USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 924 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 106 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 123 HIS : +bothHN:sc= 2.16 K(o=2.2,f=-10!) USER MOD Set 2.1: A 93 GLN :FLIP amide:sc= -0.17 F(o=-3.1!,f=-0.17) USER MOD Set 2.2: A 112 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 71 ASN : amide:sc= 0.231 X(o=0.11,f=0.6) USER MOD Set 3.2: A 72 THR OG1 : rot 180:sc= -0.117 USER MOD Set 4.1: A 69 ASN : amide:sc= 0.852 K(o=0.83,f=-0.55) USER MOD Set 4.2: A 74 LYS NZ :NH3+ 156:sc= -0.0185 (180deg=-0.166) USER MOD Set 5.1: A 56 GLN : amide:sc= -0.176 K(o=-0.19,f=-1.1) USER MOD Set 5.2: A 59 GLN : amide:sc= -0.0176 K(o=-0.19,f=-0.77) USER MOD Set 6.1: A 31 GLN : amide:sc= 0.115 K(o=-0.35,f=-0.88) USER MOD Set 6.2: A 33 SER OG : rot 120:sc= -0.464 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc=-0.00836 (180deg=-0.189) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0.123 USER MOD Single : A 5 MET CE :methyl 139:sc= -0.187 (180deg=-0.907) USER MOD Single : A 6 THR OG1 : rot 14:sc= 1.08 USER MOD Single : A 8 GLN : amide:sc= -0.0142 K(o=-0.014,f=-1.1) USER MOD Single : A 11 ASN : amide:sc= -0.273 K(o=-0.27,f=-2.8!) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.485 K(o=-0.49,f=-3.6!) USER MOD Single : A 20 ASN : amide:sc=-0.00481 X(o=-0.0048,f=0) USER MOD Single : A 26 ASN : amide:sc=-0.00934 K(o=-0.0093,f=-1.6!) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.142 X(o=-0.14,f=-0.38) USER MOD Single : A 32 ASN : amide:sc= -0.0924 K(o=-0.092,f=-2.1!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0114) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 SER OG : rot 88:sc= -0.832! USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -150:sc= 0 USER MOD Single : A 81 ASN : amide:sc= -0.194 K(o=-0.19,f=-3.8!) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN :FLIP amide:sc= -1.53 F(o=-2,f=-1.5) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 ASN : amide:sc= -0.647 K(o=-0.65,f=-2.8!) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -167:sc=-0.000231 (180deg=-0.126) USER MOD Single : A 103 THR OG1 : rot -61:sc= -1.28! USER MOD Single : A 105 GLN : amide:sc= -0.0636 X(o=-0.064,f=-0.046) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=-0.14) USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 ASN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 117 ASN :FLIP amide:sc= 0 F(o=-0.86,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 55:sc= 0.159 USER MOD Single : A 122 HIS : no HE2:sc= 0.487 K(o=0.49,f=-6.2!) USER MOD Single : A 124 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 126 HIS : no HE2:sc= 0.0242 K(o=0.024,f=-2.9) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -41.353 130.008 -13.985 1.00 0.00 N ATOM 2 CA MET A 1 -41.609 130.068 -15.443 1.00 52.33 C ATOM 3 C MET A 1 -40.319 129.801 -16.209 1.00 71.33 C ATOM 4 O MET A 1 -39.429 130.651 -16.255 1.00 1.24 O ATOM 5 CB MET A 1 -42.170 131.439 -15.837 1.00 2.44 C ATOM 6 CG MET A 1 -43.480 131.783 -15.152 1.00 75.50 C ATOM 7 SD MET A 1 -44.128 133.393 -15.643 1.00 21.34 S ATOM 8 CE MET A 1 -45.573 133.513 -14.588 1.00 13.04 C ATOM 0 H1 MET A 1 -42.258 129.970 -13.475 1.00 0.00 H new ATOM 0 H2 MET A 1 -40.796 129.158 -13.765 1.00 0.00 H new ATOM 0 H3 MET A 1 -40.825 130.854 -13.690 1.00 0.00 H new ATOM 0 HA MET A 1 -42.344 129.304 -15.696 1.00 52.33 H new ATOM 0 HB2 MET A 1 -41.433 132.206 -15.598 1.00 2.44 H new ATOM 0 HB3 MET A 1 -42.317 131.465 -16.917 1.00 2.44 H new ATOM 0 HG2 MET A 1 -44.218 131.014 -15.383 1.00 75.50 H new ATOM 0 HG3 MET A 1 -43.334 131.770 -14.072 1.00 75.50 H new ATOM 0 HE1 MET A 1 -46.083 134.458 -14.775 1.00 13.04 H new ATOM 0 HE2 MET A 1 -46.250 132.687 -14.803 1.00 13.04 H new ATOM 0 HE3 MET A 1 -45.266 133.467 -13.543 1.00 13.04 H new ATOM 20 N ALA A 2 -40.207 128.609 -16.782 1.00 12.30 N ATOM 21 CA ALA A 2 -39.014 128.223 -17.520 1.00 21.34 C ATOM 22 C ALA A 2 -39.369 127.374 -18.735 1.00 14.20 C ATOM 23 O ALA A 2 -40.101 126.388 -18.630 1.00 72.13 O ATOM 24 CB ALA A 2 -38.047 127.474 -16.611 1.00 74.23 C ATOM 0 H ALA A 2 -40.931 127.892 -16.749 1.00 12.30 H new ATOM 0 HA ALA A 2 -38.529 129.132 -17.876 1.00 21.34 H new ATOM 0 HB1 ALA A 2 -37.160 127.192 -17.178 1.00 74.23 H new ATOM 0 HB2 ALA A 2 -37.758 128.117 -15.779 1.00 74.23 H new ATOM 0 HB3 ALA A 2 -38.531 126.577 -16.225 1.00 74.23 H new ATOM 30 N GLY A 3 -38.843 127.771 -19.881 1.00 50.23 N ATOM 31 CA GLY A 3 -39.061 127.037 -21.108 1.00 65.14 C ATOM 32 C GLY A 3 -37.845 127.116 -22.005 1.00 23.21 C ATOM 33 O GLY A 3 -37.687 128.078 -22.761 1.00 32.24 O ATOM 0 H GLY A 3 -38.260 128.602 -19.984 1.00 50.23 H new ATOM 0 HA2 GLY A 3 -39.282 125.995 -20.879 1.00 65.14 H new ATOM 0 HA3 GLY A 3 -39.929 127.440 -21.629 1.00 65.14 H new ATOM 37 N THR A 4 -36.978 126.120 -21.911 1.00 43.32 N ATOM 38 CA THR A 4 -35.705 126.153 -22.609 1.00 31.21 C ATOM 39 C THR A 4 -35.878 125.938 -24.109 1.00 2.41 C ATOM 40 O THR A 4 -35.707 126.875 -24.895 1.00 63.23 O ATOM 41 CB THR A 4 -34.736 125.103 -22.040 1.00 4.31 C ATOM 42 OG1 THR A 4 -35.416 123.851 -21.880 1.00 72.25 O ATOM 43 CG2 THR A 4 -34.174 125.551 -20.700 1.00 71.44 C ATOM 0 H THR A 4 -37.134 125.278 -21.357 1.00 43.32 H new ATOM 0 HA THR A 4 -35.283 127.146 -22.453 1.00 31.21 H new ATOM 0 HB THR A 4 -33.909 124.986 -22.741 1.00 4.31 H new ATOM 0 HG1 THR A 4 -34.794 123.185 -21.519 1.00 72.25 H new ATOM 0 HG21 THR A 4 -33.492 124.791 -20.319 1.00 71.44 H new ATOM 0 HG22 THR A 4 -33.636 126.491 -20.827 1.00 71.44 H new ATOM 0 HG23 THR A 4 -34.991 125.693 -19.992 1.00 71.44 H new ATOM 51 N MET A 5 -36.231 124.708 -24.492 1.00 11.31 N ATOM 52 CA MET A 5 -36.378 124.330 -25.900 1.00 75.43 C ATOM 53 C MET A 5 -35.066 124.533 -26.657 1.00 15.13 C ATOM 54 O MET A 5 -34.021 124.759 -26.044 1.00 24.32 O ATOM 55 CB MET A 5 -37.501 125.132 -26.575 1.00 22.24 C ATOM 56 CG MET A 5 -38.878 124.901 -25.972 1.00 23.44 C ATOM 57 SD MET A 5 -40.181 125.753 -26.881 1.00 11.43 S ATOM 58 CE MET A 5 -40.052 124.949 -28.477 1.00 45.42 C ATOM 0 H MET A 5 -36.422 123.949 -23.838 1.00 11.31 H new ATOM 0 HA MET A 5 -36.642 123.273 -25.930 1.00 75.43 H new ATOM 0 HB2 MET A 5 -37.262 126.194 -26.513 1.00 22.24 H new ATOM 0 HB3 MET A 5 -37.532 124.874 -27.633 1.00 22.24 H new ATOM 0 HG2 MET A 5 -39.090 123.832 -25.956 1.00 23.44 H new ATOM 0 HG3 MET A 5 -38.879 125.241 -24.937 1.00 23.44 H new ATOM 0 HE1 MET A 5 -41.051 124.758 -28.870 1.00 45.42 H new ATOM 0 HE2 MET A 5 -39.508 125.595 -29.167 1.00 45.42 H new ATOM 0 HE3 MET A 5 -39.518 124.005 -28.367 1.00 45.42 H new ATOM 68 N THR A 6 -35.135 124.427 -27.984 1.00 41.42 N ATOM 69 CA THR A 6 -33.995 124.658 -28.879 1.00 43.12 C ATOM 70 C THR A 6 -32.766 123.829 -28.492 1.00 64.43 C ATOM 71 O THR A 6 -31.946 124.243 -27.666 1.00 60.42 O ATOM 72 CB THR A 6 -33.614 126.159 -28.968 1.00 74.21 C ATOM 73 OG1 THR A 6 -33.290 126.686 -27.673 1.00 54.11 O ATOM 74 CG2 THR A 6 -34.750 126.970 -29.570 1.00 62.12 C ATOM 0 H THR A 6 -35.993 124.176 -28.476 1.00 41.42 H new ATOM 0 HA THR A 6 -34.327 124.329 -29.864 1.00 43.12 H new ATOM 0 HB THR A 6 -32.738 126.235 -29.612 1.00 74.21 H new ATOM 0 HG1 THR A 6 -33.160 125.947 -27.042 1.00 54.11 H new ATOM 0 HG21 THR A 6 -34.460 128.019 -29.622 1.00 62.12 H new ATOM 0 HG22 THR A 6 -34.967 126.603 -30.573 1.00 62.12 H new ATOM 0 HG23 THR A 6 -35.639 126.870 -28.947 1.00 62.12 H new ATOM 82 N PHE A 7 -32.642 122.655 -29.091 1.00 42.33 N ATOM 83 CA PHE A 7 -31.511 121.785 -28.808 1.00 74.33 C ATOM 84 C PHE A 7 -30.267 122.312 -29.515 1.00 63.13 C ATOM 85 O PHE A 7 -30.358 122.893 -30.598 1.00 64.35 O ATOM 86 CB PHE A 7 -31.807 120.340 -29.239 1.00 24.13 C ATOM 87 CG PHE A 7 -31.738 120.103 -30.724 1.00 71.12 C ATOM 88 CD1 PHE A 7 -30.636 119.474 -31.281 1.00 75.04 C ATOM 89 CD2 PHE A 7 -32.767 120.505 -31.558 1.00 54.44 C ATOM 90 CE1 PHE A 7 -30.561 119.251 -32.642 1.00 24.44 C ATOM 91 CE2 PHE A 7 -32.697 120.285 -32.921 1.00 13.11 C ATOM 92 CZ PHE A 7 -31.593 119.657 -33.463 1.00 63.23 C ATOM 0 H PHE A 7 -33.305 122.284 -29.771 1.00 42.33 H new ATOM 0 HA PHE A 7 -31.334 121.781 -27.732 1.00 74.33 H new ATOM 0 HB2 PHE A 7 -31.099 119.675 -28.745 1.00 24.13 H new ATOM 0 HB3 PHE A 7 -32.801 120.066 -28.886 1.00 24.13 H new ATOM 0 HD1 PHE A 7 -29.826 119.154 -30.643 1.00 75.04 H new ATOM 0 HD2 PHE A 7 -33.633 120.996 -31.140 1.00 54.44 H new ATOM 0 HE1 PHE A 7 -29.696 118.760 -33.063 1.00 24.44 H new ATOM 0 HE2 PHE A 7 -33.506 120.604 -33.562 1.00 13.11 H new ATOM 0 HZ PHE A 7 -31.537 119.484 -34.528 1.00 63.23 H new ATOM 102 N GLN A 8 -29.113 122.140 -28.890 1.00 31.11 N ATOM 103 CA GLN A 8 -27.863 122.580 -29.485 1.00 22.32 C ATOM 104 C GLN A 8 -26.705 121.680 -29.063 1.00 73.41 C ATOM 105 O GLN A 8 -26.116 121.850 -27.995 1.00 70.13 O ATOM 106 CB GLN A 8 -27.583 124.047 -29.138 1.00 44.31 C ATOM 107 CG GLN A 8 -27.705 124.382 -27.657 1.00 2.34 C ATOM 108 CD GLN A 8 -27.641 125.874 -27.402 1.00 35.43 C ATOM 109 OE1 GLN A 8 -28.070 126.673 -28.234 1.00 50.31 O ATOM 110 NE2 GLN A 8 -27.110 126.263 -26.255 1.00 14.45 N ATOM 0 H GLN A 8 -29.017 121.701 -27.975 1.00 31.11 H new ATOM 0 HA GLN A 8 -27.959 122.504 -30.568 1.00 22.32 H new ATOM 0 HB2 GLN A 8 -26.577 124.300 -29.473 1.00 44.31 H new ATOM 0 HB3 GLN A 8 -28.274 124.678 -29.698 1.00 44.31 H new ATOM 0 HG2 GLN A 8 -28.647 123.989 -27.274 1.00 2.34 H new ATOM 0 HG3 GLN A 8 -26.905 123.886 -27.107 1.00 2.34 H new ATOM 0 HE21 GLN A 8 -26.765 125.569 -25.591 1.00 14.45 H new ATOM 0 HE22 GLN A 8 -27.045 127.257 -26.034 1.00 14.45 H new ATOM 119 N PHE A 9 -26.417 120.700 -29.906 1.00 73.24 N ATOM 120 CA PHE A 9 -25.328 119.762 -29.681 1.00 4.13 C ATOM 121 C PHE A 9 -25.061 118.977 -30.960 1.00 32.53 C ATOM 122 O PHE A 9 -25.959 118.797 -31.784 1.00 20.24 O ATOM 123 CB PHE A 9 -25.642 118.806 -28.515 1.00 55.13 C ATOM 124 CG PHE A 9 -26.946 118.068 -28.644 1.00 3.12 C ATOM 125 CD1 PHE A 9 -27.023 116.878 -29.349 1.00 54.02 C ATOM 126 CD2 PHE A 9 -28.095 118.563 -28.047 1.00 53.11 C ATOM 127 CE1 PHE A 9 -28.221 116.198 -29.457 1.00 4.52 C ATOM 128 CE2 PHE A 9 -29.295 117.888 -28.154 1.00 31.40 C ATOM 129 CZ PHE A 9 -29.359 116.703 -28.859 1.00 63.11 C ATOM 0 H PHE A 9 -26.934 120.532 -30.769 1.00 73.24 H new ATOM 0 HA PHE A 9 -24.436 120.326 -29.409 1.00 4.13 H new ATOM 0 HB2 PHE A 9 -24.835 118.078 -28.432 1.00 55.13 H new ATOM 0 HB3 PHE A 9 -25.653 119.377 -27.587 1.00 55.13 H new ATOM 0 HD1 PHE A 9 -26.137 116.477 -29.819 1.00 54.02 H new ATOM 0 HD2 PHE A 9 -28.051 119.488 -27.491 1.00 53.11 H new ATOM 0 HE1 PHE A 9 -28.268 115.271 -30.009 1.00 4.52 H new ATOM 0 HE2 PHE A 9 -30.183 118.287 -27.686 1.00 31.40 H new ATOM 0 HZ PHE A 9 -30.296 116.172 -28.943 1.00 63.11 H new ATOM 139 N ARG A 10 -23.825 118.543 -31.138 1.00 62.51 N ATOM 140 CA ARG A 10 -23.450 117.780 -32.320 1.00 44.32 C ATOM 141 C ARG A 10 -23.196 116.323 -31.961 1.00 21.34 C ATOM 142 O ARG A 10 -24.038 115.457 -32.208 1.00 35.21 O ATOM 143 CB ARG A 10 -22.199 118.376 -32.974 1.00 21.20 C ATOM 144 CG ARG A 10 -22.414 119.746 -33.596 1.00 72.03 C ATOM 145 CD ARG A 10 -23.376 119.683 -34.772 1.00 53.43 C ATOM 146 NE ARG A 10 -23.463 120.962 -35.476 1.00 61.25 N ATOM 147 CZ ARG A 10 -23.969 121.110 -36.702 1.00 52.03 C ATOM 148 NH1 ARG A 10 -24.449 120.063 -37.362 1.00 11.40 N1+ ATOM 149 NH2 ARG A 10 -24.002 122.308 -37.269 1.00 60.33 N ATOM 0 H ARG A 10 -23.063 118.705 -30.480 1.00 62.51 H new ATOM 0 HA ARG A 10 -24.277 117.831 -33.028 1.00 44.32 H new ATOM 0 HB2 ARG A 10 -21.411 118.449 -32.225 1.00 21.20 H new ATOM 0 HB3 ARG A 10 -21.844 117.691 -33.744 1.00 21.20 H new ATOM 0 HG2 ARG A 10 -22.804 120.431 -32.843 1.00 72.03 H new ATOM 0 HG3 ARG A 10 -21.458 120.149 -33.929 1.00 72.03 H new ATOM 0 HD2 ARG A 10 -23.050 118.908 -35.466 1.00 53.43 H new ATOM 0 HD3 ARG A 10 -24.366 119.397 -34.416 1.00 53.43 H new ATOM 0 HE ARG A 10 -23.115 121.794 -35.000 1.00 61.25 H new ATOM 0 HH11 ARG A 10 -24.433 119.138 -36.932 1.00 11.40 H new ATOM 0 HH12 ARG A 10 -24.834 120.183 -38.299 1.00 11.40 H new ATOM 0 HH21 ARG A 10 -23.640 123.119 -36.768 1.00 60.33 H new ATOM 0 HH22 ARG A 10 -24.389 122.418 -38.206 1.00 60.33 H new ATOM 163 N ASN A 11 -22.033 116.077 -31.357 1.00 4.11 N ATOM 164 CA ASN A 11 -21.616 114.733 -30.955 1.00 44.33 C ATOM 165 C ASN A 11 -21.679 113.764 -32.138 1.00 62.55 C ATOM 166 O ASN A 11 -22.482 112.827 -32.143 1.00 3.33 O ATOM 167 CB ASN A 11 -22.482 114.224 -29.795 1.00 42.41 C ATOM 168 CG ASN A 11 -22.332 115.059 -28.532 1.00 62.50 C ATOM 169 OD1 ASN A 11 -22.039 116.256 -28.589 1.00 63.14 O ATOM 170 ND2 ASN A 11 -22.545 114.439 -27.383 1.00 43.24 N ATOM 0 H ASN A 11 -21.353 116.804 -31.133 1.00 4.11 H new ATOM 0 HA ASN A 11 -20.581 114.787 -30.616 1.00 44.33 H new ATOM 0 HB2 ASN A 11 -23.528 114.224 -30.102 1.00 42.41 H new ATOM 0 HB3 ASN A 11 -22.214 113.191 -29.575 1.00 42.41 H new ATOM 0 HD21 ASN A 11 -22.469 114.952 -26.505 1.00 43.24 H new ATOM 0 HD22 ASN A 11 -22.785 113.448 -27.375 1.00 43.24 H new ATOM 177 N PRO A 12 -20.838 113.988 -33.166 1.00 71.33 N ATOM 178 CA PRO A 12 -20.854 113.193 -34.393 1.00 34.14 C ATOM 179 C PRO A 12 -20.211 111.827 -34.209 1.00 51.42 C ATOM 180 O PRO A 12 -20.638 110.851 -34.824 1.00 63.23 O ATOM 181 CB PRO A 12 -20.041 114.031 -35.396 1.00 5.44 C ATOM 182 CG PRO A 12 -19.734 115.319 -34.699 1.00 13.40 C ATOM 183 CD PRO A 12 -19.813 115.034 -33.230 1.00 22.12 C ATOM 0 HA PRO A 12 -21.874 112.991 -34.720 1.00 34.14 H new ATOM 0 HB2 PRO A 12 -19.125 113.515 -35.685 1.00 5.44 H new ATOM 0 HB3 PRO A 12 -20.609 114.207 -36.309 1.00 5.44 H new ATOM 0 HG2 PRO A 12 -18.743 115.681 -34.972 1.00 13.40 H new ATOM 0 HG3 PRO A 12 -20.446 116.094 -34.983 1.00 13.40 H new ATOM 0 HD2 PRO A 12 -18.858 114.692 -32.831 1.00 22.12 H new ATOM 0 HD3 PRO A 12 -20.099 115.918 -32.660 1.00 22.12 H new ATOM 191 N ASN A 13 -19.199 111.773 -33.342 1.00 41.30 N ATOM 192 CA ASN A 13 -18.395 110.566 -33.130 1.00 75.43 C ATOM 193 C ASN A 13 -17.559 110.235 -34.358 1.00 53.44 C ATOM 194 O ASN A 13 -18.081 109.899 -35.420 1.00 60.03 O ATOM 195 CB ASN A 13 -19.257 109.363 -32.728 1.00 5.35 C ATOM 196 CG ASN A 13 -19.361 109.212 -31.225 1.00 12.51 C ATOM 197 OD1 ASN A 13 -20.234 109.799 -30.588 1.00 74.54 O ATOM 198 ND2 ASN A 13 -18.480 108.408 -30.651 1.00 31.22 N ATOM 0 H ASN A 13 -18.913 112.565 -32.766 1.00 41.30 H new ATOM 0 HA ASN A 13 -17.720 110.780 -32.301 1.00 75.43 H new ATOM 0 HB2 ASN A 13 -20.256 109.476 -33.150 1.00 5.35 H new ATOM 0 HB3 ASN A 13 -18.832 108.454 -33.154 1.00 5.35 H new ATOM 0 HD21 ASN A 13 -18.509 108.256 -29.643 1.00 31.22 H new ATOM 0 HD22 ASN A 13 -17.772 107.940 -31.217 1.00 31.22 H new ATOM 205 N PHE A 14 -16.251 110.338 -34.202 1.00 62.35 N ATOM 206 CA PHE A 14 -15.323 110.085 -35.290 1.00 0.14 C ATOM 207 C PHE A 14 -14.054 109.447 -34.741 1.00 75.23 C ATOM 208 O PHE A 14 -13.905 109.303 -33.527 1.00 23.43 O ATOM 209 CB PHE A 14 -14.995 111.388 -36.039 1.00 41.22 C ATOM 210 CG PHE A 14 -14.493 112.497 -35.152 1.00 21.33 C ATOM 211 CD1 PHE A 14 -15.381 113.347 -34.509 1.00 5.43 C ATOM 212 CD2 PHE A 14 -13.133 112.691 -34.961 1.00 23.12 C ATOM 213 CE1 PHE A 14 -14.922 114.365 -33.694 1.00 32.32 C ATOM 214 CE2 PHE A 14 -12.670 113.708 -34.146 1.00 54.41 C ATOM 215 CZ PHE A 14 -13.566 114.547 -33.511 1.00 3.14 C ATOM 0 H PHE A 14 -15.804 110.598 -33.323 1.00 62.35 H new ATOM 0 HA PHE A 14 -15.787 109.399 -35.999 1.00 0.14 H new ATOM 0 HB2 PHE A 14 -14.244 111.178 -36.800 1.00 41.22 H new ATOM 0 HB3 PHE A 14 -15.889 111.730 -36.560 1.00 41.22 H new ATOM 0 HD1 PHE A 14 -16.444 113.212 -34.647 1.00 5.43 H new ATOM 0 HD2 PHE A 14 -12.427 112.040 -35.455 1.00 23.12 H new ATOM 0 HE1 PHE A 14 -15.625 115.019 -33.200 1.00 32.32 H new ATOM 0 HE2 PHE A 14 -11.608 113.847 -34.006 1.00 54.41 H new ATOM 0 HZ PHE A 14 -13.207 115.342 -32.874 1.00 3.14 H new ATOM 225 N GLY A 15 -13.145 109.072 -35.628 1.00 54.15 N ATOM 226 CA GLY A 15 -11.923 108.426 -35.202 1.00 71.23 C ATOM 227 C GLY A 15 -11.913 106.950 -35.540 1.00 65.22 C ATOM 228 O GLY A 15 -12.598 106.518 -36.470 1.00 42.44 O ATOM 0 H GLY A 15 -13.232 109.204 -36.636 1.00 54.15 H new ATOM 0 HA2 GLY A 15 -11.071 108.912 -35.677 1.00 71.23 H new ATOM 0 HA3 GLY A 15 -11.802 108.552 -34.126 1.00 71.23 H new ATOM 232 N GLY A 16 -11.152 106.174 -34.779 1.00 14.53 N ATOM 233 CA GLY A 16 -11.041 104.752 -35.042 1.00 0.24 C ATOM 234 C GLY A 16 -9.880 104.442 -35.959 1.00 22.35 C ATOM 235 O GLY A 16 -10.008 104.516 -37.182 1.00 73.33 O ATOM 0 H GLY A 16 -10.608 106.505 -33.982 1.00 14.53 H new ATOM 0 HA2 GLY A 16 -10.914 104.217 -34.101 1.00 0.24 H new ATOM 0 HA3 GLY A 16 -11.966 104.392 -35.492 1.00 0.24 H new ATOM 239 N ASN A 17 -8.744 104.104 -35.376 1.00 43.33 N ATOM 240 CA ASN A 17 -7.540 103.851 -36.153 1.00 1.12 C ATOM 241 C ASN A 17 -7.429 102.374 -36.507 1.00 62.33 C ATOM 242 O ASN A 17 -7.812 101.509 -35.716 1.00 61.32 O ATOM 243 CB ASN A 17 -6.292 104.287 -35.378 1.00 21.55 C ATOM 244 CG ASN A 17 -6.284 105.771 -35.053 1.00 72.14 C ATOM 245 OD1 ASN A 17 -5.801 106.590 -35.836 1.00 51.22 O ATOM 246 ND2 ASN A 17 -6.813 106.124 -33.890 1.00 0.34 N ATOM 0 H ASN A 17 -8.628 103.998 -34.368 1.00 43.33 H new ATOM 0 HA ASN A 17 -7.608 104.433 -37.072 1.00 1.12 H new ATOM 0 HB2 ASN A 17 -6.229 103.717 -34.451 1.00 21.55 H new ATOM 0 HB3 ASN A 17 -5.405 104.044 -35.962 1.00 21.55 H new ATOM 0 HD21 ASN A 17 -6.830 107.106 -33.615 1.00 0.34 H new ATOM 0 HD22 ASN A 17 -7.203 105.414 -33.270 1.00 0.34 H new ATOM 253 N PRO A 18 -6.912 102.066 -37.701 1.00 24.35 N ATOM 254 CA PRO A 18 -6.691 100.688 -38.128 1.00 21.23 C ATOM 255 C PRO A 18 -5.444 100.078 -37.491 1.00 14.44 C ATOM 256 O PRO A 18 -4.486 100.782 -37.165 1.00 61.41 O ATOM 257 CB PRO A 18 -6.516 100.817 -39.641 1.00 45.30 C ATOM 258 CG PRO A 18 -5.953 102.181 -39.842 1.00 32.23 C ATOM 259 CD PRO A 18 -6.514 103.039 -38.737 1.00 15.21 C ATOM 0 HA PRO A 18 -7.508 100.029 -37.834 1.00 21.23 H new ATOM 0 HB2 PRO A 18 -5.845 100.051 -40.029 1.00 45.30 H new ATOM 0 HB3 PRO A 18 -7.467 100.701 -40.161 1.00 45.30 H new ATOM 0 HG2 PRO A 18 -4.864 102.161 -39.804 1.00 32.23 H new ATOM 0 HG3 PRO A 18 -6.230 102.576 -40.819 1.00 32.23 H new ATOM 0 HD2 PRO A 18 -5.771 103.742 -38.361 1.00 15.21 H new ATOM 0 HD3 PRO A 18 -7.365 103.628 -39.081 1.00 15.21 H new ATOM 267 N ASN A 19 -5.473 98.774 -37.294 1.00 23.42 N ATOM 268 CA ASN A 19 -4.320 98.052 -36.779 1.00 64.52 C ATOM 269 C ASN A 19 -4.204 96.711 -37.487 1.00 63.24 C ATOM 270 O ASN A 19 -4.904 95.753 -37.153 1.00 74.52 O ATOM 271 CB ASN A 19 -4.431 97.857 -35.259 1.00 34.52 C ATOM 272 CG ASN A 19 -3.171 97.272 -34.629 1.00 65.20 C ATOM 273 OD1 ASN A 19 -2.435 96.499 -35.248 1.00 30.24 O ATOM 274 ND2 ASN A 19 -2.909 97.644 -33.385 1.00 44.43 N ATOM 0 H ASN A 19 -6.286 98.188 -37.483 1.00 23.42 H new ATOM 0 HA ASN A 19 -3.420 98.636 -36.973 1.00 64.52 H new ATOM 0 HB2 ASN A 19 -4.649 98.817 -34.792 1.00 34.52 H new ATOM 0 HB3 ASN A 19 -5.274 97.200 -35.045 1.00 34.52 H new ATOM 0 HD21 ASN A 19 -2.078 97.290 -32.911 1.00 44.43 H new ATOM 0 HD22 ASN A 19 -3.538 98.285 -32.901 1.00 44.43 H new ATOM 281 N ASN A 20 -3.339 96.656 -38.485 1.00 0.34 N ATOM 282 CA ASN A 20 -3.153 95.443 -39.262 1.00 2.02 C ATOM 283 C ASN A 20 -1.673 95.157 -39.448 1.00 40.34 C ATOM 284 O ASN A 20 -0.859 96.079 -39.551 1.00 74.24 O ATOM 285 CB ASN A 20 -3.852 95.558 -40.623 1.00 1.51 C ATOM 286 CG ASN A 20 -3.279 96.665 -41.495 1.00 51.11 C ATOM 287 OD1 ASN A 20 -3.691 97.821 -41.398 1.00 52.43 O ATOM 288 ND2 ASN A 20 -2.352 96.317 -42.372 1.00 2.01 N ATOM 0 H ASN A 20 -2.754 97.439 -38.777 1.00 0.34 H new ATOM 0 HA ASN A 20 -3.602 94.613 -38.716 1.00 2.02 H new ATOM 0 HB2 ASN A 20 -3.767 94.608 -41.150 1.00 1.51 H new ATOM 0 HB3 ASN A 20 -4.915 95.741 -40.465 1.00 1.51 H new ATOM 0 HD21 ASN A 20 -1.953 97.017 -42.998 1.00 2.01 H new ATOM 0 HD22 ASN A 20 -2.036 95.349 -42.423 1.00 2.01 H new ATOM 295 N GLY A 21 -1.331 93.884 -39.465 1.00 62.44 N ATOM 296 CA GLY A 21 0.042 93.476 -39.645 1.00 13.55 C ATOM 297 C GLY A 21 0.129 92.019 -40.026 1.00 0.45 C ATOM 298 O GLY A 21 -0.897 91.389 -40.299 1.00 25.41 O ATOM 0 H GLY A 21 -1.991 93.114 -39.356 1.00 62.44 H new ATOM 0 HA2 GLY A 21 0.508 94.086 -40.419 1.00 13.55 H new ATOM 0 HA3 GLY A 21 0.600 93.649 -38.725 1.00 13.55 H new ATOM 302 N ALA A 22 1.335 91.474 -40.048 1.00 11.14 N ATOM 303 CA ALA A 22 1.527 90.078 -40.407 1.00 24.15 C ATOM 304 C ALA A 22 2.771 89.501 -39.743 1.00 21.32 C ATOM 305 O ALA A 22 3.896 89.800 -40.147 1.00 64.10 O ATOM 306 CB ALA A 22 1.621 89.930 -41.921 1.00 21.11 C ATOM 0 H ALA A 22 2.194 91.976 -39.822 1.00 11.14 H new ATOM 0 HA ALA A 22 0.664 89.518 -40.048 1.00 24.15 H new ATOM 0 HB1 ALA A 22 1.765 88.880 -42.176 1.00 21.11 H new ATOM 0 HB2 ALA A 22 0.701 90.292 -42.380 1.00 21.11 H new ATOM 0 HB3 ALA A 22 2.465 90.512 -42.292 1.00 21.11 H new ATOM 312 N PHE A 23 2.561 88.696 -38.711 1.00 32.04 N ATOM 313 CA PHE A 23 3.651 88.002 -38.040 1.00 53.22 C ATOM 314 C PHE A 23 3.534 86.503 -38.288 1.00 65.32 C ATOM 315 O PHE A 23 2.527 85.888 -37.938 1.00 62.34 O ATOM 316 CB PHE A 23 3.627 88.296 -36.535 1.00 65.22 C ATOM 317 CG PHE A 23 4.727 87.624 -35.762 1.00 71.25 C ATOM 318 CD1 PHE A 23 4.484 86.449 -35.064 1.00 53.43 C ATOM 319 CD2 PHE A 23 5.999 88.167 -35.730 1.00 21.43 C ATOM 320 CE1 PHE A 23 5.493 85.833 -34.350 1.00 0.12 C ATOM 321 CE2 PHE A 23 7.012 87.553 -35.017 1.00 3.24 C ATOM 322 CZ PHE A 23 6.757 86.385 -34.326 1.00 64.54 C ATOM 0 H PHE A 23 1.639 88.507 -38.318 1.00 32.04 H new ATOM 0 HA PHE A 23 4.599 88.358 -38.443 1.00 53.22 H new ATOM 0 HB2 PHE A 23 3.697 89.373 -36.385 1.00 65.22 H new ATOM 0 HB3 PHE A 23 2.666 87.980 -36.129 1.00 65.22 H new ATOM 0 HD1 PHE A 23 3.496 86.012 -35.079 1.00 53.43 H new ATOM 0 HD2 PHE A 23 6.203 89.081 -36.268 1.00 21.43 H new ATOM 0 HE1 PHE A 23 5.292 84.919 -33.810 1.00 0.12 H new ATOM 0 HE2 PHE A 23 8.001 87.986 -35.001 1.00 3.24 H new ATOM 0 HZ PHE A 23 7.546 85.904 -33.767 1.00 64.54 H new ATOM 332 N LEU A 24 4.551 85.924 -38.912 1.00 53.34 N ATOM 333 CA LEU A 24 4.546 84.500 -39.220 1.00 51.34 C ATOM 334 C LEU A 24 5.822 83.849 -38.701 1.00 45.44 C ATOM 335 O LEU A 24 6.734 84.552 -38.261 1.00 10.11 O ATOM 336 CB LEU A 24 4.415 84.253 -40.735 1.00 62.32 C ATOM 337 CG LEU A 24 3.121 84.760 -41.392 1.00 3.14 C ATOM 338 CD1 LEU A 24 3.204 86.251 -41.685 1.00 23.03 C ATOM 339 CD2 LEU A 24 2.831 83.983 -42.667 1.00 11.23 C ATOM 0 H LEU A 24 5.390 86.418 -39.215 1.00 53.34 H new ATOM 0 HA LEU A 24 3.682 84.054 -38.727 1.00 51.34 H new ATOM 0 HB2 LEU A 24 5.261 84.725 -41.234 1.00 62.32 H new ATOM 0 HB3 LEU A 24 4.495 83.181 -40.916 1.00 62.32 H new ATOM 0 HG LEU A 24 2.302 84.598 -40.691 1.00 3.14 H new ATOM 0 HD11 LEU A 24 2.275 86.583 -42.149 1.00 23.03 H new ATOM 0 HD12 LEU A 24 3.359 86.797 -40.754 1.00 23.03 H new ATOM 0 HD13 LEU A 24 4.037 86.443 -42.361 1.00 23.03 H new ATOM 0 HD21 LEU A 24 1.911 84.355 -43.119 1.00 11.23 H new ATOM 0 HD22 LEU A 24 3.657 84.111 -43.367 1.00 11.23 H new ATOM 0 HD23 LEU A 24 2.717 82.925 -42.430 1.00 11.23 H new ATOM 351 N LEU A 25 5.867 82.510 -38.770 1.00 14.23 N ATOM 352 CA LEU A 25 7.006 81.689 -38.317 1.00 22.42 C ATOM 353 C LEU A 25 7.508 82.086 -36.925 1.00 42.44 C ATOM 354 O LEU A 25 6.827 82.793 -36.179 1.00 41.32 O ATOM 355 CB LEU A 25 8.166 81.694 -39.338 1.00 52.44 C ATOM 356 CG LEU A 25 8.813 83.050 -39.652 1.00 3.52 C ATOM 357 CD1 LEU A 25 10.327 82.916 -39.709 1.00 35.34 C ATOM 358 CD2 LEU A 25 8.288 83.597 -40.974 1.00 34.05 C ATOM 0 H LEU A 25 5.100 81.955 -39.149 1.00 14.23 H new ATOM 0 HA LEU A 25 6.625 80.670 -38.243 1.00 22.42 H new ATOM 0 HB2 LEU A 25 8.944 81.025 -38.970 1.00 52.44 H new ATOM 0 HB3 LEU A 25 7.797 81.271 -40.272 1.00 52.44 H new ATOM 0 HG LEU A 25 8.552 83.747 -38.855 1.00 3.52 H new ATOM 0 HD11 LEU A 25 10.770 83.886 -39.933 1.00 35.34 H new ATOM 0 HD12 LEU A 25 10.697 82.561 -38.747 1.00 35.34 H new ATOM 0 HD13 LEU A 25 10.600 82.204 -40.488 1.00 35.34 H new ATOM 0 HD21 LEU A 25 8.757 84.559 -41.182 1.00 34.05 H new ATOM 0 HD22 LEU A 25 8.524 82.898 -41.776 1.00 34.05 H new ATOM 0 HD23 LEU A 25 7.208 83.726 -40.911 1.00 34.05 H new ATOM 370 N ASN A 26 8.675 81.567 -36.559 1.00 73.20 N ATOM 371 CA ASN A 26 9.312 81.900 -35.290 1.00 60.40 C ATOM 372 C ASN A 26 10.762 81.429 -35.304 1.00 55.24 C ATOM 373 O ASN A 26 11.164 80.661 -36.181 1.00 70.31 O ATOM 374 CB ASN A 26 8.568 81.275 -34.096 1.00 52.12 C ATOM 375 CG ASN A 26 8.676 79.756 -34.030 1.00 31.52 C ATOM 376 OD1 ASN A 26 8.772 79.074 -35.052 1.00 61.41 O ATOM 377 ND2 ASN A 26 8.663 79.211 -32.821 1.00 0.40 N ATOM 0 H ASN A 26 9.204 80.907 -37.130 1.00 73.20 H new ATOM 0 HA ASN A 26 9.276 82.983 -35.171 1.00 60.40 H new ATOM 0 HB2 ASN A 26 8.962 81.698 -33.172 1.00 52.12 H new ATOM 0 HB3 ASN A 26 7.515 81.553 -34.150 1.00 52.12 H new ATOM 0 HD21 ASN A 26 8.734 78.199 -32.717 1.00 0.40 H new ATOM 0 HD22 ASN A 26 8.582 79.804 -31.995 1.00 0.40 H new ATOM 384 N SER A 27 11.540 81.893 -34.342 1.00 41.42 N ATOM 385 CA SER A 27 12.934 81.503 -34.236 1.00 71.35 C ATOM 386 C SER A 27 13.189 80.800 -32.903 1.00 32.44 C ATOM 387 O SER A 27 12.411 80.948 -31.957 1.00 10.41 O ATOM 388 CB SER A 27 13.832 82.734 -34.393 1.00 30.22 C ATOM 389 OG SER A 27 13.359 83.814 -33.604 1.00 62.34 O ATOM 0 H SER A 27 11.228 82.543 -33.621 1.00 41.42 H new ATOM 0 HA SER A 27 13.172 80.801 -35.035 1.00 71.35 H new ATOM 0 HB2 SER A 27 14.852 82.484 -34.100 1.00 30.22 H new ATOM 0 HB3 SER A 27 13.866 83.032 -35.441 1.00 30.22 H new ATOM 0 HG SER A 27 13.950 84.587 -33.720 1.00 62.34 H new ATOM 395 N ALA A 28 14.266 80.027 -32.840 1.00 11.40 N ATOM 396 CA ALA A 28 14.606 79.283 -31.632 1.00 74.12 C ATOM 397 C ALA A 28 16.101 78.996 -31.575 1.00 32.20 C ATOM 398 O ALA A 28 16.706 78.596 -32.572 1.00 40.33 O ATOM 399 CB ALA A 28 13.818 77.983 -31.568 1.00 11.11 C ATOM 0 H ALA A 28 14.920 79.898 -33.612 1.00 11.40 H new ATOM 0 HA ALA A 28 14.341 79.896 -30.771 1.00 74.12 H new ATOM 0 HB1 ALA A 28 14.084 77.441 -30.661 1.00 11.11 H new ATOM 0 HB2 ALA A 28 12.751 78.205 -31.559 1.00 11.11 H new ATOM 0 HB3 ALA A 28 14.054 77.371 -32.439 1.00 11.11 H new ATOM 405 N GLN A 29 16.691 79.207 -30.411 1.00 51.32 N ATOM 406 CA GLN A 29 18.111 78.960 -30.211 1.00 50.44 C ATOM 407 C GLN A 29 18.330 77.790 -29.260 1.00 51.32 C ATOM 408 O GLN A 29 18.509 76.652 -29.695 1.00 65.31 O ATOM 409 CB GLN A 29 18.797 80.210 -29.659 1.00 25.01 C ATOM 410 CG GLN A 29 19.211 81.211 -30.721 1.00 22.41 C ATOM 411 CD GLN A 29 20.322 80.678 -31.603 1.00 13.34 C ATOM 412 OE1 GLN A 29 20.075 80.105 -32.666 1.00 43.24 O ATOM 413 NE2 GLN A 29 21.554 80.837 -31.150 1.00 45.43 N ATOM 0 H GLN A 29 16.205 79.552 -29.583 1.00 51.32 H new ATOM 0 HA GLN A 29 18.548 78.710 -31.178 1.00 50.44 H new ATOM 0 HB2 GLN A 29 18.123 80.700 -28.956 1.00 25.01 H new ATOM 0 HB3 GLN A 29 19.680 79.908 -29.096 1.00 25.01 H new ATOM 0 HG2 GLN A 29 18.348 81.463 -31.338 1.00 22.41 H new ATOM 0 HG3 GLN A 29 19.540 82.133 -30.241 1.00 22.41 H new ATOM 0 HE21 GLN A 29 21.714 81.318 -30.265 1.00 45.43 H new ATOM 0 HE22 GLN A 29 22.345 80.479 -31.686 1.00 45.43 H new ATOM 422 N ALA A 30 18.286 78.079 -27.965 1.00 32.35 N ATOM 423 CA ALA A 30 18.522 77.084 -26.928 1.00 75.25 C ATOM 424 C ALA A 30 18.317 77.717 -25.562 1.00 2.24 C ATOM 425 O ALA A 30 18.080 78.922 -25.464 1.00 44.53 O ATOM 426 CB ALA A 30 19.933 76.515 -27.035 1.00 53.52 C ATOM 0 H ALA A 30 18.085 79.012 -27.605 1.00 32.35 H new ATOM 0 HA ALA A 30 17.814 76.265 -27.060 1.00 75.25 H new ATOM 0 HB1 ALA A 30 20.087 75.774 -26.251 1.00 53.52 H new ATOM 0 HB2 ALA A 30 20.063 76.044 -28.010 1.00 53.52 H new ATOM 0 HB3 ALA A 30 20.659 77.320 -26.921 1.00 53.52 H new ATOM 432 N GLN A 31 18.402 76.914 -24.517 1.00 62.43 N ATOM 433 CA GLN A 31 18.294 77.427 -23.161 1.00 45.15 C ATOM 434 C GLN A 31 19.632 77.304 -22.438 1.00 11.34 C ATOM 435 O GLN A 31 20.295 76.266 -22.511 1.00 33.30 O ATOM 436 CB GLN A 31 17.205 76.687 -22.376 1.00 15.14 C ATOM 437 CG GLN A 31 17.507 75.213 -22.140 1.00 52.33 C ATOM 438 CD GLN A 31 16.515 74.551 -21.203 1.00 4.22 C ATOM 439 OE1 GLN A 31 15.338 74.906 -21.176 1.00 75.53 O ATOM 440 NE2 GLN A 31 16.988 73.599 -20.413 1.00 5.45 N ATOM 0 H GLN A 31 18.545 75.906 -24.579 1.00 62.43 H new ATOM 0 HA GLN A 31 18.017 78.480 -23.222 1.00 45.15 H new ATOM 0 HB2 GLN A 31 17.068 77.178 -21.413 1.00 15.14 H new ATOM 0 HB3 GLN A 31 16.261 76.773 -22.915 1.00 15.14 H new ATOM 0 HG2 GLN A 31 17.502 74.689 -23.096 1.00 52.33 H new ATOM 0 HG3 GLN A 31 18.511 75.114 -21.727 1.00 52.33 H new ATOM 0 HE21 GLN A 31 17.971 73.334 -20.467 1.00 5.45 H new ATOM 0 HE22 GLN A 31 16.369 73.131 -19.751 1.00 5.45 H new ATOM 449 N ASN A 32 20.036 78.366 -21.754 1.00 32.35 N ATOM 450 CA ASN A 32 21.253 78.331 -20.952 1.00 60.00 C ATOM 451 C ASN A 32 21.027 77.455 -19.728 1.00 24.31 C ATOM 452 O ASN A 32 20.401 77.878 -18.755 1.00 12.35 O ATOM 453 CB ASN A 32 21.680 79.737 -20.514 1.00 55.23 C ATOM 454 CG ASN A 32 22.092 80.632 -21.672 1.00 52.21 C ATOM 455 OD1 ASN A 32 21.556 80.537 -22.780 1.00 64.01 O ATOM 456 ND2 ASN A 32 23.061 81.497 -21.428 1.00 12.22 N ATOM 0 H ASN A 32 19.542 79.258 -21.738 1.00 32.35 H new ATOM 0 HA ASN A 32 22.053 77.916 -21.565 1.00 60.00 H new ATOM 0 HB2 ASN A 32 20.857 80.207 -19.976 1.00 55.23 H new ATOM 0 HB3 ASN A 32 22.512 79.654 -19.815 1.00 55.23 H new ATOM 0 HD21 ASN A 32 23.391 82.116 -22.169 1.00 12.22 H new ATOM 0 HD22 ASN A 32 23.479 81.546 -20.499 1.00 12.22 H new ATOM 463 N SER A 33 21.520 76.230 -19.785 1.00 43.41 N ATOM 464 CA SER A 33 21.249 75.257 -18.743 1.00 24.32 C ATOM 465 C SER A 33 22.444 74.339 -18.526 1.00 0.13 C ATOM 466 O SER A 33 23.485 74.499 -19.166 1.00 23.01 O ATOM 467 CB SER A 33 20.009 74.444 -19.122 1.00 74.21 C ATOM 468 OG SER A 33 20.089 73.985 -20.463 1.00 5.52 O ATOM 0 H SER A 33 22.110 75.886 -20.542 1.00 43.41 H new ATOM 0 HA SER A 33 21.065 75.784 -17.807 1.00 24.32 H new ATOM 0 HB2 SER A 33 19.909 73.593 -18.448 1.00 74.21 H new ATOM 0 HB3 SER A 33 19.116 75.057 -18.997 1.00 74.21 H new ATOM 0 HG SER A 33 20.059 73.006 -20.476 1.00 5.52 H new ATOM 474 N TYR A 34 22.289 73.383 -17.624 1.00 44.31 N ATOM 475 CA TYR A 34 23.342 72.426 -17.318 1.00 61.24 C ATOM 476 C TYR A 34 22.923 71.039 -17.781 1.00 73.24 C ATOM 477 O TYR A 34 23.363 70.033 -17.222 1.00 62.43 O ATOM 478 CB TYR A 34 23.612 72.402 -15.809 1.00 13.13 C ATOM 479 CG TYR A 34 23.870 73.764 -15.211 1.00 74.24 C ATOM 480 CD1 TYR A 34 25.123 74.359 -15.297 1.00 25.42 C ATOM 481 CD2 TYR A 34 22.857 74.458 -14.561 1.00 64.13 C ATOM 482 CE1 TYR A 34 25.357 75.606 -14.753 1.00 53.30 C ATOM 483 CE2 TYR A 34 23.085 75.704 -14.013 1.00 70.13 C ATOM 484 CZ TYR A 34 24.336 76.273 -14.114 1.00 21.34 C ATOM 485 OH TYR A 34 24.565 77.518 -13.578 1.00 74.43 O ATOM 0 H TYR A 34 21.434 73.248 -17.085 1.00 44.31 H new ATOM 0 HA TYR A 34 24.252 72.725 -17.838 1.00 61.24 H new ATOM 0 HB2 TYR A 34 22.758 71.951 -15.304 1.00 13.13 H new ATOM 0 HB3 TYR A 34 24.472 71.762 -15.614 1.00 13.13 H new ATOM 0 HD1 TYR A 34 25.926 73.838 -15.797 1.00 25.42 H new ATOM 0 HD2 TYR A 34 21.875 74.015 -14.483 1.00 64.13 H new ATOM 0 HE1 TYR A 34 26.336 76.056 -14.828 1.00 53.30 H new ATOM 0 HE2 TYR A 34 22.288 76.230 -13.508 1.00 70.13 H new ATOM 0 HH TYR A 34 23.742 77.852 -13.164 1.00 74.43 H new ATOM 495 N LYS A 35 22.073 71.005 -18.815 1.00 52.32 N ATOM 496 CA LYS A 35 21.476 69.758 -19.314 1.00 32.34 C ATOM 497 C LYS A 35 20.455 69.244 -18.303 1.00 3.52 C ATOM 498 O LYS A 35 20.020 68.092 -18.356 1.00 34.43 O ATOM 499 CB LYS A 35 22.540 68.679 -19.598 1.00 4.45 C ATOM 500 CG LYS A 35 23.323 68.874 -20.895 1.00 64.01 C ATOM 501 CD LYS A 35 24.073 70.198 -20.933 1.00 53.33 C ATOM 502 CE LYS A 35 25.049 70.256 -22.097 1.00 71.43 C ATOM 503 NZ LYS A 35 26.276 69.457 -21.836 1.00 25.44 N1+ ATOM 0 H LYS A 35 21.780 71.837 -19.328 1.00 52.32 H new ATOM 0 HA LYS A 35 20.981 69.976 -20.261 1.00 32.34 H new ATOM 0 HB2 LYS A 35 23.244 68.655 -18.766 1.00 4.45 H new ATOM 0 HB3 LYS A 35 22.050 67.706 -19.629 1.00 4.45 H new ATOM 0 HG2 LYS A 35 24.033 68.055 -21.013 1.00 64.01 H new ATOM 0 HG3 LYS A 35 22.637 68.825 -21.740 1.00 64.01 H new ATOM 0 HD2 LYS A 35 23.360 71.018 -21.014 1.00 53.33 H new ATOM 0 HD3 LYS A 35 24.614 70.337 -19.997 1.00 53.33 H new ATOM 0 HE2 LYS A 35 24.560 69.886 -22.998 1.00 71.43 H new ATOM 0 HE3 LYS A 35 25.325 71.293 -22.287 1.00 71.43 H new ATOM 0 HZ1 LYS A 35 26.943 69.578 -22.624 1.00 25.44 H new ATOM 0 HZ2 LYS A 35 26.720 69.781 -20.953 1.00 25.44 H new ATOM 0 HZ3 LYS A 35 26.024 68.452 -21.748 1.00 25.44 H new ATOM 517 N ASP A 36 20.065 70.137 -17.404 1.00 74.53 N ATOM 518 CA ASP A 36 19.137 69.825 -16.328 1.00 12.22 C ATOM 519 C ASP A 36 17.708 69.703 -16.840 1.00 2.12 C ATOM 520 O ASP A 36 17.335 70.337 -17.831 1.00 1.02 O ATOM 521 CB ASP A 36 19.209 70.913 -15.251 1.00 13.10 C ATOM 522 CG ASP A 36 19.021 72.308 -15.823 1.00 53.20 C ATOM 523 OD1 ASP A 36 17.910 72.869 -15.709 1.00 0.23 O ATOM 524 OD2 ASP A 36 19.990 72.847 -16.400 1.00 61.43 O1- ATOM 0 H ASP A 36 20.386 71.105 -17.402 1.00 74.53 H new ATOM 0 HA ASP A 36 19.426 68.864 -15.903 1.00 12.22 H new ATOM 0 HB2 ASP A 36 18.444 70.726 -14.498 1.00 13.10 H new ATOM 0 HB3 ASP A 36 20.173 70.857 -14.746 1.00 13.10 H new ATOM 529 N PRO A 37 16.899 68.860 -16.188 1.00 13.20 N ATOM 530 CA PRO A 37 15.475 68.743 -16.481 1.00 63.51 C ATOM 531 C PRO A 37 14.687 69.904 -15.882 1.00 54.33 C ATOM 532 O PRO A 37 15.231 70.719 -15.133 1.00 45.11 O ATOM 533 CB PRO A 37 15.066 67.415 -15.825 1.00 21.24 C ATOM 534 CG PRO A 37 16.329 66.812 -15.294 1.00 41.34 C ATOM 535 CD PRO A 37 17.301 67.939 -15.127 1.00 70.22 C ATOM 0 HA PRO A 37 15.272 68.767 -17.552 1.00 63.51 H new ATOM 0 HB2 PRO A 37 14.346 67.581 -15.024 1.00 21.24 H new ATOM 0 HB3 PRO A 37 14.591 66.752 -16.548 1.00 21.24 H new ATOM 0 HG2 PRO A 37 16.149 66.310 -14.343 1.00 41.34 H new ATOM 0 HG3 PRO A 37 16.719 66.062 -15.981 1.00 41.34 H new ATOM 0 HD2 PRO A 37 17.226 68.398 -14.141 1.00 70.22 H new ATOM 0 HD3 PRO A 37 18.332 67.607 -15.246 1.00 70.22 H new ATOM 543 N SER A 38 13.404 69.967 -16.192 1.00 14.04 N ATOM 544 CA SER A 38 12.577 71.083 -15.775 1.00 55.00 C ATOM 545 C SER A 38 11.112 70.751 -16.014 1.00 15.51 C ATOM 546 O SER A 38 10.786 70.029 -16.962 1.00 61.15 O ATOM 547 CB SER A 38 12.968 72.348 -16.549 1.00 62.11 C ATOM 548 OG SER A 38 12.376 73.506 -15.983 1.00 2.22 O ATOM 0 H SER A 38 12.912 69.256 -16.733 1.00 14.04 H new ATOM 0 HA SER A 38 12.732 71.266 -14.712 1.00 55.00 H new ATOM 0 HB2 SER A 38 14.053 72.455 -16.549 1.00 62.11 H new ATOM 0 HB3 SER A 38 12.657 72.250 -17.589 1.00 62.11 H new ATOM 0 HG SER A 38 12.645 74.296 -16.497 1.00 2.22 H new ATOM 554 N TYR A 39 10.246 71.266 -15.139 1.00 43.44 N ATOM 555 CA TYR A 39 8.805 71.035 -15.219 1.00 20.45 C ATOM 556 C TYR A 39 8.478 69.575 -14.890 1.00 62.10 C ATOM 557 O TYR A 39 9.362 68.715 -14.897 1.00 24.30 O ATOM 558 CB TYR A 39 8.280 71.424 -16.611 1.00 32.34 C ATOM 559 CG TYR A 39 6.790 71.686 -16.667 1.00 55.01 C ATOM 560 CD1 TYR A 39 6.241 72.797 -16.039 1.00 1.41 C ATOM 561 CD2 TYR A 39 5.936 70.836 -17.358 1.00 62.40 C ATOM 562 CE1 TYR A 39 4.885 73.051 -16.093 1.00 74.42 C ATOM 563 CE2 TYR A 39 4.577 71.084 -17.417 1.00 23.44 C ATOM 564 CZ TYR A 39 4.057 72.192 -16.782 1.00 40.22 C ATOM 565 OH TYR A 39 2.702 72.444 -16.838 1.00 3.35 O ATOM 0 H TYR A 39 10.526 71.855 -14.355 1.00 43.44 H new ATOM 0 HA TYR A 39 8.305 71.663 -14.482 1.00 20.45 H new ATOM 0 HB2 TYR A 39 8.806 72.317 -16.948 1.00 32.34 H new ATOM 0 HB3 TYR A 39 8.523 70.627 -17.313 1.00 32.34 H new ATOM 0 HD1 TYR A 39 6.886 73.474 -15.499 1.00 1.41 H new ATOM 0 HD2 TYR A 39 6.340 69.968 -17.857 1.00 62.40 H new ATOM 0 HE1 TYR A 39 4.475 73.919 -15.598 1.00 74.42 H new ATOM 0 HE2 TYR A 39 3.926 70.413 -17.958 1.00 23.44 H new ATOM 0 HH TYR A 39 2.261 71.744 -17.363 1.00 3.35 H new ATOM 575 N ASN A 40 7.213 69.308 -14.574 1.00 65.22 N ATOM 576 CA ASN A 40 6.765 67.959 -14.215 1.00 3.22 C ATOM 577 C ASN A 40 7.515 67.457 -12.987 1.00 70.45 C ATOM 578 O ASN A 40 8.182 66.421 -13.034 1.00 15.21 O ATOM 579 CB ASN A 40 6.939 66.974 -15.380 1.00 75.20 C ATOM 580 CG ASN A 40 6.019 67.269 -16.548 1.00 64.02 C ATOM 581 OD1 ASN A 40 4.924 67.801 -16.375 1.00 40.50 O ATOM 582 ND2 ASN A 40 6.455 66.915 -17.746 1.00 70.04 N ATOM 0 H ASN A 40 6.474 70.011 -14.559 1.00 65.22 H new ATOM 0 HA ASN A 40 5.701 68.018 -13.984 1.00 3.22 H new ATOM 0 HB2 ASN A 40 7.973 67.004 -15.723 1.00 75.20 H new ATOM 0 HB3 ASN A 40 6.751 65.961 -15.023 1.00 75.20 H new ATOM 0 HD21 ASN A 40 5.876 67.081 -18.569 1.00 70.04 H new ATOM 0 HD22 ASN A 40 7.370 66.476 -17.846 1.00 70.04 H new ATOM 589 N ASP A 41 7.403 68.231 -11.905 1.00 1.43 N ATOM 590 CA ASP A 41 8.033 67.945 -10.604 1.00 42.41 C ATOM 591 C ASP A 41 9.510 67.547 -10.715 1.00 73.04 C ATOM 592 O ASP A 41 10.055 66.906 -9.818 1.00 20.40 O ATOM 593 CB ASP A 41 7.236 66.893 -9.799 1.00 75.34 C ATOM 594 CG ASP A 41 7.242 65.493 -10.389 1.00 44.10 C ATOM 595 OD1 ASP A 41 6.352 65.185 -11.213 1.00 61.14 O ATOM 596 OD2 ASP A 41 8.107 64.678 -10.000 1.00 31.02 O1- ATOM 0 H ASP A 41 6.860 69.095 -11.904 1.00 1.43 H new ATOM 0 HA ASP A 41 8.008 68.887 -10.055 1.00 42.41 H new ATOM 0 HB2 ASP A 41 7.642 66.847 -8.789 1.00 75.34 H new ATOM 0 HB3 ASP A 41 6.203 67.230 -9.712 1.00 75.34 H new ATOM 601 N ASP A 42 10.173 67.969 -11.786 1.00 64.11 N ATOM 602 CA ASP A 42 11.609 67.758 -11.915 1.00 22.32 C ATOM 603 C ASP A 42 12.307 69.095 -12.076 1.00 12.21 C ATOM 604 O ASP A 42 11.989 69.869 -12.976 1.00 2.23 O ATOM 605 CB ASP A 42 11.950 66.851 -13.097 1.00 70.12 C ATOM 606 CG ASP A 42 13.367 66.300 -13.013 1.00 70.01 C ATOM 607 OD1 ASP A 42 14.297 67.054 -12.638 1.00 24.15 O ATOM 608 OD2 ASP A 42 13.559 65.104 -13.326 1.00 23.10 O1- ATOM 0 H ASP A 42 9.742 68.456 -12.572 1.00 64.11 H new ATOM 0 HA ASP A 42 11.955 67.262 -11.008 1.00 22.32 H new ATOM 0 HB2 ASP A 42 11.242 66.023 -13.133 1.00 70.12 H new ATOM 0 HB3 ASP A 42 11.834 67.410 -14.026 1.00 70.12 H new ATOM 613 N PHE A 43 13.243 69.367 -11.188 1.00 34.33 N ATOM 614 CA PHE A 43 13.977 70.618 -11.209 1.00 42.52 C ATOM 615 C PHE A 43 15.463 70.331 -11.120 1.00 55.15 C ATOM 616 O PHE A 43 16.232 71.110 -10.556 1.00 42.21 O ATOM 617 CB PHE A 43 13.526 71.513 -10.051 1.00 45.40 C ATOM 618 CG PHE A 43 12.044 71.758 -10.048 1.00 60.21 C ATOM 619 CD1 PHE A 43 11.465 72.605 -10.980 1.00 61.42 C ATOM 620 CD2 PHE A 43 11.228 71.128 -9.123 1.00 74.23 C ATOM 621 CE1 PHE A 43 10.101 72.818 -10.989 1.00 3.13 C ATOM 622 CE2 PHE A 43 9.864 71.340 -9.126 1.00 34.35 C ATOM 623 CZ PHE A 43 9.300 72.185 -10.060 1.00 75.22 C ATOM 0 H PHE A 43 13.515 68.733 -10.437 1.00 34.33 H new ATOM 0 HA PHE A 43 13.775 71.144 -12.142 1.00 42.52 H new ATOM 0 HB2 PHE A 43 13.815 71.051 -9.107 1.00 45.40 H new ATOM 0 HB3 PHE A 43 14.047 72.468 -10.112 1.00 45.40 H new ATOM 0 HD1 PHE A 43 12.088 73.104 -11.707 1.00 61.42 H new ATOM 0 HD2 PHE A 43 11.664 70.464 -8.391 1.00 74.23 H new ATOM 0 HE1 PHE A 43 9.661 73.479 -11.722 1.00 3.13 H new ATOM 0 HE2 PHE A 43 9.239 70.845 -8.398 1.00 34.35 H new ATOM 0 HZ PHE A 43 8.233 72.351 -10.064 1.00 75.22 H new ATOM 633 N GLY A 44 15.859 69.200 -11.683 1.00 3.11 N ATOM 634 CA GLY A 44 17.245 68.804 -11.647 1.00 42.15 C ATOM 635 C GLY A 44 17.441 67.505 -10.898 1.00 3.45 C ATOM 636 O GLY A 44 18.436 67.326 -10.201 1.00 74.52 O ATOM 0 H GLY A 44 15.240 68.549 -12.166 1.00 3.11 H new ATOM 0 HA2 GLY A 44 17.618 68.696 -12.665 1.00 42.15 H new ATOM 0 HA3 GLY A 44 17.835 69.589 -11.173 1.00 42.15 H new ATOM 640 N ILE A 45 16.483 66.599 -11.032 1.00 51.24 N ATOM 641 CA ILE A 45 16.577 65.300 -10.386 1.00 71.42 C ATOM 642 C ILE A 45 17.392 64.356 -11.261 1.00 20.41 C ATOM 643 O ILE A 45 18.316 63.690 -10.787 1.00 25.51 O ATOM 644 CB ILE A 45 15.182 64.695 -10.114 1.00 34.42 C ATOM 645 CG1 ILE A 45 14.323 65.676 -9.308 1.00 11.31 C ATOM 646 CG2 ILE A 45 15.313 63.369 -9.378 1.00 54.24 C ATOM 647 CD1 ILE A 45 12.905 65.196 -9.075 1.00 75.24 C ATOM 0 H ILE A 45 15.635 66.740 -11.581 1.00 51.24 H new ATOM 0 HA ILE A 45 17.071 65.434 -9.424 1.00 71.42 H new ATOM 0 HB ILE A 45 14.690 64.511 -11.069 1.00 34.42 H new ATOM 0 HG12 ILE A 45 14.799 65.855 -8.344 1.00 11.31 H new ATOM 0 HG13 ILE A 45 14.292 66.632 -9.831 1.00 11.31 H new ATOM 0 HG21 ILE A 45 14.321 62.956 -9.194 1.00 54.24 H new ATOM 0 HG22 ILE A 45 15.890 62.671 -9.985 1.00 54.24 H new ATOM 0 HG23 ILE A 45 15.822 63.529 -8.427 1.00 54.24 H new ATOM 0 HD11 ILE A 45 12.358 65.942 -8.498 1.00 75.24 H new ATOM 0 HD12 ILE A 45 12.410 65.045 -10.034 1.00 75.24 H new ATOM 0 HD13 ILE A 45 12.925 64.255 -8.525 1.00 75.24 H new ATOM 659 N GLU A 46 17.050 64.313 -12.543 1.00 65.21 N ATOM 660 CA GLU A 46 17.826 63.555 -13.511 1.00 41.54 C ATOM 661 C GLU A 46 19.196 64.200 -13.692 1.00 5.12 C ATOM 662 O GLU A 46 19.300 65.383 -14.017 1.00 43.23 O ATOM 663 CB GLU A 46 17.096 63.488 -14.852 1.00 55.55 C ATOM 664 CG GLU A 46 15.772 62.742 -14.794 1.00 14.53 C ATOM 665 CD GLU A 46 15.937 61.272 -14.468 1.00 0.14 C ATOM 666 OE1 GLU A 46 15.415 60.819 -13.426 1.00 65.32 O ATOM 667 OE2 GLU A 46 16.592 60.554 -15.252 1.00 5.55 O1- ATOM 0 H GLU A 46 16.240 64.795 -12.934 1.00 65.21 H new ATOM 0 HA GLU A 46 17.954 62.539 -13.138 1.00 41.54 H new ATOM 0 HB2 GLU A 46 16.915 64.502 -15.208 1.00 55.55 H new ATOM 0 HB3 GLU A 46 17.743 63.004 -15.584 1.00 55.55 H new ATOM 0 HG2 GLU A 46 15.132 63.206 -14.043 1.00 14.53 H new ATOM 0 HG3 GLU A 46 15.263 62.841 -15.752 1.00 14.53 H new ATOM 674 N THR A 47 20.240 63.419 -13.474 1.00 53.34 N ATOM 675 CA THR A 47 21.602 63.930 -13.513 1.00 11.21 C ATOM 676 C THR A 47 22.447 63.142 -14.512 1.00 2.33 C ATOM 677 O THR A 47 23.034 62.113 -14.170 1.00 31.14 O ATOM 678 CB THR A 47 22.252 63.894 -12.113 1.00 14.13 C ATOM 679 OG1 THR A 47 21.391 64.544 -11.166 1.00 60.32 O ATOM 680 CG2 THR A 47 23.607 64.587 -12.119 1.00 31.14 C ATOM 0 H THR A 47 20.171 62.423 -13.267 1.00 53.34 H new ATOM 0 HA THR A 47 21.557 64.969 -13.839 1.00 11.21 H new ATOM 0 HB THR A 47 22.398 62.851 -11.832 1.00 14.13 H new ATOM 0 HG1 THR A 47 21.804 64.519 -10.278 1.00 60.32 H new ATOM 0 HG21 THR A 47 24.041 64.546 -11.120 1.00 31.14 H new ATOM 0 HG22 THR A 47 24.270 64.084 -12.823 1.00 31.14 H new ATOM 0 HG23 THR A 47 23.482 65.628 -12.418 1.00 31.14 H new ATOM 688 N PRO A 48 22.462 63.577 -15.784 1.00 63.35 N ATOM 689 CA PRO A 48 23.192 62.889 -16.851 1.00 21.13 C ATOM 690 C PRO A 48 24.695 62.840 -16.589 1.00 23.22 C ATOM 691 O PRO A 48 25.386 63.859 -16.660 1.00 30.10 O ATOM 692 CB PRO A 48 22.894 63.724 -18.107 1.00 72.10 C ATOM 693 CG PRO A 48 21.701 64.550 -17.757 1.00 2.42 C ATOM 694 CD PRO A 48 21.784 64.788 -16.277 1.00 3.12 C ATOM 0 HA PRO A 48 22.882 61.848 -16.939 1.00 21.13 H new ATOM 0 HB2 PRO A 48 23.744 64.353 -18.372 1.00 72.10 H new ATOM 0 HB3 PRO A 48 22.691 63.084 -18.966 1.00 72.10 H new ATOM 0 HG2 PRO A 48 21.704 65.492 -18.305 1.00 2.42 H new ATOM 0 HG3 PRO A 48 20.778 64.033 -18.018 1.00 2.42 H new ATOM 0 HD2 PRO A 48 22.350 65.690 -16.044 1.00 3.12 H new ATOM 0 HD3 PRO A 48 20.796 64.907 -15.831 1.00 3.12 H new ATOM 702 N SER A 49 25.186 61.657 -16.242 1.00 1.52 N ATOM 703 CA SER A 49 26.613 61.434 -16.065 1.00 71.45 C ATOM 704 C SER A 49 27.012 60.067 -16.625 1.00 5.40 C ATOM 705 O SER A 49 28.083 59.914 -17.207 1.00 55.33 O ATOM 706 CB SER A 49 26.981 61.546 -14.584 1.00 4.01 C ATOM 707 OG SER A 49 26.585 62.809 -14.063 1.00 52.25 O ATOM 0 H SER A 49 24.610 60.831 -16.077 1.00 1.52 H new ATOM 0 HA SER A 49 27.162 62.198 -16.615 1.00 71.45 H new ATOM 0 HB2 SER A 49 26.497 60.747 -14.022 1.00 4.01 H new ATOM 0 HB3 SER A 49 28.056 61.417 -14.460 1.00 4.01 H new ATOM 0 HG SER A 49 26.827 62.862 -13.115 1.00 52.25 H new ATOM 713 N ALA A 50 26.140 59.078 -16.459 1.00 4.34 N ATOM 714 CA ALA A 50 26.380 57.749 -17.014 1.00 71.23 C ATOM 715 C ALA A 50 25.752 57.624 -18.398 1.00 52.43 C ATOM 716 O ALA A 50 26.276 56.944 -19.278 1.00 63.35 O ATOM 717 CB ALA A 50 25.828 56.676 -16.085 1.00 52.42 C ATOM 0 H ALA A 50 25.263 59.170 -15.946 1.00 4.34 H new ATOM 0 HA ALA A 50 27.457 57.607 -17.109 1.00 71.23 H new ATOM 0 HB1 ALA A 50 26.015 55.692 -16.514 1.00 52.42 H new ATOM 0 HB2 ALA A 50 26.318 56.748 -15.114 1.00 52.42 H new ATOM 0 HB3 ALA A 50 24.755 56.819 -15.961 1.00 52.42 H new ATOM 723 N LEU A 51 24.625 58.294 -18.583 1.00 14.24 N ATOM 724 CA LEU A 51 23.917 58.265 -19.859 1.00 65.24 C ATOM 725 C LEU A 51 24.188 59.536 -20.653 1.00 54.11 C ATOM 726 O LEU A 51 23.701 59.699 -21.769 1.00 73.42 O ATOM 727 CB LEU A 51 22.407 58.118 -19.642 1.00 34.13 C ATOM 728 CG LEU A 51 21.762 59.222 -18.798 1.00 14.14 C ATOM 729 CD1 LEU A 51 20.367 59.535 -19.306 1.00 42.24 C ATOM 730 CD2 LEU A 51 21.702 58.811 -17.333 1.00 32.32 C ATOM 0 H LEU A 51 24.178 58.866 -17.866 1.00 14.24 H new ATOM 0 HA LEU A 51 24.282 57.405 -20.420 1.00 65.24 H new ATOM 0 HB2 LEU A 51 21.916 58.092 -20.615 1.00 34.13 H new ATOM 0 HB3 LEU A 51 22.216 57.158 -19.163 1.00 34.13 H new ATOM 0 HG LEU A 51 22.377 60.118 -18.885 1.00 14.14 H new ATOM 0 HD11 LEU A 51 19.925 60.321 -18.694 1.00 42.24 H new ATOM 0 HD12 LEU A 51 20.424 59.870 -20.342 1.00 42.24 H new ATOM 0 HD13 LEU A 51 19.749 58.639 -19.247 1.00 42.24 H new ATOM 0 HD21 LEU A 51 21.241 59.608 -16.750 1.00 32.32 H new ATOM 0 HD22 LEU A 51 21.111 57.901 -17.234 1.00 32.32 H new ATOM 0 HD23 LEU A 51 22.712 58.630 -16.964 1.00 32.32 H new ATOM 742 N ASP A 52 24.990 60.418 -20.072 1.00 2.23 N ATOM 743 CA ASP A 52 25.243 61.741 -20.644 1.00 12.25 C ATOM 744 C ASP A 52 25.917 61.645 -22.009 1.00 34.31 C ATOM 745 O ASP A 52 25.340 62.031 -23.025 1.00 33.15 O ATOM 746 CB ASP A 52 26.106 62.562 -19.684 1.00 5.20 C ATOM 747 CG ASP A 52 26.620 63.852 -20.294 1.00 62.52 C ATOM 748 OD1 ASP A 52 27.856 63.992 -20.435 1.00 12.41 O ATOM 749 OD2 ASP A 52 25.802 64.727 -20.626 1.00 63.02 O1- ATOM 0 H ASP A 52 25.483 60.242 -19.196 1.00 2.23 H new ATOM 0 HA ASP A 52 24.283 62.237 -20.786 1.00 12.25 H new ATOM 0 HB2 ASP A 52 25.524 62.796 -18.793 1.00 5.20 H new ATOM 0 HB3 ASP A 52 26.954 61.958 -19.361 1.00 5.20 H new ATOM 754 N ASN A 53 27.122 61.087 -22.030 1.00 61.25 N ATOM 755 CA ASN A 53 27.904 60.978 -23.260 1.00 42.12 C ATOM 756 C ASN A 53 27.254 59.973 -24.207 1.00 63.01 C ATOM 757 O ASN A 53 27.512 59.971 -25.411 1.00 23.25 O ATOM 758 CB ASN A 53 29.347 60.564 -22.935 1.00 44.53 C ATOM 759 CG ASN A 53 30.273 60.630 -24.135 1.00 73.01 C ATOM 760 OD1 ASN A 53 30.484 59.640 -24.836 1.00 72.42 O ATOM 761 ND2 ASN A 53 30.841 61.803 -24.372 1.00 31.23 N ATOM 0 H ASN A 53 27.582 60.701 -21.206 1.00 61.25 H new ATOM 0 HA ASN A 53 27.928 61.950 -23.753 1.00 42.12 H new ATOM 0 HB2 ASN A 53 29.735 61.211 -22.149 1.00 44.53 H new ATOM 0 HB3 ASN A 53 29.346 59.548 -22.540 1.00 44.53 H new ATOM 0 HD21 ASN A 53 31.480 61.910 -25.160 1.00 31.23 H new ATOM 0 HD22 ASN A 53 30.639 62.599 -23.767 1.00 31.23 H new ATOM 768 N PHE A 54 26.388 59.137 -23.648 1.00 22.14 N ATOM 769 CA PHE A 54 25.662 58.146 -24.423 1.00 43.23 C ATOM 770 C PHE A 54 24.571 58.811 -25.262 1.00 0.30 C ATOM 771 O PHE A 54 24.578 58.712 -26.490 1.00 51.31 O ATOM 772 CB PHE A 54 25.053 57.094 -23.488 1.00 64.13 C ATOM 773 CG PHE A 54 24.234 56.047 -24.194 1.00 32.43 C ATOM 774 CD1 PHE A 54 24.835 55.137 -25.051 1.00 20.25 C ATOM 775 CD2 PHE A 54 22.866 55.972 -23.992 1.00 52.44 C ATOM 776 CE1 PHE A 54 24.084 54.172 -25.695 1.00 74.25 C ATOM 777 CE2 PHE A 54 22.111 55.010 -24.632 1.00 41.13 C ATOM 778 CZ PHE A 54 22.720 54.109 -25.484 1.00 1.54 C ATOM 0 H PHE A 54 26.172 59.128 -22.651 1.00 22.14 H new ATOM 0 HA PHE A 54 26.359 57.654 -25.101 1.00 43.23 H new ATOM 0 HB2 PHE A 54 25.856 56.603 -22.939 1.00 64.13 H new ATOM 0 HB3 PHE A 54 24.425 57.597 -22.753 1.00 64.13 H new ATOM 0 HD1 PHE A 54 25.901 55.183 -25.217 1.00 20.25 H new ATOM 0 HD2 PHE A 54 22.385 56.674 -23.327 1.00 52.44 H new ATOM 0 HE1 PHE A 54 24.562 53.469 -26.361 1.00 74.25 H new ATOM 0 HE2 PHE A 54 21.045 54.962 -24.467 1.00 41.13 H new ATOM 0 HZ PHE A 54 22.130 53.356 -25.985 1.00 1.54 H new ATOM 788 N THR A 55 23.657 59.516 -24.599 1.00 75.41 N ATOM 789 CA THR A 55 22.543 60.163 -25.286 1.00 62.12 C ATOM 790 C THR A 55 23.042 61.345 -26.118 1.00 21.25 C ATOM 791 O THR A 55 22.377 61.793 -27.057 1.00 1.24 O ATOM 792 CB THR A 55 21.452 60.634 -24.288 1.00 4.21 C ATOM 793 OG1 THR A 55 20.239 60.941 -24.988 1.00 21.43 O ATOM 794 CG2 THR A 55 21.904 61.857 -23.498 1.00 4.31 C ATOM 0 H THR A 55 23.666 59.653 -23.588 1.00 75.41 H new ATOM 0 HA THR A 55 22.093 59.425 -25.950 1.00 62.12 H new ATOM 0 HB THR A 55 21.276 59.818 -23.586 1.00 4.21 H new ATOM 0 HG1 THR A 55 19.558 61.235 -24.348 1.00 21.43 H new ATOM 0 HG21 THR A 55 21.114 62.158 -22.810 1.00 4.31 H new ATOM 0 HG22 THR A 55 22.804 61.613 -22.933 1.00 4.31 H new ATOM 0 HG23 THR A 55 22.117 62.676 -24.185 1.00 4.31 H new ATOM 802 N GLN A 56 24.239 61.814 -25.784 1.00 32.54 N ATOM 803 CA GLN A 56 24.868 62.926 -26.485 1.00 40.22 C ATOM 804 C GLN A 56 25.098 62.557 -27.948 1.00 42.31 C ATOM 805 O GLN A 56 24.968 63.393 -28.844 1.00 33.50 O ATOM 806 CB GLN A 56 26.201 63.267 -25.816 1.00 24.31 C ATOM 807 CG GLN A 56 26.619 64.720 -25.963 1.00 3.12 C ATOM 808 CD GLN A 56 25.666 65.671 -25.263 1.00 23.51 C ATOM 809 OE1 GLN A 56 24.723 66.185 -25.866 1.00 22.43 O ATOM 810 NE2 GLN A 56 25.888 65.895 -23.978 1.00 51.20 N ATOM 0 H GLN A 56 24.799 61.434 -25.021 1.00 32.54 H new ATOM 0 HA GLN A 56 24.212 63.795 -26.440 1.00 40.22 H new ATOM 0 HB2 GLN A 56 26.134 63.026 -24.755 1.00 24.31 H new ATOM 0 HB3 GLN A 56 26.980 62.632 -26.239 1.00 24.31 H new ATOM 0 HG2 GLN A 56 27.622 64.850 -25.555 1.00 3.12 H new ATOM 0 HG3 GLN A 56 26.670 64.975 -27.022 1.00 3.12 H new ATOM 0 HE21 GLN A 56 26.680 65.451 -23.512 1.00 51.20 H new ATOM 0 HE22 GLN A 56 25.268 66.511 -23.453 1.00 51.20 H new ATOM 819 N ALA A 57 25.418 61.290 -28.183 1.00 43.12 N ATOM 820 CA ALA A 57 25.682 60.798 -29.530 1.00 74.22 C ATOM 821 C ALA A 57 24.386 60.409 -30.233 1.00 13.44 C ATOM 822 O ALA A 57 24.330 60.327 -31.461 1.00 44.41 O ATOM 823 CB ALA A 57 26.630 59.610 -29.482 1.00 32.32 C ATOM 0 H ALA A 57 25.501 60.581 -27.454 1.00 43.12 H new ATOM 0 HA ALA A 57 26.151 61.602 -30.098 1.00 74.22 H new ATOM 0 HB1 ALA A 57 26.818 59.253 -30.495 1.00 32.32 H new ATOM 0 HB2 ALA A 57 27.571 59.914 -29.024 1.00 32.32 H new ATOM 0 HB3 ALA A 57 26.181 58.810 -28.893 1.00 32.32 H new ATOM 829 N ILE A 58 23.343 60.177 -29.446 1.00 52.41 N ATOM 830 CA ILE A 58 22.062 59.741 -29.986 1.00 43.42 C ATOM 831 C ILE A 58 21.370 60.878 -30.729 1.00 42.32 C ATOM 832 O ILE A 58 20.615 60.643 -31.669 1.00 2.22 O ATOM 833 CB ILE A 58 21.132 59.203 -28.878 1.00 4.31 C ATOM 834 CG1 ILE A 58 21.847 58.106 -28.085 1.00 33.32 C ATOM 835 CG2 ILE A 58 19.834 58.669 -29.471 1.00 22.11 C ATOM 836 CD1 ILE A 58 20.966 57.420 -27.065 1.00 75.03 C ATOM 0 H ILE A 58 23.359 60.284 -28.432 1.00 52.41 H new ATOM 0 HA ILE A 58 22.268 58.931 -30.685 1.00 43.42 H new ATOM 0 HB ILE A 58 20.883 60.024 -28.205 1.00 4.31 H new ATOM 0 HG12 ILE A 58 22.232 57.360 -28.780 1.00 33.32 H new ATOM 0 HG13 ILE A 58 22.707 58.540 -27.575 1.00 33.32 H new ATOM 0 HG21 ILE A 58 19.195 58.295 -28.671 1.00 22.11 H new ATOM 0 HG22 ILE A 58 19.320 59.470 -30.002 1.00 22.11 H new ATOM 0 HG23 ILE A 58 20.057 57.859 -30.165 1.00 22.11 H new ATOM 0 HD11 ILE A 58 21.541 56.656 -26.543 1.00 75.03 H new ATOM 0 HD12 ILE A 58 20.602 58.154 -26.346 1.00 75.03 H new ATOM 0 HD13 ILE A 58 20.119 56.955 -27.570 1.00 75.03 H new ATOM 848 N GLN A 59 21.660 62.110 -30.327 1.00 20.32 N ATOM 849 CA GLN A 59 21.058 63.281 -30.958 1.00 43.14 C ATOM 850 C GLN A 59 21.292 63.278 -32.466 1.00 30.01 C ATOM 851 O GLN A 59 20.420 63.682 -33.234 1.00 22.32 O ATOM 852 CB GLN A 59 21.610 64.569 -30.349 1.00 0.24 C ATOM 853 CG GLN A 59 21.245 64.750 -28.887 1.00 33.03 C ATOM 854 CD GLN A 59 21.773 66.044 -28.305 1.00 32.54 C ATOM 855 OE1 GLN A 59 21.929 67.043 -29.011 1.00 24.13 O ATOM 856 NE2 GLN A 59 22.054 66.032 -27.014 1.00 51.23 N ATOM 0 H GLN A 59 22.307 62.325 -29.568 1.00 20.32 H new ATOM 0 HA GLN A 59 19.984 63.236 -30.776 1.00 43.14 H new ATOM 0 HB2 GLN A 59 22.696 64.573 -30.448 1.00 0.24 H new ATOM 0 HB3 GLN A 59 21.235 65.420 -30.917 1.00 0.24 H new ATOM 0 HG2 GLN A 59 20.160 64.726 -28.783 1.00 33.03 H new ATOM 0 HG3 GLN A 59 21.639 63.911 -28.313 1.00 33.03 H new ATOM 0 HE21 GLN A 59 21.909 65.182 -26.468 1.00 51.23 H new ATOM 0 HE22 GLN A 59 22.416 66.872 -26.563 1.00 51.23 H new ATOM 865 N SER A 60 22.459 62.798 -32.883 1.00 51.04 N ATOM 866 CA SER A 60 22.801 62.720 -34.297 1.00 11.41 C ATOM 867 C SER A 60 21.844 61.788 -35.041 1.00 54.31 C ATOM 868 O SER A 60 21.263 62.159 -36.062 1.00 71.15 O ATOM 869 CB SER A 60 24.238 62.227 -34.450 1.00 73.34 C ATOM 870 OG SER A 60 25.116 62.992 -33.643 1.00 3.51 O ATOM 0 H SER A 60 23.187 62.455 -32.257 1.00 51.04 H new ATOM 0 HA SER A 60 22.710 63.715 -34.732 1.00 11.41 H new ATOM 0 HB2 SER A 60 24.300 61.176 -34.168 1.00 73.34 H new ATOM 0 HB3 SER A 60 24.543 62.296 -35.494 1.00 73.34 H new ATOM 0 HG SER A 60 26.032 62.661 -33.752 1.00 3.51 H new ATOM 876 N GLN A 61 21.658 60.584 -34.506 1.00 30.10 N ATOM 877 CA GLN A 61 20.808 59.589 -35.154 1.00 24.42 C ATOM 878 C GLN A 61 19.331 59.942 -34.984 1.00 14.32 C ATOM 879 O GLN A 61 18.472 59.441 -35.715 1.00 1.12 O ATOM 880 CB GLN A 61 21.114 58.181 -34.624 1.00 64.21 C ATOM 881 CG GLN A 61 20.911 58.011 -33.129 1.00 32.32 C ATOM 882 CD GLN A 61 21.408 56.669 -32.627 1.00 64.01 C ATOM 883 OE1 GLN A 61 20.669 55.685 -32.611 1.00 52.54 O ATOM 884 NE2 GLN A 61 22.667 56.621 -32.218 1.00 61.52 N ATOM 0 H GLN A 61 22.081 60.275 -33.631 1.00 30.10 H new ATOM 0 HA GLN A 61 21.028 59.595 -36.222 1.00 24.42 H new ATOM 0 HB2 GLN A 61 20.481 57.464 -35.147 1.00 64.21 H new ATOM 0 HB3 GLN A 61 22.147 57.932 -34.868 1.00 64.21 H new ATOM 0 HG2 GLN A 61 21.433 58.809 -32.601 1.00 32.32 H new ATOM 0 HG3 GLN A 61 19.851 58.114 -32.895 1.00 32.32 H new ATOM 0 HE21 GLN A 61 23.245 57.461 -32.248 1.00 61.52 H new ATOM 0 HE22 GLN A 61 23.058 55.744 -31.873 1.00 61.52 H new ATOM 893 N ILE A 62 19.041 60.822 -34.030 1.00 25.21 N ATOM 894 CA ILE A 62 17.694 61.350 -33.864 1.00 60.23 C ATOM 895 C ILE A 62 17.388 62.327 -34.991 1.00 4.22 C ATOM 896 O ILE A 62 16.361 62.216 -35.659 1.00 73.53 O ATOM 897 CB ILE A 62 17.510 62.058 -32.499 1.00 31.41 C ATOM 898 CG1 ILE A 62 17.571 61.041 -31.357 1.00 75.12 C ATOM 899 CG2 ILE A 62 16.194 62.828 -32.457 1.00 11.33 C ATOM 900 CD1 ILE A 62 17.487 61.664 -29.979 1.00 54.33 C ATOM 0 H ILE A 62 19.721 61.183 -33.361 1.00 25.21 H new ATOM 0 HA ILE A 62 17.002 60.508 -33.895 1.00 60.23 H new ATOM 0 HB ILE A 62 18.324 62.772 -32.374 1.00 31.41 H new ATOM 0 HG12 ILE A 62 16.755 60.328 -31.474 1.00 75.12 H new ATOM 0 HG13 ILE A 62 18.500 60.477 -31.435 1.00 75.12 H new ATOM 0 HG21 ILE A 62 16.089 63.316 -31.488 1.00 11.33 H new ATOM 0 HG22 ILE A 62 16.188 63.581 -33.245 1.00 11.33 H new ATOM 0 HG23 ILE A 62 15.364 62.138 -32.608 1.00 11.33 H new ATOM 0 HD11 ILE A 62 17.537 60.881 -29.222 1.00 54.33 H new ATOM 0 HD12 ILE A 62 18.318 62.355 -29.841 1.00 54.33 H new ATOM 0 HD13 ILE A 62 16.545 62.204 -29.881 1.00 54.33 H new ATOM 912 N LEU A 63 18.302 63.269 -35.207 1.00 64.35 N ATOM 913 CA LEU A 63 18.167 64.245 -36.284 1.00 53.53 C ATOM 914 C LEU A 63 18.113 63.540 -37.635 1.00 34.31 C ATOM 915 O LEU A 63 17.314 63.897 -38.504 1.00 74.53 O ATOM 916 CB LEU A 63 19.335 65.232 -36.255 1.00 24.15 C ATOM 917 CG LEU A 63 19.419 66.112 -35.003 1.00 14.34 C ATOM 918 CD1 LEU A 63 20.643 67.012 -35.063 1.00 52.54 C ATOM 919 CD2 LEU A 63 18.154 66.943 -34.847 1.00 61.01 C ATOM 0 H LEU A 63 19.148 63.377 -34.647 1.00 64.35 H new ATOM 0 HA LEU A 63 17.237 64.795 -36.138 1.00 53.53 H new ATOM 0 HB2 LEU A 63 20.265 64.671 -36.348 1.00 24.15 H new ATOM 0 HB3 LEU A 63 19.264 65.879 -37.129 1.00 24.15 H new ATOM 0 HG LEU A 63 19.513 65.462 -34.133 1.00 14.34 H new ATOM 0 HD11 LEU A 63 20.685 67.629 -34.165 1.00 52.54 H new ATOM 0 HD12 LEU A 63 21.542 66.399 -35.125 1.00 52.54 H new ATOM 0 HD13 LEU A 63 20.580 67.654 -35.942 1.00 52.54 H new ATOM 0 HD21 LEU A 63 18.233 67.561 -33.953 1.00 61.01 H new ATOM 0 HD22 LEU A 63 18.029 67.583 -35.720 1.00 61.01 H new ATOM 0 HD23 LEU A 63 17.293 66.281 -34.756 1.00 61.01 H new ATOM 931 N GLY A 64 18.965 62.535 -37.798 1.00 54.14 N ATOM 932 CA GLY A 64 18.959 61.739 -39.011 1.00 43.53 C ATOM 933 C GLY A 64 17.626 61.057 -39.242 1.00 42.50 C ATOM 934 O GLY A 64 17.108 61.059 -40.358 1.00 45.41 O ATOM 0 H GLY A 64 19.663 62.256 -37.108 1.00 54.14 H new ATOM 0 HA2 GLY A 64 19.191 62.377 -39.863 1.00 43.53 H new ATOM 0 HA3 GLY A 64 19.745 60.986 -38.953 1.00 43.53 H new ATOM 938 N GLY A 65 17.064 60.488 -38.181 1.00 25.24 N ATOM 939 CA GLY A 65 15.777 59.825 -38.276 1.00 5.50 C ATOM 940 C GLY A 65 14.654 60.787 -38.608 1.00 33.53 C ATOM 941 O GLY A 65 13.722 60.440 -39.336 1.00 11.34 O ATOM 0 H GLY A 65 17.481 60.475 -37.250 1.00 25.24 H new ATOM 0 HA2 GLY A 65 15.826 59.050 -39.041 1.00 5.50 H new ATOM 0 HA3 GLY A 65 15.558 59.327 -37.332 1.00 5.50 H new ATOM 945 N LEU A 66 14.749 62.002 -38.080 1.00 53.33 N ATOM 946 CA LEU A 66 13.758 63.036 -38.346 1.00 72.23 C ATOM 947 C LEU A 66 13.714 63.366 -39.831 1.00 34.12 C ATOM 948 O LEU A 66 12.652 63.332 -40.450 1.00 33.03 O ATOM 949 CB LEU A 66 14.067 64.300 -37.542 1.00 31.31 C ATOM 950 CG LEU A 66 14.003 64.136 -36.024 1.00 64.21 C ATOM 951 CD1 LEU A 66 14.389 65.432 -35.329 1.00 22.03 C ATOM 952 CD2 LEU A 66 12.612 63.691 -35.597 1.00 65.03 C ATOM 0 H LEU A 66 15.506 62.295 -37.463 1.00 53.33 H new ATOM 0 HA LEU A 66 12.783 62.655 -38.040 1.00 72.23 H new ATOM 0 HB2 LEU A 66 15.064 64.649 -37.812 1.00 31.31 H new ATOM 0 HB3 LEU A 66 13.365 65.080 -37.837 1.00 31.31 H new ATOM 0 HG LEU A 66 14.716 63.366 -35.729 1.00 64.21 H new ATOM 0 HD11 LEU A 66 14.337 65.295 -34.249 1.00 22.03 H new ATOM 0 HD12 LEU A 66 15.405 65.708 -35.612 1.00 22.03 H new ATOM 0 HD13 LEU A 66 13.702 66.224 -35.628 1.00 22.03 H new ATOM 0 HD21 LEU A 66 12.583 63.579 -34.513 1.00 65.03 H new ATOM 0 HD22 LEU A 66 11.881 64.438 -35.904 1.00 65.03 H new ATOM 0 HD23 LEU A 66 12.375 62.737 -36.067 1.00 65.03 H new ATOM 964 N LEU A 67 14.879 63.659 -40.397 1.00 53.21 N ATOM 965 CA LEU A 67 14.979 64.009 -41.811 1.00 64.45 C ATOM 966 C LEU A 67 14.679 62.804 -42.696 1.00 60.43 C ATOM 967 O LEU A 67 14.139 62.944 -43.792 1.00 44.24 O ATOM 968 CB LEU A 67 16.374 64.555 -42.123 1.00 51.43 C ATOM 969 CG LEU A 67 16.763 65.818 -41.350 1.00 3.00 C ATOM 970 CD1 LEU A 67 18.175 66.254 -41.712 1.00 70.32 C ATOM 971 CD2 LEU A 67 15.772 66.942 -41.622 1.00 22.21 C ATOM 0 H LEU A 67 15.769 63.661 -39.899 1.00 53.21 H new ATOM 0 HA LEU A 67 14.238 64.780 -42.022 1.00 64.45 H new ATOM 0 HB2 LEU A 67 17.108 63.777 -41.911 1.00 51.43 H new ATOM 0 HB3 LEU A 67 16.434 64.768 -43.190 1.00 51.43 H new ATOM 0 HG LEU A 67 16.736 65.587 -40.285 1.00 3.00 H new ATOM 0 HD11 LEU A 67 18.433 67.153 -41.152 1.00 70.32 H new ATOM 0 HD12 LEU A 67 18.877 65.458 -41.463 1.00 70.32 H new ATOM 0 HD13 LEU A 67 18.228 66.464 -42.780 1.00 70.32 H new ATOM 0 HD21 LEU A 67 16.067 67.830 -41.063 1.00 22.21 H new ATOM 0 HD22 LEU A 67 15.764 67.170 -42.688 1.00 22.21 H new ATOM 0 HD23 LEU A 67 14.775 66.631 -41.310 1.00 22.21 H new ATOM 983 N SER A 68 15.022 61.622 -42.198 1.00 40.32 N ATOM 984 CA SER A 68 14.793 60.376 -42.917 1.00 11.31 C ATOM 985 C SER A 68 13.316 60.216 -43.274 1.00 75.02 C ATOM 986 O SER A 68 12.970 59.961 -44.429 1.00 75.11 O ATOM 987 CB SER A 68 15.257 59.196 -42.059 1.00 0.14 C ATOM 988 OG SER A 68 15.094 57.964 -42.734 1.00 4.11 O ATOM 0 H SER A 68 15.465 61.501 -41.287 1.00 40.32 H new ATOM 0 HA SER A 68 15.365 60.399 -43.844 1.00 11.31 H new ATOM 0 HB2 SER A 68 16.306 59.329 -41.793 1.00 0.14 H new ATOM 0 HB3 SER A 68 14.691 59.178 -41.127 1.00 0.14 H new ATOM 0 HG SER A 68 15.893 57.777 -43.270 1.00 4.11 H new ATOM 994 N ASN A 69 12.446 60.403 -42.281 1.00 22.22 N ATOM 995 CA ASN A 69 11.006 60.226 -42.476 1.00 3.21 C ATOM 996 C ASN A 69 10.404 61.357 -43.304 1.00 33.23 C ATOM 997 O ASN A 69 9.320 61.212 -43.868 1.00 41.32 O ATOM 998 CB ASN A 69 10.280 60.127 -41.129 1.00 53.44 C ATOM 999 CG ASN A 69 10.488 58.792 -40.439 1.00 25.14 C ATOM 1000 OD1 ASN A 69 9.753 57.837 -40.684 1.00 41.35 O ATOM 1001 ND2 ASN A 69 11.479 58.713 -39.564 1.00 2.13 N ATOM 0 H ASN A 69 12.712 60.676 -41.335 1.00 22.22 H new ATOM 0 HA ASN A 69 10.871 59.294 -43.024 1.00 3.21 H new ATOM 0 HB2 ASN A 69 10.629 60.926 -40.475 1.00 53.44 H new ATOM 0 HB3 ASN A 69 9.213 60.286 -41.285 1.00 53.44 H new ATOM 0 HD21 ASN A 69 11.653 57.839 -39.068 1.00 2.13 H new ATOM 0 HD22 ASN A 69 12.069 59.526 -39.386 1.00 2.13 H new ATOM 1008 N ILE A 70 11.107 62.481 -43.374 1.00 71.41 N ATOM 1009 CA ILE A 70 10.665 63.610 -44.181 1.00 54.25 C ATOM 1010 C ILE A 70 10.922 63.332 -45.660 1.00 15.54 C ATOM 1011 O ILE A 70 10.121 63.693 -46.525 1.00 23.53 O ATOM 1012 CB ILE A 70 11.379 64.920 -43.762 1.00 3.10 C ATOM 1013 CG1 ILE A 70 11.047 65.271 -42.303 1.00 23.53 C ATOM 1014 CG2 ILE A 70 10.993 66.067 -44.686 1.00 12.32 C ATOM 1015 CD1 ILE A 70 9.568 65.479 -42.037 1.00 42.43 C ATOM 0 H ILE A 70 11.987 62.634 -42.881 1.00 71.41 H new ATOM 0 HA ILE A 70 9.595 63.738 -44.015 1.00 54.25 H new ATOM 0 HB ILE A 70 12.454 64.762 -43.845 1.00 3.10 H new ATOM 0 HG12 ILE A 70 11.413 64.473 -41.656 1.00 23.53 H new ATOM 0 HG13 ILE A 70 11.586 66.177 -42.027 1.00 23.53 H new ATOM 0 HG21 ILE A 70 11.507 66.976 -44.372 1.00 12.32 H new ATOM 0 HG22 ILE A 70 11.280 65.823 -45.709 1.00 12.32 H new ATOM 0 HG23 ILE A 70 9.915 66.225 -44.640 1.00 12.32 H new ATOM 0 HD11 ILE A 70 9.418 65.723 -40.985 1.00 42.43 H new ATOM 0 HD12 ILE A 70 9.199 66.297 -42.655 1.00 42.43 H new ATOM 0 HD13 ILE A 70 9.023 64.567 -42.279 1.00 42.43 H new ATOM 1027 N ASN A 71 12.030 62.656 -45.935 1.00 10.14 N ATOM 1028 CA ASN A 71 12.435 62.375 -47.306 1.00 44.34 C ATOM 1029 C ASN A 71 11.515 61.332 -47.938 1.00 55.34 C ATOM 1030 O ASN A 71 10.893 61.583 -48.971 1.00 20.43 O ATOM 1031 CB ASN A 71 13.882 61.878 -47.343 1.00 33.10 C ATOM 1032 CG ASN A 71 14.494 61.940 -48.734 1.00 24.15 C ATOM 1033 OD1 ASN A 71 15.105 62.940 -49.105 1.00 2.11 O ATOM 1034 ND2 ASN A 71 14.333 60.883 -49.515 1.00 61.43 N ATOM 0 H ASN A 71 12.665 62.292 -45.225 1.00 10.14 H new ATOM 0 HA ASN A 71 12.361 63.300 -47.877 1.00 44.34 H new ATOM 0 HB2 ASN A 71 14.484 62.477 -46.660 1.00 33.10 H new ATOM 0 HB3 ASN A 71 13.917 60.850 -46.982 1.00 33.10 H new ATOM 0 HD21 ASN A 71 14.722 60.882 -50.458 1.00 61.43 H new ATOM 0 HD22 ASN A 71 13.820 60.070 -49.174 1.00 61.43 H new ATOM 1041 N THR A 72 11.432 60.160 -47.315 1.00 12.11 N ATOM 1042 CA THR A 72 10.653 59.050 -47.860 1.00 23.30 C ATOM 1043 C THR A 72 10.259 58.076 -46.744 1.00 44.31 C ATOM 1044 O THR A 72 10.899 58.050 -45.690 1.00 44.23 O ATOM 1045 CB THR A 72 11.465 58.294 -48.944 1.00 2.13 C ATOM 1046 OG1 THR A 72 12.006 59.230 -49.889 1.00 14.23 O ATOM 1047 CG2 THR A 72 10.604 57.281 -49.686 1.00 53.31 C ATOM 0 H THR A 72 11.895 59.953 -46.430 1.00 12.11 H new ATOM 0 HA THR A 72 9.751 59.460 -48.314 1.00 23.30 H new ATOM 0 HB THR A 72 12.269 57.759 -48.440 1.00 2.13 H new ATOM 0 HG1 THR A 72 12.519 58.747 -50.570 1.00 14.23 H new ATOM 0 HG21 THR A 72 11.207 56.771 -50.437 1.00 53.31 H new ATOM 0 HG22 THR A 72 10.211 56.550 -48.979 1.00 53.31 H new ATOM 0 HG23 THR A 72 9.776 57.795 -50.174 1.00 53.31 H new ATOM 1055 N GLY A 73 9.192 57.309 -46.963 1.00 3.13 N ATOM 1056 CA GLY A 73 8.832 56.238 -46.045 1.00 42.41 C ATOM 1057 C GLY A 73 9.814 55.083 -46.118 1.00 24.53 C ATOM 1058 O GLY A 73 9.461 53.972 -46.519 1.00 71.02 O ATOM 0 H GLY A 73 8.568 57.411 -47.763 1.00 3.13 H new ATOM 0 HA2 GLY A 73 8.802 56.626 -45.027 1.00 42.41 H new ATOM 0 HA3 GLY A 73 7.830 55.879 -46.279 1.00 42.41 H new ATOM 1062 N LYS A 74 11.048 55.377 -45.739 1.00 31.51 N ATOM 1063 CA LYS A 74 12.170 54.448 -45.812 1.00 51.44 C ATOM 1064 C LYS A 74 11.923 53.139 -45.054 1.00 44.43 C ATOM 1065 O LYS A 74 11.083 53.076 -44.151 1.00 24.01 O ATOM 1066 CB LYS A 74 13.421 55.152 -45.270 1.00 23.21 C ATOM 1067 CG LYS A 74 13.243 55.762 -43.882 1.00 4.23 C ATOM 1068 CD LYS A 74 13.475 54.744 -42.777 1.00 20.20 C ATOM 1069 CE LYS A 74 13.198 55.327 -41.400 1.00 35.24 C ATOM 1070 NZ LYS A 74 11.763 55.679 -41.219 1.00 22.45 N1+ ATOM 0 H LYS A 74 11.305 56.289 -45.363 1.00 31.51 H new ATOM 0 HA LYS A 74 12.304 54.167 -46.857 1.00 51.44 H new ATOM 0 HB2 LYS A 74 14.242 54.436 -45.237 1.00 23.21 H new ATOM 0 HB3 LYS A 74 13.712 55.939 -45.966 1.00 23.21 H new ATOM 0 HG2 LYS A 74 13.937 56.594 -43.760 1.00 4.23 H new ATOM 0 HG3 LYS A 74 12.237 56.171 -43.792 1.00 4.23 H new ATOM 0 HD2 LYS A 74 12.833 53.878 -42.940 1.00 20.20 H new ATOM 0 HD3 LYS A 74 14.505 54.390 -42.821 1.00 20.20 H new ATOM 0 HE2 LYS A 74 13.493 54.608 -40.636 1.00 35.24 H new ATOM 0 HE3 LYS A 74 13.810 56.217 -41.254 1.00 35.24 H new ATOM 0 HZ1 LYS A 74 11.531 55.680 -40.205 1.00 22.45 H new ATOM 0 HZ2 LYS A 74 11.585 56.624 -41.616 1.00 22.45 H new ATOM 0 HZ3 LYS A 74 11.170 54.980 -41.710 1.00 22.45 H new ATOM 1084 N PRO A 75 12.659 52.077 -45.425 1.00 62.34 N ATOM 1085 CA PRO A 75 12.666 50.815 -44.689 1.00 2.31 C ATOM 1086 C PRO A 75 13.503 50.927 -43.417 1.00 25.45 C ATOM 1087 O PRO A 75 14.354 51.812 -43.300 1.00 34.43 O ATOM 1088 CB PRO A 75 13.312 49.814 -45.664 1.00 60.25 C ATOM 1089 CG PRO A 75 13.502 50.551 -46.950 1.00 23.21 C ATOM 1090 CD PRO A 75 13.538 52.011 -46.599 1.00 65.03 C ATOM 0 HA PRO A 75 11.666 50.517 -44.373 1.00 2.31 H new ATOM 0 HB2 PRO A 75 14.265 49.453 -45.277 1.00 60.25 H new ATOM 0 HB3 PRO A 75 12.674 48.941 -45.806 1.00 60.25 H new ATOM 0 HG2 PRO A 75 14.427 50.246 -47.440 1.00 23.21 H new ATOM 0 HG3 PRO A 75 12.689 50.338 -47.644 1.00 23.21 H new ATOM 0 HD2 PRO A 75 14.549 52.348 -46.369 1.00 65.03 H new ATOM 0 HD3 PRO A 75 13.172 52.634 -47.415 1.00 65.03 H new ATOM 1098 N GLY A 76 13.265 50.029 -42.472 1.00 12.10 N ATOM 1099 CA GLY A 76 13.989 50.062 -41.214 1.00 14.01 C ATOM 1100 C GLY A 76 15.317 49.324 -41.282 1.00 13.34 C ATOM 1101 O GLY A 76 15.805 49.001 -42.365 1.00 72.12 O ATOM 0 H GLY A 76 12.582 49.276 -42.553 1.00 12.10 H new ATOM 0 HA2 GLY A 76 14.168 51.099 -40.930 1.00 14.01 H new ATOM 0 HA3 GLY A 76 13.372 49.619 -40.432 1.00 14.01 H new ATOM 1105 N ARG A 77 15.900 49.043 -40.124 1.00 2.44 N ATOM 1106 CA ARG A 77 17.171 48.342 -40.066 1.00 13.33 C ATOM 1107 C ARG A 77 16.946 46.868 -39.762 1.00 22.11 C ATOM 1108 O ARG A 77 16.254 46.522 -38.803 1.00 0.25 O ATOM 1109 CB ARG A 77 18.096 48.972 -39.014 1.00 21.41 C ATOM 1110 CG ARG A 77 17.447 49.160 -37.649 1.00 30.43 C ATOM 1111 CD ARG A 77 18.465 49.566 -36.588 1.00 20.32 C ATOM 1112 NE ARG A 77 19.199 50.783 -36.945 1.00 45.02 N ATOM 1113 CZ ARG A 77 19.184 51.909 -36.229 1.00 1.11 C ATOM 1114 NH1 ARG A 77 18.457 51.990 -35.121 1.00 21.40 N1+ ATOM 1115 NH2 ARG A 77 19.904 52.950 -36.622 1.00 14.15 N ATOM 0 H ARG A 77 15.511 49.291 -39.214 1.00 2.44 H new ATOM 0 HA ARG A 77 17.655 48.429 -41.039 1.00 13.33 H new ATOM 0 HB2 ARG A 77 18.980 48.345 -38.901 1.00 21.41 H new ATOM 0 HB3 ARG A 77 18.437 49.941 -39.379 1.00 21.41 H new ATOM 0 HG2 ARG A 77 16.670 49.922 -37.718 1.00 30.43 H new ATOM 0 HG3 ARG A 77 16.959 48.233 -37.348 1.00 30.43 H new ATOM 0 HD2 ARG A 77 17.952 49.721 -35.639 1.00 20.32 H new ATOM 0 HD3 ARG A 77 19.173 48.751 -36.438 1.00 20.32 H new ATOM 0 HE ARG A 77 19.759 50.768 -37.798 1.00 45.02 H new ATOM 0 HH11 ARG A 77 17.906 51.189 -34.813 1.00 21.40 H new ATOM 0 HH12 ARG A 77 18.450 52.853 -34.578 1.00 21.40 H new ATOM 0 HH21 ARG A 77 20.468 52.889 -37.470 1.00 14.15 H new ATOM 0 HH22 ARG A 77 19.894 53.812 -36.077 1.00 14.15 H new ATOM 1129 N MET A 78 17.506 46.002 -40.594 1.00 12.00 N ATOM 1130 CA MET A 78 17.368 44.568 -40.398 1.00 2.03 C ATOM 1131 C MET A 78 18.381 44.072 -39.378 1.00 70.13 C ATOM 1132 O MET A 78 19.577 43.997 -39.658 1.00 44.34 O ATOM 1133 CB MET A 78 17.547 43.811 -41.715 1.00 63.14 C ATOM 1134 CG MET A 78 17.441 42.302 -41.560 1.00 52.15 C ATOM 1135 SD MET A 78 17.676 41.416 -43.111 1.00 73.31 S ATOM 1136 CE MET A 78 17.582 39.722 -42.534 1.00 35.54 C ATOM 0 H MET A 78 18.059 46.267 -41.409 1.00 12.00 H new ATOM 0 HA MET A 78 16.361 44.379 -40.025 1.00 2.03 H new ATOM 0 HB2 MET A 78 16.794 44.150 -42.426 1.00 63.14 H new ATOM 0 HB3 MET A 78 18.520 44.058 -42.139 1.00 63.14 H new ATOM 0 HG2 MET A 78 18.185 41.963 -40.838 1.00 52.15 H new ATOM 0 HG3 MET A 78 16.462 42.052 -41.150 1.00 52.15 H new ATOM 0 HE1 MET A 78 17.709 39.043 -43.377 1.00 35.54 H new ATOM 0 HE2 MET A 78 18.369 39.543 -41.802 1.00 35.54 H new ATOM 0 HE3 MET A 78 16.610 39.548 -42.072 1.00 35.54 H new ATOM 1146 N VAL A 79 17.894 43.740 -38.197 1.00 63.22 N ATOM 1147 CA VAL A 79 18.753 43.247 -37.137 1.00 53.31 C ATOM 1148 C VAL A 79 19.122 41.796 -37.408 1.00 34.33 C ATOM 1149 O VAL A 79 18.295 40.892 -37.273 1.00 23.05 O ATOM 1150 CB VAL A 79 18.078 43.359 -35.754 1.00 51.15 C ATOM 1151 CG1 VAL A 79 19.031 42.920 -34.651 1.00 62.34 C ATOM 1152 CG2 VAL A 79 17.590 44.781 -35.509 1.00 20.14 C ATOM 0 H VAL A 79 16.907 43.803 -37.948 1.00 63.22 H new ATOM 0 HA VAL A 79 19.651 43.865 -37.123 1.00 53.31 H new ATOM 0 HB VAL A 79 17.215 42.694 -35.741 1.00 51.15 H new ATOM 0 HG11 VAL A 79 18.534 43.007 -33.685 1.00 62.34 H new ATOM 0 HG12 VAL A 79 19.325 41.883 -34.816 1.00 62.34 H new ATOM 0 HG13 VAL A 79 19.917 43.555 -34.662 1.00 62.34 H new ATOM 0 HG21 VAL A 79 17.117 44.840 -34.529 1.00 20.14 H new ATOM 0 HG22 VAL A 79 18.436 45.467 -35.545 1.00 20.14 H new ATOM 0 HG23 VAL A 79 16.867 45.055 -36.278 1.00 20.14 H new ATOM 1162 N THR A 80 20.359 41.589 -37.822 1.00 24.24 N ATOM 1163 CA THR A 80 20.842 40.264 -38.152 1.00 43.31 C ATOM 1164 C THR A 80 21.265 39.524 -36.884 1.00 22.22 C ATOM 1165 O THR A 80 21.492 40.145 -35.842 1.00 20.53 O ATOM 1166 CB THR A 80 22.013 40.359 -39.147 1.00 4.42 C ATOM 1167 OG1 THR A 80 21.695 41.324 -40.154 1.00 23.43 O ATOM 1168 CG2 THR A 80 22.290 39.020 -39.812 1.00 23.11 C ATOM 0 H THR A 80 21.051 42.329 -37.938 1.00 24.24 H new ATOM 0 HA THR A 80 20.036 39.701 -38.623 1.00 43.31 H new ATOM 0 HB THR A 80 22.905 40.657 -38.596 1.00 4.42 H new ATOM 0 HG1 THR A 80 22.137 41.079 -40.993 1.00 23.43 H new ATOM 0 HG21 THR A 80 23.123 39.125 -40.508 1.00 23.11 H new ATOM 0 HG22 THR A 80 22.543 38.281 -39.051 1.00 23.11 H new ATOM 0 HG23 THR A 80 21.403 38.693 -40.354 1.00 23.11 H new ATOM 1176 N ASN A 81 21.334 38.202 -36.974 1.00 12.13 N ATOM 1177 CA ASN A 81 21.666 37.350 -35.835 1.00 13.33 C ATOM 1178 C ASN A 81 22.982 37.771 -35.193 1.00 53.52 C ATOM 1179 O ASN A 81 23.028 38.143 -34.019 1.00 72.31 O ATOM 1180 CB ASN A 81 21.770 35.883 -36.271 1.00 31.34 C ATOM 1181 CG ASN A 81 20.486 35.326 -36.864 1.00 23.22 C ATOM 1182 OD1 ASN A 81 19.692 36.048 -37.469 1.00 55.05 O ATOM 1183 ND2 ASN A 81 20.284 34.028 -36.706 1.00 51.02 N ATOM 0 H ASN A 81 21.162 37.688 -37.838 1.00 12.13 H new ATOM 0 HA ASN A 81 20.865 37.460 -35.104 1.00 13.33 H new ATOM 0 HB2 ASN A 81 22.569 35.788 -37.006 1.00 31.34 H new ATOM 0 HB3 ASN A 81 22.054 35.277 -35.411 1.00 31.34 H new ATOM 0 HD21 ASN A 81 19.447 33.591 -37.092 1.00 51.02 H new ATOM 0 HD22 ASN A 81 20.966 33.464 -36.198 1.00 51.02 H new ATOM 1190 N ASP A 82 24.047 37.718 -35.975 1.00 32.11 N ATOM 1191 CA ASP A 82 25.384 38.005 -35.472 1.00 24.13 C ATOM 1192 C ASP A 82 25.918 39.316 -36.039 1.00 61.51 C ATOM 1193 O ASP A 82 26.586 40.080 -35.345 1.00 75.51 O ATOM 1194 CB ASP A 82 26.343 36.868 -35.838 1.00 23.52 C ATOM 1195 CG ASP A 82 26.033 35.555 -35.137 1.00 72.21 C ATOM 1196 OD1 ASP A 82 24.950 34.983 -35.375 1.00 63.25 O ATOM 1197 OD2 ASP A 82 26.896 35.067 -34.381 1.00 30.43 O1- ATOM 0 H ASP A 82 24.013 37.478 -36.966 1.00 32.11 H new ATOM 0 HA ASP A 82 25.318 38.095 -34.388 1.00 24.13 H new ATOM 0 HB2 ASP A 82 26.310 36.710 -36.916 1.00 23.52 H new ATOM 0 HB3 ASP A 82 27.361 37.170 -35.591 1.00 23.52 H new ATOM 1202 N TYR A 83 25.625 39.560 -37.308 1.00 2.10 N ATOM 1203 CA TYR A 83 26.108 40.750 -38.003 1.00 61.22 C ATOM 1204 C TYR A 83 25.286 41.978 -37.650 1.00 25.13 C ATOM 1205 O TYR A 83 24.067 41.901 -37.496 1.00 35.42 O ATOM 1206 CB TYR A 83 26.065 40.536 -39.517 1.00 22.35 C ATOM 1207 CG TYR A 83 27.169 39.648 -40.048 1.00 63.34 C ATOM 1208 CD1 TYR A 83 28.145 40.161 -40.892 1.00 54.31 C ATOM 1209 CD2 TYR A 83 27.240 38.302 -39.706 1.00 61.31 C ATOM 1210 CE1 TYR A 83 29.158 39.359 -41.381 1.00 54.50 C ATOM 1211 CE2 TYR A 83 28.249 37.494 -40.192 1.00 43.02 C ATOM 1212 CZ TYR A 83 29.205 38.029 -41.028 1.00 0.23 C ATOM 1213 OH TYR A 83 30.214 37.230 -41.514 1.00 35.22 O ATOM 0 H TYR A 83 25.050 38.945 -37.884 1.00 2.10 H new ATOM 0 HA TYR A 83 27.136 40.917 -37.681 1.00 61.22 H new ATOM 0 HB2 TYR A 83 25.103 40.100 -39.784 1.00 22.35 H new ATOM 0 HB3 TYR A 83 26.124 41.505 -40.012 1.00 22.35 H new ATOM 0 HD1 TYR A 83 28.112 41.204 -41.171 1.00 54.31 H new ATOM 0 HD2 TYR A 83 26.493 37.881 -39.049 1.00 61.31 H new ATOM 0 HE1 TYR A 83 29.909 39.773 -42.037 1.00 54.50 H new ATOM 0 HE2 TYR A 83 28.289 36.450 -39.919 1.00 43.02 H new ATOM 0 HH TYR A 83 30.104 36.319 -41.170 1.00 35.22 H new ATOM 1223 N ILE A 84 25.961 43.111 -37.529 1.00 71.04 N ATOM 1224 CA ILE A 84 25.284 44.375 -37.296 1.00 33.43 C ATOM 1225 C ILE A 84 25.023 45.079 -38.618 1.00 24.33 C ATOM 1226 O ILE A 84 25.866 45.830 -39.111 1.00 13.30 O ATOM 1227 CB ILE A 84 26.101 45.305 -36.373 1.00 35.11 C ATOM 1228 CG1 ILE A 84 26.398 44.609 -35.045 1.00 70.51 C ATOM 1229 CG2 ILE A 84 25.360 46.616 -36.131 1.00 63.41 C ATOM 1230 CD1 ILE A 84 25.154 44.152 -34.317 1.00 21.15 C ATOM 0 H ILE A 84 26.977 43.180 -37.588 1.00 71.04 H new ATOM 0 HA ILE A 84 24.339 44.151 -36.800 1.00 33.43 H new ATOM 0 HB ILE A 84 27.045 45.533 -36.868 1.00 35.11 H new ATOM 0 HG12 ILE A 84 27.039 43.747 -35.230 1.00 70.51 H new ATOM 0 HG13 ILE A 84 26.957 45.290 -34.403 1.00 70.51 H new ATOM 0 HG21 ILE A 84 25.955 47.255 -35.478 1.00 63.41 H new ATOM 0 HG22 ILE A 84 25.196 47.122 -37.082 1.00 63.41 H new ATOM 0 HG23 ILE A 84 24.399 46.409 -35.659 1.00 63.41 H new ATOM 0 HD11 ILE A 84 25.437 43.666 -33.383 1.00 21.15 H new ATOM 0 HD12 ILE A 84 24.522 45.013 -34.101 1.00 21.15 H new ATOM 0 HD13 ILE A 84 24.606 43.446 -34.941 1.00 21.15 H new ATOM 1242 N VAL A 85 23.875 44.796 -39.201 1.00 45.21 N ATOM 1243 CA VAL A 85 23.485 45.421 -40.452 1.00 41.00 C ATOM 1244 C VAL A 85 22.600 46.631 -40.180 1.00 52.13 C ATOM 1245 O VAL A 85 21.525 46.508 -39.590 1.00 43.50 O ATOM 1246 CB VAL A 85 22.742 44.431 -41.373 1.00 62.43 C ATOM 1247 CG1 VAL A 85 22.313 45.107 -42.662 1.00 1.04 C ATOM 1248 CG2 VAL A 85 23.619 43.228 -41.670 1.00 64.33 C ATOM 0 H VAL A 85 23.193 44.135 -38.828 1.00 45.21 H new ATOM 0 HA VAL A 85 24.395 45.740 -40.960 1.00 41.00 H new ATOM 0 HB VAL A 85 21.845 44.091 -40.855 1.00 62.43 H new ATOM 0 HG11 VAL A 85 21.792 44.388 -43.294 1.00 1.04 H new ATOM 0 HG12 VAL A 85 21.647 45.939 -42.432 1.00 1.04 H new ATOM 0 HG13 VAL A 85 23.192 45.481 -43.187 1.00 1.04 H new ATOM 0 HG21 VAL A 85 23.082 42.538 -42.321 1.00 64.33 H new ATOM 0 HG22 VAL A 85 24.533 43.557 -42.165 1.00 64.33 H new ATOM 0 HG23 VAL A 85 23.873 42.724 -40.738 1.00 64.33 H new ATOM 1258 N ASP A 86 23.068 47.801 -40.577 1.00 31.13 N ATOM 1259 CA ASP A 86 22.314 49.028 -40.388 1.00 20.21 C ATOM 1260 C ASP A 86 21.998 49.670 -41.731 1.00 24.31 C ATOM 1261 O ASP A 86 22.898 50.009 -42.501 1.00 74.51 O ATOM 1262 CB ASP A 86 23.095 50.002 -39.504 1.00 4.42 C ATOM 1263 CG ASP A 86 22.351 51.297 -39.264 1.00 33.31 C ATOM 1264 OD1 ASP A 86 21.275 51.259 -38.633 1.00 21.44 O ATOM 1265 OD2 ASP A 86 22.852 52.362 -39.681 1.00 45.22 O1- ATOM 0 H ASP A 86 23.971 47.928 -41.034 1.00 31.13 H new ATOM 0 HA ASP A 86 21.375 48.784 -39.891 1.00 20.21 H new ATOM 0 HB2 ASP A 86 23.307 49.527 -38.546 1.00 4.42 H new ATOM 0 HB3 ASP A 86 24.055 50.221 -39.971 1.00 4.42 H new ATOM 1270 N ILE A 87 20.713 49.808 -42.015 1.00 70.13 N ATOM 1271 CA ILE A 87 20.268 50.427 -43.248 1.00 11.31 C ATOM 1272 C ILE A 87 19.952 51.894 -42.992 1.00 5.45 C ATOM 1273 O ILE A 87 18.861 52.236 -42.537 1.00 31.44 O ATOM 1274 CB ILE A 87 19.022 49.717 -43.823 1.00 73.15 C ATOM 1275 CG1 ILE A 87 19.282 48.209 -43.946 1.00 41.53 C ATOM 1276 CG2 ILE A 87 18.645 50.306 -45.179 1.00 33.35 C ATOM 1277 CD1 ILE A 87 18.085 47.415 -44.429 1.00 31.30 C ATOM 0 H ILE A 87 19.958 49.497 -41.403 1.00 70.13 H new ATOM 0 HA ILE A 87 21.070 50.340 -43.981 1.00 11.31 H new ATOM 0 HB ILE A 87 18.187 49.874 -43.140 1.00 73.15 H new ATOM 0 HG12 ILE A 87 20.113 48.049 -44.633 1.00 41.53 H new ATOM 0 HG13 ILE A 87 19.593 47.824 -42.975 1.00 41.53 H new ATOM 0 HG21 ILE A 87 17.765 49.792 -45.567 1.00 33.35 H new ATOM 0 HG22 ILE A 87 18.425 51.368 -45.066 1.00 33.35 H new ATOM 0 HG23 ILE A 87 19.475 50.179 -45.874 1.00 33.35 H new ATOM 0 HD11 ILE A 87 18.349 46.359 -44.489 1.00 31.30 H new ATOM 0 HD12 ILE A 87 17.258 47.543 -43.731 1.00 31.30 H new ATOM 0 HD13 ILE A 87 17.786 47.771 -45.415 1.00 31.30 H new ATOM 1289 N ALA A 88 20.923 52.752 -43.246 1.00 34.53 N ATOM 1290 CA ALA A 88 20.767 54.173 -42.984 1.00 21.21 C ATOM 1291 C ALA A 88 20.249 54.901 -44.216 1.00 23.43 C ATOM 1292 O ALA A 88 21.000 55.181 -45.149 1.00 54.14 O ATOM 1293 CB ALA A 88 22.084 54.774 -42.511 1.00 40.44 C ATOM 0 H ALA A 88 21.829 52.490 -43.634 1.00 34.53 H new ATOM 0 HA ALA A 88 20.029 54.295 -42.191 1.00 21.21 H new ATOM 0 HB1 ALA A 88 21.950 55.839 -42.319 1.00 40.44 H new ATOM 0 HB2 ALA A 88 22.402 54.277 -41.594 1.00 40.44 H new ATOM 0 HB3 ALA A 88 22.844 54.637 -43.280 1.00 40.44 H new ATOM 1299 N ASN A 89 18.957 55.177 -44.224 1.00 52.24 N ATOM 1300 CA ASN A 89 18.345 55.930 -45.310 1.00 21.13 C ATOM 1301 C ASN A 89 18.239 57.401 -44.939 1.00 22.12 C ATOM 1302 O ASN A 89 17.442 57.781 -44.078 1.00 62.21 O ATOM 1303 CB ASN A 89 16.952 55.383 -45.638 1.00 44.43 C ATOM 1304 CG ASN A 89 16.276 56.140 -46.777 1.00 51.24 C ATOM 1305 OD1 ASN A 89 16.409 55.629 -47.992 1.00 34.21 O flip ATOM 1306 ND2 ASN A 89 15.624 57.161 -46.562 1.00 52.10 N flip ATOM 0 H ASN A 89 18.308 54.891 -43.490 1.00 52.24 H new ATOM 0 HA ASN A 89 18.979 55.824 -46.190 1.00 21.13 H new ATOM 0 HB2 ASN A 89 17.033 54.329 -45.905 1.00 44.43 H new ATOM 0 HB3 ASN A 89 16.325 55.439 -44.748 1.00 44.43 H new ATOM 0 HD21 ASN A 89 15.544 57.525 -45.612 1.00 52.10 H new ATOM 0 HD22 ASN A 89 15.163 57.644 -47.333 1.00 52.10 H new ATOM 1313 N ARG A 90 19.060 58.220 -45.569 1.00 34.23 N ATOM 1314 CA ARG A 90 19.004 59.658 -45.368 1.00 61.53 C ATOM 1315 C ARG A 90 19.132 60.378 -46.694 1.00 14.51 C ATOM 1316 O ARG A 90 20.002 60.050 -47.502 1.00 31.12 O ATOM 1317 CB ARG A 90 20.106 60.138 -44.421 1.00 1.00 C ATOM 1318 CG ARG A 90 19.599 60.566 -43.056 1.00 75.44 C ATOM 1319 CD ARG A 90 20.502 61.628 -42.451 1.00 14.21 C ATOM 1320 NE ARG A 90 20.543 62.832 -43.284 1.00 45.22 N ATOM 1321 CZ ARG A 90 21.049 64.002 -42.902 1.00 45.51 C ATOM 1322 NH1 ARG A 90 21.611 64.137 -41.704 1.00 34.45 N1+ ATOM 1323 NH2 ARG A 90 20.995 65.034 -43.732 1.00 21.12 N ATOM 0 H ARG A 90 19.777 57.914 -46.227 1.00 34.23 H new ATOM 0 HA ARG A 90 18.039 59.887 -44.916 1.00 61.53 H new ATOM 0 HB2 ARG A 90 20.835 59.338 -44.293 1.00 1.00 H new ATOM 0 HB3 ARG A 90 20.629 60.975 -44.883 1.00 1.00 H new ATOM 0 HG2 ARG A 90 18.584 60.954 -43.146 1.00 75.44 H new ATOM 0 HG3 ARG A 90 19.553 59.702 -42.393 1.00 75.44 H new ATOM 0 HD2 ARG A 90 20.146 61.886 -41.454 1.00 14.21 H new ATOM 0 HD3 ARG A 90 21.510 61.229 -42.336 1.00 14.21 H new ATOM 0 HE ARG A 90 20.156 62.769 -44.225 1.00 45.22 H new ATOM 0 HH11 ARG A 90 21.657 63.340 -41.069 1.00 34.45 H new ATOM 0 HH12 ARG A 90 21.996 65.038 -41.420 1.00 34.45 H new ATOM 0 HH21 ARG A 90 20.569 64.926 -44.652 1.00 21.12 H new ATOM 0 HH22 ARG A 90 21.380 65.936 -43.450 1.00 21.12 H new ATOM 1337 N ASP A 91 18.236 61.334 -46.927 1.00 14.33 N ATOM 1338 CA ASP A 91 18.291 62.182 -48.118 1.00 71.02 C ATOM 1339 C ASP A 91 18.155 61.355 -49.397 1.00 43.52 C ATOM 1340 O ASP A 91 18.528 61.802 -50.484 1.00 61.51 O ATOM 1341 CB ASP A 91 19.600 62.985 -48.139 1.00 34.34 C ATOM 1342 CG ASP A 91 19.667 64.041 -47.048 1.00 2.00 C ATOM 1343 OD1 ASP A 91 19.829 63.678 -45.861 1.00 21.24 O ATOM 1344 OD2 ASP A 91 19.572 65.242 -47.380 1.00 32.31 O1- ATOM 0 H ASP A 91 17.457 61.543 -46.302 1.00 14.33 H new ATOM 0 HA ASP A 91 17.450 62.874 -48.076 1.00 71.02 H new ATOM 0 HB2 ASP A 91 20.441 62.301 -48.027 1.00 34.34 H new ATOM 0 HB3 ASP A 91 19.708 63.467 -49.111 1.00 34.34 H new ATOM 1349 N GLY A 92 17.614 60.149 -49.262 1.00 75.32 N ATOM 1350 CA GLY A 92 17.433 59.281 -50.407 1.00 62.34 C ATOM 1351 C GLY A 92 18.609 58.350 -50.618 1.00 52.21 C ATOM 1352 O GLY A 92 18.564 57.460 -51.465 1.00 23.30 O ATOM 0 H GLY A 92 17.297 59.757 -48.375 1.00 75.32 H new ATOM 0 HA2 GLY A 92 16.526 58.691 -50.273 1.00 62.34 H new ATOM 0 HA3 GLY A 92 17.289 59.888 -51.301 1.00 62.34 H new ATOM 1356 N GLN A 93 19.665 58.553 -49.843 1.00 55.42 N ATOM 1357 CA GLN A 93 20.856 57.731 -49.948 1.00 43.03 C ATOM 1358 C GLN A 93 20.758 56.540 -49.003 1.00 53.23 C ATOM 1359 O GLN A 93 20.495 56.705 -47.812 1.00 62.41 O ATOM 1360 CB GLN A 93 22.110 58.552 -49.620 1.00 32.14 C ATOM 1361 CG GLN A 93 22.291 59.795 -50.488 1.00 62.32 C ATOM 1362 CD GLN A 93 23.014 59.533 -51.804 1.00 5.43 C ATOM 1363 OE1 GLN A 93 22.883 58.332 -52.347 1.00 25.23 O flip ATOM 1364 NE2 GLN A 93 23.698 60.410 -52.327 1.00 33.20 N flip ATOM 0 H GLN A 93 19.718 59.283 -49.133 1.00 55.42 H new ATOM 0 HA GLN A 93 20.933 57.369 -50.973 1.00 43.03 H new ATOM 0 HB2 GLN A 93 22.068 58.856 -48.574 1.00 32.14 H new ATOM 0 HB3 GLN A 93 22.987 57.914 -49.731 1.00 32.14 H new ATOM 0 HG2 GLN A 93 21.311 60.222 -50.702 1.00 62.32 H new ATOM 0 HG3 GLN A 93 22.847 60.543 -49.922 1.00 62.32 H new ATOM 0 HE21 GLN A 93 23.779 61.325 -51.884 1.00 33.20 H new ATOM 0 HE22 GLN A 93 24.184 60.223 -53.204 1.00 33.20 H new ATOM 1373 N LEU A 94 20.947 55.344 -49.546 1.00 22.14 N ATOM 1374 CA LEU A 94 20.928 54.128 -48.744 1.00 50.31 C ATOM 1375 C LEU A 94 22.337 53.763 -48.316 1.00 43.43 C ATOM 1376 O LEU A 94 23.149 53.337 -49.134 1.00 52.24 O ATOM 1377 CB LEU A 94 20.314 52.954 -49.522 1.00 41.23 C ATOM 1378 CG LEU A 94 18.785 52.910 -49.586 1.00 41.02 C ATOM 1379 CD1 LEU A 94 18.194 52.789 -48.192 1.00 1.43 C ATOM 1380 CD2 LEU A 94 18.237 54.135 -50.296 1.00 42.11 C ATOM 0 H LEU A 94 21.115 55.190 -50.540 1.00 22.14 H new ATOM 0 HA LEU A 94 20.313 54.321 -47.865 1.00 50.31 H new ATOM 0 HB2 LEU A 94 20.699 52.980 -50.542 1.00 41.23 H new ATOM 0 HB3 LEU A 94 20.665 52.025 -49.073 1.00 41.23 H new ATOM 0 HG LEU A 94 18.495 52.029 -50.159 1.00 41.02 H new ATOM 0 HD11 LEU A 94 17.106 52.759 -48.259 1.00 1.43 H new ATOM 0 HD12 LEU A 94 18.554 51.873 -47.723 1.00 1.43 H new ATOM 0 HD13 LEU A 94 18.497 53.647 -47.593 1.00 1.43 H new ATOM 0 HD21 LEU A 94 17.149 54.080 -50.329 1.00 42.11 H new ATOM 0 HD22 LEU A 94 18.539 55.033 -49.758 1.00 42.11 H new ATOM 0 HD23 LEU A 94 18.629 54.172 -51.312 1.00 42.11 H new ATOM 1392 N GLN A 95 22.637 53.958 -47.047 1.00 22.34 N ATOM 1393 CA GLN A 95 23.922 53.563 -46.512 1.00 52.10 C ATOM 1394 C GLN A 95 23.803 52.236 -45.783 1.00 55.53 C ATOM 1395 O GLN A 95 23.408 52.188 -44.616 1.00 20.22 O ATOM 1396 CB GLN A 95 24.478 54.632 -45.574 1.00 54.30 C ATOM 1397 CG GLN A 95 24.848 55.925 -46.272 1.00 4.25 C ATOM 1398 CD GLN A 95 25.671 56.836 -45.387 1.00 5.40 C ATOM 1399 OE1 GLN A 95 25.136 57.642 -44.628 1.00 14.41 O ATOM 1400 NE2 GLN A 95 26.987 56.719 -45.480 1.00 5.31 N ATOM 0 H GLN A 95 22.008 54.387 -46.369 1.00 22.34 H new ATOM 0 HA GLN A 95 24.615 53.449 -47.346 1.00 52.10 H new ATOM 0 HB2 GLN A 95 23.738 54.845 -44.802 1.00 54.30 H new ATOM 0 HB3 GLN A 95 25.360 54.237 -45.070 1.00 54.30 H new ATOM 0 HG2 GLN A 95 25.408 55.699 -47.179 1.00 4.25 H new ATOM 0 HG3 GLN A 95 23.940 56.443 -46.579 1.00 4.25 H new ATOM 0 HE21 GLN A 95 27.394 56.039 -46.121 1.00 5.31 H new ATOM 0 HE22 GLN A 95 27.593 57.309 -44.910 1.00 5.31 H new ATOM 1409 N LEU A 96 24.114 51.164 -46.486 1.00 75.11 N ATOM 1410 CA LEU A 96 24.095 49.836 -45.903 1.00 53.33 C ATOM 1411 C LEU A 96 25.415 49.575 -45.197 1.00 12.32 C ATOM 1412 O LEU A 96 26.397 49.170 -45.820 1.00 51.50 O ATOM 1413 CB LEU A 96 23.857 48.781 -46.987 1.00 11.23 C ATOM 1414 CG LEU A 96 23.728 47.343 -46.484 1.00 54.15 C ATOM 1415 CD1 LEU A 96 22.496 47.191 -45.606 1.00 12.31 C ATOM 1416 CD2 LEU A 96 23.674 46.376 -47.655 1.00 11.35 C ATOM 0 H LEU A 96 24.385 51.188 -47.469 1.00 75.11 H new ATOM 0 HA LEU A 96 23.281 49.775 -45.180 1.00 53.33 H new ATOM 0 HB2 LEU A 96 22.948 49.041 -47.530 1.00 11.23 H new ATOM 0 HB3 LEU A 96 24.679 48.826 -47.701 1.00 11.23 H new ATOM 0 HG LEU A 96 24.606 47.108 -45.882 1.00 54.15 H new ATOM 0 HD11 LEU A 96 22.422 46.161 -45.258 1.00 12.31 H new ATOM 0 HD12 LEU A 96 22.576 47.859 -44.748 1.00 12.31 H new ATOM 0 HD13 LEU A 96 21.606 47.444 -46.181 1.00 12.31 H new ATOM 0 HD21 LEU A 96 23.582 45.356 -47.281 1.00 11.35 H new ATOM 0 HD22 LEU A 96 22.814 46.611 -48.282 1.00 11.35 H new ATOM 0 HD23 LEU A 96 24.587 46.466 -48.243 1.00 11.35 H new ATOM 1428 N ASN A 97 25.450 49.844 -43.906 1.00 24.34 N ATOM 1429 CA ASN A 97 26.679 49.702 -43.144 1.00 24.31 C ATOM 1430 C ASN A 97 26.601 48.485 -42.231 1.00 43.41 C ATOM 1431 O ASN A 97 25.642 48.308 -41.483 1.00 33.42 O ATOM 1432 CB ASN A 97 26.989 50.984 -42.351 1.00 32.34 C ATOM 1433 CG ASN A 97 25.981 51.291 -41.257 1.00 4.11 C ATOM 1434 OD1 ASN A 97 26.172 50.911 -40.103 1.00 11.22 O ATOM 1435 ND2 ASN A 97 24.906 51.988 -41.608 1.00 2.51 N ATOM 0 H ASN A 97 24.646 50.161 -43.363 1.00 24.34 H new ATOM 0 HA ASN A 97 27.502 49.546 -43.842 1.00 24.31 H new ATOM 0 HB2 ASN A 97 27.979 50.892 -41.904 1.00 32.34 H new ATOM 0 HB3 ASN A 97 27.028 51.826 -43.042 1.00 32.34 H new ATOM 0 HD21 ASN A 97 24.202 52.226 -40.909 1.00 2.51 H new ATOM 0 HD22 ASN A 97 24.784 52.285 -42.576 1.00 2.51 H new ATOM 1442 N VAL A 98 27.600 47.629 -42.334 1.00 45.14 N ATOM 1443 CA VAL A 98 27.654 46.419 -41.534 1.00 72.02 C ATOM 1444 C VAL A 98 28.880 46.427 -40.642 1.00 15.31 C ATOM 1445 O VAL A 98 29.989 46.723 -41.089 1.00 42.35 O ATOM 1446 CB VAL A 98 27.677 45.146 -42.412 1.00 44.14 C ATOM 1447 CG1 VAL A 98 27.859 43.896 -41.560 1.00 50.42 C ATOM 1448 CG2 VAL A 98 26.405 45.036 -43.226 1.00 24.02 C ATOM 0 H VAL A 98 28.390 47.750 -42.968 1.00 45.14 H new ATOM 0 HA VAL A 98 26.751 46.401 -40.924 1.00 72.02 H new ATOM 0 HB VAL A 98 28.525 45.227 -43.092 1.00 44.14 H new ATOM 0 HG11 VAL A 98 27.872 43.016 -42.203 1.00 50.42 H new ATOM 0 HG12 VAL A 98 28.801 43.961 -41.015 1.00 50.42 H new ATOM 0 HG13 VAL A 98 27.035 43.816 -40.851 1.00 50.42 H new ATOM 0 HG21 VAL A 98 26.441 44.134 -43.837 1.00 24.02 H new ATOM 0 HG22 VAL A 98 25.547 44.986 -42.555 1.00 24.02 H new ATOM 0 HG23 VAL A 98 26.310 45.908 -43.872 1.00 24.02 H new ATOM 1458 N THR A 99 28.661 46.127 -39.379 1.00 13.53 N ATOM 1459 CA THR A 99 29.739 45.946 -38.439 1.00 63.52 C ATOM 1460 C THR A 99 29.913 44.456 -38.165 1.00 34.14 C ATOM 1461 O THR A 99 29.023 43.813 -37.602 1.00 52.04 O ATOM 1462 CB THR A 99 29.444 46.695 -37.133 1.00 15.12 C ATOM 1463 OG1 THR A 99 29.027 48.032 -37.439 1.00 32.14 O ATOM 1464 CG2 THR A 99 30.668 46.737 -36.228 1.00 64.32 C ATOM 0 H THR A 99 27.731 46.003 -38.979 1.00 13.53 H new ATOM 0 HA THR A 99 30.659 46.351 -38.861 1.00 63.52 H new ATOM 0 HB THR A 99 28.652 46.165 -36.604 1.00 15.12 H new ATOM 0 HG1 THR A 99 28.836 48.514 -36.607 1.00 32.14 H new ATOM 0 HG21 THR A 99 30.425 47.275 -35.312 1.00 64.32 H new ATOM 0 HG22 THR A 99 30.974 45.720 -35.982 1.00 64.32 H new ATOM 0 HG23 THR A 99 31.483 47.246 -36.742 1.00 64.32 H new ATOM 1472 N ASP A 100 31.039 43.908 -38.605 1.00 61.11 N ATOM 1473 CA ASP A 100 31.280 42.473 -38.500 1.00 23.41 C ATOM 1474 C ASP A 100 31.406 42.020 -37.048 1.00 63.40 C ATOM 1475 O ASP A 100 31.798 42.791 -36.167 1.00 62.23 O ATOM 1476 CB ASP A 100 32.528 42.067 -39.285 1.00 14.41 C ATOM 1477 CG ASP A 100 32.780 40.570 -39.225 1.00 53.52 C ATOM 1478 OD1 ASP A 100 33.853 40.166 -38.742 1.00 4.12 O ATOM 1479 OD2 ASP A 100 31.892 39.792 -39.623 1.00 11.31 O1- ATOM 0 H ASP A 100 31.799 44.434 -39.037 1.00 61.11 H new ATOM 0 HA ASP A 100 30.413 41.975 -38.933 1.00 23.41 H new ATOM 0 HB2 ASP A 100 32.417 42.374 -40.325 1.00 14.41 H new ATOM 0 HB3 ASP A 100 33.394 42.596 -38.887 1.00 14.41 H new ATOM 1484 N ARG A 101 31.085 40.756 -36.824 1.00 1.22 N ATOM 1485 CA ARG A 101 31.050 40.174 -35.490 1.00 70.42 C ATOM 1486 C ARG A 101 32.439 39.737 -35.024 1.00 41.44 C ATOM 1487 O ARG A 101 32.736 39.759 -33.832 1.00 3.54 O ATOM 1488 CB ARG A 101 30.106 38.967 -35.488 1.00 70.04 C ATOM 1489 CG ARG A 101 30.464 37.920 -36.535 1.00 12.41 C ATOM 1490 CD ARG A 101 29.605 36.678 -36.404 1.00 13.24 C ATOM 1491 NE ARG A 101 29.852 35.720 -37.482 1.00 14.53 N ATOM 1492 CZ ARG A 101 29.309 34.505 -37.524 1.00 32.32 C ATOM 1493 NH1 ARG A 101 28.539 34.085 -36.531 1.00 20.33 N1+ ATOM 1494 NH2 ARG A 101 29.542 33.709 -38.559 1.00 52.25 N ATOM 0 H ARG A 101 30.840 40.100 -37.566 1.00 1.22 H new ATOM 0 HA ARG A 101 30.692 40.937 -34.799 1.00 70.42 H new ATOM 0 HB2 ARG A 101 30.122 38.504 -34.501 1.00 70.04 H new ATOM 0 HB3 ARG A 101 29.087 39.311 -35.662 1.00 70.04 H new ATOM 0 HG2 ARG A 101 30.340 38.345 -37.531 1.00 12.41 H new ATOM 0 HG3 ARG A 101 31.515 37.648 -36.433 1.00 12.41 H new ATOM 0 HD2 ARG A 101 29.802 36.201 -35.444 1.00 13.24 H new ATOM 0 HD3 ARG A 101 28.553 36.964 -36.408 1.00 13.24 H new ATOM 0 HE ARG A 101 30.473 35.998 -38.242 1.00 14.53 H new ATOM 0 HH11 ARG A 101 28.361 34.693 -35.732 1.00 20.33 H new ATOM 0 HH12 ARG A 101 28.124 33.154 -36.566 1.00 20.33 H new ATOM 0 HH21 ARG A 101 30.138 34.027 -39.323 1.00 52.25 H new ATOM 0 HH22 ARG A 101 29.126 32.778 -38.591 1.00 52.25 H new ATOM 1508 N LYS A 102 33.286 39.348 -35.969 1.00 25.22 N ATOM 1509 CA LYS A 102 34.580 38.760 -35.642 1.00 51.24 C ATOM 1510 C LYS A 102 35.717 39.744 -35.885 1.00 24.03 C ATOM 1511 O LYS A 102 36.424 40.144 -34.959 1.00 61.52 O ATOM 1512 CB LYS A 102 34.800 37.504 -36.482 1.00 63.24 C ATOM 1513 CG LYS A 102 33.862 36.363 -36.132 1.00 64.00 C ATOM 1514 CD LYS A 102 33.837 35.313 -37.230 1.00 42.35 C ATOM 1515 CE LYS A 102 33.133 34.045 -36.777 1.00 32.33 C ATOM 1516 NZ LYS A 102 33.945 33.283 -35.796 1.00 73.14 N1+ ATOM 0 H LYS A 102 33.100 39.429 -36.969 1.00 25.22 H new ATOM 0 HA LYS A 102 34.576 38.503 -34.583 1.00 51.24 H new ATOM 0 HB2 LYS A 102 34.675 37.756 -37.535 1.00 63.24 H new ATOM 0 HB3 LYS A 102 35.829 37.168 -36.355 1.00 63.24 H new ATOM 0 HG2 LYS A 102 34.177 35.905 -35.195 1.00 64.00 H new ATOM 0 HG3 LYS A 102 32.856 36.752 -35.974 1.00 64.00 H new ATOM 0 HD2 LYS A 102 33.332 35.716 -38.108 1.00 42.35 H new ATOM 0 HD3 LYS A 102 34.858 35.076 -37.530 1.00 42.35 H new ATOM 0 HE2 LYS A 102 32.172 34.302 -36.331 1.00 32.33 H new ATOM 0 HE3 LYS A 102 32.925 33.416 -37.643 1.00 32.33 H new ATOM 0 HZ1 LYS A 102 33.543 32.331 -35.678 1.00 73.14 H new ATOM 0 HZ2 LYS A 102 34.923 33.206 -36.141 1.00 73.14 H new ATOM 0 HZ3 LYS A 102 33.938 33.778 -34.881 1.00 73.14 H new ATOM 1530 N THR A 103 35.878 40.136 -37.134 1.00 32.11 N ATOM 1531 CA THR A 103 36.950 41.030 -37.526 1.00 65.25 C ATOM 1532 C THR A 103 36.591 42.462 -37.159 1.00 51.12 C ATOM 1533 O THR A 103 37.457 43.332 -37.047 1.00 72.12 O ATOM 1534 CB THR A 103 37.232 40.917 -39.036 1.00 3.51 C ATOM 1535 OG1 THR A 103 36.029 41.139 -39.788 1.00 71.14 O ATOM 1536 CG2 THR A 103 37.788 39.542 -39.372 1.00 15.44 C ATOM 0 H THR A 103 35.273 39.846 -37.902 1.00 32.11 H new ATOM 0 HA THR A 103 37.855 40.743 -36.991 1.00 65.25 H new ATOM 0 HB THR A 103 37.968 41.676 -39.301 1.00 3.51 H new ATOM 0 HG1 THR A 103 35.362 40.463 -39.545 1.00 71.14 H new ATOM 0 HG21 THR A 103 37.982 39.480 -40.443 1.00 15.44 H new ATOM 0 HG22 THR A 103 38.717 39.382 -38.825 1.00 15.44 H new ATOM 0 HG23 THR A 103 37.064 38.778 -39.089 1.00 15.44 H new ATOM 1544 N GLY A 104 35.298 42.691 -36.960 1.00 65.24 N ATOM 1545 CA GLY A 104 34.822 43.998 -36.563 1.00 42.41 C ATOM 1546 C GLY A 104 34.944 45.016 -37.671 1.00 24.42 C ATOM 1547 O GLY A 104 35.065 46.211 -37.409 1.00 13.23 O ATOM 0 H GLY A 104 34.568 41.987 -37.068 1.00 65.24 H new ATOM 0 HA2 GLY A 104 33.779 43.924 -36.255 1.00 42.41 H new ATOM 0 HA3 GLY A 104 35.387 44.339 -35.696 1.00 42.41 H new ATOM 1551 N GLN A 105 34.929 44.541 -38.907 1.00 51.35 N ATOM 1552 CA GLN A 105 34.995 45.418 -40.063 1.00 72.04 C ATOM 1553 C GLN A 105 33.731 46.256 -40.152 1.00 12.40 C ATOM 1554 O GLN A 105 32.624 45.720 -40.144 1.00 64.30 O ATOM 1555 CB GLN A 105 35.162 44.602 -41.346 1.00 71.44 C ATOM 1556 CG GLN A 105 36.400 43.720 -41.359 1.00 11.23 C ATOM 1557 CD GLN A 105 37.691 44.509 -41.283 1.00 44.43 C ATOM 1558 OE1 GLN A 105 38.255 44.887 -42.308 1.00 42.45 O ATOM 1559 NE2 GLN A 105 38.178 44.743 -40.074 1.00 23.32 N ATOM 0 H GLN A 105 34.871 43.548 -39.134 1.00 51.35 H new ATOM 0 HA GLN A 105 35.857 46.075 -39.949 1.00 72.04 H new ATOM 0 HB2 GLN A 105 34.281 43.976 -41.484 1.00 71.44 H new ATOM 0 HB3 GLN A 105 35.205 45.284 -42.195 1.00 71.44 H new ATOM 0 HG2 GLN A 105 36.354 43.027 -40.519 1.00 11.23 H new ATOM 0 HG3 GLN A 105 36.401 43.119 -42.268 1.00 11.23 H new ATOM 0 HE21 GLN A 105 37.677 44.411 -39.250 1.00 23.32 H new ATOM 0 HE22 GLN A 105 39.054 45.255 -39.967 1.00 23.32 H new ATOM 1568 N THR A 106 33.897 47.564 -40.214 1.00 25.35 N ATOM 1569 CA THR A 106 32.772 48.457 -40.393 1.00 43.25 C ATOM 1570 C THR A 106 32.727 48.915 -41.844 1.00 44.11 C ATOM 1571 O THR A 106 33.387 49.884 -42.223 1.00 33.22 O ATOM 1572 CB THR A 106 32.861 49.680 -39.457 1.00 61.32 C ATOM 1573 OG1 THR A 106 33.074 49.246 -38.104 1.00 1.35 O ATOM 1574 CG2 THR A 106 31.585 50.510 -39.529 1.00 5.13 C ATOM 0 H THR A 106 34.801 48.030 -40.143 1.00 25.35 H new ATOM 0 HA THR A 106 31.860 47.917 -40.141 1.00 43.25 H new ATOM 0 HB THR A 106 33.699 50.298 -39.780 1.00 61.32 H new ATOM 0 HG1 THR A 106 33.131 50.027 -37.515 1.00 1.35 H new ATOM 0 HG21 THR A 106 31.670 51.367 -38.861 1.00 5.13 H new ATOM 0 HG22 THR A 106 31.436 50.860 -40.551 1.00 5.13 H new ATOM 0 HG23 THR A 106 30.735 49.898 -39.227 1.00 5.13 H new ATOM 1582 N SER A 107 31.981 48.191 -42.662 1.00 30.10 N ATOM 1583 CA SER A 107 31.912 48.482 -44.082 1.00 71.15 C ATOM 1584 C SER A 107 30.639 49.254 -44.397 1.00 42.21 C ATOM 1585 O SER A 107 29.534 48.796 -44.103 1.00 53.14 O ATOM 1586 CB SER A 107 31.970 47.182 -44.891 1.00 62.32 C ATOM 1587 OG SER A 107 32.099 47.438 -46.281 1.00 35.01 O ATOM 0 H SER A 107 31.414 47.397 -42.365 1.00 30.10 H new ATOM 0 HA SER A 107 32.767 49.099 -44.359 1.00 71.15 H new ATOM 0 HB2 SER A 107 32.812 46.579 -44.552 1.00 62.32 H new ATOM 0 HB3 SER A 107 31.067 46.599 -44.710 1.00 62.32 H new ATOM 0 HG SER A 107 32.135 46.588 -46.768 1.00 35.01 H new ATOM 1593 N THR A 108 30.800 50.435 -44.969 1.00 61.34 N ATOM 1594 CA THR A 108 29.670 51.264 -45.335 1.00 45.01 C ATOM 1595 C THR A 108 29.419 51.189 -46.836 1.00 51.14 C ATOM 1596 O THR A 108 30.132 51.804 -47.631 1.00 24.12 O ATOM 1597 CB THR A 108 29.901 52.731 -44.917 1.00 51.54 C ATOM 1598 OG1 THR A 108 30.270 52.792 -43.533 1.00 42.23 O ATOM 1599 CG2 THR A 108 28.648 53.562 -45.146 1.00 12.31 C ATOM 0 H THR A 108 31.709 50.841 -45.190 1.00 61.34 H new ATOM 0 HA THR A 108 28.794 50.887 -44.807 1.00 45.01 H new ATOM 0 HB THR A 108 30.706 53.138 -45.529 1.00 51.54 H new ATOM 0 HG1 THR A 108 30.417 53.726 -43.274 1.00 42.23 H new ATOM 0 HG21 THR A 108 28.835 54.593 -44.844 1.00 12.31 H new ATOM 0 HG22 THR A 108 28.382 53.536 -46.203 1.00 12.31 H new ATOM 0 HG23 THR A 108 27.828 53.154 -44.555 1.00 12.31 H new ATOM 1607 N ILE A 109 28.417 50.418 -47.220 1.00 13.34 N ATOM 1608 CA ILE A 109 28.048 50.299 -48.615 1.00 55.11 C ATOM 1609 C ILE A 109 26.959 51.310 -48.939 1.00 14.15 C ATOM 1610 O ILE A 109 25.773 51.053 -48.734 1.00 1.14 O ATOM 1611 CB ILE A 109 27.559 48.875 -48.963 1.00 61.20 C ATOM 1612 CG1 ILE A 109 28.596 47.833 -48.527 1.00 73.01 C ATOM 1613 CG2 ILE A 109 27.296 48.763 -50.460 1.00 4.42 C ATOM 1614 CD1 ILE A 109 28.154 46.402 -48.759 1.00 12.41 C ATOM 0 H ILE A 109 27.845 49.865 -46.582 1.00 13.34 H new ATOM 0 HA ILE A 109 28.936 50.498 -49.215 1.00 55.11 H new ATOM 0 HB ILE A 109 26.629 48.684 -48.427 1.00 61.20 H new ATOM 0 HG12 ILE A 109 29.526 48.009 -49.068 1.00 73.01 H new ATOM 0 HG13 ILE A 109 28.813 47.970 -47.468 1.00 73.01 H new ATOM 0 HG21 ILE A 109 26.952 47.756 -50.695 1.00 4.42 H new ATOM 0 HG22 ILE A 109 26.532 49.484 -50.750 1.00 4.42 H new ATOM 0 HG23 ILE A 109 28.216 48.969 -51.007 1.00 4.42 H new ATOM 0 HD11 ILE A 109 28.938 45.721 -48.427 1.00 12.41 H new ATOM 0 HD12 ILE A 109 27.241 46.207 -48.196 1.00 12.41 H new ATOM 0 HD13 ILE A 109 27.965 46.247 -49.821 1.00 12.41 H new ATOM 1626 N GLN A 110 27.367 52.481 -49.394 1.00 42.43 N ATOM 1627 CA GLN A 110 26.420 53.535 -49.708 1.00 3.53 C ATOM 1628 C GLN A 110 25.966 53.423 -51.160 1.00 10.22 C ATOM 1629 O GLN A 110 26.785 53.255 -52.067 1.00 61.10 O ATOM 1630 CB GLN A 110 27.037 54.916 -49.436 1.00 51.25 C ATOM 1631 CG GLN A 110 28.144 55.313 -50.405 1.00 2.41 C ATOM 1632 CD GLN A 110 28.827 56.608 -50.016 1.00 4.14 C ATOM 1633 OE1 GLN A 110 28.390 57.691 -50.391 1.00 23.33 O ATOM 1634 NE2 GLN A 110 29.925 56.497 -49.284 1.00 32.10 N ATOM 0 H GLN A 110 28.344 52.725 -49.554 1.00 42.43 H new ATOM 0 HA GLN A 110 25.548 53.421 -49.064 1.00 3.53 H new ATOM 0 HB2 GLN A 110 26.248 55.667 -49.477 1.00 51.25 H new ATOM 0 HB3 GLN A 110 27.437 54.929 -48.422 1.00 51.25 H new ATOM 0 HG2 GLN A 110 28.886 54.515 -50.449 1.00 2.41 H new ATOM 0 HG3 GLN A 110 27.725 55.415 -51.406 1.00 2.41 H new ATOM 0 HE21 GLN A 110 30.253 55.576 -48.994 1.00 32.10 H new ATOM 0 HE22 GLN A 110 30.442 57.332 -49.011 1.00 32.10 H new ATOM 1643 N VAL A 111 24.658 53.476 -51.378 1.00 22.34 N ATOM 1644 CA VAL A 111 24.119 53.477 -52.729 1.00 74.24 C ATOM 1645 C VAL A 111 24.265 54.864 -53.340 1.00 21.00 C ATOM 1646 O VAL A 111 23.340 55.680 -53.308 1.00 75.11 O ATOM 1647 CB VAL A 111 22.639 53.034 -52.763 1.00 73.33 C ATOM 1648 CG1 VAL A 111 22.123 52.963 -54.187 1.00 13.23 C ATOM 1649 CG2 VAL A 111 22.469 51.693 -52.073 1.00 44.35 C ATOM 0 H VAL A 111 23.955 53.519 -50.640 1.00 22.34 H new ATOM 0 HA VAL A 111 24.688 52.755 -53.314 1.00 74.24 H new ATOM 0 HB VAL A 111 22.053 53.780 -52.227 1.00 73.33 H new ATOM 0 HG11 VAL A 111 21.079 52.649 -54.181 1.00 13.23 H new ATOM 0 HG12 VAL A 111 22.203 53.945 -54.653 1.00 13.23 H new ATOM 0 HG13 VAL A 111 22.715 52.244 -54.753 1.00 13.23 H new ATOM 0 HG21 VAL A 111 21.421 51.397 -52.107 1.00 44.35 H new ATOM 0 HG22 VAL A 111 23.074 50.943 -52.582 1.00 44.35 H new ATOM 0 HG23 VAL A 111 22.790 51.775 -51.034 1.00 44.35 H new ATOM 1659 N SER A 112 25.459 55.139 -53.840 1.00 13.43 N ATOM 1660 CA SER A 112 25.767 56.411 -54.463 1.00 25.44 C ATOM 1661 C SER A 112 27.020 56.260 -55.314 1.00 41.43 C ATOM 1662 O SER A 112 27.964 55.569 -54.922 1.00 54.32 O ATOM 1663 CB SER A 112 25.978 57.494 -53.394 1.00 73.52 C ATOM 1664 OG SER A 112 26.099 58.782 -53.977 1.00 50.04 O ATOM 0 H SER A 112 26.241 54.484 -53.824 1.00 13.43 H new ATOM 0 HA SER A 112 24.932 56.714 -55.095 1.00 25.44 H new ATOM 0 HB2 SER A 112 25.141 57.486 -52.696 1.00 73.52 H new ATOM 0 HB3 SER A 112 26.875 57.268 -52.818 1.00 73.52 H new ATOM 0 HG SER A 112 26.231 59.449 -53.272 1.00 50.04 H new ATOM 1670 N GLY A 113 27.026 56.892 -56.477 1.00 3.12 N ATOM 1671 CA GLY A 113 28.171 56.800 -57.353 1.00 51.54 C ATOM 1672 C GLY A 113 29.185 57.884 -57.072 1.00 51.43 C ATOM 1673 O GLY A 113 30.220 57.960 -57.732 1.00 53.21 O ATOM 0 H GLY A 113 26.259 57.466 -56.828 1.00 3.12 H new ATOM 0 HA2 GLY A 113 28.641 55.824 -57.234 1.00 51.54 H new ATOM 0 HA3 GLY A 113 27.842 56.871 -58.390 1.00 51.54 H new ATOM 1677 N LEU A 114 28.889 58.725 -56.093 1.00 24.32 N ATOM 1678 CA LEU A 114 29.778 59.815 -55.735 1.00 41.32 C ATOM 1679 C LEU A 114 30.621 59.455 -54.518 1.00 21.34 C ATOM 1680 O LEU A 114 30.448 60.019 -53.441 1.00 34.33 O ATOM 1681 CB LEU A 114 28.983 61.094 -55.458 1.00 64.43 C ATOM 1682 CG LEU A 114 28.188 61.642 -56.645 1.00 3.52 C ATOM 1683 CD1 LEU A 114 27.413 62.885 -56.237 1.00 71.24 C ATOM 1684 CD2 LEU A 114 29.114 61.953 -57.813 1.00 25.04 C ATOM 0 H LEU A 114 28.038 58.672 -55.533 1.00 24.32 H new ATOM 0 HA LEU A 114 30.444 59.990 -56.580 1.00 41.32 H new ATOM 0 HB2 LEU A 114 28.292 60.902 -54.637 1.00 64.43 H new ATOM 0 HB3 LEU A 114 29.674 61.865 -55.118 1.00 64.43 H new ATOM 0 HG LEU A 114 27.478 60.879 -56.963 1.00 3.52 H new ATOM 0 HD11 LEU A 114 26.853 63.262 -57.093 1.00 71.24 H new ATOM 0 HD12 LEU A 114 26.721 62.635 -55.433 1.00 71.24 H new ATOM 0 HD13 LEU A 114 28.108 63.651 -55.893 1.00 71.24 H new ATOM 0 HD21 LEU A 114 28.530 62.341 -58.647 1.00 25.04 H new ATOM 0 HD22 LEU A 114 29.849 62.698 -57.507 1.00 25.04 H new ATOM 0 HD23 LEU A 114 29.628 61.043 -58.123 1.00 25.04 H new ATOM 1696 N GLN A 115 31.520 58.498 -54.687 1.00 45.34 N ATOM 1697 CA GLN A 115 32.446 58.139 -53.623 1.00 40.42 C ATOM 1698 C GLN A 115 33.731 58.943 -53.774 1.00 4.04 C ATOM 1699 O GLN A 115 34.709 58.470 -54.354 1.00 53.53 O ATOM 1700 CB GLN A 115 32.753 56.638 -53.633 1.00 34.14 C ATOM 1701 CG GLN A 115 31.547 55.757 -53.340 1.00 25.34 C ATOM 1702 CD GLN A 115 31.905 54.282 -53.304 1.00 62.34 C ATOM 1703 OE1 GLN A 115 32.248 53.732 -52.252 1.00 30.31 O ATOM 1704 NE2 GLN A 115 31.831 53.632 -54.452 1.00 61.02 N ATOM 0 H GLN A 115 31.629 57.958 -55.546 1.00 45.34 H new ATOM 0 HA GLN A 115 31.980 58.374 -52.666 1.00 40.42 H new ATOM 0 HB2 GLN A 115 33.159 56.367 -54.607 1.00 34.14 H new ATOM 0 HB3 GLN A 115 33.529 56.431 -52.896 1.00 34.14 H new ATOM 0 HG2 GLN A 115 31.113 56.046 -52.383 1.00 25.34 H new ATOM 0 HG3 GLN A 115 30.784 55.925 -54.100 1.00 25.34 H new ATOM 0 HE21 GLN A 115 31.543 54.123 -55.298 1.00 61.02 H new ATOM 0 HE22 GLN A 115 32.061 52.639 -54.492 1.00 61.02 H new ATOM 1713 N ASN A 116 33.708 60.172 -53.282 1.00 43.54 N ATOM 1714 CA ASN A 116 34.838 61.080 -53.430 1.00 10.42 C ATOM 1715 C ASN A 116 35.428 61.421 -52.076 1.00 30.14 C ATOM 1716 O ASN A 116 36.647 61.493 -51.919 1.00 42.14 O ATOM 1717 CB ASN A 116 34.402 62.366 -54.139 1.00 13.45 C ATOM 1718 CG ASN A 116 33.953 62.128 -55.566 1.00 41.32 C ATOM 1719 OD1 ASN A 116 34.459 61.243 -56.255 1.00 22.52 O ATOM 1720 ND2 ASN A 116 32.991 62.914 -56.019 1.00 63.44 N ATOM 0 H ASN A 116 32.916 60.566 -52.774 1.00 43.54 H new ATOM 0 HA ASN A 116 35.597 60.581 -54.032 1.00 10.42 H new ATOM 0 HB2 ASN A 116 33.588 62.826 -53.579 1.00 13.45 H new ATOM 0 HB3 ASN A 116 35.230 63.075 -54.137 1.00 13.45 H new ATOM 0 HD21 ASN A 116 32.643 62.798 -56.971 1.00 63.44 H new ATOM 0 HD22 ASN A 116 32.597 63.637 -55.417 1.00 63.44 H new ATOM 1727 N ASN A 117 34.557 61.639 -51.099 1.00 33.24 N ATOM 1728 CA ASN A 117 34.995 61.960 -49.748 1.00 2.33 C ATOM 1729 C ASN A 117 35.689 60.755 -49.132 1.00 51.41 C ATOM 1730 O ASN A 117 35.144 59.650 -49.136 1.00 1.42 O ATOM 1731 CB ASN A 117 33.814 62.380 -48.864 1.00 61.13 C ATOM 1732 CG ASN A 117 33.074 63.604 -49.380 1.00 30.42 C ATOM 1733 OD1 ASN A 117 33.767 64.475 -50.098 1.00 34.24 O flip ATOM 1734 ND2 ASN A 117 31.878 63.763 -49.133 1.00 5.04 N flip ATOM 0 H ASN A 117 33.545 61.599 -51.217 1.00 33.24 H new ATOM 0 HA ASN A 117 35.691 62.797 -49.809 1.00 2.33 H new ATOM 0 HB2 ASN A 117 33.114 61.548 -48.787 1.00 61.13 H new ATOM 0 HB3 ASN A 117 34.179 62.584 -47.857 1.00 61.13 H new ATOM 0 HD21 ASN A 117 31.376 63.071 -48.577 1.00 5.04 H new ATOM 0 HD22 ASN A 117 31.390 64.586 -49.485 1.00 5.04 H new ATOM 1741 N SER A 118 36.893 60.971 -48.618 1.00 14.15 N ATOM 1742 CA SER A 118 37.678 59.896 -48.029 1.00 75.22 C ATOM 1743 C SER A 118 36.974 59.334 -46.797 1.00 42.11 C ATOM 1744 O SER A 118 37.027 59.916 -45.710 1.00 3.43 O ATOM 1745 CB SER A 118 39.078 60.400 -47.663 1.00 22.31 C ATOM 1746 OG SER A 118 39.916 59.341 -47.221 1.00 43.44 O ATOM 0 H SER A 118 37.347 61.884 -48.598 1.00 14.15 H new ATOM 0 HA SER A 118 37.777 59.096 -48.763 1.00 75.22 H new ATOM 0 HB2 SER A 118 39.529 60.884 -48.529 1.00 22.31 H new ATOM 0 HB3 SER A 118 39.001 61.155 -46.880 1.00 22.31 H new ATOM 0 HG SER A 118 40.801 59.696 -46.997 1.00 43.44 H new ATOM 1752 N THR A 119 36.309 58.205 -46.985 1.00 1.13 N ATOM 1753 CA THR A 119 35.560 57.573 -45.922 1.00 11.34 C ATOM 1754 C THR A 119 36.402 56.484 -45.272 1.00 73.20 C ATOM 1755 O THR A 119 36.637 55.428 -45.862 1.00 53.00 O ATOM 1756 CB THR A 119 34.245 56.974 -46.458 1.00 14.15 C ATOM 1757 OG1 THR A 119 33.528 57.976 -47.197 1.00 61.21 O ATOM 1758 CG2 THR A 119 33.375 56.460 -45.317 1.00 31.13 C ATOM 0 H THR A 119 36.276 57.707 -47.875 1.00 1.13 H new ATOM 0 HA THR A 119 35.313 58.330 -45.178 1.00 11.34 H new ATOM 0 HB THR A 119 34.488 56.135 -47.110 1.00 14.15 H new ATOM 0 HG1 THR A 119 34.107 58.343 -47.897 1.00 61.21 H new ATOM 0 HG21 THR A 119 32.453 56.042 -45.722 1.00 31.13 H new ATOM 0 HG22 THR A 119 33.913 55.687 -44.769 1.00 31.13 H new ATOM 0 HG23 THR A 119 33.135 57.283 -44.643 1.00 31.13 H new ATOM 1766 N ASP A 120 36.887 56.770 -44.078 1.00 14.24 N ATOM 1767 CA ASP A 120 37.709 55.831 -43.335 1.00 62.41 C ATOM 1768 C ASP A 120 37.378 55.923 -41.860 1.00 11.22 C ATOM 1769 O ASP A 120 37.293 57.017 -41.303 1.00 34.13 O ATOM 1770 CB ASP A 120 39.195 56.120 -43.554 1.00 21.11 C ATOM 1771 CG ASP A 120 40.087 55.203 -42.741 1.00 5.01 C ATOM 1772 OD1 ASP A 120 40.282 54.040 -43.150 1.00 42.22 O ATOM 1773 OD2 ASP A 120 40.602 55.642 -41.690 1.00 22.14 O1- ATOM 0 H ASP A 120 36.724 57.655 -43.597 1.00 14.24 H new ATOM 0 HA ASP A 120 37.499 54.823 -43.694 1.00 62.41 H new ATOM 0 HB2 ASP A 120 39.432 56.009 -44.612 1.00 21.11 H new ATOM 0 HB3 ASP A 120 39.404 57.156 -43.288 1.00 21.11 H new ATOM 1778 N PHE A 121 37.182 54.782 -41.230 1.00 13.21 N ATOM 1779 CA PHE A 121 36.853 54.750 -39.822 1.00 25.12 C ATOM 1780 C PHE A 121 37.802 53.811 -39.100 1.00 43.12 C ATOM 1781 O PHE A 121 37.446 52.680 -38.764 1.00 24.43 O ATOM 1782 CB PHE A 121 35.395 54.323 -39.616 1.00 11.52 C ATOM 1783 CG PHE A 121 34.920 54.441 -38.193 1.00 23.13 C ATOM 1784 CD1 PHE A 121 34.660 53.308 -37.438 1.00 75.24 C ATOM 1785 CD2 PHE A 121 34.731 55.684 -37.613 1.00 41.35 C ATOM 1786 CE1 PHE A 121 34.220 53.415 -36.133 1.00 60.15 C ATOM 1787 CE2 PHE A 121 34.293 55.797 -36.306 1.00 43.42 C ATOM 1788 CZ PHE A 121 34.035 54.660 -35.566 1.00 30.42 C ATOM 0 H PHE A 121 37.245 53.865 -41.672 1.00 13.21 H new ATOM 0 HA PHE A 121 36.965 55.751 -39.406 1.00 25.12 H new ATOM 0 HB2 PHE A 121 34.755 54.932 -40.254 1.00 11.52 H new ATOM 0 HB3 PHE A 121 35.280 53.289 -39.943 1.00 11.52 H new ATOM 0 HD1 PHE A 121 34.803 52.331 -37.875 1.00 75.24 H new ATOM 0 HD2 PHE A 121 34.928 56.576 -38.188 1.00 41.35 H new ATOM 0 HE1 PHE A 121 34.021 52.524 -35.556 1.00 60.15 H new ATOM 0 HE2 PHE A 121 34.153 56.773 -35.865 1.00 43.42 H new ATOM 0 HZ PHE A 121 33.689 54.745 -34.546 1.00 30.42 H new ATOM 1798 N HIS A 122 39.035 54.267 -38.912 1.00 74.33 N ATOM 1799 CA HIS A 122 40.035 53.488 -38.200 1.00 33.51 C ATOM 1800 C HIS A 122 39.653 53.323 -36.741 1.00 61.51 C ATOM 1801 O HIS A 122 39.649 54.282 -35.966 1.00 44.21 O ATOM 1802 CB HIS A 122 41.421 54.124 -38.323 1.00 14.54 C ATOM 1803 CG HIS A 122 42.277 53.489 -39.378 1.00 14.41 C ATOM 1804 ND1 HIS A 122 42.184 53.803 -40.714 1.00 72.31 N ATOM 1805 CD2 HIS A 122 43.238 52.541 -39.283 1.00 55.51 C ATOM 1806 CE1 HIS A 122 43.053 53.082 -41.396 1.00 74.34 C ATOM 1807 NE2 HIS A 122 43.707 52.308 -40.552 1.00 72.12 N ATOM 0 H HIS A 122 39.364 55.174 -39.244 1.00 74.33 H new ATOM 0 HA HIS A 122 40.074 52.500 -38.659 1.00 33.51 H new ATOM 0 HB2 HIS A 122 41.307 55.184 -38.548 1.00 14.54 H new ATOM 0 HB3 HIS A 122 41.931 54.055 -37.362 1.00 14.54 H new ATOM 0 HD1 HIS A 122 41.543 54.487 -41.115 1.00 72.31 H new ATOM 0 HD2 HIS A 122 43.574 52.058 -38.377 1.00 55.51 H new ATOM 0 HE1 HIS A 122 43.203 53.119 -42.465 1.00 74.34 H new ATOM 1816 N HIS A 123 39.313 52.100 -36.384 1.00 41.22 N ATOM 1817 CA HIS A 123 38.917 51.774 -35.027 1.00 40.20 C ATOM 1818 C HIS A 123 39.732 50.594 -34.519 1.00 14.21 C ATOM 1819 O HIS A 123 39.583 49.468 -34.993 1.00 55.44 O ATOM 1820 CB HIS A 123 37.406 51.481 -34.952 1.00 64.15 C ATOM 1821 CG HIS A 123 36.920 50.406 -35.888 1.00 33.35 C ATOM 1822 ND1 HIS A 123 36.726 50.613 -37.240 1.00 51.31 N ATOM 1823 CD2 HIS A 123 36.589 49.111 -35.662 1.00 23.32 C ATOM 1824 CE1 HIS A 123 36.292 49.499 -37.797 1.00 62.03 C ATOM 1825 NE2 HIS A 123 36.204 48.575 -36.864 1.00 11.12 N ATOM 0 H HIS A 123 39.303 51.306 -37.024 1.00 41.22 H new ATOM 0 HA HIS A 123 39.116 52.633 -34.386 1.00 40.20 H new ATOM 0 HB2 HIS A 123 37.157 51.193 -33.931 1.00 64.15 H new ATOM 0 HB3 HIS A 123 36.862 52.401 -35.165 1.00 64.15 H new ATOM 0 HD1 HIS A 123 36.893 51.491 -37.731 1.00 51.31 H new ATOM 0 HD2 HIS A 123 36.622 48.597 -34.713 1.00 23.32 H new ATOM 0 HE1 HIS A 123 36.050 49.367 -38.841 1.00 62.03 H new ATOM 0 HE2 HIS A 123 35.898 47.613 -37.012 1.00 11.12 H new ATOM 1834 N HIS A 124 40.610 50.860 -33.571 1.00 75.21 N ATOM 1835 CA HIS A 124 41.467 49.822 -33.024 1.00 61.31 C ATOM 1836 C HIS A 124 40.678 48.955 -32.047 1.00 45.43 C ATOM 1837 O HIS A 124 40.812 49.075 -30.827 1.00 72.22 O ATOM 1838 CB HIS A 124 42.691 50.448 -32.350 1.00 55.11 C ATOM 1839 CG HIS A 124 43.698 49.452 -31.858 1.00 30.43 C ATOM 1840 ND1 HIS A 124 44.290 49.537 -30.619 1.00 72.32 N ATOM 1841 CD2 HIS A 124 44.232 48.358 -32.453 1.00 11.23 C ATOM 1842 CE1 HIS A 124 45.139 48.541 -30.469 1.00 60.11 C ATOM 1843 NE2 HIS A 124 45.126 47.809 -31.567 1.00 42.31 N ATOM 0 H HIS A 124 40.750 51.784 -33.163 1.00 75.21 H new ATOM 0 HA HIS A 124 41.821 49.184 -33.834 1.00 61.31 H new ATOM 0 HB2 HIS A 124 43.177 51.120 -33.057 1.00 55.11 H new ATOM 0 HB3 HIS A 124 42.358 51.056 -31.509 1.00 55.11 H new ATOM 0 HD2 HIS A 124 43.998 47.987 -33.440 1.00 11.23 H new ATOM 0 HE1 HIS A 124 45.744 48.355 -29.594 1.00 60.11 H new ATOM 0 HE2 HIS A 124 45.687 46.973 -31.731 1.00 42.31 H new ATOM 1852 N HIS A 125 39.832 48.104 -32.600 1.00 33.11 N ATOM 1853 CA HIS A 125 38.988 47.228 -31.807 1.00 42.42 C ATOM 1854 C HIS A 125 38.712 45.941 -32.575 1.00 12.25 C ATOM 1855 O HIS A 125 38.331 45.977 -33.746 1.00 65.23 O ATOM 1856 CB HIS A 125 37.671 47.933 -31.450 1.00 11.44 C ATOM 1857 CG HIS A 125 36.757 47.107 -30.599 1.00 60.43 C ATOM 1858 ND1 HIS A 125 35.614 46.513 -31.085 1.00 71.41 N ATOM 1859 CD2 HIS A 125 36.819 46.778 -29.285 1.00 3.32 C ATOM 1860 CE1 HIS A 125 35.016 45.852 -30.114 1.00 54.41 C ATOM 1861 NE2 HIS A 125 35.726 45.994 -29.015 1.00 54.24 N ATOM 0 H HIS A 125 39.711 48.001 -33.608 1.00 33.11 H new ATOM 0 HA HIS A 125 39.506 46.981 -30.880 1.00 42.42 H new ATOM 0 HB2 HIS A 125 37.897 48.863 -30.928 1.00 11.44 H new ATOM 0 HB3 HIS A 125 37.152 48.202 -32.370 1.00 11.44 H new ATOM 0 HD2 HIS A 125 37.584 47.077 -28.584 1.00 3.32 H new ATOM 0 HE1 HIS A 125 34.099 45.289 -30.205 1.00 54.41 H new ATOM 0 HE2 HIS A 125 35.500 45.586 -28.108 1.00 54.24 H new ATOM 1870 N HIS A 126 38.920 44.814 -31.918 1.00 22.41 N ATOM 1871 CA HIS A 126 38.713 43.513 -32.535 1.00 73.13 C ATOM 1872 C HIS A 126 38.008 42.586 -31.555 1.00 14.44 C ATOM 1873 O HIS A 126 38.175 42.718 -30.343 1.00 61.23 O ATOM 1874 CB HIS A 126 40.060 42.910 -32.952 1.00 23.41 C ATOM 1875 CG HIS A 126 39.954 41.716 -33.857 1.00 43.53 C ATOM 1876 ND1 HIS A 126 39.683 40.439 -33.406 1.00 63.22 N ATOM 1877 CD2 HIS A 126 40.096 41.612 -35.200 1.00 54.42 C ATOM 1878 CE1 HIS A 126 39.671 39.607 -34.430 1.00 42.22 C ATOM 1879 NE2 HIS A 126 39.916 40.292 -35.530 1.00 15.42 N ATOM 0 H HIS A 126 39.235 44.773 -30.949 1.00 22.41 H new ATOM 0 HA HIS A 126 38.092 43.633 -33.422 1.00 73.13 H new ATOM 0 HB2 HIS A 126 40.648 43.679 -33.453 1.00 23.41 H new ATOM 0 HB3 HIS A 126 40.609 42.623 -32.055 1.00 23.41 H new ATOM 0 HD1 HIS A 126 39.518 40.180 -32.433 1.00 63.22 H new ATOM 0 HD2 HIS A 126 40.311 42.419 -35.885 1.00 54.42 H new ATOM 0 HE1 HIS A 126 39.491 38.543 -34.376 1.00 42.22 H new ATOM 1888 N HIS A 127 37.213 41.665 -32.080 1.00 12.35 N ATOM 1889 CA HIS A 127 36.547 40.673 -31.252 1.00 31.34 C ATOM 1890 C HIS A 127 37.560 39.633 -30.787 1.00 12.31 C ATOM 1891 O HIS A 127 38.090 38.902 -31.645 1.00 54.42 O ATOM 1892 CB HIS A 127 35.409 40.009 -32.032 1.00 12.42 C ATOM 1893 CG HIS A 127 34.603 39.032 -31.229 1.00 22.42 C ATOM 1894 ND1 HIS A 127 33.467 39.387 -30.535 1.00 5.05 N ATOM 1895 CD2 HIS A 127 34.767 37.705 -31.022 1.00 4.12 C ATOM 1896 CE1 HIS A 127 32.966 38.320 -29.939 1.00 42.13 C ATOM 1897 NE2 HIS A 127 33.737 37.289 -30.219 1.00 54.43 N ATOM 1898 OXT HIS A 127 37.829 39.559 -29.571 1.00 0.00 O1- ATOM 0 H HIS A 127 37.014 41.585 -33.077 1.00 12.35 H new ATOM 0 HA HIS A 127 36.118 41.163 -30.378 1.00 31.34 H new ATOM 0 HB2 HIS A 127 34.745 40.784 -32.414 1.00 12.42 H new ATOM 0 HB3 HIS A 127 35.828 39.494 -32.896 1.00 12.42 H new ATOM 0 HD2 HIS A 127 35.561 37.088 -31.416 1.00 4.12 H new ATOM 0 HE1 HIS A 127 32.077 38.297 -29.327 1.00 42.13 H new ATOM 0 HE2 HIS A 127 33.591 36.334 -29.891 1.00 54.43 H new TER 1907 HIS A 127