1596 C ILE A 106 11.255 -88.290 -4.439 1.00 61.14 C ATOM 1597 O ILE A 106 10.587 -88.647 -3.467 1.00 52.41 O ATOM 1598 CB ILE A 106 12.939 -86.460 -4.033 1.00 72.12 C ATOM 1599 CG1 ILE A 106 13.107 -84.937 -3.861 1.00 61.14 C ATOM 1600 CG2 ILE A 106 14.063 -87.016 -4.901 1.00 61.45 C ATOM 1601 CD1 ILE A 106 13.092 -84.158 -5.162 1.00 61.02 C ATOM 0 H ILE A 106 10.367 -86.135 -3.071 1.00 60.24 H new ATOM 0 HA ILE A 106 11.598 -86.585 -5.726 1.00 10.30 H new ATOM 0 HB ILE A 106 12.988 -86.921 -3.047 1.00 72.12 H new ATOM 0 HG12 ILE A 106 12.309 -84.565 -3.219 1.00 61.14 H new ATOM 0 HG13 ILE A 106 14.047 -84.743 -3.345 1.00 61.14 H new ATOM 0 HG21 ILE A 106 15.025 -86.769 -4.453 1.00 61.45 H new ATOM 0 HG22 ILE A 106 13.964 -88.099 -4.974 1.00 61.45 H new ATOM 0 HG23 ILE A 106 14.004 -86.578 -5.897 1.00 61.45 H new ATOM 0 HD11 ILE A 106 13.216 -83.096 -4.951 1.00 61.02 H new ATOM 0 HD12 ILE A 106 13.908 -84.499 -5.800 1.00 61.02 H new ATOM 0 HD13 ILE A 106 12.142 -84.319 -5.671 1.00 61.02 H new ATOM 1613 N HIS A 107 11.742 -89.152 -5.334 1.00 62.33 N ATOM 1614 CA HIS A 107 11.492 -90.593 -5.230 1.00 42.21 C ATOM 1615 C HIS A 107 12.801 -91.385 -5.365 1.00 3.14 C ATOM 1616 O HIS A 107 13.704 -90.997 -6.108 1.00 44.31 O ATOM 1617 CB HIS A 107 10.467 -91.042 -6.285 1.00 1.15 C ATOM 1618 CG HIS A 107 9.884 -92.401 -6.031 1.00 52.33 C ATOM 1619 ND1 HIS A 107 8.698 -92.601 -5.356 1.00 63.51 N ATOM 1620 CD2 HIS A 107 10.325 -93.633 -6.376 1.00 51.43 C ATOM 1621 CE1 HIS A 107 8.440 -93.895 -5.299 1.00 61.40 C ATOM 1622 NE2 HIS A 107 9.410 -94.540 -5.911 1.00 21.31 N ATOM 0 H HIS A 107 12.310 -88.880 -6.136 1.00 62.33 H new ATOM 0 HA HIS A 107 11.076 -90.798 -4.244 1.00 42.21 H new ATOM 0 HB2 HIS A 107 9.658 -90.313 -6.324 1.00 1.15 H new ATOM 0 HB3 HIS A 107 10.945 -91.040 -7.265 1.00 1.15 H new ATOM 0 HD2 HIS A 107 11.231 -93.859 -6.918 1.00 51.43 H new ATOM 0 HE1 HIS A 107 7.579 -94.347 -4.830 1.00 61.40 H new ATOM 0 HE2 HIS A 107 9.471 -95.552 -6.021 1.00 21.31 H new ATOM 1631 N ALA A 108 12.849 -92.514 -4.664 1.00 62.21 N ATOM 1632 CA ALA A 108 14.066 -93.310 -4.442 1.00 71.54 C ATOM 1633 C ALA A 108 14.517 -94.144 -5.653 1.00 51.20 C ATOM 1634 O ALA A 108 15.447 -94.942 -5.525 1.00 13.21 O ATOM 1635 CB ALA A 108 13.874 -94.207 -3.224 1.00 1.01 C ATOM 0 H ALA A 108 12.024 -92.917 -4.220 1.00 62.21 H new ATOM 0 HA ALA A 108 14.869 -92.593 -4.272 1.00 71.54 H new ATOM 0 HB1 ALA A 108 14.776 -94.796 -3.060 1.00 1.01 H new ATOM 0 HB2 ALA A 108 13.678 -93.591 -2.346 1.00 1.01 H new ATOM 0 HB3 ALA A 108 13.030 -94.875 -3.394 1.00 1.01 H new ATOM 1641 N SER A 109 13.862 -93.998 -6.802 1.00 22.12 N ATOM 1642 CA SER A 109 14.091 -94.904 -7.935 1.00 13.31 C ATOM 1643 C SER A 109 15.551 -94.882 -8.402 1.00 70.35 C ATOM 1644 O SER A 109 16.126 -93.817 -8.632 1.00 20.01 O ATOM 1645 CB SER A 109 13.181 -94.517 -9.101 1.00 75.32 C ATOM 1646 OG SER A 109 11.813 -94.621 -8.734 1.00 74.32 O ATOM 0 H SER A 109 13.172 -93.268 -6.977 1.00 22.12 H new ATOM 0 HA SER A 109 13.861 -95.914 -7.597 1.00 13.31 H new ATOM 0 HB2 SER A 109 13.400 -93.497 -9.415 1.00 75.32 H new ATOM 0 HB3 SER A 109 13.383 -95.164 -9.955 1.00 75.32 H new ATOM 0 HG SER A 109 11.335 -93.815 -9.022 1.00 74.32 H new ATOM 1652 N SER A 110 16.124 -96.082 -8.542 1.00 53.15 N ATOM 1653 CA SER A 110 17.531 -96.261 -8.892 1.00 44.34 C ATOM 1654 C SER A 110 17.786 -95.949 -10.373 1.00 21.33 C ATOM 1655 O SER A 110 16.858 -95.628 -11.119 1.00 40.12 O ATOM 1656 CB SER A 110 17.979 -97.689 -8.557 1.00 20.12 C ATOM 1657 OG SER A 110 19.387 -97.825 -8.671 1.00 61.20 O ATOM 0 H SER A 110 15.619 -96.959 -8.414 1.00 53.15 H new ATOM 0 HA SER A 110 18.118 -95.557 -8.302 1.00 44.34 H new ATOM 0 HB2 SER A 110 17.667 -97.942 -7.544 1.00 20.12 H new ATOM 0 HB3 SER A 110 17.487 -98.394 -9.227 1.00 20.12 H new ATOM 0 HG SER A 110 19.646 -98.744 -8.450 1.00 61.20 H new ATOM 1663 N ARG A 111 19.057 -96.064 -10.773 1.00 10.21 N ATOM 1664 CA ARG A 111 19.537 -95.637 -12.094 1.00 70.34 C ATOM 1665 C ARG A 111 18.585 -96.028 -13.231 1.00 33.55 C ATOM 1666 O ARG A 111 18.149 -97.178 -13.331 1.00 43.23 O ATOM 1667 CB ARG A 111 20.928 -96.223 -12.370 1.00 25.13 C ATOM 1668 CG ARG A 111 21.608 -95.628 -13.607 1.00 15.51 C ATOM 1669 CD ARG A 111 22.941 -96.300 -13.918 1.00 32.52 C ATOM 1670 NE ARG A 111 22.766 -97.666 -14.415 1.00 21.10 N ATOM 1671 CZ ARG A 111 23.267 -98.111 -15.570 1.00 63.31 C ATOM 1672 NH1 ARG A 111 23.998 -97.313 -16.338 1.00 42.52 N ATOM 1673 NH2 ARG A 111 23.050 -99.360 -15.945 1.00 12.12 N ATOM 0 H ARG A 111 19.789 -96.460 -10.184 1.00 10.21 H new ATOM 0 HA ARG A 111 19.585 -94.548 -12.068 1.00 70.34 H new ATOM 0 HB2 ARG A 111 21.563 -96.055 -11.500 1.00 25.13 H new ATOM 0 HB3 ARG A 111 20.840 -97.302 -12.497 1.00 25.13 H new ATOM 0 HG2 ARG A 111 20.945 -95.728 -14.466 1.00 15.51 H new ATOM 0 HG3 ARG A 111 21.770 -94.561 -13.452 1.00 15.51 H new ATOM 0 HD2 ARG A 111 23.479 -95.711 -14.660 1.00 32.52 H new ATOM 0 HD3 ARG A 111 23.556 -96.318 -13.018 1.00 32.52 H new ATOM 0 HE ARG A 111 22.228 -98.318 -13.844 1.00 21.10 H new ATOM 0 HH11 ARG A 111 24.181 -96.352 -16.047 1.00 42.52 H new ATOM 0 HH12 ARG A 111 24.377 -97.660 -17.219 1.00 42.52 H new ATOM 0 HH21 ARG A 111 22.501 -99.982 -15.352 1.00 12.12 H new ATOM 0 HH22 ARG A 111 23.432 -99.701 -16.827 1.00 12.12 H new ATOM 1687 N VAL A 112 18.286 -95.051 -14.084 1.00 42.33 N ATOM 1688 CA VAL A 112 17.415 -95.239 -15.243 1.00 22.53 C ATOM 1689 C VAL A 112 18.119 -94.745 -16.507 1.00 21.24 C ATOM 1690 O VAL A 112 19.240 -94.237 -16.440 1.00 51.15 O ATOM 1691 CB VAL A 112 16.074 -94.478 -15.073 1.00 42.34 C ATOM 1692 CG1 VAL A 112 15.278 -95.019 -13.886 1.00 12.25 C ATOM 1693 CG2 VAL A 112 16.326 -92.979 -14.924 1.00 12.43 C ATOM 0 H VAL A 112 18.643 -94.100 -13.990 1.00 42.33 H new ATOM 0 HA VAL A 112 17.198 -96.304 -15.328 1.00 22.53 H new ATOM 0 HB VAL A 112 15.477 -94.639 -15.971 1.00 42.34 H new ATOM 0 HG11 VAL A 112 14.343 -94.466 -13.792 1.00 12.25 H new ATOM 0 HG12 VAL A 112 15.060 -96.075 -14.045 1.00 12.25 H new ATOM 0 HG13 VAL A 112 15.862 -94.902 -12.973 1.00 12.25 H new ATOM 0 HG21 VAL A 112 15.375 -92.460 -14.806 1.00 12.43 H new ATOM 0 HG22 VAL A 112 16.948 -92.800 -14.047 1.00 12.43 H new ATOM 0 HG23 VAL A 112 16.835 -92.606 -15.813 1.00 12.43 H new ATOM 1703 N ASP A 113 17.478 -94.921 -17.656 1.00 71.41 N ATOM 1704 CA ASP A 113 18.023 -94.438 -18.922 1.00 61.45 C ATOM 1705 C ASP A 113 17.639 -92.969 -19.142 1.00 54.52 C ATOM 1706 O ASP A 113 16.456 -92.629 -19.179 1.00 71.24 O ATOM 1707 CB ASP A 113 17.511 -95.298 -20.083 1.00 13.55 C ATOM 1708 CG ASP A 113 18.006 -94.808 -21.436 1.00 74.32 C ATOM 1709 OD1 ASP A 113 19.197 -95.022 -21.751 1.00 41.05 O ATOM 1710 OD2 ASP A 113 17.210 -94.213 -22.191 1.00 52.52 O ATOM 0 H ASP A 113 16.579 -95.395 -17.739 1.00 71.41 H new ATOM 0 HA ASP A 113 19.110 -94.513 -18.883 1.00 61.45 H new ATOM 0 HB2 ASP A 113 17.831 -96.329 -19.935 1.00 13.55 H new ATOM 0 HB3 ASP A 113 16.421 -95.298 -20.077 1.00 13.55 H new ATOM 1715 N ALA A 114 18.645 -92.108 -19.280 1.00 61.52 N ATOM 1716 CA ALA A 114 18.429 -90.670 -19.470 1.00 14.04 C ATOM 1717 C ALA A 114 17.762 -90.379 -20.816 1.00 42.21 C ATOM 1718 O ALA A 114 17.891 -91.154 -21.767 1.00 32.43 O ATOM 1719 CB ALA A 114 19.755 -89.926 -19.361 1.00 51.25 C ATOM 0 H ALA A 114 19.627 -92.382 -19.264 1.00 61.52 H new ATOM 0 HA ALA A 114 17.757 -90.321 -18.686 1.00 14.04 H new ATOM 0 HB1 ALA A 114 19.586 -88.859 -19.503 1.00 51.25 H new ATOM 0 HB2 ALA A 114 20.188 -90.097 -18.375 1.00 51.25 H new ATOM 0 HB3 ALA A 114 20.440 -90.290 -20.126 1.00 51.25 H new ATOM 1725 N ASP A 115 17.066 -89.246 -20.894 1.00 54.31 N ATOM 1726 CA ASP A 115 16.348 -88.855 -22.112 1.00 31.20 C ATOM 1727 C ASP A 115 16.622 -87.391 -22.460 1.00 74.33 C ATOM 1728 O ASP A 115 16.965 -87.071 -23.602 1.00 33.11 O ATOM 1729 CB ASP A 115 14.836 -89.095 -21.946 1.00 63.02 C ATOM 1730 CG ASP A 115 14.036 -88.739 -23.195 1.00 34.15 C ATOM 1731 OD1 ASP A 115 14.374 -89.246 -24.287 1.00 71.54 O ATOM 1732 OD2 ASP A 115 13.050 -87.980 -23.089 1.00 60.54 O ATOM 0 H ASP A 115 16.982 -88.579 -20.127 1.00 54.31 H new ATOM 0 HA ASP A 115 16.710 -89.473 -22.933 1.00 31.20 H new ATOM 0 HB2 ASP A 115 14.665 -90.143 -21.698 1.00 63.02 H new ATOM 0 HB3 ASP A 115 14.470 -88.505 -21.106 1.00 63.02 H new ATOM 1737 N GLY A 116 16.492 -86.512 -21.467 1.00 25.12 N ATOM 1738 CA GLY A 116 16.729 -85.090 -21.687 1.00 51.02 C ATOM 1739 C GLY A 116 15.898 -84.200 -20.776 1.00 52.42 C ATOM 1740 O GLY A 116 14.753 -84.522 -20.447 1.00 24.24 O ATOM 0 H GLY A 116 16.227 -86.758 -20.513 1.00 25.12 H new ATOM 0 HA2 GLY A 116 17.786 -84.875 -21.530 1.00 51.02 H new ATOM 0 HA3 GLY A 116 16.505 -84.847 -22.726 1.00 51.02 H new ATOM 1744 N PHE A 117 16.479 -83.083 -20.354 1.00 5.24 N ATOM 1745 CA PHE A 117 15.779 -82.113 -19.514 1.00 2.31 C ATOM 1746 C PHE A 117 15.102 -81.069 -20.395 1.00 32.41 C ATOM 1747 O PHE A 117 15.788 -80.287 -21.061 1.00 0.02 O ATOM 1748 CB PHE A 117 16.765 -81.403 -18.569 1.00 64.33 C ATOM 1749 CG PHE A 117 17.531 -82.321 -17.647 1.00 64.31 C ATOM 1750 CD1 PHE A 117 18.561 -83.113 -18.133 1.00 52.42 C ATOM 1751 CD2 PHE A 117 17.230 -82.381 -16.294 1.00 54.12 C ATOM 1752 CE1 PHE A 117 19.270 -83.945 -17.290 1.00 24.34 C ATOM 1753 CE2 PHE A 117 17.937 -83.211 -15.446 1.00 3.23 C ATOM 1754 CZ PHE A 117 18.958 -83.994 -15.945 1.00 43.44 C ATOM 0 H PHE A 117 17.439 -82.824 -20.581 1.00 5.24 H new ATOM 0 HA PHE A 117 15.035 -82.644 -18.921 1.00 2.31 H new ATOM 0 HB2 PHE A 117 17.477 -80.837 -19.169 1.00 64.33 H new ATOM 0 HB3 PHE A 117 16.213 -80.683 -17.965 1.00 64.33 H new ATOM 0 HD1 PHE A 117 18.811 -83.078 -19.183 1.00 52.42 H new ATOM 0 HD2 PHE A 117 16.432 -81.770 -15.898 1.00 54.12 H new ATOM 0 HE1 PHE A 117 20.069 -84.558 -17.682 1.00 24.34 H new ATOM 0 HE2 PHE A 117 17.691 -83.247 -14.395 1.00 3.23 H new ATOM 0 HZ PHE A 117 19.513 -84.644 -15.285 1.00 43.44 H new ATOM 1764 N GLU A 118 13.769 -81.057 -20.422 1.00 33.04 N ATOM 1765 CA GLU A 118 13.043 -80.043 -21.177 1.00 23.02 C ATOM 1766 C GLU A 118 11.586 -79.969 -20.730 1.00 63.02 C ATOM 1767 O GLU A 118 10.883 -80.975 -20.719 1.00 13.12 O ATOM 1768 CB GLU A 118 13.154 -80.320 -22.684 1.00 70.42 C ATOM 1769 CG GLU A 118 12.742 -81.730 -23.096 1.00 51.04 C ATOM 1770 CD GLU A 118 12.907 -81.968 -24.589 1.00 53.34 C ATOM 1771 OE1 GLU A 118 14.001 -82.393 -25.015 1.00 71.34 O ATOM 1772 OE2 GLU A 118 11.944 -81.722 -25.346 1.00 62.15 O ATOM 0 H GLU A 118 13.178 -81.731 -19.935 1.00 33.04 H new ATOM 0 HA GLU A 118 13.495 -79.071 -20.977 1.00 23.02 H new ATOM 0 HB2 GLU A 118 12.534 -79.602 -23.220 1.00 70.42 H new ATOM 0 HB3 GLU A 118 14.184 -80.149 -22.998 1.00 70.42 H new ATOM 0 HG2 GLU A 118 13.341 -82.456 -22.546 1.00 51.04 H new ATOM 0 HG3 GLU A 118 11.702 -81.898 -22.817 1.00 51.04 H new ATOM 1779 N ILE A 119 11.139 -78.776 -20.349 1.00 14.51 N ATOM 1780 CA ILE A 119 9.766 -78.587 -19.904 1.00 51.30 C ATOM 1781 C ILE A 119 8.801 -78.885 -21.055 1.00 62.21 C ATOM 1782 O ILE A 119 8.451 -78.009 -21.849 1.00 44.42 O ATOM 1783 CB ILE A 119 9.525 -77.161 -19.323 1.00 2.53 C ATOM 1784 CG1 ILE A 119 10.253 -76.986 -17.973 1.00 24.02 C ATOM 1785 CG2 ILE A 119 8.031 -76.891 -19.144 1.00 53.12 C ATOM 1786 CD1 ILE A 119 11.762 -77.113 -18.039 1.00 71.13 C ATOM 0 H ILE A 119 11.707 -77.929 -20.340 1.00 14.51 H new ATOM 0 HA ILE A 119 9.578 -79.288 -19.091 1.00 51.30 H new ATOM 0 HB ILE A 119 9.929 -76.442 -20.035 1.00 2.53 H new ATOM 0 HG12 ILE A 119 10.003 -76.006 -17.567 1.00 24.02 H new ATOM 0 HG13 ILE A 119 9.871 -77.728 -17.272 1.00 24.02 H new ATOM 0 HG21 ILE A 119 7.888 -75.890 -18.737 1.00 53.12 H new ATOM 0 HG22 ILE A 119 7.530 -76.966 -20.109 1.00 53.12 H new ATOM 0 HG23 ILE A 119 7.608 -77.625 -18.458 1.00 53.12 H new ATOM 0 HD11 ILE A 119 12.183 -76.975 -17.043 1.00 71.13 H new ATOM 0 HD12 ILE A 119 12.028 -78.102 -18.411 1.00 71.13 H new ATOM 0 HD13 ILE A 119 12.162 -76.353 -18.710 1.00 71.13 H new ATOM 1798 N ARG A 120 8.445 -80.161 -21.160 1.00 2.03 N ATOM 1799 CA ARG A 120 7.545 -80.662 -22.193 1.00 61.44 C ATOM 1800 C ARG A 120 6.093 -80.494 -21.781 1.00 32.31 C ATOM 1801 O ARG A 120 5.757 -80.598 -20.603 1.00 1.25 O ATOM 1802 CB ARG A 120 7.840 -82.141 -22.476 1.00 4.12 C ATOM 1803 CG ARG A 120 9.033 -82.365 -23.389 1.00 2.23 C ATOM 1804 CD ARG A 120 9.336 -83.850 -23.557 1.00 30.01 C ATOM 1805 NE ARG A 120 10.540 -84.078 -24.356 1.00 3.51 N ATOM 1806 CZ ARG A 120 11.313 -85.161 -24.260 1.00 12.41 C ATOM 1807 NH1 ARG A 120 11.005 -86.137 -23.413 1.00 3.32 N ATOM 1808 NH2 ARG A 120 12.394 -85.267 -25.017 1.00 2.32 N ATOM 0 H ARG A 120 8.777 -80.885 -20.523 1.00 2.03 H new ATOM 0 HA ARG A 120 7.713 -80.081 -23.100 1.00 61.44 H new ATOM 0 HB2 ARG A 120 8.017 -82.654 -21.531 1.00 4.12 H new ATOM 0 HB3 ARG A 120 6.959 -82.598 -22.927 1.00 4.12 H new ATOM 0 HG2 ARG A 120 8.835 -81.920 -24.364 1.00 2.23 H new ATOM 0 HG3 ARG A 120 9.907 -81.858 -22.979 1.00 2.23 H new ATOM 0 HD2 ARG A 120 9.460 -84.308 -22.576 1.00 30.01 H new ATOM 0 HD3 ARG A 120 8.487 -84.341 -24.033 1.00 30.01 H new ATOM 0 HE ARG A 120 10.806 -83.361 -25.031 1.00 3.51 H new ATOM 0 HH11 ARG A 120 10.172 -86.062 -22.830 1.00 3.32 H new ATOM 0 HH12 ARG A 120 11.602 -86.962 -23.346 1.00 3.32 H new ATOM 0 HH21 ARG A 120 12.634 -84.522 -25.671 1.00 2.32 H new ATOM 0 HH22 ARG A 120 12.987 -86.094 -24.946 1.00 2.32 H new ATOM 1822 N ARG A 121 5.252 -80.206 -22.762 1.00 14.01 N ATOM 1823 CA ARG A 121 3.809 -80.124 -22.561 1.00 75.33 C ATOM 1824 C ARG A 121 3.113 -81.044 -23.565 1.00 64.21 C ATOM 1825 O ARG A 121 2.645 -82.130 -23.167 1.00 51.44 O ATOM 1826 CB ARG A 121 3.304 -78.682 -22.733 1.00 72.42 C ATOM 1827 CG ARG A 121 3.935 -77.679 -21.771 1.00 14.51 C ATOM 1828 CD ARG A 121 3.299 -76.298 -21.908 1.00 12.45 C ATOM 1829 NE ARG A 121 3.371 -75.790 -23.283 1.00 4.53 N ATOM 1830 CZ ARG A 121 2.620 -74.793 -23.753 1.00 42.14 C ATOM 1831 NH1 ARG A 121 1.711 -74.216 -22.978 1.00 1.44 N ATOM 1832 NH2 ARG A 121 2.754 -74.398 -25.011 1.00 65.01 N ATOM 1833 OXT ARG A 121 3.081 -80.690 -24.766 1.00 0.00 O ATOM 0 H ARG A 121 5.548 -80.022 -23.721 1.00 14.01 H new ATOM 0 HA ARG A 121 3.578 -80.439 -21.543 1.00 75.33 H new ATOM 0 HB2 ARG A 121 3.500 -78.360 -23.756 1.00 72.42 H new ATOM 0 HB3 ARG A 121 2.223 -78.669 -22.596 1.00 72.42 H new ATOM 0 HG2 ARG A 121 3.820 -78.034 -20.747 1.00 14.51 H new ATOM 0 HG3 ARG A 121 5.005 -77.609 -21.966 1.00 14.51 H new ATOM 0 HD2 ARG A 121 2.256 -76.347 -21.594 1.00 12.45 H new ATOM 0 HD3 ARG A 121 3.801 -75.600 -21.238 1.00 12.45 H new ATOM 0 HE ARG A 121 4.038 -76.227 -23.919 1.00 4.53 H new ATOM 0 HH11 ARG A 121 1.584 -74.534 -22.017 1.00 1.44 H new ATOM 0 HH12 ARG A 121 1.139 -73.454 -23.343 1.00 1.44 H new ATOM 0 HH21 ARG A 121 3.432 -74.857 -25.620 1.00 65.01 H new ATOM 0 HH22 ARG A 121 2.179 -73.636 -25.370 1.00 65.01 H new TER 1847 ARG A 121