USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 991 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 13 HIS : no HD1:sc= -2.29 K(o=-10,f=-11!) USER MOD Set 1.2: A 86 ASN : amide:sc= -7.81! C(o=-10!,f=-11!) USER MOD Set 2.1: A 75 ASN : amide:sc= -0.308 X(o=-3.3,f=-2.9) USER MOD Set 2.2: A 78 HIS : no HD1:sc= -3.03 X(o=-3.3,f=-2.9) USER MOD Set 3.1: A 62 SER OG : rot 82:sc= 1.19 USER MOD Set 3.2: A 88 SER OG : rot 180:sc= 1.08 USER MOD Set 4.1: A 36 LYS NZ :NH3+ -169:sc= -1.1 (180deg=-1.33) USER MOD Set 4.2: A 40 THR OG1 : rot 122:sc= 0 USER MOD Set 5.1: A 19 THR OG1 : rot 116:sc= 1.17 USER MOD Set 5.2: A 122 SER OG : rot -35:sc= -0.264 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot -61:sc= 0.464 USER MOD Single : A 10 SER OG : rot -55:sc= 1.21 USER MOD Single : A 11 SER OG : rot 170:sc= -0.157 USER MOD Single : A 12 GLN : amide:sc= -1.23 K(o=-1.2,f=-3.2!) USER MOD Single : A 15 ASN : amide:sc= -0.146 X(o=-0.15,f=-0.2) USER MOD Single : A 17 ASN : amide:sc= -1.08 X(o=-1.1,f=-1.3) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 ASN : amide:sc= -0.225 K(o=-0.22,f=-1.4!) USER MOD Single : A 25 TYR OH : rot 45:sc= 0.851 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= -0.072 K(o=-0.072,f=-0.94) USER MOD Single : A 31 GLN : amide:sc= -0.19 K(o=-0.19,f=-1.1!) USER MOD Single : A 33 SER OG : rot -49:sc= 1.06 USER MOD Single : A 34 THR OG1 : rot -128:sc= 0.728 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= -0.664 K(o=-0.66,f=-3!) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 LYS NZ :NH3+ 151:sc= -1.35! (180deg=-2.93!) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.15 K(o=-0.15,f=-2.2!) USER MOD Single : A 49 ASN : amide:sc= -1.26 K(o=-1.3,f=-2.9!) USER MOD Single : A 50 GLN : amide:sc= -2.73 X(o=-2.7,f=-2.8!) USER MOD Single : A 54 ASN : amide:sc= -0.345 X(o=-0.34,f=-0.099) USER MOD Single : A 55 SER OG : rot -96:sc= 1.16 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 CYS SG : rot 140:sc= -0.89 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 ASN :FLIP amide:sc= -0.612 F(o=-1.4,f=-0.61) USER MOD Single : A 77 ASN : amide:sc=-0.00607 X(o=-0.0061,f=0) USER MOD Single : A 79 THR OG1 : rot 78:sc= 1.09 USER MOD Single : A 83 SER OG : rot -111:sc= -3.24! USER MOD Single : A 85 CYS SG : rot 141:sc= -10.6! USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl -128:sc= -7.39! (180deg=-11.3!) USER MOD Single : A 107 THR OG1 : rot -104:sc= -0.729 USER MOD Single : A 108 HIS : no HD1:sc= -0.397 X(o=-0.4,f=-0.11) USER MOD Single : A 109 ASN : amide:sc= -0.338 K(o=-0.34,f=-2.9!) USER MOD Single : A 111 THR OG1 : rot -108:sc= 0.869 USER MOD Single : A 112 GLN : amide:sc= -0.034 K(o=-0.034,f=-0.78) USER MOD Single : A 115 ASN :FLIP amide:sc= -0.606 F(o=-1.3,f=-0.61) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.253 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.358 26.229 -0.546 1.00 0.00 N ATOM 2 CA GLY A 1 5.432 26.589 0.563 1.00 0.00 C ATOM 3 C GLY A 1 5.871 27.839 1.302 1.00 0.00 C ATOM 4 O GLY A 1 6.624 27.761 2.274 1.00 0.00 O ATOM 0 H1 GLY A 1 6.015 25.369 -1.019 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.398 27.010 -1.232 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.309 26.057 -0.162 1.00 0.00 H new ATOM 0 HA2 GLY A 1 4.430 26.741 0.161 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.371 25.758 1.266 1.00 0.00 H new ATOM 10 N SER A 2 5.399 28.992 0.842 1.00 0.00 N ATOM 11 CA SER A 2 5.746 30.265 1.464 1.00 0.00 C ATOM 12 C SER A 2 4.712 31.333 1.124 1.00 0.00 C ATOM 13 O SER A 2 4.243 32.059 1.999 1.00 0.00 O ATOM 14 CB SER A 2 7.134 30.719 1.010 1.00 0.00 C ATOM 15 OG SER A 2 7.785 31.464 2.025 1.00 0.00 O ATOM 0 H SER A 2 4.774 29.072 0.040 1.00 0.00 H new ATOM 0 HA SER A 2 5.756 30.123 2.545 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.737 29.849 0.749 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.045 31.326 0.109 1.00 0.00 H new ATOM 0 HG SER A 2 8.671 31.741 1.710 1.00 0.00 H new ATOM 21 N SER A 3 4.363 31.422 -0.155 1.00 0.00 N ATOM 22 CA SER A 3 3.384 32.399 -0.616 1.00 0.00 C ATOM 23 C SER A 3 2.847 32.019 -1.991 1.00 0.00 C ATOM 24 O SER A 3 1.639 32.033 -2.222 1.00 0.00 O ATOM 25 CB SER A 3 4.009 33.795 -0.667 1.00 0.00 C ATOM 26 OG SER A 3 3.148 34.717 -1.311 1.00 0.00 O ATOM 0 H SER A 3 4.744 30.828 -0.892 1.00 0.00 H new ATOM 0 HA SER A 3 2.554 32.407 0.090 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.222 34.138 0.345 1.00 0.00 H new ATOM 0 HB3 SER A 3 4.961 33.751 -1.196 1.00 0.00 H new ATOM 0 HG SER A 3 3.570 35.601 -1.329 1.00 0.00 H new ATOM 32 N GLY A 4 3.755 31.678 -2.900 1.00 0.00 N ATOM 33 CA GLY A 4 3.354 31.296 -4.240 1.00 0.00 C ATOM 34 C GLY A 4 2.556 30.008 -4.261 1.00 0.00 C ATOM 35 O GLY A 4 1.393 29.985 -3.859 1.00 0.00 O ATOM 0 H GLY A 4 4.761 31.660 -2.732 1.00 0.00 H new ATOM 0 HA2 GLY A 4 2.758 32.096 -4.680 1.00 0.00 H new ATOM 0 HA3 GLY A 4 4.241 31.180 -4.862 1.00 0.00 H new ATOM 39 N SER A 5 3.183 28.933 -4.727 1.00 0.00 N ATOM 40 CA SER A 5 2.522 27.634 -4.796 1.00 0.00 C ATOM 41 C SER A 5 2.595 26.917 -3.452 1.00 0.00 C ATOM 42 O SER A 5 3.335 25.946 -3.292 1.00 0.00 O ATOM 43 CB SER A 5 3.160 26.770 -5.886 1.00 0.00 C ATOM 44 OG SER A 5 2.482 26.924 -7.121 1.00 0.00 O ATOM 0 H SER A 5 4.146 28.935 -5.062 1.00 0.00 H new ATOM 0 HA SER A 5 1.473 27.799 -5.043 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.208 27.045 -6.006 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.138 25.723 -5.584 1.00 0.00 H new ATOM 0 HG SER A 5 2.910 26.363 -7.801 1.00 0.00 H new ATOM 50 N SER A 6 1.821 27.401 -2.486 1.00 0.00 N ATOM 51 CA SER A 6 1.797 26.806 -1.154 1.00 0.00 C ATOM 52 C SER A 6 0.712 25.738 -1.057 1.00 0.00 C ATOM 53 O SER A 6 0.981 24.598 -0.678 1.00 0.00 O ATOM 54 CB SER A 6 1.564 27.885 -0.095 1.00 0.00 C ATOM 55 OG SER A 6 1.279 27.307 1.168 1.00 0.00 O ATOM 0 H SER A 6 1.202 28.204 -2.600 1.00 0.00 H new ATOM 0 HA SER A 6 2.763 26.335 -0.975 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.447 28.519 -0.017 1.00 0.00 H new ATOM 0 HB3 SER A 6 0.737 28.526 -0.400 1.00 0.00 H new ATOM 0 HG SER A 6 1.136 28.017 1.828 1.00 0.00 H new ATOM 61 N GLY A 7 -0.515 26.115 -1.404 1.00 0.00 N ATOM 62 CA GLY A 7 -1.622 25.179 -1.351 1.00 0.00 C ATOM 63 C GLY A 7 -2.174 24.858 -2.725 1.00 0.00 C ATOM 64 O GLY A 7 -1.421 24.535 -3.644 1.00 0.00 O ATOM 0 H GLY A 7 -0.762 27.053 -1.721 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -1.292 24.258 -0.871 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.416 25.595 -0.731 1.00 0.00 H new ATOM 68 N SER A 8 -3.493 24.948 -2.868 1.00 0.00 N ATOM 69 CA SER A 8 -4.144 24.665 -4.142 1.00 0.00 C ATOM 70 C SER A 8 -3.868 23.234 -4.590 1.00 0.00 C ATOM 71 O SER A 8 -3.795 22.950 -5.786 1.00 0.00 O ATOM 72 CB SER A 8 -3.666 25.649 -5.212 1.00 0.00 C ATOM 73 OG SER A 8 -4.487 26.803 -5.248 1.00 0.00 O ATOM 0 H SER A 8 -4.131 25.214 -2.118 1.00 0.00 H new ATOM 0 HA SER A 8 -5.219 24.781 -4.005 1.00 0.00 H new ATOM 0 HB2 SER A 8 -2.635 25.939 -5.009 1.00 0.00 H new ATOM 0 HB3 SER A 8 -3.674 25.163 -6.187 1.00 0.00 H new ATOM 0 HG SER A 8 -4.159 27.416 -5.939 1.00 0.00 H new ATOM 79 N SER A 9 -3.715 22.336 -3.622 1.00 0.00 N ATOM 80 CA SER A 9 -3.448 20.932 -3.917 1.00 0.00 C ATOM 81 C SER A 9 -2.152 20.778 -4.707 1.00 0.00 C ATOM 82 O SER A 9 -2.171 20.473 -5.900 1.00 0.00 O ATOM 83 CB SER A 9 -4.613 20.323 -4.699 1.00 0.00 C ATOM 84 OG SER A 9 -4.291 19.024 -5.164 1.00 0.00 O ATOM 0 H SER A 9 -3.771 22.555 -2.627 1.00 0.00 H new ATOM 0 HA SER A 9 -3.339 20.402 -2.971 1.00 0.00 H new ATOM 0 HB2 SER A 9 -5.497 20.276 -4.063 1.00 0.00 H new ATOM 0 HB3 SER A 9 -4.862 20.964 -5.545 1.00 0.00 H new ATOM 0 HG SER A 9 -3.518 19.074 -5.765 1.00 0.00 H new ATOM 90 N SER A 10 -1.025 20.989 -4.033 1.00 0.00 N ATOM 91 CA SER A 10 0.281 20.873 -4.672 1.00 0.00 C ATOM 92 C SER A 10 0.921 19.525 -4.356 1.00 0.00 C ATOM 93 O SER A 10 2.145 19.413 -4.271 1.00 0.00 O ATOM 94 CB SER A 10 1.199 22.007 -4.214 1.00 0.00 C ATOM 95 OG SER A 10 2.511 21.839 -4.722 1.00 0.00 O ATOM 0 H SER A 10 -0.990 21.241 -3.045 1.00 0.00 H new ATOM 0 HA SER A 10 0.139 20.945 -5.750 1.00 0.00 H new ATOM 0 HB2 SER A 10 0.796 22.963 -4.549 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.229 22.037 -3.125 1.00 0.00 H new ATOM 0 HG SER A 10 2.849 20.954 -4.470 1.00 0.00 H new ATOM 101 N SER A 11 0.087 18.505 -4.182 1.00 0.00 N ATOM 102 CA SER A 11 0.572 17.165 -3.875 1.00 0.00 C ATOM 103 C SER A 11 0.461 16.254 -5.093 1.00 0.00 C ATOM 104 O SER A 11 -0.505 16.329 -5.852 1.00 0.00 O ATOM 105 CB SER A 11 -0.216 16.569 -2.707 1.00 0.00 C ATOM 106 OG SER A 11 -0.777 17.589 -1.898 1.00 0.00 O ATOM 0 H SER A 11 -0.928 18.581 -4.248 1.00 0.00 H new ATOM 0 HA SER A 11 1.622 17.242 -3.595 1.00 0.00 H new ATOM 0 HB2 SER A 11 -1.009 15.926 -3.089 1.00 0.00 H new ATOM 0 HB3 SER A 11 0.440 15.941 -2.104 1.00 0.00 H new ATOM 0 HG SER A 11 -1.404 17.191 -1.258 1.00 0.00 H new ATOM 111 N GLN A 12 1.458 15.393 -5.274 1.00 0.00 N ATOM 112 CA GLN A 12 1.472 14.468 -6.401 1.00 0.00 C ATOM 113 C GLN A 12 0.764 13.164 -6.046 1.00 0.00 C ATOM 114 O GLN A 12 0.663 12.799 -4.874 1.00 0.00 O ATOM 115 CB GLN A 12 2.911 14.180 -6.837 1.00 0.00 C ATOM 116 CG GLN A 12 3.734 13.454 -5.786 1.00 0.00 C ATOM 117 CD GLN A 12 5.225 13.653 -5.976 1.00 0.00 C ATOM 118 OE1 GLN A 12 5.871 12.919 -6.724 1.00 0.00 O ATOM 119 NE2 GLN A 12 5.781 14.650 -5.297 1.00 0.00 N ATOM 0 H GLN A 12 2.265 15.317 -4.655 1.00 0.00 H new ATOM 0 HA GLN A 12 0.937 14.936 -7.227 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.892 13.582 -7.748 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.402 15.121 -7.084 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.447 13.808 -4.796 1.00 0.00 H new ATOM 0 HG3 GLN A 12 3.505 12.389 -5.822 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.208 15.234 -4.688 1.00 0.00 H new ATOM 0 HE22 GLN A 12 6.781 14.832 -5.385 1.00 0.00 H new ATOM 128 N HIS A 13 0.272 12.468 -7.066 1.00 0.00 N ATOM 129 CA HIS A 13 -0.430 11.205 -6.865 1.00 0.00 C ATOM 130 C HIS A 13 0.214 10.088 -7.682 1.00 0.00 C ATOM 131 O HIS A 13 0.736 10.324 -8.772 1.00 0.00 O ATOM 132 CB HIS A 13 -1.902 11.351 -7.253 1.00 0.00 C ATOM 133 CG HIS A 13 -2.670 12.273 -6.356 1.00 0.00 C ATOM 134 ND1 HIS A 13 -3.879 12.834 -6.712 1.00 0.00 N ATOM 135 CD2 HIS A 13 -2.395 12.733 -5.112 1.00 0.00 C ATOM 136 CE1 HIS A 13 -4.314 13.598 -5.726 1.00 0.00 C ATOM 137 NE2 HIS A 13 -3.433 13.554 -4.744 1.00 0.00 N ATOM 0 H HIS A 13 0.347 12.758 -8.041 1.00 0.00 H new ATOM 0 HA HIS A 13 -0.362 10.944 -5.809 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -1.964 11.719 -8.277 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -2.372 10.368 -7.238 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -1.523 12.498 -4.520 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -5.234 14.163 -5.724 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -3.510 14.049 -3.856 1.00 0.00 H new ATOM 146 N PHE A 14 0.171 8.871 -7.149 1.00 0.00 N ATOM 147 CA PHE A 14 0.748 7.716 -7.831 1.00 0.00 C ATOM 148 C PHE A 14 -0.172 6.505 -7.722 1.00 0.00 C ATOM 149 O PHE A 14 -0.582 6.120 -6.627 1.00 0.00 O ATOM 150 CB PHE A 14 2.122 7.387 -7.245 1.00 0.00 C ATOM 151 CG PHE A 14 3.211 8.298 -7.734 1.00 0.00 C ATOM 152 CD1 PHE A 14 3.584 8.299 -9.068 1.00 0.00 C ATOM 153 CD2 PHE A 14 3.860 9.156 -6.860 1.00 0.00 C ATOM 154 CE1 PHE A 14 4.584 9.137 -9.523 1.00 0.00 C ATOM 155 CE2 PHE A 14 4.861 9.997 -7.309 1.00 0.00 C ATOM 156 CZ PHE A 14 5.223 9.987 -8.642 1.00 0.00 C ATOM 0 H PHE A 14 -0.257 8.658 -6.248 1.00 0.00 H new ATOM 0 HA PHE A 14 0.863 7.966 -8.886 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.069 7.447 -6.158 1.00 0.00 H new ATOM 0 HB3 PHE A 14 2.379 6.358 -7.496 1.00 0.00 H new ATOM 0 HD1 PHE A 14 3.087 7.636 -9.761 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.581 9.168 -5.817 1.00 0.00 H new ATOM 0 HE1 PHE A 14 4.865 9.127 -10.566 1.00 0.00 H new ATOM 0 HE2 PHE A 14 5.359 10.661 -6.618 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.005 10.643 -8.995 1.00 0.00 H new ATOM 166 N ASN A 15 -0.498 5.910 -8.864 1.00 0.00 N ATOM 167 CA ASN A 15 -1.376 4.745 -8.899 1.00 0.00 C ATOM 168 C ASN A 15 -0.722 3.537 -8.236 1.00 0.00 C ATOM 169 O ASN A 15 0.276 3.011 -8.727 1.00 0.00 O ATOM 170 CB ASN A 15 -1.750 4.407 -10.344 1.00 0.00 C ATOM 171 CG ASN A 15 -3.240 4.191 -10.520 1.00 0.00 C ATOM 172 OD1 ASN A 15 -3.901 3.614 -9.657 1.00 0.00 O ATOM 173 ND2 ASN A 15 -3.777 4.655 -11.643 1.00 0.00 N ATOM 0 H ASN A 15 -0.167 6.215 -9.779 1.00 0.00 H new ATOM 0 HA ASN A 15 -2.279 4.991 -8.341 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -1.423 5.214 -10.999 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -1.216 3.509 -10.654 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -4.775 4.539 -11.817 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -3.191 5.127 -12.331 1.00 0.00 H new ATOM 180 N LEU A 16 -1.297 3.098 -7.120 1.00 0.00 N ATOM 181 CA LEU A 16 -0.778 1.946 -6.392 1.00 0.00 C ATOM 182 C LEU A 16 -1.532 0.680 -6.785 1.00 0.00 C ATOM 183 O LEU A 16 -2.762 0.651 -6.773 1.00 0.00 O ATOM 184 CB LEU A 16 -0.896 2.175 -4.884 1.00 0.00 C ATOM 185 CG LEU A 16 -0.165 1.152 -4.014 1.00 0.00 C ATOM 186 CD1 LEU A 16 1.340 1.254 -4.218 1.00 0.00 C ATOM 187 CD2 LEU A 16 -0.524 1.349 -2.549 1.00 0.00 C ATOM 0 H LEU A 16 -2.123 3.524 -6.700 1.00 0.00 H new ATOM 0 HA LEU A 16 0.273 1.822 -6.651 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.511 3.168 -4.652 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.952 2.171 -4.613 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.482 0.153 -4.314 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.843 0.518 -3.591 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.579 1.063 -5.264 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.677 2.254 -3.946 1.00 0.00 H new ATOM 0 HD21 LEU A 16 0.004 0.613 -1.943 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.235 2.352 -2.235 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.599 1.223 -2.418 1.00 0.00 H new ATOM 199 N ASN A 17 -0.790 -0.366 -7.138 1.00 0.00 N ATOM 200 CA ASN A 17 -1.403 -1.627 -7.538 1.00 0.00 C ATOM 201 C ASN A 17 -0.529 -2.817 -7.152 1.00 0.00 C ATOM 202 O ASN A 17 0.699 -2.746 -7.204 1.00 0.00 O ATOM 203 CB ASN A 17 -1.656 -1.638 -9.046 1.00 0.00 C ATOM 204 CG ASN A 17 -2.866 -0.810 -9.435 1.00 0.00 C ATOM 205 OD1 ASN A 17 -3.966 -1.336 -9.602 1.00 0.00 O ATOM 206 ND2 ASN A 17 -2.665 0.495 -9.583 1.00 0.00 N ATOM 0 H ASN A 17 0.230 -0.365 -7.155 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.353 -1.716 -7.011 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.776 -1.255 -9.562 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.800 -2.666 -9.380 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -3.440 1.104 -9.845 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -1.736 0.888 -9.434 1.00 0.00 H new ATOM 213 N PHE A 18 -1.178 -3.913 -6.770 1.00 0.00 N ATOM 214 CA PHE A 18 -0.477 -5.130 -6.379 1.00 0.00 C ATOM 215 C PHE A 18 -1.473 -6.244 -6.072 1.00 0.00 C ATOM 216 O PHE A 18 -2.233 -6.163 -5.108 1.00 0.00 O ATOM 217 CB PHE A 18 0.418 -4.870 -5.165 1.00 0.00 C ATOM 218 CG PHE A 18 -0.329 -4.403 -3.948 1.00 0.00 C ATOM 219 CD1 PHE A 18 -0.816 -3.107 -3.872 1.00 0.00 C ATOM 220 CD2 PHE A 18 -0.538 -5.257 -2.879 1.00 0.00 C ATOM 221 CE1 PHE A 18 -1.499 -2.674 -2.752 1.00 0.00 C ATOM 222 CE2 PHE A 18 -1.221 -4.831 -1.756 1.00 0.00 C ATOM 223 CZ PHE A 18 -1.701 -3.537 -1.692 1.00 0.00 C ATOM 0 H PHE A 18 -2.195 -3.982 -6.723 1.00 0.00 H new ATOM 0 HA PHE A 18 0.152 -5.445 -7.212 1.00 0.00 H new ATOM 0 HB2 PHE A 18 0.956 -5.786 -4.920 1.00 0.00 H new ATOM 0 HB3 PHE A 18 1.165 -4.122 -5.430 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -0.660 -2.429 -4.698 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.163 -6.269 -2.923 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -1.875 -1.662 -2.705 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.379 -5.508 -0.930 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.233 -3.201 -0.815 1.00 0.00 H new ATOM 233 N THR A 19 -1.468 -7.280 -6.906 1.00 0.00 N ATOM 234 CA THR A 19 -2.377 -8.407 -6.735 1.00 0.00 C ATOM 235 C THR A 19 -2.040 -9.206 -5.481 1.00 0.00 C ATOM 236 O THR A 19 -0.886 -9.568 -5.252 1.00 0.00 O ATOM 237 CB THR A 19 -2.327 -9.318 -7.961 1.00 0.00 C ATOM 238 OG1 THR A 19 -2.537 -8.575 -9.148 1.00 0.00 O ATOM 239 CG2 THR A 19 -3.357 -10.427 -7.925 1.00 0.00 C ATOM 0 H THR A 19 -0.843 -7.362 -7.708 1.00 0.00 H new ATOM 0 HA THR A 19 -3.385 -8.008 -6.623 1.00 0.00 H new ATOM 0 HB THR A 19 -1.333 -9.766 -7.947 1.00 0.00 H new ATOM 0 HG1 THR A 19 -1.732 -8.615 -9.706 1.00 0.00 H new ATOM 0 HG21 THR A 19 -3.267 -11.036 -8.824 1.00 0.00 H new ATOM 0 HG22 THR A 19 -3.190 -11.050 -7.046 1.00 0.00 H new ATOM 0 HG23 THR A 19 -4.356 -9.994 -7.879 1.00 0.00 H new ATOM 247 N ILE A 20 -3.060 -9.483 -4.675 1.00 0.00 N ATOM 248 CA ILE A 20 -2.882 -10.244 -3.445 1.00 0.00 C ATOM 249 C ILE A 20 -3.406 -11.668 -3.607 1.00 0.00 C ATOM 250 O ILE A 20 -4.506 -11.881 -4.115 1.00 0.00 O ATOM 251 CB ILE A 20 -3.605 -9.575 -2.261 1.00 0.00 C ATOM 252 CG1 ILE A 20 -3.235 -8.093 -2.179 1.00 0.00 C ATOM 253 CG2 ILE A 20 -3.261 -10.285 -0.960 1.00 0.00 C ATOM 254 CD1 ILE A 20 -4.212 -7.270 -1.369 1.00 0.00 C ATOM 0 H ILE A 20 -4.021 -9.191 -4.853 1.00 0.00 H new ATOM 0 HA ILE A 20 -1.812 -10.271 -3.237 1.00 0.00 H new ATOM 0 HB ILE A 20 -4.680 -9.653 -2.422 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -2.242 -7.999 -1.740 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -3.178 -7.685 -3.188 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -3.780 -9.800 -0.133 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.571 -11.328 -1.022 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.185 -10.236 -0.792 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -3.887 -6.230 -1.354 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.203 -7.334 -1.819 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.252 -7.652 -0.349 1.00 0.00 H new ATOM 266 N THR A 21 -2.610 -12.640 -3.172 1.00 0.00 N ATOM 267 CA THR A 21 -2.994 -14.044 -3.270 1.00 0.00 C ATOM 268 C THR A 21 -3.575 -14.545 -1.952 1.00 0.00 C ATOM 269 O THR A 21 -3.456 -15.724 -1.619 1.00 0.00 O ATOM 270 CB THR A 21 -1.786 -14.896 -3.664 1.00 0.00 C ATOM 271 OG1 THR A 21 -0.808 -14.886 -2.639 1.00 0.00 O ATOM 272 CG2 THR A 21 -1.117 -14.434 -4.940 1.00 0.00 C ATOM 0 H THR A 21 -1.696 -12.481 -2.749 1.00 0.00 H new ATOM 0 HA THR A 21 -3.761 -14.132 -4.039 1.00 0.00 H new ATOM 0 HB THR A 21 -2.182 -15.899 -3.823 1.00 0.00 H new ATOM 0 HG1 THR A 21 -0.045 -15.438 -2.910 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.269 -15.082 -5.161 1.00 0.00 H new ATOM 0 HG22 THR A 21 -1.831 -14.479 -5.762 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.768 -13.409 -4.817 1.00 0.00 H new ATOM 280 N ASN A 22 -4.205 -13.643 -1.206 1.00 0.00 N ATOM 281 CA ASN A 22 -4.807 -13.995 0.075 1.00 0.00 C ATOM 282 C ASN A 22 -6.291 -13.645 0.092 1.00 0.00 C ATOM 283 O ASN A 22 -7.117 -14.423 0.567 1.00 0.00 O ATOM 284 CB ASN A 22 -4.087 -13.274 1.215 1.00 0.00 C ATOM 285 CG ASN A 22 -4.202 -14.016 2.532 1.00 0.00 C ATOM 286 OD1 ASN A 22 -4.247 -15.246 2.563 1.00 0.00 O ATOM 287 ND2 ASN A 22 -4.247 -13.270 3.630 1.00 0.00 N ATOM 0 H ASN A 22 -4.312 -12.663 -1.467 1.00 0.00 H new ATOM 0 HA ASN A 22 -4.705 -15.071 0.214 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -3.034 -13.155 0.959 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -4.502 -12.273 1.328 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -4.322 -13.714 4.545 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -4.207 -12.253 3.558 1.00 0.00 H new ATOM 294 N LEU A 23 -6.621 -12.469 -0.431 1.00 0.00 N ATOM 295 CA LEU A 23 -8.006 -12.015 -0.478 1.00 0.00 C ATOM 296 C LEU A 23 -8.761 -12.692 -1.621 1.00 0.00 C ATOM 297 O LEU A 23 -8.476 -12.443 -2.792 1.00 0.00 O ATOM 298 CB LEU A 23 -8.056 -10.495 -0.649 1.00 0.00 C ATOM 299 CG LEU A 23 -9.329 -9.824 -0.129 1.00 0.00 C ATOM 300 CD1 LEU A 23 -10.521 -10.195 -0.997 1.00 0.00 C ATOM 301 CD2 LEU A 23 -9.581 -10.212 1.320 1.00 0.00 C ATOM 0 H LEU A 23 -5.948 -11.813 -0.828 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.486 -12.286 0.462 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.199 -10.059 -0.136 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.947 -10.260 -1.708 1.00 0.00 H new ATOM 0 HG LEU A 23 -9.193 -8.744 -0.177 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -11.417 -9.709 -0.612 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.342 -9.867 -2.021 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -10.660 -11.276 -0.982 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -10.490 -9.726 1.674 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -9.696 -11.294 1.392 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.738 -9.895 1.934 1.00 0.00 H new ATOM 313 N PRO A 24 -9.738 -13.561 -1.301 1.00 0.00 N ATOM 314 CA PRO A 24 -10.524 -14.268 -2.315 1.00 0.00 C ATOM 315 C PRO A 24 -11.543 -13.360 -2.995 1.00 0.00 C ATOM 316 O PRO A 24 -12.499 -12.903 -2.367 1.00 0.00 O ATOM 317 CB PRO A 24 -11.231 -15.358 -1.512 1.00 0.00 C ATOM 318 CG PRO A 24 -11.368 -14.785 -0.145 1.00 0.00 C ATOM 319 CD PRO A 24 -10.151 -13.925 0.070 1.00 0.00 C ATOM 0 HA PRO A 24 -9.901 -14.650 -3.124 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.204 -15.599 -1.941 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -10.651 -16.281 -1.499 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -12.281 -14.197 -0.059 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -11.425 -15.574 0.605 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -10.383 -13.043 0.666 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.365 -14.467 0.595 1.00 0.00 H new ATOM 327 N TYR A 25 -11.332 -13.101 -4.282 1.00 0.00 N ATOM 328 CA TYR A 25 -12.232 -12.247 -5.047 1.00 0.00 C ATOM 329 C TYR A 25 -13.582 -12.926 -5.255 1.00 0.00 C ATOM 330 O TYR A 25 -13.648 -14.081 -5.680 1.00 0.00 O ATOM 331 CB TYR A 25 -11.610 -11.899 -6.401 1.00 0.00 C ATOM 332 CG TYR A 25 -12.137 -10.614 -6.998 1.00 0.00 C ATOM 333 CD1 TYR A 25 -11.942 -9.396 -6.359 1.00 0.00 C ATOM 334 CD2 TYR A 25 -12.832 -10.618 -8.202 1.00 0.00 C ATOM 335 CE1 TYR A 25 -12.422 -8.220 -6.902 1.00 0.00 C ATOM 336 CE2 TYR A 25 -13.314 -9.447 -8.752 1.00 0.00 C ATOM 337 CZ TYR A 25 -13.107 -8.251 -8.098 1.00 0.00 C ATOM 338 OH TYR A 25 -13.587 -7.081 -8.642 1.00 0.00 O ATOM 0 H TYR A 25 -10.546 -13.471 -4.816 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.391 -11.330 -4.480 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -10.529 -11.819 -6.285 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -11.796 -12.716 -7.098 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -11.406 -9.368 -5.422 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -12.998 -11.553 -8.716 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -12.262 -7.281 -6.392 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -13.850 -9.468 -9.689 1.00 0.00 H new ATOM 0 HH TYR A 25 -12.895 -6.389 -8.592 1.00 0.00 H new ATOM 348 N SER A 26 -14.656 -12.204 -4.955 1.00 0.00 N ATOM 349 CA SER A 26 -16.004 -12.736 -5.110 1.00 0.00 C ATOM 350 C SER A 26 -16.966 -11.653 -5.586 1.00 0.00 C ATOM 351 O SER A 26 -16.554 -10.535 -5.896 1.00 0.00 O ATOM 352 CB SER A 26 -16.496 -13.327 -3.789 1.00 0.00 C ATOM 353 OG SER A 26 -15.594 -14.303 -3.297 1.00 0.00 O ATOM 0 H SER A 26 -14.619 -11.248 -4.603 1.00 0.00 H new ATOM 0 HA SER A 26 -15.972 -13.524 -5.863 1.00 0.00 H new ATOM 0 HB2 SER A 26 -16.613 -12.532 -3.053 1.00 0.00 H new ATOM 0 HB3 SER A 26 -17.479 -13.776 -3.932 1.00 0.00 H new ATOM 0 HG SER A 26 -15.932 -14.664 -2.451 1.00 0.00 H new ATOM 359 N GLN A 27 -18.250 -11.992 -5.644 1.00 0.00 N ATOM 360 CA GLN A 27 -19.272 -11.049 -6.082 1.00 0.00 C ATOM 361 C GLN A 27 -19.377 -9.872 -5.118 1.00 0.00 C ATOM 362 O GLN A 27 -19.653 -8.745 -5.527 1.00 0.00 O ATOM 363 CB GLN A 27 -20.627 -11.750 -6.198 1.00 0.00 C ATOM 364 CG GLN A 27 -20.732 -12.674 -7.403 1.00 0.00 C ATOM 365 CD GLN A 27 -21.056 -14.104 -7.017 1.00 0.00 C ATOM 366 OE1 GLN A 27 -20.591 -14.603 -5.993 1.00 0.00 O ATOM 367 NE2 GLN A 27 -21.860 -14.770 -7.837 1.00 0.00 N ATOM 0 H GLN A 27 -18.607 -12.914 -5.393 1.00 0.00 H new ATOM 0 HA GLN A 27 -18.982 -10.668 -7.061 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -20.807 -12.327 -5.291 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -21.413 -10.997 -6.258 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -21.503 -12.300 -8.076 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -19.791 -12.655 -7.954 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -22.223 -14.316 -8.676 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -22.115 -15.735 -7.628 1.00 0.00 H new ATOM 376 N ASP A 28 -19.156 -10.142 -3.835 1.00 0.00 N ATOM 377 CA ASP A 28 -19.226 -9.104 -2.814 1.00 0.00 C ATOM 378 C ASP A 28 -18.139 -8.056 -3.027 1.00 0.00 C ATOM 379 O ASP A 28 -18.412 -6.856 -3.039 1.00 0.00 O ATOM 380 CB ASP A 28 -19.092 -9.720 -1.421 1.00 0.00 C ATOM 381 CG ASP A 28 -19.999 -10.920 -1.228 1.00 0.00 C ATOM 382 OD1 ASP A 28 -21.229 -10.726 -1.142 1.00 0.00 O ATOM 383 OD2 ASP A 28 -19.478 -12.054 -1.164 1.00 0.00 O ATOM 0 H ASP A 28 -18.927 -11.070 -3.479 1.00 0.00 H new ATOM 0 HA ASP A 28 -20.197 -8.615 -2.895 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -18.057 -10.021 -1.258 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -19.327 -8.966 -0.670 1.00 0.00 H new ATOM 388 N ILE A 29 -16.904 -8.518 -3.195 1.00 0.00 N ATOM 389 CA ILE A 29 -15.775 -7.621 -3.408 1.00 0.00 C ATOM 390 C ILE A 29 -15.811 -7.005 -4.805 1.00 0.00 C ATOM 391 O ILE A 29 -15.173 -5.984 -5.060 1.00 0.00 O ATOM 392 CB ILE A 29 -14.432 -8.351 -3.212 1.00 0.00 C ATOM 393 CG1 ILE A 29 -14.416 -9.077 -1.867 1.00 0.00 C ATOM 394 CG2 ILE A 29 -13.273 -7.368 -3.302 1.00 0.00 C ATOM 395 CD1 ILE A 29 -14.608 -8.156 -0.680 1.00 0.00 C ATOM 0 H ILE A 29 -16.660 -9.508 -3.188 1.00 0.00 H new ATOM 0 HA ILE A 29 -15.860 -6.827 -2.666 1.00 0.00 H new ATOM 0 HB ILE A 29 -14.318 -9.089 -4.006 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -15.202 -9.832 -1.862 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.468 -9.603 -1.759 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -12.332 -7.901 -3.161 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -13.276 -6.890 -4.282 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -13.379 -6.608 -2.528 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.586 -8.739 0.240 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -13.808 -7.416 -0.660 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -15.569 -7.649 -0.765 1.00 0.00 H new ATOM 407 N ALA A 30 -16.563 -7.630 -5.710 1.00 0.00 N ATOM 408 CA ALA A 30 -16.680 -7.137 -7.077 1.00 0.00 C ATOM 409 C ALA A 30 -17.924 -6.270 -7.245 1.00 0.00 C ATOM 410 O ALA A 30 -18.511 -6.212 -8.325 1.00 0.00 O ATOM 411 CB ALA A 30 -16.713 -8.303 -8.056 1.00 0.00 C ATOM 0 H ALA A 30 -17.098 -8.477 -5.519 1.00 0.00 H new ATOM 0 HA ALA A 30 -15.807 -6.520 -7.290 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -16.801 -7.922 -9.073 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -15.794 -8.882 -7.963 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -17.568 -8.941 -7.833 1.00 0.00 H new ATOM 417 N GLN A 31 -18.320 -5.597 -6.169 1.00 0.00 N ATOM 418 CA GLN A 31 -19.492 -4.732 -6.195 1.00 0.00 C ATOM 419 C GLN A 31 -19.484 -3.778 -5.001 1.00 0.00 C ATOM 420 O GLN A 31 -19.737 -4.191 -3.869 1.00 0.00 O ATOM 421 CB GLN A 31 -20.772 -5.572 -6.182 1.00 0.00 C ATOM 422 CG GLN A 31 -21.319 -5.866 -7.571 1.00 0.00 C ATOM 423 CD GLN A 31 -22.683 -5.246 -7.805 1.00 0.00 C ATOM 424 OE1 GLN A 31 -23.479 -5.100 -6.877 1.00 0.00 O ATOM 425 NE2 GLN A 31 -22.960 -4.876 -9.050 1.00 0.00 N ATOM 0 H GLN A 31 -17.845 -5.635 -5.267 1.00 0.00 H new ATOM 0 HA GLN A 31 -19.462 -4.144 -7.112 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -20.574 -6.514 -5.671 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -21.534 -5.050 -5.603 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -20.621 -5.491 -8.319 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -21.386 -6.945 -7.710 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -22.271 -5.016 -9.789 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -23.862 -4.452 -9.267 1.00 0.00 H new ATOM 434 N PRO A 32 -19.189 -2.485 -5.233 1.00 0.00 N ATOM 435 CA PRO A 32 -19.148 -1.482 -4.163 1.00 0.00 C ATOM 436 C PRO A 32 -20.529 -1.207 -3.574 1.00 0.00 C ATOM 437 O PRO A 32 -21.052 -0.097 -3.681 1.00 0.00 O ATOM 438 CB PRO A 32 -18.602 -0.234 -4.861 1.00 0.00 C ATOM 439 CG PRO A 32 -18.939 -0.422 -6.298 1.00 0.00 C ATOM 440 CD PRO A 32 -18.871 -1.901 -6.550 1.00 0.00 C ATOM 0 HA PRO A 32 -18.541 -1.811 -3.320 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -19.058 0.673 -4.463 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -17.526 -0.139 -4.717 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -19.933 -0.034 -6.519 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -18.238 0.115 -6.937 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -19.586 -2.213 -7.311 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -17.883 -2.205 -6.897 1.00 0.00 H new ATOM 448 N SER A 33 -21.113 -2.225 -2.951 1.00 0.00 N ATOM 449 CA SER A 33 -22.432 -2.096 -2.344 1.00 0.00 C ATOM 450 C SER A 33 -22.714 -3.263 -1.402 1.00 0.00 C ATOM 451 O SER A 33 -23.861 -3.680 -1.242 1.00 0.00 O ATOM 452 CB SER A 33 -23.511 -2.024 -3.425 1.00 0.00 C ATOM 453 OG SER A 33 -24.796 -1.857 -2.852 1.00 0.00 O ATOM 0 H SER A 33 -20.693 -3.149 -2.853 1.00 0.00 H new ATOM 0 HA SER A 33 -22.448 -1.173 -1.765 1.00 0.00 H new ATOM 0 HB2 SER A 33 -23.300 -1.194 -4.100 1.00 0.00 H new ATOM 0 HB3 SER A 33 -23.492 -2.935 -4.024 1.00 0.00 H new ATOM 0 HG SER A 33 -24.921 -2.511 -2.133 1.00 0.00 H new ATOM 459 N THR A 34 -21.661 -3.787 -0.783 1.00 0.00 N ATOM 460 CA THR A 34 -21.795 -4.905 0.142 1.00 0.00 C ATOM 461 C THR A 34 -20.978 -4.662 1.407 1.00 0.00 C ATOM 462 O THR A 34 -20.269 -3.662 1.517 1.00 0.00 O ATOM 463 CB THR A 34 -21.349 -6.206 -0.527 1.00 0.00 C ATOM 464 OG1 THR A 34 -19.935 -6.278 -0.589 1.00 0.00 O ATOM 465 CG2 THR A 34 -21.879 -6.369 -1.935 1.00 0.00 C ATOM 0 H THR A 34 -20.705 -3.454 -0.906 1.00 0.00 H new ATOM 0 HA THR A 34 -22.845 -4.992 0.420 1.00 0.00 H new ATOM 0 HB THR A 34 -21.759 -7.004 0.092 1.00 0.00 H new ATOM 0 HG1 THR A 34 -19.657 -6.468 -1.509 1.00 0.00 H new ATOM 0 HG21 THR A 34 -21.525 -7.312 -2.350 1.00 0.00 H new ATOM 0 HG22 THR A 34 -22.969 -6.368 -1.916 1.00 0.00 H new ATOM 0 HG23 THR A 34 -21.526 -5.545 -2.554 1.00 0.00 H new ATOM 473 N THR A 35 -21.083 -5.583 2.361 1.00 0.00 N ATOM 474 CA THR A 35 -20.354 -5.466 3.618 1.00 0.00 C ATOM 475 C THR A 35 -18.925 -5.981 3.472 1.00 0.00 C ATOM 476 O THR A 35 -18.002 -5.462 4.100 1.00 0.00 O ATOM 477 CB THR A 35 -21.076 -6.237 4.724 1.00 0.00 C ATOM 478 OG1 THR A 35 -22.476 -6.041 4.642 1.00 0.00 O ATOM 479 CG2 THR A 35 -20.637 -5.837 6.116 1.00 0.00 C ATOM 0 H THR A 35 -21.665 -6.417 2.287 1.00 0.00 H new ATOM 0 HA THR A 35 -20.313 -4.410 3.887 1.00 0.00 H new ATOM 0 HB THR A 35 -20.815 -7.283 4.564 1.00 0.00 H new ATOM 0 HG1 THR A 35 -22.919 -6.544 5.357 1.00 0.00 H new ATOM 0 HG21 THR A 35 -21.188 -6.421 6.853 1.00 0.00 H new ATOM 0 HG22 THR A 35 -19.569 -6.024 6.229 1.00 0.00 H new ATOM 0 HG23 THR A 35 -20.838 -4.777 6.270 1.00 0.00 H new ATOM 487 N LYS A 36 -18.750 -7.003 2.641 1.00 0.00 N ATOM 488 CA LYS A 36 -17.436 -7.588 2.413 1.00 0.00 C ATOM 489 C LYS A 36 -16.552 -6.642 1.606 1.00 0.00 C ATOM 490 O LYS A 36 -15.335 -6.604 1.788 1.00 0.00 O ATOM 491 CB LYS A 36 -17.585 -8.925 1.687 1.00 0.00 C ATOM 492 CG LYS A 36 -16.752 -10.047 2.291 1.00 0.00 C ATOM 493 CD LYS A 36 -15.264 -9.822 2.076 1.00 0.00 C ATOM 494 CE LYS A 36 -14.714 -10.729 0.988 1.00 0.00 C ATOM 495 NZ LYS A 36 -13.239 -10.591 0.841 1.00 0.00 N ATOM 0 H LYS A 36 -19.504 -7.443 2.114 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.957 -7.756 3.378 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.635 -9.218 1.697 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -17.300 -8.795 0.643 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -16.958 -10.119 3.359 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -17.044 -10.998 1.845 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -15.088 -8.781 1.806 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -14.729 -10.005 3.008 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.960 -11.765 1.221 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -15.197 -10.492 0.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.929 -11.078 -0.024 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -12.989 -9.583 0.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.767 -11.015 1.665 1.00 0.00 H new ATOM 509 N TYR A 37 -17.173 -5.877 0.715 1.00 0.00 N ATOM 510 CA TYR A 37 -16.444 -4.929 -0.120 1.00 0.00 C ATOM 511 C TYR A 37 -15.787 -3.844 0.731 1.00 0.00 C ATOM 512 O TYR A 37 -14.568 -3.679 0.709 1.00 0.00 O ATOM 513 CB TYR A 37 -17.385 -4.291 -1.145 1.00 0.00 C ATOM 514 CG TYR A 37 -16.716 -3.260 -2.027 1.00 0.00 C ATOM 515 CD1 TYR A 37 -16.565 -1.946 -1.600 1.00 0.00 C ATOM 516 CD2 TYR A 37 -16.236 -3.601 -3.285 1.00 0.00 C ATOM 517 CE1 TYR A 37 -15.955 -1.001 -2.404 1.00 0.00 C ATOM 518 CE2 TYR A 37 -15.624 -2.662 -4.093 1.00 0.00 C ATOM 519 CZ TYR A 37 -15.486 -1.364 -3.649 1.00 0.00 C ATOM 520 OH TYR A 37 -14.877 -0.427 -4.450 1.00 0.00 O ATOM 0 H TYR A 37 -18.180 -5.895 0.552 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.661 -5.475 -0.646 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.808 -5.075 -1.774 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -18.216 -3.821 -0.619 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -16.930 -1.659 -0.625 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -16.343 -4.616 -3.637 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -15.846 0.017 -2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -15.255 -2.944 -5.068 1.00 0.00 H new ATOM 0 HH TYR A 37 -14.603 -0.845 -5.293 1.00 0.00 H new ATOM 530 N GLN A 38 -16.605 -3.107 1.475 1.00 0.00 N ATOM 531 CA GLN A 38 -16.103 -2.035 2.329 1.00 0.00 C ATOM 532 C GLN A 38 -15.281 -2.593 3.487 1.00 0.00 C ATOM 533 O GLN A 38 -14.371 -1.934 3.986 1.00 0.00 O ATOM 534 CB GLN A 38 -17.266 -1.201 2.869 1.00 0.00 C ATOM 535 CG GLN A 38 -17.691 -0.076 1.940 1.00 0.00 C ATOM 536 CD GLN A 38 -18.978 -0.384 1.201 1.00 0.00 C ATOM 537 OE1 GLN A 38 -19.832 -1.118 1.697 1.00 0.00 O ATOM 538 NE2 GLN A 38 -19.123 0.178 0.007 1.00 0.00 N ATOM 0 H GLN A 38 -17.617 -3.232 1.504 1.00 0.00 H new ATOM 0 HA GLN A 38 -15.455 -1.399 1.725 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -18.119 -1.855 3.048 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -16.982 -0.778 3.832 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -17.819 0.839 2.518 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -16.897 0.112 1.217 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -18.389 0.780 -0.366 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -19.968 0.008 -0.538 1.00 0.00 H new ATOM 547 N GLN A 39 -15.607 -3.811 3.909 1.00 0.00 N ATOM 548 CA GLN A 39 -14.897 -4.454 5.010 1.00 0.00 C ATOM 549 C GLN A 39 -13.404 -4.552 4.714 1.00 0.00 C ATOM 550 O GLN A 39 -12.585 -3.936 5.396 1.00 0.00 O ATOM 551 CB GLN A 39 -15.471 -5.849 5.269 1.00 0.00 C ATOM 552 CG GLN A 39 -16.526 -5.877 6.363 1.00 0.00 C ATOM 553 CD GLN A 39 -15.945 -6.198 7.726 1.00 0.00 C ATOM 554 OE1 GLN A 39 -15.495 -5.307 8.447 1.00 0.00 O ATOM 555 NE2 GLN A 39 -15.950 -7.476 8.087 1.00 0.00 N ATOM 0 H GLN A 39 -16.357 -4.372 3.506 1.00 0.00 H new ATOM 0 HA GLN A 39 -15.031 -3.842 5.902 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -15.906 -6.231 4.346 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -14.659 -6.523 5.541 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -17.027 -4.910 6.404 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -17.285 -6.618 6.112 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -16.333 -8.182 7.458 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -15.571 -7.752 8.993 1.00 0.00 H new ATOM 564 N THR A 40 -13.056 -5.332 3.696 1.00 0.00 N ATOM 565 CA THR A 40 -11.660 -5.511 3.312 1.00 0.00 C ATOM 566 C THR A 40 -11.073 -4.215 2.762 1.00 0.00 C ATOM 567 O THR A 40 -9.878 -3.956 2.900 1.00 0.00 O ATOM 568 CB THR A 40 -11.535 -6.623 2.270 1.00 0.00 C ATOM 569 OG1 THR A 40 -12.214 -7.790 2.697 1.00 0.00 O ATOM 570 CG2 THR A 40 -10.102 -7.008 1.975 1.00 0.00 C ATOM 0 H THR A 40 -13.721 -5.850 3.122 1.00 0.00 H new ATOM 0 HA THR A 40 -11.099 -5.791 4.203 1.00 0.00 H new ATOM 0 HB THR A 40 -11.980 -6.218 1.361 1.00 0.00 H new ATOM 0 HG1 THR A 40 -12.894 -8.033 2.035 1.00 0.00 H new ATOM 0 HG21 THR A 40 -10.085 -7.802 1.228 1.00 0.00 H new ATOM 0 HG22 THR A 40 -9.563 -6.140 1.595 1.00 0.00 H new ATOM 0 HG23 THR A 40 -9.624 -7.360 2.889 1.00 0.00 H new ATOM 578 N LYS A 41 -11.921 -3.404 2.137 1.00 0.00 N ATOM 579 CA LYS A 41 -11.485 -2.135 1.565 1.00 0.00 C ATOM 580 C LYS A 41 -10.864 -1.240 2.632 1.00 0.00 C ATOM 581 O LYS A 41 -9.939 -0.476 2.355 1.00 0.00 O ATOM 582 CB LYS A 41 -12.665 -1.417 0.905 1.00 0.00 C ATOM 583 CG LYS A 41 -12.280 -0.116 0.219 1.00 0.00 C ATOM 584 CD LYS A 41 -13.507 0.672 -0.209 1.00 0.00 C ATOM 585 CE LYS A 41 -13.235 1.492 -1.459 1.00 0.00 C ATOM 586 NZ LYS A 41 -12.920 2.910 -1.135 1.00 0.00 N ATOM 0 H LYS A 41 -12.914 -3.603 2.014 1.00 0.00 H new ATOM 0 HA LYS A 41 -10.728 -2.347 0.810 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -13.121 -2.083 0.172 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -13.422 -1.209 1.661 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -11.676 0.488 0.896 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -11.663 -0.332 -0.653 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -14.334 -0.013 -0.395 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -13.817 1.333 0.601 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.403 1.052 -2.008 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -14.105 1.454 -2.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -12.292 3.302 -1.866 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.801 3.462 -1.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.447 2.958 -0.210 1.00 0.00 H new ATOM 600 N ARG A 42 -11.379 -1.338 3.853 1.00 0.00 N ATOM 601 CA ARG A 42 -10.874 -0.536 4.963 1.00 0.00 C ATOM 602 C ARG A 42 -9.630 -1.172 5.573 1.00 0.00 C ATOM 603 O ARG A 42 -8.744 -0.476 6.067 1.00 0.00 O ATOM 604 CB ARG A 42 -11.955 -0.372 6.033 1.00 0.00 C ATOM 605 CG ARG A 42 -11.728 0.821 6.947 1.00 0.00 C ATOM 606 CD ARG A 42 -13.037 1.494 7.327 1.00 0.00 C ATOM 607 NE ARG A 42 -13.212 1.574 8.775 1.00 0.00 N ATOM 608 CZ ARG A 42 -13.464 0.522 9.550 1.00 0.00 C ATOM 609 NH1 ARG A 42 -13.572 -0.691 9.021 1.00 0.00 N ATOM 610 NH2 ARG A 42 -13.608 0.681 10.858 1.00 0.00 N ATOM 0 H ARG A 42 -12.145 -1.964 4.100 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.604 0.446 4.576 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -12.924 -0.267 5.546 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -11.998 -1.279 6.636 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -11.211 0.495 7.849 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.079 1.542 6.450 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.065 2.498 6.903 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.869 0.940 6.891 1.00 0.00 H new ATOM 0 HE ARG A 42 -13.137 2.490 9.218 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -13.462 -0.820 8.015 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.765 -1.493 9.620 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -13.526 1.610 11.271 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -13.801 -0.126 11.452 1.00 0.00 H new ATOM 624 N SER A 43 -9.570 -2.499 5.536 1.00 0.00 N ATOM 625 CA SER A 43 -8.434 -3.230 6.086 1.00 0.00 C ATOM 626 C SER A 43 -7.155 -2.902 5.323 1.00 0.00 C ATOM 627 O SER A 43 -6.142 -2.536 5.918 1.00 0.00 O ATOM 628 CB SER A 43 -8.700 -4.736 6.041 1.00 0.00 C ATOM 629 OG SER A 43 -8.334 -5.356 7.262 1.00 0.00 O ATOM 0 H SER A 43 -10.295 -3.091 5.131 1.00 0.00 H new ATOM 0 HA SER A 43 -8.304 -2.923 7.124 1.00 0.00 H new ATOM 0 HB2 SER A 43 -9.756 -4.916 5.841 1.00 0.00 H new ATOM 0 HB3 SER A 43 -8.139 -5.183 5.220 1.00 0.00 H new ATOM 0 HG SER A 43 -8.515 -6.318 7.208 1.00 0.00 H new ATOM 635 N ILE A 44 -7.209 -3.036 4.001 1.00 0.00 N ATOM 636 CA ILE A 44 -6.055 -2.752 3.157 1.00 0.00 C ATOM 637 C ILE A 44 -5.651 -1.284 3.258 1.00 0.00 C ATOM 638 O ILE A 44 -4.471 -0.963 3.388 1.00 0.00 O ATOM 639 CB ILE A 44 -6.335 -3.099 1.681 1.00 0.00 C ATOM 640 CG1 ILE A 44 -6.846 -4.537 1.560 1.00 0.00 C ATOM 641 CG2 ILE A 44 -5.079 -2.905 0.841 1.00 0.00 C ATOM 642 CD1 ILE A 44 -7.157 -4.949 0.138 1.00 0.00 C ATOM 0 H ILE A 44 -8.039 -3.339 3.492 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.238 -3.377 3.517 1.00 0.00 H new ATOM 0 HB ILE A 44 -7.106 -2.426 1.306 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -6.099 -5.216 1.971 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -7.745 -4.647 2.167 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.294 -3.154 -0.198 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -4.755 -1.866 0.905 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.288 -3.556 1.214 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -7.514 -5.979 0.127 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -7.927 -4.294 -0.271 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.255 -4.871 -0.469 1.00 0.00 H new ATOM 654 N GLU A 45 -6.641 -0.399 3.198 1.00 0.00 N ATOM 655 CA GLU A 45 -6.389 1.035 3.285 1.00 0.00 C ATOM 656 C GLU A 45 -5.703 1.386 4.602 1.00 0.00 C ATOM 657 O GLU A 45 -4.937 2.346 4.677 1.00 0.00 O ATOM 658 CB GLU A 45 -7.700 1.812 3.155 1.00 0.00 C ATOM 659 CG GLU A 45 -7.505 3.296 2.888 1.00 0.00 C ATOM 660 CD GLU A 45 -7.838 4.154 4.093 1.00 0.00 C ATOM 661 OE1 GLU A 45 -8.740 3.768 4.867 1.00 0.00 O ATOM 662 OE2 GLU A 45 -7.198 5.213 4.263 1.00 0.00 O ATOM 0 H GLU A 45 -7.624 -0.649 3.090 1.00 0.00 H new ATOM 0 HA GLU A 45 -5.727 1.315 2.465 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.290 1.380 2.346 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.278 1.689 4.071 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -6.471 3.476 2.593 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.132 3.596 2.049 1.00 0.00 H new ATOM 669 N ASN A 46 -5.984 0.601 5.637 1.00 0.00 N ATOM 670 CA ASN A 46 -5.394 0.826 6.951 1.00 0.00 C ATOM 671 C ASN A 46 -3.940 0.366 6.979 1.00 0.00 C ATOM 672 O ASN A 46 -3.067 1.064 7.496 1.00 0.00 O ATOM 673 CB ASN A 46 -6.195 0.085 8.024 1.00 0.00 C ATOM 674 CG ASN A 46 -6.335 0.891 9.301 1.00 0.00 C ATOM 675 OD1 ASN A 46 -5.778 1.981 9.426 1.00 0.00 O ATOM 676 ND2 ASN A 46 -7.083 0.355 10.259 1.00 0.00 N ATOM 0 H ASN A 46 -6.617 -0.197 5.591 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.423 1.896 7.158 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -7.186 -0.151 7.636 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.707 -0.863 8.248 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -7.214 0.850 11.141 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.527 -0.552 10.112 1.00 0.00 H new ATOM 683 N ALA A 47 -3.688 -0.813 6.420 1.00 0.00 N ATOM 684 CA ALA A 47 -2.341 -1.370 6.379 1.00 0.00 C ATOM 685 C ALA A 47 -1.408 -0.494 5.550 1.00 0.00 C ATOM 686 O ALA A 47 -0.220 -0.379 5.849 1.00 0.00 O ATOM 687 CB ALA A 47 -2.374 -2.784 5.822 1.00 0.00 C ATOM 0 H ALA A 47 -4.400 -1.402 5.988 1.00 0.00 H new ATOM 0 HA ALA A 47 -1.956 -1.400 7.398 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.362 -3.189 5.797 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.000 -3.411 6.457 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -2.784 -2.768 4.812 1.00 0.00 H new ATOM 693 N LEU A 48 -1.954 0.120 4.506 1.00 0.00 N ATOM 694 CA LEU A 48 -1.169 0.984 3.630 1.00 0.00 C ATOM 695 C LEU A 48 -0.799 2.284 4.338 1.00 0.00 C ATOM 696 O LEU A 48 0.272 2.845 4.106 1.00 0.00 O ATOM 697 CB LEU A 48 -1.949 1.292 2.350 1.00 0.00 C ATOM 698 CG LEU A 48 -2.005 0.148 1.337 1.00 0.00 C ATOM 699 CD1 LEU A 48 -2.992 0.469 0.225 1.00 0.00 C ATOM 700 CD2 LEU A 48 -0.623 -0.123 0.762 1.00 0.00 C ATOM 0 H LEU A 48 -2.937 0.036 4.245 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.251 0.458 3.370 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -2.968 1.568 2.621 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.501 2.161 1.869 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.346 -0.751 1.851 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -3.019 -0.356 -0.487 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.985 0.614 0.650 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.680 1.380 -0.287 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -0.682 -0.940 0.043 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -0.254 0.773 0.263 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.059 -0.397 1.567 1.00 0.00 H new ATOM 712 N ASN A 49 -1.691 2.758 5.201 1.00 0.00 N ATOM 713 CA ASN A 49 -1.457 3.994 5.941 1.00 0.00 C ATOM 714 C ASN A 49 -0.253 3.858 6.866 1.00 0.00 C ATOM 715 O ASN A 49 0.720 4.603 6.748 1.00 0.00 O ATOM 716 CB ASN A 49 -2.698 4.367 6.753 1.00 0.00 C ATOM 717 CG ASN A 49 -2.656 5.802 7.243 1.00 0.00 C ATOM 718 OD1 ASN A 49 -1.610 6.296 7.663 1.00 0.00 O ATOM 719 ND2 ASN A 49 -3.798 6.477 7.195 1.00 0.00 N ATOM 0 H ASN A 49 -2.582 2.306 5.406 1.00 0.00 H new ATOM 0 HA ASN A 49 -1.249 4.785 5.220 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.588 4.221 6.140 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -2.785 3.696 7.608 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.832 7.445 7.514 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.642 6.027 6.839 1.00 0.00 H new ATOM 726 N GLN A 50 -0.325 2.905 7.791 1.00 0.00 N ATOM 727 CA GLN A 50 0.760 2.675 8.739 1.00 0.00 C ATOM 728 C GLN A 50 2.075 2.408 8.015 1.00 0.00 C ATOM 729 O GLN A 50 3.149 2.729 8.522 1.00 0.00 O ATOM 730 CB GLN A 50 0.423 1.499 9.658 1.00 0.00 C ATOM 731 CG GLN A 50 0.014 0.239 8.913 1.00 0.00 C ATOM 732 CD GLN A 50 -1.064 -0.542 9.638 1.00 0.00 C ATOM 733 OE1 GLN A 50 -2.253 -0.389 9.357 1.00 0.00 O ATOM 734 NE2 GLN A 50 -0.654 -1.385 10.578 1.00 0.00 N ATOM 0 H GLN A 50 -1.123 2.280 7.904 1.00 0.00 H new ATOM 0 HA GLN A 50 0.876 3.577 9.340 1.00 0.00 H new ATOM 0 HB2 GLN A 50 1.289 1.277 10.281 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -0.385 1.793 10.328 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -0.344 0.509 7.919 1.00 0.00 H new ATOM 0 HG3 GLN A 50 0.888 -0.397 8.775 1.00 0.00 H new ATOM 0 HE21 GLN A 50 0.342 -1.480 10.778 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -1.335 -1.937 11.100 1.00 0.00 H new ATOM 743 N LEU A 51 1.985 1.822 6.825 1.00 0.00 N ATOM 744 CA LEU A 51 3.171 1.516 6.033 1.00 0.00 C ATOM 745 C LEU A 51 3.897 2.794 5.627 1.00 0.00 C ATOM 746 O LEU A 51 5.119 2.886 5.728 1.00 0.00 O ATOM 747 CB LEU A 51 2.788 0.714 4.787 1.00 0.00 C ATOM 748 CG LEU A 51 3.941 -0.045 4.127 1.00 0.00 C ATOM 749 CD1 LEU A 51 3.430 -1.305 3.445 1.00 0.00 C ATOM 750 CD2 LEU A 51 4.663 0.848 3.129 1.00 0.00 C ATOM 0 H LEU A 51 1.104 1.550 6.389 1.00 0.00 H new ATOM 0 HA LEU A 51 3.843 0.917 6.648 1.00 0.00 H new ATOM 0 HB2 LEU A 51 2.011 -0.000 5.058 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.354 1.395 4.054 1.00 0.00 H new ATOM 0 HG LEU A 51 4.649 -0.338 4.902 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.264 -1.832 2.981 1.00 0.00 H new ATOM 0 HD12 LEU A 51 2.958 -1.953 4.184 1.00 0.00 H new ATOM 0 HD13 LEU A 51 2.701 -1.035 2.681 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.480 0.293 2.669 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.964 1.171 2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 51 5.063 1.721 3.645 1.00 0.00 H new ATOM 762 N PHE A 52 3.134 3.782 5.169 1.00 0.00 N ATOM 763 CA PHE A 52 3.707 5.055 4.749 1.00 0.00 C ATOM 764 C PHE A 52 4.416 5.743 5.911 1.00 0.00 C ATOM 765 O PHE A 52 5.381 6.481 5.712 1.00 0.00 O ATOM 766 CB PHE A 52 2.614 5.970 4.192 1.00 0.00 C ATOM 767 CG PHE A 52 1.712 5.294 3.200 1.00 0.00 C ATOM 768 CD1 PHE A 52 2.237 4.494 2.198 1.00 0.00 C ATOM 769 CD2 PHE A 52 0.338 5.458 3.270 1.00 0.00 C ATOM 770 CE1 PHE A 52 1.408 3.871 1.284 1.00 0.00 C ATOM 771 CE2 PHE A 52 -0.496 4.839 2.359 1.00 0.00 C ATOM 772 CZ PHE A 52 0.039 4.044 1.364 1.00 0.00 C ATOM 0 H PHE A 52 2.120 3.725 5.080 1.00 0.00 H new ATOM 0 HA PHE A 52 4.439 4.855 3.967 1.00 0.00 H new ATOM 0 HB2 PHE A 52 2.012 6.348 5.019 1.00 0.00 H new ATOM 0 HB3 PHE A 52 3.081 6.833 3.717 1.00 0.00 H new ATOM 0 HD1 PHE A 52 3.306 4.356 2.130 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.086 6.077 4.046 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.830 3.249 0.508 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.565 4.977 2.425 1.00 0.00 H new ATOM 0 HZ PHE A 52 -0.611 3.559 0.651 1.00 0.00 H new ATOM 782 N ARG A 53 3.932 5.496 7.124 1.00 0.00 N ATOM 783 CA ARG A 53 4.520 6.093 8.318 1.00 0.00 C ATOM 784 C ARG A 53 5.690 5.259 8.831 1.00 0.00 C ATOM 785 O ARG A 53 6.602 5.781 9.470 1.00 0.00 O ATOM 786 CB ARG A 53 3.463 6.236 9.415 1.00 0.00 C ATOM 787 CG ARG A 53 2.174 6.887 8.937 1.00 0.00 C ATOM 788 CD ARG A 53 2.022 8.301 9.479 1.00 0.00 C ATOM 789 NE ARG A 53 0.831 8.442 10.316 1.00 0.00 N ATOM 790 CZ ARG A 53 0.779 8.085 11.597 1.00 0.00 C ATOM 791 NH1 ARG A 53 1.844 7.565 12.196 1.00 0.00 N ATOM 792 NH2 ARG A 53 -0.344 8.249 12.284 1.00 0.00 N ATOM 0 H ARG A 53 3.134 4.887 7.306 1.00 0.00 H new ATOM 0 HA ARG A 53 4.895 7.081 8.049 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.234 5.250 9.818 1.00 0.00 H new ATOM 0 HB3 ARG A 53 3.877 6.826 10.232 1.00 0.00 H new ATOM 0 HG2 ARG A 53 2.161 6.912 7.847 1.00 0.00 H new ATOM 0 HG3 ARG A 53 1.323 6.283 9.252 1.00 0.00 H new ATOM 0 HD2 ARG A 53 2.906 8.564 10.060 1.00 0.00 H new ATOM 0 HD3 ARG A 53 1.966 9.004 8.648 1.00 0.00 H new ATOM 0 HE ARG A 53 -0.009 8.837 9.893 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.711 7.436 11.674 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.795 7.294 13.178 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -1.166 8.648 11.830 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.386 7.976 13.266 1.00 0.00 H new ATOM 806 N ASN A 54 5.658 3.959 8.550 1.00 0.00 N ATOM 807 CA ASN A 54 6.718 3.057 8.988 1.00 0.00 C ATOM 808 C ASN A 54 7.741 2.830 7.879 1.00 0.00 C ATOM 809 O ASN A 54 8.417 1.802 7.847 1.00 0.00 O ATOM 810 CB ASN A 54 6.125 1.719 9.431 1.00 0.00 C ATOM 811 CG ASN A 54 5.364 1.828 10.737 1.00 0.00 C ATOM 812 OD1 ASN A 54 5.897 2.299 11.741 1.00 0.00 O ATOM 813 ND2 ASN A 54 4.110 1.391 10.729 1.00 0.00 N ATOM 0 H ASN A 54 4.911 3.508 8.022 1.00 0.00 H new ATOM 0 HA ASN A 54 7.226 3.522 9.833 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.457 1.346 8.655 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.926 0.988 9.540 1.00 0.00 H new ATOM 0 HD21 ASN A 54 3.548 1.438 11.579 1.00 0.00 H new ATOM 0 HD22 ASN A 54 3.709 1.008 9.873 1.00 0.00 H new ATOM 820 N SER A 55 7.854 3.796 6.971 1.00 0.00 N ATOM 821 CA SER A 55 8.798 3.696 5.863 1.00 0.00 C ATOM 822 C SER A 55 9.759 4.880 5.858 1.00 0.00 C ATOM 823 O SER A 55 9.578 5.842 6.602 1.00 0.00 O ATOM 824 CB SER A 55 8.048 3.628 4.532 1.00 0.00 C ATOM 825 OG SER A 55 6.864 4.406 4.573 1.00 0.00 O ATOM 0 H SER A 55 7.304 4.655 6.981 1.00 0.00 H new ATOM 0 HA SER A 55 9.377 2.782 5.993 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.693 3.984 3.729 1.00 0.00 H new ATOM 0 HB3 SER A 55 7.798 2.592 4.304 1.00 0.00 H new ATOM 0 HG SER A 55 6.101 3.830 4.789 1.00 0.00 H new ATOM 831 N SER A 56 10.783 4.801 5.013 1.00 0.00 N ATOM 832 CA SER A 56 11.774 5.866 4.910 1.00 0.00 C ATOM 833 C SER A 56 11.117 7.182 4.507 1.00 0.00 C ATOM 834 O SER A 56 11.559 8.258 4.911 1.00 0.00 O ATOM 835 CB SER A 56 12.854 5.490 3.894 1.00 0.00 C ATOM 836 OG SER A 56 13.866 6.481 3.836 1.00 0.00 O ATOM 0 H SER A 56 10.948 4.010 4.390 1.00 0.00 H new ATOM 0 HA SER A 56 12.235 5.995 5.889 1.00 0.00 H new ATOM 0 HB2 SER A 56 13.295 4.531 4.165 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.404 5.367 2.909 1.00 0.00 H new ATOM 0 HG SER A 56 14.545 6.217 3.181 1.00 0.00 H new ATOM 842 N ILE A 57 10.057 7.089 3.711 1.00 0.00 N ATOM 843 CA ILE A 57 9.337 8.272 3.254 1.00 0.00 C ATOM 844 C ILE A 57 8.151 8.575 4.165 1.00 0.00 C ATOM 845 O ILE A 57 7.043 8.840 3.695 1.00 0.00 O ATOM 846 CB ILE A 57 8.835 8.100 1.807 1.00 0.00 C ATOM 847 CG1 ILE A 57 7.911 6.885 1.704 1.00 0.00 C ATOM 848 CG2 ILE A 57 10.009 7.962 0.851 1.00 0.00 C ATOM 849 CD1 ILE A 57 7.263 6.732 0.346 1.00 0.00 C ATOM 0 H ILE A 57 9.677 6.206 3.369 1.00 0.00 H new ATOM 0 HA ILE A 57 10.038 9.106 3.287 1.00 0.00 H new ATOM 0 HB ILE A 57 8.268 8.988 1.528 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.482 5.984 1.929 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.132 6.966 2.462 1.00 0.00 H new ATOM 0 HG21 ILE A 57 9.637 7.841 -0.167 1.00 0.00 H new ATOM 0 HG22 ILE A 57 10.631 8.856 0.907 1.00 0.00 H new ATOM 0 HG23 ILE A 57 10.602 7.090 1.126 1.00 0.00 H new ATOM 0 HD11 ILE A 57 6.622 5.850 0.346 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.664 7.616 0.127 1.00 0.00 H new ATOM 0 HD13 ILE A 57 8.035 6.619 -0.415 1.00 0.00 H new ATOM 861 N LYS A 58 8.391 8.532 5.471 1.00 0.00 N ATOM 862 CA LYS A 58 7.345 8.801 6.451 1.00 0.00 C ATOM 863 C LYS A 58 7.365 10.264 6.885 1.00 0.00 C ATOM 864 O LYS A 58 7.243 10.573 8.070 1.00 0.00 O ATOM 865 CB LYS A 58 7.516 7.893 7.671 1.00 0.00 C ATOM 866 CG LYS A 58 8.851 8.068 8.376 1.00 0.00 C ATOM 867 CD LYS A 58 8.949 7.186 9.610 1.00 0.00 C ATOM 868 CE LYS A 58 10.219 7.468 10.396 1.00 0.00 C ATOM 869 NZ LYS A 58 11.297 6.491 10.080 1.00 0.00 N ATOM 0 H LYS A 58 9.301 8.313 5.876 1.00 0.00 H new ATOM 0 HA LYS A 58 6.383 8.594 5.983 1.00 0.00 H new ATOM 0 HB2 LYS A 58 6.712 8.094 8.379 1.00 0.00 H new ATOM 0 HB3 LYS A 58 7.413 6.854 7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.661 7.825 7.689 1.00 0.00 H new ATOM 0 HG3 LYS A 58 8.978 9.112 8.663 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.081 7.352 10.247 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.929 6.138 9.312 1.00 0.00 H new ATOM 0 HE2 LYS A 58 10.567 8.477 10.174 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.000 7.434 11.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 12.146 6.718 10.637 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 10.975 5.531 10.316 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 11.524 6.541 9.066 1.00 0.00 H new ATOM 883 N SER A 59 7.521 11.161 5.917 1.00 0.00 N ATOM 884 CA SER A 59 7.557 12.591 6.199 1.00 0.00 C ATOM 885 C SER A 59 6.718 13.366 5.188 1.00 0.00 C ATOM 886 O SER A 59 5.927 14.233 5.558 1.00 0.00 O ATOM 887 CB SER A 59 9.000 13.100 6.179 1.00 0.00 C ATOM 888 OG SER A 59 9.729 12.610 7.290 1.00 0.00 O ATOM 0 H SER A 59 7.624 10.923 4.931 1.00 0.00 H new ATOM 0 HA SER A 59 7.136 12.751 7.192 1.00 0.00 H new ATOM 0 HB2 SER A 59 9.486 12.788 5.255 1.00 0.00 H new ATOM 0 HB3 SER A 59 9.005 14.190 6.189 1.00 0.00 H new ATOM 0 HG SER A 59 10.648 12.948 7.253 1.00 0.00 H new ATOM 894 N TYR A 60 6.897 13.047 3.911 1.00 0.00 N ATOM 895 CA TYR A 60 6.156 13.712 2.845 1.00 0.00 C ATOM 896 C TYR A 60 4.867 12.963 2.527 1.00 0.00 C ATOM 897 O TYR A 60 3.862 13.567 2.151 1.00 0.00 O ATOM 898 CB TYR A 60 7.019 13.822 1.588 1.00 0.00 C ATOM 899 CG TYR A 60 8.150 14.819 1.713 1.00 0.00 C ATOM 900 CD1 TYR A 60 7.914 16.110 2.169 1.00 0.00 C ATOM 901 CD2 TYR A 60 9.451 14.470 1.375 1.00 0.00 C ATOM 902 CE1 TYR A 60 8.944 17.025 2.284 1.00 0.00 C ATOM 903 CE2 TYR A 60 10.486 15.378 1.488 1.00 0.00 C ATOM 904 CZ TYR A 60 10.228 16.654 1.943 1.00 0.00 C ATOM 905 OH TYR A 60 11.256 17.561 2.057 1.00 0.00 O ATOM 0 H TYR A 60 7.549 12.332 3.589 1.00 0.00 H new ATOM 0 HA TYR A 60 5.896 14.713 3.188 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.435 12.841 1.356 1.00 0.00 H new ATOM 0 HB3 TYR A 60 6.386 14.107 0.747 1.00 0.00 H new ATOM 0 HD1 TYR A 60 6.910 16.403 2.438 1.00 0.00 H new ATOM 0 HD2 TYR A 60 9.657 13.472 1.018 1.00 0.00 H new ATOM 0 HE1 TYR A 60 8.744 18.025 2.639 1.00 0.00 H new ATOM 0 HE2 TYR A 60 11.492 15.090 1.221 1.00 0.00 H new ATOM 0 HH TYR A 60 12.096 17.140 1.778 1.00 0.00 H new ATOM 915 N PHE A 61 4.902 11.643 2.681 1.00 0.00 N ATOM 916 CA PHE A 61 3.734 10.811 2.410 1.00 0.00 C ATOM 917 C PHE A 61 2.569 11.200 3.315 1.00 0.00 C ATOM 918 O PHE A 61 2.740 11.378 4.521 1.00 0.00 O ATOM 919 CB PHE A 61 4.078 9.334 2.608 1.00 0.00 C ATOM 920 CG PHE A 61 3.239 8.407 1.775 1.00 0.00 C ATOM 921 CD1 PHE A 61 1.868 8.335 1.964 1.00 0.00 C ATOM 922 CD2 PHE A 61 3.821 7.608 0.805 1.00 0.00 C ATOM 923 CE1 PHE A 61 1.094 7.484 1.198 1.00 0.00 C ATOM 924 CE2 PHE A 61 3.052 6.754 0.037 1.00 0.00 C ATOM 925 CZ PHE A 61 1.687 6.692 0.234 1.00 0.00 C ATOM 0 H PHE A 61 5.725 11.127 2.992 1.00 0.00 H new ATOM 0 HA PHE A 61 3.436 10.971 1.374 1.00 0.00 H new ATOM 0 HB2 PHE A 61 5.129 9.178 2.364 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.953 9.078 3.660 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.399 8.950 2.718 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.888 7.653 0.647 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.026 7.438 1.353 1.00 0.00 H new ATOM 0 HE2 PHE A 61 3.518 6.136 -0.716 1.00 0.00 H new ATOM 0 HZ PHE A 61 1.084 6.025 -0.365 1.00 0.00 H new ATOM 935 N SER A 62 1.387 11.331 2.724 1.00 0.00 N ATOM 936 CA SER A 62 0.193 11.699 3.477 1.00 0.00 C ATOM 937 C SER A 62 -0.677 10.476 3.750 1.00 0.00 C ATOM 938 O SER A 62 -0.783 10.019 4.887 1.00 0.00 O ATOM 939 CB SER A 62 -0.610 12.754 2.715 1.00 0.00 C ATOM 940 OG SER A 62 -1.060 13.779 3.584 1.00 0.00 O ATOM 0 H SER A 62 1.229 11.188 1.726 1.00 0.00 H new ATOM 0 HA SER A 62 0.510 12.116 4.433 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.007 13.186 1.927 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.465 12.284 2.229 1.00 0.00 H new ATOM 0 HG SER A 62 -0.339 14.428 3.726 1.00 0.00 H new ATOM 946 N ASP A 63 -1.298 9.950 2.699 1.00 0.00 N ATOM 947 CA ASP A 63 -2.160 8.780 2.827 1.00 0.00 C ATOM 948 C ASP A 63 -2.384 8.118 1.472 1.00 0.00 C ATOM 949 O ASP A 63 -1.749 8.478 0.480 1.00 0.00 O ATOM 950 CB ASP A 63 -3.503 9.176 3.444 1.00 0.00 C ATOM 951 CG ASP A 63 -4.021 8.136 4.417 1.00 0.00 C ATOM 952 OD1 ASP A 63 -4.131 6.956 4.022 1.00 0.00 O ATOM 953 OD2 ASP A 63 -4.316 8.499 5.574 1.00 0.00 O ATOM 0 H ASP A 63 -1.221 10.315 1.750 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.664 8.064 3.482 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -3.396 10.130 3.960 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.235 9.323 2.650 1.00 0.00 H new ATOM 958 N CYS A 64 -3.292 7.148 1.436 1.00 0.00 N ATOM 959 CA CYS A 64 -3.600 6.434 0.203 1.00 0.00 C ATOM 960 C CYS A 64 -5.085 6.537 -0.127 1.00 0.00 C ATOM 961 O CYS A 64 -5.869 7.077 0.654 1.00 0.00 O ATOM 962 CB CYS A 64 -3.194 4.964 0.323 1.00 0.00 C ATOM 963 SG CYS A 64 -3.989 4.089 1.690 1.00 0.00 S ATOM 0 H CYS A 64 -3.827 6.839 2.247 1.00 0.00 H new ATOM 0 HA CYS A 64 -3.032 6.895 -0.605 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -3.435 4.454 -0.610 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -2.113 4.906 0.448 1.00 0.00 H new ATOM 0 HG CYS A 64 -4.318 2.892 1.306 1.00 0.00 H new ATOM 969 N GLN A 65 -5.466 6.013 -1.288 1.00 0.00 N ATOM 970 CA GLN A 65 -6.858 6.045 -1.720 1.00 0.00 C ATOM 971 C GLN A 65 -7.218 4.774 -2.481 1.00 0.00 C ATOM 972 O GLN A 65 -6.905 4.637 -3.665 1.00 0.00 O ATOM 973 CB GLN A 65 -7.114 7.269 -2.600 1.00 0.00 C ATOM 974 CG GLN A 65 -8.576 7.685 -2.651 1.00 0.00 C ATOM 975 CD GLN A 65 -8.790 8.961 -3.442 1.00 0.00 C ATOM 976 OE1 GLN A 65 -8.266 10.018 -3.093 1.00 0.00 O ATOM 977 NE2 GLN A 65 -9.566 8.868 -4.517 1.00 0.00 N ATOM 0 H GLN A 65 -4.830 5.562 -1.946 1.00 0.00 H new ATOM 0 HA GLN A 65 -7.487 6.108 -0.832 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -6.520 8.104 -2.229 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -6.769 7.057 -3.612 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -9.163 6.882 -3.097 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -8.946 7.825 -1.635 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -9.981 7.971 -4.771 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -9.747 9.693 -5.088 1.00 0.00 H new ATOM 986 N VAL A 66 -7.879 3.846 -1.796 1.00 0.00 N ATOM 987 CA VAL A 66 -8.282 2.588 -2.409 1.00 0.00 C ATOM 988 C VAL A 66 -9.421 2.803 -3.401 1.00 0.00 C ATOM 989 O VAL A 66 -10.570 3.017 -3.009 1.00 0.00 O ATOM 990 CB VAL A 66 -8.720 1.560 -1.346 1.00 0.00 C ATOM 991 CG1 VAL A 66 -9.895 2.090 -0.538 1.00 0.00 C ATOM 992 CG2 VAL A 66 -9.067 0.228 -1.995 1.00 0.00 C ATOM 0 H VAL A 66 -8.146 3.943 -0.816 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.413 2.198 -2.939 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.885 1.397 -0.665 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.188 1.350 0.206 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.605 3.013 -0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -10.735 2.287 -1.204 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -9.373 -0.482 -1.227 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.883 0.370 -2.704 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -8.194 -0.159 -2.520 1.00 0.00 H new ATOM 1002 N LEU A 67 -9.097 2.749 -4.688 1.00 0.00 N ATOM 1003 CA LEU A 67 -10.091 2.939 -5.736 1.00 0.00 C ATOM 1004 C LEU A 67 -11.031 1.740 -5.819 1.00 0.00 C ATOM 1005 O LEU A 67 -12.245 1.880 -5.678 1.00 0.00 O ATOM 1006 CB LEU A 67 -9.404 3.158 -7.085 1.00 0.00 C ATOM 1007 CG LEU A 67 -8.219 4.123 -7.059 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -7.652 4.308 -8.458 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -8.635 5.461 -6.468 1.00 0.00 C ATOM 0 H LEU A 67 -8.152 2.575 -5.030 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.680 3.822 -5.488 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -9.060 2.194 -7.461 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -10.142 3.532 -7.795 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.440 3.696 -6.427 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.809 4.998 -8.421 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -7.316 3.346 -8.845 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -8.424 4.713 -9.113 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.779 6.136 -6.457 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.431 5.894 -7.073 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.993 5.313 -5.449 1.00 0.00 H new ATOM 1021 N ALA A 68 -10.459 0.563 -6.051 1.00 0.00 N ATOM 1022 CA ALA A 68 -11.246 -0.660 -6.154 1.00 0.00 C ATOM 1023 C ALA A 68 -10.346 -1.879 -6.324 1.00 0.00 C ATOM 1024 O ALA A 68 -9.120 -1.766 -6.310 1.00 0.00 O ATOM 1025 CB ALA A 68 -12.227 -0.560 -7.313 1.00 0.00 C ATOM 0 H ALA A 68 -9.455 0.430 -6.171 1.00 0.00 H new ATOM 0 HA ALA A 68 -11.807 -0.781 -5.227 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -12.808 -1.480 -7.378 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.899 0.283 -7.149 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -11.678 -0.411 -8.243 1.00 0.00 H new ATOM 1031 N PHE A 69 -10.963 -3.045 -6.485 1.00 0.00 N ATOM 1032 CA PHE A 69 -10.218 -4.288 -6.658 1.00 0.00 C ATOM 1033 C PHE A 69 -10.465 -4.883 -8.040 1.00 0.00 C ATOM 1034 O PHE A 69 -11.608 -5.008 -8.479 1.00 0.00 O ATOM 1035 CB PHE A 69 -10.614 -5.297 -5.578 1.00 0.00 C ATOM 1036 CG PHE A 69 -10.369 -4.809 -4.179 1.00 0.00 C ATOM 1037 CD1 PHE A 69 -9.080 -4.585 -3.724 1.00 0.00 C ATOM 1038 CD2 PHE A 69 -11.430 -4.573 -3.319 1.00 0.00 C ATOM 1039 CE1 PHE A 69 -8.852 -4.135 -2.438 1.00 0.00 C ATOM 1040 CE2 PHE A 69 -11.208 -4.124 -2.031 1.00 0.00 C ATOM 1041 CZ PHE A 69 -9.917 -3.904 -1.590 1.00 0.00 C ATOM 0 H PHE A 69 -11.977 -3.156 -6.499 1.00 0.00 H new ATOM 0 HA PHE A 69 -9.156 -4.062 -6.564 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -11.671 -5.539 -5.689 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.057 -6.221 -5.734 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.243 -4.764 -4.383 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -12.441 -4.742 -3.659 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -7.842 -3.964 -2.096 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -12.043 -3.945 -1.370 1.00 0.00 H new ATOM 0 HZ PHE A 69 -9.741 -3.552 -0.584 1.00 0.00 H new ATOM 1051 N ARG A 70 -9.384 -5.252 -8.721 1.00 0.00 N ATOM 1052 CA ARG A 70 -9.483 -5.837 -10.053 1.00 0.00 C ATOM 1053 C ARG A 70 -9.873 -7.309 -9.971 1.00 0.00 C ATOM 1054 O ARG A 70 -9.666 -7.959 -8.947 1.00 0.00 O ATOM 1055 CB ARG A 70 -8.154 -5.690 -10.797 1.00 0.00 C ATOM 1056 CG ARG A 70 -7.557 -4.295 -10.707 1.00 0.00 C ATOM 1057 CD ARG A 70 -8.302 -3.311 -11.592 1.00 0.00 C ATOM 1058 NE ARG A 70 -8.180 -3.647 -13.010 1.00 0.00 N ATOM 1059 CZ ARG A 70 -8.432 -2.793 -13.998 1.00 0.00 C ATOM 1060 NH1 ARG A 70 -8.817 -1.551 -13.730 1.00 0.00 N ATOM 1061 NH2 ARG A 70 -8.298 -3.179 -15.259 1.00 0.00 N ATOM 0 H ARG A 70 -8.430 -5.156 -8.372 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.259 -5.303 -10.602 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -7.440 -6.408 -10.394 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -8.304 -5.945 -11.846 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -7.588 -3.951 -9.673 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -6.508 -4.328 -11.001 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -9.355 -3.298 -11.312 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -7.914 -2.306 -11.423 1.00 0.00 H new ATOM 0 HE ARG A 70 -7.884 -4.592 -13.256 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -8.921 -1.247 -12.762 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -9.009 -0.901 -14.492 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -8.002 -4.131 -15.472 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -8.491 -2.524 -16.016 1.00 0.00 H new ATOM 1075 N SER A 71 -10.438 -7.827 -11.056 1.00 0.00 N ATOM 1076 CA SER A 71 -10.857 -9.223 -11.107 1.00 0.00 C ATOM 1077 C SER A 71 -9.751 -10.105 -11.679 1.00 0.00 C ATOM 1078 O SER A 71 -9.008 -9.688 -12.567 1.00 0.00 O ATOM 1079 CB SER A 71 -12.126 -9.365 -11.950 1.00 0.00 C ATOM 1080 OG SER A 71 -12.512 -10.723 -12.068 1.00 0.00 O ATOM 0 H SER A 71 -10.616 -7.301 -11.912 1.00 0.00 H new ATOM 0 HA SER A 71 -11.066 -9.550 -10.089 1.00 0.00 H new ATOM 0 HB2 SER A 71 -12.934 -8.792 -11.495 1.00 0.00 H new ATOM 0 HB3 SER A 71 -11.956 -8.945 -12.941 1.00 0.00 H new ATOM 0 HG SER A 71 -13.326 -10.786 -12.610 1.00 0.00 H new ATOM 1086 N VAL A 72 -9.651 -11.326 -11.165 1.00 0.00 N ATOM 1087 CA VAL A 72 -8.638 -12.269 -11.624 1.00 0.00 C ATOM 1088 C VAL A 72 -9.263 -13.613 -11.983 1.00 0.00 C ATOM 1089 O VAL A 72 -9.235 -14.554 -11.190 1.00 0.00 O ATOM 1090 CB VAL A 72 -7.550 -12.489 -10.558 1.00 0.00 C ATOM 1091 CG1 VAL A 72 -6.619 -11.289 -10.487 1.00 0.00 C ATOM 1092 CG2 VAL A 72 -8.179 -12.766 -9.201 1.00 0.00 C ATOM 0 H VAL A 72 -10.260 -11.686 -10.430 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.180 -11.834 -12.513 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.960 -13.360 -10.844 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -5.857 -11.464 -9.728 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -6.140 -11.143 -11.455 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.192 -10.399 -10.227 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.394 -12.919 -8.460 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -8.796 -11.917 -8.906 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -8.799 -13.661 -9.263 1.00 0.00 H new ATOM 1102 N SER A 73 -9.827 -13.695 -13.184 1.00 0.00 N ATOM 1103 CA SER A 73 -10.461 -14.924 -13.650 1.00 0.00 C ATOM 1104 C SER A 73 -9.437 -16.042 -13.824 1.00 0.00 C ATOM 1105 O SER A 73 -9.790 -17.221 -13.836 1.00 0.00 O ATOM 1106 CB SER A 73 -11.189 -14.674 -14.972 1.00 0.00 C ATOM 1107 OG SER A 73 -12.102 -13.597 -14.857 1.00 0.00 O ATOM 0 H SER A 73 -9.858 -12.925 -13.852 1.00 0.00 H new ATOM 0 HA SER A 73 -11.182 -15.237 -12.895 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.463 -14.457 -15.755 1.00 0.00 H new ATOM 0 HB3 SER A 73 -11.722 -15.576 -15.273 1.00 0.00 H new ATOM 0 HG SER A 73 -12.553 -13.457 -15.716 1.00 0.00 H new ATOM 1112 N ASN A 74 -8.166 -15.669 -13.962 1.00 0.00 N ATOM 1113 CA ASN A 74 -7.095 -16.644 -14.137 1.00 0.00 C ATOM 1114 C ASN A 74 -7.118 -17.692 -13.027 1.00 0.00 C ATOM 1115 O ASN A 74 -7.197 -18.891 -13.294 1.00 0.00 O ATOM 1116 CB ASN A 74 -5.737 -15.941 -14.161 1.00 0.00 C ATOM 1117 CG ASN A 74 -4.777 -16.569 -15.151 1.00 0.00 C ATOM 1118 OD1 ASN A 74 -4.800 -16.255 -16.341 1.00 0.00 O ATOM 1119 ND2 ASN A 74 -3.926 -17.464 -14.663 1.00 0.00 N ATOM 0 H ASN A 74 -7.854 -14.698 -13.956 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.254 -17.150 -15.089 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -5.880 -14.890 -14.414 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -5.298 -15.972 -13.164 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -3.256 -17.921 -15.282 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -3.942 -17.694 -13.669 1.00 0.00 H new ATOM 1126 N ASN A 75 -7.046 -17.231 -11.783 1.00 0.00 N ATOM 1127 CA ASN A 75 -7.056 -18.130 -10.633 1.00 0.00 C ATOM 1128 C ASN A 75 -8.360 -18.005 -9.849 1.00 0.00 C ATOM 1129 O ASN A 75 -8.767 -18.937 -9.155 1.00 0.00 O ATOM 1130 CB ASN A 75 -5.867 -17.832 -9.717 1.00 0.00 C ATOM 1131 CG ASN A 75 -5.428 -19.048 -8.927 1.00 0.00 C ATOM 1132 OD1 ASN A 75 -5.420 -20.168 -9.440 1.00 0.00 O ATOM 1133 ND2 ASN A 75 -5.059 -18.835 -7.668 1.00 0.00 N ATOM 0 H ASN A 75 -6.980 -16.241 -11.545 1.00 0.00 H new ATOM 0 HA ASN A 75 -6.976 -19.152 -11.004 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -5.032 -17.470 -10.317 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -6.135 -17.031 -9.028 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.754 -19.616 -7.087 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -5.081 -17.891 -7.283 1.00 0.00 H new ATOM 1140 N ASN A 76 -9.008 -16.850 -9.961 1.00 0.00 N ATOM 1141 CA ASN A 76 -10.265 -16.607 -9.258 1.00 0.00 C ATOM 1142 C ASN A 76 -10.074 -16.695 -7.746 1.00 0.00 C ATOM 1143 O ASN A 76 -11.035 -16.890 -7.002 1.00 0.00 O ATOM 1144 CB ASN A 76 -11.328 -17.610 -9.710 1.00 0.00 C ATOM 1145 CG ASN A 76 -11.906 -17.268 -11.069 1.00 0.00 C ATOM 1146 OD1 ASN A 76 -12.514 -16.092 -11.175 1.00 0.00 O flip ATOM 1147 ND2 ASN A 76 -11.807 -18.052 -12.014 1.00 0.00 N flip ATOM 0 H ASN A 76 -8.685 -16.068 -10.531 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.598 -15.599 -9.503 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -10.890 -18.608 -9.745 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -12.131 -17.640 -8.974 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -11.331 -18.945 -11.888 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -12.201 -17.808 -12.923 1.00 0.00 H new ATOM 1154 N ASN A 77 -8.830 -16.550 -7.297 1.00 0.00 N ATOM 1155 CA ASN A 77 -8.517 -16.613 -5.874 1.00 0.00 C ATOM 1156 C ASN A 77 -7.842 -15.326 -5.408 1.00 0.00 C ATOM 1157 O ASN A 77 -8.064 -14.869 -4.286 1.00 0.00 O ATOM 1158 CB ASN A 77 -7.613 -17.812 -5.582 1.00 0.00 C ATOM 1159 CG ASN A 77 -7.482 -18.091 -4.097 1.00 0.00 C ATOM 1160 OD1 ASN A 77 -6.403 -17.961 -3.522 1.00 0.00 O ATOM 1161 ND2 ASN A 77 -8.587 -18.477 -3.469 1.00 0.00 N ATOM 0 H ASN A 77 -8.023 -16.388 -7.899 1.00 0.00 H new ATOM 0 HA ASN A 77 -9.452 -16.730 -5.326 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -8.013 -18.695 -6.081 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -6.624 -17.629 -6.003 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -8.562 -18.679 -2.469 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -9.461 -18.572 -3.986 1.00 0.00 H new ATOM 1168 N HIS A 78 -7.019 -14.745 -6.274 1.00 0.00 N ATOM 1169 CA HIS A 78 -6.315 -13.510 -5.947 1.00 0.00 C ATOM 1170 C HIS A 78 -7.230 -12.303 -6.123 1.00 0.00 C ATOM 1171 O HIS A 78 -8.400 -12.445 -6.480 1.00 0.00 O ATOM 1172 CB HIS A 78 -5.074 -13.357 -6.827 1.00 0.00 C ATOM 1173 CG HIS A 78 -4.233 -14.594 -6.900 1.00 0.00 C ATOM 1174 ND1 HIS A 78 -3.418 -14.889 -7.972 1.00 0.00 N ATOM 1175 CD2 HIS A 78 -4.083 -15.615 -6.022 1.00 0.00 C ATOM 1176 CE1 HIS A 78 -2.804 -16.038 -7.752 1.00 0.00 C ATOM 1177 NE2 HIS A 78 -3.189 -16.499 -6.578 1.00 0.00 N ATOM 0 H HIS A 78 -6.823 -15.109 -7.207 1.00 0.00 H new ATOM 0 HA HIS A 78 -6.006 -13.561 -4.903 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -5.385 -13.080 -7.834 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -4.466 -12.537 -6.444 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.574 -15.715 -5.065 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.105 -16.518 -8.421 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -2.874 -17.370 -6.151 1.00 0.00 H new ATOM 1186 N THR A 79 -6.690 -11.116 -5.871 1.00 0.00 N ATOM 1187 CA THR A 79 -7.459 -9.883 -6.003 1.00 0.00 C ATOM 1188 C THR A 79 -6.546 -8.707 -6.330 1.00 0.00 C ATOM 1189 O THR A 79 -5.723 -8.300 -5.509 1.00 0.00 O ATOM 1190 CB THR A 79 -8.236 -9.601 -4.716 1.00 0.00 C ATOM 1191 OG1 THR A 79 -9.112 -10.673 -4.414 1.00 0.00 O ATOM 1192 CG2 THR A 79 -9.066 -8.336 -4.780 1.00 0.00 C ATOM 0 H THR A 79 -5.724 -10.981 -5.574 1.00 0.00 H new ATOM 0 HA THR A 79 -8.166 -10.010 -6.823 1.00 0.00 H new ATOM 0 HB THR A 79 -7.477 -9.479 -3.943 1.00 0.00 H new ATOM 0 HG1 THR A 79 -8.603 -11.409 -4.015 1.00 0.00 H new ATOM 0 HG21 THR A 79 -9.591 -8.197 -3.835 1.00 0.00 H new ATOM 0 HG22 THR A 79 -8.414 -7.482 -4.962 1.00 0.00 H new ATOM 0 HG23 THR A 79 -9.792 -8.418 -5.589 1.00 0.00 H new ATOM 1200 N GLY A 80 -6.695 -8.165 -7.535 1.00 0.00 N ATOM 1201 CA GLY A 80 -5.876 -7.043 -7.948 1.00 0.00 C ATOM 1202 C GLY A 80 -6.172 -5.786 -7.155 1.00 0.00 C ATOM 1203 O GLY A 80 -7.285 -5.263 -7.199 1.00 0.00 O ATOM 0 H GLY A 80 -7.368 -8.484 -8.232 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -4.824 -7.303 -7.832 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.041 -6.848 -9.008 1.00 0.00 H new ATOM 1207 N VAL A 81 -5.173 -5.300 -6.425 1.00 0.00 N ATOM 1208 CA VAL A 81 -5.332 -4.097 -5.618 1.00 0.00 C ATOM 1209 C VAL A 81 -5.197 -2.842 -6.473 1.00 0.00 C ATOM 1210 O VAL A 81 -4.303 -2.744 -7.314 1.00 0.00 O ATOM 1211 CB VAL A 81 -4.297 -4.047 -4.476 1.00 0.00 C ATOM 1212 CG1 VAL A 81 -4.496 -2.804 -3.619 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -4.381 -5.306 -3.627 1.00 0.00 C ATOM 0 H VAL A 81 -4.245 -5.721 -6.376 1.00 0.00 H new ATOM 0 HA VAL A 81 -6.333 -4.132 -5.187 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.302 -3.996 -4.918 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -3.755 -2.790 -2.820 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -4.380 -1.914 -4.237 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -5.496 -2.817 -3.186 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -3.644 -5.254 -2.826 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.379 -5.389 -3.197 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.180 -6.178 -4.249 1.00 0.00 H new ATOM 1223 N ASP A 82 -6.088 -1.883 -6.249 1.00 0.00 N ATOM 1224 CA ASP A 82 -6.070 -0.630 -6.994 1.00 0.00 C ATOM 1225 C ASP A 82 -6.087 0.560 -6.041 1.00 0.00 C ATOM 1226 O ASP A 82 -7.105 1.235 -5.891 1.00 0.00 O ATOM 1227 CB ASP A 82 -7.267 -0.559 -7.945 1.00 0.00 C ATOM 1228 CG ASP A 82 -6.941 0.177 -9.230 1.00 0.00 C ATOM 1229 OD1 ASP A 82 -6.854 1.422 -9.196 1.00 0.00 O ATOM 1230 OD2 ASP A 82 -6.774 -0.493 -10.271 1.00 0.00 O ATOM 0 H ASP A 82 -6.833 -1.950 -5.556 1.00 0.00 H new ATOM 0 HA ASP A 82 -5.152 -0.593 -7.580 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.599 -1.570 -8.183 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -8.097 -0.060 -7.444 1.00 0.00 H new ATOM 1235 N SER A 83 -4.951 0.807 -5.396 1.00 0.00 N ATOM 1236 CA SER A 83 -4.832 1.910 -4.452 1.00 0.00 C ATOM 1237 C SER A 83 -4.192 3.127 -5.112 1.00 0.00 C ATOM 1238 O SER A 83 -3.787 3.074 -6.274 1.00 0.00 O ATOM 1239 CB SER A 83 -4.009 1.478 -3.237 1.00 0.00 C ATOM 1240 OG SER A 83 -3.055 0.492 -3.592 1.00 0.00 O ATOM 0 H SER A 83 -4.100 0.257 -5.511 1.00 0.00 H new ATOM 0 HA SER A 83 -5.834 2.186 -4.124 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.501 2.343 -2.811 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.672 1.086 -2.465 1.00 0.00 H new ATOM 0 HG SER A 83 -3.305 -0.365 -3.189 1.00 0.00 H new ATOM 1246 N LEU A 84 -4.106 4.222 -4.365 1.00 0.00 N ATOM 1247 CA LEU A 84 -3.518 5.454 -4.879 1.00 0.00 C ATOM 1248 C LEU A 84 -2.538 6.052 -3.874 1.00 0.00 C ATOM 1249 O LEU A 84 -2.943 6.603 -2.850 1.00 0.00 O ATOM 1250 CB LEU A 84 -4.617 6.469 -5.201 1.00 0.00 C ATOM 1251 CG LEU A 84 -4.226 7.553 -6.207 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -3.201 8.502 -5.603 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -3.690 6.925 -7.485 1.00 0.00 C ATOM 0 H LEU A 84 -4.436 4.282 -3.402 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.972 5.214 -5.791 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.484 5.932 -5.587 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.928 6.951 -4.274 1.00 0.00 H new ATOM 0 HG LEU A 84 -5.117 8.129 -6.455 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.936 9.265 -6.335 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.623 8.978 -4.718 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -2.308 7.943 -5.323 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -3.417 7.711 -8.190 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.811 6.323 -7.254 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -4.458 6.291 -7.929 1.00 0.00 H new ATOM 1265 N CYS A 85 -1.246 5.944 -4.174 1.00 0.00 N ATOM 1266 CA CYS A 85 -0.212 6.480 -3.298 1.00 0.00 C ATOM 1267 C CYS A 85 -0.301 8.002 -3.231 1.00 0.00 C ATOM 1268 O CYS A 85 0.468 8.708 -3.884 1.00 0.00 O ATOM 1269 CB CYS A 85 1.177 6.059 -3.788 1.00 0.00 C ATOM 1270 SG CYS A 85 1.581 4.329 -3.462 1.00 0.00 S ATOM 0 H CYS A 85 -0.892 5.490 -5.016 1.00 0.00 H new ATOM 0 HA CYS A 85 -0.370 6.076 -2.298 1.00 0.00 H new ATOM 0 HB2 CYS A 85 1.242 6.240 -4.861 1.00 0.00 H new ATOM 0 HB3 CYS A 85 1.926 6.692 -3.312 1.00 0.00 H new ATOM 0 HG CYS A 85 2.226 3.835 -4.477 1.00 0.00 H new ATOM 1276 N ASN A 86 -1.248 8.501 -2.443 1.00 0.00 N ATOM 1277 CA ASN A 86 -1.443 9.939 -2.298 1.00 0.00 C ATOM 1278 C ASN A 86 -0.360 10.553 -1.417 1.00 0.00 C ATOM 1279 O ASN A 86 0.032 9.976 -0.403 1.00 0.00 O ATOM 1280 CB ASN A 86 -2.823 10.229 -1.703 1.00 0.00 C ATOM 1281 CG ASN A 86 -3.899 10.342 -2.765 1.00 0.00 C ATOM 1282 OD1 ASN A 86 -4.055 11.386 -3.400 1.00 0.00 O ATOM 1283 ND2 ASN A 86 -4.650 9.264 -2.964 1.00 0.00 N ATOM 0 H ASN A 86 -1.892 7.931 -1.895 1.00 0.00 H new ATOM 0 HA ASN A 86 -1.377 10.389 -3.289 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -3.088 9.436 -1.004 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.782 11.156 -1.132 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -5.390 9.281 -3.665 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -4.486 8.420 -2.415 1.00 0.00 H new ATOM 1290 N PHE A 87 0.119 11.728 -1.812 1.00 0.00 N ATOM 1291 CA PHE A 87 1.156 12.424 -1.058 1.00 0.00 C ATOM 1292 C PHE A 87 0.670 13.798 -0.606 1.00 0.00 C ATOM 1293 O PHE A 87 -0.420 14.233 -0.976 1.00 0.00 O ATOM 1294 CB PHE A 87 2.421 12.569 -1.906 1.00 0.00 C ATOM 1295 CG PHE A 87 3.358 11.401 -1.788 1.00 0.00 C ATOM 1296 CD1 PHE A 87 2.969 10.139 -2.209 1.00 0.00 C ATOM 1297 CD2 PHE A 87 4.627 11.565 -1.257 1.00 0.00 C ATOM 1298 CE1 PHE A 87 3.828 9.062 -2.102 1.00 0.00 C ATOM 1299 CE2 PHE A 87 5.490 10.492 -1.147 1.00 0.00 C ATOM 1300 CZ PHE A 87 5.092 9.239 -1.570 1.00 0.00 C ATOM 0 H PHE A 87 -0.194 12.218 -2.650 1.00 0.00 H new ATOM 0 HA PHE A 87 1.387 11.832 -0.173 1.00 0.00 H new ATOM 0 HB2 PHE A 87 2.136 12.692 -2.951 1.00 0.00 H new ATOM 0 HB3 PHE A 87 2.946 13.477 -1.609 1.00 0.00 H new ATOM 0 HD1 PHE A 87 1.983 9.996 -2.626 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.945 12.542 -0.925 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.513 8.084 -2.433 1.00 0.00 H new ATOM 0 HE2 PHE A 87 6.476 10.633 -0.730 1.00 0.00 H new ATOM 0 HZ PHE A 87 5.766 8.400 -1.485 1.00 0.00 H new ATOM 1310 N SER A 88 1.486 14.475 0.194 1.00 0.00 N ATOM 1311 CA SER A 88 1.139 15.799 0.696 1.00 0.00 C ATOM 1312 C SER A 88 1.747 16.891 -0.181 1.00 0.00 C ATOM 1313 O SER A 88 2.635 16.623 -0.991 1.00 0.00 O ATOM 1314 CB SER A 88 1.616 15.962 2.141 1.00 0.00 C ATOM 1315 OG SER A 88 0.569 15.697 3.058 1.00 0.00 O ATOM 0 H SER A 88 2.392 14.129 0.509 1.00 0.00 H new ATOM 0 HA SER A 88 0.054 15.898 0.667 1.00 0.00 H new ATOM 0 HB2 SER A 88 2.449 15.285 2.330 1.00 0.00 H new ATOM 0 HB3 SER A 88 1.988 16.975 2.292 1.00 0.00 H new ATOM 0 HG SER A 88 0.901 15.806 3.974 1.00 0.00 H new ATOM 1321 N PRO A 89 1.278 18.141 -0.030 1.00 0.00 N ATOM 1322 CA PRO A 89 1.784 19.274 -0.812 1.00 0.00 C ATOM 1323 C PRO A 89 3.254 19.561 -0.529 1.00 0.00 C ATOM 1324 O PRO A 89 3.972 20.081 -1.383 1.00 0.00 O ATOM 1325 CB PRO A 89 0.912 20.450 -0.358 1.00 0.00 C ATOM 1326 CG PRO A 89 0.378 20.042 0.973 1.00 0.00 C ATOM 1327 CD PRO A 89 0.223 18.550 0.914 1.00 0.00 C ATOM 0 HA PRO A 89 1.731 19.081 -1.883 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.495 21.368 -0.285 1.00 0.00 H new ATOM 0 HB3 PRO A 89 0.105 20.640 -1.066 1.00 0.00 H new ATOM 0 HG2 PRO A 89 1.059 20.333 1.773 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -0.577 20.526 1.176 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.359 18.092 1.894 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.767 18.261 0.562 1.00 0.00 H new ATOM 1335 N LEU A 90 3.696 19.219 0.677 1.00 0.00 N ATOM 1336 CA LEU A 90 5.082 19.439 1.074 1.00 0.00 C ATOM 1337 C LEU A 90 6.026 18.554 0.266 1.00 0.00 C ATOM 1338 O LEU A 90 7.186 18.906 0.047 1.00 0.00 O ATOM 1339 CB LEU A 90 5.256 19.160 2.567 1.00 0.00 C ATOM 1340 CG LEU A 90 4.836 20.304 3.493 1.00 0.00 C ATOM 1341 CD1 LEU A 90 3.341 20.250 3.762 1.00 0.00 C ATOM 1342 CD2 LEU A 90 5.617 20.247 4.797 1.00 0.00 C ATOM 0 H LEU A 90 3.115 18.789 1.396 1.00 0.00 H new ATOM 0 HA LEU A 90 5.330 20.481 0.875 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.678 18.273 2.825 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.303 18.924 2.757 1.00 0.00 H new ATOM 0 HG LEU A 90 5.061 21.249 2.999 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.060 21.071 4.422 1.00 0.00 H new ATOM 0 HD12 LEU A 90 2.799 20.339 2.821 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.091 19.301 4.236 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.306 21.068 5.444 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.423 19.298 5.296 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.683 20.335 4.587 1.00 0.00 H new ATOM 1354 N ALA A 91 5.524 17.405 -0.175 1.00 0.00 N ATOM 1355 CA ALA A 91 6.324 16.470 -0.958 1.00 0.00 C ATOM 1356 C ALA A 91 6.876 17.135 -2.215 1.00 0.00 C ATOM 1357 O ALA A 91 6.325 18.124 -2.700 1.00 0.00 O ATOM 1358 CB ALA A 91 5.495 15.249 -1.327 1.00 0.00 C ATOM 0 H ALA A 91 4.566 17.099 -0.003 1.00 0.00 H new ATOM 0 HA ALA A 91 7.169 16.153 -0.346 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.104 14.559 -1.911 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.154 14.752 -0.418 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.632 15.560 -1.916 1.00 0.00 H new ATOM 1364 N ARG A 92 7.968 16.586 -2.737 1.00 0.00 N ATOM 1365 CA ARG A 92 8.595 17.128 -3.936 1.00 0.00 C ATOM 1366 C ARG A 92 9.603 16.141 -4.517 1.00 0.00 C ATOM 1367 O ARG A 92 10.478 15.643 -3.809 1.00 0.00 O ATOM 1368 CB ARG A 92 9.286 18.457 -3.620 1.00 0.00 C ATOM 1369 CG ARG A 92 9.013 19.543 -4.648 1.00 0.00 C ATOM 1370 CD ARG A 92 8.157 20.659 -4.069 1.00 0.00 C ATOM 1371 NE ARG A 92 7.243 21.220 -5.061 1.00 0.00 N ATOM 1372 CZ ARG A 92 6.189 20.571 -5.549 1.00 0.00 C ATOM 1373 NH1 ARG A 92 5.911 19.339 -5.138 1.00 0.00 N ATOM 1374 NH2 ARG A 92 5.409 21.154 -6.449 1.00 0.00 N ATOM 0 H ARG A 92 8.436 15.767 -2.349 1.00 0.00 H new ATOM 0 HA ARG A 92 7.815 17.300 -4.678 1.00 0.00 H new ATOM 0 HB2 ARG A 92 8.957 18.804 -2.641 1.00 0.00 H new ATOM 0 HB3 ARG A 92 10.361 18.292 -3.555 1.00 0.00 H new ATOM 0 HG2 ARG A 92 9.958 19.955 -5.003 1.00 0.00 H new ATOM 0 HG3 ARG A 92 8.510 19.109 -5.512 1.00 0.00 H new ATOM 0 HD2 ARG A 92 7.584 20.275 -3.225 1.00 0.00 H new ATOM 0 HD3 ARG A 92 8.803 21.448 -3.684 1.00 0.00 H new ATOM 0 HE ARG A 92 7.424 22.165 -5.400 1.00 0.00 H new ATOM 0 HH11 ARG A 92 6.507 18.886 -4.445 1.00 0.00 H new ATOM 0 HH12 ARG A 92 5.102 18.846 -5.515 1.00 0.00 H new ATOM 0 HH21 ARG A 92 5.617 22.100 -6.768 1.00 0.00 H new ATOM 0 HH22 ARG A 92 4.601 20.656 -6.823 1.00 0.00 H new ATOM 1388 N ARG A 93 9.474 15.864 -5.810 1.00 0.00 N ATOM 1389 CA ARG A 93 10.373 14.938 -6.488 1.00 0.00 C ATOM 1390 C ARG A 93 10.278 13.540 -5.881 1.00 0.00 C ATOM 1391 O ARG A 93 11.194 13.085 -5.196 1.00 0.00 O ATOM 1392 CB ARG A 93 11.814 15.448 -6.413 1.00 0.00 C ATOM 1393 CG ARG A 93 12.259 16.184 -7.665 1.00 0.00 C ATOM 1394 CD ARG A 93 12.077 17.686 -7.522 1.00 0.00 C ATOM 1395 NE ARG A 93 11.602 18.300 -8.760 1.00 0.00 N ATOM 1396 CZ ARG A 93 11.014 19.493 -8.819 1.00 0.00 C ATOM 1397 NH1 ARG A 93 10.829 20.206 -7.715 1.00 0.00 N ATOM 1398 NH2 ARG A 93 10.609 19.974 -9.986 1.00 0.00 N ATOM 0 H ARG A 93 8.755 16.268 -6.410 1.00 0.00 H new ATOM 0 HA ARG A 93 10.072 14.877 -7.534 1.00 0.00 H new ATOM 0 HB2 ARG A 93 11.912 16.113 -5.555 1.00 0.00 H new ATOM 0 HB3 ARG A 93 12.482 14.604 -6.240 1.00 0.00 H new ATOM 0 HG2 ARG A 93 13.307 15.961 -7.867 1.00 0.00 H new ATOM 0 HG3 ARG A 93 11.687 15.827 -8.521 1.00 0.00 H new ATOM 0 HD2 ARG A 93 11.367 17.891 -6.720 1.00 0.00 H new ATOM 0 HD3 ARG A 93 13.025 18.140 -7.232 1.00 0.00 H new ATOM 0 HE ARG A 93 11.728 17.784 -9.631 1.00 0.00 H new ATOM 0 HH11 ARG A 93 11.138 19.841 -6.814 1.00 0.00 H new ATOM 0 HH12 ARG A 93 10.378 21.119 -7.767 1.00 0.00 H new ATOM 0 HH21 ARG A 93 10.748 19.430 -10.838 1.00 0.00 H new ATOM 0 HH22 ARG A 93 10.158 20.888 -10.032 1.00 0.00 H new ATOM 1412 N VAL A 94 9.164 12.864 -6.141 1.00 0.00 N ATOM 1413 CA VAL A 94 8.948 11.518 -5.624 1.00 0.00 C ATOM 1414 C VAL A 94 8.653 10.541 -6.756 1.00 0.00 C ATOM 1415 O VAL A 94 7.545 10.513 -7.292 1.00 0.00 O ATOM 1416 CB VAL A 94 7.785 11.480 -4.614 1.00 0.00 C ATOM 1417 CG1 VAL A 94 7.678 10.105 -3.971 1.00 0.00 C ATOM 1418 CG2 VAL A 94 7.958 12.558 -3.555 1.00 0.00 C ATOM 0 H VAL A 94 8.397 13.226 -6.707 1.00 0.00 H new ATOM 0 HA VAL A 94 9.866 11.222 -5.117 1.00 0.00 H new ATOM 0 HB VAL A 94 6.858 11.678 -5.152 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.851 10.099 -3.261 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.500 9.356 -4.742 1.00 0.00 H new ATOM 0 HG13 VAL A 94 8.606 9.874 -3.449 1.00 0.00 H new ATOM 0 HG21 VAL A 94 7.126 12.514 -2.852 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.894 12.396 -3.021 1.00 0.00 H new ATOM 0 HG23 VAL A 94 7.978 13.538 -4.033 1.00 0.00 H new ATOM 1428 N ASP A 95 9.651 9.740 -7.117 1.00 0.00 N ATOM 1429 CA ASP A 95 9.495 8.762 -8.187 1.00 0.00 C ATOM 1430 C ASP A 95 8.557 7.636 -7.763 1.00 0.00 C ATOM 1431 O ASP A 95 8.450 7.318 -6.578 1.00 0.00 O ATOM 1432 CB ASP A 95 10.856 8.187 -8.582 1.00 0.00 C ATOM 1433 CG ASP A 95 11.814 9.253 -9.073 1.00 0.00 C ATOM 1434 OD1 ASP A 95 12.528 9.842 -8.234 1.00 0.00 O ATOM 1435 OD2 ASP A 95 11.850 9.501 -10.297 1.00 0.00 O ATOM 0 H ASP A 95 10.575 9.749 -6.685 1.00 0.00 H new ATOM 0 HA ASP A 95 9.058 9.268 -9.048 1.00 0.00 H new ATOM 0 HB2 ASP A 95 11.294 7.676 -7.725 1.00 0.00 H new ATOM 0 HB3 ASP A 95 10.718 7.439 -9.363 1.00 0.00 H new ATOM 1440 N ARG A 96 7.879 7.038 -8.736 1.00 0.00 N ATOM 1441 CA ARG A 96 6.952 5.947 -8.460 1.00 0.00 C ATOM 1442 C ARG A 96 7.693 4.729 -7.917 1.00 0.00 C ATOM 1443 O ARG A 96 7.151 3.963 -7.121 1.00 0.00 O ATOM 1444 CB ARG A 96 6.183 5.569 -9.728 1.00 0.00 C ATOM 1445 CG ARG A 96 7.063 5.447 -10.963 1.00 0.00 C ATOM 1446 CD ARG A 96 6.887 6.637 -11.893 1.00 0.00 C ATOM 1447 NE ARG A 96 5.962 6.346 -12.986 1.00 0.00 N ATOM 1448 CZ ARG A 96 5.897 7.054 -14.111 1.00 0.00 C ATOM 1449 NH1 ARG A 96 6.702 8.094 -14.298 1.00 0.00 N ATOM 1450 NH2 ARG A 96 5.028 6.720 -15.056 1.00 0.00 N ATOM 0 H ARG A 96 7.954 7.290 -9.722 1.00 0.00 H new ATOM 0 HA ARG A 96 6.245 6.287 -7.703 1.00 0.00 H new ATOM 0 HB2 ARG A 96 5.671 4.621 -9.563 1.00 0.00 H new ATOM 0 HB3 ARG A 96 5.414 6.319 -9.913 1.00 0.00 H new ATOM 0 HG2 ARG A 96 8.108 5.372 -10.661 1.00 0.00 H new ATOM 0 HG3 ARG A 96 6.818 4.528 -11.496 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.518 7.490 -11.324 1.00 0.00 H new ATOM 0 HD3 ARG A 96 7.855 6.922 -12.304 1.00 0.00 H new ATOM 0 HE ARG A 96 5.329 5.553 -12.881 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.375 8.354 -13.577 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.647 8.632 -15.163 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.409 5.920 -14.920 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.978 7.263 -15.918 1.00 0.00 H new ATOM 1464 N VAL A 97 8.937 4.557 -8.354 1.00 0.00 N ATOM 1465 CA VAL A 97 9.753 3.433 -7.912 1.00 0.00 C ATOM 1466 C VAL A 97 10.077 3.536 -6.424 1.00 0.00 C ATOM 1467 O VAL A 97 10.258 2.523 -5.748 1.00 0.00 O ATOM 1468 CB VAL A 97 11.070 3.346 -8.708 1.00 0.00 C ATOM 1469 CG1 VAL A 97 11.833 2.081 -8.346 1.00 0.00 C ATOM 1470 CG2 VAL A 97 10.796 3.400 -10.204 1.00 0.00 C ATOM 0 H VAL A 97 9.401 5.182 -9.013 1.00 0.00 H new ATOM 0 HA VAL A 97 9.168 2.531 -8.091 1.00 0.00 H new ATOM 0 HB VAL A 97 11.688 4.204 -8.443 1.00 0.00 H new ATOM 0 HG11 VAL A 97 12.759 2.038 -8.919 1.00 0.00 H new ATOM 0 HG12 VAL A 97 12.065 2.088 -7.281 1.00 0.00 H new ATOM 0 HG13 VAL A 97 11.222 1.209 -8.579 1.00 0.00 H new ATOM 0 HG21 VAL A 97 11.738 3.337 -10.749 1.00 0.00 H new ATOM 0 HG22 VAL A 97 10.157 2.564 -10.487 1.00 0.00 H new ATOM 0 HG23 VAL A 97 10.297 4.338 -10.449 1.00 0.00 H new ATOM 1480 N ALA A 98 10.149 4.764 -5.919 1.00 0.00 N ATOM 1481 CA ALA A 98 10.452 4.994 -4.512 1.00 0.00 C ATOM 1482 C ALA A 98 9.423 4.318 -3.613 1.00 0.00 C ATOM 1483 O ALA A 98 9.768 3.489 -2.771 1.00 0.00 O ATOM 1484 CB ALA A 98 10.514 6.485 -4.220 1.00 0.00 C ATOM 0 H ALA A 98 10.002 5.614 -6.463 1.00 0.00 H new ATOM 0 HA ALA A 98 11.427 4.555 -4.299 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.741 6.640 -3.165 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.293 6.943 -4.830 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.553 6.942 -4.455 1.00 0.00 H new ATOM 1490 N ILE A 99 8.155 4.674 -3.799 1.00 0.00 N ATOM 1491 CA ILE A 99 7.077 4.096 -3.006 1.00 0.00 C ATOM 1492 C ILE A 99 6.998 2.588 -3.215 1.00 0.00 C ATOM 1493 O ILE A 99 6.561 1.851 -2.332 1.00 0.00 O ATOM 1494 CB ILE A 99 5.714 4.730 -3.358 1.00 0.00 C ATOM 1495 CG1 ILE A 99 5.795 6.255 -3.260 1.00 0.00 C ATOM 1496 CG2 ILE A 99 4.627 4.194 -2.439 1.00 0.00 C ATOM 1497 CD1 ILE A 99 4.861 6.970 -4.211 1.00 0.00 C ATOM 0 H ILE A 99 7.850 5.359 -4.491 1.00 0.00 H new ATOM 0 HA ILE A 99 7.302 4.305 -1.960 1.00 0.00 H new ATOM 0 HB ILE A 99 5.461 4.463 -4.384 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.564 6.559 -2.239 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.819 6.571 -3.462 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.672 4.651 -2.700 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.555 3.112 -2.553 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.874 4.434 -1.405 1.00 0.00 H new ATOM 0 HD11 ILE A 99 4.971 8.047 -4.088 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.106 6.695 -5.237 1.00 0.00 H new ATOM 0 HD13 ILE A 99 3.832 6.683 -3.995 1.00 0.00 H new ATOM 1509 N TYR A 100 7.428 2.137 -4.389 1.00 0.00 N ATOM 1510 CA TYR A 100 7.413 0.717 -4.717 1.00 0.00 C ATOM 1511 C TYR A 100 8.487 -0.032 -3.935 1.00 0.00 C ATOM 1512 O TYR A 100 8.215 -1.063 -3.318 1.00 0.00 O ATOM 1513 CB TYR A 100 7.629 0.521 -6.219 1.00 0.00 C ATOM 1514 CG TYR A 100 7.680 -0.930 -6.645 1.00 0.00 C ATOM 1515 CD1 TYR A 100 6.551 -1.735 -6.574 1.00 0.00 C ATOM 1516 CD2 TYR A 100 8.859 -1.492 -7.119 1.00 0.00 C ATOM 1517 CE1 TYR A 100 6.595 -3.061 -6.962 1.00 0.00 C ATOM 1518 CE2 TYR A 100 8.910 -2.817 -7.510 1.00 0.00 C ATOM 1519 CZ TYR A 100 7.777 -3.597 -7.429 1.00 0.00 C ATOM 1520 OH TYR A 100 7.824 -4.916 -7.817 1.00 0.00 O ATOM 0 H TYR A 100 7.792 2.736 -5.130 1.00 0.00 H new ATOM 0 HA TYR A 100 6.439 0.313 -4.440 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.826 1.021 -6.760 1.00 0.00 H new ATOM 0 HB3 TYR A 100 8.560 1.008 -6.509 1.00 0.00 H new ATOM 0 HD1 TYR A 100 5.624 -1.318 -6.210 1.00 0.00 H new ATOM 0 HD2 TYR A 100 9.749 -0.884 -7.183 1.00 0.00 H new ATOM 0 HE1 TYR A 100 5.708 -3.674 -6.900 1.00 0.00 H new ATOM 0 HE2 TYR A 100 9.834 -3.239 -7.877 1.00 0.00 H new ATOM 0 HH TYR A 100 8.729 -5.135 -8.122 1.00 0.00 H new ATOM 1530 N GLU A 101 9.706 0.493 -3.967 1.00 0.00 N ATOM 1531 CA GLU A 101 10.826 -0.124 -3.265 1.00 0.00 C ATOM 1532 C GLU A 101 10.555 -0.208 -1.765 1.00 0.00 C ATOM 1533 O GLU A 101 10.658 -1.277 -1.165 1.00 0.00 O ATOM 1534 CB GLU A 101 12.110 0.667 -3.519 1.00 0.00 C ATOM 1535 CG GLU A 101 12.864 0.220 -4.761 1.00 0.00 C ATOM 1536 CD GLU A 101 14.368 0.315 -4.594 1.00 0.00 C ATOM 1537 OE1 GLU A 101 14.977 -0.672 -4.133 1.00 0.00 O ATOM 1538 OE2 GLU A 101 14.936 1.377 -4.928 1.00 0.00 O ATOM 0 H GLU A 101 9.945 1.346 -4.472 1.00 0.00 H new ATOM 0 HA GLU A 101 10.947 -1.137 -3.649 1.00 0.00 H new ATOM 0 HB2 GLU A 101 11.863 1.724 -3.615 1.00 0.00 H new ATOM 0 HB3 GLU A 101 12.764 0.570 -2.652 1.00 0.00 H new ATOM 0 HG2 GLU A 101 12.592 -0.809 -4.996 1.00 0.00 H new ATOM 0 HG3 GLU A 101 12.557 0.832 -5.609 1.00 0.00 H new ATOM 1545 N GLU A 102 10.209 0.928 -1.167 1.00 0.00 N ATOM 1546 CA GLU A 102 9.926 0.984 0.264 1.00 0.00 C ATOM 1547 C GLU A 102 8.824 0.001 0.645 1.00 0.00 C ATOM 1548 O GLU A 102 8.790 -0.504 1.767 1.00 0.00 O ATOM 1549 CB GLU A 102 9.519 2.403 0.668 1.00 0.00 C ATOM 1550 CG GLU A 102 10.687 3.373 0.744 1.00 0.00 C ATOM 1551 CD GLU A 102 11.664 3.023 1.848 1.00 0.00 C ATOM 1552 OE1 GLU A 102 11.210 2.769 2.985 1.00 0.00 O ATOM 1553 OE2 GLU A 102 12.884 3.003 1.578 1.00 0.00 O ATOM 0 H GLU A 102 10.118 1.822 -1.650 1.00 0.00 H new ATOM 0 HA GLU A 102 10.835 0.705 0.797 1.00 0.00 H new ATOM 0 HB2 GLU A 102 8.790 2.781 -0.049 1.00 0.00 H new ATOM 0 HB3 GLU A 102 9.023 2.367 1.638 1.00 0.00 H new ATOM 0 HG2 GLU A 102 11.211 3.380 -0.212 1.00 0.00 H new ATOM 0 HG3 GLU A 102 10.307 4.382 0.906 1.00 0.00 H new ATOM 1560 N PHE A 103 7.922 -0.266 -0.294 1.00 0.00 N ATOM 1561 CA PHE A 103 6.818 -1.188 -0.054 1.00 0.00 C ATOM 1562 C PHE A 103 7.308 -2.632 -0.011 1.00 0.00 C ATOM 1563 O PHE A 103 6.935 -3.398 0.878 1.00 0.00 O ATOM 1564 CB PHE A 103 5.753 -1.032 -1.141 1.00 0.00 C ATOM 1565 CG PHE A 103 4.551 -1.909 -0.935 1.00 0.00 C ATOM 1566 CD1 PHE A 103 3.650 -1.645 0.084 1.00 0.00 C ATOM 1567 CD2 PHE A 103 4.322 -2.999 -1.760 1.00 0.00 C ATOM 1568 CE1 PHE A 103 2.543 -2.449 0.277 1.00 0.00 C ATOM 1569 CE2 PHE A 103 3.217 -3.808 -1.571 1.00 0.00 C ATOM 1570 CZ PHE A 103 2.327 -3.532 -0.552 1.00 0.00 C ATOM 0 H PHE A 103 7.934 0.143 -1.228 1.00 0.00 H new ATOM 0 HA PHE A 103 6.381 -0.945 0.915 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.431 0.009 -1.176 1.00 0.00 H new ATOM 0 HB3 PHE A 103 6.198 -1.261 -2.109 1.00 0.00 H new ATOM 0 HD1 PHE A 103 3.815 -0.800 0.736 1.00 0.00 H new ATOM 0 HD2 PHE A 103 5.014 -3.219 -2.559 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.848 -2.231 1.075 1.00 0.00 H new ATOM 0 HE2 PHE A 103 3.050 -4.655 -2.220 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.463 -4.163 -0.404 1.00 0.00 H new ATOM 1580 N LEU A 104 8.143 -2.998 -0.978 1.00 0.00 N ATOM 1581 CA LEU A 104 8.682 -4.352 -1.055 1.00 0.00 C ATOM 1582 C LEU A 104 9.506 -4.689 0.185 1.00 0.00 C ATOM 1583 O LEU A 104 9.377 -5.773 0.753 1.00 0.00 O ATOM 1584 CB LEU A 104 9.543 -4.510 -2.309 1.00 0.00 C ATOM 1585 CG LEU A 104 8.880 -4.055 -3.610 1.00 0.00 C ATOM 1586 CD1 LEU A 104 9.910 -3.447 -4.552 1.00 0.00 C ATOM 1587 CD2 LEU A 104 8.167 -5.222 -4.277 1.00 0.00 C ATOM 0 H LEU A 104 8.462 -2.375 -1.720 1.00 0.00 H new ATOM 0 HA LEU A 104 7.841 -5.044 -1.107 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.465 -3.945 -2.172 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.823 -5.559 -2.409 1.00 0.00 H new ATOM 0 HG LEU A 104 8.142 -3.289 -3.372 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.419 -3.129 -5.472 1.00 0.00 H new ATOM 0 HD12 LEU A 104 10.377 -2.586 -4.074 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.673 -4.190 -4.786 1.00 0.00 H new ATOM 0 HD21 LEU A 104 7.700 -4.883 -5.202 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.888 -6.008 -4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 104 7.402 -5.612 -3.606 1.00 0.00 H new ATOM 1599 N ARG A 105 10.358 -3.754 0.595 1.00 0.00 N ATOM 1600 CA ARG A 105 11.209 -3.954 1.764 1.00 0.00 C ATOM 1601 C ARG A 105 10.377 -4.250 3.010 1.00 0.00 C ATOM 1602 O ARG A 105 10.589 -5.257 3.684 1.00 0.00 O ATOM 1603 CB ARG A 105 12.084 -2.719 1.998 1.00 0.00 C ATOM 1604 CG ARG A 105 13.557 -2.954 1.709 1.00 0.00 C ATOM 1605 CD ARG A 105 14.285 -3.497 2.927 1.00 0.00 C ATOM 1606 NE ARG A 105 14.907 -2.433 3.713 1.00 0.00 N ATOM 1607 CZ ARG A 105 16.061 -1.852 3.393 1.00 0.00 C ATOM 1608 NH1 ARG A 105 16.723 -2.230 2.307 1.00 0.00 N ATOM 1609 NH2 ARG A 105 16.554 -0.892 4.162 1.00 0.00 N ATOM 0 H ARG A 105 10.478 -2.851 0.136 1.00 0.00 H new ATOM 0 HA ARG A 105 11.848 -4.815 1.571 1.00 0.00 H new ATOM 0 HB2 ARG A 105 11.724 -1.905 1.369 1.00 0.00 H new ATOM 0 HB3 ARG A 105 11.972 -2.396 3.033 1.00 0.00 H new ATOM 0 HG2 ARG A 105 13.659 -3.655 0.881 1.00 0.00 H new ATOM 0 HG3 ARG A 105 14.020 -2.019 1.394 1.00 0.00 H new ATOM 0 HD2 ARG A 105 13.583 -4.047 3.553 1.00 0.00 H new ATOM 0 HD3 ARG A 105 15.049 -4.205 2.607 1.00 0.00 H new ATOM 0 HE ARG A 105 14.428 -2.117 4.557 1.00 0.00 H new ATOM 0 HH11 ARG A 105 16.348 -2.969 1.713 1.00 0.00 H new ATOM 0 HH12 ARG A 105 17.607 -1.781 2.067 1.00 0.00 H new ATOM 0 HH21 ARG A 105 16.049 -0.599 4.998 1.00 0.00 H new ATOM 0 HH22 ARG A 105 17.438 -0.446 3.917 1.00 0.00 H new ATOM 1623 N MET A 106 9.435 -3.363 3.310 1.00 0.00 N ATOM 1624 CA MET A 106 8.576 -3.527 4.478 1.00 0.00 C ATOM 1625 C MET A 106 7.693 -4.765 4.348 1.00 0.00 C ATOM 1626 O MET A 106 7.298 -5.364 5.348 1.00 0.00 O ATOM 1627 CB MET A 106 7.703 -2.287 4.673 1.00 0.00 C ATOM 1628 CG MET A 106 6.987 -2.255 6.014 1.00 0.00 C ATOM 1629 SD MET A 106 7.344 -0.761 6.960 1.00 0.00 S ATOM 1630 CE MET A 106 6.804 0.501 5.810 1.00 0.00 C ATOM 0 H MET A 106 9.246 -2.524 2.762 1.00 0.00 H new ATOM 0 HA MET A 106 9.220 -3.656 5.348 1.00 0.00 H new ATOM 0 HB2 MET A 106 8.325 -1.396 4.580 1.00 0.00 H new ATOM 0 HB3 MET A 106 6.963 -2.244 3.874 1.00 0.00 H new ATOM 0 HG2 MET A 106 5.912 -2.327 5.849 1.00 0.00 H new ATOM 0 HG3 MET A 106 7.279 -3.128 6.598 1.00 0.00 H new ATOM 0 HE1 MET A 106 7.601 1.231 5.671 1.00 0.00 H new ATOM 0 HE2 MET A 106 6.562 0.041 4.852 1.00 0.00 H new ATOM 0 HE3 MET A 106 5.920 1.000 6.206 1.00 0.00 H new ATOM 1640 N THR A 107 7.384 -5.144 3.112 1.00 0.00 N ATOM 1641 CA THR A 107 6.544 -6.310 2.860 1.00 0.00 C ATOM 1642 C THR A 107 7.387 -7.560 2.615 1.00 0.00 C ATOM 1643 O THR A 107 6.907 -8.538 2.041 1.00 0.00 O ATOM 1644 CB THR A 107 5.631 -6.054 1.660 1.00 0.00 C ATOM 1645 OG1 THR A 107 6.394 -5.825 0.490 1.00 0.00 O ATOM 1646 CG2 THR A 107 4.712 -4.866 1.848 1.00 0.00 C ATOM 0 H THR A 107 7.702 -4.662 2.271 1.00 0.00 H new ATOM 0 HA THR A 107 5.934 -6.480 3.747 1.00 0.00 H new ATOM 0 HB THR A 107 5.021 -6.952 1.565 1.00 0.00 H new ATOM 0 HG1 THR A 107 6.387 -4.868 0.277 1.00 0.00 H new ATOM 0 HG21 THR A 107 4.092 -4.741 0.960 1.00 0.00 H new ATOM 0 HG22 THR A 107 4.074 -5.034 2.715 1.00 0.00 H new ATOM 0 HG23 THR A 107 5.307 -3.966 2.004 1.00 0.00 H new ATOM 1654 N HIS A 108 8.642 -7.526 3.056 1.00 0.00 N ATOM 1655 CA HIS A 108 9.546 -8.659 2.886 1.00 0.00 C ATOM 1656 C HIS A 108 9.593 -9.114 1.428 1.00 0.00 C ATOM 1657 O HIS A 108 9.093 -10.185 1.084 1.00 0.00 O ATOM 1658 CB HIS A 108 9.113 -9.820 3.783 1.00 0.00 C ATOM 1659 CG HIS A 108 10.260 -10.603 4.345 1.00 0.00 C ATOM 1660 ND1 HIS A 108 10.108 -11.834 4.946 1.00 0.00 N ATOM 1661 CD2 HIS A 108 11.584 -10.323 4.393 1.00 0.00 C ATOM 1662 CE1 HIS A 108 11.289 -12.277 5.342 1.00 0.00 C ATOM 1663 NE2 HIS A 108 12.200 -11.379 5.017 1.00 0.00 N ATOM 0 H HIS A 108 9.056 -6.725 3.534 1.00 0.00 H new ATOM 0 HA HIS A 108 10.547 -8.337 3.174 1.00 0.00 H new ATOM 0 HB2 HIS A 108 8.513 -9.429 4.605 1.00 0.00 H new ATOM 0 HB3 HIS A 108 8.472 -10.491 3.211 1.00 0.00 H new ATOM 0 HD2 HIS A 108 12.065 -9.435 4.012 1.00 0.00 H new ATOM 0 HE1 HIS A 108 11.476 -13.214 5.846 1.00 0.00 H new ATOM 0 HE2 HIS A 108 13.200 -11.457 5.200 1.00 0.00 H new ATOM 1672 N ASN A 109 10.197 -8.292 0.577 1.00 0.00 N ATOM 1673 CA ASN A 109 10.312 -8.610 -0.842 1.00 0.00 C ATOM 1674 C ASN A 109 8.935 -8.786 -1.476 1.00 0.00 C ATOM 1675 O ASN A 109 8.757 -9.605 -2.378 1.00 0.00 O ATOM 1676 CB ASN A 109 11.140 -9.881 -1.036 1.00 0.00 C ATOM 1677 CG ASN A 109 12.562 -9.728 -0.532 1.00 0.00 C ATOM 1678 OD1 ASN A 109 12.797 -9.158 0.534 1.00 0.00 O ATOM 1679 ND2 ASN A 109 13.520 -10.236 -1.298 1.00 0.00 N ATOM 0 H ASN A 109 10.615 -7.401 0.845 1.00 0.00 H new ATOM 0 HA ASN A 109 10.815 -7.777 -1.334 1.00 0.00 H new ATOM 0 HB2 ASN A 109 10.659 -10.708 -0.513 1.00 0.00 H new ATOM 0 HB3 ASN A 109 11.159 -10.141 -2.094 1.00 0.00 H new ATOM 0 HD21 ASN A 109 14.496 -10.162 -1.011 1.00 0.00 H new ATOM 0 HD22 ASN A 109 13.280 -10.700 -2.174 1.00 0.00 H new ATOM 1686 N GLY A 110 7.964 -8.014 -0.997 1.00 0.00 N ATOM 1687 CA GLY A 110 6.617 -8.101 -1.530 1.00 0.00 C ATOM 1688 C GLY A 110 6.038 -9.498 -1.424 1.00 0.00 C ATOM 1689 O GLY A 110 5.712 -10.121 -2.434 1.00 0.00 O ATOM 0 H GLY A 110 8.086 -7.330 -0.250 1.00 0.00 H new ATOM 0 HA2 GLY A 110 5.973 -7.403 -0.995 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.623 -7.792 -2.575 1.00 0.00 H new ATOM 1693 N THR A 111 5.911 -9.992 -0.197 1.00 0.00 N ATOM 1694 CA THR A 111 5.369 -11.326 0.036 1.00 0.00 C ATOM 1695 C THR A 111 4.224 -11.285 1.042 1.00 0.00 C ATOM 1696 O THR A 111 3.190 -11.922 0.846 1.00 0.00 O ATOM 1697 CB THR A 111 6.467 -12.265 0.538 1.00 0.00 C ATOM 1698 OG1 THR A 111 7.167 -11.684 1.624 1.00 0.00 O ATOM 1699 CG2 THR A 111 7.484 -12.620 -0.526 1.00 0.00 C ATOM 0 H THR A 111 6.176 -9.490 0.650 1.00 0.00 H new ATOM 0 HA THR A 111 4.982 -11.701 -0.912 1.00 0.00 H new ATOM 0 HB THR A 111 5.951 -13.175 0.843 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.061 -11.412 1.329 1.00 0.00 H new ATOM 0 HG21 THR A 111 8.234 -13.288 -0.104 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.983 -13.116 -1.357 1.00 0.00 H new ATOM 0 HG23 THR A 111 7.968 -11.711 -0.884 1.00 0.00 H new ATOM 1707 N GLN A 112 4.415 -10.533 2.122 1.00 0.00 N ATOM 1708 CA GLN A 112 3.395 -10.415 3.157 1.00 0.00 C ATOM 1709 C GLN A 112 3.285 -8.980 3.662 1.00 0.00 C ATOM 1710 O GLN A 112 4.190 -8.472 4.323 1.00 0.00 O ATOM 1711 CB GLN A 112 3.714 -11.353 4.323 1.00 0.00 C ATOM 1712 CG GLN A 112 2.608 -11.429 5.363 1.00 0.00 C ATOM 1713 CD GLN A 112 2.545 -12.780 6.048 1.00 0.00 C ATOM 1714 OE1 GLN A 112 3.511 -13.543 6.031 1.00 0.00 O ATOM 1715 NE2 GLN A 112 1.405 -13.083 6.658 1.00 0.00 N ATOM 0 H GLN A 112 5.264 -9.998 2.302 1.00 0.00 H new ATOM 0 HA GLN A 112 2.438 -10.698 2.718 1.00 0.00 H new ATOM 0 HB2 GLN A 112 3.904 -12.353 3.933 1.00 0.00 H new ATOM 0 HB3 GLN A 112 4.633 -11.020 4.806 1.00 0.00 H new ATOM 0 HG2 GLN A 112 2.764 -10.653 6.112 1.00 0.00 H new ATOM 0 HG3 GLN A 112 1.650 -11.223 4.885 1.00 0.00 H new ATOM 0 HE21 GLN A 112 0.629 -12.421 6.647 1.00 0.00 H new ATOM 0 HE22 GLN A 112 1.305 -13.978 7.137 1.00 0.00 H new ATOM 1724 N LEU A 113 2.167 -8.332 3.348 1.00 0.00 N ATOM 1725 CA LEU A 113 1.937 -6.957 3.774 1.00 0.00 C ATOM 1726 C LEU A 113 1.128 -6.923 5.067 1.00 0.00 C ATOM 1727 O LEU A 113 -0.099 -7.011 5.045 1.00 0.00 O ATOM 1728 CB LEU A 113 1.208 -6.174 2.676 1.00 0.00 C ATOM 1729 CG LEU A 113 0.849 -4.723 3.022 1.00 0.00 C ATOM 1730 CD1 LEU A 113 -0.478 -4.662 3.763 1.00 0.00 C ATOM 1731 CD2 LEU A 113 1.951 -4.071 3.846 1.00 0.00 C ATOM 0 H LEU A 113 1.408 -8.737 2.801 1.00 0.00 H new ATOM 0 HA LEU A 113 2.904 -6.489 3.958 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.831 -6.172 1.782 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.291 -6.706 2.424 1.00 0.00 H new ATOM 0 HG LEU A 113 0.750 -4.168 2.089 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.715 -3.625 4.000 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.265 -5.080 3.135 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.406 -5.237 4.686 1.00 0.00 H new ATOM 0 HD21 LEU A 113 1.672 -3.043 4.078 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.090 -4.627 4.773 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.881 -4.075 3.278 1.00 0.00 H new ATOM 1743 N LEU A 114 1.827 -6.797 6.191 1.00 0.00 N ATOM 1744 CA LEU A 114 1.180 -6.754 7.498 1.00 0.00 C ATOM 1745 C LEU A 114 0.424 -8.051 7.780 1.00 0.00 C ATOM 1746 O LEU A 114 0.907 -8.913 8.513 1.00 0.00 O ATOM 1747 CB LEU A 114 0.227 -5.558 7.582 1.00 0.00 C ATOM 1748 CG LEU A 114 0.906 -4.188 7.594 1.00 0.00 C ATOM 1749 CD1 LEU A 114 -0.123 -3.080 7.774 1.00 0.00 C ATOM 1750 CD2 LEU A 114 1.959 -4.125 8.691 1.00 0.00 C ATOM 0 H LEU A 114 2.844 -6.723 6.223 1.00 0.00 H new ATOM 0 HA LEU A 114 1.957 -6.641 8.255 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -0.459 -5.599 6.736 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -0.375 -5.656 8.485 1.00 0.00 H new ATOM 0 HG LEU A 114 1.400 -4.041 6.634 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.381 -2.113 7.780 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -0.839 -3.111 6.953 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.648 -3.221 8.719 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.432 -3.143 8.685 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.487 -4.295 9.659 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.713 -4.892 8.516 1.00 0.00 H new ATOM 1762 N ASN A 115 -0.762 -8.182 7.194 1.00 0.00 N ATOM 1763 CA ASN A 115 -1.580 -9.375 7.383 1.00 0.00 C ATOM 1764 C ASN A 115 -2.287 -9.759 6.087 1.00 0.00 C ATOM 1765 O ASN A 115 -3.439 -10.192 6.102 1.00 0.00 O ATOM 1766 CB ASN A 115 -2.610 -9.142 8.490 1.00 0.00 C ATOM 1767 CG ASN A 115 -3.296 -10.423 8.920 1.00 0.00 C ATOM 1768 OD1 ASN A 115 -4.508 -10.639 8.424 1.00 0.00 O flip ATOM 1769 ND2 ASN A 115 -2.743 -11.208 9.690 1.00 0.00 N flip ATOM 0 H ASN A 115 -1.178 -7.477 6.585 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.923 -10.194 7.675 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.118 -8.690 9.351 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.359 -8.431 8.142 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -1.810 -11.001 10.047 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -3.218 -12.066 9.972 1.00 0.00 H new ATOM 1776 N PHE A 116 -1.589 -9.599 4.967 1.00 0.00 N ATOM 1777 CA PHE A 116 -2.152 -9.931 3.663 1.00 0.00 C ATOM 1778 C PHE A 116 -1.067 -10.419 2.708 1.00 0.00 C ATOM 1779 O PHE A 116 -0.408 -9.621 2.042 1.00 0.00 O ATOM 1780 CB PHE A 116 -2.861 -8.713 3.065 1.00 0.00 C ATOM 1781 CG PHE A 116 -4.221 -8.462 3.650 1.00 0.00 C ATOM 1782 CD1 PHE A 116 -4.357 -7.838 4.880 1.00 0.00 C ATOM 1783 CD2 PHE A 116 -5.364 -8.850 2.969 1.00 0.00 C ATOM 1784 CE1 PHE A 116 -5.607 -7.605 5.420 1.00 0.00 C ATOM 1785 CE2 PHE A 116 -6.617 -8.619 3.505 1.00 0.00 C ATOM 1786 CZ PHE A 116 -6.740 -7.996 4.732 1.00 0.00 C ATOM 0 H PHE A 116 -0.634 -9.242 4.936 1.00 0.00 H new ATOM 0 HA PHE A 116 -2.876 -10.734 3.803 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.240 -7.830 3.218 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -2.958 -8.852 1.988 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -3.475 -7.530 5.423 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -5.275 -9.338 2.010 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -5.699 -7.118 6.379 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -7.500 -8.926 2.964 1.00 0.00 H new ATOM 0 HZ PHE A 116 -7.718 -7.815 5.152 1.00 0.00 H new ATOM 1796 N THR A 117 -0.889 -11.735 2.646 1.00 0.00 N ATOM 1797 CA THR A 117 0.116 -12.328 1.771 1.00 0.00 C ATOM 1798 C THR A 117 -0.163 -11.983 0.312 1.00 0.00 C ATOM 1799 O THR A 117 -1.197 -12.361 -0.238 1.00 0.00 O ATOM 1800 CB THR A 117 0.147 -13.848 1.950 1.00 0.00 C ATOM 1801 OG1 THR A 117 -1.140 -14.403 1.749 1.00 0.00 O ATOM 1802 CG2 THR A 117 0.625 -14.279 3.320 1.00 0.00 C ATOM 0 H THR A 117 -1.427 -12.410 3.190 1.00 0.00 H new ATOM 0 HA THR A 117 1.088 -11.917 2.045 1.00 0.00 H new ATOM 0 HB THR A 117 0.854 -14.213 1.205 1.00 0.00 H new ATOM 0 HG1 THR A 117 -1.099 -15.375 1.866 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.623 -15.367 3.380 1.00 0.00 H new ATOM 0 HG22 THR A 117 1.637 -13.908 3.486 1.00 0.00 H new ATOM 0 HG23 THR A 117 -0.040 -13.872 4.082 1.00 0.00 H new ATOM 1810 N LEU A 118 0.765 -11.262 -0.309 1.00 0.00 N ATOM 1811 CA LEU A 118 0.615 -10.867 -1.705 1.00 0.00 C ATOM 1812 C LEU A 118 1.904 -11.110 -2.483 1.00 0.00 C ATOM 1813 O LEU A 118 2.979 -11.240 -1.897 1.00 0.00 O ATOM 1814 CB LEU A 118 0.208 -9.396 -1.800 1.00 0.00 C ATOM 1815 CG LEU A 118 1.199 -8.403 -1.189 1.00 0.00 C ATOM 1816 CD1 LEU A 118 2.210 -7.951 -2.232 1.00 0.00 C ATOM 1817 CD2 LEU A 118 0.464 -7.209 -0.597 1.00 0.00 C ATOM 0 H LEU A 118 1.627 -10.940 0.131 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.170 -11.479 -2.148 1.00 0.00 H new ATOM 0 HB2 LEU A 118 0.066 -9.142 -2.851 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.757 -9.270 -1.308 1.00 0.00 H new ATOM 0 HG LEU A 118 1.738 -8.903 -0.384 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.907 -7.245 -1.781 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.759 -8.815 -2.605 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.689 -7.468 -3.059 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.186 -6.514 -0.167 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.103 -6.706 -1.380 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.218 -7.551 0.181 1.00 0.00 H new ATOM 1829 N ASP A 119 1.789 -11.177 -3.805 1.00 0.00 N ATOM 1830 CA ASP A 119 2.944 -11.412 -4.663 1.00 0.00 C ATOM 1831 C ASP A 119 3.727 -10.124 -4.898 1.00 0.00 C ATOM 1832 O ASP A 119 3.205 -9.025 -4.713 1.00 0.00 O ATOM 1833 CB ASP A 119 2.498 -12.005 -6.002 1.00 0.00 C ATOM 1834 CG ASP A 119 3.337 -13.199 -6.414 1.00 0.00 C ATOM 1835 OD1 ASP A 119 3.359 -14.196 -5.662 1.00 0.00 O ATOM 1836 OD2 ASP A 119 3.972 -13.137 -7.487 1.00 0.00 O ATOM 0 H ASP A 119 0.907 -11.072 -4.306 1.00 0.00 H new ATOM 0 HA ASP A 119 3.599 -12.122 -4.158 1.00 0.00 H new ATOM 0 HB2 ASP A 119 1.453 -12.306 -5.933 1.00 0.00 H new ATOM 0 HB3 ASP A 119 2.559 -11.238 -6.774 1.00 0.00 H new ATOM 1841 N ARG A 120 4.983 -10.270 -5.307 1.00 0.00 N ATOM 1842 CA ARG A 120 5.842 -9.121 -5.570 1.00 0.00 C ATOM 1843 C ARG A 120 5.887 -8.809 -7.063 1.00 0.00 C ATOM 1844 O ARG A 120 6.001 -7.651 -7.463 1.00 0.00 O ATOM 1845 CB ARG A 120 7.256 -9.388 -5.050 1.00 0.00 C ATOM 1846 CG ARG A 120 8.223 -8.241 -5.297 1.00 0.00 C ATOM 1847 CD ARG A 120 9.565 -8.742 -5.807 1.00 0.00 C ATOM 1848 NE ARG A 120 9.567 -8.920 -7.257 1.00 0.00 N ATOM 1849 CZ ARG A 120 10.447 -9.676 -7.910 1.00 0.00 C ATOM 1850 NH1 ARG A 120 11.397 -10.326 -7.248 1.00 0.00 N ATOM 1851 NH2 ARG A 120 10.376 -9.785 -9.230 1.00 0.00 N ATOM 0 H ARG A 120 5.429 -11.174 -5.464 1.00 0.00 H new ATOM 0 HA ARG A 120 5.427 -8.259 -5.048 1.00 0.00 H new ATOM 0 HB2 ARG A 120 7.209 -9.588 -3.980 1.00 0.00 H new ATOM 0 HB3 ARG A 120 7.645 -10.289 -5.525 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.792 -7.550 -6.022 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.370 -7.682 -4.373 1.00 0.00 H new ATOM 0 HD2 ARG A 120 10.346 -8.035 -5.527 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.805 -9.690 -5.325 1.00 0.00 H new ATOM 0 HE ARG A 120 8.852 -8.437 -7.801 1.00 0.00 H new ATOM 0 HH11 ARG A 120 11.456 -10.248 -6.233 1.00 0.00 H new ATOM 0 HH12 ARG A 120 12.068 -10.903 -7.755 1.00 0.00 H new ATOM 0 HH21 ARG A 120 9.647 -9.290 -9.744 1.00 0.00 H new ATOM 0 HH22 ARG A 120 11.050 -10.364 -9.731 1.00 0.00 H new ATOM 1865 N LYS A 121 5.797 -9.852 -7.881 1.00 0.00 N ATOM 1866 CA LYS A 121 5.826 -9.694 -9.330 1.00 0.00 C ATOM 1867 C LYS A 121 4.596 -8.938 -9.828 1.00 0.00 C ATOM 1868 O LYS A 121 4.613 -8.356 -10.911 1.00 0.00 O ATOM 1869 CB LYS A 121 5.907 -11.062 -10.011 1.00 0.00 C ATOM 1870 CG LYS A 121 7.296 -11.677 -9.978 1.00 0.00 C ATOM 1871 CD LYS A 121 7.467 -12.604 -8.785 1.00 0.00 C ATOM 1872 CE LYS A 121 8.711 -13.468 -8.925 1.00 0.00 C ATOM 1873 NZ LYS A 121 8.852 -14.426 -7.793 1.00 0.00 N ATOM 0 H LYS A 121 5.703 -10.817 -7.564 1.00 0.00 H new ATOM 0 HA LYS A 121 6.712 -9.112 -9.586 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.206 -11.742 -9.526 1.00 0.00 H new ATOM 0 HB3 LYS A 121 5.588 -10.962 -11.048 1.00 0.00 H new ATOM 0 HG2 LYS A 121 7.471 -12.232 -10.899 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.044 -10.886 -9.935 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.533 -12.014 -7.871 1.00 0.00 H new ATOM 0 HD3 LYS A 121 6.588 -13.242 -8.690 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.666 -14.020 -9.864 1.00 0.00 H new ATOM 0 HE3 LYS A 121 9.593 -12.829 -8.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.712 -14.996 -7.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 8.920 -13.899 -6.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 8.022 -15.052 -7.763 1.00 0.00 H new ATOM 1887 N SER A 122 3.530 -8.955 -9.033 1.00 0.00 N ATOM 1888 CA SER A 122 2.294 -8.273 -9.399 1.00 0.00 C ATOM 1889 C SER A 122 2.302 -6.824 -8.922 1.00 0.00 C ATOM 1890 O SER A 122 1.707 -5.950 -9.554 1.00 0.00 O ATOM 1891 CB SER A 122 1.090 -9.008 -8.809 1.00 0.00 C ATOM 1892 OG SER A 122 -0.088 -8.733 -9.548 1.00 0.00 O ATOM 0 H SER A 122 3.498 -9.433 -8.133 1.00 0.00 H new ATOM 0 HA SER A 122 2.219 -8.275 -10.486 1.00 0.00 H new ATOM 0 HB2 SER A 122 1.280 -10.081 -8.808 1.00 0.00 H new ATOM 0 HB3 SER A 122 0.950 -8.708 -7.771 1.00 0.00 H new ATOM 0 HG SER A 122 -0.067 -7.805 -9.864 1.00 0.00 H new ATOM 1898 N VAL A 123 2.978 -6.573 -7.806 1.00 0.00 N ATOM 1899 CA VAL A 123 3.059 -5.227 -7.249 1.00 0.00 C ATOM 1900 C VAL A 123 3.689 -4.259 -8.245 1.00 0.00 C ATOM 1901 O VAL A 123 4.652 -4.598 -8.931 1.00 0.00 O ATOM 1902 CB VAL A 123 3.874 -5.207 -5.940 1.00 0.00 C ATOM 1903 CG1 VAL A 123 3.814 -3.831 -5.291 1.00 0.00 C ATOM 1904 CG2 VAL A 123 3.374 -6.276 -4.980 1.00 0.00 C ATOM 0 H VAL A 123 3.477 -7.283 -7.270 1.00 0.00 H new ATOM 0 HA VAL A 123 2.038 -4.910 -7.035 1.00 0.00 H new ATOM 0 HB VAL A 123 4.914 -5.425 -6.182 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.395 -3.838 -4.369 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.226 -3.088 -5.974 1.00 0.00 H new ATOM 0 HG13 VAL A 123 2.778 -3.580 -5.065 1.00 0.00 H new ATOM 0 HG21 VAL A 123 3.962 -6.245 -4.063 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.326 -6.092 -4.745 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.476 -7.257 -5.443 1.00 0.00 H new ATOM 1914 N PHE A 124 3.136 -3.052 -8.319 1.00 0.00 N ATOM 1915 CA PHE A 124 3.642 -2.035 -9.233 1.00 0.00 C ATOM 1916 C PHE A 124 2.930 -0.704 -9.016 1.00 0.00 C ATOM 1917 O PHE A 124 1.779 -0.668 -8.577 1.00 0.00 O ATOM 1918 CB PHE A 124 3.466 -2.491 -10.683 1.00 0.00 C ATOM 1919 CG PHE A 124 4.256 -1.677 -11.668 1.00 0.00 C ATOM 1920 CD1 PHE A 124 3.826 -0.415 -12.047 1.00 0.00 C ATOM 1921 CD2 PHE A 124 5.427 -2.174 -12.216 1.00 0.00 C ATOM 1922 CE1 PHE A 124 4.549 0.336 -12.953 1.00 0.00 C ATOM 1923 CE2 PHE A 124 6.156 -1.429 -13.123 1.00 0.00 C ATOM 1924 CZ PHE A 124 5.716 -0.172 -13.493 1.00 0.00 C ATOM 0 H PHE A 124 2.338 -2.755 -7.757 1.00 0.00 H new ATOM 0 HA PHE A 124 4.704 -1.895 -9.029 1.00 0.00 H new ATOM 0 HB2 PHE A 124 3.764 -3.536 -10.765 1.00 0.00 H new ATOM 0 HB3 PHE A 124 2.409 -2.439 -10.946 1.00 0.00 H new ATOM 0 HD1 PHE A 124 2.915 -0.014 -11.629 1.00 0.00 H new ATOM 0 HD2 PHE A 124 5.775 -3.156 -11.931 1.00 0.00 H new ATOM 0 HE1 PHE A 124 4.203 1.318 -13.239 1.00 0.00 H new ATOM 0 HE2 PHE A 124 7.068 -1.828 -13.542 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.283 0.412 -14.203 1.00 0.00 H new ATOM 1934 N VAL A 125 3.620 0.388 -9.325 1.00 0.00 N ATOM 1935 CA VAL A 125 3.055 1.721 -9.164 1.00 0.00 C ATOM 1936 C VAL A 125 3.546 2.662 -10.260 1.00 0.00 C ATOM 1937 O VAL A 125 4.749 2.803 -10.476 1.00 0.00 O ATOM 1938 CB VAL A 125 3.409 2.318 -7.786 1.00 0.00 C ATOM 1939 CG1 VAL A 125 4.917 2.441 -7.628 1.00 0.00 C ATOM 1940 CG2 VAL A 125 2.729 3.667 -7.593 1.00 0.00 C ATOM 0 H VAL A 125 4.573 0.375 -9.689 1.00 0.00 H new ATOM 0 HA VAL A 125 1.972 1.619 -9.238 1.00 0.00 H new ATOM 0 HB VAL A 125 3.041 1.642 -7.014 1.00 0.00 H new ATOM 0 HG11 VAL A 125 5.147 2.864 -6.650 1.00 0.00 H new ATOM 0 HG12 VAL A 125 5.373 1.455 -7.713 1.00 0.00 H new ATOM 0 HG13 VAL A 125 5.313 3.093 -8.407 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.992 4.070 -6.615 1.00 0.00 H new ATOM 0 HG22 VAL A 125 3.060 4.356 -8.370 1.00 0.00 H new ATOM 0 HG23 VAL A 125 1.648 3.542 -7.655 1.00 0.00 H new ATOM 1950 N ASP A 126 2.607 3.302 -10.948 1.00 0.00 N ATOM 1951 CA ASP A 126 2.945 4.229 -12.023 1.00 0.00 C ATOM 1952 C ASP A 126 2.202 5.551 -11.852 1.00 0.00 C ATOM 1953 O ASP A 126 1.404 5.711 -10.929 1.00 0.00 O ATOM 1954 CB ASP A 126 2.612 3.610 -13.382 1.00 0.00 C ATOM 1955 CG ASP A 126 3.816 3.548 -14.301 1.00 0.00 C ATOM 1956 OD1 ASP A 126 4.771 4.322 -14.081 1.00 0.00 O ATOM 1957 OD2 ASP A 126 3.804 2.724 -15.240 1.00 0.00 O ATOM 0 H ASP A 126 1.606 3.196 -10.781 1.00 0.00 H new ATOM 0 HA ASP A 126 4.016 4.428 -11.978 1.00 0.00 H new ATOM 0 HB2 ASP A 126 2.220 2.604 -13.233 1.00 0.00 H new ATOM 0 HB3 ASP A 126 1.824 4.192 -13.860 1.00 0.00 H new ATOM 1962 N SER A 127 2.471 6.495 -12.748 1.00 0.00 N ATOM 1963 CA SER A 127 1.829 7.805 -12.698 1.00 0.00 C ATOM 1964 C SER A 127 0.310 7.670 -12.737 1.00 0.00 C ATOM 1965 O SER A 127 -0.274 7.414 -13.790 1.00 0.00 O ATOM 1966 CB SER A 127 2.306 8.674 -13.862 1.00 0.00 C ATOM 1967 OG SER A 127 2.490 10.018 -13.453 1.00 0.00 O ATOM 0 H SER A 127 3.129 6.378 -13.518 1.00 0.00 H new ATOM 0 HA SER A 127 2.108 8.283 -11.759 1.00 0.00 H new ATOM 0 HB2 SER A 127 3.243 8.279 -14.255 1.00 0.00 H new ATOM 0 HB3 SER A 127 1.578 8.634 -14.672 1.00 0.00 H new ATOM 0 HG SER A 127 2.797 10.553 -14.215 1.00 0.00 H new ATOM 1973 N GLY A 128 -0.323 7.845 -11.581 1.00 0.00 N ATOM 1974 CA GLY A 128 -1.768 7.740 -11.501 1.00 0.00 C ATOM 1975 C GLY A 128 -2.477 8.896 -12.184 1.00 0.00 C ATOM 1976 O GLY A 128 -3.230 8.687 -13.135 1.00 0.00 O ATOM 0 H GLY A 128 0.140 8.058 -10.697 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.086 6.803 -11.958 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -2.068 7.702 -10.454 1.00 0.00 H new ATOM 1980 N PRO A 129 -2.259 10.137 -11.718 1.00 0.00 N ATOM 1981 CA PRO A 129 -2.893 11.323 -12.302 1.00 0.00 C ATOM 1982 C PRO A 129 -2.530 11.509 -13.771 1.00 0.00 C ATOM 1983 O PRO A 129 -1.387 11.824 -14.104 1.00 0.00 O ATOM 1984 CB PRO A 129 -2.348 12.486 -11.463 1.00 0.00 C ATOM 1985 CG PRO A 129 -1.127 11.949 -10.798 1.00 0.00 C ATOM 1986 CD PRO A 129 -1.380 10.486 -10.589 1.00 0.00 C ATOM 0 HA PRO A 129 -3.980 11.248 -12.283 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -2.110 13.346 -12.089 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -3.082 12.820 -10.729 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -0.244 12.108 -11.417 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -0.946 12.453 -9.849 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -0.455 9.910 -10.605 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -1.859 10.292 -9.629 1.00 0.00 H new ATOM 1994 N SER A 130 -3.510 11.310 -14.646 1.00 0.00 N ATOM 1995 CA SER A 130 -3.296 11.456 -16.081 1.00 0.00 C ATOM 1996 C SER A 130 -4.600 11.261 -16.848 1.00 0.00 C ATOM 1997 O SER A 130 -4.879 11.975 -17.811 1.00 0.00 O ATOM 1998 CB SER A 130 -2.250 10.450 -16.566 1.00 0.00 C ATOM 1999 OG SER A 130 -2.218 10.388 -17.982 1.00 0.00 O ATOM 0 H SER A 130 -4.461 11.047 -14.386 1.00 0.00 H new ATOM 0 HA SER A 130 -2.933 12.467 -16.269 1.00 0.00 H new ATOM 0 HB2 SER A 130 -1.267 10.733 -16.189 1.00 0.00 H new ATOM 0 HB3 SER A 130 -2.475 9.463 -16.161 1.00 0.00 H new ATOM 0 HG SER A 130 -1.541 9.739 -18.266 1.00 0.00 H new ATOM 2005 N SER A 131 -5.396 10.288 -16.415 1.00 0.00 N ATOM 2006 CA SER A 131 -6.671 9.999 -17.059 1.00 0.00 C ATOM 2007 C SER A 131 -7.620 11.188 -16.946 1.00 0.00 C ATOM 2008 O SER A 131 -7.215 12.283 -16.556 1.00 0.00 O ATOM 2009 CB SER A 131 -7.310 8.755 -16.438 1.00 0.00 C ATOM 2010 OG SER A 131 -7.741 7.849 -17.439 1.00 0.00 O ATOM 0 H SER A 131 -5.180 9.686 -15.620 1.00 0.00 H new ATOM 0 HA SER A 131 -6.482 9.810 -18.116 1.00 0.00 H new ATOM 0 HB2 SER A 131 -6.592 8.263 -15.782 1.00 0.00 H new ATOM 0 HB3 SER A 131 -8.158 9.048 -15.819 1.00 0.00 H new ATOM 0 HG SER A 131 -8.144 7.062 -17.016 1.00 0.00 H new ATOM 2016 N GLY A 132 -8.885 10.965 -17.287 1.00 0.00 N ATOM 2017 CA GLY A 132 -9.872 12.025 -17.217 1.00 0.00 C ATOM 2018 C GLY A 132 -11.147 11.587 -16.521 1.00 0.00 C ATOM 0 H GLY A 132 -9.244 10.067 -17.611 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -9.447 12.878 -16.687 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -10.110 12.362 -18.226 1.00 0.00 H new TER 2022 GLY A 132