USER MOD reduce.3.24.130724 H: found=0, std=0, add=1082, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 956 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 644 GLN : amide:sc= -0.24 K(o=-0.2,f=-0.91) USER MOD Set 1.2: A 714 TYR OH : rot 134:sc= 0.0451 USER MOD Set 2.1: A 692 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 711 ASN : amide:sc= -0.0309 K(o=-0.35,f=-2.6!) USER MOD Set 2.3: A 715 ASN : amide:sc= -0.316 K(o=-0.35,f=-2.9) USER MOD Set 3.1: A 681 ASN : amide:sc= 0.0344 X(o=0.069,f=0.14) USER MOD Set 3.2: A 685 THR OG1 : rot 180:sc= 0.0348 USER MOD Set 4.1: A 663 SER OG : rot -138:sc= 0.982 USER MOD Set 4.2: A 672 THR OG1 : rot 114:sc= 1.13 USER MOD Set 5.1: A 621 TYR OH : rot 180:sc= 0 USER MOD Set 5.2: A 646 SER OG : rot 102:sc= 1.21 USER MOD Single : A 585 SER OG : rot 180:sc= 0 USER MOD Single : A 587 THR OG1 : rot -140:sc= 1.31 USER MOD Single : A 591 ASN : amide:sc= -0.0635 K(o=-0.064,f=-1.3!) USER MOD Single : A 593 THR OG1 : rot 180:sc= 0 USER MOD Single : A 597 SER OG : rot 140:sc= 0.52 USER MOD Single : A 598 GLN : amide:sc= 1.15 K(o=1.1,f=-0.1) USER MOD Single : A 602 SER OG : rot 180:sc= 0 USER MOD Single : A 606 THR OG1 : rot -160:sc= -0.0138 USER MOD Single : A 609 THR OG1 : rot -49:sc= 1.25 USER MOD Single : A 610 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0826) USER MOD Single : A 611 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 614 TYR OH : rot 21:sc= -0.255 USER MOD Single : A 615 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 618 THR OG1 : rot -45:sc= 0.185 USER MOD Single : A 620 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 624 HIS : no HE2:sc= -1.78! C(o=-1.8!,f=-5.7!) USER MOD Single : A 626 ASN : amide:sc= 0.265 K(o=0.27,f=-6.1!) USER MOD Single : A 632 SER OG : rot 180:sc= 0 USER MOD Single : A 640 SER OG : rot -56:sc= 1.2 USER MOD Single : A 648 SER OG : rot -160:sc= -1.48! USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 652 SER OG : rot -161:sc= 1.25 USER MOD Single : A 654 ASN : amide:sc= 0.4 K(o=0.4,f=-8.5!) USER MOD Single : A 658 SER OG : rot 39:sc= 0.0213 USER MOD Single : A 659 ASN : amide:sc= -2.74! C(o=-2.7!,f=-6.8!) USER MOD Single : A 661 LYS NZ :NH3+ -113:sc= 1.22 (180deg=0.235) USER MOD Single : A 664 TYR OH : rot 165:sc= 0.00388 USER MOD Single : A 665 TYR OH : rot 180:sc= 0.687 USER MOD Single : A 668 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 670 GLN : amide:sc= -2.7 K(o=-2.7,f=-5.3!) USER MOD Single : A 673 TYR OH : rot -136:sc= 1.27 USER MOD Single : A 677 THR OG1 : rot 180:sc= -0.288 USER MOD Single : A 679 TYR OH : rot 158:sc= 0.295 USER MOD Single : A 680 ASN : amide:sc= -0.166 K(o=-0.17,f=-3.6!) USER MOD Single : A 683 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 689 THR OG1 : rot 79:sc= 1.26 USER MOD Single : A 706 TYR OH : rot 180:sc= 0.699 USER MOD Single : A 707 GLN :FLIP amide:sc= -1.44 F(o=-5.3!,f=-1.4) USER MOD Single : A 712 SER OG : rot 4:sc= 1.16 USER MOD Single : A 713 THR OG1 : rot 160:sc= -0.246 USER MOD Single : A 719 TYR OH : rot 30:sc= -1.52! USER MOD Single : A 720 THR OG1 : rot 87:sc= -0.67 USER MOD Single : A 721 SER OG : rot -17:sc= 1.24 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 578 -23.377 5.811 -2.555 1.00 70.13 N ATOM 2 CA GLU A 578 -22.050 6.425 -2.602 1.00 54.12 C ATOM 3 C GLU A 578 -21.036 5.289 -2.749 1.00 53.11 C ATOM 4 O GLU A 578 -20.311 5.199 -3.746 1.00 1.35 O ATOM 5 CB GLU A 578 -21.821 7.222 -1.292 1.00 23.21 C ATOM 6 CG GLU A 578 -20.665 8.238 -1.298 1.00 4.53 C ATOM 7 CD GLU A 578 -19.311 7.650 -1.587 1.00 41.23 C ATOM 8 OE1 GLU A 578 -18.763 6.941 -0.723 1.00 25.14 O ATOM 9 OE2 GLU A 578 -18.770 7.894 -2.681 1.00 4.12 O ATOM 0 HA GLU A 578 -21.947 7.118 -3.437 1.00 54.12 H new ATOM 0 HB2 GLU A 578 -22.741 7.754 -1.051 1.00 23.21 H new ATOM 0 HB3 GLU A 578 -21.645 6.510 -0.486 1.00 23.21 H new ATOM 0 HG2 GLU A 578 -20.878 9.006 -2.042 1.00 4.53 H new ATOM 0 HG3 GLU A 578 -20.631 8.734 -0.328 1.00 4.53 H new ATOM 18 N ALA A 579 -21.026 4.414 -1.765 1.00 5.21 N ATOM 19 CA ALA A 579 -20.185 3.245 -1.723 1.00 34.32 C ATOM 20 C ALA A 579 -20.746 2.304 -0.687 1.00 63.34 C ATOM 21 O ALA A 579 -20.403 2.384 0.497 1.00 4.03 O ATOM 22 CB ALA A 579 -18.730 3.591 -1.404 1.00 33.02 C ATOM 0 H ALA A 579 -21.626 4.504 -0.945 1.00 5.21 H new ATOM 0 HA ALA A 579 -20.180 2.775 -2.707 1.00 34.32 H new ATOM 0 HB1 ALA A 579 -18.135 2.678 -1.383 1.00 33.02 H new ATOM 0 HB2 ALA A 579 -18.339 4.261 -2.169 1.00 33.02 H new ATOM 0 HB3 ALA A 579 -18.677 4.081 -0.432 1.00 33.02 H new ATOM 28 N GLU A 580 -21.680 1.489 -1.111 1.00 21.15 N ATOM 29 CA GLU A 580 -22.323 0.546 -0.236 1.00 45.12 C ATOM 30 C GLU A 580 -22.186 -0.841 -0.837 1.00 70.53 C ATOM 31 O GLU A 580 -22.074 -0.981 -2.068 1.00 55.12 O ATOM 32 CB GLU A 580 -23.831 0.854 -0.052 1.00 55.32 C ATOM 33 CG GLU A 580 -24.218 2.243 0.504 1.00 52.20 C ATOM 34 CD GLU A 580 -23.962 3.399 -0.453 1.00 61.04 C ATOM 35 OE1 GLU A 580 -24.603 3.458 -1.522 1.00 43.42 O ATOM 36 OE2 GLU A 580 -23.154 4.300 -0.134 1.00 72.54 O ATOM 0 H GLU A 580 -22.015 1.462 -2.074 1.00 21.15 H new ATOM 0 HA GLU A 580 -21.843 0.612 0.740 1.00 45.12 H new ATOM 0 HB2 GLU A 580 -24.319 0.732 -1.019 1.00 55.32 H new ATOM 0 HB3 GLU A 580 -24.249 0.098 0.613 1.00 55.32 H new ATOM 0 HG2 GLU A 580 -25.276 2.233 0.767 1.00 52.20 H new ATOM 0 HG3 GLU A 580 -23.662 2.420 1.425 1.00 52.20 H new ATOM 43 N ALA A 581 -22.163 -1.845 -0.005 1.00 62.14 N ATOM 44 CA ALA A 581 -22.090 -3.210 -0.469 1.00 13.32 C ATOM 45 C ALA A 581 -22.921 -4.106 0.425 1.00 55.44 C ATOM 46 O ALA A 581 -22.536 -4.377 1.568 1.00 51.34 O ATOM 47 CB ALA A 581 -20.640 -3.691 -0.514 1.00 44.24 C ATOM 0 H ALA A 581 -22.194 -1.745 1.010 1.00 62.14 H new ATOM 0 HA ALA A 581 -22.491 -3.255 -1.482 1.00 13.32 H new ATOM 0 HB1 ALA A 581 -20.609 -4.722 -0.866 1.00 44.24 H new ATOM 0 HB2 ALA A 581 -20.068 -3.058 -1.193 1.00 44.24 H new ATOM 0 HB3 ALA A 581 -20.207 -3.636 0.485 1.00 44.24 H new ATOM 53 N GLU A 582 -24.074 -4.541 -0.074 1.00 42.15 N ATOM 54 CA GLU A 582 -24.944 -5.408 0.698 1.00 22.14 C ATOM 55 C GLU A 582 -24.317 -6.790 0.818 1.00 25.03 C ATOM 56 O GLU A 582 -24.303 -7.390 1.903 1.00 63.21 O ATOM 57 CB GLU A 582 -26.377 -5.489 0.100 1.00 10.13 C ATOM 58 CG GLU A 582 -26.462 -6.017 -1.332 1.00 12.02 C ATOM 59 CD GLU A 582 -27.885 -6.215 -1.796 1.00 23.35 C ATOM 60 OE1 GLU A 582 -28.492 -7.243 -1.444 1.00 61.32 O ATOM 61 OE2 GLU A 582 -28.421 -5.364 -2.534 1.00 12.02 O ATOM 0 H GLU A 582 -24.422 -4.307 -1.004 1.00 42.15 H new ATOM 0 HA GLU A 582 -25.051 -4.978 1.694 1.00 22.14 H new ATOM 0 HB2 GLU A 582 -26.984 -6.128 0.741 1.00 10.13 H new ATOM 0 HB3 GLU A 582 -26.821 -4.494 0.129 1.00 10.13 H new ATOM 0 HG2 GLU A 582 -25.959 -5.320 -2.002 1.00 12.02 H new ATOM 0 HG3 GLU A 582 -25.927 -6.965 -1.398 1.00 12.02 H new ATOM 68 N PHE A 583 -23.787 -7.266 -0.295 1.00 72.04 N ATOM 69 CA PHE A 583 -23.102 -8.533 -0.402 1.00 62.30 C ATOM 70 C PHE A 583 -22.726 -8.685 -1.861 1.00 42.40 C ATOM 71 O PHE A 583 -23.520 -8.351 -2.740 1.00 31.31 O ATOM 72 CB PHE A 583 -24.003 -9.701 0.032 1.00 44.42 C ATOM 73 CG PHE A 583 -23.262 -10.986 0.259 1.00 52.13 C ATOM 74 CD1 PHE A 583 -23.041 -11.883 -0.771 1.00 33.23 C ATOM 75 CD2 PHE A 583 -22.781 -11.291 1.522 1.00 71.55 C ATOM 76 CE1 PHE A 583 -22.353 -13.056 -0.544 1.00 62.41 C ATOM 77 CE2 PHE A 583 -22.097 -12.461 1.753 1.00 12.15 C ATOM 78 CZ PHE A 583 -21.881 -13.345 0.720 1.00 53.33 C ATOM 0 H PHE A 583 -23.826 -6.759 -1.179 1.00 72.04 H new ATOM 0 HA PHE A 583 -22.229 -8.552 0.251 1.00 62.30 H new ATOM 0 HB2 PHE A 583 -24.523 -9.425 0.950 1.00 44.42 H new ATOM 0 HB3 PHE A 583 -24.766 -9.862 -0.730 1.00 44.42 H new ATOM 0 HD1 PHE A 583 -23.411 -11.662 -1.761 1.00 33.23 H new ATOM 0 HD2 PHE A 583 -22.946 -10.600 2.336 1.00 71.55 H new ATOM 0 HE1 PHE A 583 -22.184 -13.748 -1.355 1.00 62.41 H new ATOM 0 HE2 PHE A 583 -21.730 -12.686 2.743 1.00 12.15 H new ATOM 0 HZ PHE A 583 -21.343 -14.264 0.899 1.00 53.33 H new ATOM 88 N LEU A 584 -21.548 -9.167 -2.117 1.00 22.42 N ATOM 89 CA LEU A 584 -21.025 -9.268 -3.456 1.00 70.41 C ATOM 90 C LEU A 584 -19.834 -10.205 -3.349 1.00 52.32 C ATOM 91 O LEU A 584 -19.644 -10.811 -2.300 1.00 34.11 O ATOM 92 CB LEU A 584 -20.555 -7.837 -3.882 1.00 51.51 C ATOM 93 CG LEU A 584 -20.119 -7.600 -5.336 1.00 10.12 C ATOM 94 CD1 LEU A 584 -21.291 -7.764 -6.290 1.00 11.24 C ATOM 95 CD2 LEU A 584 -19.509 -6.218 -5.479 1.00 23.04 C ATOM 0 H LEU A 584 -20.911 -9.507 -1.397 1.00 22.42 H new ATOM 0 HA LEU A 584 -21.747 -9.636 -4.185 1.00 70.41 H new ATOM 0 HB2 LEU A 584 -21.369 -7.145 -3.665 1.00 51.51 H new ATOM 0 HB3 LEU A 584 -19.720 -7.559 -3.238 1.00 51.51 H new ATOM 0 HG LEU A 584 -19.368 -8.346 -5.594 1.00 10.12 H new ATOM 0 HD11 LEU A 584 -20.955 -7.591 -7.312 1.00 11.24 H new ATOM 0 HD12 LEU A 584 -21.690 -8.775 -6.206 1.00 11.24 H new ATOM 0 HD13 LEU A 584 -22.069 -7.044 -6.037 1.00 11.24 H new ATOM 0 HD21 LEU A 584 -19.203 -6.060 -6.513 1.00 23.04 H new ATOM 0 HD22 LEU A 584 -20.245 -5.465 -5.199 1.00 23.04 H new ATOM 0 HD23 LEU A 584 -18.639 -6.135 -4.827 1.00 23.04 H new ATOM 103 N SER A 585 -19.026 -10.319 -4.392 1.00 54.23 N ATOM 104 CA SER A 585 -17.771 -11.063 -4.307 1.00 24.14 C ATOM 105 C SER A 585 -16.729 -10.241 -3.516 1.00 4.44 C ATOM 106 O SER A 585 -15.555 -10.594 -3.453 1.00 51.02 O ATOM 107 CB SER A 585 -17.248 -11.376 -5.701 1.00 12.54 C ATOM 108 OG SER A 585 -18.205 -12.116 -6.446 1.00 22.40 O ATOM 0 H SER A 585 -19.213 -9.908 -5.307 1.00 54.23 H new ATOM 0 HA SER A 585 -17.951 -12.004 -3.786 1.00 24.14 H new ATOM 0 HB2 SER A 585 -17.013 -10.448 -6.223 1.00 12.54 H new ATOM 0 HB3 SER A 585 -16.320 -11.944 -5.627 1.00 12.54 H new ATOM 0 HG SER A 585 -17.849 -12.305 -7.339 1.00 22.40 H new ATOM 114 N ARG A 586 -17.204 -9.149 -2.932 1.00 25.14 N ATOM 115 CA ARG A 586 -16.447 -8.280 -2.086 1.00 73.40 C ATOM 116 C ARG A 586 -17.010 -8.364 -0.693 1.00 72.24 C ATOM 117 O ARG A 586 -18.217 -8.172 -0.500 1.00 73.14 O ATOM 118 CB ARG A 586 -16.581 -6.785 -2.499 1.00 15.34 C ATOM 119 CG ARG A 586 -15.856 -5.849 -1.503 1.00 11.43 C ATOM 120 CD ARG A 586 -16.278 -4.372 -1.583 1.00 25.15 C ATOM 121 NE ARG A 586 -15.939 -3.703 -2.835 1.00 24.54 N ATOM 122 CZ ARG A 586 -15.955 -2.360 -2.997 1.00 51.44 C ATOM 123 NH1 ARG A 586 -16.211 -1.546 -1.965 1.00 61.41 N ATOM 124 NH2 ARG A 586 -15.681 -1.837 -4.179 1.00 34.14 N ATOM 0 H ARG A 586 -18.170 -8.845 -3.050 1.00 25.14 H new ATOM 0 HA ARG A 586 -15.405 -8.592 -2.158 1.00 73.40 H new ATOM 0 HB2 ARG A 586 -16.167 -6.645 -3.497 1.00 15.34 H new ATOM 0 HB3 ARG A 586 -17.636 -6.515 -2.550 1.00 15.34 H new ATOM 0 HG2 ARG A 586 -16.036 -6.210 -0.490 1.00 11.43 H new ATOM 0 HG3 ARG A 586 -14.782 -5.916 -1.679 1.00 11.43 H new ATOM 0 HD2 ARG A 586 -17.356 -4.309 -1.434 1.00 25.15 H new ATOM 0 HD3 ARG A 586 -15.811 -3.831 -0.761 1.00 25.15 H new ATOM 0 HE ARG A 586 -15.675 -4.281 -3.633 1.00 24.54 H new ATOM 0 HH11 ARG A 586 -16.397 -1.937 -1.041 1.00 61.41 H new ATOM 0 HH12 ARG A 586 -16.220 -0.535 -2.103 1.00 61.41 H new ATOM 0 HH21 ARG A 586 -15.458 -2.446 -4.967 1.00 34.14 H new ATOM 0 HH22 ARG A 586 -15.692 -0.825 -4.304 1.00 34.14 H new ATOM 136 N THR A 587 -16.188 -8.645 0.251 1.00 34.44 N ATOM 137 CA THR A 587 -16.581 -8.492 1.610 1.00 51.40 C ATOM 138 C THR A 587 -15.902 -7.196 2.055 1.00 63.23 C ATOM 139 O THR A 587 -14.778 -6.890 1.586 1.00 23.42 O ATOM 140 CB THR A 587 -16.141 -9.682 2.517 1.00 23.02 C ATOM 141 OG1 THR A 587 -16.850 -9.624 3.776 1.00 54.12 O ATOM 142 CG2 THR A 587 -14.672 -9.585 2.829 1.00 14.34 C ATOM 0 H THR A 587 -15.236 -8.983 0.111 1.00 34.44 H new ATOM 0 HA THR A 587 -17.667 -8.467 1.699 1.00 51.40 H new ATOM 0 HB THR A 587 -16.359 -10.609 1.987 1.00 23.02 H new ATOM 0 HG1 THR A 587 -16.240 -9.859 4.506 1.00 54.12 H new ATOM 0 HG21 THR A 587 -14.379 -10.422 3.463 1.00 14.34 H new ATOM 0 HG22 THR A 587 -14.100 -9.614 1.901 1.00 14.34 H new ATOM 0 HG23 THR A 587 -14.472 -8.648 3.349 1.00 14.34 H new ATOM 148 N GLU A 588 -16.553 -6.404 2.845 1.00 53.12 N ATOM 149 CA GLU A 588 -15.954 -5.164 3.215 1.00 12.14 C ATOM 150 C GLU A 588 -15.878 -5.015 4.724 1.00 0.21 C ATOM 151 O GLU A 588 -16.871 -5.236 5.442 1.00 31.32 O ATOM 152 CB GLU A 588 -16.701 -4.008 2.563 1.00 2.53 C ATOM 153 CG GLU A 588 -16.034 -2.666 2.726 1.00 55.53 C ATOM 154 CD GLU A 588 -16.777 -1.589 2.004 1.00 32.22 C ATOM 155 OE1 GLU A 588 -16.681 -1.520 0.759 1.00 32.44 O ATOM 156 OE2 GLU A 588 -17.490 -0.804 2.663 1.00 64.12 O ATOM 0 H GLU A 588 -17.476 -6.587 3.238 1.00 53.12 H new ATOM 0 HA GLU A 588 -14.927 -5.149 2.849 1.00 12.14 H new ATOM 0 HB2 GLU A 588 -16.813 -4.218 1.499 1.00 2.53 H new ATOM 0 HB3 GLU A 588 -17.704 -3.955 2.985 1.00 2.53 H new ATOM 0 HG2 GLU A 588 -15.971 -2.417 3.785 1.00 55.53 H new ATOM 0 HG3 GLU A 588 -15.013 -2.719 2.349 1.00 55.53 H new ATOM 163 N GLY A 589 -14.696 -4.690 5.196 1.00 3.33 N ATOM 164 CA GLY A 589 -14.466 -4.451 6.599 1.00 52.31 C ATOM 165 C GLY A 589 -14.394 -2.972 6.856 1.00 1.13 C ATOM 166 O GLY A 589 -14.219 -2.204 5.915 1.00 62.44 O ATOM 0 H GLY A 589 -13.865 -4.584 4.614 1.00 3.33 H new ATOM 0 HA2 GLY A 589 -15.268 -4.894 7.189 1.00 52.31 H new ATOM 0 HA3 GLY A 589 -13.538 -4.930 6.912 1.00 52.31 H new ATOM 170 N ASP A 590 -14.502 -2.564 8.099 1.00 2.20 N ATOM 171 CA ASP A 590 -14.521 -1.130 8.407 1.00 3.31 C ATOM 172 C ASP A 590 -13.194 -0.670 8.932 1.00 23.31 C ATOM 173 O ASP A 590 -12.728 0.410 8.588 1.00 52.23 O ATOM 174 CB ASP A 590 -15.650 -0.750 9.372 1.00 11.23 C ATOM 175 CG ASP A 590 -15.636 0.734 9.712 1.00 25.53 C ATOM 176 OD1 ASP A 590 -15.904 1.563 8.825 1.00 20.23 O ATOM 177 OD2 ASP A 590 -15.369 1.086 10.876 1.00 21.33 O ATOM 0 H ASP A 590 -14.577 -3.181 8.908 1.00 2.20 H new ATOM 0 HA ASP A 590 -14.718 -0.614 7.468 1.00 3.31 H new ATOM 0 HB2 ASP A 590 -16.610 -1.011 8.927 1.00 11.23 H new ATOM 0 HB3 ASP A 590 -15.555 -1.333 10.288 1.00 11.23 H new ATOM 182 N ASN A 591 -12.598 -1.479 9.768 1.00 21.45 N ATOM 183 CA ASN A 591 -11.270 -1.205 10.283 1.00 55.21 C ATOM 184 C ASN A 591 -10.257 -1.965 9.474 1.00 0.35 C ATOM 185 O ASN A 591 -10.612 -2.590 8.484 1.00 5.31 O ATOM 186 CB ASN A 591 -11.146 -1.539 11.782 1.00 53.43 C ATOM 187 CG ASN A 591 -11.835 -0.519 12.676 1.00 23.15 C ATOM 188 OD1 ASN A 591 -11.925 0.662 12.335 1.00 42.14 O ATOM 189 ND2 ASN A 591 -12.290 -0.944 13.820 1.00 21.23 N ATOM 0 H ASN A 591 -13.012 -2.345 10.114 1.00 21.45 H new ATOM 0 HA ASN A 591 -11.081 -0.136 10.190 1.00 55.21 H new ATOM 0 HB2 ASN A 591 -11.575 -2.524 11.966 1.00 53.43 H new ATOM 0 HB3 ASN A 591 -10.091 -1.596 12.050 1.00 53.43 H new ATOM 0 HD21 ASN A 591 -12.737 -0.292 14.465 1.00 21.23 H new ATOM 0 HD22 ASN A 591 -12.199 -1.928 14.071 1.00 21.23 H new ATOM 195 N CYS A 592 -9.008 -1.939 9.892 1.00 61.11 N ATOM 196 CA CYS A 592 -7.922 -2.558 9.168 1.00 64.13 C ATOM 197 C CYS A 592 -7.997 -4.141 9.221 1.00 72.33 C ATOM 198 O CYS A 592 -6.978 -4.825 9.062 1.00 42.40 O ATOM 199 CB CYS A 592 -6.611 -2.083 9.795 1.00 52.04 C ATOM 200 SG CYS A 592 -6.685 -0.424 10.631 1.00 61.24 S ATOM 0 H CYS A 592 -8.717 -1.481 10.756 1.00 61.11 H new ATOM 0 HA CYS A 592 -7.987 -2.270 8.119 1.00 64.13 H new ATOM 0 HB2 CYS A 592 -6.287 -2.825 10.525 1.00 52.04 H new ATOM 0 HB3 CYS A 592 -5.848 -2.046 9.017 1.00 52.04 H new ATOM 205 N THR A 593 -9.204 -4.707 9.377 1.00 42.14 N ATOM 206 CA THR A 593 -9.380 -6.148 9.412 1.00 10.42 C ATOM 207 C THR A 593 -10.470 -6.535 8.441 1.00 13.04 C ATOM 208 O THR A 593 -11.448 -5.799 8.284 1.00 70.23 O ATOM 209 CB THR A 593 -9.805 -6.617 10.823 1.00 0.31 C ATOM 210 OG1 THR A 593 -10.947 -5.861 11.265 1.00 51.25 O ATOM 211 CG2 THR A 593 -8.680 -6.475 11.817 1.00 23.24 C ATOM 0 H THR A 593 -10.069 -4.177 9.480 1.00 42.14 H new ATOM 0 HA THR A 593 -8.432 -6.617 9.146 1.00 10.42 H new ATOM 0 HB THR A 593 -10.065 -7.674 10.761 1.00 0.31 H new ATOM 0 HG1 THR A 593 -11.213 -6.163 12.158 1.00 51.25 H new ATOM 0 HG21 THR A 593 -9.015 -6.814 12.797 1.00 23.24 H new ATOM 0 HG22 THR A 593 -7.832 -7.079 11.495 1.00 23.24 H new ATOM 0 HG23 THR A 593 -8.379 -5.429 11.878 1.00 23.24 H new ATOM 217 N VAL A 594 -10.324 -7.665 7.799 1.00 73.51 N ATOM 218 CA VAL A 594 -11.324 -8.102 6.879 1.00 32.54 C ATOM 219 C VAL A 594 -11.723 -9.564 7.129 1.00 12.41 C ATOM 220 O VAL A 594 -10.859 -10.422 7.374 1.00 42.40 O ATOM 221 CB VAL A 594 -10.891 -7.874 5.393 1.00 24.13 C ATOM 222 CG1 VAL A 594 -9.714 -8.749 4.979 1.00 44.05 C ATOM 223 CG2 VAL A 594 -12.059 -8.017 4.442 1.00 50.51 C ATOM 0 H VAL A 594 -9.525 -8.291 7.900 1.00 73.51 H new ATOM 0 HA VAL A 594 -12.207 -7.487 7.054 1.00 32.54 H new ATOM 0 HB VAL A 594 -10.541 -6.844 5.330 1.00 24.13 H new ATOM 0 HG11 VAL A 594 -9.459 -8.547 3.939 1.00 44.05 H new ATOM 0 HG12 VAL A 594 -8.855 -8.528 5.613 1.00 44.05 H new ATOM 0 HG13 VAL A 594 -9.985 -9.799 5.089 1.00 44.05 H new ATOM 0 HG21 VAL A 594 -11.718 -7.852 3.420 1.00 50.51 H new ATOM 0 HG22 VAL A 594 -12.477 -9.020 4.527 1.00 50.51 H new ATOM 0 HG23 VAL A 594 -12.824 -7.282 4.693 1.00 50.51 H new ATOM 229 N PHE A 595 -13.000 -9.838 7.102 1.00 64.45 N ATOM 230 CA PHE A 595 -13.474 -11.200 7.131 1.00 52.42 C ATOM 231 C PHE A 595 -14.364 -11.449 5.947 1.00 33.45 C ATOM 232 O PHE A 595 -15.335 -10.719 5.714 1.00 61.30 O ATOM 233 CB PHE A 595 -14.168 -11.608 8.444 1.00 72.43 C ATOM 234 CG PHE A 595 -14.745 -13.011 8.358 1.00 33.42 C ATOM 235 CD1 PHE A 595 -13.941 -14.078 7.978 1.00 41.14 C ATOM 236 CD2 PHE A 595 -16.078 -13.252 8.620 1.00 64.12 C ATOM 237 CE1 PHE A 595 -14.448 -15.350 7.859 1.00 42.41 C ATOM 238 CE2 PHE A 595 -16.595 -14.531 8.510 1.00 71.52 C ATOM 239 CZ PHE A 595 -15.778 -15.581 8.127 1.00 0.30 C ATOM 0 H PHE A 595 -13.736 -9.133 7.060 1.00 64.45 H new ATOM 0 HA PHE A 595 -12.590 -11.835 7.076 1.00 52.42 H new ATOM 0 HB2 PHE A 595 -13.453 -11.558 9.265 1.00 72.43 H new ATOM 0 HB3 PHE A 595 -14.965 -10.899 8.671 1.00 72.43 H new ATOM 0 HD1 PHE A 595 -12.895 -13.904 7.772 1.00 41.14 H new ATOM 0 HD2 PHE A 595 -16.723 -12.437 8.913 1.00 64.12 H new ATOM 0 HE1 PHE A 595 -13.806 -16.164 7.557 1.00 42.41 H new ATOM 0 HE2 PHE A 595 -17.638 -14.710 8.723 1.00 71.52 H new ATOM 0 HZ PHE A 595 -16.183 -16.578 8.039 1.00 0.30 H new ATOM 249 N ASP A 596 -14.029 -12.463 5.203 1.00 12.43 N ATOM 250 CA ASP A 596 -14.723 -12.792 3.993 1.00 71.20 C ATOM 251 C ASP A 596 -15.564 -14.028 4.186 1.00 50.43 C ATOM 252 O ASP A 596 -15.054 -15.099 4.499 1.00 71.44 O ATOM 253 CB ASP A 596 -13.709 -12.979 2.900 1.00 11.43 C ATOM 254 CG ASP A 596 -14.317 -13.217 1.577 1.00 24.44 C ATOM 255 OD1 ASP A 596 -14.785 -12.272 0.923 1.00 30.53 O ATOM 256 OD2 ASP A 596 -14.310 -14.328 1.168 1.00 12.53 O ATOM 0 H ASP A 596 -13.257 -13.092 5.423 1.00 12.43 H new ATOM 0 HA ASP A 596 -15.402 -11.985 3.717 1.00 71.20 H new ATOM 0 HB2 ASP A 596 -13.074 -12.094 2.847 1.00 11.43 H new ATOM 0 HB3 ASP A 596 -13.063 -13.820 3.152 1.00 11.43 H new ATOM 261 N SER A 597 -16.849 -13.864 4.002 1.00 41.10 N ATOM 262 CA SER A 597 -17.824 -14.900 4.216 1.00 73.54 C ATOM 263 C SER A 597 -17.724 -16.021 3.183 1.00 23.03 C ATOM 264 O SER A 597 -17.921 -17.197 3.506 1.00 50.05 O ATOM 265 CB SER A 597 -19.199 -14.255 4.188 1.00 70.20 C ATOM 266 OG SER A 597 -19.324 -13.427 3.043 1.00 11.44 O ATOM 0 H SER A 597 -17.256 -12.982 3.691 1.00 41.10 H new ATOM 0 HA SER A 597 -17.639 -15.370 5.182 1.00 73.54 H new ATOM 0 HB2 SER A 597 -19.971 -15.025 4.176 1.00 70.20 H new ATOM 0 HB3 SER A 597 -19.351 -13.665 5.092 1.00 70.20 H new ATOM 0 HG SER A 597 -20.219 -13.533 2.659 1.00 11.44 H new ATOM 272 N GLN A 598 -17.393 -15.662 1.959 1.00 61.33 N ATOM 273 CA GLN A 598 -17.318 -16.620 0.889 1.00 41.23 C ATOM 274 C GLN A 598 -16.048 -17.472 1.007 1.00 43.20 C ATOM 275 O GLN A 598 -16.090 -18.681 0.782 1.00 13.14 O ATOM 276 CB GLN A 598 -17.395 -15.917 -0.470 1.00 42.35 C ATOM 277 CG GLN A 598 -16.326 -14.900 -0.636 1.00 73.41 C ATOM 278 CD GLN A 598 -16.323 -14.106 -1.888 1.00 14.01 C ATOM 279 OE1 GLN A 598 -16.768 -14.554 -2.954 1.00 24.12 O ATOM 280 NE2 GLN A 598 -15.791 -12.916 -1.775 1.00 11.15 N ATOM 0 H GLN A 598 -17.171 -14.705 1.685 1.00 61.33 H new ATOM 0 HA GLN A 598 -18.173 -17.291 0.967 1.00 41.23 H new ATOM 0 HB2 GLN A 598 -17.316 -16.658 -1.266 1.00 42.35 H new ATOM 0 HB3 GLN A 598 -18.369 -15.439 -0.575 1.00 42.35 H new ATOM 0 HG2 GLN A 598 -16.390 -14.206 0.202 1.00 73.41 H new ATOM 0 HG3 GLN A 598 -15.364 -15.407 -0.557 1.00 73.41 H new ATOM 0 HE21 GLN A 598 -15.440 -12.598 -0.872 1.00 11.15 H new ATOM 0 HE22 GLN A 598 -15.727 -12.306 -2.590 1.00 11.15 H new ATOM 288 N ALA A 599 -14.928 -16.854 1.384 1.00 51.21 N ATOM 289 CA ALA A 599 -13.687 -17.586 1.521 1.00 42.05 C ATOM 290 C ALA A 599 -13.603 -18.252 2.872 1.00 50.02 C ATOM 291 O ALA A 599 -12.907 -19.243 3.037 1.00 14.42 O ATOM 292 CB ALA A 599 -12.508 -16.627 1.391 1.00 44.33 C ATOM 0 H ALA A 599 -14.863 -15.858 1.596 1.00 51.21 H new ATOM 0 HA ALA A 599 -13.655 -18.344 0.738 1.00 42.05 H new ATOM 0 HB1 ALA A 599 -11.575 -17.181 1.495 1.00 44.33 H new ATOM 0 HB2 ALA A 599 -12.537 -16.145 0.414 1.00 44.33 H new ATOM 0 HB3 ALA A 599 -12.568 -15.869 2.172 1.00 44.33 H new ATOM 298 N GLY A 600 -14.345 -17.730 3.825 1.00 40.13 N ATOM 299 CA GLY A 600 -14.367 -18.319 5.150 1.00 20.32 C ATOM 300 C GLY A 600 -13.044 -18.136 5.885 1.00 20.05 C ATOM 301 O GLY A 600 -12.714 -18.899 6.798 1.00 34.53 O ATOM 0 H GLY A 600 -14.936 -16.907 3.711 1.00 40.13 H new ATOM 0 HA2 GLY A 600 -15.170 -17.867 5.733 1.00 20.32 H new ATOM 0 HA3 GLY A 600 -14.591 -19.383 5.069 1.00 20.32 H new ATOM 305 N PHE A 601 -12.286 -17.136 5.483 1.00 33.13 N ATOM 306 CA PHE A 601 -11.015 -16.836 6.107 1.00 4.11 C ATOM 307 C PHE A 601 -11.010 -15.406 6.584 1.00 74.24 C ATOM 308 O PHE A 601 -11.566 -14.515 5.917 1.00 71.23 O ATOM 309 CB PHE A 601 -9.828 -17.044 5.149 1.00 13.44 C ATOM 310 CG PHE A 601 -9.625 -18.445 4.647 1.00 54.42 C ATOM 311 CD1 PHE A 601 -9.190 -19.446 5.497 1.00 75.34 C ATOM 312 CD2 PHE A 601 -9.843 -18.753 3.315 1.00 1.32 C ATOM 313 CE1 PHE A 601 -8.984 -20.729 5.028 1.00 65.11 C ATOM 314 CE2 PHE A 601 -9.640 -20.033 2.841 1.00 11.41 C ATOM 315 CZ PHE A 601 -9.211 -21.022 3.699 1.00 15.55 C ATOM 0 H PHE A 601 -12.534 -16.510 4.716 1.00 33.13 H new ATOM 0 HA PHE A 601 -10.897 -17.524 6.944 1.00 4.11 H new ATOM 0 HB2 PHE A 601 -9.961 -16.387 4.290 1.00 13.44 H new ATOM 0 HB3 PHE A 601 -8.917 -16.725 5.656 1.00 13.44 H new ATOM 0 HD1 PHE A 601 -9.010 -19.222 6.538 1.00 75.34 H new ATOM 0 HD2 PHE A 601 -10.177 -17.981 2.638 1.00 1.32 H new ATOM 0 HE1 PHE A 601 -8.645 -21.502 5.701 1.00 65.11 H new ATOM 0 HE2 PHE A 601 -9.817 -20.259 1.800 1.00 11.41 H new ATOM 0 HZ PHE A 601 -9.053 -22.025 3.332 1.00 15.55 H new ATOM 325 N SER A 602 -10.416 -15.182 7.719 1.00 22.54 N ATOM 326 CA SER A 602 -10.300 -13.865 8.272 1.00 54.42 C ATOM 327 C SER A 602 -8.861 -13.395 8.152 1.00 61.20 C ATOM 328 O SER A 602 -7.922 -14.189 8.307 1.00 3.31 O ATOM 329 CB SER A 602 -10.777 -13.874 9.726 1.00 73.03 C ATOM 330 OG SER A 602 -10.101 -14.872 10.479 1.00 13.11 O ATOM 0 H SER A 602 -9.995 -15.914 8.291 1.00 22.54 H new ATOM 0 HA SER A 602 -10.930 -13.167 7.721 1.00 54.42 H new ATOM 0 HB2 SER A 602 -10.604 -12.896 10.175 1.00 73.03 H new ATOM 0 HB3 SER A 602 -11.851 -14.055 9.759 1.00 73.03 H new ATOM 0 HG SER A 602 -10.422 -14.857 11.405 1.00 13.11 H new ATOM 336 N PHE A 603 -8.681 -12.134 7.853 1.00 2.54 N ATOM 337 CA PHE A 603 -7.366 -11.581 7.667 1.00 22.25 C ATOM 338 C PHE A 603 -7.204 -10.277 8.448 1.00 3.41 C ATOM 339 O PHE A 603 -8.055 -9.376 8.371 1.00 13.54 O ATOM 340 CB PHE A 603 -7.068 -11.396 6.162 1.00 43.44 C ATOM 341 CG PHE A 603 -6.955 -12.706 5.389 1.00 35.22 C ATOM 342 CD1 PHE A 603 -5.743 -13.364 5.332 1.00 71.41 C ATOM 343 CD2 PHE A 603 -8.048 -13.279 4.725 1.00 31.12 C ATOM 344 CE1 PHE A 603 -5.605 -14.546 4.646 1.00 44.22 C ATOM 345 CE2 PHE A 603 -7.898 -14.469 4.038 1.00 21.05 C ATOM 346 CZ PHE A 603 -6.680 -15.098 4.001 1.00 61.12 C ATOM 0 H PHE A 603 -9.440 -11.464 7.732 1.00 2.54 H new ATOM 0 HA PHE A 603 -6.633 -12.282 8.065 1.00 22.25 H new ATOM 0 HB2 PHE A 603 -7.857 -10.790 5.717 1.00 43.44 H new ATOM 0 HB3 PHE A 603 -6.138 -10.839 6.052 1.00 43.44 H new ATOM 0 HD1 PHE A 603 -4.887 -12.941 5.836 1.00 71.41 H new ATOM 0 HD2 PHE A 603 -9.010 -12.789 4.750 1.00 31.12 H new ATOM 0 HE1 PHE A 603 -4.646 -15.042 4.615 1.00 44.22 H new ATOM 0 HE2 PHE A 603 -8.744 -14.905 3.528 1.00 21.05 H new ATOM 0 HZ PHE A 603 -6.568 -16.028 3.464 1.00 61.12 H new ATOM 356 N ASP A 604 -6.151 -10.203 9.226 1.00 74.51 N ATOM 357 CA ASP A 604 -5.844 -9.039 10.056 1.00 64.32 C ATOM 358 C ASP A 604 -4.693 -8.296 9.420 1.00 31.13 C ATOM 359 O ASP A 604 -3.582 -8.807 9.324 1.00 0.53 O ATOM 360 CB ASP A 604 -5.435 -9.562 11.447 1.00 2.44 C ATOM 361 CG ASP A 604 -5.178 -8.480 12.451 1.00 40.30 C ATOM 362 OD1 ASP A 604 -4.054 -8.006 12.541 1.00 33.42 O ATOM 363 OD2 ASP A 604 -6.121 -8.088 13.189 1.00 54.43 O ATOM 0 H ASP A 604 -5.467 -10.955 9.309 1.00 74.51 H new ATOM 0 HA ASP A 604 -6.698 -8.367 10.146 1.00 64.32 H new ATOM 0 HB2 ASP A 604 -6.222 -10.215 11.825 1.00 2.44 H new ATOM 0 HB3 ASP A 604 -4.537 -10.171 11.346 1.00 2.44 H new ATOM 368 N LEU A 605 -4.968 -7.099 8.957 1.00 21.41 N ATOM 369 CA LEU A 605 -3.968 -6.266 8.331 1.00 42.54 C ATOM 370 C LEU A 605 -3.583 -5.148 9.274 1.00 60.45 C ATOM 371 O LEU A 605 -3.000 -4.147 8.885 1.00 41.33 O ATOM 372 CB LEU A 605 -4.458 -5.714 6.970 1.00 32.43 C ATOM 373 CG LEU A 605 -4.619 -6.725 5.796 1.00 61.10 C ATOM 374 CD1 LEU A 605 -3.304 -7.424 5.476 1.00 52.33 C ATOM 375 CD2 LEU A 605 -5.721 -7.746 6.044 1.00 53.13 C ATOM 0 H LEU A 605 -5.894 -6.674 9.004 1.00 21.41 H new ATOM 0 HA LEU A 605 -3.086 -6.872 8.123 1.00 42.54 H new ATOM 0 HB2 LEU A 605 -5.422 -5.231 7.131 1.00 32.43 H new ATOM 0 HB3 LEU A 605 -3.761 -4.938 6.652 1.00 32.43 H new ATOM 0 HG LEU A 605 -4.917 -6.135 4.929 1.00 61.10 H new ATOM 0 HD11 LEU A 605 -3.454 -8.122 4.652 1.00 52.33 H new ATOM 0 HD12 LEU A 605 -2.557 -6.682 5.192 1.00 52.33 H new ATOM 0 HD13 LEU A 605 -2.958 -7.969 6.355 1.00 52.33 H new ATOM 0 HD21 LEU A 605 -5.787 -8.424 5.193 1.00 53.13 H new ATOM 0 HD22 LEU A 605 -5.493 -8.316 6.945 1.00 53.13 H new ATOM 0 HD23 LEU A 605 -6.673 -7.230 6.172 1.00 53.13 H new ATOM 383 N THR A 606 -3.881 -5.373 10.510 1.00 71.13 N ATOM 384 CA THR A 606 -3.670 -4.466 11.570 1.00 64.14 C ATOM 385 C THR A 606 -2.140 -4.119 11.805 1.00 72.23 C ATOM 386 O THR A 606 -1.807 -2.940 11.954 1.00 23.42 O ATOM 387 CB THR A 606 -4.328 -5.070 12.804 1.00 24.41 C ATOM 388 OG1 THR A 606 -5.667 -5.454 12.456 1.00 22.04 O ATOM 389 CG2 THR A 606 -4.422 -4.099 13.893 1.00 41.01 C ATOM 0 H THR A 606 -4.303 -6.249 10.817 1.00 71.13 H new ATOM 0 HA THR A 606 -4.119 -3.503 11.327 1.00 64.14 H new ATOM 0 HB THR A 606 -3.725 -5.917 13.132 1.00 24.41 H new ATOM 0 HG1 THR A 606 -6.204 -5.543 13.271 1.00 22.04 H new ATOM 0 HG21 THR A 606 -4.897 -4.565 14.756 1.00 41.01 H new ATOM 0 HG22 THR A 606 -3.422 -3.761 14.167 1.00 41.01 H new ATOM 0 HG23 THR A 606 -5.017 -3.245 13.569 1.00 41.01 H new ATOM 395 N PRO A 607 -1.181 -5.125 11.821 1.00 44.42 N ATOM 396 CA PRO A 607 0.271 -4.840 11.995 1.00 10.54 C ATOM 397 C PRO A 607 0.857 -4.092 10.793 1.00 65.33 C ATOM 398 O PRO A 607 1.924 -3.473 10.873 1.00 13.32 O ATOM 399 CB PRO A 607 0.910 -6.239 12.101 1.00 71.51 C ATOM 400 CG PRO A 607 -0.220 -7.159 12.396 1.00 30.44 C ATOM 401 CD PRO A 607 -1.409 -6.581 11.697 1.00 12.43 C ATOM 0 HA PRO A 607 0.456 -4.205 12.861 1.00 10.54 H new ATOM 0 HB2 PRO A 607 1.411 -6.515 11.173 1.00 71.51 H new ATOM 0 HB3 PRO A 607 1.661 -6.271 12.891 1.00 71.51 H new ATOM 0 HG2 PRO A 607 -0.008 -8.166 12.038 1.00 30.44 H new ATOM 0 HG3 PRO A 607 -0.395 -7.232 13.469 1.00 30.44 H new ATOM 0 HD2 PRO A 607 -1.459 -6.896 10.655 1.00 12.43 H new ATOM 0 HD3 PRO A 607 -2.344 -6.886 12.167 1.00 12.43 H new ATOM 409 N LEU A 608 0.148 -4.175 9.687 1.00 55.10 N ATOM 410 CA LEU A 608 0.544 -3.577 8.416 1.00 4.31 C ATOM 411 C LEU A 608 0.511 -2.057 8.477 1.00 33.15 C ATOM 412 O LEU A 608 1.149 -1.387 7.678 1.00 75.32 O ATOM 413 CB LEU A 608 -0.373 -4.071 7.269 1.00 40.44 C ATOM 414 CG LEU A 608 -0.227 -5.533 6.776 1.00 54.23 C ATOM 415 CD1 LEU A 608 1.103 -5.729 6.139 1.00 3.24 C ATOM 416 CD2 LEU A 608 -0.410 -6.533 7.898 1.00 30.34 C ATOM 0 H LEU A 608 -0.742 -4.671 9.639 1.00 55.10 H new ATOM 0 HA LEU A 608 1.569 -3.890 8.218 1.00 4.31 H new ATOM 0 HB2 LEU A 608 -1.406 -3.932 7.588 1.00 40.44 H new ATOM 0 HB3 LEU A 608 -0.213 -3.416 6.413 1.00 40.44 H new ATOM 0 HG LEU A 608 -1.015 -5.708 6.044 1.00 54.23 H new ATOM 0 HD11 LEU A 608 1.194 -6.760 5.797 1.00 3.24 H new ATOM 0 HD12 LEU A 608 1.202 -5.054 5.289 1.00 3.24 H new ATOM 0 HD13 LEU A 608 1.889 -5.517 6.864 1.00 3.24 H new ATOM 0 HD21 LEU A 608 -0.299 -7.544 7.506 1.00 30.34 H new ATOM 0 HD22 LEU A 608 0.342 -6.358 8.668 1.00 30.34 H new ATOM 0 HD23 LEU A 608 -1.404 -6.418 8.329 1.00 30.34 H new ATOM 424 N THR A 609 -0.235 -1.534 9.404 1.00 60.32 N ATOM 425 CA THR A 609 -0.370 -0.111 9.574 1.00 72.34 C ATOM 426 C THR A 609 0.868 0.485 10.257 1.00 1.31 C ATOM 427 O THR A 609 1.189 0.162 11.411 1.00 40.24 O ATOM 428 CB THR A 609 -1.632 0.190 10.404 1.00 72.43 C ATOM 429 OG1 THR A 609 -2.763 -0.466 9.802 1.00 30.20 O ATOM 430 CG2 THR A 609 -1.901 1.679 10.456 1.00 41.11 C ATOM 0 H THR A 609 -0.774 -2.085 10.072 1.00 60.32 H new ATOM 0 HA THR A 609 -0.462 0.349 8.590 1.00 72.34 H new ATOM 0 HB THR A 609 -1.474 -0.175 11.419 1.00 72.43 H new ATOM 0 HG1 THR A 609 -2.778 -0.276 8.841 1.00 30.20 H new ATOM 0 HG21 THR A 609 -2.797 1.866 11.048 1.00 41.11 H new ATOM 0 HG22 THR A 609 -1.052 2.186 10.913 1.00 41.11 H new ATOM 0 HG23 THR A 609 -2.048 2.058 9.445 1.00 41.11 H new ATOM 436 N LYS A 610 1.548 1.351 9.550 1.00 33.01 N ATOM 437 CA LYS A 610 2.710 2.008 10.066 1.00 51.23 C ATOM 438 C LYS A 610 2.479 3.498 10.120 1.00 61.15 C ATOM 439 O LYS A 610 1.860 4.061 9.231 1.00 40.03 O ATOM 440 CB LYS A 610 3.932 1.726 9.192 1.00 14.13 C ATOM 441 CG LYS A 610 4.437 0.296 9.211 1.00 73.10 C ATOM 442 CD LYS A 610 5.686 0.150 8.350 1.00 52.32 C ATOM 443 CE LYS A 610 6.274 -1.260 8.421 1.00 73.12 C ATOM 444 NZ LYS A 610 6.810 -1.583 9.759 1.00 32.23 N ATOM 0 H LYS A 610 1.306 1.618 8.596 1.00 33.01 H new ATOM 0 HA LYS A 610 2.895 1.623 11.069 1.00 51.23 H new ATOM 0 HB2 LYS A 610 3.690 1.993 8.163 1.00 14.13 H new ATOM 0 HB3 LYS A 610 4.742 2.382 9.509 1.00 14.13 H new ATOM 0 HG2 LYS A 610 4.660 -0.002 10.236 1.00 73.10 H new ATOM 0 HG3 LYS A 610 3.658 -0.374 8.846 1.00 73.10 H new ATOM 0 HD2 LYS A 610 5.442 0.388 7.315 1.00 52.32 H new ATOM 0 HD3 LYS A 610 6.436 0.871 8.675 1.00 52.32 H new ATOM 0 HE2 LYS A 610 5.504 -1.985 8.157 1.00 73.12 H new ATOM 0 HE3 LYS A 610 7.069 -1.356 7.682 1.00 73.12 H new ATOM 0 HZ1 LYS A 610 7.330 -2.482 9.717 1.00 32.23 H new ATOM 0 HZ2 LYS A 610 7.452 -0.826 10.068 1.00 32.23 H new ATOM 0 HZ3 LYS A 610 6.025 -1.669 10.436 1.00 32.23 H new ATOM 458 N LYS A 611 2.992 4.136 11.149 1.00 62.23 N ATOM 459 CA LYS A 611 2.875 5.582 11.286 1.00 14.00 C ATOM 460 C LYS A 611 3.779 6.216 10.248 1.00 42.02 C ATOM 461 O LYS A 611 3.421 7.187 9.578 1.00 44.12 O ATOM 462 CB LYS A 611 3.339 6.002 12.670 1.00 34.30 C ATOM 463 CG LYS A 611 2.962 7.433 13.094 1.00 75.31 C ATOM 464 CD LYS A 611 1.496 7.584 13.605 1.00 10.34 C ATOM 465 CE LYS A 611 0.420 7.275 12.567 1.00 4.52 C ATOM 466 NZ LYS A 611 -0.946 7.490 13.106 1.00 64.31 N ATOM 0 H LYS A 611 3.497 3.680 11.909 1.00 62.23 H new ATOM 0 HA LYS A 611 1.840 5.895 11.147 1.00 14.00 H new ATOM 0 HB2 LYS A 611 2.925 5.306 13.399 1.00 34.30 H new ATOM 0 HB3 LYS A 611 4.424 5.903 12.715 1.00 34.30 H new ATOM 0 HG2 LYS A 611 3.644 7.759 13.880 1.00 75.31 H new ATOM 0 HG3 LYS A 611 3.110 8.102 12.246 1.00 75.31 H new ATOM 0 HD2 LYS A 611 1.355 6.924 14.461 1.00 10.34 H new ATOM 0 HD3 LYS A 611 1.354 8.604 13.962 1.00 10.34 H new ATOM 0 HE2 LYS A 611 0.568 7.907 11.691 1.00 4.52 H new ATOM 0 HE3 LYS A 611 0.521 6.242 12.236 1.00 4.52 H new ATOM 0 HZ1 LYS A 611 -1.648 7.269 12.371 1.00 64.31 H new ATOM 0 HZ2 LYS A 611 -1.097 6.869 13.927 1.00 64.31 H new ATOM 0 HZ3 LYS A 611 -1.051 8.482 13.399 1.00 64.31 H new ATOM 480 N ASP A 612 4.956 5.621 10.143 1.00 41.23 N ATOM 481 CA ASP A 612 5.997 5.983 9.185 1.00 22.33 C ATOM 482 C ASP A 612 5.489 5.797 7.773 1.00 20.10 C ATOM 483 O ASP A 612 5.896 6.515 6.847 1.00 24.14 O ATOM 484 CB ASP A 612 7.195 5.052 9.379 1.00 32.42 C ATOM 485 CG ASP A 612 7.870 5.180 10.717 1.00 35.22 C ATOM 486 OD1 ASP A 612 7.295 4.728 11.728 1.00 42.20 O ATOM 487 OD2 ASP A 612 9.003 5.692 10.780 1.00 4.32 O ATOM 0 H ASP A 612 5.226 4.842 10.744 1.00 41.23 H new ATOM 0 HA ASP A 612 6.279 7.024 9.345 1.00 22.33 H new ATOM 0 HB2 ASP A 612 6.864 4.022 9.250 1.00 32.42 H new ATOM 0 HB3 ASP A 612 7.926 5.252 8.596 1.00 32.42 H new ATOM 492 N ALA A 613 4.592 4.821 7.627 1.00 45.00 N ATOM 493 CA ALA A 613 3.979 4.450 6.367 1.00 34.33 C ATOM 494 C ALA A 613 4.982 3.806 5.416 1.00 41.44 C ATOM 495 O ALA A 613 6.152 3.619 5.750 1.00 1.11 O ATOM 496 CB ALA A 613 3.288 5.636 5.733 1.00 70.23 C ATOM 0 H ALA A 613 4.267 4.254 8.411 1.00 45.00 H new ATOM 0 HA ALA A 613 3.219 3.697 6.579 1.00 34.33 H new ATOM 0 HB1 ALA A 613 2.836 5.332 4.789 1.00 70.23 H new ATOM 0 HB2 ALA A 613 2.513 6.007 6.404 1.00 70.23 H new ATOM 0 HB3 ALA A 613 4.016 6.426 5.549 1.00 70.23 H new ATOM 502 N TYR A 614 4.513 3.454 4.256 1.00 31.45 N ATOM 503 CA TYR A 614 5.308 2.785 3.252 1.00 1.15 C ATOM 504 C TYR A 614 5.508 3.712 2.085 1.00 73.34 C ATOM 505 O TYR A 614 4.632 4.528 1.793 1.00 51.20 O ATOM 506 CB TYR A 614 4.570 1.532 2.779 1.00 32.44 C ATOM 507 CG TYR A 614 4.349 0.485 3.853 1.00 22.23 C ATOM 508 CD1 TYR A 614 3.444 0.688 4.907 1.00 42.33 C ATOM 509 CD2 TYR A 614 5.041 -0.714 3.816 1.00 45.33 C ATOM 510 CE1 TYR A 614 3.254 -0.252 5.851 1.00 13.25 C ATOM 511 CE2 TYR A 614 4.845 -1.670 4.779 1.00 73.42 C ATOM 512 CZ TYR A 614 3.943 -1.423 5.796 1.00 30.25 C ATOM 513 OH TYR A 614 3.737 -2.340 6.761 1.00 50.53 O ATOM 0 H TYR A 614 3.549 3.624 3.969 1.00 31.45 H new ATOM 0 HA TYR A 614 6.275 2.506 3.671 1.00 1.15 H new ATOM 0 HB2 TYR A 614 3.602 1.828 2.374 1.00 32.44 H new ATOM 0 HB3 TYR A 614 5.133 1.082 1.962 1.00 32.44 H new ATOM 0 HD1 TYR A 614 2.891 1.614 4.961 1.00 42.33 H new ATOM 0 HD2 TYR A 614 5.745 -0.898 3.018 1.00 45.33 H new ATOM 0 HE1 TYR A 614 2.553 -0.076 6.654 1.00 13.25 H new ATOM 0 HE2 TYR A 614 5.388 -2.603 4.743 1.00 73.42 H new ATOM 0 HH TYR A 614 2.877 -2.168 7.197 1.00 50.53 H new ATOM 523 N LYS A 615 6.639 3.626 1.436 1.00 61.24 N ATOM 524 CA LYS A 615 6.904 4.428 0.322 1.00 33.42 C ATOM 525 C LYS A 615 7.439 3.592 -0.838 1.00 74.10 C ATOM 526 O LYS A 615 8.284 2.700 -0.655 1.00 4.23 O ATOM 527 CB LYS A 615 7.879 5.501 0.731 1.00 20.32 C ATOM 528 CG LYS A 615 8.421 6.314 -0.380 1.00 11.03 C ATOM 529 CD LYS A 615 9.516 7.202 0.150 1.00 33.43 C ATOM 530 CE LYS A 615 10.385 7.648 -0.963 1.00 51.23 C ATOM 531 NZ LYS A 615 11.489 8.536 -0.521 1.00 1.44 N ATOM 0 H LYS A 615 7.393 2.986 1.685 1.00 61.24 H new ATOM 0 HA LYS A 615 5.983 4.894 -0.029 1.00 33.42 H new ATOM 0 HB2 LYS A 615 7.387 6.166 1.441 1.00 20.32 H new ATOM 0 HB3 LYS A 615 8.711 5.033 1.257 1.00 20.32 H new ATOM 0 HG2 LYS A 615 8.809 5.666 -1.166 1.00 11.03 H new ATOM 0 HG3 LYS A 615 7.630 6.917 -0.826 1.00 11.03 H new ATOM 0 HD2 LYS A 615 9.083 8.066 0.654 1.00 33.43 H new ATOM 0 HD3 LYS A 615 10.107 6.663 0.891 1.00 33.43 H new ATOM 0 HE2 LYS A 615 10.807 6.774 -1.459 1.00 51.23 H new ATOM 0 HE3 LYS A 615 9.779 8.172 -1.702 1.00 51.23 H new ATOM 0 HZ1 LYS A 615 12.061 8.814 -1.344 1.00 1.44 H new ATOM 0 HZ2 LYS A 615 11.092 9.386 -0.072 1.00 1.44 H new ATOM 0 HZ3 LYS A 615 12.088 8.031 0.163 1.00 1.44 H new ATOM 545 N VAL A 616 6.925 3.870 -1.999 1.00 61.32 N ATOM 546 CA VAL A 616 7.331 3.241 -3.241 1.00 44.32 C ATOM 547 C VAL A 616 7.829 4.361 -4.137 1.00 53.02 C ATOM 548 O VAL A 616 7.270 5.453 -4.103 1.00 11.13 O ATOM 549 CB VAL A 616 6.129 2.543 -3.934 1.00 4.53 C ATOM 550 CG1 VAL A 616 6.569 1.784 -5.182 1.00 13.45 C ATOM 551 CG2 VAL A 616 5.393 1.622 -2.971 1.00 73.32 C ATOM 0 H VAL A 616 6.186 4.563 -2.122 1.00 61.32 H new ATOM 0 HA VAL A 616 8.092 2.484 -3.052 1.00 44.32 H new ATOM 0 HB VAL A 616 5.436 3.325 -4.246 1.00 4.53 H new ATOM 0 HG11 VAL A 616 5.703 1.308 -5.642 1.00 13.45 H new ATOM 0 HG12 VAL A 616 7.020 2.479 -5.890 1.00 13.45 H new ATOM 0 HG13 VAL A 616 7.298 1.022 -4.906 1.00 13.45 H new ATOM 0 HG21 VAL A 616 4.557 1.149 -3.487 1.00 73.32 H new ATOM 0 HG22 VAL A 616 6.076 0.855 -2.607 1.00 73.32 H new ATOM 0 HG23 VAL A 616 5.017 2.202 -2.128 1.00 73.32 H new ATOM 557 N GLU A 617 8.854 4.132 -4.902 1.00 23.51 N ATOM 558 CA GLU A 617 9.418 5.194 -5.705 1.00 14.22 C ATOM 559 C GLU A 617 9.404 4.853 -7.175 1.00 75.45 C ATOM 560 O GLU A 617 9.592 3.697 -7.568 1.00 31.11 O ATOM 561 CB GLU A 617 10.845 5.493 -5.261 1.00 62.20 C ATOM 562 CG GLU A 617 10.960 5.860 -3.802 1.00 71.55 C ATOM 563 CD GLU A 617 12.371 6.129 -3.373 1.00 43.24 C ATOM 564 OE1 GLU A 617 13.127 5.169 -3.148 1.00 34.04 O ATOM 565 OE2 GLU A 617 12.741 7.299 -3.228 1.00 71.52 O ATOM 0 H GLU A 617 9.319 3.229 -4.992 1.00 23.51 H new ATOM 0 HA GLU A 617 8.797 6.078 -5.558 1.00 14.22 H new ATOM 0 HB2 GLU A 617 11.468 4.620 -5.458 1.00 62.20 H new ATOM 0 HB3 GLU A 617 11.241 6.310 -5.865 1.00 62.20 H new ATOM 0 HG2 GLU A 617 10.352 6.744 -3.607 1.00 71.55 H new ATOM 0 HG3 GLU A 617 10.550 5.051 -3.197 1.00 71.55 H new ATOM 572 N THR A 618 9.168 5.849 -7.977 1.00 23.31 N ATOM 573 CA THR A 618 9.238 5.721 -9.393 1.00 30.43 C ATOM 574 C THR A 618 10.413 6.582 -9.824 1.00 60.20 C ATOM 575 O THR A 618 11.251 6.919 -8.975 1.00 35.33 O ATOM 576 CB THR A 618 7.918 6.185 -10.076 1.00 0.45 C ATOM 577 OG1 THR A 618 7.659 7.568 -9.791 1.00 34.30 O ATOM 578 CG2 THR A 618 6.735 5.339 -9.597 1.00 55.14 C ATOM 0 H THR A 618 8.918 6.784 -7.656 1.00 23.31 H new ATOM 0 HA THR A 618 9.373 4.681 -9.690 1.00 30.43 H new ATOM 0 HB THR A 618 8.037 6.057 -11.152 1.00 0.45 H new ATOM 0 HG1 THR A 618 7.813 7.740 -8.839 1.00 34.30 H new ATOM 0 HG21 THR A 618 5.822 5.680 -10.086 1.00 55.14 H new ATOM 0 HG22 THR A 618 6.911 4.293 -9.846 1.00 55.14 H new ATOM 0 HG23 THR A 618 6.628 5.442 -8.517 1.00 55.14 H new ATOM 584 N ASP A 619 10.506 6.941 -11.088 1.00 0.33 N ATOM 585 CA ASP A 619 11.638 7.738 -11.564 1.00 4.23 C ATOM 586 C ASP A 619 11.723 9.077 -10.834 1.00 63.14 C ATOM 587 O ASP A 619 12.777 9.446 -10.313 1.00 65.03 O ATOM 588 CB ASP A 619 11.567 7.978 -13.078 1.00 3.25 C ATOM 589 CG ASP A 619 11.584 6.704 -13.887 1.00 14.04 C ATOM 590 OD1 ASP A 619 12.670 6.163 -14.155 1.00 14.34 O ATOM 591 OD2 ASP A 619 10.494 6.233 -14.283 1.00 4.02 O ATOM 0 H ASP A 619 9.822 6.700 -11.805 1.00 0.33 H new ATOM 0 HA ASP A 619 12.538 7.162 -11.348 1.00 4.23 H new ATOM 0 HB2 ASP A 619 10.658 8.534 -13.308 1.00 3.25 H new ATOM 0 HB3 ASP A 619 12.408 8.603 -13.379 1.00 3.25 H new ATOM 596 N LYS A 620 10.604 9.782 -10.754 1.00 23.01 N ATOM 597 CA LYS A 620 10.598 11.104 -10.134 1.00 43.44 C ATOM 598 C LYS A 620 9.437 11.321 -9.158 1.00 71.42 C ATOM 599 O LYS A 620 9.243 12.427 -8.642 1.00 43.21 O ATOM 600 CB LYS A 620 10.683 12.251 -11.179 1.00 2.35 C ATOM 601 CG LYS A 620 9.581 12.352 -12.229 1.00 4.23 C ATOM 602 CD LYS A 620 9.550 11.179 -13.192 1.00 22.23 C ATOM 603 CE LYS A 620 8.446 11.342 -14.215 1.00 72.02 C ATOM 604 NZ LYS A 620 8.357 10.184 -15.128 1.00 1.33 N ATOM 0 H LYS A 620 9.699 9.469 -11.105 1.00 23.01 H new ATOM 0 HA LYS A 620 11.508 11.137 -9.535 1.00 43.44 H new ATOM 0 HB2 LYS A 620 10.713 13.195 -10.635 1.00 2.35 H new ATOM 0 HB3 LYS A 620 11.634 12.155 -11.703 1.00 2.35 H new ATOM 0 HG2 LYS A 620 8.617 12.424 -11.726 1.00 4.23 H new ATOM 0 HG3 LYS A 620 9.714 13.273 -12.796 1.00 4.23 H new ATOM 0 HD2 LYS A 620 10.511 11.096 -13.700 1.00 22.23 H new ATOM 0 HD3 LYS A 620 9.402 10.253 -12.637 1.00 22.23 H new ATOM 0 HE2 LYS A 620 7.493 11.472 -13.702 1.00 72.02 H new ATOM 0 HE3 LYS A 620 8.621 12.248 -14.795 1.00 72.02 H new ATOM 0 HZ1 LYS A 620 7.588 10.339 -15.811 1.00 1.33 H new ATOM 0 HZ2 LYS A 620 9.257 10.074 -15.638 1.00 1.33 H new ATOM 0 HZ3 LYS A 620 8.163 9.323 -14.578 1.00 1.33 H new ATOM 618 N TYR A 621 8.688 10.294 -8.891 1.00 33.01 N ATOM 619 CA TYR A 621 7.585 10.380 -7.941 1.00 52.43 C ATOM 620 C TYR A 621 7.732 9.312 -6.896 1.00 42.14 C ATOM 621 O TYR A 621 8.478 8.349 -7.084 1.00 3.31 O ATOM 622 CB TYR A 621 6.197 10.278 -8.653 1.00 1.15 C ATOM 623 CG TYR A 621 5.846 11.491 -9.501 1.00 23.24 C ATOM 624 CD1 TYR A 621 6.648 11.863 -10.550 1.00 4.35 C ATOM 625 CD2 TYR A 621 4.740 12.276 -9.217 1.00 60.42 C ATOM 626 CE1 TYR A 621 6.387 12.976 -11.309 1.00 13.43 C ATOM 627 CE2 TYR A 621 4.458 13.402 -9.970 1.00 20.15 C ATOM 628 CZ TYR A 621 5.293 13.749 -11.016 1.00 74.41 C ATOM 629 OH TYR A 621 5.030 14.871 -11.763 1.00 33.31 O ATOM 0 H TYR A 621 8.810 9.374 -9.314 1.00 33.01 H new ATOM 0 HA TYR A 621 7.624 11.357 -7.460 1.00 52.43 H new ATOM 0 HB2 TYR A 621 6.189 9.391 -9.286 1.00 1.15 H new ATOM 0 HB3 TYR A 621 5.423 10.138 -7.899 1.00 1.15 H new ATOM 0 HD1 TYR A 621 7.513 11.260 -10.786 1.00 4.35 H new ATOM 0 HD2 TYR A 621 4.090 12.006 -8.398 1.00 60.42 H new ATOM 0 HE1 TYR A 621 7.037 13.241 -12.130 1.00 13.43 H new ATOM 0 HE2 TYR A 621 3.592 14.006 -9.742 1.00 20.15 H new ATOM 0 HH TYR A 621 4.219 15.305 -11.426 1.00 33.31 H new ATOM 639 N GLU A 622 7.086 9.495 -5.797 1.00 21.41 N ATOM 640 CA GLU A 622 7.055 8.500 -4.779 1.00 3.43 C ATOM 641 C GLU A 622 5.648 8.398 -4.308 1.00 71.21 C ATOM 642 O GLU A 622 4.882 9.375 -4.396 1.00 14.11 O ATOM 643 CB GLU A 622 7.949 8.833 -3.567 1.00 24.41 C ATOM 644 CG GLU A 622 7.458 10.018 -2.754 1.00 71.41 C ATOM 645 CD GLU A 622 8.210 10.226 -1.459 1.00 23.42 C ATOM 646 OE1 GLU A 622 9.272 10.879 -1.469 1.00 51.43 O ATOM 647 OE2 GLU A 622 7.727 9.742 -0.394 1.00 45.33 O ATOM 0 H GLU A 622 6.562 10.342 -5.577 1.00 21.41 H new ATOM 0 HA GLU A 622 7.434 7.571 -5.205 1.00 3.43 H new ATOM 0 HB2 GLU A 622 8.008 7.958 -2.919 1.00 24.41 H new ATOM 0 HB3 GLU A 622 8.960 9.038 -3.918 1.00 24.41 H new ATOM 0 HG2 GLU A 622 7.540 10.921 -3.360 1.00 71.41 H new ATOM 0 HG3 GLU A 622 6.400 9.879 -2.530 1.00 71.41 H new ATOM 654 N PHE A 623 5.295 7.269 -3.844 1.00 2.03 N ATOM 655 CA PHE A 623 4.019 7.088 -3.286 1.00 24.53 C ATOM 656 C PHE A 623 4.205 6.712 -1.859 1.00 23.50 C ATOM 657 O PHE A 623 4.900 5.742 -1.553 1.00 61.35 O ATOM 658 CB PHE A 623 3.262 5.967 -3.996 1.00 62.51 C ATOM 659 CG PHE A 623 3.092 6.162 -5.470 1.00 42.11 C ATOM 660 CD1 PHE A 623 4.054 5.716 -6.351 1.00 41.44 C ATOM 661 CD2 PHE A 623 1.972 6.786 -5.975 1.00 11.25 C ATOM 662 CE1 PHE A 623 3.902 5.888 -7.699 1.00 35.54 C ATOM 663 CE2 PHE A 623 1.817 6.960 -7.329 1.00 55.13 C ATOM 664 CZ PHE A 623 2.787 6.508 -8.191 1.00 24.54 C ATOM 0 H PHE A 623 5.886 6.438 -3.840 1.00 2.03 H new ATOM 0 HA PHE A 623 3.442 8.007 -3.390 1.00 24.53 H new ATOM 0 HB2 PHE A 623 3.788 5.028 -3.826 1.00 62.51 H new ATOM 0 HB3 PHE A 623 2.277 5.867 -3.541 1.00 62.51 H new ATOM 0 HD1 PHE A 623 4.938 5.225 -5.972 1.00 41.44 H new ATOM 0 HD2 PHE A 623 1.208 7.142 -5.300 1.00 11.25 H new ATOM 0 HE1 PHE A 623 4.664 5.533 -8.377 1.00 35.54 H new ATOM 0 HE2 PHE A 623 0.935 7.451 -7.715 1.00 55.13 H new ATOM 0 HZ PHE A 623 2.669 6.642 -9.256 1.00 24.54 H new ATOM 674 N HIS A 624 3.637 7.460 -0.996 1.00 50.23 N ATOM 675 CA HIS A 624 3.652 7.133 0.374 1.00 12.20 C ATOM 676 C HIS A 624 2.251 6.716 0.728 1.00 20.11 C ATOM 677 O HIS A 624 1.305 7.471 0.536 1.00 62.42 O ATOM 678 CB HIS A 624 4.083 8.349 1.193 1.00 74.32 C ATOM 679 CG HIS A 624 5.264 8.090 2.068 1.00 62.51 C ATOM 680 ND1 HIS A 624 6.534 8.550 1.786 1.00 34.34 N ATOM 681 CD2 HIS A 624 5.364 7.428 3.240 1.00 42.14 C ATOM 682 CE1 HIS A 624 7.351 8.177 2.748 1.00 53.25 C ATOM 683 NE2 HIS A 624 6.667 7.500 3.641 1.00 54.53 N ATOM 0 H HIS A 624 3.144 8.324 -1.222 1.00 50.23 H new ATOM 0 HA HIS A 624 4.358 6.331 0.589 1.00 12.20 H new ATOM 0 HB2 HIS A 624 4.317 9.170 0.515 1.00 74.32 H new ATOM 0 HB3 HIS A 624 3.247 8.675 1.812 1.00 74.32 H new ATOM 0 HD1 HIS A 624 6.797 9.092 0.963 1.00 34.34 H new ATOM 0 HD2 HIS A 624 4.561 6.932 3.764 1.00 42.14 H new ATOM 0 HE1 HIS A 624 8.408 8.392 2.795 1.00 53.25 H new ATOM 692 N ILE A 625 2.110 5.532 1.237 1.00 63.44 N ATOM 693 CA ILE A 625 0.806 4.985 1.523 1.00 15.13 C ATOM 694 C ILE A 625 0.867 4.239 2.824 1.00 41.35 C ATOM 695 O ILE A 625 1.948 3.816 3.260 1.00 62.20 O ATOM 696 CB ILE A 625 0.310 3.992 0.402 1.00 12.25 C ATOM 697 CG1 ILE A 625 1.177 2.731 0.385 1.00 1.31 C ATOM 698 CG2 ILE A 625 0.306 4.658 -0.977 1.00 2.11 C ATOM 699 CD1 ILE A 625 0.826 1.731 -0.701 1.00 20.31 C ATOM 0 H ILE A 625 2.888 4.914 1.468 1.00 63.44 H new ATOM 0 HA ILE A 625 0.104 5.818 1.570 1.00 15.13 H new ATOM 0 HB ILE A 625 -0.717 3.711 0.637 1.00 12.25 H new ATOM 0 HG12 ILE A 625 2.219 3.026 0.265 1.00 1.31 H new ATOM 0 HG13 ILE A 625 1.095 2.238 1.354 1.00 1.31 H new ATOM 0 HG21 ILE A 625 -0.041 3.945 -1.725 1.00 2.11 H new ATOM 0 HG22 ILE A 625 -0.360 5.521 -0.962 1.00 2.11 H new ATOM 0 HG23 ILE A 625 1.316 4.983 -1.227 1.00 2.11 H new ATOM 0 HD11 ILE A 625 1.493 0.872 -0.634 1.00 20.31 H new ATOM 0 HD12 ILE A 625 -0.205 1.401 -0.572 1.00 20.31 H new ATOM 0 HD13 ILE A 625 0.937 2.201 -1.678 1.00 20.31 H new ATOM 706 N ASN A 626 -0.234 4.113 3.447 1.00 54.43 N ATOM 707 CA ASN A 626 -0.327 3.358 4.672 1.00 74.43 C ATOM 708 C ASN A 626 -1.520 2.425 4.594 1.00 2.21 C ATOM 709 O ASN A 626 -2.499 2.732 3.910 1.00 13.13 O ATOM 710 CB ASN A 626 -0.479 4.306 5.865 1.00 31.55 C ATOM 711 CG ASN A 626 -0.518 3.584 7.198 1.00 15.42 C ATOM 712 OD1 ASN A 626 0.099 2.520 7.372 1.00 51.42 O ATOM 713 ND2 ASN A 626 -1.234 4.139 8.135 1.00 50.13 N ATOM 0 H ASN A 626 -1.114 4.525 3.138 1.00 54.43 H new ATOM 0 HA ASN A 626 0.583 2.774 4.807 1.00 74.43 H new ATOM 0 HB2 ASN A 626 0.350 5.014 5.866 1.00 31.55 H new ATOM 0 HB3 ASN A 626 -1.394 4.886 5.746 1.00 31.55 H new ATOM 0 HD21 ASN A 626 -1.303 3.699 9.052 1.00 50.13 H new ATOM 0 HD22 ASN A 626 -1.725 5.014 7.951 1.00 50.13 H new ATOM 719 N VAL A 627 -1.430 1.284 5.247 1.00 41.14 N ATOM 720 CA VAL A 627 -2.544 0.367 5.316 1.00 23.11 C ATOM 721 C VAL A 627 -3.472 0.828 6.367 1.00 22.02 C ATOM 722 O VAL A 627 -3.107 0.845 7.538 1.00 3.13 O ATOM 723 CB VAL A 627 -2.129 -1.090 5.640 1.00 23.44 C ATOM 724 CG1 VAL A 627 -3.367 -1.969 5.891 1.00 55.41 C ATOM 725 CG2 VAL A 627 -1.336 -1.661 4.499 1.00 5.05 C ATOM 0 H VAL A 627 -0.593 0.971 5.738 1.00 41.14 H new ATOM 0 HA VAL A 627 -3.007 0.359 4.329 1.00 23.11 H new ATOM 0 HB VAL A 627 -1.519 -1.078 6.543 1.00 23.44 H new ATOM 0 HG11 VAL A 627 -3.051 -2.987 6.116 1.00 55.41 H new ATOM 0 HG12 VAL A 627 -3.932 -1.570 6.733 1.00 55.41 H new ATOM 0 HG13 VAL A 627 -3.997 -1.973 5.001 1.00 55.41 H new ATOM 0 HG21 VAL A 627 -1.047 -2.686 4.733 1.00 5.05 H new ATOM 0 HG22 VAL A 627 -1.943 -1.653 3.594 1.00 5.05 H new ATOM 0 HG23 VAL A 627 -0.441 -1.059 4.341 1.00 5.05 H new ATOM 731 N CYS A 628 -4.644 1.230 5.938 1.00 54.15 N ATOM 732 CA CYS A 628 -5.716 1.652 6.795 1.00 22.01 C ATOM 733 C CYS A 628 -5.435 3.048 7.378 1.00 21.40 C ATOM 734 O CYS A 628 -4.292 3.415 7.670 1.00 44.45 O ATOM 735 CB CYS A 628 -5.916 0.574 7.901 1.00 55.41 C ATOM 736 SG CYS A 628 -7.130 0.922 9.187 1.00 33.11 S ATOM 0 H CYS A 628 -4.882 1.272 4.947 1.00 54.15 H new ATOM 0 HA CYS A 628 -6.641 1.743 6.226 1.00 22.01 H new ATOM 0 HB2 CYS A 628 -6.199 -0.360 7.414 1.00 55.41 H new ATOM 0 HB3 CYS A 628 -4.954 0.403 8.383 1.00 55.41 H new ATOM 741 N GLY A 629 -6.489 3.800 7.541 1.00 23.24 N ATOM 742 CA GLY A 629 -6.405 5.112 8.128 1.00 71.31 C ATOM 743 C GLY A 629 -5.690 6.093 7.235 1.00 13.43 C ATOM 744 O GLY A 629 -5.642 5.920 6.012 1.00 72.21 O ATOM 0 H GLY A 629 -7.432 3.521 7.271 1.00 23.24 H new ATOM 0 HA2 GLY A 629 -7.410 5.479 8.337 1.00 71.31 H new ATOM 0 HA3 GLY A 629 -5.884 5.048 9.084 1.00 71.31 H new ATOM 748 N PRO A 630 -5.190 7.162 7.812 1.00 11.00 N ATOM 749 CA PRO A 630 -4.392 8.136 7.100 1.00 64.33 C ATOM 750 C PRO A 630 -2.909 7.773 7.065 1.00 74.30 C ATOM 751 O PRO A 630 -2.443 6.838 7.751 1.00 12.43 O ATOM 752 CB PRO A 630 -4.568 9.382 7.933 1.00 42.43 C ATOM 753 CG PRO A 630 -4.754 8.874 9.330 1.00 23.13 C ATOM 754 CD PRO A 630 -5.417 7.544 9.219 1.00 53.12 C ATOM 0 HA PRO A 630 -4.701 8.223 6.058 1.00 64.33 H new ATOM 0 HB2 PRO A 630 -3.698 10.035 7.860 1.00 42.43 H new ATOM 0 HB3 PRO A 630 -5.430 9.962 7.603 1.00 42.43 H new ATOM 0 HG2 PRO A 630 -3.795 8.787 9.841 1.00 23.13 H new ATOM 0 HG3 PRO A 630 -5.364 9.563 9.914 1.00 23.13 H new ATOM 0 HD2 PRO A 630 -4.981 6.820 9.907 1.00 53.12 H new ATOM 0 HD3 PRO A 630 -6.480 7.605 9.452 1.00 53.12 H new ATOM 762 N VAL A 631 -2.181 8.508 6.288 1.00 62.43 N ATOM 763 CA VAL A 631 -0.776 8.363 6.200 1.00 71.12 C ATOM 764 C VAL A 631 -0.148 9.540 6.937 1.00 50.22 C ATOM 765 O VAL A 631 -0.545 10.692 6.744 1.00 40.54 O ATOM 766 CB VAL A 631 -0.303 8.299 4.707 1.00 72.24 C ATOM 767 CG1 VAL A 631 -0.554 9.564 3.916 1.00 74.11 C ATOM 768 CG2 VAL A 631 1.109 7.834 4.577 1.00 55.52 C ATOM 0 H VAL A 631 -2.561 9.239 5.687 1.00 62.43 H new ATOM 0 HA VAL A 631 -0.462 7.425 6.658 1.00 71.12 H new ATOM 0 HB VAL A 631 -0.942 7.544 4.249 1.00 72.24 H new ATOM 0 HG11 VAL A 631 -0.196 9.432 2.895 1.00 74.11 H new ATOM 0 HG12 VAL A 631 -1.623 9.778 3.901 1.00 74.11 H new ATOM 0 HG13 VAL A 631 -0.024 10.395 4.381 1.00 74.11 H new ATOM 0 HG21 VAL A 631 1.388 7.807 3.524 1.00 55.52 H new ATOM 0 HG22 VAL A 631 1.768 8.519 5.110 1.00 55.52 H new ATOM 0 HG23 VAL A 631 1.204 6.835 5.003 1.00 55.52 H new ATOM 774 N SER A 632 0.779 9.267 7.801 1.00 74.10 N ATOM 775 CA SER A 632 1.371 10.318 8.561 1.00 12.51 C ATOM 776 C SER A 632 2.682 10.735 7.959 1.00 15.43 C ATOM 777 O SER A 632 3.747 10.263 8.358 1.00 13.42 O ATOM 778 CB SER A 632 1.503 9.933 10.046 1.00 31.44 C ATOM 779 OG SER A 632 2.113 10.963 10.825 1.00 33.52 O ATOM 0 H SER A 632 1.139 8.333 7.995 1.00 74.10 H new ATOM 0 HA SER A 632 0.709 11.183 8.524 1.00 12.51 H new ATOM 0 HB2 SER A 632 0.515 9.713 10.450 1.00 31.44 H new ATOM 0 HB3 SER A 632 2.093 9.020 10.131 1.00 31.44 H new ATOM 0 HG SER A 632 2.174 10.674 11.759 1.00 33.52 H new ATOM 785 N VAL A 633 2.599 11.531 6.924 1.00 4.04 N ATOM 786 CA VAL A 633 3.778 12.086 6.308 1.00 34.41 C ATOM 787 C VAL A 633 3.624 13.592 6.282 1.00 54.01 C ATOM 788 O VAL A 633 2.518 14.099 6.082 1.00 40.44 O ATOM 789 CB VAL A 633 3.967 11.573 4.850 1.00 40.15 C ATOM 790 CG1 VAL A 633 5.333 11.931 4.297 1.00 61.01 C ATOM 791 CG2 VAL A 633 3.737 10.094 4.763 1.00 5.22 C ATOM 0 H VAL A 633 1.721 11.811 6.487 1.00 4.04 H new ATOM 0 HA VAL A 633 4.651 11.779 6.884 1.00 34.41 H new ATOM 0 HB VAL A 633 3.219 12.076 4.236 1.00 40.15 H new ATOM 0 HG11 VAL A 633 5.423 11.555 3.278 1.00 61.01 H new ATOM 0 HG12 VAL A 633 5.452 13.014 4.295 1.00 61.01 H new ATOM 0 HG13 VAL A 633 6.107 11.482 4.920 1.00 61.01 H new ATOM 0 HG21 VAL A 633 3.876 9.764 3.733 1.00 5.22 H new ATOM 0 HG22 VAL A 633 4.447 9.577 5.409 1.00 5.22 H new ATOM 0 HG23 VAL A 633 2.721 9.864 5.084 1.00 5.22 H new ATOM 797 N GLY A 634 4.705 14.308 6.482 1.00 10.04 N ATOM 798 CA GLY A 634 4.646 15.753 6.450 1.00 42.02 C ATOM 799 C GLY A 634 4.877 16.295 5.058 1.00 12.44 C ATOM 800 O GLY A 634 5.244 17.451 4.884 1.00 40.15 O ATOM 0 H GLY A 634 5.630 13.919 6.667 1.00 10.04 H new ATOM 0 HA2 GLY A 634 3.673 16.085 6.812 1.00 42.02 H new ATOM 0 HA3 GLY A 634 5.395 16.162 7.128 1.00 42.02 H new ATOM 804 N ALA A 635 4.670 15.457 4.069 1.00 24.14 N ATOM 805 CA ALA A 635 4.837 15.857 2.686 1.00 4.32 C ATOM 806 C ALA A 635 3.493 15.860 1.988 1.00 24.41 C ATOM 807 O ALA A 635 3.371 16.280 0.839 1.00 3.40 O ATOM 808 CB ALA A 635 5.808 14.921 1.974 1.00 13.53 C ATOM 0 H ALA A 635 4.383 14.486 4.195 1.00 24.14 H new ATOM 0 HA ALA A 635 5.252 16.864 2.656 1.00 4.32 H new ATOM 0 HB1 ALA A 635 5.922 15.236 0.937 1.00 13.53 H new ATOM 0 HB2 ALA A 635 6.777 14.955 2.472 1.00 13.53 H new ATOM 0 HB3 ALA A 635 5.420 13.903 2.004 1.00 13.53 H new ATOM 814 N CYS A 636 2.494 15.388 2.685 1.00 24.32 N ATOM 815 CA CYS A 636 1.165 15.305 2.156 1.00 24.44 C ATOM 816 C CYS A 636 0.156 15.532 3.277 1.00 3.02 C ATOM 817 O CYS A 636 0.516 15.408 4.449 1.00 3.22 O ATOM 818 CB CYS A 636 0.974 13.952 1.491 1.00 65.12 C ATOM 819 SG CYS A 636 1.279 12.515 2.563 1.00 1.43 S ATOM 0 H CYS A 636 2.584 15.049 3.643 1.00 24.32 H new ATOM 0 HA CYS A 636 1.007 16.077 1.403 1.00 24.44 H new ATOM 0 HB2 CYS A 636 -0.046 13.892 1.111 1.00 65.12 H new ATOM 0 HB3 CYS A 636 1.639 13.891 0.630 1.00 65.12 H new ATOM 824 N PRO A 637 -1.099 15.906 2.953 1.00 22.52 N ATOM 825 CA PRO A 637 -2.128 16.179 3.966 1.00 4.44 C ATOM 826 C PRO A 637 -2.505 14.945 4.825 1.00 3.53 C ATOM 827 O PRO A 637 -2.596 13.816 4.325 1.00 42.31 O ATOM 828 CB PRO A 637 -3.326 16.653 3.144 1.00 32.42 C ATOM 829 CG PRO A 637 -3.099 16.098 1.783 1.00 13.33 C ATOM 830 CD PRO A 637 -1.622 16.118 1.585 1.00 13.13 C ATOM 0 HA PRO A 637 -1.774 16.907 4.696 1.00 4.44 H new ATOM 0 HB2 PRO A 637 -4.263 16.292 3.567 1.00 32.42 H new ATOM 0 HB3 PRO A 637 -3.385 17.741 3.122 1.00 32.42 H new ATOM 0 HG2 PRO A 637 -3.492 15.085 1.702 1.00 13.33 H new ATOM 0 HG3 PRO A 637 -3.604 16.697 1.026 1.00 13.33 H new ATOM 0 HD2 PRO A 637 -1.296 15.333 0.902 1.00 13.13 H new ATOM 0 HD3 PRO A 637 -1.284 17.066 1.166 1.00 13.13 H new ATOM 838 N PRO A 638 -2.750 15.169 6.131 1.00 51.45 N ATOM 839 CA PRO A 638 -3.088 14.103 7.101 1.00 21.44 C ATOM 840 C PRO A 638 -4.445 13.442 6.831 1.00 50.01 C ATOM 841 O PRO A 638 -4.772 12.415 7.423 1.00 44.24 O ATOM 842 CB PRO A 638 -3.127 14.840 8.440 1.00 1.51 C ATOM 843 CG PRO A 638 -3.394 16.258 8.091 1.00 72.24 C ATOM 844 CD PRO A 638 -2.710 16.492 6.780 1.00 12.44 C ATOM 0 HA PRO A 638 -2.366 13.287 7.054 1.00 21.44 H new ATOM 0 HB2 PRO A 638 -3.907 14.440 9.088 1.00 1.51 H new ATOM 0 HB3 PRO A 638 -2.183 14.736 8.975 1.00 1.51 H new ATOM 0 HG2 PRO A 638 -4.465 16.446 8.012 1.00 72.24 H new ATOM 0 HG3 PRO A 638 -3.008 16.929 8.859 1.00 72.24 H new ATOM 0 HD2 PRO A 638 -3.227 17.246 6.186 1.00 12.44 H new ATOM 0 HD3 PRO A 638 -1.687 16.841 6.918 1.00 12.44 H new ATOM 852 N ASP A 639 -5.238 14.038 5.961 1.00 33.43 N ATOM 853 CA ASP A 639 -6.544 13.481 5.634 1.00 12.11 C ATOM 854 C ASP A 639 -6.425 12.415 4.566 1.00 32.42 C ATOM 855 O ASP A 639 -7.411 11.781 4.208 1.00 43.13 O ATOM 856 CB ASP A 639 -7.548 14.554 5.187 1.00 13.21 C ATOM 857 CG ASP A 639 -7.189 15.236 3.883 1.00 11.43 C ATOM 858 OD1 ASP A 639 -6.294 16.100 3.882 1.00 2.22 O ATOM 859 OD2 ASP A 639 -7.837 14.947 2.849 1.00 4.02 O ATOM 0 H ASP A 639 -5.007 14.901 5.469 1.00 33.43 H new ATOM 0 HA ASP A 639 -6.926 13.033 6.552 1.00 12.11 H new ATOM 0 HB2 ASP A 639 -8.532 14.095 5.085 1.00 13.21 H new ATOM 0 HB3 ASP A 639 -7.628 15.309 5.969 1.00 13.21 H new ATOM 864 N SER A 640 -5.227 12.204 4.067 1.00 10.22 N ATOM 865 CA SER A 640 -5.027 11.205 3.057 1.00 34.22 C ATOM 866 C SER A 640 -4.337 9.984 3.636 1.00 75.41 C ATOM 867 O SER A 640 -3.555 10.099 4.572 1.00 11.33 O ATOM 868 CB SER A 640 -4.279 11.772 1.825 1.00 65.12 C ATOM 869 OG SER A 640 -3.007 12.318 2.148 1.00 42.11 O ATOM 0 H SER A 640 -4.386 12.710 4.346 1.00 10.22 H new ATOM 0 HA SER A 640 -6.007 10.889 2.701 1.00 34.22 H new ATOM 0 HB2 SER A 640 -4.151 10.979 1.088 1.00 65.12 H new ATOM 0 HB3 SER A 640 -4.891 12.544 1.359 1.00 65.12 H new ATOM 0 HG SER A 640 -3.112 13.004 2.840 1.00 42.11 H new ATOM 875 N GLY A 641 -4.681 8.819 3.123 1.00 74.40 N ATOM 876 CA GLY A 641 -4.039 7.586 3.545 1.00 20.31 C ATOM 877 C GLY A 641 -3.020 7.140 2.531 1.00 22.34 C ATOM 878 O GLY A 641 -2.212 6.231 2.776 1.00 63.31 O ATOM 0 H GLY A 641 -5.402 8.699 2.412 1.00 74.40 H new ATOM 0 HA2 GLY A 641 -3.557 7.734 4.511 1.00 20.31 H new ATOM 0 HA3 GLY A 641 -4.790 6.807 3.680 1.00 20.31 H new ATOM 882 N ALA A 642 -3.064 7.780 1.390 1.00 34.04 N ATOM 883 CA ALA A 642 -2.145 7.530 0.313 1.00 13.11 C ATOM 884 C ALA A 642 -1.867 8.839 -0.379 1.00 24.44 C ATOM 885 O ALA A 642 -2.797 9.550 -0.788 1.00 41.24 O ATOM 886 CB ALA A 642 -2.731 6.512 -0.646 1.00 75.34 C ATOM 0 H ALA A 642 -3.753 8.503 1.182 1.00 34.04 H new ATOM 0 HA ALA A 642 -1.211 7.117 0.694 1.00 13.11 H new ATOM 0 HB1 ALA A 642 -2.027 6.330 -1.458 1.00 75.34 H new ATOM 0 HB2 ALA A 642 -2.922 5.579 -0.115 1.00 75.34 H new ATOM 0 HB3 ALA A 642 -3.666 6.894 -1.055 1.00 75.34 H new ATOM 892 N CYS A 643 -0.622 9.183 -0.477 1.00 55.11 N ATOM 893 CA CYS A 643 -0.238 10.432 -1.051 1.00 5.21 C ATOM 894 C CYS A 643 0.999 10.284 -1.921 1.00 72.54 C ATOM 895 O CYS A 643 1.955 9.599 -1.554 1.00 32.04 O ATOM 896 CB CYS A 643 0.007 11.447 0.052 1.00 4.12 C ATOM 897 SG CYS A 643 1.345 11.001 1.226 1.00 4.41 S ATOM 0 H CYS A 643 0.157 8.605 -0.161 1.00 55.11 H new ATOM 0 HA CYS A 643 -1.049 10.781 -1.689 1.00 5.21 H new ATOM 0 HB2 CYS A 643 0.248 12.407 -0.404 1.00 4.12 H new ATOM 0 HB3 CYS A 643 -0.918 11.584 0.612 1.00 4.12 H new ATOM 902 N GLN A 644 0.975 10.885 -3.079 1.00 63.34 N ATOM 903 CA GLN A 644 2.140 10.880 -3.933 1.00 1.30 C ATOM 904 C GLN A 644 2.751 12.244 -3.937 1.00 3.12 C ATOM 905 O GLN A 644 2.035 13.232 -3.872 1.00 70.34 O ATOM 906 CB GLN A 644 1.813 10.496 -5.366 1.00 24.55 C ATOM 907 CG GLN A 644 0.824 11.417 -6.063 1.00 72.41 C ATOM 908 CD GLN A 644 0.505 10.997 -7.485 1.00 64.43 C ATOM 909 OE1 GLN A 644 0.522 9.827 -7.811 1.00 71.51 O ATOM 910 NE2 GLN A 644 0.226 11.958 -8.340 1.00 72.22 N ATOM 0 H GLN A 644 0.168 11.383 -3.455 1.00 63.34 H new ATOM 0 HA GLN A 644 2.829 10.135 -3.535 1.00 1.30 H new ATOM 0 HB2 GLN A 644 2.738 10.477 -5.942 1.00 24.55 H new ATOM 0 HB3 GLN A 644 1.412 9.483 -5.373 1.00 24.55 H new ATOM 0 HG2 GLN A 644 -0.100 11.448 -5.486 1.00 72.41 H new ATOM 0 HG3 GLN A 644 1.228 12.429 -6.073 1.00 72.41 H new ATOM 0 HE21 GLN A 644 0.221 12.930 -8.031 1.00 72.22 H new ATOM 0 HE22 GLN A 644 0.015 11.731 -9.312 1.00 72.22 H new ATOM 918 N VAL A 645 4.037 12.309 -4.005 1.00 14.44 N ATOM 919 CA VAL A 645 4.723 13.562 -4.067 1.00 1.34 C ATOM 920 C VAL A 645 5.804 13.499 -5.130 1.00 73.34 C ATOM 921 O VAL A 645 6.529 12.500 -5.255 1.00 42.13 O ATOM 922 CB VAL A 645 5.279 14.040 -2.666 1.00 52.55 C ATOM 923 CG1 VAL A 645 6.244 13.057 -2.063 1.00 1.53 C ATOM 924 CG2 VAL A 645 5.915 15.427 -2.750 1.00 61.12 C ATOM 0 H VAL A 645 4.648 11.493 -4.019 1.00 14.44 H new ATOM 0 HA VAL A 645 3.998 14.325 -4.351 1.00 1.34 H new ATOM 0 HB VAL A 645 4.414 14.099 -2.005 1.00 52.55 H new ATOM 0 HG11 VAL A 645 6.595 13.434 -1.102 1.00 1.53 H new ATOM 0 HG12 VAL A 645 5.744 12.100 -1.916 1.00 1.53 H new ATOM 0 HG13 VAL A 645 7.094 12.924 -2.733 1.00 1.53 H new ATOM 0 HG21 VAL A 645 6.284 15.718 -1.767 1.00 61.12 H new ATOM 0 HG22 VAL A 645 6.744 15.405 -3.457 1.00 61.12 H new ATOM 0 HG23 VAL A 645 5.171 16.149 -3.086 1.00 61.12 H new ATOM 930 N SER A 646 5.860 14.520 -5.928 1.00 72.35 N ATOM 931 CA SER A 646 6.822 14.606 -6.974 1.00 52.33 C ATOM 932 C SER A 646 8.119 15.112 -6.398 1.00 30.31 C ATOM 933 O SER A 646 8.167 16.211 -5.863 1.00 73.40 O ATOM 934 CB SER A 646 6.319 15.566 -8.057 1.00 51.44 C ATOM 935 OG SER A 646 7.248 15.682 -9.129 1.00 61.13 O ATOM 0 H SER A 646 5.233 15.322 -5.868 1.00 72.35 H new ATOM 0 HA SER A 646 6.978 13.624 -7.421 1.00 52.33 H new ATOM 0 HB2 SER A 646 5.362 15.212 -8.441 1.00 51.44 H new ATOM 0 HB3 SER A 646 6.143 16.549 -7.619 1.00 51.44 H new ATOM 0 HG SER A 646 6.939 15.146 -9.889 1.00 61.13 H new ATOM 941 N ARG A 647 9.167 14.320 -6.488 1.00 4.14 N ATOM 942 CA ARG A 647 10.456 14.744 -5.977 1.00 64.12 C ATOM 943 C ARG A 647 11.023 15.837 -6.888 1.00 11.42 C ATOM 944 O ARG A 647 11.848 16.646 -6.492 1.00 44.33 O ATOM 945 CB ARG A 647 11.395 13.532 -5.789 1.00 3.22 C ATOM 946 CG ARG A 647 11.769 12.791 -7.054 1.00 24.35 C ATOM 947 CD ARG A 647 12.250 11.379 -6.741 1.00 74.31 C ATOM 948 NE ARG A 647 13.409 11.332 -5.846 1.00 34.12 N ATOM 949 CZ ARG A 647 13.595 10.390 -4.908 1.00 21.54 C ATOM 950 NH1 ARG A 647 12.720 9.396 -4.783 1.00 64.32 N ATOM 951 NH2 ARG A 647 14.657 10.437 -4.119 1.00 73.01 N ATOM 0 H ARG A 647 9.154 13.389 -6.905 1.00 4.14 H new ATOM 0 HA ARG A 647 10.349 15.181 -4.984 1.00 64.12 H new ATOM 0 HB2 ARG A 647 12.310 13.876 -5.307 1.00 3.22 H new ATOM 0 HB3 ARG A 647 10.919 12.829 -5.105 1.00 3.22 H new ATOM 0 HG2 ARG A 647 10.908 12.746 -7.721 1.00 24.35 H new ATOM 0 HG3 ARG A 647 12.552 13.337 -7.581 1.00 24.35 H new ATOM 0 HD2 ARG A 647 11.431 10.819 -6.289 1.00 74.31 H new ATOM 0 HD3 ARG A 647 12.503 10.877 -7.675 1.00 74.31 H new ATOM 0 HE ARG A 647 14.118 12.059 -5.941 1.00 34.12 H new ATOM 0 HH11 ARG A 647 11.909 9.350 -5.400 1.00 64.32 H new ATOM 0 HH12 ARG A 647 12.860 8.680 -4.071 1.00 64.32 H new ATOM 0 HH21 ARG A 647 15.337 11.190 -4.223 1.00 73.01 H new ATOM 0 HH22 ARG A 647 14.796 9.720 -3.407 1.00 73.01 H new ATOM 963 N SER A 648 10.539 15.844 -8.112 1.00 72.13 N ATOM 964 CA SER A 648 10.889 16.827 -9.094 1.00 71.52 C ATOM 965 C SER A 648 10.091 18.143 -8.944 1.00 3.45 C ATOM 966 O SER A 648 10.675 19.222 -8.936 1.00 21.21 O ATOM 967 CB SER A 648 10.718 16.213 -10.476 1.00 31.32 C ATOM 968 OG SER A 648 11.633 15.142 -10.627 1.00 1.30 O ATOM 0 H SER A 648 9.877 15.147 -8.452 1.00 72.13 H new ATOM 0 HA SER A 648 11.930 17.112 -8.944 1.00 71.52 H new ATOM 0 HB2 SER A 648 9.696 15.855 -10.604 1.00 31.32 H new ATOM 0 HB3 SER A 648 10.891 16.966 -11.245 1.00 31.32 H new ATOM 0 HG SER A 648 11.759 14.952 -11.580 1.00 1.30 H new ATOM 974 N ASP A 649 8.779 18.042 -8.791 1.00 50.25 N ATOM 975 CA ASP A 649 7.909 19.239 -8.782 1.00 22.24 C ATOM 976 C ASP A 649 7.587 19.738 -7.365 1.00 14.44 C ATOM 977 O ASP A 649 7.225 20.889 -7.166 1.00 21.23 O ATOM 978 CB ASP A 649 6.630 18.944 -9.572 1.00 73.10 C ATOM 979 CG ASP A 649 5.698 20.119 -9.695 1.00 54.22 C ATOM 980 OD1 ASP A 649 6.023 21.090 -10.419 1.00 44.33 O ATOM 981 OD2 ASP A 649 4.641 20.088 -9.092 1.00 60.30 O ATOM 0 H ASP A 649 8.284 17.158 -8.671 1.00 50.25 H new ATOM 0 HA ASP A 649 8.456 20.050 -9.262 1.00 22.24 H new ATOM 0 HB2 ASP A 649 6.903 18.605 -10.571 1.00 73.10 H new ATOM 0 HB3 ASP A 649 6.100 18.122 -9.090 1.00 73.10 H new ATOM 986 N ARG A 650 7.762 18.867 -6.402 1.00 63.10 N ATOM 987 CA ARG A 650 7.517 19.134 -4.952 1.00 64.12 C ATOM 988 C ARG A 650 6.061 19.304 -4.577 1.00 51.43 C ATOM 989 O ARG A 650 5.742 19.773 -3.475 1.00 13.54 O ATOM 990 CB ARG A 650 8.380 20.270 -4.362 1.00 20.04 C ATOM 991 CG ARG A 650 9.853 19.926 -4.163 1.00 13.35 C ATOM 992 CD ARG A 650 10.599 19.721 -5.461 1.00 21.24 C ATOM 993 NE ARG A 650 10.633 20.943 -6.260 1.00 35.12 N ATOM 994 CZ ARG A 650 11.753 21.587 -6.614 1.00 73.31 C ATOM 995 NH1 ARG A 650 12.937 21.176 -6.179 1.00 72.23 N ATOM 996 NH2 ARG A 650 11.684 22.654 -7.381 1.00 54.23 N ATOM 0 H ARG A 650 8.088 17.917 -6.580 1.00 63.10 H new ATOM 0 HA ARG A 650 7.848 18.208 -4.482 1.00 64.12 H new ATOM 0 HB2 ARG A 650 8.311 21.137 -5.019 1.00 20.04 H new ATOM 0 HB3 ARG A 650 7.958 20.564 -3.401 1.00 20.04 H new ATOM 0 HG2 ARG A 650 10.333 20.726 -3.599 1.00 13.35 H new ATOM 0 HG3 ARG A 650 9.929 19.021 -3.561 1.00 13.35 H new ATOM 0 HD2 ARG A 650 11.618 19.396 -5.249 1.00 21.24 H new ATOM 0 HD3 ARG A 650 10.123 18.925 -6.033 1.00 21.24 H new ATOM 0 HE ARG A 650 9.743 21.333 -6.570 1.00 35.12 H new ATOM 0 HH11 ARG A 650 13.001 20.362 -5.568 1.00 72.23 H new ATOM 0 HH12 ARG A 650 13.783 21.674 -6.455 1.00 72.23 H new ATOM 0 HH21 ARG A 650 10.778 22.991 -7.706 1.00 54.23 H new ATOM 0 HH22 ARG A 650 12.537 23.144 -7.651 1.00 54.23 H new ATOM 1008 N LYS A 651 5.189 18.874 -5.427 1.00 11.13 N ATOM 1009 CA LYS A 651 3.807 18.855 -5.088 1.00 5.04 C ATOM 1010 C LYS A 651 3.380 17.476 -4.733 1.00 72.31 C ATOM 1011 O LYS A 651 4.021 16.494 -5.136 1.00 42.22 O ATOM 1012 CB LYS A 651 2.935 19.389 -6.185 1.00 12.23 C ATOM 1013 CG LYS A 651 3.189 20.825 -6.506 1.00 21.13 C ATOM 1014 CD LYS A 651 2.125 21.372 -7.460 1.00 42.21 C ATOM 1015 CE LYS A 651 0.723 21.312 -6.861 1.00 50.21 C ATOM 1016 NZ LYS A 651 -0.303 21.823 -7.791 1.00 13.11 N ATOM 0 H LYS A 651 5.410 18.531 -6.362 1.00 11.13 H new ATOM 0 HA LYS A 651 3.686 19.512 -4.227 1.00 5.04 H new ATOM 0 HB2 LYS A 651 3.090 18.792 -7.084 1.00 12.23 H new ATOM 0 HB3 LYS A 651 1.890 19.269 -5.898 1.00 12.23 H new ATOM 0 HG2 LYS A 651 3.194 21.411 -5.587 1.00 21.13 H new ATOM 0 HG3 LYS A 651 4.176 20.931 -6.957 1.00 21.13 H new ATOM 0 HD2 LYS A 651 2.365 22.404 -7.715 1.00 42.21 H new ATOM 0 HD3 LYS A 651 2.145 20.802 -8.389 1.00 42.21 H new ATOM 0 HE2 LYS A 651 0.488 20.282 -6.594 1.00 50.21 H new ATOM 0 HE3 LYS A 651 0.698 21.894 -5.940 1.00 50.21 H new ATOM 0 HZ1 LYS A 651 -1.239 21.763 -7.342 1.00 13.11 H new ATOM 0 HZ2 LYS A 651 -0.095 22.814 -8.027 1.00 13.11 H new ATOM 0 HZ3 LYS A 651 -0.299 21.252 -8.660 1.00 13.11 H new ATOM 1030 N SER A 652 2.318 17.389 -4.006 1.00 74.33 N ATOM 1031 CA SER A 652 1.793 16.135 -3.599 1.00 72.35 C ATOM 1032 C SER A 652 0.311 16.104 -3.816 1.00 21.13 C ATOM 1033 O SER A 652 -0.363 17.129 -3.721 1.00 70.25 O ATOM 1034 CB SER A 652 2.164 15.809 -2.158 1.00 33.32 C ATOM 1035 OG SER A 652 1.738 16.830 -1.253 1.00 24.21 O ATOM 0 H SER A 652 1.787 18.195 -3.676 1.00 74.33 H new ATOM 0 HA SER A 652 2.243 15.357 -4.216 1.00 72.35 H new ATOM 0 HB2 SER A 652 1.711 14.859 -1.873 1.00 33.32 H new ATOM 0 HB3 SER A 652 3.244 15.683 -2.081 1.00 33.32 H new ATOM 0 HG SER A 652 2.238 16.753 -0.414 1.00 24.21 H new ATOM 1041 N TRP A 653 -0.192 14.954 -4.127 1.00 60.53 N ATOM 1042 CA TRP A 653 -1.576 14.801 -4.446 1.00 53.32 C ATOM 1043 C TRP A 653 -2.217 13.772 -3.539 1.00 22.11 C ATOM 1044 O TRP A 653 -1.525 12.928 -2.954 1.00 63.12 O ATOM 1045 CB TRP A 653 -1.729 14.426 -5.929 1.00 23.02 C ATOM 1046 CG TRP A 653 -1.209 15.496 -6.871 1.00 33.41 C ATOM 1047 CD1 TRP A 653 -1.929 16.496 -7.447 1.00 61.42 C ATOM 1048 CD2 TRP A 653 0.148 15.675 -7.327 1.00 22.02 C ATOM 1049 NE1 TRP A 653 -1.117 17.272 -8.238 1.00 44.44 N ATOM 1050 CE2 TRP A 653 0.161 16.789 -8.179 1.00 71.45 C ATOM 1051 CE3 TRP A 653 1.345 14.997 -7.095 1.00 3.42 C ATOM 1052 CZ2 TRP A 653 1.326 17.239 -8.801 1.00 3.55 C ATOM 1053 CZ3 TRP A 653 2.493 15.434 -7.701 1.00 40.33 C ATOM 1054 CH2 TRP A 653 2.483 16.547 -8.551 1.00 12.00 C ATOM 0 H TRP A 653 0.347 14.089 -4.167 1.00 60.53 H new ATOM 0 HA TRP A 653 -2.092 15.747 -4.281 1.00 53.32 H new ATOM 0 HB2 TRP A 653 -1.197 13.494 -6.119 1.00 23.02 H new ATOM 0 HB3 TRP A 653 -2.782 14.241 -6.144 1.00 23.02 H new ATOM 0 HD1 TRP A 653 -2.987 16.657 -7.303 1.00 61.42 H new ATOM 0 HE1 TRP A 653 -1.419 18.080 -8.783 1.00 44.44 H new ATOM 0 HE3 TRP A 653 1.366 14.136 -6.444 1.00 3.42 H new ATOM 0 HZ2 TRP A 653 1.317 18.099 -9.454 1.00 3.55 H new ATOM 0 HZ3 TRP A 653 3.421 14.912 -7.520 1.00 40.33 H new ATOM 0 HH2 TRP A 653 3.403 16.866 -9.018 1.00 12.00 H new ATOM 1065 N ASN A 654 -3.524 13.824 -3.446 1.00 31.53 N ATOM 1066 CA ASN A 654 -4.281 12.953 -2.556 1.00 2.23 C ATOM 1067 C ASN A 654 -4.746 11.759 -3.353 1.00 20.22 C ATOM 1068 O ASN A 654 -5.456 11.919 -4.349 1.00 63.12 O ATOM 1069 CB ASN A 654 -5.512 13.710 -2.045 1.00 20.14 C ATOM 1070 CG ASN A 654 -6.270 13.010 -0.936 1.00 10.05 C ATOM 1071 OD1 ASN A 654 -6.295 11.793 -0.840 1.00 20.41 O ATOM 1072 ND2 ASN A 654 -6.905 13.784 -0.106 1.00 1.43 N ATOM 0 H ASN A 654 -4.101 14.471 -3.984 1.00 31.53 H new ATOM 0 HA ASN A 654 -3.663 12.639 -1.715 1.00 2.23 H new ATOM 0 HB2 ASN A 654 -5.197 14.690 -1.688 1.00 20.14 H new ATOM 0 HB3 ASN A 654 -6.191 13.878 -2.881 1.00 20.14 H new ATOM 0 HD21 ASN A 654 -7.447 13.378 0.657 1.00 1.43 H new ATOM 0 HD22 ASN A 654 -6.861 14.797 -0.218 1.00 1.43 H new ATOM 1078 N LEU A 655 -4.350 10.581 -2.929 1.00 33.24 N ATOM 1079 CA LEU A 655 -4.661 9.363 -3.657 1.00 34.24 C ATOM 1080 C LEU A 655 -5.706 8.558 -2.907 1.00 34.25 C ATOM 1081 O LEU A 655 -5.888 7.362 -3.151 1.00 74.21 O ATOM 1082 CB LEU A 655 -3.402 8.517 -3.808 1.00 20.52 C ATOM 1083 CG LEU A 655 -2.172 9.223 -4.354 1.00 15.04 C ATOM 1084 CD1 LEU A 655 -1.055 8.238 -4.579 1.00 63.05 C ATOM 1085 CD2 LEU A 655 -2.489 9.988 -5.613 1.00 30.13 C ATOM 0 H LEU A 655 -3.808 10.436 -2.078 1.00 33.24 H new ATOM 0 HA LEU A 655 -5.046 9.634 -4.640 1.00 34.24 H new ATOM 0 HB2 LEU A 655 -3.151 8.101 -2.832 1.00 20.52 H new ATOM 0 HB3 LEU A 655 -3.632 7.677 -4.463 1.00 20.52 H new ATOM 0 HG LEU A 655 -1.842 9.949 -3.611 1.00 15.04 H new ATOM 0 HD11 LEU A 655 -0.182 8.761 -4.970 1.00 63.05 H new ATOM 0 HD12 LEU A 655 -0.798 7.758 -3.635 1.00 63.05 H new ATOM 0 HD13 LEU A 655 -1.376 7.481 -5.295 1.00 63.05 H new ATOM 0 HD21 LEU A 655 -1.587 10.481 -5.976 1.00 30.13 H new ATOM 0 HD22 LEU A 655 -2.858 9.300 -6.374 1.00 30.13 H new ATOM 0 HD23 LEU A 655 -3.251 10.738 -5.401 1.00 30.13 H new ATOM 1093 N GLY A 656 -6.372 9.200 -2.006 1.00 12.23 N ATOM 1094 CA GLY A 656 -7.377 8.548 -1.248 1.00 73.11 C ATOM 1095 C GLY A 656 -7.368 9.030 0.162 1.00 50.31 C ATOM 1096 O GLY A 656 -6.338 8.946 0.852 1.00 4.41 O ATOM 0 H GLY A 656 -6.234 10.185 -1.778 1.00 12.23 H new ATOM 0 HA2 GLY A 656 -8.354 8.733 -1.695 1.00 73.11 H new ATOM 0 HA3 GLY A 656 -7.215 7.470 -1.270 1.00 73.11 H new ATOM 1100 N ARG A 657 -8.496 9.552 0.610 1.00 52.44 N ATOM 1101 CA ARG A 657 -8.596 10.064 1.944 1.00 74.21 C ATOM 1102 C ARG A 657 -8.561 8.889 2.922 1.00 1.33 C ATOM 1103 O ARG A 657 -8.733 7.731 2.505 1.00 42.14 O ATOM 1104 CB ARG A 657 -9.888 10.866 2.137 1.00 3.21 C ATOM 1105 CG ARG A 657 -10.220 11.842 1.018 1.00 12.44 C ATOM 1106 CD ARG A 657 -11.446 12.681 1.365 1.00 44.13 C ATOM 1107 NE ARG A 657 -12.038 13.317 0.177 1.00 32.04 N ATOM 1108 CZ ARG A 657 -12.373 14.605 0.047 1.00 74.40 C ATOM 1109 NH1 ARG A 657 -12.057 15.496 0.986 1.00 20.20 N ATOM 1110 NH2 ARG A 657 -13.022 14.993 -1.040 1.00 61.53 N ATOM 0 H ARG A 657 -9.352 9.628 0.060 1.00 52.44 H new ATOM 0 HA ARG A 657 -7.759 10.737 2.129 1.00 74.21 H new ATOM 0 HB2 ARG A 657 -10.717 10.167 2.245 1.00 3.21 H new ATOM 0 HB3 ARG A 657 -9.815 11.422 3.072 1.00 3.21 H new ATOM 0 HG2 ARG A 657 -9.367 12.496 0.837 1.00 12.44 H new ATOM 0 HG3 ARG A 657 -10.401 11.293 0.094 1.00 12.44 H new ATOM 0 HD2 ARG A 657 -12.192 12.049 1.847 1.00 44.13 H new ATOM 0 HD3 ARG A 657 -11.166 13.450 2.085 1.00 44.13 H new ATOM 0 HE ARG A 657 -12.210 12.715 -0.628 1.00 32.04 H new ATOM 0 HH11 ARG A 657 -11.551 15.200 1.821 1.00 20.20 H new ATOM 0 HH12 ARG A 657 -12.321 16.474 0.870 1.00 20.20 H new ATOM 0 HH21 ARG A 657 -13.259 14.313 -1.762 1.00 61.53 H new ATOM 0 HH22 ARG A 657 -13.285 15.972 -1.155 1.00 61.53 H new ATOM 1122 N SER A 658 -8.375 9.183 4.187 1.00 73.04 N ATOM 1123 CA SER A 658 -8.267 8.180 5.224 1.00 64.11 C ATOM 1124 C SER A 658 -9.490 7.264 5.273 1.00 64.12 C ATOM 1125 O SER A 658 -10.641 7.715 5.405 1.00 15.45 O ATOM 1126 CB SER A 658 -8.030 8.868 6.553 1.00 11.24 C ATOM 1127 OG SER A 658 -8.957 9.925 6.751 1.00 24.03 O ATOM 0 H SER A 658 -8.293 10.140 4.532 1.00 73.04 H new ATOM 0 HA SER A 658 -7.420 7.533 4.997 1.00 64.11 H new ATOM 0 HB2 SER A 658 -8.120 8.144 7.363 1.00 11.24 H new ATOM 0 HB3 SER A 658 -7.013 9.260 6.588 1.00 11.24 H new ATOM 0 HG SER A 658 -9.836 9.657 6.412 1.00 24.03 H new ATOM 1133 N ASN A 659 -9.237 5.988 5.151 1.00 52.34 N ATOM 1134 CA ASN A 659 -10.277 5.008 5.081 1.00 65.02 C ATOM 1135 C ASN A 659 -9.695 3.690 5.534 1.00 22.21 C ATOM 1136 O ASN A 659 -8.479 3.553 5.576 1.00 64.03 O ATOM 1137 CB ASN A 659 -10.723 4.898 3.631 1.00 43.34 C ATOM 1138 CG ASN A 659 -11.964 4.083 3.445 1.00 20.24 C ATOM 1139 OD1 ASN A 659 -12.835 4.050 4.296 1.00 0.32 O ATOM 1140 ND2 ASN A 659 -12.041 3.401 2.351 1.00 75.23 N ATOM 0 H ASN A 659 -8.295 5.601 5.097 1.00 52.34 H new ATOM 0 HA ASN A 659 -11.127 5.278 5.708 1.00 65.02 H new ATOM 0 HB2 ASN A 659 -10.893 5.899 3.235 1.00 43.34 H new ATOM 0 HB3 ASN A 659 -9.917 4.456 3.045 1.00 43.34 H new ATOM 0 HD21 ASN A 659 -12.852 2.808 2.176 1.00 75.23 H new ATOM 0 HD22 ASN A 659 -11.291 3.455 1.662 1.00 75.23 H new ATOM 1146 N ALA A 660 -10.515 2.737 5.887 1.00 32.53 N ATOM 1147 CA ALA A 660 -9.998 1.458 6.300 1.00 42.41 C ATOM 1148 C ALA A 660 -10.839 0.360 5.733 1.00 10.14 C ATOM 1149 O ALA A 660 -10.755 -0.778 6.158 1.00 15.14 O ATOM 1150 CB ALA A 660 -9.941 1.369 7.810 1.00 22.11 C ATOM 0 H ALA A 660 -11.532 2.818 5.898 1.00 32.53 H new ATOM 0 HA ALA A 660 -8.982 1.349 5.919 1.00 42.41 H new ATOM 0 HB1 ALA A 660 -9.548 0.395 8.103 1.00 22.11 H new ATOM 0 HB2 ALA A 660 -9.291 2.154 8.196 1.00 22.11 H new ATOM 0 HB3 ALA A 660 -10.943 1.494 8.220 1.00 22.11 H new ATOM 1156 N LYS A 661 -11.629 0.708 4.735 1.00 44.34 N ATOM 1157 CA LYS A 661 -12.503 -0.247 4.111 1.00 51.31 C ATOM 1158 C LYS A 661 -11.713 -1.270 3.331 1.00 74.14 C ATOM 1159 O LYS A 661 -11.247 -1.008 2.207 1.00 25.22 O ATOM 1160 CB LYS A 661 -13.536 0.437 3.210 1.00 23.00 C ATOM 1161 CG LYS A 661 -14.450 1.406 3.926 1.00 63.43 C ATOM 1162 CD LYS A 661 -15.188 0.707 5.031 1.00 53.13 C ATOM 1163 CE LYS A 661 -16.261 1.574 5.624 1.00 35.22 C ATOM 1164 NZ LYS A 661 -15.717 2.684 6.418 1.00 32.33 N ATOM 0 H LYS A 661 -11.678 1.649 4.344 1.00 44.34 H new ATOM 0 HA LYS A 661 -13.045 -0.760 4.905 1.00 51.31 H new ATOM 0 HB2 LYS A 661 -13.011 0.970 2.417 1.00 23.00 H new ATOM 0 HB3 LYS A 661 -14.145 -0.329 2.730 1.00 23.00 H new ATOM 0 HG2 LYS A 661 -13.867 2.232 4.334 1.00 63.43 H new ATOM 0 HG3 LYS A 661 -15.161 1.836 3.220 1.00 63.43 H new ATOM 0 HD2 LYS A 661 -15.634 -0.210 4.646 1.00 53.13 H new ATOM 0 HD3 LYS A 661 -14.484 0.416 5.811 1.00 53.13 H new ATOM 0 HE2 LYS A 661 -16.882 1.975 4.823 1.00 35.22 H new ATOM 0 HE3 LYS A 661 -16.908 0.964 6.255 1.00 35.22 H new ATOM 0 HZ1 LYS A 661 -15.958 2.545 7.420 1.00 32.33 H new ATOM 0 HZ2 LYS A 661 -14.683 2.713 6.311 1.00 32.33 H new ATOM 0 HZ3 LYS A 661 -16.125 3.581 6.086 1.00 32.33 H new ATOM 1178 N LEU A 662 -11.516 -2.405 3.940 1.00 45.42 N ATOM 1179 CA LEU A 662 -10.834 -3.474 3.299 1.00 21.44 C ATOM 1180 C LEU A 662 -11.813 -4.236 2.474 1.00 43.50 C ATOM 1181 O LEU A 662 -12.909 -4.553 2.932 1.00 40.44 O ATOM 1182 CB LEU A 662 -10.146 -4.409 4.294 1.00 21.33 C ATOM 1183 CG LEU A 662 -9.061 -3.819 5.182 1.00 54.43 C ATOM 1184 CD1 LEU A 662 -8.380 -4.920 5.944 1.00 22.12 C ATOM 1185 CD2 LEU A 662 -8.059 -3.038 4.375 1.00 62.53 C ATOM 0 H LEU A 662 -11.825 -2.607 4.891 1.00 45.42 H new ATOM 0 HA LEU A 662 -10.049 -3.051 2.673 1.00 21.44 H new ATOM 0 HB2 LEU A 662 -10.914 -4.835 4.940 1.00 21.33 H new ATOM 0 HB3 LEU A 662 -9.708 -5.234 3.732 1.00 21.33 H new ATOM 0 HG LEU A 662 -9.527 -3.128 5.885 1.00 54.43 H new ATOM 0 HD11 LEU A 662 -7.603 -4.496 6.580 1.00 22.12 H new ATOM 0 HD12 LEU A 662 -9.111 -5.440 6.563 1.00 22.12 H new ATOM 0 HD13 LEU A 662 -7.931 -5.624 5.243 1.00 22.12 H new ATOM 0 HD21 LEU A 662 -7.297 -2.629 5.038 1.00 62.53 H new ATOM 0 HD22 LEU A 662 -7.589 -3.696 3.644 1.00 62.53 H new ATOM 0 HD23 LEU A 662 -8.565 -2.223 3.858 1.00 62.53 H new ATOM 1193 N SER A 663 -11.440 -4.523 1.287 1.00 25.53 N ATOM 1194 CA SER A 663 -12.284 -5.188 0.367 1.00 33.01 C ATOM 1195 C SER A 663 -11.637 -6.488 -0.044 1.00 44.22 C ATOM 1196 O SER A 663 -10.504 -6.512 -0.465 1.00 21.13 O ATOM 1197 CB SER A 663 -12.481 -4.290 -0.844 1.00 52.45 C ATOM 1198 OG SER A 663 -13.000 -3.026 -0.446 1.00 71.33 O ATOM 0 H SER A 663 -10.517 -4.298 0.916 1.00 25.53 H new ATOM 0 HA SER A 663 -13.252 -5.403 0.819 1.00 33.01 H new ATOM 0 HB2 SER A 663 -11.532 -4.154 -1.362 1.00 52.45 H new ATOM 0 HB3 SER A 663 -13.163 -4.765 -1.549 1.00 52.45 H new ATOM 0 HG SER A 663 -13.695 -2.745 -1.077 1.00 71.33 H new ATOM 1204 N TYR A 664 -12.327 -7.550 0.063 1.00 11.40 N ATOM 1205 CA TYR A 664 -11.744 -8.788 -0.324 1.00 53.31 C ATOM 1206 C TYR A 664 -12.485 -9.239 -1.533 1.00 3.12 C ATOM 1207 O TYR A 664 -13.698 -9.392 -1.498 1.00 73.54 O ATOM 1208 CB TYR A 664 -11.917 -9.829 0.797 1.00 2.51 C ATOM 1209 CG TYR A 664 -11.088 -11.115 0.698 1.00 43.15 C ATOM 1210 CD1 TYR A 664 -10.752 -11.692 -0.517 1.00 62.15 C ATOM 1211 CD2 TYR A 664 -10.662 -11.750 1.849 1.00 23.51 C ATOM 1212 CE1 TYR A 664 -10.016 -12.860 -0.581 1.00 4.11 C ATOM 1213 CE2 TYR A 664 -9.935 -12.915 1.794 1.00 31.44 C ATOM 1214 CZ TYR A 664 -9.614 -13.468 0.579 1.00 73.04 C ATOM 1215 OH TYR A 664 -8.883 -14.638 0.528 1.00 61.44 O ATOM 0 H TYR A 664 -13.285 -7.600 0.409 1.00 11.40 H new ATOM 0 HA TYR A 664 -10.678 -8.674 -0.520 1.00 53.31 H new ATOM 0 HB2 TYR A 664 -11.679 -9.346 1.745 1.00 2.51 H new ATOM 0 HB3 TYR A 664 -12.970 -10.109 0.838 1.00 2.51 H new ATOM 0 HD1 TYR A 664 -11.072 -11.219 -1.433 1.00 62.15 H new ATOM 0 HD2 TYR A 664 -10.905 -11.322 2.811 1.00 23.51 H new ATOM 0 HE1 TYR A 664 -9.760 -13.290 -1.538 1.00 4.11 H new ATOM 0 HE2 TYR A 664 -9.616 -13.396 2.707 1.00 31.44 H new ATOM 0 HH TYR A 664 -8.479 -14.810 1.404 1.00 61.44 H new ATOM 1225 N TYR A 665 -11.768 -9.386 -2.594 1.00 63.24 N ATOM 1226 CA TYR A 665 -12.290 -9.928 -3.794 1.00 35.13 C ATOM 1227 C TYR A 665 -11.725 -11.274 -3.912 1.00 32.22 C ATOM 1228 O TYR A 665 -10.557 -11.455 -3.567 1.00 62.31 O ATOM 1229 CB TYR A 665 -11.883 -9.111 -5.007 1.00 30.44 C ATOM 1230 CG TYR A 665 -12.522 -7.770 -5.065 1.00 22.33 C ATOM 1231 CD1 TYR A 665 -13.863 -7.665 -5.350 1.00 2.52 C ATOM 1232 CD2 TYR A 665 -11.798 -6.612 -4.854 1.00 71.33 C ATOM 1233 CE1 TYR A 665 -14.474 -6.455 -5.427 1.00 5.50 C ATOM 1234 CE2 TYR A 665 -12.402 -5.382 -4.926 1.00 31.14 C ATOM 1235 CZ TYR A 665 -13.744 -5.308 -5.214 1.00 52.23 C ATOM 1236 OH TYR A 665 -14.353 -4.085 -5.299 1.00 1.13 O ATOM 0 H TYR A 665 -10.783 -9.127 -2.649 1.00 63.24 H new ATOM 0 HA TYR A 665 -13.379 -9.930 -3.759 1.00 35.13 H new ATOM 0 HB2 TYR A 665 -10.800 -8.988 -5.005 1.00 30.44 H new ATOM 0 HB3 TYR A 665 -12.139 -9.665 -5.910 1.00 30.44 H new ATOM 0 HD1 TYR A 665 -14.441 -8.562 -5.516 1.00 2.52 H new ATOM 0 HD2 TYR A 665 -10.744 -6.676 -4.630 1.00 71.33 H new ATOM 0 HE1 TYR A 665 -15.528 -6.393 -5.654 1.00 5.50 H new ATOM 0 HE2 TYR A 665 -11.829 -4.482 -4.758 1.00 31.14 H new ATOM 0 HH TYR A 665 -13.697 -3.380 -5.120 1.00 1.13 H new ATOM 1246 N ASP A 666 -12.519 -12.219 -4.360 1.00 74.43 N ATOM 1247 CA ASP A 666 -12.074 -13.602 -4.519 1.00 0.44 C ATOM 1248 C ASP A 666 -10.683 -13.669 -5.133 1.00 74.12 C ATOM 1249 O ASP A 666 -10.426 -13.120 -6.207 1.00 62.43 O ATOM 1250 CB ASP A 666 -13.085 -14.413 -5.341 1.00 13.32 C ATOM 1251 CG ASP A 666 -13.406 -13.790 -6.673 1.00 63.03 C ATOM 1252 OD1 ASP A 666 -14.337 -12.969 -6.739 1.00 51.11 O ATOM 1253 OD2 ASP A 666 -12.740 -14.103 -7.683 1.00 31.10 O ATOM 0 H ASP A 666 -13.491 -12.061 -4.626 1.00 74.43 H new ATOM 0 HA ASP A 666 -12.015 -14.049 -3.527 1.00 0.44 H new ATOM 0 HB2 ASP A 666 -12.690 -15.416 -5.503 1.00 13.32 H new ATOM 0 HB3 ASP A 666 -14.005 -14.522 -4.767 1.00 13.32 H new ATOM 1258 N GLY A 667 -9.781 -14.272 -4.404 1.00 23.04 N ATOM 1259 CA GLY A 667 -8.427 -14.362 -4.839 1.00 24.11 C ATOM 1260 C GLY A 667 -7.467 -13.568 -3.962 1.00 73.52 C ATOM 1261 O GLY A 667 -6.547 -14.140 -3.382 1.00 60.50 O ATOM 0 H GLY A 667 -9.969 -14.708 -3.501 1.00 23.04 H new ATOM 0 HA2 GLY A 667 -8.122 -15.409 -4.847 1.00 24.11 H new ATOM 0 HA3 GLY A 667 -8.356 -14.001 -5.865 1.00 24.11 H new ATOM 1265 N MET A 668 -7.686 -12.253 -3.832 1.00 61.43 N ATOM 1266 CA MET A 668 -6.730 -11.404 -3.106 1.00 2.41 C ATOM 1267 C MET A 668 -7.440 -10.367 -2.254 1.00 21.24 C ATOM 1268 O MET A 668 -8.474 -9.801 -2.659 1.00 31.15 O ATOM 1269 CB MET A 668 -5.782 -10.618 -4.060 1.00 50.20 C ATOM 1270 CG MET A 668 -5.045 -11.420 -5.134 1.00 41.04 C ATOM 1271 SD MET A 668 -6.118 -11.958 -6.497 1.00 0.14 S ATOM 1272 CE MET A 668 -4.944 -12.849 -7.506 1.00 22.53 C ATOM 0 H MET A 668 -8.496 -11.762 -4.210 1.00 61.43 H new ATOM 0 HA MET A 668 -6.154 -12.094 -2.489 1.00 2.41 H new ATOM 0 HB2 MET A 668 -6.369 -9.847 -4.558 1.00 50.20 H new ATOM 0 HB3 MET A 668 -5.037 -10.107 -3.450 1.00 50.20 H new ATOM 0 HG2 MET A 668 -4.234 -10.813 -5.538 1.00 41.04 H new ATOM 0 HG3 MET A 668 -4.589 -12.296 -4.673 1.00 41.04 H new ATOM 0 HE1 MET A 668 -5.448 -13.244 -8.388 1.00 22.53 H new ATOM 0 HE2 MET A 668 -4.146 -12.175 -7.816 1.00 22.53 H new ATOM 0 HE3 MET A 668 -4.521 -13.672 -6.930 1.00 22.53 H new ATOM 1282 N ILE A 669 -6.873 -10.093 -1.093 1.00 53.20 N ATOM 1283 CA ILE A 669 -7.364 -9.034 -0.229 1.00 20.53 C ATOM 1284 C ILE A 669 -6.965 -7.718 -0.878 1.00 22.33 C ATOM 1285 O ILE A 669 -5.877 -7.612 -1.430 1.00 63.31 O ATOM 1286 CB ILE A 669 -6.779 -9.084 1.250 1.00 2.50 C ATOM 1287 CG1 ILE A 669 -7.144 -10.386 2.004 1.00 10.10 C ATOM 1288 CG2 ILE A 669 -7.230 -7.875 2.069 1.00 20.44 C ATOM 1289 CD1 ILE A 669 -6.449 -11.634 1.511 1.00 63.43 C ATOM 0 H ILE A 669 -6.065 -10.594 -0.724 1.00 53.20 H new ATOM 0 HA ILE A 669 -8.443 -9.151 -0.126 1.00 20.53 H new ATOM 0 HB ILE A 669 -5.695 -9.062 1.137 1.00 2.50 H new ATOM 0 HG12 ILE A 669 -6.910 -10.253 3.060 1.00 10.10 H new ATOM 0 HG13 ILE A 669 -8.221 -10.538 1.933 1.00 10.10 H new ATOM 0 HG21 ILE A 669 -6.813 -7.940 3.074 1.00 20.44 H new ATOM 0 HG22 ILE A 669 -6.881 -6.960 1.590 1.00 20.44 H new ATOM 0 HG23 ILE A 669 -8.318 -7.861 2.128 1.00 20.44 H new ATOM 0 HD11 ILE A 669 -6.773 -12.489 2.104 1.00 63.43 H new ATOM 0 HD12 ILE A 669 -6.702 -11.802 0.464 1.00 63.43 H new ATOM 0 HD13 ILE A 669 -5.370 -11.512 1.609 1.00 63.43 H new ATOM 1296 N GLN A 670 -7.838 -6.765 -0.869 1.00 50.34 N ATOM 1297 CA GLN A 670 -7.589 -5.483 -1.468 1.00 24.34 C ATOM 1298 C GLN A 670 -8.036 -4.352 -0.542 1.00 54.14 C ATOM 1299 O GLN A 670 -8.873 -4.546 0.333 1.00 43.13 O ATOM 1300 CB GLN A 670 -8.239 -5.435 -2.867 1.00 70.13 C ATOM 1301 CG GLN A 670 -7.451 -6.266 -3.895 1.00 51.21 C ATOM 1302 CD GLN A 670 -8.207 -6.624 -5.144 1.00 23.33 C ATOM 1303 OE1 GLN A 670 -8.212 -5.883 -6.118 1.00 0.04 O ATOM 1304 NE2 GLN A 670 -8.793 -7.792 -5.149 1.00 62.02 N ATOM 0 H GLN A 670 -8.760 -6.850 -0.441 1.00 50.34 H new ATOM 0 HA GLN A 670 -6.518 -5.337 -1.608 1.00 24.34 H new ATOM 0 HB2 GLN A 670 -9.261 -5.808 -2.805 1.00 70.13 H new ATOM 0 HB3 GLN A 670 -8.297 -4.400 -3.205 1.00 70.13 H new ATOM 0 HG2 GLN A 670 -6.556 -5.711 -4.178 1.00 51.21 H new ATOM 0 HG3 GLN A 670 -7.117 -7.186 -3.415 1.00 51.21 H new ATOM 0 HE21 GLN A 670 -8.766 -8.380 -4.316 1.00 62.02 H new ATOM 0 HE22 GLN A 670 -9.278 -8.116 -5.986 1.00 62.02 H new ATOM 1312 N LEU A 671 -7.456 -3.204 -0.694 1.00 21.24 N ATOM 1313 CA LEU A 671 -7.793 -2.087 0.160 1.00 21.31 C ATOM 1314 C LEU A 671 -8.322 -0.988 -0.736 1.00 12.13 C ATOM 1315 O LEU A 671 -7.639 -0.583 -1.676 1.00 52.42 O ATOM 1316 CB LEU A 671 -6.520 -1.609 0.906 1.00 21.22 C ATOM 1317 CG LEU A 671 -6.691 -0.838 2.238 1.00 1.12 C ATOM 1318 CD1 LEU A 671 -5.355 -0.396 2.786 1.00 32.42 C ATOM 1319 CD2 LEU A 671 -7.661 0.325 2.151 1.00 34.30 C ATOM 0 H LEU A 671 -6.746 -3.006 -1.399 1.00 21.24 H new ATOM 0 HA LEU A 671 -8.540 -2.365 0.904 1.00 21.31 H new ATOM 0 HB2 LEU A 671 -5.904 -2.486 1.107 1.00 21.22 H new ATOM 0 HB3 LEU A 671 -5.955 -0.973 0.225 1.00 21.22 H new ATOM 0 HG LEU A 671 -7.139 -1.545 2.936 1.00 1.12 H new ATOM 0 HD11 LEU A 671 -5.506 0.143 3.721 1.00 32.42 H new ATOM 0 HD12 LEU A 671 -4.729 -1.270 2.967 1.00 32.42 H new ATOM 0 HD13 LEU A 671 -4.865 0.258 2.065 1.00 32.42 H new ATOM 0 HD21 LEU A 671 -7.728 0.816 3.122 1.00 34.30 H new ATOM 0 HD22 LEU A 671 -7.307 1.039 1.407 1.00 34.30 H new ATOM 0 HD23 LEU A 671 -8.645 -0.043 1.862 1.00 34.30 H new ATOM 1327 N THR A 672 -9.513 -0.517 -0.455 1.00 11.52 N ATOM 1328 CA THR A 672 -10.141 0.490 -1.269 1.00 22.43 C ATOM 1329 C THR A 672 -10.108 1.850 -0.548 1.00 64.15 C ATOM 1330 O THR A 672 -10.614 1.982 0.559 1.00 34.42 O ATOM 1331 CB THR A 672 -11.616 0.089 -1.543 1.00 51.14 C ATOM 1332 OG1 THR A 672 -11.655 -1.241 -2.097 1.00 51.41 O ATOM 1333 CG2 THR A 672 -12.278 1.057 -2.521 1.00 15.20 C ATOM 0 H THR A 672 -10.071 -0.821 0.343 1.00 11.52 H new ATOM 0 HA THR A 672 -9.600 0.572 -2.212 1.00 22.43 H new ATOM 0 HB THR A 672 -12.160 0.123 -0.599 1.00 51.14 H new ATOM 0 HG1 THR A 672 -12.093 -1.847 -1.463 1.00 51.41 H new ATOM 0 HG21 THR A 672 -13.310 0.751 -2.694 1.00 15.20 H new ATOM 0 HG22 THR A 672 -12.263 2.064 -2.103 1.00 15.20 H new ATOM 0 HG23 THR A 672 -11.734 1.049 -3.466 1.00 15.20 H new ATOM 1339 N TYR A 673 -9.483 2.838 -1.148 1.00 22.23 N ATOM 1340 CA TYR A 673 -9.481 4.171 -0.571 1.00 44.25 C ATOM 1341 C TYR A 673 -10.530 5.101 -1.153 1.00 15.05 C ATOM 1342 O TYR A 673 -11.235 4.757 -2.100 1.00 51.42 O ATOM 1343 CB TYR A 673 -8.102 4.811 -0.531 1.00 14.21 C ATOM 1344 CG TYR A 673 -7.271 4.343 0.631 1.00 52.40 C ATOM 1345 CD1 TYR A 673 -7.565 4.802 1.898 1.00 30.13 C ATOM 1346 CD2 TYR A 673 -6.217 3.450 0.483 1.00 21.30 C ATOM 1347 CE1 TYR A 673 -6.860 4.396 2.989 1.00 62.53 C ATOM 1348 CE2 TYR A 673 -5.488 3.037 1.588 1.00 74.40 C ATOM 1349 CZ TYR A 673 -5.827 3.520 2.843 1.00 52.43 C ATOM 1350 OH TYR A 673 -5.148 3.113 3.955 1.00 61.20 O ATOM 0 H TYR A 673 -8.973 2.750 -2.027 1.00 22.23 H new ATOM 0 HA TYR A 673 -9.776 4.012 0.466 1.00 44.25 H new ATOM 0 HB2 TYR A 673 -7.577 4.588 -1.460 1.00 14.21 H new ATOM 0 HB3 TYR A 673 -8.212 5.894 -0.479 1.00 14.21 H new ATOM 0 HD1 TYR A 673 -8.377 5.503 2.028 1.00 30.13 H new ATOM 0 HD2 TYR A 673 -5.964 3.075 -0.498 1.00 21.30 H new ATOM 0 HE1 TYR A 673 -7.119 4.768 3.969 1.00 62.53 H new ATOM 0 HE2 TYR A 673 -4.665 2.347 1.473 1.00 74.40 H new ATOM 0 HH TYR A 673 -4.185 3.121 3.772 1.00 61.20 H new ATOM 1360 N ARG A 674 -10.624 6.280 -0.555 1.00 23.25 N ATOM 1361 CA ARG A 674 -11.628 7.279 -0.905 1.00 72.13 C ATOM 1362 C ARG A 674 -11.281 8.043 -2.171 1.00 20.32 C ATOM 1363 O ARG A 674 -10.237 7.844 -2.757 1.00 0.23 O ATOM 1364 CB ARG A 674 -11.831 8.267 0.245 1.00 61.32 C ATOM 1365 CG ARG A 674 -12.312 7.635 1.542 1.00 2.30 C ATOM 1366 CD ARG A 674 -13.658 6.952 1.368 1.00 4.31 C ATOM 1367 NE ARG A 674 -14.668 7.893 0.909 1.00 23.33 N ATOM 1368 CZ ARG A 674 -15.808 7.569 0.301 1.00 1.02 C ATOM 1369 NH1 ARG A 674 -16.157 6.302 0.128 1.00 34.33 N ATOM 1370 NH2 ARG A 674 -16.620 8.516 -0.107 1.00 42.55 N ATOM 0 H ARG A 674 -9.999 6.575 0.195 1.00 23.25 H new ATOM 0 HA ARG A 674 -12.552 6.732 -1.091 1.00 72.13 H new ATOM 0 HB2 ARG A 674 -10.890 8.783 0.434 1.00 61.32 H new ATOM 0 HB3 ARG A 674 -12.552 9.023 -0.065 1.00 61.32 H new ATOM 0 HG2 ARG A 674 -11.577 6.908 1.887 1.00 2.30 H new ATOM 0 HG3 ARG A 674 -12.389 8.401 2.313 1.00 2.30 H new ATOM 0 HD2 ARG A 674 -13.565 6.136 0.652 1.00 4.31 H new ATOM 0 HD3 ARG A 674 -13.971 6.511 2.315 1.00 4.31 H new ATOM 0 HE ARG A 674 -14.488 8.885 1.066 1.00 23.33 H new ATOM 0 HH11 ARG A 674 -15.548 5.555 0.463 1.00 34.33 H new ATOM 0 HH12 ARG A 674 -17.034 6.074 -0.340 1.00 34.33 H new ATOM 0 HH21 ARG A 674 -16.377 9.495 0.042 1.00 42.55 H new ATOM 0 HH22 ARG A 674 -17.494 8.273 -0.573 1.00 42.55 H new ATOM 1382 N ASP A 675 -12.192 8.930 -2.536 1.00 60.35 N ATOM 1383 CA ASP A 675 -12.135 9.794 -3.728 1.00 42.41 C ATOM 1384 C ASP A 675 -10.847 10.640 -3.777 1.00 71.51 C ATOM 1385 O ASP A 675 -10.291 10.882 -4.841 1.00 34.42 O ATOM 1386 CB ASP A 675 -13.371 10.728 -3.713 1.00 45.52 C ATOM 1387 CG ASP A 675 -13.381 11.716 -2.539 1.00 35.35 C ATOM 1388 OD1 ASP A 675 -13.078 11.307 -1.390 1.00 41.10 O ATOM 1389 OD2 ASP A 675 -13.706 12.904 -2.744 1.00 31.31 O ATOM 0 H ASP A 675 -13.039 9.083 -1.988 1.00 60.35 H new ATOM 0 HA ASP A 675 -12.134 9.158 -4.613 1.00 42.41 H new ATOM 0 HB2 ASP A 675 -13.404 11.287 -4.648 1.00 45.52 H new ATOM 0 HB3 ASP A 675 -14.275 10.120 -3.673 1.00 45.52 H new ATOM 1394 N GLY A 676 -10.427 11.108 -2.628 1.00 74.00 N ATOM 1395 CA GLY A 676 -9.198 11.872 -2.514 1.00 42.10 C ATOM 1396 C GLY A 676 -9.245 13.165 -3.302 1.00 53.44 C ATOM 1397 O GLY A 676 -10.157 13.971 -3.133 1.00 32.33 O ATOM 0 H GLY A 676 -10.921 10.974 -1.746 1.00 74.00 H new ATOM 0 HA2 GLY A 676 -9.009 12.096 -1.464 1.00 42.10 H new ATOM 0 HA3 GLY A 676 -8.363 11.266 -2.865 1.00 42.10 H new ATOM 1401 N THR A 677 -8.282 13.358 -4.156 1.00 15.50 N ATOM 1402 CA THR A 677 -8.223 14.516 -5.000 1.00 62.35 C ATOM 1403 C THR A 677 -8.077 14.058 -6.457 1.00 41.11 C ATOM 1404 O THR A 677 -7.112 13.388 -6.785 1.00 44.34 O ATOM 1405 CB THR A 677 -7.041 15.429 -4.598 1.00 1.14 C ATOM 1406 OG1 THR A 677 -7.244 15.922 -3.253 1.00 72.21 O ATOM 1407 CG2 THR A 677 -6.884 16.598 -5.561 1.00 71.24 C ATOM 0 H THR A 677 -7.507 12.708 -4.287 1.00 15.50 H new ATOM 0 HA THR A 677 -9.140 15.094 -4.887 1.00 62.35 H new ATOM 0 HB THR A 677 -6.126 14.838 -4.641 1.00 1.14 H new ATOM 0 HG1 THR A 677 -6.493 16.499 -2.999 1.00 72.21 H new ATOM 0 HG21 THR A 677 -6.044 17.218 -5.247 1.00 71.24 H new ATOM 0 HG22 THR A 677 -6.700 16.219 -6.566 1.00 71.24 H new ATOM 0 HG23 THR A 677 -7.796 17.195 -5.560 1.00 71.24 H new ATOM 1413 N PRO A 678 -9.027 14.415 -7.344 1.00 51.11 N ATOM 1414 CA PRO A 678 -9.038 13.958 -8.730 1.00 73.12 C ATOM 1415 C PRO A 678 -7.836 14.407 -9.551 1.00 3.25 C ATOM 1416 O PRO A 678 -7.179 15.382 -9.228 1.00 23.23 O ATOM 1417 CB PRO A 678 -10.336 14.508 -9.300 1.00 73.25 C ATOM 1418 CG PRO A 678 -10.632 15.683 -8.483 1.00 1.11 C ATOM 1419 CD PRO A 678 -10.164 15.329 -7.084 1.00 63.53 C ATOM 0 HA PRO A 678 -8.974 12.871 -8.770 1.00 73.12 H new ATOM 0 HB2 PRO A 678 -10.225 14.774 -10.351 1.00 73.25 H new ATOM 0 HB3 PRO A 678 -11.138 13.772 -9.240 1.00 73.25 H new ATOM 0 HG2 PRO A 678 -10.113 16.564 -8.860 1.00 1.11 H new ATOM 0 HG3 PRO A 678 -11.698 15.911 -8.495 1.00 1.11 H new ATOM 0 HD2 PRO A 678 -9.854 16.212 -6.525 1.00 63.53 H new ATOM 0 HD3 PRO A 678 -10.950 14.844 -6.505 1.00 63.53 H new ATOM 1427 N TYR A 679 -7.544 13.637 -10.598 1.00 62.51 N ATOM 1428 CA TYR A 679 -6.404 13.876 -11.528 1.00 54.54 C ATOM 1429 C TYR A 679 -6.523 15.192 -12.247 1.00 72.21 C ATOM 1430 O TYR A 679 -5.557 15.671 -12.824 1.00 34.05 O ATOM 1431 CB TYR A 679 -6.361 12.801 -12.591 1.00 5.44 C ATOM 1432 CG TYR A 679 -6.300 11.436 -12.040 1.00 20.25 C ATOM 1433 CD1 TYR A 679 -5.114 10.899 -11.650 1.00 23.12 C ATOM 1434 CD2 TYR A 679 -7.439 10.696 -11.909 1.00 0.11 C ATOM 1435 CE1 TYR A 679 -5.053 9.621 -11.128 1.00 72.31 C ATOM 1436 CE2 TYR A 679 -7.420 9.430 -11.399 1.00 5.34 C ATOM 1437 CZ TYR A 679 -6.217 8.889 -11.002 1.00 1.21 C ATOM 1438 OH TYR A 679 -6.172 7.629 -10.469 1.00 12.35 O ATOM 0 H TYR A 679 -8.092 12.812 -10.841 1.00 62.51 H new ATOM 0 HA TYR A 679 -5.504 13.872 -10.913 1.00 54.54 H new ATOM 0 HB2 TYR A 679 -7.244 12.890 -13.224 1.00 5.44 H new ATOM 0 HB3 TYR A 679 -5.493 12.966 -13.230 1.00 5.44 H new ATOM 0 HD1 TYR A 679 -4.208 11.478 -11.749 1.00 23.12 H new ATOM 0 HD2 TYR A 679 -8.382 11.124 -12.217 1.00 0.11 H new ATOM 0 HE1 TYR A 679 -4.107 9.200 -10.822 1.00 72.31 H new ATOM 0 HE2 TYR A 679 -8.334 8.861 -11.308 1.00 5.34 H new ATOM 0 HH TYR A 679 -7.057 7.387 -10.125 1.00 12.35 H new ATOM 1448 N ASN A 680 -7.713 15.760 -12.204 1.00 44.14 N ATOM 1449 CA ASN A 680 -8.038 16.998 -12.892 1.00 60.23 C ATOM 1450 C ASN A 680 -8.198 16.763 -14.343 1.00 24.24 C ATOM 1451 O ASN A 680 -7.334 17.068 -15.161 1.00 55.15 O ATOM 1452 CB ASN A 680 -7.074 18.150 -12.590 1.00 41.43 C ATOM 1453 CG ASN A 680 -7.120 18.540 -11.155 1.00 33.54 C ATOM 1454 OD1 ASN A 680 -7.855 19.458 -10.766 1.00 22.20 O ATOM 1455 ND2 ASN A 680 -6.408 17.814 -10.347 1.00 2.24 N ATOM 0 H ASN A 680 -8.496 15.368 -11.681 1.00 44.14 H new ATOM 0 HA ASN A 680 -8.996 17.331 -12.492 1.00 60.23 H new ATOM 0 HB2 ASN A 680 -6.059 17.855 -12.855 1.00 41.43 H new ATOM 0 HB3 ASN A 680 -7.328 19.010 -13.210 1.00 41.43 H new ATOM 0 HD21 ASN A 680 -6.439 17.989 -9.343 1.00 2.24 H new ATOM 0 HD22 ASN A 680 -5.818 17.069 -10.717 1.00 2.24 H new ATOM 1461 N ASN A 681 -9.266 16.111 -14.638 1.00 44.34 N ATOM 1462 CA ASN A 681 -9.669 15.853 -15.993 1.00 44.42 C ATOM 1463 C ASN A 681 -10.944 16.582 -16.175 1.00 4.32 C ATOM 1464 O ASN A 681 -11.481 17.133 -15.203 1.00 43.25 O ATOM 1465 CB ASN A 681 -10.004 14.370 -16.237 1.00 11.00 C ATOM 1466 CG ASN A 681 -8.957 13.376 -15.839 1.00 74.11 C ATOM 1467 OD1 ASN A 681 -7.764 13.650 -15.832 1.00 4.13 O ATOM 1468 ND2 ASN A 681 -9.410 12.195 -15.511 1.00 14.21 N ATOM 0 H ASN A 681 -9.903 15.731 -13.938 1.00 44.34 H new ATOM 0 HA ASN A 681 -8.861 16.147 -16.662 1.00 44.42 H new ATOM 0 HB2 ASN A 681 -10.921 14.134 -15.698 1.00 11.00 H new ATOM 0 HB3 ASN A 681 -10.215 14.238 -17.298 1.00 11.00 H new ATOM 0 HD21 ASN A 681 -8.761 11.458 -15.235 1.00 14.21 H new ATOM 0 HD22 ASN A 681 -10.413 12.010 -15.531 1.00 14.21 H new ATOM 1474 N GLU A 682 -11.469 16.535 -17.354 1.00 54.24 N ATOM 1475 CA GLU A 682 -12.755 17.104 -17.639 1.00 24.41 C ATOM 1476 C GLU A 682 -13.826 16.274 -16.915 1.00 12.51 C ATOM 1477 O GLU A 682 -14.882 16.775 -16.551 1.00 42.12 O ATOM 1478 CB GLU A 682 -12.982 17.080 -19.147 1.00 10.35 C ATOM 1479 CG GLU A 682 -14.297 17.652 -19.612 1.00 21.21 C ATOM 1480 CD GLU A 682 -14.459 17.517 -21.095 1.00 62.23 C ATOM 1481 OE1 GLU A 682 -14.971 16.473 -21.553 1.00 45.44 O ATOM 1482 OE2 GLU A 682 -14.063 18.447 -21.832 1.00 71.40 O ATOM 0 H GLU A 682 -11.018 16.098 -18.158 1.00 54.24 H new ATOM 0 HA GLU A 682 -12.809 18.136 -17.293 1.00 24.41 H new ATOM 0 HB2 GLU A 682 -12.175 17.632 -19.628 1.00 10.35 H new ATOM 0 HB3 GLU A 682 -12.912 16.048 -19.492 1.00 10.35 H new ATOM 0 HG2 GLU A 682 -15.117 17.141 -19.107 1.00 21.21 H new ATOM 0 HG3 GLU A 682 -14.357 18.704 -19.332 1.00 21.21 H new ATOM 1489 N LYS A 683 -13.513 15.000 -16.675 1.00 44.22 N ATOM 1490 CA LYS A 683 -14.434 14.107 -16.012 1.00 14.22 C ATOM 1491 C LYS A 683 -14.253 14.179 -14.478 1.00 61.13 C ATOM 1492 O LYS A 683 -14.997 13.555 -13.721 1.00 13.50 O ATOM 1493 CB LYS A 683 -14.216 12.691 -16.545 1.00 72.10 C ATOM 1494 CG LYS A 683 -15.229 11.663 -16.085 1.00 5.24 C ATOM 1495 CD LYS A 683 -14.974 10.353 -16.773 1.00 40.24 C ATOM 1496 CE LYS A 683 -15.964 9.284 -16.361 1.00 31.25 C ATOM 1497 NZ LYS A 683 -15.721 8.017 -17.077 1.00 23.13 N ATOM 0 H LYS A 683 -12.624 14.573 -16.935 1.00 44.22 H new ATOM 0 HA LYS A 683 -15.461 14.406 -16.223 1.00 14.22 H new ATOM 0 HB2 LYS A 683 -14.226 12.725 -17.634 1.00 72.10 H new ATOM 0 HB3 LYS A 683 -13.222 12.357 -16.246 1.00 72.10 H new ATOM 0 HG2 LYS A 683 -15.165 11.535 -15.004 1.00 5.24 H new ATOM 0 HG3 LYS A 683 -16.238 12.010 -16.306 1.00 5.24 H new ATOM 0 HD2 LYS A 683 -15.026 10.496 -17.852 1.00 40.24 H new ATOM 0 HD3 LYS A 683 -13.963 10.016 -16.544 1.00 40.24 H new ATOM 0 HE2 LYS A 683 -15.893 9.115 -15.286 1.00 31.25 H new ATOM 0 HE3 LYS A 683 -16.978 9.629 -16.563 1.00 31.25 H new ATOM 0 HZ1 LYS A 683 -16.416 7.307 -16.771 1.00 23.13 H new ATOM 0 HZ2 LYS A 683 -15.813 8.174 -18.101 1.00 23.13 H new ATOM 0 HZ3 LYS A 683 -14.762 7.676 -16.864 1.00 23.13 H new ATOM 1511 N ARG A 684 -13.252 14.978 -14.035 1.00 51.41 N ATOM 1512 CA ARG A 684 -12.948 15.194 -12.590 1.00 50.52 C ATOM 1513 C ARG A 684 -12.783 13.854 -11.837 1.00 13.51 C ATOM 1514 O ARG A 684 -13.242 13.712 -10.710 1.00 15.41 O ATOM 1515 CB ARG A 684 -14.063 16.039 -11.930 1.00 34.21 C ATOM 1516 CG ARG A 684 -14.290 17.421 -12.554 1.00 4.13 C ATOM 1517 CD ARG A 684 -13.032 18.283 -12.533 1.00 32.12 C ATOM 1518 NE ARG A 684 -12.507 18.489 -11.174 1.00 55.50 N ATOM 1519 CZ ARG A 684 -11.313 19.032 -10.890 1.00 42.10 C ATOM 1520 NH1 ARG A 684 -10.531 19.497 -11.871 1.00 45.41 N ATOM 1521 NH2 ARG A 684 -10.919 19.137 -9.619 1.00 51.40 N ATOM 0 H ARG A 684 -12.632 15.491 -14.662 1.00 51.41 H new ATOM 0 HA ARG A 684 -12.002 15.732 -12.527 1.00 50.52 H new ATOM 0 HB2 ARG A 684 -14.997 15.479 -11.977 1.00 34.21 H new ATOM 0 HB3 ARG A 684 -13.822 16.169 -10.875 1.00 34.21 H new ATOM 0 HG2 ARG A 684 -14.627 17.301 -13.583 1.00 4.13 H new ATOM 0 HG3 ARG A 684 -15.087 17.933 -12.015 1.00 4.13 H new ATOM 0 HD2 ARG A 684 -12.264 17.813 -13.147 1.00 32.12 H new ATOM 0 HD3 ARG A 684 -13.252 19.251 -12.984 1.00 32.12 H new ATOM 0 HE ARG A 684 -13.093 18.198 -10.391 1.00 55.50 H new ATOM 0 HH11 ARG A 684 -10.841 19.440 -12.841 1.00 45.41 H new ATOM 0 HH12 ARG A 684 -9.625 19.909 -11.649 1.00 45.41 H new ATOM 0 HH21 ARG A 684 -11.525 18.805 -8.868 1.00 51.40 H new ATOM 0 HH22 ARG A 684 -10.012 19.549 -9.399 1.00 51.40 H new ATOM 1533 N THR A 685 -12.056 12.935 -12.446 1.00 51.43 N ATOM 1534 CA THR A 685 -11.885 11.567 -11.938 1.00 40.14 C ATOM 1535 C THR A 685 -11.082 11.531 -10.631 1.00 74.15 C ATOM 1536 O THR A 685 -9.897 11.887 -10.631 1.00 12.21 O ATOM 1537 CB THR A 685 -11.152 10.708 -12.979 1.00 23.22 C ATOM 1538 OG1 THR A 685 -11.857 10.777 -14.233 1.00 13.45 O ATOM 1539 CG2 THR A 685 -11.084 9.268 -12.513 1.00 52.32 C ATOM 0 H THR A 685 -11.558 13.110 -13.319 1.00 51.43 H new ATOM 0 HA THR A 685 -12.883 11.174 -11.744 1.00 40.14 H new ATOM 0 HB THR A 685 -10.137 11.086 -13.105 1.00 23.22 H new ATOM 0 HG1 THR A 685 -11.391 10.231 -14.901 1.00 13.45 H new ATOM 0 HG21 THR A 685 -10.562 8.668 -13.259 1.00 52.32 H new ATOM 0 HG22 THR A 685 -10.547 9.217 -11.566 1.00 52.32 H new ATOM 0 HG23 THR A 685 -12.094 8.881 -12.378 1.00 52.32 H new ATOM 1545 N PRO A 686 -11.712 11.109 -9.512 1.00 74.22 N ATOM 1546 CA PRO A 686 -11.052 11.023 -8.202 1.00 73.23 C ATOM 1547 C PRO A 686 -9.891 10.024 -8.188 1.00 13.50 C ATOM 1548 O PRO A 686 -9.950 8.979 -8.842 1.00 63.21 O ATOM 1549 CB PRO A 686 -12.160 10.548 -7.248 1.00 34.33 C ATOM 1550 CG PRO A 686 -13.230 9.982 -8.116 1.00 33.05 C ATOM 1551 CD PRO A 686 -13.130 10.678 -9.441 1.00 62.32 C ATOM 0 HA PRO A 686 -10.614 11.982 -7.924 1.00 73.23 H new ATOM 0 HB2 PRO A 686 -11.782 9.797 -6.554 1.00 34.33 H new ATOM 0 HB3 PRO A 686 -12.540 11.375 -6.648 1.00 34.33 H new ATOM 0 HG2 PRO A 686 -13.102 8.906 -8.234 1.00 33.05 H new ATOM 0 HG3 PRO A 686 -14.212 10.139 -7.670 1.00 33.05 H new ATOM 0 HD2 PRO A 686 -13.386 10.010 -10.263 1.00 62.32 H new ATOM 0 HD3 PRO A 686 -13.809 11.529 -9.498 1.00 62.32 H new ATOM 1559 N ARG A 687 -8.840 10.364 -7.473 1.00 4.11 N ATOM 1560 CA ARG A 687 -7.697 9.485 -7.313 1.00 72.11 C ATOM 1561 C ARG A 687 -7.920 8.559 -6.157 1.00 60.41 C ATOM 1562 O ARG A 687 -8.114 9.007 -5.035 1.00 51.53 O ATOM 1563 CB ARG A 687 -6.423 10.277 -7.048 1.00 62.32 C ATOM 1564 CG ARG A 687 -5.850 11.000 -8.233 1.00 72.33 C ATOM 1565 CD ARG A 687 -4.637 11.809 -7.825 1.00 63.00 C ATOM 1566 NE ARG A 687 -3.870 12.313 -8.973 1.00 73.43 N ATOM 1567 CZ ARG A 687 -3.630 13.597 -9.241 1.00 25.54 C ATOM 1568 NH1 ARG A 687 -4.324 14.557 -8.630 1.00 31.12 N ATOM 1569 NH2 ARG A 687 -2.743 13.917 -10.167 1.00 54.02 N ATOM 0 H ARG A 687 -8.752 11.256 -6.986 1.00 4.11 H new ATOM 0 HA ARG A 687 -7.586 8.922 -8.240 1.00 72.11 H new ATOM 0 HB2 ARG A 687 -6.626 11.006 -6.264 1.00 62.32 H new ATOM 0 HB3 ARG A 687 -5.666 9.595 -6.661 1.00 62.32 H new ATOM 0 HG2 ARG A 687 -5.573 10.282 -9.005 1.00 72.33 H new ATOM 0 HG3 ARG A 687 -6.604 11.657 -8.665 1.00 72.33 H new ATOM 0 HD2 ARG A 687 -4.958 12.651 -7.212 1.00 63.00 H new ATOM 0 HD3 ARG A 687 -3.988 11.192 -7.204 1.00 63.00 H new ATOM 0 HE ARG A 687 -3.489 11.622 -9.619 1.00 73.43 H new ATOM 0 HH11 ARG A 687 -5.045 14.312 -7.952 1.00 31.12 H new ATOM 0 HH12 ARG A 687 -4.134 15.537 -8.841 1.00 31.12 H new ATOM 0 HH21 ARG A 687 -2.246 13.183 -10.672 1.00 54.02 H new ATOM 0 HH22 ARG A 687 -2.555 14.898 -10.376 1.00 54.02 H new ATOM 1581 N ALA A 688 -7.866 7.284 -6.408 1.00 51.41 N ATOM 1582 CA ALA A 688 -8.040 6.339 -5.344 1.00 54.34 C ATOM 1583 C ALA A 688 -6.908 5.362 -5.369 1.00 42.54 C ATOM 1584 O ALA A 688 -6.239 5.210 -6.390 1.00 23.43 O ATOM 1585 CB ALA A 688 -9.372 5.612 -5.480 1.00 2.13 C ATOM 0 H ALA A 688 -7.705 6.877 -7.329 1.00 51.41 H new ATOM 0 HA ALA A 688 -8.045 6.868 -4.391 1.00 54.34 H new ATOM 0 HB1 ALA A 688 -9.483 4.900 -4.662 1.00 2.13 H new ATOM 0 HB2 ALA A 688 -10.187 6.335 -5.444 1.00 2.13 H new ATOM 0 HB3 ALA A 688 -9.401 5.080 -6.431 1.00 2.13 H new ATOM 1591 N THR A 689 -6.683 4.708 -4.283 1.00 24.03 N ATOM 1592 CA THR A 689 -5.651 3.720 -4.195 1.00 1.51 C ATOM 1593 C THR A 689 -6.271 2.365 -3.897 1.00 52.42 C ATOM 1594 O THR A 689 -7.130 2.249 -3.012 1.00 24.20 O ATOM 1595 CB THR A 689 -4.630 4.103 -3.104 1.00 20.34 C ATOM 1596 OG1 THR A 689 -4.058 5.367 -3.434 1.00 13.11 O ATOM 1597 CG2 THR A 689 -3.520 3.068 -2.983 1.00 31.02 C ATOM 0 H THR A 689 -7.211 4.841 -3.421 1.00 24.03 H new ATOM 0 HA THR A 689 -5.123 3.667 -5.147 1.00 1.51 H new ATOM 0 HB THR A 689 -5.151 4.149 -2.148 1.00 20.34 H new ATOM 0 HG1 THR A 689 -4.683 6.082 -3.192 1.00 13.11 H new ATOM 0 HG21 THR A 689 -2.821 3.373 -2.204 1.00 31.02 H new ATOM 0 HG22 THR A 689 -3.951 2.101 -2.725 1.00 31.02 H new ATOM 0 HG23 THR A 689 -2.992 2.988 -3.933 1.00 31.02 H new ATOM 1603 N LEU A 690 -5.868 1.372 -4.652 1.00 61.10 N ATOM 1604 CA LEU A 690 -6.337 0.046 -4.477 1.00 3.22 C ATOM 1605 C LEU A 690 -5.103 -0.824 -4.283 1.00 24.24 C ATOM 1606 O LEU A 690 -4.261 -0.954 -5.175 1.00 54.24 O ATOM 1607 CB LEU A 690 -7.151 -0.378 -5.735 1.00 23.45 C ATOM 1608 CG LEU A 690 -8.004 -1.679 -5.673 1.00 5.32 C ATOM 1609 CD1 LEU A 690 -7.165 -2.917 -5.437 1.00 15.14 C ATOM 1610 CD2 LEU A 690 -9.096 -1.561 -4.622 1.00 11.13 C ATOM 0 H LEU A 690 -5.196 1.478 -5.412 1.00 61.10 H new ATOM 0 HA LEU A 690 -6.999 -0.052 -3.617 1.00 3.22 H new ATOM 0 HB2 LEU A 690 -7.821 0.444 -5.987 1.00 23.45 H new ATOM 0 HB3 LEU A 690 -6.449 -0.483 -6.562 1.00 23.45 H new ATOM 0 HG LEU A 690 -8.469 -1.795 -6.652 1.00 5.32 H new ATOM 0 HD11 LEU A 690 -7.812 -3.794 -5.403 1.00 15.14 H new ATOM 0 HD12 LEU A 690 -6.445 -3.029 -6.248 1.00 15.14 H new ATOM 0 HD13 LEU A 690 -6.633 -2.821 -4.490 1.00 15.14 H new ATOM 0 HD21 LEU A 690 -9.678 -2.482 -4.597 1.00 11.13 H new ATOM 0 HD22 LEU A 690 -8.644 -1.392 -3.645 1.00 11.13 H new ATOM 0 HD23 LEU A 690 -9.750 -0.725 -4.869 1.00 11.13 H new ATOM 1618 N ILE A 691 -4.983 -1.392 -3.136 1.00 44.41 N ATOM 1619 CA ILE A 691 -3.839 -2.211 -2.841 1.00 1.32 C ATOM 1620 C ILE A 691 -4.244 -3.665 -2.936 1.00 44.41 C ATOM 1621 O ILE A 691 -5.195 -4.074 -2.303 1.00 51.04 O ATOM 1622 CB ILE A 691 -3.285 -1.912 -1.426 1.00 52.23 C ATOM 1623 CG1 ILE A 691 -2.970 -0.414 -1.283 1.00 11.02 C ATOM 1624 CG2 ILE A 691 -2.026 -2.739 -1.170 1.00 23.30 C ATOM 1625 CD1 ILE A 691 -2.483 -0.011 0.096 1.00 43.13 C ATOM 0 H ILE A 691 -5.660 -1.310 -2.377 1.00 44.41 H new ATOM 0 HA ILE A 691 -3.051 -1.989 -3.561 1.00 1.32 H new ATOM 0 HB ILE A 691 -4.042 -2.183 -0.690 1.00 52.23 H new ATOM 0 HG12 ILE A 691 -2.212 -0.142 -2.018 1.00 11.02 H new ATOM 0 HG13 ILE A 691 -3.866 0.159 -1.522 1.00 11.02 H new ATOM 0 HG21 ILE A 691 -1.644 -2.521 -0.172 1.00 23.30 H new ATOM 0 HG22 ILE A 691 -2.266 -3.800 -1.243 1.00 23.30 H new ATOM 0 HG23 ILE A 691 -1.268 -2.487 -1.911 1.00 23.30 H new ATOM 0 HD11 ILE A 691 -2.283 1.060 0.113 1.00 43.13 H new ATOM 0 HD12 ILE A 691 -3.247 -0.249 0.836 1.00 43.13 H new ATOM 0 HD13 ILE A 691 -1.568 -0.554 0.332 1.00 43.13 H new ATOM 1632 N THR A 692 -3.544 -4.412 -3.739 1.00 72.41 N ATOM 1633 CA THR A 692 -3.815 -5.808 -3.936 1.00 54.41 C ATOM 1634 C THR A 692 -2.796 -6.628 -3.129 1.00 72.22 C ATOM 1635 O THR A 692 -1.588 -6.517 -3.344 1.00 2.15 O ATOM 1636 CB THR A 692 -3.676 -6.144 -5.427 1.00 35.53 C ATOM 1637 OG1 THR A 692 -4.472 -5.218 -6.217 1.00 43.42 O ATOM 1638 CG2 THR A 692 -4.132 -7.564 -5.718 1.00 62.41 C ATOM 0 H THR A 692 -2.756 -4.064 -4.285 1.00 72.41 H new ATOM 0 HA THR A 692 -4.826 -6.044 -3.604 1.00 54.41 H new ATOM 0 HB THR A 692 -2.623 -6.055 -5.693 1.00 35.53 H new ATOM 0 HG1 THR A 692 -4.379 -5.435 -7.168 1.00 43.42 H new ATOM 0 HG21 THR A 692 -4.021 -7.771 -6.782 1.00 62.41 H new ATOM 0 HG22 THR A 692 -3.524 -8.266 -5.147 1.00 62.41 H new ATOM 0 HG23 THR A 692 -5.178 -7.676 -5.434 1.00 62.41 H new ATOM 1644 N PHE A 693 -3.284 -7.415 -2.217 1.00 42.21 N ATOM 1645 CA PHE A 693 -2.448 -8.195 -1.328 1.00 12.54 C ATOM 1646 C PHE A 693 -2.336 -9.635 -1.805 1.00 34.22 C ATOM 1647 O PHE A 693 -3.338 -10.281 -2.100 1.00 34.24 O ATOM 1648 CB PHE A 693 -3.035 -8.172 0.074 1.00 75.22 C ATOM 1649 CG PHE A 693 -3.117 -6.799 0.717 1.00 53.22 C ATOM 1650 CD1 PHE A 693 -4.046 -5.875 0.293 1.00 63.52 C ATOM 1651 CD2 PHE A 693 -2.273 -6.450 1.753 1.00 31.12 C ATOM 1652 CE1 PHE A 693 -4.138 -4.647 0.872 1.00 52.11 C ATOM 1653 CE2 PHE A 693 -2.363 -5.212 2.348 1.00 42.43 C ATOM 1654 CZ PHE A 693 -3.299 -4.311 1.903 1.00 41.51 C ATOM 0 H PHE A 693 -4.284 -7.541 -2.061 1.00 42.21 H new ATOM 0 HA PHE A 693 -1.451 -7.755 -1.322 1.00 12.54 H new ATOM 0 HB2 PHE A 693 -4.037 -8.599 0.038 1.00 75.22 H new ATOM 0 HB3 PHE A 693 -2.435 -8.820 0.713 1.00 75.22 H new ATOM 0 HD1 PHE A 693 -4.715 -6.130 -0.515 1.00 63.52 H new ATOM 0 HD2 PHE A 693 -1.534 -7.157 2.100 1.00 31.12 H new ATOM 0 HE1 PHE A 693 -4.872 -3.937 0.519 1.00 52.11 H new ATOM 0 HE2 PHE A 693 -1.701 -4.951 3.160 1.00 42.43 H new ATOM 0 HZ PHE A 693 -3.374 -3.338 2.365 1.00 41.51 H new ATOM 1664 N LEU A 694 -1.125 -10.117 -1.870 1.00 21.45 N ATOM 1665 CA LEU A 694 -0.824 -11.463 -2.310 1.00 24.42 C ATOM 1666 C LEU A 694 -0.232 -12.267 -1.167 1.00 12.04 C ATOM 1667 O LEU A 694 0.214 -11.700 -0.155 1.00 63.02 O ATOM 1668 CB LEU A 694 0.197 -11.456 -3.472 1.00 73.13 C ATOM 1669 CG LEU A 694 -0.224 -10.894 -4.843 1.00 51.24 C ATOM 1670 CD1 LEU A 694 -1.394 -11.666 -5.423 1.00 44.10 C ATOM 1671 CD2 LEU A 694 -0.519 -9.400 -4.804 1.00 22.32 C ATOM 0 H LEU A 694 -0.298 -9.578 -1.614 1.00 21.45 H new ATOM 0 HA LEU A 694 -1.758 -11.911 -2.649 1.00 24.42 H new ATOM 0 HB2 LEU A 694 1.067 -10.890 -3.140 1.00 73.13 H new ATOM 0 HB3 LEU A 694 0.525 -12.484 -3.626 1.00 73.13 H new ATOM 0 HG LEU A 694 0.633 -11.027 -5.504 1.00 51.24 H new ATOM 0 HD11 LEU A 694 -1.665 -11.243 -6.390 1.00 44.10 H new ATOM 0 HD12 LEU A 694 -1.113 -12.711 -5.550 1.00 44.10 H new ATOM 0 HD13 LEU A 694 -2.246 -11.599 -4.746 1.00 44.10 H new ATOM 0 HD21 LEU A 694 -0.810 -9.061 -5.798 1.00 22.32 H new ATOM 0 HD22 LEU A 694 -1.331 -9.208 -4.102 1.00 22.32 H new ATOM 0 HD23 LEU A 694 0.373 -8.861 -4.484 1.00 22.32 H new ATOM 1679 N CYS A 695 -0.216 -13.571 -1.334 1.00 51.32 N ATOM 1680 CA CYS A 695 0.361 -14.466 -0.363 1.00 30.11 C ATOM 1681 C CYS A 695 1.872 -14.451 -0.399 1.00 72.51 C ATOM 1682 O CYS A 695 2.498 -14.866 -1.383 1.00 74.04 O ATOM 1683 CB CYS A 695 -0.173 -15.911 -0.508 1.00 53.32 C ATOM 1684 SG CYS A 695 0.792 -17.192 0.408 1.00 74.04 S ATOM 0 H CYS A 695 -0.605 -14.040 -2.152 1.00 51.32 H new ATOM 0 HA CYS A 695 0.048 -14.093 0.612 1.00 30.11 H new ATOM 0 HB2 CYS A 695 -1.206 -15.938 -0.161 1.00 53.32 H new ATOM 0 HB3 CYS A 695 -0.186 -16.174 -1.566 1.00 53.32 H new ATOM 1689 N ASP A 696 2.438 -13.939 0.653 1.00 41.40 N ATOM 1690 CA ASP A 696 3.867 -13.965 0.878 1.00 44.11 C ATOM 1691 C ASP A 696 4.205 -15.192 1.687 1.00 3.53 C ATOM 1692 O ASP A 696 3.415 -15.594 2.566 1.00 43.32 O ATOM 1693 CB ASP A 696 4.294 -12.706 1.624 1.00 14.24 C ATOM 1694 CG ASP A 696 5.687 -12.765 2.202 1.00 50.20 C ATOM 1695 OD1 ASP A 696 6.671 -12.698 1.433 1.00 2.31 O ATOM 1696 OD2 ASP A 696 5.799 -12.884 3.444 1.00 11.44 O ATOM 0 H ASP A 696 1.915 -13.480 1.399 1.00 41.40 H new ATOM 0 HA ASP A 696 4.396 -13.998 -0.074 1.00 44.11 H new ATOM 0 HB2 ASP A 696 4.232 -11.857 0.944 1.00 14.24 H new ATOM 0 HB3 ASP A 696 3.586 -12.520 2.432 1.00 14.24 H new ATOM 1701 N ARG A 697 5.330 -15.807 1.391 1.00 63.24 N ATOM 1702 CA ARG A 697 5.731 -16.981 2.117 1.00 2.32 C ATOM 1703 C ARG A 697 6.276 -16.516 3.453 1.00 22.24 C ATOM 1704 O ARG A 697 5.659 -16.748 4.495 1.00 32.33 O ATOM 1705 CB ARG A 697 6.784 -17.786 1.320 1.00 14.11 C ATOM 1706 CG ARG A 697 7.049 -19.238 1.797 1.00 74.32 C ATOM 1707 CD ARG A 697 7.562 -19.345 3.226 1.00 74.12 C ATOM 1708 NE ARG A 697 7.834 -20.735 3.602 1.00 13.02 N ATOM 1709 CZ ARG A 697 8.024 -21.179 4.850 1.00 0.30 C ATOM 1710 NH1 ARG A 697 7.881 -20.361 5.896 1.00 74.01 N ATOM 1711 NH2 ARG A 697 8.340 -22.452 5.051 1.00 24.01 N ATOM 0 H ARG A 697 5.975 -15.513 0.658 1.00 63.24 H new ATOM 0 HA ARG A 697 4.885 -17.651 2.272 1.00 2.32 H new ATOM 0 HB2 ARG A 697 6.469 -17.821 0.277 1.00 14.11 H new ATOM 0 HB3 ARG A 697 7.726 -17.239 1.350 1.00 14.11 H new ATOM 0 HG2 ARG A 697 6.125 -19.810 1.711 1.00 74.32 H new ATOM 0 HG3 ARG A 697 7.774 -19.701 1.128 1.00 74.32 H new ATOM 0 HD2 ARG A 697 8.472 -18.755 3.331 1.00 74.12 H new ATOM 0 HD3 ARG A 697 6.827 -18.920 3.909 1.00 74.12 H new ATOM 0 HE ARG A 697 7.883 -21.422 2.849 1.00 13.02 H new ATOM 0 HH11 ARG A 697 7.624 -19.385 5.749 1.00 74.01 H new ATOM 0 HH12 ARG A 697 8.029 -20.712 6.842 1.00 74.01 H new ATOM 0 HH21 ARG A 697 8.437 -23.085 4.257 1.00 24.01 H new ATOM 0 HH22 ARG A 697 8.486 -22.798 5.999 1.00 24.01 H new ATOM 1723 N ASP A 698 7.429 -15.881 3.437 1.00 44.33 N ATOM 1724 CA ASP A 698 7.955 -15.311 4.652 1.00 31.31 C ATOM 1725 C ASP A 698 8.828 -14.117 4.367 1.00 51.11 C ATOM 1726 O ASP A 698 9.935 -14.247 3.815 1.00 21.24 O ATOM 1727 CB ASP A 698 8.732 -16.333 5.478 1.00 72.03 C ATOM 1728 CG ASP A 698 9.082 -15.789 6.853 1.00 34.24 C ATOM 1729 OD1 ASP A 698 8.232 -15.892 7.760 1.00 3.31 O ATOM 1730 OD2 ASP A 698 10.194 -15.262 7.049 1.00 44.35 O ATOM 0 H ASP A 698 8.010 -15.749 2.609 1.00 44.33 H new ATOM 0 HA ASP A 698 7.094 -14.987 5.236 1.00 31.31 H new ATOM 0 HB2 ASP A 698 8.139 -17.242 5.585 1.00 72.03 H new ATOM 0 HB3 ASP A 698 9.646 -16.609 4.951 1.00 72.03 H new ATOM 1735 N ALA A 699 8.332 -12.983 4.723 1.00 40.22 N ATOM 1736 CA ALA A 699 9.051 -11.733 4.664 1.00 65.03 C ATOM 1737 C ALA A 699 8.633 -10.918 5.851 1.00 64.14 C ATOM 1738 O ALA A 699 9.435 -10.210 6.469 1.00 52.20 O ATOM 1739 CB ALA A 699 8.758 -10.986 3.374 1.00 45.22 C ATOM 0 H ALA A 699 7.381 -12.884 5.078 1.00 40.22 H new ATOM 0 HA ALA A 699 10.125 -11.920 4.682 1.00 65.03 H new ATOM 0 HB1 ALA A 699 9.315 -10.049 3.361 1.00 45.22 H new ATOM 0 HB2 ALA A 699 9.058 -11.598 2.523 1.00 45.22 H new ATOM 0 HB3 ALA A 699 7.691 -10.774 3.311 1.00 45.22 H new ATOM 1745 N GLY A 700 7.364 -10.993 6.156 1.00 3.23 N ATOM 1746 CA GLY A 700 6.866 -10.386 7.329 1.00 21.51 C ATOM 1747 C GLY A 700 5.735 -9.491 7.028 1.00 54.23 C ATOM 1748 O GLY A 700 4.643 -9.948 6.656 1.00 60.50 O ATOM 0 H GLY A 700 6.664 -11.476 5.593 1.00 3.23 H new ATOM 0 HA2 GLY A 700 6.547 -11.155 8.032 1.00 21.51 H new ATOM 0 HA3 GLY A 700 7.661 -9.820 7.815 1.00 21.51 H new ATOM 1752 N VAL A 701 5.982 -8.227 7.144 1.00 42.13 N ATOM 1753 CA VAL A 701 4.976 -7.250 6.933 1.00 3.14 C ATOM 1754 C VAL A 701 4.759 -7.038 5.423 1.00 74.15 C ATOM 1755 O VAL A 701 3.636 -6.856 4.959 1.00 64.40 O ATOM 1756 CB VAL A 701 5.333 -5.932 7.672 1.00 25.13 C ATOM 1757 CG1 VAL A 701 6.485 -5.162 7.041 1.00 44.55 C ATOM 1758 CG2 VAL A 701 4.128 -5.076 7.938 1.00 11.40 C ATOM 0 H VAL A 701 6.895 -7.845 7.390 1.00 42.13 H new ATOM 0 HA VAL A 701 4.033 -7.601 7.353 1.00 3.14 H new ATOM 0 HB VAL A 701 5.710 -6.242 8.647 1.00 25.13 H new ATOM 0 HG11 VAL A 701 6.673 -4.254 7.615 1.00 44.55 H new ATOM 0 HG12 VAL A 701 7.381 -5.783 7.040 1.00 44.55 H new ATOM 0 HG13 VAL A 701 6.227 -4.896 6.016 1.00 44.55 H new ATOM 0 HG21 VAL A 701 4.434 -4.167 8.456 1.00 11.40 H new ATOM 0 HG22 VAL A 701 3.653 -4.812 6.993 1.00 11.40 H new ATOM 0 HG23 VAL A 701 3.420 -5.626 8.558 1.00 11.40 H new ATOM 1764 N GLY A 702 5.828 -7.127 4.664 1.00 44.05 N ATOM 1765 CA GLY A 702 5.730 -6.976 3.255 1.00 3.04 C ATOM 1766 C GLY A 702 5.854 -5.542 2.795 1.00 55.42 C ATOM 1767 O GLY A 702 5.550 -4.595 3.527 1.00 62.41 O ATOM 0 H GLY A 702 6.770 -7.304 5.012 1.00 44.05 H new ATOM 0 HA2 GLY A 702 6.509 -7.571 2.778 1.00 3.04 H new ATOM 0 HA3 GLY A 702 4.773 -7.376 2.920 1.00 3.04 H new ATOM 1771 N PHE A 703 6.339 -5.405 1.619 1.00 13.04 N ATOM 1772 CA PHE A 703 6.479 -4.133 0.927 1.00 40.13 C ATOM 1773 C PHE A 703 5.531 -4.087 -0.285 1.00 43.34 C ATOM 1774 O PHE A 703 5.338 -5.099 -0.969 1.00 72.31 O ATOM 1775 CB PHE A 703 7.931 -3.931 0.436 1.00 65.31 C ATOM 1776 CG PHE A 703 8.969 -3.795 1.522 1.00 74.42 C ATOM 1777 CD1 PHE A 703 9.497 -4.911 2.153 1.00 71.01 C ATOM 1778 CD2 PHE A 703 9.420 -2.541 1.904 1.00 3.44 C ATOM 1779 CE1 PHE A 703 10.450 -4.779 3.143 1.00 25.01 C ATOM 1780 CE2 PHE A 703 10.376 -2.402 2.891 1.00 63.24 C ATOM 1781 CZ PHE A 703 10.891 -3.522 3.512 1.00 1.24 C ATOM 0 H PHE A 703 6.671 -6.197 1.068 1.00 13.04 H new ATOM 0 HA PHE A 703 6.226 -3.338 1.628 1.00 40.13 H new ATOM 0 HB2 PHE A 703 8.202 -4.775 -0.199 1.00 65.31 H new ATOM 0 HB3 PHE A 703 7.964 -3.038 -0.189 1.00 65.31 H new ATOM 0 HD1 PHE A 703 9.159 -5.896 1.866 1.00 71.01 H new ATOM 0 HD2 PHE A 703 9.018 -1.661 1.423 1.00 3.44 H new ATOM 0 HE1 PHE A 703 10.850 -5.657 3.629 1.00 25.01 H new ATOM 0 HE2 PHE A 703 10.720 -1.419 3.176 1.00 63.24 H new ATOM 0 HZ PHE A 703 11.638 -3.416 4.285 1.00 1.24 H new ATOM 1791 N PRO A 704 4.888 -2.933 -0.531 1.00 25.13 N ATOM 1792 CA PRO A 704 4.026 -2.745 -1.704 1.00 21.44 C ATOM 1793 C PRO A 704 4.819 -2.371 -2.977 1.00 33.21 C ATOM 1794 O PRO A 704 5.847 -1.686 -2.909 1.00 44.54 O ATOM 1795 CB PRO A 704 3.136 -1.579 -1.286 1.00 55.10 C ATOM 1796 CG PRO A 704 3.981 -0.770 -0.358 1.00 24.32 C ATOM 1797 CD PRO A 704 4.901 -1.741 0.341 1.00 72.42 C ATOM 0 HA PRO A 704 3.489 -3.657 -1.963 1.00 21.44 H new ATOM 0 HB2 PRO A 704 2.822 -0.992 -2.149 1.00 55.10 H new ATOM 0 HB3 PRO A 704 2.230 -1.930 -0.792 1.00 55.10 H new ATOM 0 HG2 PRO A 704 4.552 -0.021 -0.907 1.00 24.32 H new ATOM 0 HG3 PRO A 704 3.363 -0.234 0.362 1.00 24.32 H new ATOM 0 HD2 PRO A 704 5.907 -1.334 0.446 1.00 72.42 H new ATOM 0 HD3 PRO A 704 4.546 -1.976 1.344 1.00 72.42 H new ATOM 1805 N GLU A 705 4.344 -2.833 -4.112 1.00 72.33 N ATOM 1806 CA GLU A 705 4.941 -2.528 -5.405 1.00 43.12 C ATOM 1807 C GLU A 705 3.972 -1.673 -6.207 1.00 32.24 C ATOM 1808 O GLU A 705 2.765 -1.873 -6.114 1.00 61.21 O ATOM 1809 CB GLU A 705 5.179 -3.833 -6.171 1.00 53.02 C ATOM 1810 CG GLU A 705 5.925 -3.663 -7.481 1.00 53.13 C ATOM 1811 CD GLU A 705 7.282 -3.061 -7.282 1.00 52.20 C ATOM 1812 OE1 GLU A 705 7.383 -1.834 -7.182 1.00 54.42 O ATOM 1813 OE2 GLU A 705 8.277 -3.819 -7.226 1.00 34.30 O ATOM 0 H GLU A 705 3.524 -3.437 -4.170 1.00 72.33 H new ATOM 0 HA GLU A 705 5.883 -2.000 -5.257 1.00 43.12 H new ATOM 0 HB2 GLU A 705 5.739 -4.517 -5.534 1.00 53.02 H new ATOM 0 HB3 GLU A 705 4.216 -4.302 -6.373 1.00 53.02 H new ATOM 0 HG2 GLU A 705 6.027 -4.633 -7.968 1.00 53.13 H new ATOM 0 HG3 GLU A 705 5.342 -3.030 -8.150 1.00 53.13 H new ATOM 1820 N TYR A 706 4.474 -0.745 -6.986 1.00 1.33 N ATOM 1821 CA TYR A 706 3.609 0.068 -7.811 1.00 25.54 C ATOM 1822 C TYR A 706 3.583 -0.438 -9.231 1.00 51.30 C ATOM 1823 O TYR A 706 4.616 -0.499 -9.900 1.00 24.44 O ATOM 1824 CB TYR A 706 3.976 1.559 -7.766 1.00 25.52 C ATOM 1825 CG TYR A 706 3.098 2.414 -8.655 1.00 23.12 C ATOM 1826 CD1 TYR A 706 1.741 2.575 -8.390 1.00 41.51 C ATOM 1827 CD2 TYR A 706 3.625 3.063 -9.754 1.00 4.13 C ATOM 1828 CE1 TYR A 706 0.951 3.360 -9.192 1.00 53.34 C ATOM 1829 CE2 TYR A 706 2.843 3.844 -10.558 1.00 53.13 C ATOM 1830 CZ TYR A 706 1.512 3.995 -10.279 1.00 70.23 C ATOM 1831 OH TYR A 706 0.737 4.789 -11.086 1.00 44.13 O ATOM 0 H TYR A 706 5.469 -0.534 -7.067 1.00 1.33 H new ATOM 0 HA TYR A 706 2.606 -0.021 -7.393 1.00 25.54 H new ATOM 0 HB2 TYR A 706 3.899 1.915 -6.739 1.00 25.52 H new ATOM 0 HB3 TYR A 706 5.016 1.680 -8.068 1.00 25.52 H new ATOM 0 HD1 TYR A 706 1.303 2.074 -7.539 1.00 41.51 H new ATOM 0 HD2 TYR A 706 4.675 2.951 -9.982 1.00 4.13 H new ATOM 0 HE1 TYR A 706 -0.100 3.479 -8.973 1.00 53.34 H new ATOM 0 HE2 TYR A 706 3.275 4.342 -11.413 1.00 53.13 H new ATOM 0 HH TYR A 706 1.289 5.162 -11.805 1.00 44.13 H new ATOM 1841 N GLN A 707 2.404 -0.834 -9.682 1.00 13.32 N ATOM 1842 CA GLN A 707 2.223 -1.273 -11.048 1.00 64.35 C ATOM 1843 C GLN A 707 2.159 -0.078 -11.976 1.00 44.25 C ATOM 1844 O GLN A 707 3.180 0.340 -12.498 1.00 42.04 O ATOM 1845 CB GLN A 707 0.980 -2.184 -11.207 1.00 1.43 C ATOM 1846 CG GLN A 707 1.132 -3.611 -10.674 1.00 5.41 C ATOM 1847 CD GLN A 707 1.499 -3.686 -9.218 1.00 44.43 C ATOM 1848 OE1 GLN A 707 0.523 -3.745 -8.373 1.00 54.53 O flip ATOM 1849 NE2 GLN A 707 2.672 -3.707 -8.860 1.00 12.24 N flip ATOM 0 H GLN A 707 1.556 -0.859 -9.115 1.00 13.32 H new ATOM 0 HA GLN A 707 3.086 -1.879 -11.323 1.00 64.35 H new ATOM 0 HB2 GLN A 707 0.139 -1.713 -10.698 1.00 1.43 H new ATOM 0 HB3 GLN A 707 0.723 -2.236 -12.265 1.00 1.43 H new ATOM 0 HG2 GLN A 707 0.196 -4.147 -10.830 1.00 5.41 H new ATOM 0 HG3 GLN A 707 1.895 -4.126 -11.257 1.00 5.41 H new ATOM 0 HE21 GLN A 707 3.418 -3.659 -9.554 1.00 12.24 H new ATOM 0 HE22 GLN A 707 2.901 -3.773 -7.868 1.00 12.24 H new ATOM 1857 N GLU A 708 0.962 0.466 -12.127 1.00 62.32 N ATOM 1858 CA GLU A 708 0.645 1.661 -12.920 1.00 70.24 C ATOM 1859 C GLU A 708 -0.794 2.016 -12.709 1.00 1.33 C ATOM 1860 O GLU A 708 -1.659 1.135 -12.660 1.00 10.13 O ATOM 1861 CB GLU A 708 0.890 1.504 -14.451 1.00 1.30 C ATOM 1862 CG GLU A 708 2.322 1.729 -14.939 1.00 24.53 C ATOM 1863 CD GLU A 708 2.796 3.158 -14.735 1.00 4.41 C ATOM 1864 OE1 GLU A 708 2.507 4.018 -15.600 1.00 14.24 O ATOM 1865 OE2 GLU A 708 3.469 3.438 -13.730 1.00 3.22 O ATOM 0 H GLU A 708 0.136 0.070 -11.679 1.00 62.32 H new ATOM 0 HA GLU A 708 1.322 2.441 -12.573 1.00 70.24 H new ATOM 0 HB2 GLU A 708 0.583 0.500 -14.745 1.00 1.30 H new ATOM 0 HB3 GLU A 708 0.237 2.203 -14.974 1.00 1.30 H new ATOM 0 HG2 GLU A 708 2.992 1.050 -14.411 1.00 24.53 H new ATOM 0 HG3 GLU A 708 2.384 1.478 -15.998 1.00 24.53 H new ATOM 1872 N GLU A 709 -1.041 3.265 -12.520 1.00 73.33 N ATOM 1873 CA GLU A 709 -2.378 3.768 -12.456 1.00 55.31 C ATOM 1874 C GLU A 709 -2.908 3.817 -13.887 1.00 65.12 C ATOM 1875 O GLU A 709 -2.218 4.293 -14.810 1.00 43.32 O ATOM 1876 CB GLU A 709 -2.374 5.148 -11.768 1.00 64.34 C ATOM 1877 CG GLU A 709 -3.736 5.798 -11.479 1.00 14.23 C ATOM 1878 CD GLU A 709 -4.504 6.218 -12.707 1.00 62.23 C ATOM 1879 OE1 GLU A 709 -4.045 7.145 -13.410 1.00 71.31 O ATOM 1880 OE2 GLU A 709 -5.564 5.624 -12.991 1.00 42.50 O ATOM 0 H GLU A 709 -0.319 3.976 -12.404 1.00 73.33 H new ATOM 0 HA GLU A 709 -3.033 3.130 -11.862 1.00 55.31 H new ATOM 0 HB2 GLU A 709 -1.839 5.052 -10.823 1.00 64.34 H new ATOM 0 HB3 GLU A 709 -1.799 5.833 -12.391 1.00 64.34 H new ATOM 0 HG2 GLU A 709 -4.345 5.097 -10.908 1.00 14.23 H new ATOM 0 HG3 GLU A 709 -3.580 6.672 -10.847 1.00 14.23 H new ATOM 1887 N ASP A 710 -4.087 3.314 -14.059 1.00 51.33 N ATOM 1888 CA ASP A 710 -4.714 3.179 -15.363 1.00 60.52 C ATOM 1889 C ASP A 710 -6.202 3.085 -15.179 1.00 64.30 C ATOM 1890 O ASP A 710 -6.981 3.839 -15.754 1.00 72.53 O ATOM 1891 CB ASP A 710 -4.194 1.895 -16.034 1.00 13.10 C ATOM 1892 CG ASP A 710 -4.877 1.568 -17.341 1.00 73.54 C ATOM 1893 OD1 ASP A 710 -4.419 2.041 -18.402 1.00 32.21 O ATOM 1894 OD2 ASP A 710 -5.863 0.793 -17.331 1.00 35.13 O ATOM 0 H ASP A 710 -4.665 2.974 -13.290 1.00 51.33 H new ATOM 0 HA ASP A 710 -4.477 4.040 -15.988 1.00 60.52 H new ATOM 0 HB2 ASP A 710 -3.123 1.997 -16.210 1.00 13.10 H new ATOM 0 HB3 ASP A 710 -4.326 1.059 -15.347 1.00 13.10 H new ATOM 1899 N ASN A 711 -6.565 2.175 -14.334 1.00 40.34 N ATOM 1900 CA ASN A 711 -7.943 1.853 -13.990 1.00 2.21 C ATOM 1901 C ASN A 711 -8.528 2.803 -12.924 1.00 25.23 C ATOM 1902 O ASN A 711 -9.272 2.369 -12.049 1.00 1.00 O ATOM 1903 CB ASN A 711 -7.976 0.389 -13.520 1.00 0.15 C ATOM 1904 CG ASN A 711 -6.905 0.093 -12.484 1.00 50.33 C ATOM 1905 OD1 ASN A 711 -5.781 -0.249 -12.832 1.00 43.21 O ATOM 1906 ND2 ASN A 711 -7.223 0.212 -11.239 1.00 21.34 N ATOM 0 H ASN A 711 -5.889 1.600 -13.832 1.00 40.34 H new ATOM 0 HA ASN A 711 -8.574 1.986 -14.869 1.00 2.21 H new ATOM 0 HB2 ASN A 711 -8.957 0.167 -13.100 1.00 0.15 H new ATOM 0 HB3 ASN A 711 -7.840 -0.269 -14.378 1.00 0.15 H new ATOM 0 HD21 ASN A 711 -6.531 0.020 -10.515 1.00 21.34 H new ATOM 0 HD22 ASN A 711 -8.167 0.499 -10.979 1.00 21.34 H new ATOM 1912 N SER A 712 -8.199 4.104 -13.034 1.00 21.02 N ATOM 1913 CA SER A 712 -8.718 5.217 -12.182 1.00 74.31 C ATOM 1914 C SER A 712 -8.282 5.145 -10.714 1.00 3.10 C ATOM 1915 O SER A 712 -8.626 6.008 -9.908 1.00 73.51 O ATOM 1916 CB SER A 712 -10.251 5.430 -12.322 1.00 62.34 C ATOM 1917 OG SER A 712 -11.005 4.299 -11.900 1.00 42.05 O ATOM 0 H SER A 712 -7.541 4.432 -13.741 1.00 21.02 H new ATOM 0 HA SER A 712 -8.236 6.107 -12.586 1.00 74.31 H new ATOM 0 HB2 SER A 712 -10.548 6.299 -11.734 1.00 62.34 H new ATOM 0 HB3 SER A 712 -10.489 5.652 -13.362 1.00 62.34 H new ATOM 0 HG SER A 712 -10.399 3.618 -11.540 1.00 42.05 H new ATOM 1923 N THR A 713 -7.537 4.154 -10.387 1.00 50.31 N ATOM 1924 CA THR A 713 -7.057 3.965 -9.082 1.00 75.53 C ATOM 1925 C THR A 713 -5.669 3.355 -9.161 1.00 11.43 C ATOM 1926 O THR A 713 -5.354 2.610 -10.103 1.00 15.33 O ATOM 1927 CB THR A 713 -8.051 3.107 -8.207 1.00 13.22 C ATOM 1928 OG1 THR A 713 -7.528 2.887 -6.909 1.00 73.20 O ATOM 1929 CG2 THR A 713 -8.371 1.779 -8.830 1.00 15.21 C ATOM 0 H THR A 713 -7.239 3.434 -11.045 1.00 50.31 H new ATOM 0 HA THR A 713 -6.988 4.927 -8.575 1.00 75.53 H new ATOM 0 HB THR A 713 -8.971 3.688 -8.145 1.00 13.22 H new ATOM 0 HG1 THR A 713 -8.257 2.649 -6.299 1.00 73.20 H new ATOM 0 HG21 THR A 713 -9.058 1.231 -8.186 1.00 15.21 H new ATOM 0 HG22 THR A 713 -8.834 1.936 -9.804 1.00 15.21 H new ATOM 0 HG23 THR A 713 -7.453 1.204 -8.953 1.00 15.21 H new ATOM 1935 N TYR A 714 -4.841 3.713 -8.222 1.00 43.43 N ATOM 1936 CA TYR A 714 -3.486 3.245 -8.167 1.00 61.02 C ATOM 1937 C TYR A 714 -3.458 1.873 -7.567 1.00 33.24 C ATOM 1938 O TYR A 714 -3.893 1.687 -6.447 1.00 63.33 O ATOM 1939 CB TYR A 714 -2.632 4.182 -7.302 1.00 34.41 C ATOM 1940 CG TYR A 714 -2.569 5.609 -7.785 1.00 14.33 C ATOM 1941 CD1 TYR A 714 -3.593 6.498 -7.509 1.00 22.21 C ATOM 1942 CD2 TYR A 714 -1.480 6.072 -8.502 1.00 71.14 C ATOM 1943 CE1 TYR A 714 -3.536 7.796 -7.929 1.00 52.10 C ATOM 1944 CE2 TYR A 714 -1.417 7.379 -8.932 1.00 55.21 C ATOM 1945 CZ TYR A 714 -2.448 8.235 -8.638 1.00 20.42 C ATOM 1946 OH TYR A 714 -2.390 9.542 -9.042 1.00 70.53 O ATOM 0 H TYR A 714 -5.091 4.347 -7.463 1.00 43.43 H new ATOM 0 HA TYR A 714 -3.082 3.222 -9.179 1.00 61.02 H new ATOM 0 HB2 TYR A 714 -3.026 4.175 -6.286 1.00 34.41 H new ATOM 0 HB3 TYR A 714 -1.618 3.785 -7.254 1.00 34.41 H new ATOM 0 HD1 TYR A 714 -4.453 6.159 -6.951 1.00 22.21 H new ATOM 0 HD2 TYR A 714 -0.667 5.398 -8.728 1.00 71.14 H new ATOM 0 HE1 TYR A 714 -4.345 8.475 -7.703 1.00 52.10 H new ATOM 0 HE2 TYR A 714 -0.564 7.727 -9.495 1.00 55.21 H new ATOM 0 HH TYR A 714 -1.501 9.905 -8.848 1.00 70.53 H new ATOM 1956 N ASN A 715 -2.948 0.930 -8.298 1.00 11.44 N ATOM 1957 CA ASN A 715 -2.816 -0.424 -7.795 1.00 73.41 C ATOM 1958 C ASN A 715 -1.425 -0.722 -7.328 1.00 31.14 C ATOM 1959 O ASN A 715 -0.432 -0.520 -8.055 1.00 22.54 O ATOM 1960 CB ASN A 715 -3.199 -1.458 -8.841 1.00 13.20 C ATOM 1961 CG ASN A 715 -4.684 -1.726 -8.946 1.00 1.31 C ATOM 1962 OD1 ASN A 715 -5.388 -1.080 -9.707 1.00 73.45 O ATOM 1963 ND2 ASN A 715 -5.173 -2.699 -8.188 1.00 11.15 N ATOM 0 H ASN A 715 -2.611 1.063 -9.252 1.00 11.44 H new ATOM 0 HA ASN A 715 -3.501 -0.487 -6.950 1.00 73.41 H new ATOM 0 HB2 ASN A 715 -2.833 -1.126 -9.813 1.00 13.20 H new ATOM 0 HB3 ASN A 715 -2.689 -2.394 -8.612 1.00 13.20 H new ATOM 0 HD21 ASN A 715 -6.166 -2.928 -8.230 1.00 11.15 H new ATOM 0 HD22 ASN A 715 -4.556 -3.218 -7.564 1.00 11.15 H new ATOM 1969 N PHE A 716 -1.353 -1.188 -6.110 1.00 74.14 N ATOM 1970 CA PHE A 716 -0.125 -1.620 -5.507 1.00 72.12 C ATOM 1971 C PHE A 716 -0.193 -3.101 -5.238 1.00 70.21 C ATOM 1972 O PHE A 716 -1.246 -3.624 -4.912 1.00 64.12 O ATOM 1973 CB PHE A 716 0.179 -0.852 -4.214 1.00 62.11 C ATOM 1974 CG PHE A 716 0.467 0.608 -4.427 1.00 50.20 C ATOM 1975 CD1 PHE A 716 -0.556 1.535 -4.515 1.00 65.03 C ATOM 1976 CD2 PHE A 716 1.773 1.048 -4.548 1.00 31.15 C ATOM 1977 CE1 PHE A 716 -0.278 2.870 -4.719 1.00 20.50 C ATOM 1978 CE2 PHE A 716 2.054 2.381 -4.752 1.00 12.44 C ATOM 1979 CZ PHE A 716 1.028 3.291 -4.836 1.00 3.53 C ATOM 0 H PHE A 716 -2.164 -1.279 -5.498 1.00 74.14 H new ATOM 0 HA PHE A 716 0.688 -1.410 -6.202 1.00 72.12 H new ATOM 0 HB2 PHE A 716 -0.669 -0.950 -3.537 1.00 62.11 H new ATOM 0 HB3 PHE A 716 1.035 -1.313 -3.722 1.00 62.11 H new ATOM 0 HD1 PHE A 716 -1.582 1.210 -4.423 1.00 65.03 H new ATOM 0 HD2 PHE A 716 2.583 0.337 -4.482 1.00 31.15 H new ATOM 0 HE1 PHE A 716 -1.084 3.585 -4.787 1.00 20.50 H new ATOM 0 HE2 PHE A 716 3.078 2.710 -4.846 1.00 12.44 H new ATOM 0 HZ PHE A 716 1.246 4.337 -4.994 1.00 3.53 H new ATOM 1989 N ARG A 717 0.913 -3.765 -5.401 1.00 4.13 N ATOM 1990 CA ARG A 717 1.005 -5.194 -5.184 1.00 55.02 C ATOM 1991 C ARG A 717 1.713 -5.412 -3.873 1.00 20.24 C ATOM 1992 O ARG A 717 2.848 -5.012 -3.720 1.00 5.30 O ATOM 1993 CB ARG A 717 1.813 -5.814 -6.318 1.00 55.10 C ATOM 1994 CG ARG A 717 2.012 -7.301 -6.245 1.00 12.43 C ATOM 1995 CD ARG A 717 2.878 -7.777 -7.400 1.00 51.23 C ATOM 1996 NE ARG A 717 2.298 -7.453 -8.696 1.00 62.11 N ATOM 1997 CZ ARG A 717 2.970 -7.406 -9.849 1.00 12.23 C ATOM 1998 NH1 ARG A 717 4.255 -7.712 -9.887 1.00 52.40 N ATOM 1999 NH2 ARG A 717 2.340 -7.069 -10.965 1.00 34.20 N ATOM 0 H ARG A 717 1.790 -3.333 -5.691 1.00 4.13 H new ATOM 0 HA ARG A 717 0.017 -5.653 -5.160 1.00 55.02 H new ATOM 0 HB2 ARG A 717 1.319 -5.579 -7.261 1.00 55.10 H new ATOM 0 HB3 ARG A 717 2.793 -5.337 -6.343 1.00 55.10 H new ATOM 0 HG2 ARG A 717 2.481 -7.565 -5.297 1.00 12.43 H new ATOM 0 HG3 ARG A 717 1.046 -7.805 -6.274 1.00 12.43 H new ATOM 0 HD2 ARG A 717 3.865 -7.322 -7.322 1.00 51.23 H new ATOM 0 HD3 ARG A 717 3.017 -8.856 -7.326 1.00 51.23 H new ATOM 0 HE ARG A 717 1.300 -7.246 -8.725 1.00 62.11 H new ATOM 0 HH11 ARG A 717 4.739 -7.986 -9.032 1.00 52.40 H new ATOM 0 HH12 ARG A 717 4.762 -7.674 -10.771 1.00 52.40 H new ATOM 0 HH21 ARG A 717 1.345 -6.846 -10.942 1.00 34.20 H new ATOM 0 HH22 ARG A 717 2.850 -7.032 -11.847 1.00 34.20 H new ATOM 2011 N TRP A 718 1.061 -6.014 -2.943 1.00 12.34 N ATOM 2012 CA TRP A 718 1.633 -6.170 -1.643 1.00 51.01 C ATOM 2013 C TRP A 718 1.835 -7.643 -1.346 1.00 64.53 C ATOM 2014 O TRP A 718 0.892 -8.419 -1.385 1.00 43.13 O ATOM 2015 CB TRP A 718 0.682 -5.570 -0.610 1.00 64.30 C ATOM 2016 CG TRP A 718 1.307 -5.293 0.718 1.00 1.25 C ATOM 2017 CD1 TRP A 718 1.942 -6.169 1.541 1.00 1.42 C ATOM 2018 CD2 TRP A 718 1.321 -4.042 1.383 1.00 14.20 C ATOM 2019 NE1 TRP A 718 2.372 -5.527 2.667 1.00 25.33 N ATOM 2020 CE2 TRP A 718 1.997 -4.222 2.595 1.00 35.51 C ATOM 2021 CE3 TRP A 718 0.831 -2.778 1.064 1.00 43.40 C ATOM 2022 CZ2 TRP A 718 2.192 -3.192 3.482 1.00 25.02 C ATOM 2023 CZ3 TRP A 718 1.026 -1.754 1.951 1.00 35.54 C ATOM 2024 CH2 TRP A 718 1.700 -1.966 3.146 1.00 32.14 C ATOM 0 H TRP A 718 0.127 -6.410 -3.053 1.00 12.34 H new ATOM 0 HA TRP A 718 2.596 -5.662 -1.602 1.00 51.01 H new ATOM 0 HB2 TRP A 718 0.274 -4.640 -1.007 1.00 64.30 H new ATOM 0 HB3 TRP A 718 -0.157 -6.251 -0.468 1.00 64.30 H new ATOM 0 HD1 TRP A 718 2.085 -7.219 1.335 1.00 1.42 H new ATOM 0 HE1 TRP A 718 2.889 -5.955 3.435 1.00 25.33 H new ATOM 0 HE3 TRP A 718 0.307 -2.609 0.135 1.00 43.40 H new ATOM 0 HZ2 TRP A 718 2.717 -3.348 4.413 1.00 25.02 H new ATOM 0 HZ3 TRP A 718 0.651 -0.768 1.718 1.00 35.54 H new ATOM 0 HH2 TRP A 718 1.838 -1.139 3.827 1.00 32.14 H new ATOM 2035 N TYR A 719 3.043 -8.025 -1.066 1.00 55.02 N ATOM 2036 CA TYR A 719 3.315 -9.380 -0.664 1.00 20.45 C ATOM 2037 C TYR A 719 3.457 -9.438 0.836 1.00 42.44 C ATOM 2038 O TYR A 719 4.505 -9.100 1.374 1.00 31.13 O ATOM 2039 CB TYR A 719 4.567 -9.936 -1.335 1.00 21.42 C ATOM 2040 CG TYR A 719 4.418 -10.137 -2.813 1.00 13.41 C ATOM 2041 CD1 TYR A 719 3.813 -11.284 -3.306 1.00 25.41 C ATOM 2042 CD2 TYR A 719 4.866 -9.191 -3.717 1.00 72.12 C ATOM 2043 CE1 TYR A 719 3.660 -11.485 -4.654 1.00 42.34 C ATOM 2044 CE2 TYR A 719 4.715 -9.387 -5.069 1.00 22.42 C ATOM 2045 CZ TYR A 719 4.112 -10.536 -5.531 1.00 71.12 C ATOM 2046 OH TYR A 719 3.957 -10.726 -6.880 1.00 5.05 O ATOM 0 H TYR A 719 3.862 -7.419 -1.107 1.00 55.02 H new ATOM 0 HA TYR A 719 2.478 -10.001 -0.982 1.00 20.45 H new ATOM 0 HB2 TYR A 719 5.399 -9.257 -1.151 1.00 21.42 H new ATOM 0 HB3 TYR A 719 4.825 -10.888 -0.872 1.00 21.42 H new ATOM 0 HD1 TYR A 719 3.456 -12.033 -2.615 1.00 25.41 H new ATOM 0 HD2 TYR A 719 5.339 -8.289 -3.357 1.00 72.12 H new ATOM 0 HE1 TYR A 719 3.187 -12.384 -5.020 1.00 42.34 H new ATOM 0 HE2 TYR A 719 5.068 -8.642 -5.767 1.00 22.42 H new ATOM 0 HH TYR A 719 3.154 -11.263 -7.045 1.00 5.05 H new ATOM 2056 N THR A 720 2.404 -9.830 1.509 1.00 12.41 N ATOM 2057 CA THR A 720 2.413 -9.884 2.945 1.00 64.53 C ATOM 2058 C THR A 720 1.974 -11.251 3.434 1.00 43.34 C ATOM 2059 O THR A 720 1.084 -11.892 2.834 1.00 32.10 O ATOM 2060 CB THR A 720 1.542 -8.773 3.594 1.00 63.54 C ATOM 2061 OG1 THR A 720 1.638 -8.846 5.015 1.00 21.51 O ATOM 2062 CG2 THR A 720 0.083 -8.887 3.186 1.00 14.50 C ATOM 0 H THR A 720 1.525 -10.118 1.079 1.00 12.41 H new ATOM 0 HA THR A 720 3.442 -9.705 3.257 1.00 64.53 H new ATOM 0 HB THR A 720 1.921 -7.814 3.240 1.00 63.54 H new ATOM 0 HG1 THR A 720 2.409 -8.323 5.318 1.00 21.51 H new ATOM 0 HG21 THR A 720 -0.491 -8.092 3.662 1.00 14.50 H new ATOM 0 HG22 THR A 720 -0.000 -8.797 2.103 1.00 14.50 H new ATOM 0 HG23 THR A 720 -0.308 -9.855 3.500 1.00 14.50 H new ATOM 2068 N SER A 721 2.616 -11.717 4.482 1.00 64.31 N ATOM 2069 CA SER A 721 2.312 -12.994 5.067 1.00 33.03 C ATOM 2070 C SER A 721 0.856 -12.995 5.601 1.00 52.33 C ATOM 2071 O SER A 721 0.189 -14.030 5.624 1.00 12.52 O ATOM 2072 CB SER A 721 3.287 -13.251 6.219 1.00 32.14 C ATOM 2073 OG SER A 721 4.650 -13.051 5.815 1.00 43.23 O ATOM 0 H SER A 721 3.368 -11.213 4.952 1.00 64.31 H new ATOM 0 HA SER A 721 2.410 -13.778 4.316 1.00 33.03 H new ATOM 0 HB2 SER A 721 3.052 -12.586 7.050 1.00 32.14 H new ATOM 0 HB3 SER A 721 3.161 -14.271 6.582 1.00 32.14 H new ATOM 0 HG SER A 721 4.706 -13.061 4.837 1.00 43.23 H new ATOM 2079 N TYR A 722 0.359 -11.801 5.958 1.00 73.11 N ATOM 2080 CA TYR A 722 -0.956 -11.635 6.558 1.00 2.34 C ATOM 2081 C TYR A 722 -2.081 -11.784 5.547 1.00 23.11 C ATOM 2082 O TYR A 722 -3.233 -11.870 5.918 1.00 30.32 O ATOM 2083 CB TYR A 722 -1.050 -10.287 7.256 1.00 13.50 C ATOM 2084 CG TYR A 722 -0.036 -10.120 8.359 1.00 14.12 C ATOM 2085 CD1 TYR A 722 1.229 -9.608 8.102 1.00 22.14 C ATOM 2086 CD2 TYR A 722 -0.338 -10.486 9.652 1.00 5.31 C ATOM 2087 CE1 TYR A 722 2.156 -9.467 9.104 1.00 42.42 C ATOM 2088 CE2 TYR A 722 0.583 -10.351 10.660 1.00 1.22 C ATOM 2089 CZ TYR A 722 1.829 -9.842 10.384 1.00 32.34 C ATOM 2090 OH TYR A 722 2.753 -9.712 11.393 1.00 70.04 O ATOM 0 H TYR A 722 0.867 -10.925 5.834 1.00 73.11 H new ATOM 0 HA TYR A 722 -1.077 -12.433 7.290 1.00 2.34 H new ATOM 0 HB2 TYR A 722 -0.913 -9.494 6.521 1.00 13.50 H new ATOM 0 HB3 TYR A 722 -2.051 -10.168 7.670 1.00 13.50 H new ATOM 0 HD1 TYR A 722 1.488 -9.315 7.095 1.00 22.14 H new ATOM 0 HD2 TYR A 722 -1.316 -10.886 9.876 1.00 5.31 H new ATOM 0 HE1 TYR A 722 3.135 -9.064 8.888 1.00 42.42 H new ATOM 0 HE2 TYR A 722 0.329 -10.644 11.668 1.00 1.22 H new ATOM 0 HH TYR A 722 2.362 -10.021 12.237 1.00 70.04 H new ATOM 2100 N ALA A 723 -1.742 -11.804 4.273 1.00 41.43 N ATOM 2101 CA ALA A 723 -2.743 -11.966 3.225 1.00 74.31 C ATOM 2102 C ALA A 723 -2.772 -13.406 2.759 1.00 24.52 C ATOM 2103 O ALA A 723 -3.434 -13.754 1.769 1.00 33.12 O ATOM 2104 CB ALA A 723 -2.441 -11.047 2.063 1.00 53.45 C ATOM 0 H ALA A 723 -0.784 -11.711 3.934 1.00 41.43 H new ATOM 0 HA ALA A 723 -3.721 -11.704 3.629 1.00 74.31 H new ATOM 0 HB1 ALA A 723 -3.197 -11.179 1.289 1.00 53.45 H new ATOM 0 HB2 ALA A 723 -2.450 -10.012 2.406 1.00 53.45 H new ATOM 0 HB3 ALA A 723 -1.459 -11.286 1.656 1.00 53.45 H new ATOM 2110 N CYS A 724 -2.071 -14.238 3.474 1.00 73.52 N ATOM 2111 CA CYS A 724 -1.967 -15.615 3.135 1.00 11.42 C ATOM 2112 C CYS A 724 -2.417 -16.451 4.320 1.00 23.20 C ATOM 2113 O CYS A 724 -1.930 -16.251 5.429 1.00 40.54 O ATOM 2114 CB CYS A 724 -0.519 -15.938 2.814 1.00 40.21 C ATOM 2115 SG CYS A 724 -0.266 -17.581 2.089 1.00 52.44 S ATOM 0 H CYS A 724 -1.555 -13.972 4.312 1.00 73.52 H new ATOM 0 HA CYS A 724 -2.593 -15.835 2.270 1.00 11.42 H new ATOM 0 HB2 CYS A 724 -0.135 -15.186 2.125 1.00 40.21 H new ATOM 0 HB3 CYS A 724 0.070 -15.862 3.728 1.00 40.21 H new ATOM 2120 N PRO A 725 -3.359 -17.377 4.123 1.00 23.42 N ATOM 2121 CA PRO A 725 -3.814 -18.237 5.184 1.00 62.54 C ATOM 2122 C PRO A 725 -2.860 -19.419 5.375 1.00 51.35 C ATOM 2123 O PRO A 725 -3.120 -20.511 4.838 1.00 37.37 O ATOM 2124 CB PRO A 725 -5.198 -18.704 4.716 1.00 54.41 C ATOM 2125 CG PRO A 725 -5.193 -18.563 3.223 1.00 72.00 C ATOM 2126 CD PRO A 725 -4.046 -17.647 2.850 1.00 53.01 C ATOM 2127 OXT PRO A 725 -1.825 -19.252 6.067 1.00 37.37 O ATOM 0 HA PRO A 725 -3.853 -17.733 6.150 1.00 62.54 H new ATOM 0 HB2 PRO A 725 -5.382 -19.737 5.011 1.00 54.41 H new ATOM 0 HB3 PRO A 725 -5.987 -18.099 5.163 1.00 54.41 H new ATOM 0 HG2 PRO A 725 -5.075 -19.537 2.747 1.00 72.00 H new ATOM 0 HG3 PRO A 725 -6.140 -18.151 2.875 1.00 72.00 H new ATOM 0 HD2 PRO A 725 -3.377 -18.121 2.131 1.00 53.01 H new ATOM 0 HD3 PRO A 725 -4.407 -16.727 2.391 1.00 53.01 H new TER 2135 PRO A 725